A0A3Q0KL71_SCHMA Loading...

Smp_127430

AlphaFold DB , UniProt , Accession A0A3Q0KL71, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 982 aa.

						>A0A3Q0KL71_SCHMA|A0A3Q0KL71
MVKSKKDFQKVRVKVGRKLKCHNETVINLQKKRIILPKEREISKIQGDGTNVQIFESSIHSLNIEDSALRQSALRALNRLLDPLAKGITTIPFLDKNVLSLSSNFIPKVVDGQQKLLGSTVNTGCDIQIGNLIFVLGRFCRRVDDPRFCHEICQLFVKIVHIAYTHPKISDIIFELDQVVLNLLHRNELVWKFFGCHLSAYTFGLHCRLIMTMSILYQPSNRKKSVYSGVFDSLQQSIRFRAYSHLIIQCYNNLRQNRTFKTLSKYRAYLVRTTMVYLKDNQYTVSLSYSQSHHPWLYCLPYFSNQYIQLYISLKGYYLKELIDFHPTSRTFDSGLFSVVKQSLPFPSSIKNVVNNKHSQHKRNEKNQRSSTSGKISDNSSVVYIPTWCQEDYDDQVMIHGLIGEGLVLLDELNENPNGEVLSSLYYLLRALRVVFETKEVSFFTSHSSMKHDYSGWRLDVNEISPDLSTSLERFLDKFYSIYPLQLSPDSLSLMYIKCNKQKSQKSLNNQIGNYAFLLNSSNGQKSVNLTSKQFKQERKRRNKQLKRQLKNAINAGVTGDNNNNNNIDNVDDHDDSTVIDDGHSISTTDSIGYSTIDTSNSTRRINDPSTKGNLNNQIFYWIQLINQSAFELFTYIEYYSFRCSTANHHSPFLWPPPENTQERLVTLWFNQLSCFGPSNATTEFYHEISCWLRSFDLYLLSPYRFKWNVDISTRLFVSPVIIFLAQLFHQFATNNSIDSDKSLSKREHFLTGRCAGLLTTVLTRELLHPTEQKTGSERNLIDVDDVSVSMDVEFSSHGMEYNEMWLWDKLRSYLSDETIKSLHGSIFPTLINYLVQFSLNQSPRICCAPPLTEETLNIVRNQYPSCNISIGNLKEIQIVDSTWTACLLQLYHVKYSLAVKYVRENKELYTKLHLTETYLDNLTPLSVLNEKLNVQYDTQLLKNQTGWLVPGFLPRITDGRYACPVFWRPLKDNRNKILPLL
					

Structure Viewer

Loading PAE data...

(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	31.3	Very low	34.4	Very low	244 Å²	244	174.7 Å²	174.7	100%	1.202	86%	0.858	S	S	*	*				0	126.6	0	-98.6	173.6	126	0	0	109.9	K3	M1-K3 PolarHBondContact O-N 3.24Å
2	V	33.2	Very low	34.2	Very low	140 Å²	140	180.3 Å²	180.3	85%	0.848	86%	0.862	S	S	*	*			trans	-54.7	114.7	174.9	175.5	0	0	0	0	109.5	S4	V2-S4 PolarHBondContact O-N 3.06Å
3	K	35.1	Very low	34.7	Very low	205 Å²	205	175.1 Å²	175.1	89%	0.891	85%	0.849	S	S	*	*			trans	-71.3	115.6	164.4	-82.6	-178.1	176.1	177.3	0	107.3	M1	M1-K3 PolarHBondContact O-N 3.24Å
4	S	35.2	Very low	34.5	Very low	107 Å²	107	177 Å²	177	75%	0.748	85%	0.851	S	S	*	*			trans	-50.2	133.6	-174.6	43.7	0	0	0	0	112.4	V2 K6	V2-S4 PolarHBondContact O-N 3.06Å; S4-K6 PolarHBondContact O-N 3.07Å
5	K	36.6	Very low	34.3	Very low	190 Å²	190	174.7 Å²	174.7	83%	0.826	85%	0.852	S	S	*	*			trans	-52.3	128.1	165	-73.9	170.9	175	172.1	0	107.9	D7	K5-D7 PolarHBondContact O-N 2.99Å
6	K	37.1	Very low	34.2	Very low	204 Å²	204	168.4 Å²	168.4	89%	0.887	85%	0.846	S	S	*	*			trans	-55	111.5	168.1	-77.6	-179.9	173.5	-179.5	0	108.3	S4 F8	S4-K6 PolarHBondContact O-N 3.07Å; K6-F8 PolarHBondContact O-N 3.45Å
7	D	35.4	Very low	34	Very low	133 Å²	133	171.9 Å²	171.9	71%	0.711	85%	0.847	S	S	*	*			trans	-59.4	116.3	178.3	-78.4	-43.7	0	0	0	110.4	K5 Q9	K5-D7 PolarHBondContact O-N 2.99Å; D7-Q9 HydrophobicContact CB-CB 4.35Å; D7-Q9 PolarHBondContact O-N 2.97Å
8	F	35.2	Very low	34	Very low	210 Å²	210	174.7 Å²	174.7	92%	0.921	85%	0.854	S	S	*	*			trans	-74.8	36.8	164.6	-105.6	-91.4	0	0	0	110.9	K6	K6-F8 PolarHBondContact O-N 3.45Å
9	Q	31.6	Very low	34.1	Very low	157 Å²	157	172.5 Å²	172.5	73%	0.734	85%	0.845	S	S	*	*			trans	-103.1	99.2	176.5	-84.8	-173.7	-7.3	0	0	110.6	D7	D7-Q9 HydrophobicContact CB-CB 4.35Å; D7-Q9 PolarHBondContact O-N 2.97Å
10	K	32	Very low	34.3	Very low	199 Å²	199	173.3 Å²	173.3	87%	0.865	84%	0.844	S	S	*	*			trans	164.5	63.6	132.8	-89.1	172.9	-175.9	177	0	109.9
11	V	35.9	Very low	34.6	Very low	133 Å²	133	170.4 Å²	170.4	81%	0.806	84%	0.84	S	S	*	*			trans	-93.2	96.7	150	-175.8	0	0	0	0	105.8	V13	V11-V13 VanDerWaalsContact C-N 3.35Å; V11-V13 PolarHBondContact O-N 3.47Å
12	R	32	Very low	35	Very low	241 Å²	241	166.8 Å²	166.8	91%	0.909	82%	0.82	S	S	*	*			trans	-64.5	96.4	170.2	-93.3	-176.6	172.7	175.1	-2.6	107.7	K14	R12-K14 PolarHBondContact O-N 3.04Å
13	V	40.9	Very low	35.3	Very low	113 Å²	113	165.4 Å²	165.4	69%	0.685	81%	0.808	S	S	*	*			trans	-70.4	115.1	166	-178.2	0	0	0	0	106.7	V11 V15	V11-V13 VanDerWaalsContact C-N 3.35Å; V11-V13 PolarHBondContact O-N 3.47Å; V13-V15 VanDerWaalsContact C-N 3.34Å; V13-V15 PolarHBondContact O-N 3.48Å
14	K	31.5	Very low	35.8	Very low	202 Å²	202	161.9 Å²	161.9	88%	0.878	79%	0.794	S	S	*	*			trans	-66.1	95.9	169.9	-94.3	-177.5	173.2	178.2	0	108.1	R12 G16	R12-K14 PolarHBondContact O-N 3.04Å; K14-G16 PolarHBondContact O-N 2.87Å
15	V	31.9	Very low	36.4	Very low	143 Å²	143	160.6 Å²	160.6	87%	0.867	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	118.1	171.4	-170.3	0	0	0	0	107.4	V13	V13-V15 VanDerWaalsContact C-N 3.34Å; V13-V15 PolarHBondContact O-N 3.48Å
16	G	31.6	Very low	36.9	Very low	74 Å²	74	154.4 Å²	154.4	76%	0.763	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	147.6	-5.5	177.2	0	0	0	0	0	116.6	K14	K14-G16 PolarHBondContact O-N 2.87Å
17	R	30.7	Very low	37.4	Very low	228 Å²	228	149.7 Å²	149.7	86%	0.86	74%	0.744	S	S	*	*			trans	-118.2	119.7	168.3	-70.4	-172.1	177.9	176.4	-1.1	110.1	L19	R17-L19 PolarHBondContact O-N 2.78Å
18	K	34.1	Very low	38.2	Very low	221 Å²	221	145.6 Å²	145.6	96%	0.961	72%	0.722	S	S	*	*			trans	-60.7	97.5	167.2	-78.3	-178.2	175.8	178.9	0	108.2
19	L	35.9	Very low	38.7	Very low	133 Å²	133	142.9 Å²	142.9	70%	0.696	72%	0.716	S	S	*	*			trans	-77.8	126	169	-74.4	166.6	0	0	0	107.7	R17 C21	R17-L19 PolarHBondContact O-N 2.78Å; L19-C21 PolarHBondContact O-N 3.02Å
20	K	38.7	Very low	39.8	Very low	189 Å²	189	144.2 Å²	144.2	82%	0.822	72%	0.722	S	S	*	*			trans	-51.4	133.9	174.9	-73.6	-179.7	175	-179.3	0	109	H22 N23	K20-H22 PolarHBondContact O-N 3.48Å; K20-N23 PolarHBondContact O-N 2.68Å
21	C	41	Very low	41.1	Very low	113 Å²	113	142.8 Å²	142.8	76%	0.764	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.6	-5.5	-170.7	-64.6	0	0	0	0	117.6	L19	L19-C21 PolarHBondContact O-N 3.02Å
22	H	40.5	Very low	41.4	Very low	168 Å²	168	145.8 Å²	145.8	78%	0.778	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-10.2	-177.8	-80.1	39.3	0	0	0	114.9	K20	K20-H22 PolarHBondContact O-N 3.48Å
23	N	39.4	Very low	42.4	Very low	110 Å²	110	141 Å²	141	59%	0.588	70%	0.7	S	S	*	*			trans	-116.7	28.1	-173.2	-71.3	-14.6	0	0	0	114.4	K20	K20-N23 PolarHBondContact O-N 2.68Å
24	E	44.6	Very low	42.9	Very low	131 Å²	131	140 Å²	140	61%	0.612	69%	0.69	S	S	*	*			trans	-81.6	118.8	173.6	-70.9	-173	174.6	0	0	111.7	V26	E24-V26 PolarHBondContact O-N 2.95Å
25	T	47.2	Very low	43.8	Very low	81 Å²	81	133 Å²	133	50%	0.497	66%	0.662	S	S	.	*			trans	-73.8	110.1	168.4	-39.2	0	0	0	0	108.9	I34	T25-I34 HydrophobicContact CG2-CG2 3.29Å
26	V	48.7	Very low	44.6	Very low	60 Å²	60	131.1 Å²	131.1	36%	0.364	65%	0.646	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.3	123.6	177.6	179.3	0	0	0	0	110.1	E24 N28 I35	E24-V26 PolarHBondContact O-N 2.95Å; V26-N28 PolarHBondContact O-N 3.49Å; V26-I35 PolarHBondContact O-N 3.47Å
27	I	47.7	Very low	45.1	Very low	105 Å²	105	130.2 Å²	130.2	54%	0.538	63%	0.627	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84	110	172.8	-56.8	176.9	0	0	0	107.6	L29 I34	I27-L29 HydrophobicContact CG2-CD2 4.17Å; I27-L29 PolarHBondContact O-N 3.03Å; I27-I34 HydrophobicContact CG1-CG1 4.46Å
28	N	50.4	Low	45.9	Very low	46 Å²	46	127.6 Å²	127.6	25%	0.246	62%	0.622	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.9	104.2	172.2	-173.7	-32	0	0	0	108.9	V26 Q30 K31 K32 R33 I35	V26-N28 PolarHBondContact O-N 3.49Å; N28-Q30 VanDerWaalsContact C-N 3.34Å; N28-Q30 PolarHBondContact O-N 3.05Å; N28-Q30 WeakPolarHBondContact OD1-CB 3.36Å; N28-Q30 PolarHBondContact OD1-N 2.89Å; N28-K31 PolarHBondContact OD1-N 2.77Å; N28-K32 WeakPolarHBondContact O-CA 3.46Å; N28-K32 PolarHBondContact O-N 2.81Å; N28-R33 PolarHBondContact N-O 3.46Å; N28-R33 PolarHBondContact O-N 3.47Å; N28-I35 HydrophobicContact CB-CD1 4.02Å
29	L	46.7	Very low	46.3	Very low	153 Å²	153	120.7 Å²	120.7	80%	0.801	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-29.2	-179	-68	172.9	0	0	0	113.2	I27	I27-L29 HydrophobicContact CG2-CD2 4.17Å; I27-L29 PolarHBondContact O-N 3.03Å
30	Q	55	Low	46.3	Very low	186 Å²	186	120.1 Å²	120.1	87%	0.869	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-40.5	178.3	-73.7	-179.1	-19.6	0	0	112.1	N28	N28-Q30 VanDerWaalsContact C-N 3.34Å; N28-Q30 PolarHBondContact O-N 3.05Å; N28-Q30 WeakPolarHBondContact OD1-CB 3.36Å; N28-Q30 PolarHBondContact OD1-N 2.89Å
31	K	58.1	Low	46.2	Very low	168 Å²	168	117.8 Å²	117.8	73%	0.73	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	0.7	179.3	-65	-173	179	-178.9	0	113.8	N28 R33	N28-K31 PolarHBondContact OD1-N 2.77Å; K31-R33 PolarHBondContact O-N 2.99Å
32	K	43.6	Very low	46.2	Very low	197 Å²	197	117.7 Å²	117.7	86%	0.857	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	43	45.8	-172.1	-67.4	-176.6	178.6	174.6	0	112.9	N28	N28-K32 WeakPolarHBondContact O-CA 3.46Å; N28-K32 PolarHBondContact O-N 2.81Å
33	R	51.6	Low	46	Very low	140 Å²	140	113.1 Å²	113.1	53%	0.528	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-133.5	138.6	-178.3	-170.2	175.3	176.2	-161	-8.2	111.3	N28 K31 E39	N28-R33 PolarHBondContact N-O 3.46Å; N28-R33 PolarHBondContact O-N 3.47Å; K31-R33 PolarHBondContact O-N 2.99Å; R33-E39 IonicContact CZ-OE1 3.14Å; R33-E39 IonicContact CZ-OE2 2.73Å; R33-E39 IonicContact NH2-OE1 2.69Å; R33-E39 PolarHBondContact NH2-OE1 3.04Å; R33-E39 IonicContact NH2-OE2 3.73Å; R33-E39 PolarHBondContact NH2-OE2 3.35Å
34	I	51.5	Low	46	Very low	92 Å²	92	116.4 Å²	116.4	47%	0.472	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.1	117.2	170.6	-56.8	179.1	0	0	0	107.2	T25 I27	T25-I34 HydrophobicContact CG2-CG2 3.29Å; I27-I34 HydrophobicContact CG1-CG1 4.46Å
35	I	50.6	Low	45.7	Very low	55 Å²	55	117.3 Å²	117.3	28%	0.282	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.7	121.3	-179.8	-58.9	173.7	0	0	0	108.3	V26 N28 E39	V26-I35 PolarHBondContact O-N 3.47Å; N28-I35 HydrophobicContact CB-CD1 4.02Å; I35-E39 HydrophobicContact CG2-CB 4.25Å
36	L	49.9	Very low	45.2	Very low	104 Å²	104	119.7 Å²	119.7	55%	0.545	57%	0.573	S	S	.	*	P	Polyproline II helix	trans	-84.5	152.3	179.9	-68.4	172	0	0	0	111.4	K38 E39	L36-K38 VanDerWaalsContact C-N 3.29Å; L36-K38 PolarHBondContact O-N 2.85Å; L36-E39 PolarHBondContact O-N 2.97Å
37	P	42.6	Very low	44.8	Very low	55 Å²	55	119.4 Å²	119.4	36%	0.357	58%	0.582	S	S	.	*	H	α-helix	trans	-54.7	-37.9	-175.8	-26.4	33.6	0	0	0	114.6	E39 R40	P37-E39 PolarHBondContact O-N 3.26Å; P37-R40 WeakPolarHBondContact O-CB 3.23Å; P37-R40 PolarHBondContact O-N 2.93Å
38	K	46.6	Very low	44.7	Very low	173 Å²	173	123 Å²	123	75%	0.752	60%	0.603	S	S	*	*	H	α-helix	trans	-66.5	-21.1	179.1	-71.5	-172.1	175.5	-176.8	0	113.9	L36	L36-K38 VanDerWaalsContact C-N 3.29Å; L36-K38 PolarHBondContact O-N 2.85Å
39	E	41.6	Very low	44.7	Very low	76 Å²	76	122 Å²	122	36%	0.355	60%	0.603	S	S	.	*	H	α-helix	trans	-79.4	-21.3	173.5	-67.9	-171.7	146.9	0	0	112.2	R33 I35 L36 P37 S43	R33-E39 IonicContact CZ-OE1 3.14Å; R33-E39 IonicContact CZ-OE2 2.73Å; R33-E39 IonicContact NH2-OE1 2.69Å; R33-E39 PolarHBondContact NH2-OE1 3.04Å; R33-E39 IonicContact NH2-OE2 3.73Å; R33-E39 PolarHBondContact NH2-OE2 3.35Å; I35-E39 HydrophobicContact CG2-CB 4.25Å; L36-E39 PolarHBondContact O-N 2.97Å; P37-E39 PolarHBondContact O-N 3.26Å; E39-S43 PolarHBondContact O-N 2.81Å; E39-S43 PolarHBondContact O-OG 3.07Å
40	R	36.9	Very low	45.6	Very low	120 Å²	120	118.5 Å²	118.5	45%	0.453	59%	0.588	S	S	.	*	H	α-helix	trans	-71.2	-38.6	175.1	-78.6	-175.6	170.5	179.9	-2.7	112.9	P37 I42 S43 K44	P37-R40 WeakPolarHBondContact O-CB 3.23Å; P37-R40 PolarHBondContact O-N 2.93Å; R40-I42 VanDerWaalsContact C-N 3.29Å; R40-I42 PolarHBondContact O-N 3.47Å; R40-S43 WeakPolarHBondContact CA-OG 3.42Å; R40-S43 PolarHBondContact O-N 3.25Å; R40-S43 PolarHBondContact O-OG 3.45Å; R40-K44 PolarHBondContact O-N 3.49Å
41	E	36.4	Very low	46.1	Very low	140 Å²	140	114.2 Å²	114.2	65%	0.654	57%	0.571	S	S	*	*	H	α-helix	trans	-64.5	-36.7	179.8	-75.8	-179.5	167	0	0	111.8
42	I	41.2	Very low	46.5	Very low	111 Å²	111	107.5 Å²	107.5	57%	0.569	54%	0.544	S	S	*	.	H	α-helix	trans	-75	-31.7	179.7	-56.4	172.7	0	0	0	111.4	R40	R40-I42 VanDerWaalsContact C-N 3.29Å; R40-I42 PolarHBondContact O-N 3.47Å
43	S	36.8	Very low	47.9	Very low	72 Å²	72	103.3 Å²	103.3	50%	0.503	53%	0.528	S	S	.	.	H	α-helix	trans	-82.3	-26.2	-179.1	43.5	0	0	0	0	114	E39 R40	E39-S43 PolarHBondContact O-N 2.81Å; E39-S43 PolarHBondContact O-OG 3.07Å; R40-S43 WeakPolarHBondContact CA-OG 3.42Å; R40-S43 PolarHBondContact O-N 3.25Å; R40-S43 PolarHBondContact O-OG 3.45Å
44	K	37.8	Very low	49	Very low	180 Å²	180	99.2 Å²	99.2	78%	0.783	52%	0.516	S	S	*	.	H	α-helix	trans	-76.5	-23.4	177.8	-80.9	-171.6	174.9	-172.5	0	114.7	R40 Q46	R40-K44 PolarHBondContact O-N 3.49Å; K44-Q46 VanDerWaalsContact C-N 3.34Å
45	I	39.6	Very low	50.2	Low	149 Å²	149	95.1 Å²	95.1	76%	0.764	49%	0.494	S	S	*	.	S	Bend	trans	-85.4	-13.7	179.8	-57.8	169.9	0	0	0	111.2	G47	I45-G47 VanDerWaalsContact C-N 3.34Å; I45-G47 PolarHBondContact O-N 3.03Å; I45-G47 VanDerWaalsContact O-N 3.15Å
46	Q	37.1	Very low	51.6	Low	131 Å²	131	98 Å²	98	61%	0.612	51%	0.507	S	S	*	.			trans	-86.2	77.9	169.9	-67.9	-177.1	-7.7	0	0	109.2	K44	K44-Q46 VanDerWaalsContact C-N 3.34Å
47	G	40.3	Very low	53.1	Low	54 Å²	54	96 Å²	96	56%	0.557	50%	0.501	S	S	*	.			trans	-58.6	157.7	160.8	0	0	0	0	0	110.3	I45 G49	I45-G47 VanDerWaalsContact C-N 3.34Å; I45-G47 PolarHBondContact O-N 3.03Å; I45-G47 VanDerWaalsContact O-N 3.15Å; G47-G49 PolarHBondContact O-N 3.35Å
48	D	44	Very low	55.1	Low	182 Å²	182	93.8 Å²	93.8	97%	0.973	49%	0.487	S	S	*	.	S	Bend	trans	-64.5	49.4	175.1	-77.8	-38.1	0	0	0	112.6
49	G	51.1	Low	56.8	Low	23 Å²	23	86.5 Å²	86.5	24%	0.237	46%	0.456	C	S	.	.			trans	-77.1	139.8	171.9	0	0	0	0	0	110.2	G47	G47-G49 PolarHBondContact O-N 3.35Å
50	T	64.6	Low	58.8	Low	81 Å²	81	88.9 Å²	88.9	50%	0.497	47%	0.467	S	S	.	.			trans	-57.9	156.2	168.7	59.2	0	0	0	0	109.9	V52 Q53 I54	T50-V52 PolarHBondContact O-N 3.02Å; T50-Q53 PolarHBondContact O-N 3.3Å; T50-Q53 WeakPolarHBondContact OG1-CG 3.37Å; T50-Q53 PolarHBondContact OG1-N 3.06Å; T50-I54 PolarHBondContact O-N 3.36Å
51	N	65.7	Low	61.1	Low	96 Å²	96	84.5 Å²	84.5	51%	0.513	46%	0.455	S	S	.	.	H	α-helix	trans	-51.9	-30.9	177.1	-76	-25.6	0	0	0	112.5	F55 L80	N51-F55 VanDerWaalsContact O-CB 3.28Å; N51-F55 WeakPolarHBondContact O-CB 3.46Å; N51-F55 PolarHBondContact O-N 3.17Å; N51-L80 HydrophobicContact CB-CD2 4.33Å
52	V	66.3	Low	63.4	Low	26 Å²	26	77.9 Å²	77.9	16%	0.158	42%	0.424	C	S	.	.	H	α-helix	trans	-66.8	-47.4	173.8	175.5	0	0	0	0	111.9	T50 I54 F55 E56 G124	T50-V52 PolarHBondContact O-N 3.02Å; V52-I54 VanDerWaalsContact C-N 3.32Å; V52-I54 PolarHBondContact O-N 3.22Å; V52-F55 WeakPolarHBondContact O-CA 3.39Å; V52-F55 WeakPolarHBondContact O-CB 3.47Å; V52-F55 PolarHBondContact O-N 3.07Å; V52-F55 VanDerWaalsContact O-N 3.1Å; V52-E56 HydrophobicContact CG1-CG 4.39Å; V52-E56 WeakPolarHBondContact O-CG 3.41Å; V52-E56 PolarHBondContact O-N 3.41Å; V52-G124 WeakPolarHBondContact CG2-O 3.39Å
53	Q	73.6	Confident	65.4	Low	110 Å²	110	75.6 Å²	75.6	51%	0.514	41%	0.413	S	S	.	.	H	α-helix	trans	-62.9	-39.4	177.4	-71.8	175.2	-3.2	0	0	111.9	T50 F55 S57	T50-Q53 PolarHBondContact O-N 3.3Å; T50-Q53 WeakPolarHBondContact OG1-CG 3.37Å; T50-Q53 PolarHBondContact OG1-N 3.06Å; Q53-F55 VanDerWaalsContact C-N 3.31Å; Q53-S57 VanDerWaalsContact O-CB 3.22Å; Q53-S57 WeakPolarHBondContact O-CB 3.44Å; Q53-S57 PolarHBondContact O-N 2.83Å; Q53-S57 PolarHBondContact O-OG 3.48Å
54	I	74	Confident	67.5	Low	54 Å²	54	75.4 Å²	75.4	28%	0.277	41%	0.405	S	S	.	.	H	α-helix	trans	-64.7	-39.3	174.4	-58	174.1	0	0	0	110.2	T50 V52 S57 S58 L80	T50-I54 PolarHBondContact O-N 3.36Å; V52-I54 VanDerWaalsContact C-N 3.32Å; V52-I54 PolarHBondContact O-N 3.22Å; I54-S57 WeakPolarHBondContact CA-OG 3.14Å; I54-S57 PolarHBondContact O-OG 3.29Å; I54-S57 VanDerWaalsContact O-OG 3.05Å; I54-S58 WeakPolarHBondContact O-CB 3.36Å; I54-S58 PolarHBondContact O-N 3.38Å; I54-S58 PolarHBondContact O-OG 2.95Å; I54-L80 HydrophobicContact CB-CD1 4.33Å; I54-L80 HydrophobicContact CG2-CD1 3.96Å
55	F	77.6	Confident	69.4	Low	6 Å²	6	74.7 Å²	74.7	3%	0.026	41%	0.405	C	S	.	.	H	α-helix	trans	-64.3	-51.8	177.1	-174.7	-99.3	0	0	0	112	N51 V52 Q53 S58 I59 L77 L80 L81 I127 L132	N51-F55 VanDerWaalsContact O-CB 3.28Å; N51-F55 WeakPolarHBondContact O-CB 3.46Å; N51-F55 PolarHBondContact O-N 3.17Å; V52-F55 WeakPolarHBondContact O-CA 3.39Å; V52-F55 WeakPolarHBondContact O-CB 3.47Å; V52-F55 PolarHBondContact O-N 3.07Å; V52-F55 VanDerWaalsContact O-N 3.1Å; Q53-F55 VanDerWaalsContact C-N 3.31Å; F55-S58 PolarHBondContact O-N 2.95Å; F55-I59 HydrophobicContact CD1-CD1 3.74Å; F55-I59 HydrophobicContact CD1-CG1 4.5Å; F55-I59 HydrophobicContact CE1-CD1 3.23Å; F55-I59 HydrophobicContact CE1-CG1 4.24Å; F55-I59 HydrophobicContact CZ-CD1 3.68Å; F55-I59 HydrophobicContact CZ-CG1 4.45Å; F55-I59 WeakPolarHBondContact O-CG1 3.48Å; F55-I59 PolarHBondContact O-N 2.96Å; F55-L77 HydrophobicContact CD2-CD2 3.55Å; F55-L77 HydrophobicContact CE2-CD2 3.6Å; F55-L77 HydrophobicContact CG-CD2 4.33Å; F55-L77 HydrophobicContact CZ-CD2 4.42Å; F55-L80 HydrophobicContact CB-CD1 4.03Å; F55-L80 HydrophobicContact CD2-CD1 4.24Å; F55-L81 HydrophobicContact CE2-CD2 4.46Å; F55-I127 HydrophobicContact CD1-CG2 4.28Å; F55-I127 HydrophobicContact CD2-CG2 4.34Å; F55-I127 HydrophobicContact CE1-CG2 3.64Å; F55-I127 HydrophobicContact CE2-CG2 3.73Å; F55-I127 HydrophobicContact CZ-CG2 3.35Å; F55-L132 HydrophobicContact CE2-CD2 4.05Å; F55-L132 HydrophobicContact CZ-CB 3.98Å; F55-L132 HydrophobicContact CZ-CD2 3.91Å; F55-L132 HydrophobicContact CZ-CG 4.38Å
56	E	79.1	Confident	71.4	Confident	116 Å²	116	71.2 Å²	71.2	54%	0.542	39%	0.388	S	S	.	.	H	α-helix	trans	-63.6	-44.8	179.5	-70.7	-176.8	163.1	0	0	112.4	V52 S58 I59 H60	V52-E56 HydrophobicContact CG1-CG 4.39Å; V52-E56 WeakPolarHBondContact O-CG 3.41Å; V52-E56 PolarHBondContact O-N 3.41Å; E56-S58 VanDerWaalsContact C-N 3.29Å; E56-S58 PolarHBondContact O-N 3.4Å; E56-I59 PolarHBondContact O-N 3.36Å; E56-H60 PolarHBondContact O-N 2.78Å
57	S	82.1	Confident	73.6	Confident	61 Å²	61	67.4 Å²	67.4	43%	0.427	38%	0.376	S	S	.	.	H	α-helix	trans	-63.3	-36.1	175.6	58.9	0	0	0	0	112.2	Q53 I54 H60 S61	Q53-S57 VanDerWaalsContact O-CB 3.22Å; Q53-S57 WeakPolarHBondContact O-CB 3.44Å; Q53-S57 PolarHBondContact O-N 2.83Å; Q53-S57 PolarHBondContact O-OG 3.48Å; I54-S57 WeakPolarHBondContact CA-OG 3.14Å; I54-S57 PolarHBondContact O-OG 3.29Å; I54-S57 VanDerWaalsContact O-OG 3.05Å; S57-H60 PolarHBondContact O-N 2.84Å; S57-S61 VanDerWaalsContact O-CB 3.32Å; S57-S61 WeakPolarHBondContact O-CB 3.31Å; S57-S61 PolarHBondContact O-N 3.35Å; S57-S61 PolarHBondContact O-OG 3.49Å
58	S	84.8	Confident	75.6	Confident	9 Å²	9	67.9 Å²	67.9	6%	0.063	37%	0.374	C	S	.	.	H	α-helix	trans	-68	-41.4	174.3	-60.3	0	0	0	0	111.5	I54 F55 E56 H60 S61 L62 A73 A76	I54-S58 WeakPolarHBondContact O-CB 3.36Å; I54-S58 PolarHBondContact O-N 3.38Å; I54-S58 PolarHBondContact O-OG 2.95Å; F55-S58 PolarHBondContact O-N 2.95Å; E56-S58 VanDerWaalsContact C-N 3.29Å; E56-S58 PolarHBondContact O-N 3.4Å; S58-H60 VanDerWaalsContact C-N 3.33Å; S58-H60 PolarHBondContact O-N 3.17Å; S58-S61 PolarHBondContact O-N 2.91Å; S58-L62 PolarHBondContact O-N 3.35Å; S58-A73 WeakPolarHBondContact O-CB 3.13Å; S58-A76 WeakPolarHBondContact OG-CB 3.45Å
59	I	83	Confident	77.6	Confident	20 Å²	20	62.8 Å²	62.8	10%	0.103	35%	0.347	C	S	.	.	H	α-helix	trans	-58.8	-47	172.9	-72.4	177.9	0	0	0	110.2	F55 E56 S61 L62 L77 L132 V135	F55-I59 HydrophobicContact CD1-CD1 3.74Å; F55-I59 HydrophobicContact CD1-CG1 4.5Å; F55-I59 HydrophobicContact CE1-CD1 3.23Å; F55-I59 HydrophobicContact CE1-CG1 4.24Å; F55-I59 HydrophobicContact CZ-CD1 3.68Å; F55-I59 HydrophobicContact CZ-CG1 4.45Å; F55-I59 WeakPolarHBondContact O-CG1 3.48Å; F55-I59 PolarHBondContact O-N 2.96Å; E56-I59 PolarHBondContact O-N 3.36Å; I59-S61 VanDerWaalsContact C-N 3.3Å; I59-S61 PolarHBondContact O-N 3.29Å; I59-L62 WeakPolarHBondContact O-CB 3.5Å; I59-L62 PolarHBondContact O-N 2.84Å; I59-L77 HydrophobicContact CG1-CD2 4.21Å; I59-L132 HydrophobicContact CD1-CB 4.05Å; I59-L132 HydrophobicContact CD1-CD1 4.38Å; I59-L132 HydrophobicContact CG1-CD1 4.06Å; I59-V135 HydrophobicContact CG2-CB 4.08Å; I59-V135 HydrophobicContact CG2-CG1 4.18Å; I59-V135 HydrophobicContact CG2-CG2 3.72Å
60	H	84	Confident	79.2	Confident	126 Å²	126	63.4 Å²	63.4	58%	0.583	34%	0.342	S	S	*	.	H	α-helix	trans	-61.8	-40.8	178.4	-167.6	67.1	0	0	0	111.7	E56 S57 S58 L62 N63	E56-H60 PolarHBondContact O-N 2.78Å; S57-H60 PolarHBondContact O-N 2.84Å; S58-H60 VanDerWaalsContact C-N 3.33Å; S58-H60 PolarHBondContact O-N 3.17Å; H60-L62 PolarHBondContact O-N 3.19Å; H60-N63 WeakPolarHBondContact O-CB 3.5Å; H60-N63 PolarHBondContact O-N 3.47Å
61	S	85	Confident	80.2	Confident	28 Å²	28	61.9 Å²	61.9	20%	0.196	33%	0.329	C	S	.	.	H	α-helix	trans	-63.6	-24.5	179	-61.9	0	0	0	0	114	S57 S58 I59 N63 I64	S57-S61 VanDerWaalsContact O-CB 3.32Å; S57-S61 WeakPolarHBondContact O-CB 3.31Å; S57-S61 PolarHBondContact O-N 3.35Å; S57-S61 PolarHBondContact O-OG 3.49Å; S58-S61 PolarHBondContact O-N 2.91Å; I59-S61 VanDerWaalsContact C-N 3.3Å; I59-S61 PolarHBondContact O-N 3.29Å; S61-N63 PolarHBondContact O-N 2.76Å; S61-I64 PolarHBondContact O-N 2.93Å
62	L	83.4	Confident	81.2	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.005	33%	0.328	C	S	.	.	H	α-helix	trans	-66.1	-26	173.4	-67.8	177.9	0	0	0	112.9	S58 I59 H60 A73 L74 L77 V135	S58-L62 PolarHBondContact O-N 3.35Å; I59-L62 WeakPolarHBondContact O-CB 3.5Å; I59-L62 PolarHBondContact O-N 2.84Å; H60-L62 PolarHBondContact O-N 3.19Å; L62-A73 HydrophobicContact CD2-CB 3.91Å; L62-A73 HydrophobicContact CG-CB 4.25Å; L62-L74 HydrophobicContact CD1-CD2 4.45Å; L62-L74 HydrophobicContact CD2-CD2 3.67Å; L62-L74 HydrophobicContact CD2-CG 3.6Å; L62-L77 HydrophobicContact CD1-CD1 3.59Å; L62-L77 HydrophobicContact CG-CD1 4.19Å; L62-V135 HydrophobicContact CB-CG1 3.86Å; L62-V135 HydrophobicContact CD1-CG1 4.09Å
63	N	82.6	Confident	82.2	Confident	63 Å²	63	59.6 Å²	59.6	34%	0.337	32%	0.322	S	S	.	.	H	α-helix	trans	-82.3	-18.6	178.4	-73.1	-48	0	0	0	113.3	H60 S61	H60-N63 WeakPolarHBondContact O-CB 3.5Å; H60-N63 PolarHBondContact O-N 3.47Å; S61-N63 PolarHBondContact O-N 2.76Å
64	I	81.9	Confident	82.8	Confident	67 Å²	67	54.3 Å²	54.3	34%	0.344	30%	0.297	S	S	.	.	S	Bend	trans	-71.1	140.9	180	-57.3	177.7	0	0	0	109.3	S61 D66 L69 R70	S61-I64 PolarHBondContact O-N 2.93Å; I64-D66 HydrophobicContact CG2-CB 4.28Å; I64-D66 PolarHBondContact O-N 3.22Å; I64-L69 HydrophobicContact CD1-CD1 4.44Å; I64-L69 HydrophobicContact CG2-CD1 4.14Å; I64-R70 WeakPolarHBondContact O-CD 3.44Å; I64-R70 WeakPolarHBondContact O-CG 3.36Å; I64-R70 VanDerWaalsContact O-CZ 3.24Å; I64-R70 PolarHBondContact O-NE 3.28Å; I64-R70 PolarHBondContact O-NH2 3.46Å
65	E	77.4	Confident	83.5	Confident	166 Å²	166	57 Å²	57	78%	0.776	30%	0.304	S	S	*	.	S	Bend	trans	-74.5	1.3	-175.1	-66.6	-174.8	170.2	0	0	115.8
66	D	82.9	Confident	83.8	Confident	75 Å²	75	57.8 Å²	57.8	40%	0.401	31%	0.312	S	S	.	.			trans	-82.9	119.3	176.6	-177	-5.7	0	0	0	112	I64 A68 L69 R70	I64-D66 HydrophobicContact CG2-CB 4.28Å; I64-D66 PolarHBondContact O-N 3.22Å; D66-A68 VanDerWaalsContact C-N 3.33Å; D66-A68 PolarHBondContact O-N 3.05Å; D66-A68 PolarHBondContact OD1-N 2.9Å; D66-L69 HydrophobicContact CB-CB 4.07Å; D66-L69 HydrophobicContact CB-CD1 3.95Å; D66-L69 HydrophobicContact CB-CG 4.1Å; D66-L69 PolarHBondContact O-N 3.28Å; D66-L69 WeakPolarHBondContact OD2-CG 3.38Å; D66-R70 WeakPolarHBondContact O-CB 3.47Å; D66-R70 WeakPolarHBondContact O-CD 3.03Å; D66-R70 VanDerWaalsContact O-CG 3.27Å; D66-R70 WeakPolarHBondContact O-CG 3.47Å; D66-R70 PolarHBondContact O-N 3.42Å
67	S	82.3	Confident	84.2	Confident	52 Å²	52	52.3 Å²	52.3	36%	0.364	29%	0.286	S	S	.	.	H	α-helix	trans	-58.6	-39.6	177	-176.2	0	0	0	0	113.2	R70 Q71 F148	S67-R70 PolarHBondContact O-N 3.38Å; S67-Q71 WeakPolarHBondContact O-CB 3.41Å; S67-Q71 PolarHBondContact O-N 3.02Å; S67-F148 WeakPolarHBondContact OG-CZ 3.36Å
68	A	83.3	Confident	84.5	Confident	64 Å²	64	49.7 Å²	49.7	53%	0.529	27%	0.267	S	S	.	.	H	α-helix	trans	-69.1	-42.2	-178.6	0	0	0	0	0	111.5	D66 Q71 S72	D66-A68 VanDerWaalsContact C-N 3.33Å; D66-A68 PolarHBondContact O-N 3.05Å; D66-A68 PolarHBondContact OD1-N 2.9Å; A68-Q71 PolarHBondContact O-N 3.1Å; A68-S72 WeakPolarHBondContact O-CB 3.37Å; A68-S72 PolarHBondContact O-N 3.43Å
69	L	84.4	Confident	84.4	Confident	75 Å²	75	57.3 Å²	57.3	39%	0.393	30%	0.295	S	S	.	.	H	α-helix	trans	-64.8	-45	174.7	-71.2	176.9	0	0	0	111.5	I64 D66 Q71 S72 A73	I64-L69 HydrophobicContact CD1-CD1 4.44Å; I64-L69 HydrophobicContact CG2-CD1 4.14Å; D66-L69 HydrophobicContact CB-CB 4.07Å; D66-L69 HydrophobicContact CB-CD1 3.95Å; D66-L69 HydrophobicContact CB-CG 4.1Å; D66-L69 PolarHBondContact O-N 3.28Å; D66-L69 WeakPolarHBondContact OD2-CG 3.38Å; L69-Q71 VanDerWaalsContact C-N 3.31Å; L69-Q71 PolarHBondContact O-N 3.01Å; L69-S72 PolarHBondContact O-N 3.21Å; L69-A73 VanDerWaalsContact O-CB 3.29Å; L69-A73 WeakPolarHBondContact O-CB 3.24Å; L69-A73 PolarHBondContact O-N 3.38Å
70	R	86.1	Confident	84.4	Confident	35 Å²	35	58 Å²	58	13%	0.132	30%	0.299	C	S	.	.	H	α-helix	trans	-55.9	-44.7	173.8	-75.7	163.3	164.8	179.9	13.1	111.8	I64 D66 S67 A73 L74 F139 F148	I64-R70 WeakPolarHBondContact O-CD 3.44Å; I64-R70 WeakPolarHBondContact O-CG 3.36Å; I64-R70 VanDerWaalsContact O-CZ 3.24Å; I64-R70 PolarHBondContact O-NE 3.28Å; I64-R70 PolarHBondContact O-NH2 3.46Å; D66-R70 WeakPolarHBondContact O-CB 3.47Å; D66-R70 WeakPolarHBondContact O-CD 3.03Å; D66-R70 VanDerWaalsContact O-CG 3.27Å; D66-R70 WeakPolarHBondContact O-CG 3.47Å; D66-R70 PolarHBondContact O-N 3.42Å; S67-R70 PolarHBondContact O-N 3.38Å; R70-A73 PolarHBondContact O-N 3.09Å; R70-L74 WeakPolarHBondContact O-CG 3.2Å; R70-L74 PolarHBondContact O-N 2.84Å; R70-F139 HydrophobicContact CB-CE2 4.2Å; R70-F139 HydrophobicContact CG-CE2 3.95Å; R70-F148 HydrophobicContact CB-CE1 4.08Å; R70-F148 HydrophobicContact CB-CZ 4.06Å
71	Q	85.2	Confident	84.2	Confident	50 Å²	50	52.2 Å²	52.2	23%	0.234	27%	0.272	C	S	.	.	H	α-helix	trans	-68.9	-40.4	179.7	-157.7	177.6	24.7	0	0	112	S67 A68 L69 R75 F148 E151	S67-Q71 WeakPolarHBondContact O-CB 3.41Å; S67-Q71 PolarHBondContact O-N 3.02Å; A68-Q71 PolarHBondContact O-N 3.1Å; L69-Q71 VanDerWaalsContact C-N 3.31Å; L69-Q71 PolarHBondContact O-N 3.01Å; Q71-R75 VanDerWaalsContact O-CG 3.29Å; Q71-R75 WeakPolarHBondContact O-CG 3.3Å; Q71-R75 PolarHBondContact O-N 3.38Å; Q71-R75 VanDerWaalsContact O-N 3.08Å; Q71-R75 VanDerWaalsContact OE1-NH2 3.17Å; Q71-F148 HydrophobicContact CB-CE1 3.72Å; Q71-F148 HydrophobicContact CB-CZ 4.44Å; Q71-F148 HydrophobicContact CG-CE1 4.09Å; Q71-E151 PolarHBondContact NE2-OE1 2.8Å
72	S	85.8	Confident	84	Confident	69 Å²	69	53.1 Å²	53.1	48%	0.483	28%	0.275	S	S	.	.	H	α-helix	trans	-60.9	-45.4	174.2	-169.1	0	0	0	0	111.3	A68 L69 R75 A76	A68-S72 WeakPolarHBondContact O-CB 3.37Å; A68-S72 PolarHBondContact O-N 3.43Å; L69-S72 PolarHBondContact O-N 3.21Å; S72-R75 PolarHBondContact O-N 3.12Å; S72-A76 WeakPolarHBondContact O-CB 3.38Å; S72-A76 PolarHBondContact O-N 3.15Å
73	A	86.9	Confident	83.5	Confident	4 Å²	4	57.2 Å²	57.2	3%	0.033	30%	0.301	C	S	.	.	H	α-helix	trans	-61.7	-47.3	177.8	0	0	0	0	0	112.4	S58 L62 L69 R70 R75 A76 L77	S58-A73 WeakPolarHBondContact O-CB 3.13Å; L62-A73 HydrophobicContact CD2-CB 3.91Å; L62-A73 HydrophobicContact CG-CB 4.25Å; L69-A73 VanDerWaalsContact O-CB 3.29Å; L69-A73 WeakPolarHBondContact O-CB 3.24Å; L69-A73 PolarHBondContact O-N 3.38Å; R70-A73 PolarHBondContact O-N 3.09Å; A73-R75 VanDerWaalsContact C-N 3.28Å; A73-R75 PolarHBondContact O-N 3.26Å; A73-A76 PolarHBondContact O-N 3.46Å; A73-A76 VanDerWaalsContact O-N 3.16Å; A73-L77 WeakPolarHBondContact O-CB 3.49Å; A73-L77 WeakPolarHBondContact O-CG 3.44Å; A73-L77 PolarHBondContact O-N 3.42Å
74	L	87.8	Confident	82.8	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-59.6	-39.3	175.1	-74.8	172.4	0	0	0	112	L62 R70 N78 F139 F148 E151 I152 L155	L62-L74 HydrophobicContact CD1-CD2 4.45Å; L62-L74 HydrophobicContact CD2-CD2 3.67Å; L62-L74 HydrophobicContact CD2-CG 3.6Å; R70-L74 WeakPolarHBondContact O-CG 3.2Å; R70-L74 PolarHBondContact O-N 2.84Å; L74-N78 VanDerWaalsContact O-CB 3.22Å; L74-N78 WeakPolarHBondContact O-CB 3.48Å; L74-N78 PolarHBondContact O-N 3.21Å; L74-N78 PolarHBondContact O-ND2 3.43Å; L74-F139 HydrophobicContact CD1-CE1 3.91Å; L74-F139 HydrophobicContact CD1-CZ 4.12Å; L74-F148 HydrophobicContact CD1-CB 4.49Å; L74-F148 HydrophobicContact CD1-CD1 3.55Å; L74-F148 HydrophobicContact CD1-CE1 4.18Å; L74-F148 HydrophobicContact CD1-CG 4.4Å; L74-E151 HydrophobicContact CB-CB 4.04Å; L74-E151 HydrophobicContact CD1-CB 4.12Å; L74-I152 HydrophobicContact CD1-CG1 4.32Å; L74-L155 HydrophobicContact CD2-CD2 3.88Å
75	R	87.9	Confident	82.3	Confident	110 Å²	110	53.9 Å²	53.9	42%	0.415	28%	0.284	S	S	.	.	H	α-helix	trans	-68.3	-39.3	175.9	-71.4	174.5	-171.5	148.1	-1.3	111.8	Q71 S72 A73 N78 R79	Q71-R75 VanDerWaalsContact O-CG 3.29Å; Q71-R75 WeakPolarHBondContact O-CG 3.3Å; Q71-R75 PolarHBondContact O-N 3.38Å; Q71-R75 VanDerWaalsContact O-N 3.08Å; Q71-R75 VanDerWaalsContact OE1-NH2 3.17Å; S72-R75 PolarHBondContact O-N 3.12Å; A73-R75 VanDerWaalsContact C-N 3.28Å; A73-R75 PolarHBondContact O-N 3.26Å; R75-N78 PolarHBondContact O-N 3.07Å; R75-R79 WeakPolarHBondContact O-CB 3.3Å; R75-R79 VanDerWaalsContact O-CG 3.27Å; R75-R79 WeakPolarHBondContact O-CG 3.37Å; R75-R79 PolarHBondContact O-N 3.2Å
76	A	84.7	Confident	82	Confident	23 Å²	23	50 Å²	50	19%	0.19	27%	0.265	C	S	.	.	H	α-helix	trans	-63.6	-50.2	176.3	0	0	0	0	0	111.2	S58 S72 A73 N78 R79 L80	S58-A76 WeakPolarHBondContact OG-CB 3.45Å; S72-A76 WeakPolarHBondContact O-CB 3.38Å; S72-A76 PolarHBondContact O-N 3.15Å; A73-A76 PolarHBondContact O-N 3.46Å; A73-A76 VanDerWaalsContact O-N 3.16Å; A76-N78 VanDerWaalsContact C-N 3.33Å; A76-N78 PolarHBondContact O-N 3.33Å; A76-R79 WeakPolarHBondContact O-CB 3.42Å; A76-R79 PolarHBondContact O-N 3.07Å; A76-L80 WeakPolarHBondContact O-CG 2.89Å; A76-L80 PolarHBondContact O-N 3.05Å
77	L	87.1	Confident	81.1	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-58	-44.9	175.1	-69.1	167	0	0	0	111.7	F55 I59 L62 A73 R79 L80 L81 L132 L155	F55-L77 HydrophobicContact CD2-CD2 3.55Å; F55-L77 HydrophobicContact CE2-CD2 3.6Å; F55-L77 HydrophobicContact CG-CD2 4.33Å; F55-L77 HydrophobicContact CZ-CD2 4.42Å; I59-L77 HydrophobicContact CG1-CD2 4.21Å; L62-L77 HydrophobicContact CD1-CD1 3.59Å; L62-L77 HydrophobicContact CG-CD1 4.19Å; A73-L77 WeakPolarHBondContact O-CB 3.49Å; A73-L77 WeakPolarHBondContact O-CG 3.44Å; A73-L77 PolarHBondContact O-N 3.42Å; L77-R79 VanDerWaalsContact C-N 3.3Å; L77-R79 PolarHBondContact O-N 2.99Å; L77-L80 PolarHBondContact O-N 3.48Å; L77-L81 PolarHBondContact O-N 3.22Å; L77-L132 HydrophobicContact CD1-CD1 3.82Å; L77-L132 HydrophobicContact CD2-CD1 4.12Å; L77-L155 HydrophobicContact CB-CD1 4.05Å; L77-L155 HydrophobicContact CB-CD2 4.49Å; L77-L155 HydrophobicContact CD1-CD2 4.37Å
78	N	88	Confident	80.2	Confident	7 Å²	7	46.5 Å²	46.5	4%	0.037	25%	0.25	C	C	.	.	H	α-helix	trans	-59.2	-40.9	175.2	-93	-62.8	0	0	0	112.3	L74 R75 A76 D82 E151 Q154 L155 K158	L74-N78 VanDerWaalsContact O-CB 3.22Å; L74-N78 WeakPolarHBondContact O-CB 3.48Å; L74-N78 PolarHBondContact O-N 3.21Å; L74-N78 PolarHBondContact O-ND2 3.43Å; R75-N78 PolarHBondContact O-N 3.07Å; A76-N78 VanDerWaalsContact C-N 3.33Å; A76-N78 PolarHBondContact O-N 3.33Å; N78-D82 VanDerWaalsContact O-CB 3.26Å; N78-D82 WeakPolarHBondContact O-CB 3.31Å; N78-D82 PolarHBondContact O-N 3.38Å; N78-D82 VanDerWaalsContact O-N 3.16Å; N78-E151 PolarHBondContact ND2-O 3.19Å; N78-Q154 WeakPolarHBondContact OD1-CB 3.48Å; N78-L155 WeakPolarHBondContact OD1-CA 3.43Å; N78-L155 PolarHBondContact OD1-N 3.31Å; N78-K158 PolarHBondContact O-NZ 3.05Å; N78-K158 PolarHBondContact OD1-NZ 2.84Å
79	R	83.7	Confident	79.2	Confident	169 Å²	169	46.2 Å²	46.2	64%	0.638	24%	0.241	S	C	*	.	H	α-helix	trans	-69.6	-38.7	178.1	-75.7	171.6	-179.9	173.1	0.1	112.2	R75 A76 L77 P83	R75-R79 WeakPolarHBondContact O-CB 3.3Å; R75-R79 VanDerWaalsContact O-CG 3.27Å; R75-R79 WeakPolarHBondContact O-CG 3.37Å; R75-R79 PolarHBondContact O-N 3.2Å; A76-R79 WeakPolarHBondContact O-CB 3.42Å; A76-R79 PolarHBondContact O-N 3.07Å; L77-R79 VanDerWaalsContact C-N 3.3Å; L77-R79 PolarHBondContact O-N 2.99Å; R79-P83 WeakPolarHBondContact O-CD 3.5Å
80	L	81.5	Confident	77.8	Confident	35 Å²	35	47.8 Å²	47.8	18%	0.183	26%	0.255	C	S	.	.	H	α-helix	trans	-67.2	-40.4	179.2	-71.5	171.7	0	0	0	112.2	N51 I54 F55 A76 L77	N51-L80 HydrophobicContact CB-CD2 4.33Å; I54-L80 HydrophobicContact CB-CD1 4.33Å; I54-L80 HydrophobicContact CG2-CD1 3.96Å; F55-L80 HydrophobicContact CB-CD1 4.03Å; F55-L80 HydrophobicContact CD2-CD1 4.24Å; A76-L80 WeakPolarHBondContact O-CG 2.89Å; A76-L80 PolarHBondContact O-N 3.05Å; L77-L80 PolarHBondContact O-N 3.48Å
81	L	81.3	Confident	76.1	Confident	3 Å²	3	48 Å²	48	2%	0.016	26%	0.258	C	S	.	.	H	α-helix	trans	-83.8	-14.9	-179.9	-64	-177	0	0	0	114.1	F55 L77 L84 A85 I127 L132 L155 K158 I159 I162	F55-L81 HydrophobicContact CE2-CD2 4.46Å; L77-L81 PolarHBondContact O-N 3.22Å; L81-L84 HydrophobicContact CD2-CD1 4.14Å; L81-L84 PolarHBondContact O-N 2.88Å; L81-A85 WeakPolarHBondContact O-CB 3.44Å; L81-A85 PolarHBondContact O-N 2.92Å; L81-I127 HydrophobicContact CD2-CD1 4.4Å; L81-L132 HydrophobicContact CD1-CD2 3.8Å; L81-L155 HydrophobicContact CD1-CD1 3.73Å; L81-K158 HydrophobicContact CB-CB 4.36Å; L81-K158 HydrophobicContact CB-CD 4.22Å; L81-I159 HydrophobicContact CD1-CG1 4.38Å; L81-I162 HydrophobicContact CB-CD1 4.38Å; L81-I162 HydrophobicContact CD1-CD1 4.37Å; L81-I162 HydrophobicContact CD2-CD1 3.93Å; L81-I162 HydrophobicContact CG-CD1 4.46Å
82	D	79.4	Confident	74	Confident	48 Å²	48	47.4 Å²	47.4	26%	0.257	26%	0.258	S	S	.	.	H	α-helix	trans	-63.1	-45.9	-175.4	-170.8	57.9	0	0	0	113.8	N78 L84 A85 K86 K158	N78-D82 VanDerWaalsContact O-CB 3.26Å; N78-D82 WeakPolarHBondContact O-CB 3.31Å; N78-D82 PolarHBondContact O-N 3.38Å; N78-D82 VanDerWaalsContact O-N 3.16Å; D82-L84 VanDerWaalsContact C-N 3.25Å; D82-L84 PolarHBondContact O-N 3.32Å; D82-A85 PolarHBondContact O-N 3.1Å; D82-K86 VanDerWaalsContact O-CB 3.24Å; D82-K86 WeakPolarHBondContact O-CB 3.43Å; D82-K86 VanDerWaalsContact O-CG 3.25Å; D82-K86 WeakPolarHBondContact O-CG 3.46Å; D82-K86 PolarHBondContact O-N 2.65Å; D82-K86 WeakPolarHBondContact OD1-CE 3.44Å; D82-K86 IonicContact OD1-NZ 3.98Å; D82-K86 WeakPolarHBondContact OD2-CE 3.41Å; D82-K86 IonicContact OD2-NZ 3.2Å; D82-K86 PolarHBondContact OD2-NZ 3.09Å; D82-K158 WeakPolarHBondContact OD1-CE 3.45Å; D82-K158 IonicContact OD1-NZ 2.64Å
83	P	73.5	Confident	72.1	Confident	86 Å²	86	45.5 Å²	45.5	56%	0.558	24%	0.241	S	C	*	.	H	α-helix	trans	-60.1	-35.2	174.6	-23	33.8	0	0	0	113	R79 G87	R79-P83 WeakPolarHBondContact O-CD 3.5Å; P83-G87 PolarHBondContact O-N 3.42Å
84	L	67.4	Low	69.5	Low	54 Å²	54	46.6 Å²	46.6	28%	0.283	25%	0.246	S	C	.	.	H	α-helix	trans	-72.2	-50.1	179.9	-65.2	171.2	0	0	0	111.3	L81 D82 K86 G87 I88 L116 I127	L81-L84 HydrophobicContact CD2-CD1 4.14Å; L81-L84 PolarHBondContact O-N 2.88Å; D82-L84 VanDerWaalsContact C-N 3.25Å; D82-L84 PolarHBondContact O-N 3.32Å; L84-K86 VanDerWaalsContact C-N 3.26Å; L84-K86 PolarHBondContact O-N 2.76Å; L84-G87 PolarHBondContact O-N 2.9Å; L84-G87 VanDerWaalsContact O-N 3.11Å; L84-I88 WeakPolarHBondContact O-CG1 3.22Å; L84-I88 PolarHBondContact O-N 3.31Å; L84-L116 HydrophobicContact CD1-CD1 3.84Å; L84-L116 HydrophobicContact CD2-CD1 4.18Å; L84-L116 HydrophobicContact CG-CD1 4.48Å; L84-I127 HydrophobicContact CD1-CD1 3.98Å
85	A	70.9	Confident	67	Low	6 Å²	6	53.2 Å²	53.2	5%	0.05	28%	0.282	C	S	.	.	H	α-helix	trans	-60.8	-38.4	175.2	0	0	0	0	0	111.2	L81 D82 I88 T89 K158 H161	L81-A85 WeakPolarHBondContact O-CB 3.44Å; L81-A85 PolarHBondContact O-N 2.92Å; D82-A85 PolarHBondContact O-N 3.1Å; A85-I88 PolarHBondContact O-N 3.49Å; A85-T89 VanDerWaalsContact O-CB 3.31Å; A85-T89 WeakPolarHBondContact O-CB 3.37Å; A85-T89 WeakPolarHBondContact O-CG2 3.37Å; A85-T89 PolarHBondContact O-N 2.95Å; A85-T89 PolarHBondContact O-OG1 2.8Å; A85-K158 HydrophobicContact CB-CB 4.04Å; A85-K158 HydrophobicContact CB-CG 3.77Å; A85-H161 HydrophobicContact CB-CB 4.35Å
86	K	71.9	Confident	64.5	Low	85 Å²	85	50 Å²	50	37%	0.37	27%	0.271	S	S	.	.	H	α-helix	trans	-63.7	-45.2	171.6	-77.5	173.5	177.3	167.1	0	111.9	D82 L84 I88 T89 T90	D82-K86 VanDerWaalsContact O-CB 3.24Å; D82-K86 WeakPolarHBondContact O-CB 3.43Å; D82-K86 VanDerWaalsContact O-CG 3.25Å; D82-K86 WeakPolarHBondContact O-CG 3.46Å; D82-K86 PolarHBondContact O-N 2.65Å; D82-K86 WeakPolarHBondContact OD1-CE 3.44Å; D82-K86 IonicContact OD1-NZ 3.98Å; D82-K86 WeakPolarHBondContact OD2-CE 3.41Å; D82-K86 IonicContact OD2-NZ 3.2Å; D82-K86 PolarHBondContact OD2-NZ 3.09Å; L84-K86 VanDerWaalsContact C-N 3.26Å; L84-K86 PolarHBondContact O-N 2.76Å; K86-I88 VanDerWaalsContact C-N 3.3Å; K86-I88 PolarHBondContact O-N 2.98Å; K86-T89 VanDerWaalsContact CA-OG1 3.27Å; K86-T89 WeakPolarHBondContact CA-OG1 3.33Å; K86-T89 PolarHBondContact O-N 2.84Å; K86-T89 PolarHBondContact O-OG1 3.42Å; K86-T89 VanDerWaalsContact O-OG1 3.12Å; K86-T90 WeakPolarHBondContact O-CB 3.09Å; K86-T90 WeakPolarHBondContact O-CG2 3.21Å; K86-T90 PolarHBondContact O-N 2.88Å; K86-T90 PolarHBondContact O-OG1 2.86Å
87	G	64.5	Low	62	Low	33 Å²	33	50.8 Å²	50.8	34%	0.34	27%	0.272	S	S	.	.	H	α-helix	trans	-58	-41.2	175.9	0	0	0	0	0	112.3	P83 L84 T90 I91	P83-G87 PolarHBondContact O-N 3.42Å; L84-G87 PolarHBondContact O-N 2.9Å; L84-G87 VanDerWaalsContact O-N 3.11Å; G87-T90 PolarHBondContact O-OG1 2.75Å; G87-I91 WeakPolarHBondContact O-CD1 3.31Å; G87-I91 WeakPolarHBondContact O-CG1 3.42Å
88	I	63.3	Low	59.4	Low	20 Å²	20	54.4 Å²	54.4	10%	0.103	29%	0.294	C	S	.	.	H	α-helix	trans	-75.1	-35.6	177.9	-63.1	168.1	0	0	0	111.6	L84 A85 K86 I91 L94 I162 T165	L84-I88 WeakPolarHBondContact O-CG1 3.22Å; L84-I88 PolarHBondContact O-N 3.31Å; A85-I88 PolarHBondContact O-N 3.49Å; K86-I88 VanDerWaalsContact C-N 3.3Å; K86-I88 PolarHBondContact O-N 2.98Å; I88-I91 WeakPolarHBondContact O-CB 3.4Å; I88-I91 PolarHBondContact O-N 3.47Å; I88-L94 HydrophobicContact CG2-CD1 4.35Å; I88-L94 HydrophobicContact CG2-CD2 4.41Å; I88-I162 HydrophobicContact CD1-CB 4.23Å; I88-I162 HydrophobicContact CD1-CG1 3.99Å; I88-I162 HydrophobicContact CD1-CG2 4.38Å; I88-T165 HydrophobicContact CG2-CG2 3.84Å
89	T	61.6	Low	56.6	Low	58 Å²	58	57.4 Å²	57.4	36%	0.356	31%	0.31	S	S	.	.	H	α-helix	trans	-78.3	-26.1	180	54	0	0	0	0	114.3	A85 K86 I91 L94 H161	A85-T89 VanDerWaalsContact O-CB 3.31Å; A85-T89 WeakPolarHBondContact O-CB 3.37Å; A85-T89 WeakPolarHBondContact O-CG2 3.37Å; A85-T89 PolarHBondContact O-N 2.95Å; A85-T89 PolarHBondContact O-OG1 2.8Å; K86-T89 VanDerWaalsContact CA-OG1 3.27Å; K86-T89 WeakPolarHBondContact CA-OG1 3.33Å; K86-T89 PolarHBondContact O-N 2.84Å; K86-T89 PolarHBondContact O-OG1 3.42Å; K86-T89 VanDerWaalsContact O-OG1 3.12Å; T89-I91 PolarHBondContact O-N 3.23Å; T89-L94 HydrophobicContact CG2-CD1 3.44Å; T89-L94 VanDerWaalsContact CG2-CD1 3.44Å; T89-H161 HydrophobicContact CG2-CB 4.37Å
90	T	55.6	Low	54.1	Low	109 Å²	109	51.3 Å²	51.3	67%	0.669	29%	0.293	S	S	*	.	H	α-helix	trans	-72.6	-20.4	171.5	54.3	0	0	0	0	112	K86 G87 P92	K86-T90 WeakPolarHBondContact O-CB 3.09Å; K86-T90 WeakPolarHBondContact O-CG2 3.21Å; K86-T90 PolarHBondContact O-N 2.88Å; K86-T90 PolarHBondContact O-OG1 2.86Å; G87-T90 PolarHBondContact O-OG1 2.75Å; T90-P92 WeakPolarHBondContact O-CD 3.25Å
91	I	50	Low	51.9	Low	38 Å²	38	51 Å²	51	20%	0.195	29%	0.291	C	S	.	.	S	Bend	trans	-72.1	121.5	173.8	-64.2	166.3	0	0	0	108.1	G87 I88 T89 F93 V109	G87-I91 WeakPolarHBondContact O-CD1 3.31Å; G87-I91 WeakPolarHBondContact O-CG1 3.42Å; I88-I91 WeakPolarHBondContact O-CB 3.4Å; I88-I91 PolarHBondContact O-N 3.47Å; T89-I91 PolarHBondContact O-N 3.23Å; I91-F93 HydrophobicContact CB-CD2 4.23Å; I91-F93 HydrophobicContact CB-CE2 4.38Å; I91-F93 HydrophobicContact CG2-CB 4.43Å; I91-F93 HydrophobicContact CG2-CD2 2.93Å; I91-F93 HydrophobicContact CG2-CE2 2.9Å; I91-F93 HydrophobicContact CG2-CG 3.85Å; I91-F93 HydrophobicContact CG2-CZ 3.84Å; I91-F93 PolarHBondContact O-N 3.18Å; I91-V109 HydrophobicContact CD1-CG2 4.4Å; I91-V109 HydrophobicContact CG2-CG2 4.44Å
92	P	41.7	Very low	49.7	Very low	38 Å²	38	51.2 Å²	51.2	25%	0.247	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	16.5	-170.6	26.7	-35.2	0	0	0	115.6	T90 N976	T90-P92 WeakPolarHBondContact O-CD 3.25Å; P92-N976 HydrophobicContact CB-CB 4.44Å
93	F	44.6	Very low	47.5	Very low	29 Å²	29	50.5 Å²	50.5	13%	0.127	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-20.3	176.2	-55.2	-49	0	0	0	114	I91 D95 K96 L101 F105 V109	I91-F93 HydrophobicContact CB-CD2 4.23Å; I91-F93 HydrophobicContact CB-CE2 4.38Å; I91-F93 HydrophobicContact CG2-CB 4.43Å; I91-F93 HydrophobicContact CG2-CD2 2.93Å; I91-F93 HydrophobicContact CG2-CE2 2.9Å; I91-F93 HydrophobicContact CG2-CG 3.85Å; I91-F93 HydrophobicContact CG2-CZ 3.84Å; I91-F93 PolarHBondContact O-N 3.18Å; F93-D95 PolarHBondContact O-N 2.92Å; F93-K96 CarbonylContact C-O 3.56Å; F93-K96 CarbonylContact O-C 3.59Å; F93-K96 VanDerWaalsContact O-C 3.31Å; F93-K96 WeakPolarHBondContact O-CA 2.9Å; F93-K96 PolarHBondContact O-N 3.08Å; F93-L101 HydrophobicContact CD1-CD2 3.92Å; F93-L101 HydrophobicContact CD1-CG 4.11Å; F93-L101 HydrophobicContact CD2-CD2 3.9Å; F93-L101 HydrophobicContact CE1-CD2 3.34Å; F93-L101 HydrophobicContact CE1-CG 3.85Å; F93-L101 HydrophobicContact CE2-CD2 3.36Å; F93-L101 HydrophobicContact CE2-CG 4.47Å; F93-L101 HydrophobicContact CG-CD2 4.25Å; F93-L101 HydrophobicContact CZ-CD2 3.15Å; F93-L101 HydrophobicContact CZ-CG 4.16Å; F93-F105 HydrophobicContact CE1-CB 4.4Å; F93-F105 HydrophobicContact CE2-CB 3.89Å; F93-F105 HydrophobicContact CE2-CG 4.4Å; F93-F105 HydrophobicContact CZ-CB 3.34Å; F93-F105 HydrophobicContact CZ-CD1 4.04Å; F93-F105 HydrophobicContact CZ-CD2 4.24Å; F93-F105 AromaticContact CZ-CG 3.64Å; F93-F105 HydrophobicContact CZ-CG 3.64Å; F93-V109 HydrophobicContact CD2-CG2 3.84Å; F93-V109 HydrophobicContact CE2-CG2 3.48Å; F93-V109 VanDerWaalsContact CE2-CG2 3.48Å
94	L	32.5	Very low	45.8	Very low	27 Å²	27	50.3 Å²	50.3	14%	0.141	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-10.6	-172.3	-70.3	-174.3	0	0	0	114.2	I88 T89 Y164 R208	I88-L94 HydrophobicContact CG2-CD1 4.35Å; I88-L94 HydrophobicContact CG2-CD2 4.41Å; T89-L94 HydrophobicContact CG2-CD1 3.44Å; T89-L94 VanDerWaalsContact CG2-CD1 3.44Å; L94-Y164 HydrophobicContact CD1-CD2 4.39Å; L94-Y164 HydrophobicContact CD2-CD2 3.44Å; L94-Y164 VanDerWaalsContact CD2-CD2 3.44Å; L94-Y164 HydrophobicContact CD2-CE2 4.19Å; L94-Y164 HydrophobicContact CD2-CG 3.83Å; L94-R208 VanDerWaalsContact O-CZ 3.23Å; L94-R208 PolarHBondContact O-NH1 2.99Å; L94-R208 PolarHBondContact O-NH2 3.35Å
95	D	35.9	Very low	44.6	Very low	140 Å²	140	49.4 Å²	49.4	75%	0.749	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	-4.2	164.3	-72.1	-28.3	0	0	0	113.2	F93	F93-D95 PolarHBondContact O-N 2.92Å
96	K	35.7	Very low	43.3	Very low	42 Å²	42	53 Å²	53	18%	0.183	30%	0.297	C	S	.	.	S	Bend	trans	-130.8	116.4	-167.1	-52.8	-171.3	174.4	-157.9	0	111.4	F93 S100 D973 N976	F93-K96 CarbonylContact C-O 3.56Å; F93-K96 CarbonylContact O-C 3.59Å; F93-K96 VanDerWaalsContact O-C 3.31Å; F93-K96 WeakPolarHBondContact O-CA 2.9Å; F93-K96 PolarHBondContact O-N 3.08Å; K96-S100 VanDerWaalsContact CB-OG 3.31Å; K96-S100 WeakPolarHBondContact CB-OG 3.24Å; K96-D973 WeakPolarHBondContact CE-O 3.34Å; K96-D973 PolarHBondContact NZ-O 3.37Å; K96-N976 PolarHBondContact NZ-O 2.79Å
97	N	32.4	Very low	41.9	Very low	40 Å²	40	52.8 Å²	52.8	21%	0.214	31%	0.305	C	S	.	.			trans	-34.6	140	173.9	-65	-28.5	0	0	0	112.8	L99 S100 I215	N97-L99 PolarHBondContact O-N 2.93Å; N97-S100 PolarHBondContact O-N 3.42Å; N97-S100 PolarHBondContact O-OG 3.36Å; N97-I215 HydrophobicContact CB-CD1 3.71Å; N97-I215 WeakPolarHBondContact ND2-CD1 3.49Å
98	V	32.3	Very low	41.3	Very low	75 Å²	75	57.8 Å²	57.8	46%	0.455	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-45.9	-31.9	177.1	176.9	0	0	0	0	111.8	S100 L101 T212	V98-S100 PolarHBondContact O-N 2.9Å; V98-L101 HydrophobicContact CB-CD1 4.44Å; V98-L101 HydrophobicContact CG1-CD1 3.61Å; V98-L101 WeakPolarHBondContact O-CB 3.4Å; V98-L101 WeakPolarHBondContact O-CD1 3.41Å; V98-L101 WeakPolarHBondContact O-CG 3.34Å; V98-L101 PolarHBondContact O-N 2.84Å; V98-L101 VanDerWaalsContact O-N 3.09Å; V98-T212 HydrophobicContact CB-CG2 4.04Å; V98-T212 HydrophobicContact CG2-CG2 3.74Å
99	L	29.4	Very low	40.5	Very low	71 Å²	71	57.8 Å²	57.8	37%	0.372	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-75.9	-1.2	179.9	-65.8	164.8	0	0	0	115.9	N97 L101 I215 L216 P850	N97-L99 PolarHBondContact O-N 2.93Å; L99-L101 VanDerWaalsContact C-N 3.34Å; L99-I215 HydrophobicContact CD1-CB 3.46Å; L99-I215 VanDerWaalsContact CD1-CB 3.46Å; L99-I215 HydrophobicContact CD1-CG2 3.11Å; L99-I215 HydrophobicContact CG-CG2 4.44Å; L99-L216 HydrophobicContact CD1-CD2 4.13Å; L99-L216 HydrophobicContact CD1-CG 4.47Å; L99-L216 HydrophobicContact CD2-CD2 3.91Å; L99-L216 HydrophobicContact CG-CD2 4.36Å; L99-P850 VanDerWaalsContact O-CB 3.31Å; L99-P850 WeakPolarHBondContact O-CB 3.41Å; L99-P850 VanDerWaalsContact O-CG 3.26Å; L99-P850 WeakPolarHBondContact O-CG 3.3Å
100	S	31.6	Very low	39.9	Very low	40 Å²	40	57.5 Å²	57.5	28%	0.28	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-95.7	9.8	167.4	66.4	0	0	0	0	113	K96 N97 V98 S102	K96-S100 VanDerWaalsContact CB-OG 3.31Å; K96-S100 WeakPolarHBondContact CB-OG 3.24Å; N97-S100 PolarHBondContact O-N 3.42Å; N97-S100 PolarHBondContact O-OG 3.36Å; V98-S100 PolarHBondContact O-N 2.9Å; S100-S102 PolarHBondContact O-N 3.2Å; S100-S102 VanDerWaalsContact O-N 3.08Å
101	L	35.4	Very low	39.6	Very low	29 Å²	29	55.6 Å²	55.6	15%	0.152	30%	0.302	C	S	.	.			trans	-59.7	108.8	167.4	-81.9	159.8	0	0	0	108.4	F93 V98 L99 S103 F105 I106 V109	F93-L101 HydrophobicContact CD1-CD2 3.92Å; F93-L101 HydrophobicContact CD1-CG 4.11Å; F93-L101 HydrophobicContact CD2-CD2 3.9Å; F93-L101 HydrophobicContact CE1-CD2 3.34Å; F93-L101 HydrophobicContact CE1-CG 3.85Å; F93-L101 HydrophobicContact CE2-CD2 3.36Å; F93-L101 HydrophobicContact CE2-CG 4.47Å; F93-L101 HydrophobicContact CG-CD2 4.25Å; F93-L101 HydrophobicContact CZ-CD2 3.15Å; F93-L101 HydrophobicContact CZ-CG 4.16Å; V98-L101 HydrophobicContact CB-CD1 4.44Å; V98-L101 HydrophobicContact CG1-CD1 3.61Å; V98-L101 WeakPolarHBondContact O-CB 3.4Å; V98-L101 WeakPolarHBondContact O-CD1 3.41Å; V98-L101 WeakPolarHBondContact O-CG 3.34Å; V98-L101 PolarHBondContact O-N 2.84Å; V98-L101 VanDerWaalsContact O-N 3.09Å; L99-L101 VanDerWaalsContact C-N 3.34Å; L101-S103 PolarHBondContact O-N 3.47Å; L101-F105 HydrophobicContact CD2-CB 4Å; L101-I106 HydrophobicContact CB-CG1 4.1Å; L101-I106 HydrophobicContact CD1-CG1 4.24Å; L101-I106 HydrophobicContact CD2-CG1 4.19Å; L101-I106 HydrophobicContact CG-CG1 4.43Å; L101-V109 HydrophobicContact CD2-CG2 4.34Å
102	S	33.5	Very low	39.7	Very low	8 Å²	8	55.5 Å²	55.5	6%	0.056	31%	0.31	C	S	.	.			trans	-60.7	138.1	153	63	0	0	0	0	107.5	S100 N104 F105	S100-S102 PolarHBondContact O-N 3.2Å; S100-S102 VanDerWaalsContact O-N 3.08Å; S102-N104 PolarHBondContact O-N 3.44Å; S102-F105 PolarHBondContact O-N 3.24Å; S102-F105 WeakPolarHBondContact OG-CD2 3.39Å
103	S	34.2	Very low	40.1	Very low	32 Å²	32	56 Å²	56	22%	0.224	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-45.2	-33.2	178.7	48.3	0	0	0	0	111.9	L101 F105 I106 P107	L101-S103 PolarHBondContact O-N 3.47Å; S103-F105 PolarHBondContact O-N 3.42Å; S103-F105 VanDerWaalsContact O-N 3.1Å; S103-I106 PolarHBondContact O-N 3.5Å; S103-P107 WeakPolarHBondContact O-CD 3.37Å
104	N	36.9	Very low	40.2	Very low	83 Å²	83	58.5 Å²	58.5	44%	0.444	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-57.9	-21.6	178.1	-60.1	-10.1	0	0	0	115.7	S102	S102-N104 PolarHBondContact O-N 3.44Å
105	F	43.2	Very low	41.1	Very low	34 Å²	34	62.3 Å²	62.3	15%	0.149	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-104.6	-14.8	179.5	-69.5	-92.1	0	0	0	114.2	F93 L101 S102 S103 P107 K108 V109 K977 L979	F93-F105 HydrophobicContact CE1-CB 4.4Å; F93-F105 HydrophobicContact CE2-CB 3.89Å; F93-F105 HydrophobicContact CE2-CG 4.4Å; F93-F105 HydrophobicContact CZ-CB 3.34Å; F93-F105 HydrophobicContact CZ-CD1 4.04Å; F93-F105 HydrophobicContact CZ-CD2 4.24Å; F93-F105 AromaticContact CZ-CG 3.64Å; F93-F105 HydrophobicContact CZ-CG 3.64Å; L101-F105 HydrophobicContact CD2-CB 4Å; S102-F105 PolarHBondContact O-N 3.24Å; S102-F105 WeakPolarHBondContact OG-CD2 3.39Å; S103-F105 PolarHBondContact O-N 3.42Å; S103-F105 VanDerWaalsContact O-N 3.1Å; F105-P107 VanDerWaalsContact C-CD 3.5Å; F105-P107 VanDerWaalsContact C-N 3.28Å; F105-K108 HydrophobicContact CD1-CD 4.36Å; F105-K108 PolarHBondContact O-N 2.82Å; F105-V109 WeakPolarHBondContact O-CG2 3.09Å; F105-V109 PolarHBondContact O-N 3.31Å; F105-K977 HydrophobicContact CE2-CD 4Å; F105-K977 HydrophobicContact CZ-CD 4.45Å; F105-L979 HydrophobicContact CE2-CD1 4.34Å; F105-L979 HydrophobicContact CE2-CD2 4.02Å; F105-L979 HydrophobicContact CE2-CG 4.33Å; F105-L979 HydrophobicContact CZ-CD2 4.39Å
106	I	42.9	Very low	41.6	Very low	81 Å²	81	56.1 Å²	56.1	42%	0.415	30%	0.304	S	S	.	.	H	α-helix	trans	-54.1	-45.5	174.2	-61.3	175.1	0	0	0	109.8	L101 S103 K108 V109 V110	L101-I106 HydrophobicContact CB-CG1 4.1Å; L101-I106 HydrophobicContact CD1-CG1 4.24Å; L101-I106 HydrophobicContact CD2-CG1 4.19Å; L101-I106 HydrophobicContact CG-CG1 4.43Å; S103-I106 PolarHBondContact O-N 3.5Å; I106-K108 VanDerWaalsContact C-N 3.33Å; I106-K108 PolarHBondContact O-N 2.89Å; I106-V109 PolarHBondContact O-N 3.03Å; I106-V110 HydrophobicContact CG2-CG2 4Å; I106-V110 VanDerWaalsContact O-CB 3.3Å; I106-V110 WeakPolarHBondContact O-CB 3.19Å; I106-V110 WeakPolarHBondContact O-CG2 3.43Å; I106-V110 PolarHBondContact O-N 3.43Å
107	P	42.6	Very low	42.1	Very low	82 Å²	82	57.3 Å²	57.3	53%	0.532	31%	0.312	S	S	.	.	H	α-helix	trans	-61.1	-36.3	175.4	-23.8	33.2	0	0	0	113.8	S103 F105 D111	S103-P107 WeakPolarHBondContact O-CD 3.37Å; F105-P107 VanDerWaalsContact C-CD 3.5Å; F105-P107 VanDerWaalsContact C-N 3.28Å; P107-D111 WeakPolarHBondContact O-CA 3.08Å; P107-D111 WeakPolarHBondContact O-CB 2.81Å; P107-D111 PolarHBondContact O-N 3.35Å
108	K	51.5	Low	42.8	Very low	137 Å²	137	57 Å²	57	60%	0.596	32%	0.318	S	S	*	.	H	α-helix	trans	-72.1	-36.2	178.8	-70.2	-174.9	179.5	178.8	0	112.4	F105 I106 G112	F105-K108 HydrophobicContact CD1-CD 4.36Å; F105-K108 PolarHBondContact O-N 2.82Å; I106-K108 VanDerWaalsContact C-N 3.33Å; I106-K108 PolarHBondContact O-N 2.89Å; K108-G112 PolarHBondContact O-N 3.35Å
109	V	47.2	Very low	43.3	Very low	21 Å²	21	56.4 Å²	56.4	13%	0.127	32%	0.317	C	S	.	.	H	α-helix	trans	-70.4	-45.6	174.5	175	0	0	0	0	109.9	I91 F93 L101 F105 I106 G112 Q113	I91-V109 HydrophobicContact CD1-CG2 4.4Å; I91-V109 HydrophobicContact CG2-CG2 4.44Å; F93-V109 HydrophobicContact CD2-CG2 3.84Å; F93-V109 HydrophobicContact CE2-CG2 3.48Å; F93-V109 VanDerWaalsContact CE2-CG2 3.48Å; L101-V109 HydrophobicContact CD2-CG2 4.34Å; F105-V109 WeakPolarHBondContact O-CG2 3.09Å; F105-V109 PolarHBondContact O-N 3.31Å; I106-V109 PolarHBondContact O-N 3.03Å; V109-G112 PolarHBondContact O-N 3.1Å; V109-Q113 HydrophobicContact CG1-CG 4.41Å; V109-Q113 VanDerWaalsContact O-CB 3.31Å; V109-Q113 WeakPolarHBondContact O-CB 3.45Å; V109-Q113 VanDerWaalsContact O-CG 3.28Å; V109-Q113 WeakPolarHBondContact O-CG 3.17Å; V109-Q113 PolarHBondContact O-N 2.95Å
110	V	47.8	Very low	43.9	Very low	52 Å²	52	59.2 Å²	59.2	32%	0.315	34%	0.337	S	S	.	.	H	α-helix	trans	-62.9	-43.1	175.6	172.1	0	0	0	0	110.5	I106 Q113 Q114	I106-V110 HydrophobicContact CG2-CG2 4Å; I106-V110 VanDerWaalsContact O-CB 3.3Å; I106-V110 WeakPolarHBondContact O-CB 3.19Å; I106-V110 WeakPolarHBondContact O-CG2 3.43Å; I106-V110 PolarHBondContact O-N 3.43Å; V110-Q113 CarbonylContact O-C 3.47Å; V110-Q113 PolarHBondContact O-N 3.47Å; V110-Q114 HydrophobicContact CG1-CG 4.02Å; V110-Q114 WeakPolarHBondContact O-CB 3.36Å; V110-Q114 WeakPolarHBondContact O-CG 3.15Å; V110-Q114 PolarHBondContact O-N 2.87Å
111	D	50.2	Low	44.1	Very low	69 Å²	69	62.5 Å²	62.5	37%	0.369	36%	0.355	S	S	.	.	H	α-helix	trans	-64.5	-42.8	174.6	178.1	49.4	0	0	0	111.3	P107 Q113 Q114 K115	P107-D111 WeakPolarHBondContact O-CA 3.08Å; P107-D111 WeakPolarHBondContact O-CB 2.81Å; P107-D111 PolarHBondContact O-N 3.35Å; D111-Q113 VanDerWaalsContact C-N 3.34Å; D111-Q113 PolarHBondContact O-N 2.75Å; D111-Q114 PolarHBondContact O-N 3.12Å; D111-K115 VanDerWaalsContact O-CB 3.3Å; D111-K115 WeakPolarHBondContact O-CB 3.34Å; D111-K115 VanDerWaalsContact O-CG 3.26Å; D111-K115 WeakPolarHBondContact O-CG 3.28Å; D111-K115 PolarHBondContact O-N 3.49Å; D111-K115 WeakPolarHBondContact OD1-CE 3.19Å; D111-K115 IonicContact OD1-NZ 2.73Å; D111-K115 PolarHBondContact OD1-NZ 3.23Å; D111-K115 WeakPolarHBondContact OD2-CE 3.38Å; D111-K115 IonicContact OD2-NZ 3.22Å; D111-K115 PolarHBondContact OD2-NZ 3.17Å
112	G	53.1	Low	44.3	Very low	36 Å²	36	69.4 Å²	69.4	37%	0.371	39%	0.393	S	S	.	.	H	α-helix	trans	-61.2	-40.4	173.1	0	0	0	0	0	113	K108 V109 L116	K108-G112 PolarHBondContact O-N 3.35Å; V109-G112 PolarHBondContact O-N 3.1Å; G112-L116 WeakPolarHBondContact O-CB 3.35Å; G112-L116 PolarHBondContact O-N 3.36Å
113	Q	48.4	Very low	44.5	Very low	49 Å²	49	72.4 Å²	72.4	23%	0.229	41%	0.411	C	S	.	.	H	α-helix	trans	-73.2	-37.6	174.5	-76.3	171.6	-2	0	0	112.5	V109 V110 D111 L116 L117 T165	V109-Q113 HydrophobicContact CG1-CG 4.41Å; V109-Q113 VanDerWaalsContact O-CB 3.31Å; V109-Q113 WeakPolarHBondContact O-CB 3.45Å; V109-Q113 VanDerWaalsContact O-CG 3.28Å; V109-Q113 WeakPolarHBondContact O-CG 3.17Å; V109-Q113 PolarHBondContact O-N 2.95Å; V110-Q113 CarbonylContact O-C 3.47Å; V110-Q113 PolarHBondContact O-N 3.47Å; D111-Q113 VanDerWaalsContact C-N 3.34Å; D111-Q113 PolarHBondContact O-N 2.75Å; Q113-L116 CarbonylContact O-C 3.47Å; Q113-L116 WeakPolarHBondContact O-CA 3.43Å; Q113-L116 VanDerWaalsContact O-CB 3.3Å; Q113-L116 WeakPolarHBondContact O-CB 3.22Å; Q113-L116 PolarHBondContact O-N 3.4Å; Q113-L117 HydrophobicContact CB-CD1 4.3Å; Q113-L117 WeakPolarHBondContact O-CB 3.49Å; Q113-L117 VanDerWaalsContact O-CG 3.26Å; Q113-L117 WeakPolarHBondContact O-CG 3.31Å; Q113-L117 PolarHBondContact O-N 3.46Å; Q113-T165 PolarHBondContact NE2-O 3.18Å
114	Q	48.5	Very low	44.6	Very low	81 Å²	81	73.6 Å²	73.6	38%	0.379	43%	0.428	S	S	.	.	H	α-helix	trans	-68.4	-39.7	178	-79.8	175.5	-11.6	0	0	110.4	V110 D111 L116 L117 G118	V110-Q114 HydrophobicContact CG1-CG 4.02Å; V110-Q114 WeakPolarHBondContact O-CB 3.36Å; V110-Q114 WeakPolarHBondContact O-CG 3.15Å; V110-Q114 PolarHBondContact O-N 2.87Å; D111-Q114 PolarHBondContact O-N 3.12Å; Q114-L116 PolarHBondContact O-N 2.95Å; Q114-L117 PolarHBondContact O-N 2.95Å; Q114-G118 PolarHBondContact O-N 2.9Å
115	K	51.4	Low	44.7	Very low	106 Å²	106	71.1 Å²	71.1	46%	0.461	42%	0.417	S	S	.	.	H	α-helix	trans	-59.7	-30.7	167.9	-76.8	169.2	178.4	159.1	0	112.8	D111 T123	D111-K115 VanDerWaalsContact O-CB 3.3Å; D111-K115 WeakPolarHBondContact O-CB 3.34Å; D111-K115 VanDerWaalsContact O-CG 3.26Å; D111-K115 WeakPolarHBondContact O-CG 3.28Å; D111-K115 PolarHBondContact O-N 3.49Å; D111-K115 WeakPolarHBondContact OD1-CE 3.19Å; D111-K115 IonicContact OD1-NZ 2.73Å; D111-K115 PolarHBondContact OD1-NZ 3.23Å; D111-K115 WeakPolarHBondContact OD2-CE 3.38Å; D111-K115 IonicContact OD2-NZ 3.22Å; D111-K115 PolarHBondContact OD2-NZ 3.17Å; K115-T123 HydrophobicContact CG-CG2 4.43Å
116	L	45.3	Very low	44.9	Very low	11 Å²	11	75 Å²	75	6%	0.058	44%	0.439	C	S	.	.	H	α-helix	trans	-84.1	-34.4	179	-170	86.6	0	0	0	113.2	L84 G112 Q113 Q114 I162	L84-L116 HydrophobicContact CD1-CD1 3.84Å; L84-L116 HydrophobicContact CD2-CD1 4.18Å; L84-L116 HydrophobicContact CG-CD1 4.48Å; G112-L116 WeakPolarHBondContact O-CB 3.35Å; G112-L116 PolarHBondContact O-N 3.36Å; Q113-L116 CarbonylContact O-C 3.47Å; Q113-L116 WeakPolarHBondContact O-CA 3.43Å; Q113-L116 VanDerWaalsContact O-CB 3.3Å; Q113-L116 WeakPolarHBondContact O-CB 3.22Å; Q113-L116 PolarHBondContact O-N 3.4Å; Q114-L116 PolarHBondContact O-N 2.95Å; L116-I162 HydrophobicContact CD1-CG2 4.35Å; L116-I162 HydrophobicContact CD2-CG2 3.75Å
117	L	45.8	Very low	45.8	Very low	66 Å²	66	72.4 Å²	72.4	35%	0.346	43%	0.426	S	S	.	.	H	α-helix	trans	-113.5	3.7	-165.9	-62.5	172.6	0	0	0	114	Q113 Q114 S119 H166 P167	Q113-L117 HydrophobicContact CB-CD1 4.3Å; Q113-L117 WeakPolarHBondContact O-CB 3.49Å; Q113-L117 VanDerWaalsContact O-CG 3.26Å; Q113-L117 WeakPolarHBondContact O-CG 3.31Å; Q113-L117 PolarHBondContact O-N 3.46Å; Q114-L117 PolarHBondContact O-N 2.95Å; L117-S119 PolarHBondContact O-N 2.77Å; L117-H166 WeakPolarHBondContact CD2-NE2 3.06Å; L117-P167 HydrophobicContact CD1-CG 3.69Å
118	G	47.4	Very low	47.1	Very low	34 Å²	34	73.9 Å²	73.9	35%	0.351	43%	0.426	S	S	.	.			trans	64.6	15.6	167	0	0	0	0	0	115.5	Q114 T120	Q114-G118 PolarHBondContact O-N 2.9Å; G118-T120 PolarHBondContact O-N 2.95Å; G118-T120 VanDerWaalsContact O-N 3.07Å
119	S	42.7	Very low	48.1	Very low	62 Å²	62	68.1 Å²	68.1	43%	0.434	40%	0.401	S	S	.	.	S	Bend	trans	-83.2	92.6	175.8	70.4	0	0	0	0	109.9	L117	L117-S119 PolarHBondContact O-N 2.77Å
120	T	41.6	Very low	49.4	Very low	130 Å²	130	69 Å²	69	80%	0.798	41%	0.414	S	S	*	.	S	Bend	trans	100.1	-2.1	158.5	70.8	0	0	0	0	121.2	G118	G118-T120 PolarHBondContact O-N 2.95Å; G118-T120 VanDerWaalsContact O-N 3.07Å
121	V	36.9	Very low	50.9	Low	109 Å²	109	70.5 Å²	70.5	66%	0.661	42%	0.421	S	S	*	.	S	Bend	trans	-140.5	126.2	170.6	-167.5	0	0	0	0	110.6	T123	V121-T123 VanDerWaalsContact C-N 3.27Å; V121-T123 PolarHBondContact O-N 3.48Å
122	N	38.8	Very low	52.6	Low	174 Å²	174	67.2 Å²	67.2	93%	0.93	40%	0.403	S	S	*	.			trans	-52.8	69.8	-178.7	-80.3	-20	0	0	0	114.8
123	T	37.7	Very low	54.1	Low	71 Å²	71	65.6 Å²	65.6	44%	0.436	39%	0.386	S	S	.	.			trans	-94.6	6.4	173	52.3	0	0	0	0	113.9	K115 V121 C125	K115-T123 HydrophobicContact CG-CG2 4.43Å; V121-T123 VanDerWaalsContact C-N 3.27Å; V121-T123 PolarHBondContact O-N 3.48Å; T123-C125 VanDerWaalsContact C-N 3.28Å; T123-C125 PolarHBondContact O-N 2.84Å; T123-C125 VanDerWaalsContact O-N 3.13Å
124	G	37	Very low	55.8	Low	58 Å²	58	69.4 Å²	69.4	60%	0.598	40%	0.402	S	S	*	.	S	Bend	trans	61.5	26.9	162.1	0	0	0	0	0	115.9	V52	V52-G124 WeakPolarHBondContact CG2-O 3.39Å
125	C	38.6	Very low	57.6	Low	30 Å²	30	66.2 Å²	66.2	20%	0.203	39%	0.388	C	S	.	.			trans	-132.4	71.4	176	-98	0	0	0	0	110.4	T123 I127	T123-C125 VanDerWaalsContact C-N 3.28Å; T123-C125 PolarHBondContact O-N 2.84Å; T123-C125 VanDerWaalsContact O-N 3.13Å; C125-I127 HydrophobicContact CB-CD1 4.43Å; C125-I127 HydrophobicContact CB-CG1 4.28Å; C125-I127 PolarHBondContact O-N 2.67Å
126	D	48.6	Very low	59.3	Low	115 Å²	115	61.1 Å²	61.1	62%	0.615	37%	0.366	S	S	*	.			trans	-76.9	77.5	165.5	-75.5	-21.4	0	0	0	109.2	Q128	D126-Q128 PolarHBondContact O-N 3.23Å
127	I	60.3	Low	61.3	Low	27 Å²	27	60.9 Å²	60.9	14%	0.138	37%	0.366	C	S	.	.			trans	-81.6	101.6	179.2	-62.2	178.6	0	0	0	108.5	F55 L81 L84 C125 I129	F55-I127 HydrophobicContact CD1-CG2 4.28Å; F55-I127 HydrophobicContact CD2-CG2 4.34Å; F55-I127 HydrophobicContact CE1-CG2 3.64Å; F55-I127 HydrophobicContact CE2-CG2 3.73Å; F55-I127 HydrophobicContact CZ-CG2 3.35Å; L81-I127 HydrophobicContact CD2-CD1 4.4Å; L84-I127 HydrophobicContact CD1-CD1 3.98Å; C125-I127 HydrophobicContact CB-CD1 4.43Å; C125-I127 HydrophobicContact CB-CG1 4.28Å; C125-I127 PolarHBondContact O-N 2.67Å; I127-I129 VanDerWaalsContact C-N 3.32Å; I127-I129 HydrophobicContact CG2-CG1 4.11Å; I127-I129 PolarHBondContact O-N 3.29Å
128	Q	69.4	Low	63.2	Low	114 Å²	114	63.1 Å²	63.1	53%	0.533	37%	0.37	S	S	.	.			trans	-72.9	83.8	172.8	-65.5	-171.6	0.3	0	0	110.9	D126 G130 N131 L132	D126-Q128 PolarHBondContact O-N 3.23Å; Q128-G130 PolarHBondContact O-N 3.04Å; Q128-N131 HydrophobicContact CB-CB 4.36Å; Q128-N131 PolarHBondContact O-N 3.31Å; Q128-N131 VanDerWaalsContact O-N 3.16Å; Q128-N131 PolarHBondContact OE1-ND2 3.48Å; Q128-L132 PolarHBondContact O-N 3.38Å
129	I	73.6	Confident	65.1	Low	15 Å²	15	61.8 Å²	61.8	8%	0.077	35%	0.354	C	S	.	.	H	α-helix	trans	-55.7	-35.1	-180	-63.6	172.5	0	0	0	111.7	I127 N131 L132 I133 I159 I162	I127-I129 VanDerWaalsContact C-N 3.32Å; I127-I129 HydrophobicContact CG2-CG1 4.11Å; I127-I129 PolarHBondContact O-N 3.29Å; I129-N131 PolarHBondContact O-N 2.82Å; I129-L132 WeakPolarHBondContact O-CB 3.33Å; I129-L132 PolarHBondContact O-N 3.47Å; I129-I133 HydrophobicContact CG2-CD1 3.73Å; I129-I133 HydrophobicContact CG2-CG1 4.16Å; I129-I133 WeakPolarHBondContact O-CG1 3.22Å; I129-I133 PolarHBondContact O-N 2.78Å; I129-I159 HydrophobicContact CG2-CG2 4.25Å; I129-I162 HydrophobicContact CD1-CG2 3.6Å
130	G	74.6	Confident	67.2	Low	39 Å²	39	58.8 Å²	58.8	40%	0.402	33%	0.333	S	S	.	.	H	α-helix	trans	-57.1	-47.4	177	0	0	0	0	0	113	Q128 L132 I133 F134	Q128-G130 PolarHBondContact O-N 3.04Å; G130-L132 VanDerWaalsContact C-N 3.29Å; G130-L132 PolarHBondContact O-N 2.73Å; G130-I133 PolarHBondContact O-N 3.32Å; G130-F134 WeakPolarHBondContact O-CB 3.39Å; G130-F134 PolarHBondContact O-N 3.08Å
131	N	79.6	Confident	69.3	Low	84 Å²	84	59.7 Å²	59.7	45%	0.449	32%	0.322	S	S	.	.	H	α-helix	trans	-62.5	-38.4	177.9	-68.5	0.4	0	0	0	111.8	Q128 I129 V135	Q128-N131 HydrophobicContact CB-CB 4.36Å; Q128-N131 PolarHBondContact O-N 3.31Å; Q128-N131 VanDerWaalsContact O-N 3.16Å; Q128-N131 PolarHBondContact OE1-ND2 3.48Å; I129-N131 PolarHBondContact O-N 2.82Å; N131-V135 WeakPolarHBondContact O-CB 3.11Å; N131-V135 VanDerWaalsContact O-CG2 3.32Å; N131-V135 WeakPolarHBondContact O-CG2 3.43Å; N131-V135 PolarHBondContact O-N 3.45Å
132	L	85.1	Confident	71.5	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-62.4	-47.1	176.2	176.3	63.7	0	0	0	111.3	F55 I59 L77 L81 Q128 I129 G130 V135 L136 L155 I159	F55-L132 HydrophobicContact CE2-CD2 4.05Å; F55-L132 HydrophobicContact CZ-CB 3.98Å; F55-L132 HydrophobicContact CZ-CD2 3.91Å; F55-L132 HydrophobicContact CZ-CG 4.38Å; I59-L132 HydrophobicContact CD1-CB 4.05Å; I59-L132 HydrophobicContact CD1-CD1 4.38Å; I59-L132 HydrophobicContact CG1-CD1 4.06Å; L77-L132 HydrophobicContact CD1-CD1 3.82Å; L77-L132 HydrophobicContact CD2-CD1 4.12Å; L81-L132 HydrophobicContact CD1-CD2 3.8Å; Q128-L132 PolarHBondContact O-N 3.38Å; I129-L132 WeakPolarHBondContact O-CB 3.33Å; I129-L132 PolarHBondContact O-N 3.47Å; G130-L132 VanDerWaalsContact C-N 3.29Å; G130-L132 PolarHBondContact O-N 2.73Å; L132-V135 PolarHBondContact O-N 3.33Å; L132-L136 WeakPolarHBondContact O-CB 3.27Å; L132-L136 PolarHBondContact O-N 3.47Å; L132-L155 HydrophobicContact CD1-CD2 4.33Å; L132-L155 HydrophobicContact CD2-CD1 4.32Å; L132-I159 HydrophobicContact CD2-CD1 3.87Å; L132-I159 HydrophobicContact CD2-CG1 4.13Å; L132-I159 HydrophobicContact CG-CD1 4.15Å
133	I	85.4	Confident	73.7	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-64.8	-44.1	179.9	-60.8	165.8	0	0	0	110.3	I129 G130 V135 L136 G137 I159 I172 E175 L176 V179	I129-I133 HydrophobicContact CG2-CD1 3.73Å; I129-I133 HydrophobicContact CG2-CG1 4.16Å; I129-I133 WeakPolarHBondContact O-CG1 3.22Å; I129-I133 PolarHBondContact O-N 2.78Å; G130-I133 PolarHBondContact O-N 3.32Å; I133-V135 PolarHBondContact O-N 3.31Å; I133-L136 WeakPolarHBondContact O-CB 3.49Å; I133-L136 PolarHBondContact O-N 3.18Å; I133-G137 PolarHBondContact O-N 3.21Å; I133-I159 HydrophobicContact CD1-CG2 3.86Å; I133-I159 HydrophobicContact CG1-CD1 4.26Å; I133-I159 HydrophobicContact CG1-CG2 3.92Å; I133-I172 HydrophobicContact CD1-CG1 4.47Å; I133-I172 HydrophobicContact CD1-CG2 3.81Å; I133-E175 HydrophobicContact CB-CB 4.22Å; I133-E175 HydrophobicContact CD1-CB 4.4Å; I133-E175 HydrophobicContact CG2-CB 3.56Å; I133-L176 HydrophobicContact CD1-CD2 4.33Å; I133-L176 HydrophobicContact CD1-CG 4.42Å; I133-L176 HydrophobicContact CG1-CD2 4.31Å; I133-L176 HydrophobicContact CG2-CD2 4.04Å; I133-L176 HydrophobicContact CG2-CG 4.49Å; I133-V179 HydrophobicContact CG2-CG2 3.7Å
134	F	84.4	Confident	75.9	Confident	130 Å²	130	54.7 Å²	54.7	57%	0.57	28%	0.279	S	S	*	.	H	α-helix	trans	-59.3	-48.7	177.7	179.5	-98.2	0	0	0	112.2	G130 L136 G137 R138	G130-F134 WeakPolarHBondContact O-CB 3.39Å; G130-F134 PolarHBondContact O-N 3.08Å; F134-L136 VanDerWaalsContact C-N 3.33Å; F134-L136 PolarHBondContact O-N 2.86Å; F134-G137 PolarHBondContact O-N 2.95Å; F134-R138 PolarHBondContact O-N 2.98Å
135	V	84.9	Confident	78.1	Confident	13 Å²	13	54.2 Å²	54.2	8%	0.079	26%	0.263	C	S	.	.	H	α-helix	trans	-66.4	-36.5	177.2	172.3	0	0	0	0	111.3	I59 L62 N131 L132 I133 G137 R138 F139	I59-V135 HydrophobicContact CG2-CB 4.08Å; I59-V135 HydrophobicContact CG2-CG1 4.18Å; I59-V135 HydrophobicContact CG2-CG2 3.72Å; L62-V135 HydrophobicContact CB-CG1 3.86Å; L62-V135 HydrophobicContact CD1-CG1 4.09Å; N131-V135 WeakPolarHBondContact O-CB 3.11Å; N131-V135 VanDerWaalsContact O-CG2 3.32Å; N131-V135 WeakPolarHBondContact O-CG2 3.43Å; N131-V135 PolarHBondContact O-N 3.45Å; L132-V135 PolarHBondContact O-N 3.33Å; I133-V135 PolarHBondContact O-N 3.31Å; V135-G137 VanDerWaalsContact C-N 3.33Å; V135-G137 PolarHBondContact O-N 3.12Å; V135-R138 PolarHBondContact O-N 3.2Å; V135-F139 VanDerWaalsContact O-CB 3.29Å; V135-F139 WeakPolarHBondContact O-CB 3.27Å; V135-F139 PolarHBondContact O-N 2.86Å
136	L	88.2	Confident	80.3	Confident	0 Å²	0	56 Å²	56	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-61.4	-42.2	173.3	-174.4	63	0	0	0	111.4	L132 I133 F134 F139 C140 I152 L155 F156 I159 V179	L132-L136 WeakPolarHBondContact O-CB 3.27Å; L132-L136 PolarHBondContact O-N 3.47Å; I133-L136 WeakPolarHBondContact O-CB 3.49Å; I133-L136 PolarHBondContact O-N 3.18Å; F134-L136 VanDerWaalsContact C-N 3.33Å; F134-L136 PolarHBondContact O-N 2.86Å; L136-F139 HydrophobicContact CD1-CD1 4.44Å; L136-F139 WeakPolarHBondContact O-CB 3Å; L136-F139 PolarHBondContact O-N 2.78Å; L136-C140 WeakPolarHBondContact O-CB 3.12Å; L136-C140 PolarHBondContact O-N 3.35Å; L136-C140 PolarHBondContact O-SG 3.28Å; L136-I152 HydrophobicContact CD1-CG2 4.22Å; L136-L155 HydrophobicContact CD1-CD2 4.13Å; L136-L155 HydrophobicContact CD2-CD2 4.43Å; L136-F156 HydrophobicContact CD2-CD2 4.27Å; L136-I159 HydrophobicContact CD2-CD1 4.08Å; L136-V179 HydrophobicContact CG-CG1 4.4Å
137	G	86.4	Confident	82	Confident	5 Å²	5	59.7 Å²	59.7	5%	0.052	28%	0.279	C	S	.	.	H	α-helix	trans	-60.5	-47.2	174.9	0	0	0	0	0	112.6	I133 F134 V135 F139 C140 R141	I133-G137 PolarHBondContact O-N 3.21Å; F134-G137 PolarHBondContact O-N 2.95Å; V135-G137 VanDerWaalsContact C-N 3.33Å; V135-G137 PolarHBondContact O-N 3.12Å; G137-F139 VanDerWaalsContact C-N 3.33Å; G137-F139 PolarHBondContact O-N 3Å; G137-C140 PolarHBondContact O-N 2.99Å; G137-R141 PolarHBondContact O-N 3.23Å
138	R	86	Confident	83.3	Confident	114 Å²	114	58.7 Å²	58.7	43%	0.43	27%	0.274	S	S	.	.	H	α-helix	trans	-61.8	-40.6	175.1	-175.1	179.3	176.2	133.6	-6.3	112.2	F134 V135 R141	F134-R138 PolarHBondContact O-N 2.98Å; V135-R138 PolarHBondContact O-N 3.2Å; R138-R141 PolarHBondContact O-N 3.26Å
139	F	87	Confident	84.2	Confident	5 Å²	5	54.3 Å²	54.3	2%	0.022	26%	0.256	C	S	.	.	H	α-helix	trans	-63.2	-49.9	176.2	178	-108.7	0	0	0	111.1	R70 L74 V135 L136 G137 R141 R142 V143 F148 I152	R70-F139 HydrophobicContact CB-CE2 4.2Å; R70-F139 HydrophobicContact CG-CE2 3.95Å; L74-F139 HydrophobicContact CD1-CE1 3.91Å; L74-F139 HydrophobicContact CD1-CZ 4.12Å; V135-F139 VanDerWaalsContact O-CB 3.29Å; V135-F139 WeakPolarHBondContact O-CB 3.27Å; V135-F139 PolarHBondContact O-N 2.86Å; L136-F139 HydrophobicContact CD1-CD1 4.44Å; L136-F139 WeakPolarHBondContact O-CB 3Å; L136-F139 PolarHBondContact O-N 2.78Å; G137-F139 VanDerWaalsContact C-N 3.33Å; G137-F139 PolarHBondContact O-N 3Å; F139-R141 PolarHBondContact O-N 2.96Å; F139-R142 PolarHBondContact O-N 3.33Å; F139-V143 HydrophobicContact CD1-CG1 4.44Å; F139-V143 HydrophobicContact CD2-CB 4.46Å; F139-V143 HydrophobicContact CE1-CB 4.18Å; F139-V143 HydrophobicContact CE1-CG1 4.26Å; F139-V143 HydrophobicContact CE1-CG2 4.13Å; F139-V143 HydrophobicContact CE2-CB 4.06Å; F139-V143 HydrophobicContact CE2-CG2 4.1Å; F139-V143 HydrophobicContact CZ-CB 3.92Å; F139-V143 HydrophobicContact CZ-CG1 4.5Å; F139-V143 HydrophobicContact CZ-CG2 3.64Å; F139-V143 WeakPolarHBondContact O-CB 3.47Å; F139-V143 VanDerWaalsContact O-CG1 3.3Å; F139-V143 WeakPolarHBondContact O-CG1 3.22Å; F139-V143 PolarHBondContact O-N 3.31Å; F139-F148 HydrophobicContact CE1-CB 4.45Å; F139-F148 HydrophobicContact CZ-CB 4.44Å; F139-F148 HydrophobicContact CZ-CD1 4.14Å; F139-F148 HydrophobicContact CZ-CD2 4.31Å; F139-F148 HydrophobicContact CZ-CE1 4.43Å; F139-F148 HydrophobicContact CZ-CG 4.06Å; F139-I152 HydrophobicContact CD1-CD1 4.2Å; F139-I152 HydrophobicContact CD1-CG1 4.34Å; F139-I152 HydrophobicContact CE1-CD1 3.72Å; F139-I152 HydrophobicContact CE1-CG1 3.9Å
140	C	87.6	Confident	84.9	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-58.5	-31.3	177.6	-76.4	0	0	0	0	113.4	L136 G137 R142 V179 L183 R186	L136-C140 WeakPolarHBondContact O-CB 3.12Å; L136-C140 PolarHBondContact O-N 3.35Å; L136-C140 PolarHBondContact O-SG 3.28Å; G137-C140 PolarHBondContact O-N 2.99Å; C140-R142 VanDerWaalsContact C-N 3.32Å; C140-R142 PolarHBondContact O-N 3.48Å; C140-V179 HydrophobicContact CB-CG1 4.34Å; C140-L183 HydrophobicContact CB-CD1 4.29Å; C140-L183 HydrophobicContact CB-CD2 3.79Å; C140-L183 HydrophobicContact CB-CG 3.9Å; C140-R186 PolarHBondContact O-NH1 3.06Å; C140-R186 VanDerWaalsContact O-NH1 3.16Å
141	R	85	Confident	85.5	Confident	148 Å²	148	58.7 Å²	58.7	56%	0.558	27%	0.265	S	S	*	.	H	α-helix	trans	-69.9	-24.4	175.3	-169.4	173	179.4	168.8	1.7	113.8	G137 R138 F139 N182	G137-R141 PolarHBondContact O-N 3.23Å; R138-R141 PolarHBondContact O-N 3.26Å; F139-R141 PolarHBondContact O-N 2.96Å; R141-N182 HydrophobicContact CB-CB 4.43Å
142	R	84.1	Confident	86.1	Confident	135 Å²	135	54.7 Å²	54.7	51%	0.509	24%	0.244	S	C	.	.	H	α-helix	trans	-118.5	-12.2	-169.8	-64	-178.4	179.2	-164.6	-5	115.2	F139 C140 D144	F139-R142 PolarHBondContact O-N 3.33Å; C140-R142 VanDerWaalsContact C-N 3.32Å; C140-R142 PolarHBondContact O-N 3.48Å; R142-D144 PolarHBondContact O-N 3.22Å
143	V	84	Confident	86.4	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.006	25%	0.25	C	C	.	.			trans	-79	118.8	-172.5	58.3	0	0	0	0	111.4	F139 F148 I152 R186 W191	F139-V143 HydrophobicContact CD1-CG1 4.44Å; F139-V143 HydrophobicContact CD2-CB 4.46Å; F139-V143 HydrophobicContact CE1-CB 4.18Å; F139-V143 HydrophobicContact CE1-CG1 4.26Å; F139-V143 HydrophobicContact CE1-CG2 4.13Å; F139-V143 HydrophobicContact CE2-CB 4.06Å; F139-V143 HydrophobicContact CE2-CG2 4.1Å; F139-V143 HydrophobicContact CZ-CB 3.92Å; F139-V143 HydrophobicContact CZ-CG1 4.5Å; F139-V143 HydrophobicContact CZ-CG2 3.64Å; F139-V143 WeakPolarHBondContact O-CB 3.47Å; F139-V143 VanDerWaalsContact O-CG1 3.3Å; F139-V143 WeakPolarHBondContact O-CG1 3.22Å; F139-V143 PolarHBondContact O-N 3.31Å; V143-F148 HydrophobicContact CG2-CB 4.11Å; V143-F148 HydrophobicContact CG2-CD2 3.31Å; V143-F148 HydrophobicContact CG2-CE2 3.98Å; V143-F148 HydrophobicContact CG2-CG 3.95Å; V143-I152 HydrophobicContact CG1-CD1 4.41Å; V143-R186 PolarHBondContact O-NH1 3.47Å; V143-R186 PolarHBondContact O-NH2 2.92Å; V143-W191 HydrophobicContact CB-CH2 4.32Å; V143-W191 HydrophobicContact CB-CZ2 4.38Å; V143-W191 HydrophobicContact CG1-CE3 4.48Å; V143-W191 HydrophobicContact CG1-CH2 3.48Å; V143-W191 VanDerWaalsContact CG1-CH2 3.48Å; V143-W191 HydrophobicContact CG1-CZ2 3.79Å; V143-W191 HydrophobicContact CG1-CZ3 3.85Å; V143-W191 HydrophobicContact CG2-CH2 3.97Å; V143-W191 HydrophobicContact CG2-CZ2 4.08Å; V143-W191 WeakPolarHBondContact O-CZ2 3.5Å; V143-W191 PolarHBondContact O-NE1 3.21Å
144	D	83.4	Confident	86.6	Confident	114 Å²	114	59.3 Å²	59.3	61%	0.61	27%	0.267	S	S	*	.			trans	-95	-22.5	-177.6	-60.4	-33.9	0	0	0	113.7	R142 P146 R186	R142-D144 PolarHBondContact O-N 3.22Å; D144-P146 VanDerWaalsContact O-CD 3.29Å; D144-P146 WeakPolarHBondContact O-CD 3.49Å; D144-R186 IonicContact OD1-NH2 3.54Å; D144-R186 PolarHBondContact OD1-NH2 2.85Å
145	D	84.6	Confident	86.9	Confident	47 Å²	47	53.1 Å²	53.1	25%	0.251	24%	0.24	S	C	.	.			trans	-80.5	114	-177.7	-174.7	-6.3	0	0	0	111.9	R147 F148 W191	D145-R147 PolarHBondContact O-N 2.82Å; D145-R147 VanDerWaalsContact O-N 3.09Å; D145-R147 VanDerWaalsContact OD1-CB 3.25Å; D145-R147 WeakPolarHBondContact OD1-CB 3.49Å; D145-R147 WeakPolarHBondContact OD1-CG 3.46Å; D145-R147 PolarHBondContact OD1-N 3.41Å; D145-R147 WeakPolarHBondContact OD2-CD 3.44Å; D145-F148 HydrophobicContact CB-CD2 3.81Å; D145-F148 HydrophobicContact CB-CE2 3.83Å; D145-F148 VanDerWaalsContact O-CD2 3.32Å; D145-F148 WeakPolarHBondContact O-CD2 3.48Å; D145-F148 PolarHBondContact O-N 3.14Å; D145-W191 WeakPolarHBondContact O-CH2 3.41Å; D145-W191 VanDerWaalsContact O-CZ2 3.28Å; D145-W191 WeakPolarHBondContact O-CZ2 3.23Å
146	P	84	Confident	87.3	Confident	67 Å²	67	52.5 Å²	52.5	44%	0.435	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-66.3	-12.2	-179.4	29.1	-36.9	0	0	0	113.6	D144 F148 C149 V190	D144-P146 VanDerWaalsContact O-CD 3.29Å; D144-P146 WeakPolarHBondContact O-CD 3.49Å; P146-F148 PolarHBondContact O-N 3.17Å; P146-C149 VanDerWaalsContact O-CB 3.29Å; P146-C149 WeakPolarHBondContact O-CB 3.46Å; P146-C149 PolarHBondContact O-N 2.9Å; P146-C149 VanDerWaalsContact O-N 3.08Å; P146-C149 PolarHBondContact O-SG 3.13Å; P146-V190 HydrophobicContact CB-CG1 3.86Å
147	R	85	Confident	87.3	Confident	194 Å²	194	53.7 Å²	53.7	73%	0.732	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-58	-30.2	175.4	-68.7	172.6	-174.2	177.9	2.5	112.3	D145 C149 E151	D145-R147 PolarHBondContact O-N 2.82Å; D145-R147 VanDerWaalsContact O-N 3.09Å; D145-R147 VanDerWaalsContact OD1-CB 3.25Å; D145-R147 WeakPolarHBondContact OD1-CB 3.49Å; D145-R147 WeakPolarHBondContact OD1-CG 3.46Å; D145-R147 PolarHBondContact OD1-N 3.41Å; D145-R147 WeakPolarHBondContact OD2-CD 3.44Å; R147-C149 PolarHBondContact O-N 3.09Å; R147-E151 VanDerWaalsContact O-OE2 3.09Å
148	F	87.1	Confident	87.3	Confident	6 Å²	6	54.5 Å²	54.5	3%	0.026	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-69.3	-16.2	178.3	-67.7	-69.1	0	0	0	114.3	S67 R70 Q71 L74 F139 V143 D145 P146 H150 E151 I152 W191	S67-F148 WeakPolarHBondContact OG-CZ 3.36Å; R70-F148 HydrophobicContact CB-CE1 4.08Å; R70-F148 HydrophobicContact CB-CZ 4.06Å; Q71-F148 HydrophobicContact CB-CE1 3.72Å; Q71-F148 HydrophobicContact CB-CZ 4.44Å; Q71-F148 HydrophobicContact CG-CE1 4.09Å; L74-F148 HydrophobicContact CD1-CB 4.49Å; L74-F148 HydrophobicContact CD1-CD1 3.55Å; L74-F148 HydrophobicContact CD1-CE1 4.18Å; L74-F148 HydrophobicContact CD1-CG 4.4Å; F139-F148 HydrophobicContact CE1-CB 4.45Å; F139-F148 HydrophobicContact CZ-CB 4.44Å; F139-F148 HydrophobicContact CZ-CD1 4.14Å; F139-F148 HydrophobicContact CZ-CD2 4.31Å; F139-F148 HydrophobicContact CZ-CE1 4.43Å; F139-F148 HydrophobicContact CZ-CG 4.06Å; V143-F148 HydrophobicContact CG2-CB 4.11Å; V143-F148 HydrophobicContact CG2-CD2 3.31Å; V143-F148 HydrophobicContact CG2-CE2 3.98Å; V143-F148 HydrophobicContact CG2-CG 3.95Å; D145-F148 HydrophobicContact CB-CD2 3.81Å; D145-F148 HydrophobicContact CB-CE2 3.83Å; D145-F148 VanDerWaalsContact O-CD2 3.32Å; D145-F148 WeakPolarHBondContact O-CD2 3.48Å; D145-F148 PolarHBondContact O-N 3.14Å; P146-F148 PolarHBondContact O-N 3.17Å; F148-H150 PolarHBondContact O-N 3.28Å; F148-H150 VanDerWaalsContact O-N 3.13Å; F148-E151 PolarHBondContact O-N 2.97Å; F148-I152 HydrophobicContact CB-CD1 3.84Å; F148-I152 HydrophobicContact CB-CG1 4.32Å; F148-I152 WeakPolarHBondContact O-CB 3.36Å; F148-I152 WeakPolarHBondContact O-CD1 3.42Å; F148-I152 WeakPolarHBondContact O-CG1 3.3Å; F148-I152 PolarHBondContact O-N 2.91Å; F148-W191 HydrophobicContact CB-CH2 4.46Å
149	C	88.2	Confident	87.4	Confident	22 Å²	22	49.1 Å²	49.1	15%	0.149	23%	0.225	C	C	.	.	H	α-helix	trans	-54.1	-37.6	-177.1	-70.6	0	0	0	0	112.4	P146 R147 C153 W191 F194	P146-C149 VanDerWaalsContact O-CB 3.29Å; P146-C149 WeakPolarHBondContact O-CB 3.46Å; P146-C149 PolarHBondContact O-N 2.9Å; P146-C149 VanDerWaalsContact O-N 3.08Å; P146-C149 PolarHBondContact O-SG 3.13Å; R147-C149 PolarHBondContact O-N 3.09Å; C149-C153 WeakPolarHBondContact O-CB 3.21Å; C149-C153 PolarHBondContact O-N 3.46Å; C149-W191 VanDerWaalsContact SG-CZ3 3.54Å; C149-F194 HydrophobicContact CB-CD2 3.92Å; C149-F194 HydrophobicContact CB-CE1 4.49Å; C149-F194 HydrophobicContact CB-CE2 3.79Å; C149-F194 HydrophobicContact CB-CG 4.34Å; C149-F194 HydrophobicContact CB-CZ 4.1Å; C149-F194 WeakPolarHBondContact O-CE2 3.1Å; C149-F194 WeakPolarHBondContact O-CZ 3.12Å
150	H	87.4	Confident	87.4	Confident	122 Å²	122	49 Å²	49	57%	0.565	23%	0.225	S	C	*	.	H	α-helix	trans	-69.2	-51.4	-178.1	-174.6	67.1	0	0	0	111.9	F148 I152 C153 Q154	F148-H150 PolarHBondContact O-N 3.28Å; F148-H150 VanDerWaalsContact O-N 3.13Å; H150-I152 PolarHBondContact O-N 3.14Å; H150-C153 PolarHBondContact O-N 3.43Å; H150-Q154 PolarHBondContact NE2-NE2 3.49Å; H150-Q154 WeakPolarHBondContact O-CG 3.31Å; H150-Q154 PolarHBondContact O-N 2.99Å
151	E	88.6	Confident	87.1	Confident	24 Å²	24	51.4 Å²	51.4	11%	0.112	24%	0.236	C	C	.	.	H	α-helix	trans	-65.8	-36.6	179.4	-67.1	92	150.5	0	0	112.5	Q71 L74 N78 R147 F148 L155	Q71-E151 PolarHBondContact NE2-OE1 2.8Å; L74-E151 HydrophobicContact CB-CB 4.04Å; L74-E151 HydrophobicContact CD1-CB 4.12Å; N78-E151 PolarHBondContact ND2-O 3.19Å; R147-E151 VanDerWaalsContact O-OE2 3.09Å; F148-E151 PolarHBondContact O-N 2.97Å; E151-L155 WeakPolarHBondContact O-CB 3.19Å; E151-L155 PolarHBondContact O-N 3.11Å; E151-L155 VanDerWaalsContact O-N 3.08Å
152	I	91.4	Very high	86.7	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-62.1	-47.7	172.5	-66.2	164.2	0	0	0	109.9	L74 L136 F139 V143 F148 H150 Q154 L155 F156 W191 F194 L198	L74-I152 HydrophobicContact CD1-CG1 4.32Å; L136-I152 HydrophobicContact CD1-CG2 4.22Å; F139-I152 HydrophobicContact CD1-CD1 4.2Å; F139-I152 HydrophobicContact CD1-CG1 4.34Å; F139-I152 HydrophobicContact CE1-CD1 3.72Å; F139-I152 HydrophobicContact CE1-CG1 3.9Å; V143-I152 HydrophobicContact CG1-CD1 4.41Å; F148-I152 HydrophobicContact CB-CD1 3.84Å; F148-I152 HydrophobicContact CB-CG1 4.32Å; F148-I152 WeakPolarHBondContact O-CB 3.36Å; F148-I152 WeakPolarHBondContact O-CD1 3.42Å; F148-I152 WeakPolarHBondContact O-CG1 3.3Å; F148-I152 PolarHBondContact O-N 2.91Å; H150-I152 PolarHBondContact O-N 3.14Å; I152-Q154 PolarHBondContact O-N 3.35Å; I152-L155 PolarHBondContact O-N 2.85Å; I152-F156 VanDerWaalsContact O-CB 3.31Å; I152-F156 WeakPolarHBondContact O-CB 3.33Å; I152-F156 PolarHBondContact O-N 2.67Å; I152-W191 HydrophobicContact CD1-CH2 4.3Å; I152-W191 HydrophobicContact CD1-CZ3 4.02Å; I152-F194 HydrophobicContact CB-CE1 4.09Å; I152-F194 HydrophobicContact CB-CZ 3.98Å; I152-F194 HydrophobicContact CD1-CE1 4.39Å; I152-F194 HydrophobicContact CG2-CE1 3.69Å; I152-F194 HydrophobicContact CG2-CZ 3.84Å; I152-L198 HydrophobicContact CG2-CD1 4.33Å
153	C	91.6	Very high	86.5	Confident	20 Å²	20	38.1 Å²	38.1	14%	0.135	19%	0.186	C	C	.	.	H	α-helix	trans	-60.6	-45.9	-179.8	-176.9	0	0	0	0	111.5	C149 H150 L155 F156 V157 F194 L198	C149-C153 WeakPolarHBondContact O-CB 3.21Å; C149-C153 PolarHBondContact O-N 3.46Å; H150-C153 PolarHBondContact O-N 3.43Å; C153-L155 VanDerWaalsContact C-N 3.3Å; C153-L155 PolarHBondContact O-N 3.35Å; C153-F156 PolarHBondContact O-N 3.31Å; C153-V157 WeakPolarHBondContact O-CB 3.46Å; C153-V157 VanDerWaalsContact O-CG2 3.24Å; C153-V157 WeakPolarHBondContact O-CG2 3.26Å; C153-V157 PolarHBondContact O-N 2.52Å; C153-F194 HydrophobicContact CB-CE2 3.9Å; C153-F194 HydrophobicContact CB-CZ 3.99Å; C153-L198 HydrophobicContact CB-CD2 4.35Å
154	Q	90.8	Very high	85.7	Confident	78 Å²	78	40.5 Å²	40.5	36%	0.364	20%	0.196	S	C	.	.	H	α-helix	trans	-58.4	-43.3	176.1	-70.6	-173.1	0.8	0	0	112.2	N78 H150 I152 K158	N78-Q154 WeakPolarHBondContact OD1-CB 3.48Å; H150-Q154 PolarHBondContact NE2-NE2 3.49Å; H150-Q154 WeakPolarHBondContact O-CG 3.31Å; H150-Q154 PolarHBondContact O-N 2.99Å; I152-Q154 PolarHBondContact O-N 3.35Å; Q154-K158 VanDerWaalsContact O-CG 3.28Å; Q154-K158 WeakPolarHBondContact O-CG 3.2Å; Q154-K158 PolarHBondContact O-N 2.88Å; Q154-K158 VanDerWaalsContact O-N 3.08Å
155	L	90.8	Very high	84.7	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-65.6	-48.1	179	-178.2	61.6	0	0	0	110.9	L74 L77 N78 L81 L132 L136 E151 I152 C153 V157 K158 I159	L74-L155 HydrophobicContact CD2-CD2 3.88Å; L77-L155 HydrophobicContact CB-CD1 4.05Å; L77-L155 HydrophobicContact CB-CD2 4.49Å; L77-L155 HydrophobicContact CD1-CD2 4.37Å; N78-L155 WeakPolarHBondContact OD1-CA 3.43Å; N78-L155 PolarHBondContact OD1-N 3.31Å; L81-L155 HydrophobicContact CD1-CD1 3.73Å; L132-L155 HydrophobicContact CD1-CD2 4.33Å; L132-L155 HydrophobicContact CD2-CD1 4.32Å; L136-L155 HydrophobicContact CD1-CD2 4.13Å; L136-L155 HydrophobicContact CD2-CD2 4.43Å; E151-L155 WeakPolarHBondContact O-CB 3.19Å; E151-L155 PolarHBondContact O-N 3.11Å; E151-L155 VanDerWaalsContact O-N 3.08Å; I152-L155 PolarHBondContact O-N 2.85Å; C153-L155 VanDerWaalsContact C-N 3.3Å; C153-L155 PolarHBondContact O-N 3.35Å; L155-V157 PolarHBondContact O-N 2.93Å; L155-K158 WeakPolarHBondContact O-CB 3.28Å; L155-K158 PolarHBondContact O-N 3.49Å; L155-K158 VanDerWaalsContact O-N 3.16Å; L155-I159 HydrophobicContact CG-CD1 4.14Å; L155-I159 WeakPolarHBondContact O-CG1 3.34Å; L155-I159 PolarHBondContact O-N 3.37Å
156	F	92.4	Very high	83.8	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-57.8	-47	178.5	-167.1	-84.5	0	0	0	111.5	L136 I152 C153 K158 I159 V160 L176 V179 V180 L198 T202	L136-F156 HydrophobicContact CD2-CD2 4.27Å; I152-F156 VanDerWaalsContact O-CB 3.31Å; I152-F156 WeakPolarHBondContact O-CB 3.33Å; I152-F156 PolarHBondContact O-N 2.67Å; C153-F156 PolarHBondContact O-N 3.31Å; F156-K158 VanDerWaalsContact C-N 3.33Å; F156-K158 PolarHBondContact O-N 3.22Å; F156-I159 WeakPolarHBondContact O-CB 3.24Å; F156-I159 PolarHBondContact O-N 2.73Å; F156-V160 HydrophobicContact CD1-CG2 3.93Å; F156-V160 HydrophobicContact CE1-CG2 3.77Å; F156-V160 WeakPolarHBondContact O-CG2 3.36Å; F156-V160 PolarHBondContact O-N 3.4Å; F156-L176 HydrophobicContact CD2-CD2 4.06Å; F156-L176 HydrophobicContact CE1-CD2 4.48Å; F156-L176 HydrophobicContact CE2-CB 4.42Å; F156-L176 HydrophobicContact CE2-CD2 3.53Å; F156-L176 HydrophobicContact CZ-CB 4.13Å; F156-L176 HydrophobicContact CZ-CD2 3.77Å; F156-L176 HydrophobicContact CZ-CG 4.39Å; F156-V179 HydrophobicContact CD2-CG1 4.39Å; F156-V179 HydrophobicContact CE2-CB 4.24Å; F156-V179 HydrophobicContact CE2-CG1 4.1Å; F156-V180 HydrophobicContact CE2-CG2 4.24Å; F156-V180 HydrophobicContact CZ-CG2 3.85Å; F156-L198 HydrophobicContact CB-CD2 4.14Å; F156-L198 HydrophobicContact CD1-CB 4.39Å; F156-L198 HydrophobicContact CD1-CD2 3.97Å; F156-L198 HydrophobicContact CD2-CD1 3.92Å; F156-L198 HydrophobicContact CE1-CB 4.16Å; F156-L198 HydrophobicContact CE2-CB 4.48Å; F156-L198 HydrophobicContact CE2-CD1 4.24Å; F156-L198 HydrophobicContact CG-CD1 4.11Å; F156-L198 HydrophobicContact CG-CD2 4Å; F156-L198 HydrophobicContact CG-CG 4.49Å; F156-L198 HydrophobicContact CZ-CB 4.2Å; F156-T202 WeakPolarHBondContact CZ-OG1 3.3Å
157	V	88.6	Confident	82.6	Confident	26 Å²	26	34 Å²	34	16%	0.158	16%	0.159	C	C	.	.	H	α-helix	trans	-62.3	-39.2	177.5	169.2	0	0	0	0	111.4	C153 L155 V160 H161 Y201	C153-V157 WeakPolarHBondContact O-CB 3.46Å; C153-V157 VanDerWaalsContact O-CG2 3.24Å; C153-V157 WeakPolarHBondContact O-CG2 3.26Å; C153-V157 PolarHBondContact O-N 2.52Å; L155-V157 PolarHBondContact O-N 2.93Å; V157-V160 PolarHBondContact O-N 3.27Å; V157-H161 WeakPolarHBondContact CG1-CE1 3.31Å; V157-H161 VanDerWaalsContact O-CG 3.28Å; V157-H161 PolarHBondContact O-N 3.33Å; V157-H161 PolarHBondContact O-ND1 2.86Å; V157-Y201 HydrophobicContact CG2-CD1 4.02Å; V157-Y201 HydrophobicContact CG2-CD2 4.3Å; V157-Y201 HydrophobicContact CG2-CE1 3.65Å; V157-Y201 HydrophobicContact CG2-CE2 3.94Å; V157-Y201 HydrophobicContact CG2-CG 4.33Å
158	K	86.8	Confident	81.7	Confident	21 Å²	21	29.5 Å²	29.5	9%	0.091	15%	0.145	C	C	.	.	H	α-helix	trans	-64.9	-41.5	174.1	-72.5	169.5	-174.5	161.4	0	112.2	N78 L81 D82 A85 Q154 L155 F156 H161 I162	N78-K158 PolarHBondContact O-NZ 3.05Å; N78-K158 PolarHBondContact OD1-NZ 2.84Å; L81-K158 HydrophobicContact CB-CB 4.36Å; L81-K158 HydrophobicContact CB-CD 4.22Å; D82-K158 WeakPolarHBondContact OD1-CE 3.45Å; D82-K158 IonicContact OD1-NZ 2.64Å; A85-K158 HydrophobicContact CB-CB 4.04Å; A85-K158 HydrophobicContact CB-CG 3.77Å; Q154-K158 VanDerWaalsContact O-CG 3.28Å; Q154-K158 WeakPolarHBondContact O-CG 3.2Å; Q154-K158 PolarHBondContact O-N 2.88Å; Q154-K158 VanDerWaalsContact O-N 3.08Å; L155-K158 WeakPolarHBondContact O-CB 3.28Å; L155-K158 PolarHBondContact O-N 3.49Å; L155-K158 VanDerWaalsContact O-N 3.16Å; F156-K158 VanDerWaalsContact C-N 3.33Å; F156-K158 PolarHBondContact O-N 3.22Å; K158-H161 PolarHBondContact O-N 2.81Å; K158-I162 VanDerWaalsContact O-CG1 3.3Å; K158-I162 WeakPolarHBondContact O-CG1 3.39Å; K158-I162 PolarHBondContact O-N 3.21Å
159	I	87.6	Confident	80.9	Confident	2 Å²	2	29.8 Å²	29.8	1%	0.01	15%	0.147	C	C	.	.	H	α-helix	trans	-60.7	-46.6	175	-65.9	165.3	0	0	0	110.1	L81 I129 L132 I133 L136 L155 F156 H161 I162 A163 L176	L81-I159 HydrophobicContact CD1-CG1 4.38Å; I129-I159 HydrophobicContact CG2-CG2 4.25Å; L132-I159 HydrophobicContact CD2-CD1 3.87Å; L132-I159 HydrophobicContact CD2-CG1 4.13Å; L132-I159 HydrophobicContact CG-CD1 4.15Å; I133-I159 HydrophobicContact CD1-CG2 3.86Å; I133-I159 HydrophobicContact CG1-CD1 4.26Å; I133-I159 HydrophobicContact CG1-CG2 3.92Å; L136-I159 HydrophobicContact CD2-CD1 4.08Å; L155-I159 HydrophobicContact CG-CD1 4.14Å; L155-I159 WeakPolarHBondContact O-CG1 3.34Å; L155-I159 PolarHBondContact O-N 3.37Å; F156-I159 WeakPolarHBondContact O-CB 3.24Å; F156-I159 PolarHBondContact O-N 2.73Å; I159-H161 VanDerWaalsContact C-N 3.31Å; I159-H161 PolarHBondContact O-N 3.11Å; I159-I162 PolarHBondContact O-N 3.47Å; I159-I162 VanDerWaalsContact O-N 3.16Å; I159-A163 WeakPolarHBondContact O-CB 3.3Å; I159-A163 PolarHBondContact O-N 2.85Å; I159-L176 HydrophobicContact CG2-CD2 4.05Å
160	V	86	Confident	80	Confident	1 Å²	1	29.1 Å²	29.1	1%	0.006	14%	0.142	C	C	.	.	H	α-helix	trans	-58.6	-42.9	175.4	170.2	0	0	0	0	111.4	F156 V157 I162 A163 Y164 L176 L205	F156-V160 HydrophobicContact CD1-CG2 3.93Å; F156-V160 HydrophobicContact CE1-CG2 3.77Å; F156-V160 WeakPolarHBondContact O-CG2 3.36Å; F156-V160 PolarHBondContact O-N 3.4Å; V157-V160 PolarHBondContact O-N 3.27Å; V160-I162 VanDerWaalsContact C-N 3.33Å; V160-I162 PolarHBondContact O-N 3.1Å; V160-A163 WeakPolarHBondContact O-CB 3.05Å; V160-A163 PolarHBondContact O-N 2.88Å; V160-Y164 HydrophobicContact CG1-CE1 4.48Å; V160-Y164 HydrophobicContact CG1-CE2 4.17Å; V160-Y164 WeakPolarHBondContact O-CD2 3.17Å; V160-Y164 PolarHBondContact O-N 3.49Å; V160-L176 HydrophobicContact CG2-CD1 3.93Å; V160-L205 HydrophobicContact CG1-CB 4.26Å; V160-L205 HydrophobicContact CG1-CD1 4.49Å; V160-L205 HydrophobicContact CG1-CD2 4.48Å
161	H	80.9	Confident	79.3	Confident	52 Å²	52	25.7 Å²	25.7	24%	0.241	13%	0.128	C	C	.	.	H	α-helix	trans	-60.8	-41.7	175.9	-71.4	132.9	0	0	0	112.8	A85 T89 V157 K158 I159 Y164	A85-H161 HydrophobicContact CB-CB 4.35Å; T89-H161 HydrophobicContact CG2-CB 4.37Å; V157-H161 WeakPolarHBondContact CG1-CE1 3.31Å; V157-H161 VanDerWaalsContact O-CG 3.28Å; V157-H161 PolarHBondContact O-N 3.33Å; V157-H161 PolarHBondContact O-ND1 2.86Å; K158-H161 PolarHBondContact O-N 2.81Å; I159-H161 VanDerWaalsContact C-N 3.31Å; I159-H161 PolarHBondContact O-N 3.11Å; H161-Y164 AromaticContact CD2-CE2 3.73Å; H161-Y164 WeakPolarHBondContact O-CB 3.21Å; H161-Y164 WeakPolarHBondContact O-CD2 3.26Å
162	I	77.9	Confident	78.9	Confident	3 Å²	3	25.1 Å²	25.1	2%	0.015	13%	0.125	C	C	.	.	H	α-helix	trans	-67.7	-43.3	177.4	-65.3	162.7	0	0	0	110.5	L81 I88 L116 I129 K158 I159 V160 Y164 T165	L81-I162 HydrophobicContact CB-CD1 4.38Å; L81-I162 HydrophobicContact CD1-CD1 4.37Å; L81-I162 HydrophobicContact CD2-CD1 3.93Å; L81-I162 HydrophobicContact CG-CD1 4.46Å; I88-I162 HydrophobicContact CD1-CB 4.23Å; I88-I162 HydrophobicContact CD1-CG1 3.99Å; I88-I162 HydrophobicContact CD1-CG2 4.38Å; L116-I162 HydrophobicContact CD1-CG2 4.35Å; L116-I162 HydrophobicContact CD2-CG2 3.75Å; I129-I162 HydrophobicContact CD1-CG2 3.6Å; K158-I162 VanDerWaalsContact O-CG1 3.3Å; K158-I162 WeakPolarHBondContact O-CG1 3.39Å; K158-I162 PolarHBondContact O-N 3.21Å; I159-I162 PolarHBondContact O-N 3.47Å; I159-I162 VanDerWaalsContact O-N 3.16Å; V160-I162 VanDerWaalsContact C-N 3.33Å; V160-I162 PolarHBondContact O-N 3.1Å; I162-Y164 PolarHBondContact O-N 2.95Å; I162-Y164 VanDerWaalsContact O-N 3.15Å; I162-T165 PolarHBondContact O-N 2.74Å; I162-T165 VanDerWaalsContact O-N 3.1Å; I162-T165 PolarHBondContact O-OG1 3.16Å
163	A	79.4	Confident	78.5	Confident	1 Å²	1	25.1 Å²	25.1	1%	0.008	13%	0.125	C	C	.	.	H	α-helix	trans	-56.5	-30.7	-179.9	0	0	0	0	0	113.1	I159 V160 T165 H166 I169 I172 L205	I159-A163 WeakPolarHBondContact O-CB 3.3Å; I159-A163 PolarHBondContact O-N 2.85Å; V160-A163 WeakPolarHBondContact O-CB 3.05Å; V160-A163 PolarHBondContact O-N 2.88Å; A163-T165 PolarHBondContact O-N 3.39Å; A163-T165 VanDerWaalsContact O-N 3.1Å; A163-H166 WeakPolarHBondContact O-CB 3.07Å; A163-H166 PolarHBondContact O-N 3.03Å; A163-I169 WeakPolarHBondContact O-CD1 3.21Å; A163-I169 WeakPolarHBondContact O-CG1 3.43Å; A163-I172 HydrophobicContact CB-CB 4.38Å; A163-I172 HydrophobicContact CB-CD1 4.2Å; A163-I172 HydrophobicContact CB-CG2 3.63Å; A163-L205 HydrophobicContact CB-CD1 4.16Å; A163-L205 HydrophobicContact CB-CD2 3.75Å
164	Y	67.3	Low	78	Confident	51 Å²	51	25.4 Å²	25.4	20%	0.2	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-32	176.8	-73.4	-47.6	0	0	0	114.3	L94 V160 H161 I162 L205 R208	L94-Y164 HydrophobicContact CD1-CD2 4.39Å; L94-Y164 HydrophobicContact CD2-CD2 3.44Å; L94-Y164 VanDerWaalsContact CD2-CD2 3.44Å; L94-Y164 HydrophobicContact CD2-CE2 4.19Å; L94-Y164 HydrophobicContact CD2-CG 3.83Å; V160-Y164 HydrophobicContact CG1-CE1 4.48Å; V160-Y164 HydrophobicContact CG1-CE2 4.17Å; V160-Y164 WeakPolarHBondContact O-CD2 3.17Å; V160-Y164 PolarHBondContact O-N 3.49Å; H161-Y164 AromaticContact CD2-CE2 3.73Å; H161-Y164 WeakPolarHBondContact O-CB 3.21Å; H161-Y164 WeakPolarHBondContact O-CD2 3.26Å; I162-Y164 PolarHBondContact O-N 2.95Å; I162-Y164 VanDerWaalsContact O-N 3.15Å; Y164-L205 HydrophobicContact CD1-CD1 3.3Å; Y164-L205 HydrophobicContact CE1-CB 4.44Å; Y164-L205 HydrophobicContact CE1-CD1 3.36Å; Y164-L205 HydrophobicContact CG-CD1 4.18Å; Y164-R208 HydrophobicContact CE1-CB 4.38Å; Y164-R208 HydrophobicContact CE1-CG 4.44Å
165	T	63	Low	77.7	Confident	32 Å²	32	24.6 Å²	24.6	20%	0.196	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.8	7	-179.4	62.1	0	0	0	0	111.4	I88 Q113 I162 A163	I88-T165 HydrophobicContact CG2-CG2 3.84Å; Q113-T165 PolarHBondContact NE2-O 3.18Å; I162-T165 PolarHBondContact O-N 2.74Å; I162-T165 VanDerWaalsContact O-N 3.1Å; I162-T165 PolarHBondContact O-OG1 3.16Å; A163-T165 PolarHBondContact O-N 3.39Å; A163-T165 VanDerWaalsContact O-N 3.1Å
166	H	64.4	Low	77.7	Confident	27 Å²	27	24.6 Å²	24.6	13%	0.125	12%	0.121	C	C	.	.			trans	-86.8	136.1	-171.9	-165.1	-91	0	0	0	111.8	L117 A163 K168 I169 I172	L117-H166 WeakPolarHBondContact CD2-NE2 3.06Å; A163-H166 WeakPolarHBondContact O-CB 3.07Å; A163-H166 PolarHBondContact O-N 3.03Å; H166-K168 PolarHBondContact ND1-N 2.71Å; H166-K168 PolarHBondContact O-N 2.74Å; H166-I169 WeakPolarHBondContact O-CB 3.42Å; H166-I169 PolarHBondContact O-N 3.14Å; H166-I172 HydrophobicContact CB-CD1 3.66Å; H166-I172 VanDerWaalsContact ND1-CD1 3.31Å; H166-I172 WeakPolarHBondContact ND1-CD1 3.5Å
167	P	59.4	Low	77.5	Confident	32 Å²	32	24.7 Å²	24.7	21%	0.208	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-21.5	179.4	24.1	-33.9	0	0	0	114	L117 Y311 I312	L117-P167 HydrophobicContact CD1-CG 3.69Å; P167-Y311 WeakPolarHBondContact CB-O 3.36Å; P167-I312 VanDerWaalsContact O-CA 3.25Å; P167-I312 WeakPolarHBondContact O-CA 3.46Å; P167-I312 WeakPolarHBondContact O-CB 3.41Å; P167-I312 WeakPolarHBondContact O-CG2 3.48Å
168	K	65.7	Low	77.4	Confident	100 Å²	100	25.5 Å²	25.5	44%	0.435	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.4	39.9	174	-57.6	-176.3	173.9	-176.7	0	112.7	H166 S170 D171 I172	H166-K168 PolarHBondContact ND1-N 2.71Å; H166-K168 PolarHBondContact O-N 2.74Å; K168-S170 PolarHBondContact O-N 3.24Å; K168-D171 HydrophobicContact CB-CB 4.23Å; K168-D171 PolarHBondContact O-N 3.47Å; K168-D171 VanDerWaalsContact O-N 3.17Å; K168-I172 PolarHBondContact O-N 3.32Å; K168-I172 VanDerWaalsContact O-N 3.08Å
169	I	70.2	Confident	77.6	Confident	12 Å²	12	24.6 Å²	24.6	6%	0.062	12%	0.12	C	C	.	.	H	α-helix	trans	-54.2	-34.9	-178.5	-175	170.3	0	0	0	112.8	A163 H166 I172 I173 L205 L209	A163-I169 WeakPolarHBondContact O-CD1 3.21Å; A163-I169 WeakPolarHBondContact O-CG1 3.43Å; H166-I169 WeakPolarHBondContact O-CB 3.42Å; H166-I169 PolarHBondContact O-N 3.14Å; I169-I172 PolarHBondContact O-N 2.94Å; I169-I173 HydrophobicContact CG1-CD1 4.02Å; I169-I173 HydrophobicContact CG1-CG1 4.45Å; I169-I173 VanDerWaalsContact O-CG1 3.26Å; I169-I173 WeakPolarHBondContact O-CG1 3.41Å; I169-I173 PolarHBondContact O-N 3.14Å; I169-L205 HydrophobicContact CD1-CD1 3.77Å; I169-L205 HydrophobicContact CD1-CG 4.4Å; I169-L205 HydrophobicContact CG1-CD1 4.2Å; I169-L205 HydrophobicContact CG1-CG 4.44Å; I169-L209 HydrophobicContact CD1-CB 4.25Å; I169-L209 HydrophobicContact CD1-CD1 4.35Å; I169-L209 HydrophobicContact CG2-CD1 3.56Å; I169-L209 HydrophobicContact CG2-CD2 4.17Å; I169-L209 HydrophobicContact CG2-CG 4.42Å
170	S	69.8	Low	77.8	Confident	7 Å²	7	24.5 Å²	24.5	5%	0.049	12%	0.119	C	C	.	.	H	α-helix	trans	-61.1	-48.7	175.7	52.2	0	0	0	0	112.5	K168 I172 I173 F174	K168-S170 PolarHBondContact O-N 3.24Å; S170-I172 VanDerWaalsContact C-N 3.3Å; S170-I172 PolarHBondContact O-N 3.29Å; S170-I173 PolarHBondContact O-N 3Å; S170-F174 PolarHBondContact O-N 3.37Å
171	D	73.1	Confident	78	Confident	50 Å²	50	24.7 Å²	24.7	27%	0.267	12%	0.12	S	C	.	.	H	α-helix	trans	-65	-37.7	178.9	-57.5	-14.7	0	0	0	110.6	K168 F174 E175	K168-D171 HydrophobicContact CB-CB 4.23Å; K168-D171 PolarHBondContact O-N 3.47Å; K168-D171 VanDerWaalsContact O-N 3.17Å; D171-F174 WeakPolarHBondContact O-CB 3.27Å; D171-F174 PolarHBondContact O-N 2.9Å; D171-E175 WeakPolarHBondContact O-CG 3.34Å; D171-E175 PolarHBondContact O-N 3.38Å; D171-E175 VanDerWaalsContact O-N 3.08Å
172	I	79.9	Confident	78.4	Confident	12 Å²	12	24.1 Å²	24.1	6%	0.062	12%	0.119	C	C	.	.	H	α-helix	trans	-65.9	-42.2	175.9	-67.4	171.2	0	0	0	111.1	I133 A163 H166 K168 I169 S170 F174 E175 L176	I133-I172 HydrophobicContact CD1-CG1 4.47Å; I133-I172 HydrophobicContact CD1-CG2 3.81Å; A163-I172 HydrophobicContact CB-CB 4.38Å; A163-I172 HydrophobicContact CB-CD1 4.2Å; A163-I172 HydrophobicContact CB-CG2 3.63Å; H166-I172 HydrophobicContact CB-CD1 3.66Å; H166-I172 VanDerWaalsContact ND1-CD1 3.31Å; H166-I172 WeakPolarHBondContact ND1-CD1 3.5Å; K168-I172 PolarHBondContact O-N 3.32Å; K168-I172 VanDerWaalsContact O-N 3.08Å; I169-I172 PolarHBondContact O-N 2.94Å; S170-I172 VanDerWaalsContact C-N 3.3Å; S170-I172 PolarHBondContact O-N 3.29Å; I172-F174 VanDerWaalsContact C-N 3.29Å; I172-F174 PolarHBondContact O-N 3.09Å; I172-E175 PolarHBondContact O-N 3.11Å; I172-L176 HydrophobicContact CG2-CD1 3.74Å; I172-L176 HydrophobicContact CG2-CG 4.12Å; I172-L176 WeakPolarHBondContact O-CB 3.35Å; I172-L176 WeakPolarHBondContact O-CG 3.23Å; I172-L176 PolarHBondContact O-N 2.82Å
173	I	83.1	Confident	79	Confident	0 Å²	0	24 Å²	24	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-59.1	-45.2	176	-71.2	161.6	0	0	0	110	I169 S170 E175 L176 D177 T202 L205 H206 L209	I169-I173 HydrophobicContact CG1-CD1 4.02Å; I169-I173 HydrophobicContact CG1-CG1 4.45Å; I169-I173 VanDerWaalsContact O-CG1 3.26Å; I169-I173 WeakPolarHBondContact O-CG1 3.41Å; I169-I173 PolarHBondContact O-N 3.14Å; S170-I173 PolarHBondContact O-N 3Å; I173-E175 PolarHBondContact O-N 3.21Å; I173-L176 PolarHBondContact O-N 3.08Å; I173-D177 PolarHBondContact O-N 3.4Å; I173-T202 HydrophobicContact CG2-CG2 4.19Å; I173-L205 HydrophobicContact CD1-CD2 4.44Å; I173-L205 HydrophobicContact CD1-CG 4.1Å; I173-L205 HydrophobicContact CG1-CB 4.49Å; I173-L205 HydrophobicContact CG1-CD2 3.6Å; I173-L205 HydrophobicContact CG1-CG 3.77Å; I173-H206 HydrophobicContact CD1-CB 4.32Å; I173-H206 HydrophobicContact CG2-CB 4.45Å; I173-L209 HydrophobicContact CD1-CB 4.28Å; I173-L209 HydrophobicContact CD1-CD2 3.64Å
174	F	82	Confident	79.4	Confident	26 Å²	26	24 Å²	24	11%	0.114	12%	0.118	C	C	.	.	H	α-helix	trans	-55.1	-52	176.9	176.5	-99.8	0	0	0	112.2	S170 D171 I172 L176 D177 Q178 Y317 L319	S170-F174 PolarHBondContact O-N 3.37Å; D171-F174 WeakPolarHBondContact O-CB 3.27Å; D171-F174 PolarHBondContact O-N 2.9Å; I172-F174 VanDerWaalsContact C-N 3.29Å; I172-F174 PolarHBondContact O-N 3.09Å; F174-L176 VanDerWaalsContact C-N 3.32Å; F174-L176 PolarHBondContact O-N 2.85Å; F174-D177 WeakPolarHBondContact O-CB 3.45Å; F174-D177 PolarHBondContact O-N 2.78Å; F174-Q178 HydrophobicContact CE1-CG 4.38Å; F174-Q178 PolarHBondContact O-N 2.82Å; F174-Q178 VanDerWaalsContact O-N 3.15Å; F174-Y317 HydrophobicContact CB-CD1 4.25Å; F174-Y317 HydrophobicContact CB-CD2 4.08Å; F174-Y317 HydrophobicContact CB-CG 3.92Å; F174-Y317 AromaticContact CD2-CD2 3.42Å; F174-Y317 HydrophobicContact CD2-CD2 3.42Å; F174-Y317 VanDerWaalsContact CD2-CD2 3.42Å; F174-Y317 HydrophobicContact CD2-CE2 4.01Å; F174-Y317 AromaticContact CD2-CG 3.98Å; F174-Y317 HydrophobicContact CD2-CG 3.98Å; F174-Y317 HydrophobicContact CE2-CD2 4.19Å; F174-Y317 HydrophobicContact CG-CD2 4.08Å; F174-Y317 HydrophobicContact CG-CG 4.19Å; F174-L319 HydrophobicContact CD2-CD1 3.35Å; F174-L319 HydrophobicContact CD2-CG 4.13Å; F174-L319 HydrophobicContact CE2-CB 4.22Å; F174-L319 HydrophobicContact CE2-CD1 3.44Å; F174-L319 VanDerWaalsContact CE2-CD1 3.44Å; F174-L319 HydrophobicContact CE2-CG 3.68Å
175	E	84.4	Confident	80.3	Confident	62 Å²	62	25.8 Å²	25.8	29%	0.29	13%	0.128	S	C	.	.	H	α-helix	trans	-64.3	-36.8	179.4	-67.8	-61.9	151.1	0	0	112	I133 D171 I172 I173 Q178 V179	I133-E175 HydrophobicContact CB-CB 4.22Å; I133-E175 HydrophobicContact CD1-CB 4.4Å; I133-E175 HydrophobicContact CG2-CB 3.56Å; D171-E175 WeakPolarHBondContact O-CG 3.34Å; D171-E175 PolarHBondContact O-N 3.38Å; D171-E175 VanDerWaalsContact O-N 3.08Å; I172-E175 PolarHBondContact O-N 3.11Å; I173-E175 PolarHBondContact O-N 3.21Å; E175-Q178 WeakPolarHBondContact O-CB 3.44Å; E175-Q178 PolarHBondContact O-N 3.28Å; E175-V179 WeakPolarHBondContact O-CG2 3.22Å; E175-V179 PolarHBondContact O-N 3.33Å
176	L	90.1	Very high	81.4	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-68.1	-36.9	175.3	-69.5	173.8	0	0	0	112.5	I133 F156 I159 V160 I172 I173 F174 Q178 V179 V180 T202 L205	I133-L176 HydrophobicContact CD1-CD2 4.33Å; I133-L176 HydrophobicContact CD1-CG 4.42Å; I133-L176 HydrophobicContact CG1-CD2 4.31Å; I133-L176 HydrophobicContact CG2-CD2 4.04Å; I133-L176 HydrophobicContact CG2-CG 4.49Å; F156-L176 HydrophobicContact CD2-CD2 4.06Å; F156-L176 HydrophobicContact CE1-CD2 4.48Å; F156-L176 HydrophobicContact CE2-CB 4.42Å; F156-L176 HydrophobicContact CE2-CD2 3.53Å; F156-L176 HydrophobicContact CZ-CB 4.13Å; F156-L176 HydrophobicContact CZ-CD2 3.77Å; F156-L176 HydrophobicContact CZ-CG 4.39Å; I159-L176 HydrophobicContact CG2-CD2 4.05Å; V160-L176 HydrophobicContact CG2-CD1 3.93Å; I172-L176 HydrophobicContact CG2-CD1 3.74Å; I172-L176 HydrophobicContact CG2-CG 4.12Å; I172-L176 WeakPolarHBondContact O-CB 3.35Å; I172-L176 WeakPolarHBondContact O-CG 3.23Å; I172-L176 PolarHBondContact O-N 2.82Å; I173-L176 PolarHBondContact O-N 3.08Å; F174-L176 VanDerWaalsContact C-N 3.32Å; F174-L176 PolarHBondContact O-N 2.85Å; L176-Q178 VanDerWaalsContact C-N 3.27Å; L176-Q178 PolarHBondContact O-N 3.35Å; L176-V179 PolarHBondContact O-N 2.84Å; L176-V180 WeakPolarHBondContact O-CG2 3.29Å; L176-V180 PolarHBondContact O-N 2.86Å; L176-T202 HydrophobicContact CB-CG2 3.98Å; L176-L205 HydrophobicContact CD1-CD2 3.87Å
177	D	88.2	Confident	82.4	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-59.2	-42	172.8	-76.2	-29.5	0	0	0	109.6	I173 F174 V179 V180 L181 T202 R239 Y243	I173-D177 PolarHBondContact O-N 3.4Å; F174-D177 WeakPolarHBondContact O-CB 3.45Å; F174-D177 PolarHBondContact O-N 2.78Å; D177-V179 PolarHBondContact O-N 3.3Å; D177-V180 PolarHBondContact O-N 2.85Å; D177-L181 WeakPolarHBondContact O-CB 3.03Å; D177-L181 WeakPolarHBondContact O-CG 3.39Å; D177-L181 PolarHBondContact O-N 3Å; D177-T202 WeakPolarHBondContact OD1-CG2 3.47Å; D177-R239 IonicContact OD1-CZ 3.9Å; D177-R239 IonicContact OD1-NE 2.79Å; D177-R239 PolarHBondContact OD1-NE 2.92Å; D177-R239 IonicContact OD1-NH2 2.89Å; D177-R239 PolarHBondContact OD1-NH2 3.26Å; D177-R239 IonicContact OD2-CZ 2.84Å; D177-R239 IonicContact OD2-NE 2.97Å; D177-R239 PolarHBondContact OD2-NE 3.14Å; D177-R239 IonicContact OD2-NH2 2.89Å; D177-Y243 PolarHBondContact OD1-OH 3.38Å
178	Q	87	Confident	83.7	Confident	44 Å²	44	34 Å²	34	21%	0.206	17%	0.166	C	C	.	.	H	α-helix	trans	-60.3	-44	175.3	-62.4	-63.5	-17.6	0	0	112.7	F174 E175 L176 V180 L181 N182	F174-Q178 HydrophobicContact CE1-CG 4.38Å; F174-Q178 PolarHBondContact O-N 2.82Å; F174-Q178 VanDerWaalsContact O-N 3.15Å; E175-Q178 WeakPolarHBondContact O-CB 3.44Å; E175-Q178 PolarHBondContact O-N 3.28Å; L176-Q178 VanDerWaalsContact C-N 3.27Å; L176-Q178 PolarHBondContact O-N 3.35Å; Q178-V180 VanDerWaalsContact C-N 3.3Å; Q178-V180 PolarHBondContact O-N 3.15Å; Q178-L181 PolarHBondContact O-N 3.47Å; Q178-N182 WeakPolarHBondContact O-CB 3.29Å; Q178-N182 VanDerWaalsContact O-CG 3.3Å; Q178-N182 PolarHBondContact O-N 3.42Å; Q178-N182 PolarHBondContact O-ND2 3.05Å
179	V	90.3	Very high	84.6	Confident	2 Å²	2	31.8 Å²	31.8	1%	0.012	16%	0.158	C	C	.	.	H	α-helix	trans	-58.6	-45.7	175.9	179.9	0	0	0	0	110.8	I133 L136 C140 F156 E175 L176 D177 N182 L183	I133-V179 HydrophobicContact CG2-CG2 3.7Å; L136-V179 HydrophobicContact CG-CG1 4.4Å; C140-V179 HydrophobicContact CB-CG1 4.34Å; F156-V179 HydrophobicContact CD2-CG1 4.39Å; F156-V179 HydrophobicContact CE2-CB 4.24Å; F156-V179 HydrophobicContact CE2-CG1 4.1Å; E175-V179 WeakPolarHBondContact O-CG2 3.22Å; E175-V179 PolarHBondContact O-N 3.33Å; L176-V179 PolarHBondContact O-N 2.84Å; D177-V179 PolarHBondContact O-N 3.3Å; V179-N182 PolarHBondContact O-N 3.23Å; V179-L183 PolarHBondContact O-N 3.39Å
180	V	92.3	Very high	85.4	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-65.7	-45.3	-179.2	167.3	0	0	0	0	111.4	F156 L176 D177 Q178 N182 L183 L184 L198 S199 Y243	F156-V180 HydrophobicContact CE2-CG2 4.24Å; F156-V180 HydrophobicContact CZ-CG2 3.85Å; L176-V180 WeakPolarHBondContact O-CG2 3.29Å; L176-V180 PolarHBondContact O-N 2.86Å; D177-V180 PolarHBondContact O-N 2.85Å; Q178-V180 VanDerWaalsContact C-N 3.3Å; Q178-V180 PolarHBondContact O-N 3.15Å; V180-N182 VanDerWaalsContact C-N 3.33Å; V180-N182 PolarHBondContact O-N 2.95Å; V180-L183 WeakPolarHBondContact O-CB 3.19Å; V180-L183 PolarHBondContact O-N 3.42Å; V180-L183 VanDerWaalsContact O-N 3.11Å; V180-L184 HydrophobicContact CG1-CD1 3.75Å; V180-L184 HydrophobicContact CG1-CG 4.27Å; V180-L184 WeakPolarHBondContact O-CG 3.43Å; V180-L184 PolarHBondContact O-N 3.3Å; V180-L198 HydrophobicContact CG2-CB 3.95Å; V180-S199 VanDerWaalsContact CG1-CB 3.43Å; V180-Y243 HydrophobicContact CG1-CE1 3.69Å; V180-Y243 WeakPolarHBondContact CG1-OH 3.05Å
181	L	89.1	Confident	86.4	Confident	5 Å²	5	33.6 Å²	33.6	3%	0.026	17%	0.169	C	C	.	.	H	α-helix	trans	-65.3	-38.4	179.6	-69.1	166.9	0	0	0	111.1	D177 Q178 L183 L184 H185 Y243 L246 L322	D177-L181 WeakPolarHBondContact O-CB 3.03Å; D177-L181 WeakPolarHBondContact O-CG 3.39Å; D177-L181 PolarHBondContact O-N 3Å; Q178-L181 PolarHBondContact O-N 3.47Å; L181-L183 PolarHBondContact O-N 2.89Å; L181-L184 HydrophobicContact CD2-CD1 4.46Å; L181-L184 PolarHBondContact O-N 2.72Å; L181-H185 PolarHBondContact O-N 2.62Å; L181-H185 PolarHBondContact O-ND1 3.35Å; L181-Y243 HydrophobicContact CD2-CD1 4.47Å; L181-Y243 HydrophobicContact CD2-CE1 4.12Å; L181-L246 HydrophobicContact CD2-CD1 3.39Å; L181-L322 HydrophobicContact CD1-CD1 3.38Å; L181-L322 HydrophobicContact CD1-CD2 3.58Å; L181-L322 HydrophobicContact CD1-CG 4.14Å
182	N	88.9	Confident	87.1	Confident	39 Å²	39	31.9 Å²	31.9	21%	0.209	16%	0.159	C	C	.	.	H	α-helix	trans	-57.6	-35.5	172.7	-79.8	-53.6	0	0	0	112.5	R141 Q178 V179 V180 R186	R141-N182 HydrophobicContact CB-CB 4.43Å; Q178-N182 WeakPolarHBondContact O-CB 3.29Å; Q178-N182 VanDerWaalsContact O-CG 3.3Å; Q178-N182 PolarHBondContact O-N 3.42Å; Q178-N182 PolarHBondContact O-ND2 3.05Å; V179-N182 PolarHBondContact O-N 3.23Å; V180-N182 VanDerWaalsContact C-N 3.33Å; V180-N182 PolarHBondContact O-N 2.95Å; N182-R186 WeakPolarHBondContact O-CG 3.31Å
183	L	90.6	Very high	87.6	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-76.8	-42	175.9	-71.9	168.1	0	0	0	112.7	C140 V179 V180 L181 H185 R186 W191 F194 L198	C140-L183 HydrophobicContact CB-CD1 4.29Å; C140-L183 HydrophobicContact CB-CD2 3.79Å; C140-L183 HydrophobicContact CB-CG 3.9Å; V179-L183 PolarHBondContact O-N 3.39Å; V180-L183 WeakPolarHBondContact O-CB 3.19Å; V180-L183 PolarHBondContact O-N 3.42Å; V180-L183 VanDerWaalsContact O-N 3.11Å; L181-L183 PolarHBondContact O-N 2.89Å; L183-H185 VanDerWaalsContact C-N 3.29Å; L183-H185 PolarHBondContact O-N 3.29Å; L183-R186 WeakPolarHBondContact O-CB 3.14Å; L183-R186 PolarHBondContact O-N 2.71Å; L183-R186 VanDerWaalsContact O-N 3.15Å; L183-W191 HydrophobicContact CD2-CB 4.35Å; L183-W191 HydrophobicContact CD2-CD2 4.47Å; L183-W191 HydrophobicContact CD2-CE3 3.75Å; L183-W191 HydrophobicContact CD2-CZ3 4.48Å; L183-F194 HydrophobicContact CD1-CD1 3.86Å; L183-F194 HydrophobicContact CD1-CE1 4.15Å; L183-F194 HydrophobicContact CD2-CD1 4.3Å; L183-L198 HydrophobicContact CD1-CD1 3.64Å
184	L	88.3	Confident	88	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-66.1	-30	-178.9	-73.9	172.7	0	0	0	113.3	V180 L181 R186 K192 C196 Y243 L246	V180-L184 HydrophobicContact CG1-CD1 3.75Å; V180-L184 HydrophobicContact CG1-CG 4.27Å; V180-L184 WeakPolarHBondContact O-CG 3.43Å; V180-L184 PolarHBondContact O-N 3.3Å; L181-L184 HydrophobicContact CD2-CD1 4.46Å; L181-L184 PolarHBondContact O-N 2.72Å; L184-R186 VanDerWaalsContact C-N 3.26Å; L184-R186 PolarHBondContact O-N 3.34Å; L184-K192 WeakPolarHBondContact CD2-O 3.35Å; L184-K192 WeakPolarHBondContact O-CE 3.08Å; L184-K192 WeakPolarHBondContact O-CG 3.44Å; L184-C196 HydrophobicContact CD2-CB 4.45Å; L184-C196 WeakPolarHBondContact CD2-SG 3.26Å; L184-Y243 HydrophobicContact CD1-CD1 3.96Å; L184-Y243 HydrophobicContact CD1-CE1 3.74Å; L184-L246 HydrophobicContact CB-CB 4.37Å; L184-L246 HydrophobicContact CB-CD1 3.86Å; L184-L246 HydrophobicContact CB-CD2 4.25Å; L184-L246 HydrophobicContact CB-CG 4.4Å; L184-L246 HydrophobicContact CD1-CB 4.24Å; L184-L246 HydrophobicContact CD1-CD1 3.96Å
185	H	87.4	Confident	88.4	Confident	90 Å²	90	30.7 Å²	30.7	42%	0.417	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-4.3	175.5	-71.8	103.1	0	0	0	113.8	L181 L183	L181-H185 PolarHBondContact O-N 2.62Å; L181-H185 PolarHBondContact O-ND1 3.35Å; L183-H185 VanDerWaalsContact C-N 3.29Å; L183-H185 PolarHBondContact O-N 3.29Å
186	R	86.3	Confident	88.7	Confident	23 Å²	23	27.7 Å²	27.7	9%	0.087	14%	0.139	C	C	.	.			trans	-69.4	146	177.1	-69.6	-167.9	61.3	157.7	6.5	111.7	C140 V143 D144 N182 L183 L184 E188 W191	C140-R186 PolarHBondContact O-NH1 3.06Å; C140-R186 VanDerWaalsContact O-NH1 3.16Å; V143-R186 PolarHBondContact O-NH1 3.47Å; V143-R186 PolarHBondContact O-NH2 2.92Å; D144-R186 IonicContact OD1-NH2 3.54Å; D144-R186 PolarHBondContact OD1-NH2 2.85Å; N182-R186 WeakPolarHBondContact O-CG 3.31Å; L183-R186 WeakPolarHBondContact O-CB 3.14Å; L183-R186 PolarHBondContact O-N 2.71Å; L183-R186 VanDerWaalsContact O-N 3.15Å; L184-R186 VanDerWaalsContact C-N 3.26Å; L184-R186 PolarHBondContact O-N 3.34Å; R186-E188 IonicContact CZ-OE1 3.88Å; R186-E188 IonicContact CZ-OE2 3.8Å; R186-E188 VanDerWaalsContact CZ-OE2 3.26Å; R186-E188 IonicContact NE-OE1 2.63Å; R186-E188 IonicContact NE-OE2 3.82Å; R186-E188 PolarHBondContact NE-OE2 2.89Å; R186-E188 IonicContact NH2-OE1 3.55Å; R186-E188 PolarHBondContact NH2-OE1 3.43Å; R186-E188 IonicContact NH2-OE2 2.76Å; R186-E188 PolarHBondContact NH2-OE2 3.38Å; R186-W191 HydrophobicContact CB-CB 4.06Å; R186-W191 HydrophobicContact CG-CB 4.36Å
187	N	84	Confident	88.8	Confident	158 Å²	158	28.5 Å²	28.5	85%	0.845	14%	0.143	S	C	*	.	S	Bend	trans	-74.2	-30	177	-67.9	-25.7	0	0	0	111.8	L189	N187-L189 PolarHBondContact O-N 3.24Å
188	E	86.3	Confident	89	Confident	83 Å²	83	28.4 Å²	28.4	39%	0.388	14%	0.143	S	C	.	.	S	Bend	trans	-77.4	128	-179.9	-44.2	95.5	158.3	0	0	111.6	R186 V190 W191 K192	R186-E188 IonicContact CZ-OE1 3.88Å; R186-E188 IonicContact CZ-OE2 3.8Å; R186-E188 VanDerWaalsContact CZ-OE2 3.26Å; R186-E188 IonicContact NE-OE1 2.63Å; R186-E188 IonicContact NE-OE2 3.82Å; R186-E188 PolarHBondContact NE-OE2 2.89Å; R186-E188 IonicContact NH2-OE1 3.55Å; R186-E188 PolarHBondContact NH2-OE1 3.43Å; R186-E188 IonicContact NH2-OE2 2.76Å; R186-E188 PolarHBondContact NH2-OE2 3.38Å; E188-V190 VanDerWaalsContact C-N 3.26Å; E188-V190 PolarHBondContact O-N 3.25Å; E188-W191 PolarHBondContact O-N 2.94Å; E188-K192 PolarHBondContact O-N 3.27Å; E188-K192 VanDerWaalsContact O-N 3.08Å
189	L	86.1	Confident	89.3	Confident	53 Å²	53	26.4 Å²	26.4	28%	0.277	13%	0.133	S	C	.	.	H	α-helix	trans	-55.8	-39.6	-177.2	-63.4	177.3	0	0	0	112.9	N187 W191 K192 F193 N253 N257	N187-L189 PolarHBondContact O-N 3.24Å; L189-W191 VanDerWaalsContact C-N 3.33Å; L189-W191 PolarHBondContact O-N 3.46Å; L189-K192 PolarHBondContact O-N 3.42Å; L189-F193 HydrophobicContact CB-CD2 4.26Å; L189-F193 HydrophobicContact CB-CE2 4.25Å; L189-F193 HydrophobicContact CD2-CE2 4.21Å; L189-F193 WeakPolarHBondContact O-CD2 3.43Å; L189-F193 PolarHBondContact O-N 2.85Å; L189-N253 HydrophobicContact CD2-CB 3.8Å; L189-N257 WeakPolarHBondContact CD1-ND2 3.2Å
190	V	87	Confident	89.3	Confident	52 Å²	52	26.6 Å²	26.6	32%	0.315	14%	0.135	S	C	.	.	H	α-helix	trans	-57.7	-48	-177.9	-173.4	0	0	0	0	110.8	P146 E188 F194 Y266	P146-V190 HydrophobicContact CB-CG1 3.86Å; E188-V190 VanDerWaalsContact C-N 3.26Å; E188-V190 PolarHBondContact O-N 3.25Å; V190-F194 VanDerWaalsContact O-CB 3.23Å; V190-F194 WeakPolarHBondContact O-CB 3.38Å; V190-F194 PolarHBondContact O-N 3.02Å; V190-Y266 WeakPolarHBondContact CG2-OH 3.29Å
191	W	89.4	Confident	89.3	Confident	4 Å²	4	29 Å²	29	2%	0.015	15%	0.145	C	C	.	.	H	α-helix	trans	-73.3	-36.7	-179.4	-65.8	115.7	0	0	0	112.4	V143 D145 F148 C149 I152 L183 R186 E188 L189 F194 G195	V143-W191 HydrophobicContact CB-CH2 4.32Å; V143-W191 HydrophobicContact CB-CZ2 4.38Å; V143-W191 HydrophobicContact CG1-CE3 4.48Å; V143-W191 HydrophobicContact CG1-CH2 3.48Å; V143-W191 VanDerWaalsContact CG1-CH2 3.48Å; V143-W191 HydrophobicContact CG1-CZ2 3.79Å; V143-W191 HydrophobicContact CG1-CZ3 3.85Å; V143-W191 HydrophobicContact CG2-CH2 3.97Å; V143-W191 HydrophobicContact CG2-CZ2 4.08Å; V143-W191 WeakPolarHBondContact O-CZ2 3.5Å; V143-W191 PolarHBondContact O-NE1 3.21Å; D145-W191 WeakPolarHBondContact O-CH2 3.41Å; D145-W191 VanDerWaalsContact O-CZ2 3.28Å; D145-W191 WeakPolarHBondContact O-CZ2 3.23Å; F148-W191 HydrophobicContact CB-CH2 4.46Å; C149-W191 VanDerWaalsContact SG-CZ3 3.54Å; I152-W191 HydrophobicContact CD1-CH2 4.3Å; I152-W191 HydrophobicContact CD1-CZ3 4.02Å; L183-W191 HydrophobicContact CD2-CB 4.35Å; L183-W191 HydrophobicContact CD2-CD2 4.47Å; L183-W191 HydrophobicContact CD2-CE3 3.75Å; L183-W191 HydrophobicContact CD2-CZ3 4.48Å; R186-W191 HydrophobicContact CB-CB 4.06Å; R186-W191 HydrophobicContact CG-CB 4.36Å; E188-W191 PolarHBondContact O-N 2.94Å; L189-W191 VanDerWaalsContact C-N 3.33Å; L189-W191 PolarHBondContact O-N 3.46Å; W191-F194 AromaticContact CE3-CD1 3.97Å; W191-F194 HydrophobicContact CE3-CD1 3.97Å; W191-F194 HydrophobicContact CZ3-CD1 4.07Å; W191-F194 HydrophobicContact CZ3-CE1 4.39Å; W191-F194 CarbonylContact O-C 3.31Å; W191-F194 WeakPolarHBondContact O-CB 3.44Å; W191-F194 PolarHBondContact O-N 3.07Å; W191-G195 PolarHBondContact O-N 3.33Å
192	K	89.2	Confident	89.3	Confident	15 Å²	15	28.8 Å²	28.8	7%	0.065	14%	0.144	C	C	.	.	H	α-helix	trans	-60.8	-49.6	175.6	-171.2	163.9	-171.3	167.7	0	111.8	L184 E188 L189 F194 G195 C196 C250	L184-K192 WeakPolarHBondContact CD2-O 3.35Å; L184-K192 WeakPolarHBondContact O-CE 3.08Å; L184-K192 WeakPolarHBondContact O-CG 3.44Å; E188-K192 PolarHBondContact O-N 3.27Å; E188-K192 VanDerWaalsContact O-N 3.08Å; L189-K192 PolarHBondContact O-N 3.42Å; K192-F194 VanDerWaalsContact C-N 3.33Å; K192-F194 PolarHBondContact O-N 3.13Å; K192-G195 WeakPolarHBondContact O-CA 3.19Å; K192-G195 PolarHBondContact O-N 3.36Å; K192-G195 VanDerWaalsContact O-N 3.16Å; K192-C196 PolarHBondContact O-N 3.35Å; K192-C250 WeakPolarHBondContact CE-SG 3.32Å
193	F	90	Very high	89.3	Confident	1 Å²	1	27 Å²	27	0%	0.004	13%	0.134	C	C	.	.	H	α-helix	trans	-70.8	-27.4	176	-72.6	-70.2	0	0	0	113.4	L189 C196 H197 C250 N253 L254 Y266 L270	L189-F193 HydrophobicContact CB-CD2 4.26Å; L189-F193 HydrophobicContact CB-CE2 4.25Å; L189-F193 HydrophobicContact CD2-CE2 4.21Å; L189-F193 WeakPolarHBondContact O-CD2 3.43Å; L189-F193 PolarHBondContact O-N 2.85Å; F193-C196 WeakPolarHBondContact O-CB 3.31Å; F193-C196 PolarHBondContact O-N 3.09Å; F193-H197 PolarHBondContact O-N 2.81Å; F193-C250 HydrophobicContact CE1-CB 4.04Å; F193-N253 HydrophobicContact CZ-CB 4.38Å; F193-L254 HydrophobicContact CE1-CD1 4.13Å; F193-L254 HydrophobicContact CE1-CD2 3.94Å; F193-L254 HydrophobicContact CE1-CG 3.78Å; F193-L254 HydrophobicContact CE2-CD2 4.24Å; F193-L254 HydrophobicContact CZ-CD1 4.42Å; F193-L254 HydrophobicContact CZ-CD2 3.58Å; F193-L254 HydrophobicContact CZ-CG 3.57Å; F193-Y266 HydrophobicContact CB-CD1 3.48Å; F193-Y266 VanDerWaalsContact CB-CD1 3.48Å; F193-Y266 HydrophobicContact CB-CD2 4.48Å; F193-Y266 HydrophobicContact CB-CE1 4.07Å; F193-Y266 HydrophobicContact CB-CG 3.74Å; F193-Y266 HydrophobicContact CD1-CG 4.27Å; F193-Y266 HydrophobicContact CD2-CD1 4.16Å; F193-Y266 AromaticContact CD2-CD2 3.6Å; F193-Y266 HydrophobicContact CD2-CD2 3.6Å; F193-Y266 HydrophobicContact CD2-CE2 4.24Å; F193-Y266 AromaticContact CD2-CG 3.58Å; F193-Y266 HydrophobicContact CD2-CG 3.58Å; F193-Y266 HydrophobicContact CE2-CD2 4.1Å; F193-Y266 HydrophobicContact CE2-CG 4.3Å; F193-Y266 AromaticContact CG-CD1 3.91Å; F193-Y266 HydrophobicContact CG-CD1 3.91Å; F193-Y266 HydrophobicContact CG-CD2 4.13Å; F193-Y266 AromaticContact CG-CG 3.6Å; F193-Y266 HydrophobicContact CG-CG 3.6Å; F193-L270 HydrophobicContact CE1-CB 4.49Å; F193-L270 HydrophobicContact CE1-CD2 4.38Å
194	F	90.5	Very high	88.9	Confident	11 Å²	11	27.8 Å²	27.8	5%	0.048	14%	0.142	C	C	.	.	H	α-helix	trans	-65.8	-39.7	168.9	-175.2	-115.5	0	0	0	111.6	C149 I152 C153 L183 V190 W191 K192 C196 H197 L198	C149-F194 HydrophobicContact CB-CD2 3.92Å; C149-F194 HydrophobicContact CB-CE1 4.49Å; C149-F194 HydrophobicContact CB-CE2 3.79Å; C149-F194 HydrophobicContact CB-CG 4.34Å; C149-F194 HydrophobicContact CB-CZ 4.1Å; C149-F194 WeakPolarHBondContact O-CE2 3.1Å; C149-F194 WeakPolarHBondContact O-CZ 3.12Å; I152-F194 HydrophobicContact CB-CE1 4.09Å; I152-F194 HydrophobicContact CB-CZ 3.98Å; I152-F194 HydrophobicContact CD1-CE1 4.39Å; I152-F194 HydrophobicContact CG2-CE1 3.69Å; I152-F194 HydrophobicContact CG2-CZ 3.84Å; C153-F194 HydrophobicContact CB-CE2 3.9Å; C153-F194 HydrophobicContact CB-CZ 3.99Å; L183-F194 HydrophobicContact CD1-CD1 3.86Å; L183-F194 HydrophobicContact CD1-CE1 4.15Å; L183-F194 HydrophobicContact CD2-CD1 4.3Å; V190-F194 VanDerWaalsContact O-CB 3.23Å; V190-F194 WeakPolarHBondContact O-CB 3.38Å; V190-F194 PolarHBondContact O-N 3.02Å; W191-F194 AromaticContact CE3-CD1 3.97Å; W191-F194 HydrophobicContact CE3-CD1 3.97Å; W191-F194 HydrophobicContact CZ3-CD1 4.07Å; W191-F194 HydrophobicContact CZ3-CE1 4.39Å; W191-F194 CarbonylContact O-C 3.31Å; W191-F194 WeakPolarHBondContact O-CB 3.44Å; W191-F194 PolarHBondContact O-N 3.07Å; K192-F194 VanDerWaalsContact C-N 3.33Å; K192-F194 PolarHBondContact O-N 3.13Å; F194-C196 PolarHBondContact O-N 2.92Å; F194-H197 WeakPolarHBondContact O-CB 3.21Å; F194-H197 PolarHBondContact O-N 3.08Å; F194-H197 VanDerWaalsContact O-N 3.15Å; F194-L198 HydrophobicContact CD1-CD1 4.28Å; F194-L198 HydrophobicContact CE1-CD1 3.69Å; F194-L198 HydrophobicContact CE1-CG 4.17Å; F194-L198 HydrophobicContact CE2-CD2 4.27Å; F194-L198 HydrophobicContact CE2-CG 4.41Å; F194-L198 HydrophobicContact CZ-CD1 3.94Å; F194-L198 HydrophobicContact CZ-CD2 4.04Å; F194-L198 HydrophobicContact CZ-CG 4.08Å; F194-L198 WeakPolarHBondContact O-CG 3.25Å; F194-L198 PolarHBondContact O-N 2.84Å
195	G	91.7	Very high	88.7	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-57.5	-44.9	169.5	0	0	0	0	0	112.2	W191 K192 H197 L198 S199	W191-G195 PolarHBondContact O-N 3.33Å; K192-G195 WeakPolarHBondContact O-CA 3.19Å; K192-G195 PolarHBondContact O-N 3.36Å; K192-G195 VanDerWaalsContact O-N 3.16Å; G195-H197 PolarHBondContact O-N 2.92Å; G195-L198 PolarHBondContact O-N 3.44Å; G195-S199 WeakPolarHBondContact O-CB 3.09Å; G195-S199 PolarHBondContact O-N 2.88Å
196	C	90.4	Very high	88.5	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-55.6	-51.6	171.4	-64.9	0	0	0	0	110.6	L184 K192 F193 F194 L198 S199 A200 C250 T273	L184-C196 HydrophobicContact CD2-CB 4.45Å; L184-C196 WeakPolarHBondContact CD2-SG 3.26Å; K192-C196 PolarHBondContact O-N 3.35Å; F193-C196 WeakPolarHBondContact O-CB 3.31Å; F193-C196 PolarHBondContact O-N 3.09Å; F194-C196 PolarHBondContact O-N 2.92Å; C196-L198 VanDerWaalsContact C-N 3.28Å; C196-L198 PolarHBondContact O-N 3.33Å; C196-S199 WeakPolarHBondContact O-CB 3.35Å; C196-S199 PolarHBondContact O-N 3.47Å; C196-S199 VanDerWaalsContact O-N 3.08Å; C196-S199 PolarHBondContact O-OG 3.1Å; C196-A200 PolarHBondContact O-N 2.87Å; C196-C250 PolarHBondContact SG-SG 3.19Å; C196-T273 PolarHBondContact O-OG1 2.91Å
197	H	91.9	Very high	87.9	Confident	16 Å²	16	22.6 Å²	22.6	7%	0.074	12%	0.12	C	C	.	.	H	α-helix	trans	-54.2	-43.5	179.3	-176.8	59.5	0	0	0	113.3	F193 F194 G195 Y201 Y269	F193-H197 PolarHBondContact O-N 2.81Å; F194-H197 WeakPolarHBondContact O-CB 3.21Å; F194-H197 PolarHBondContact O-N 3.08Å; F194-H197 VanDerWaalsContact O-N 3.15Å; G195-H197 PolarHBondContact O-N 2.92Å; H197-Y201 AromaticContact CE1-CE2 3.9Å; H197-Y201 AromaticContact NE2-CE2 3.67Å; H197-Y201 WeakPolarHBondContact O-CD2 3.45Å; H197-Y269 HydrophobicContact CB-CD1 4.09Å; H197-Y269 HydrophobicContact CB-CD2 3.73Å; H197-Y269 HydrophobicContact CB-CE1 4.33Å; H197-Y269 HydrophobicContact CB-CE2 3.99Å; H197-Y269 HydrophobicContact CB-CG 3.75Å; H197-Y269 AromaticContact CE1-CE1 3.74Å; H197-Y269 AromaticContact CG-CD1 3.91Å; H197-Y269 AromaticContact CG-CE1 3.8Å; H197-Y269 AromaticContact CG-CZ 3.88Å; H197-Y269 AromaticContact ND1-CD1 3.35Å; H197-Y269 VanDerWaalsContact ND1-CD1 3.35Å; H197-Y269 WeakPolarHBondContact ND1-CD1 3.16Å; H197-Y269 AromaticContact ND1-CE1 3.28Å; H197-Y269 VanDerWaalsContact ND1-CE1 3.28Å; H197-Y269 WeakPolarHBondContact ND1-CE1 3.27Å; H197-Y269 AromaticContact ND1-CG 3.95Å; H197-Y269 AromaticContact ND1-CZ 3.83Å
198	L	93.5	Very high	87.2	Confident	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-70.3	-37	178.4	-64.1	-169.9	0	0	0	112.6	I152 C153 F156 V180 L183 F194 G195 C196 A200 Y201 T202	I152-L198 HydrophobicContact CG2-CD1 4.33Å; C153-L198 HydrophobicContact CB-CD2 4.35Å; F156-L198 HydrophobicContact CB-CD2 4.14Å; F156-L198 HydrophobicContact CD1-CB 4.39Å; F156-L198 HydrophobicContact CD1-CD2 3.97Å; F156-L198 HydrophobicContact CD2-CD1 3.92Å; F156-L198 HydrophobicContact CE1-CB 4.16Å; F156-L198 HydrophobicContact CE2-CB 4.48Å; F156-L198 HydrophobicContact CE2-CD1 4.24Å; F156-L198 HydrophobicContact CG-CD1 4.11Å; F156-L198 HydrophobicContact CG-CD2 4Å; F156-L198 HydrophobicContact CG-CG 4.49Å; F156-L198 HydrophobicContact CZ-CB 4.2Å; V180-L198 HydrophobicContact CG2-CB 3.95Å; L183-L198 HydrophobicContact CD1-CD1 3.64Å; F194-L198 HydrophobicContact CD1-CD1 4.28Å; F194-L198 HydrophobicContact CE1-CD1 3.69Å; F194-L198 HydrophobicContact CE1-CG 4.17Å; F194-L198 HydrophobicContact CE2-CD2 4.27Å; F194-L198 HydrophobicContact CE2-CG 4.41Å; F194-L198 HydrophobicContact CZ-CD1 3.94Å; F194-L198 HydrophobicContact CZ-CD2 4.04Å; F194-L198 HydrophobicContact CZ-CG 4.08Å; F194-L198 WeakPolarHBondContact O-CG 3.25Å; F194-L198 PolarHBondContact O-N 2.84Å; G195-L198 PolarHBondContact O-N 3.44Å; C196-L198 VanDerWaalsContact C-N 3.28Å; C196-L198 PolarHBondContact O-N 3.33Å; L198-A200 PolarHBondContact O-N 3.24Å; L198-Y201 WeakPolarHBondContact O-CB 3.46Å; L198-Y201 PolarHBondContact O-N 3.17Å; L198-T202 PolarHBondContact O-N 3.32Å
199	S	92.9	Very high	86.5	Confident	1 Å²	1	15.4 Å²	15.4	1%	0.007	8%	0.078	C	C	.	.	H	α-helix	trans	-57.5	-34.4	178.7	74.7	0	0	0	0	112.9	V180 G195 C196 Y201 T202 F203 T273	V180-S199 VanDerWaalsContact CG1-CB 3.43Å; G195-S199 WeakPolarHBondContact O-CB 3.09Å; G195-S199 PolarHBondContact O-N 2.88Å; C196-S199 WeakPolarHBondContact O-CB 3.35Å; C196-S199 PolarHBondContact O-N 3.47Å; C196-S199 VanDerWaalsContact O-N 3.08Å; C196-S199 PolarHBondContact O-OG 3.1Å; S199-Y201 PolarHBondContact O-N 2.92Å; S199-T202 PolarHBondContact O-N 2.78Å; S199-F203 WeakPolarHBondContact O-CD2 3.17Å; S199-F203 WeakPolarHBondContact O-CG 3.42Å; S199-F203 PolarHBondContact O-N 3.03Å; S199-T273 WeakPolarHBondContact OG-CG2 3.47Å
200	A	90.4	Very high	85.5	Confident	7 Å²	7	13 Å²	13	6%	0.058	7%	0.065	C	C	.	.	H	α-helix	trans	-59.2	-30.5	175.2	0	0	0	0	0	113	C196 L198 G204	C196-A200 PolarHBondContact O-N 2.87Å; L198-A200 PolarHBondContact O-N 3.24Å; A200-G204 PolarHBondContact O-N 3.33Å; A200-G204 VanDerWaalsContact O-N 3.11Å
201	Y	90.7	Very high	84.1	Confident	51 Å²	51	12.3 Å²	12.3	20%	0.2	6%	0.059	C	C	.	.	H	α-helix	trans	-77.7	-37.8	174.5	-63.6	-82.9	0	0	0	111.8	V157 H197 L198 S199 G204 L205	V157-Y201 HydrophobicContact CG2-CD1 4.02Å; V157-Y201 HydrophobicContact CG2-CD2 4.3Å; V157-Y201 HydrophobicContact CG2-CE1 3.65Å; V157-Y201 HydrophobicContact CG2-CE2 3.94Å; V157-Y201 HydrophobicContact CG2-CG 4.33Å; H197-Y201 AromaticContact CE1-CE2 3.9Å; H197-Y201 AromaticContact NE2-CE2 3.67Å; H197-Y201 WeakPolarHBondContact O-CD2 3.45Å; L198-Y201 WeakPolarHBondContact O-CB 3.46Å; L198-Y201 PolarHBondContact O-N 3.17Å; S199-Y201 PolarHBondContact O-N 2.92Å; Y201-G204 PolarHBondContact O-N 3.19Å; Y201-L205 WeakPolarHBondContact O-CB 3.3Å; Y201-L205 PolarHBondContact O-N 2.86Å
202	T	90	Very high	82.6	Confident	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-67	-45.3	177.2	-43.9	0	0	0	0	111.8	F156 I173 L176 D177 L198 S199 G204 L205 H206	F156-T202 WeakPolarHBondContact CZ-OG1 3.3Å; I173-T202 HydrophobicContact CG2-CG2 4.19Å; L176-T202 HydrophobicContact CB-CG2 3.98Å; D177-T202 WeakPolarHBondContact OD1-CG2 3.47Å; L198-T202 PolarHBondContact O-N 3.32Å; S199-T202 PolarHBondContact O-N 2.78Å; T202-G204 VanDerWaalsContact C-N 3.3Å; T202-G204 PolarHBondContact O-N 3.47Å; T202-L205 WeakPolarHBondContact O-CB 3.46Å; T202-L205 PolarHBondContact O-N 2.94Å; T202-H206 WeakPolarHBondContact O-CB 3.1Å; T202-H206 PolarHBondContact O-N 3.24Å
203	F	88.3	Confident	81	Confident	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-60.8	-39.5	170.5	-63.5	-50.7	0	0	0	112	S199 L205 H206 C207 Y243 T273 V276 Y277 D280	S199-F203 WeakPolarHBondContact O-CD2 3.17Å; S199-F203 WeakPolarHBondContact O-CG 3.42Å; S199-F203 PolarHBondContact O-N 3.03Å; F203-L205 VanDerWaalsContact C-N 3.33Å; F203-L205 PolarHBondContact O-N 2.78Å; F203-H206 PolarHBondContact O-N 3.08Å; F203-C207 VanDerWaalsContact O-CB 3.22Å; F203-C207 WeakPolarHBondContact O-CB 2.98Å; F203-C207 PolarHBondContact O-N 3.38Å; F203-Y243 HydrophobicContact CE1-CD1 4.3Å; F203-Y243 AromaticContact CE1-CD2 3.59Å; F203-Y243 HydrophobicContact CE1-CD2 3.59Å; F203-Y243 HydrophobicContact CE1-CE1 4.48Å; F203-Y243 AromaticContact CE1-CE2 3.81Å; F203-Y243 HydrophobicContact CE1-CE2 3.81Å; F203-Y243 AromaticContact CE1-CG 3.87Å; F203-Y243 HydrophobicContact CE1-CG 3.87Å; F203-Y243 HydrophobicContact CE2-CD1 4.24Å; F203-Y243 HydrophobicContact CE2-CE1 4.46Å; F203-Y243 HydrophobicContact CE2-CG 4.48Å; F203-Y243 AromaticContact CZ-CD1 3.49Å; F203-Y243 HydrophobicContact CZ-CD1 3.49Å; F203-Y243 VanDerWaalsContact CZ-CD1 3.49Å; F203-Y243 AromaticContact CZ-CD2 3.61Å; F203-Y243 HydrophobicContact CZ-CD2 3.61Å; F203-Y243 AromaticContact CZ-CE1 3.84Å; F203-Y243 HydrophobicContact CZ-CE1 3.84Å; F203-Y243 AromaticContact CZ-CE2 3.96Å; F203-Y243 HydrophobicContact CZ-CE2 3.96Å; F203-Y243 AromaticContact CZ-CG 3.37Å; F203-Y243 HydrophobicContact CZ-CG 3.37Å; F203-T273 HydrophobicContact CD2-CG2 4.46Å; F203-T273 HydrophobicContact CE2-CG2 3.99Å; F203-V276 HydrophobicContact CB-CB 4.32Å; F203-V276 HydrophobicContact CB-CG1 3.55Å; F203-Y277 AromaticContact CE1-CD2 3.94Å; F203-Y277 HydrophobicContact CE1-CD2 3.94Å; F203-Y277 HydrophobicContact CE2-CD2 4.32Å; F203-Y277 AromaticContact CZ-CD2 3.7Å; F203-Y277 HydrophobicContact CZ-CD2 3.7Å; F203-Y277 HydrophobicContact CZ-CG 4.39Å; F203-D280 HydrophobicContact CB-CB 4.15Å; F203-D280 HydrophobicContact CD1-CB 4.41Å; F203-D280 WeakPolarHBondContact CD1-OD2 3.23Å
204	G	83.6	Confident	79.2	Confident	18 Å²	18	13.9 Å²	13.9	19%	0.186	7%	0.07	C	C	.	.	H	α-helix	trans	-61.1	-41.1	175.3	0	0	0	0	0	112.8	A200 Y201 T202 R208	A200-G204 PolarHBondContact O-N 3.33Å; A200-G204 VanDerWaalsContact O-N 3.11Å; Y201-G204 PolarHBondContact O-N 3.19Å; T202-G204 VanDerWaalsContact C-N 3.3Å; T202-G204 PolarHBondContact O-N 3.47Å; G204-R208 WeakPolarHBondContact O-CB 3.44Å; G204-R208 WeakPolarHBondContact O-CD 3.26Å; G204-R208 VanDerWaalsContact O-CG 3.28Å; G204-R208 WeakPolarHBondContact O-CG 3.2Å; G204-R208 PolarHBondContact O-N 3.33Å; G204-R208 VanDerWaalsContact O-N 3.15Å
205	L	83.5	Confident	77.2	Confident	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-65.4	-45.5	175.3	-177.6	61.8	0	0	0	111.4	V160 A163 Y164 I169 I173 L176 Y201 T202 F203 R208 L209	V160-L205 HydrophobicContact CG1-CB 4.26Å; V160-L205 HydrophobicContact CG1-CD1 4.49Å; V160-L205 HydrophobicContact CG1-CD2 4.48Å; A163-L205 HydrophobicContact CB-CD1 4.16Å; A163-L205 HydrophobicContact CB-CD2 3.75Å; Y164-L205 HydrophobicContact CD1-CD1 3.3Å; Y164-L205 HydrophobicContact CE1-CB 4.44Å; Y164-L205 HydrophobicContact CE1-CD1 3.36Å; Y164-L205 HydrophobicContact CG-CD1 4.18Å; I169-L205 HydrophobicContact CD1-CD1 3.77Å; I169-L205 HydrophobicContact CD1-CG 4.4Å; I169-L205 HydrophobicContact CG1-CD1 4.2Å; I169-L205 HydrophobicContact CG1-CG 4.44Å; I173-L205 HydrophobicContact CD1-CD2 4.44Å; I173-L205 HydrophobicContact CD1-CG 4.1Å; I173-L205 HydrophobicContact CG1-CB 4.49Å; I173-L205 HydrophobicContact CG1-CD2 3.6Å; I173-L205 HydrophobicContact CG1-CG 3.77Å; L176-L205 HydrophobicContact CD1-CD2 3.87Å; Y201-L205 WeakPolarHBondContact O-CB 3.3Å; Y201-L205 PolarHBondContact O-N 2.86Å; T202-L205 WeakPolarHBondContact O-CB 3.46Å; T202-L205 PolarHBondContact O-N 2.94Å; F203-L205 VanDerWaalsContact C-N 3.33Å; F203-L205 PolarHBondContact O-N 2.78Å; L205-R208 PolarHBondContact O-N 3.19Å; L205-L209 PolarHBondContact O-N 2.67Å
206	H	82.8	Confident	75	Confident	1 Å²	1	17.5 Å²	17.5	1%	0.005	9%	0.089	C	C	.	.	H	α-helix	trans	-64.4	-48.1	178.2	-173.1	-104.2	0	0	0	112.5	I173 T202 F203 R208 L209 I210 F231 Q236 R239 D280 T284	I173-H206 HydrophobicContact CD1-CB 4.32Å; I173-H206 HydrophobicContact CG2-CB 4.45Å; T202-H206 WeakPolarHBondContact O-CB 3.1Å; T202-H206 PolarHBondContact O-N 3.24Å; F203-H206 PolarHBondContact O-N 3.08Å; H206-R208 PolarHBondContact O-N 2.77Å; H206-L209 WeakPolarHBondContact O-CB 3.31Å; H206-L209 PolarHBondContact O-N 3.32Å; H206-I210 WeakPolarHBondContact CE1-CD1 3.34Å; H206-I210 VanDerWaalsContact ND1-CD1 3.3Å; H206-I210 WeakPolarHBondContact ND1-CD1 3.47Å; H206-I210 WeakPolarHBondContact O-CG1 3.33Å; H206-I210 PolarHBondContact O-N 2.89Å; H206-F231 AromaticContact NE2-CD1 3.84Å; H206-F231 AromaticContact NE2-CE1 3.58Å; H206-Q236 PolarHBondContact CE1-OE1 3.39Å; H206-Q236 PolarHBondContact NE2-NE2 2.71Å; H206-Q236 PolarHBondContact NE2-OE1 2.87Å; H206-R239 PolarHBondContact CE1-NH1 3.3Å; H206-R239 VanDerWaalsContact CG-NH1 3.32Å; H206-R239 PolarHBondContact ND1-NH1 3.15Å; H206-R239 VanDerWaalsContact ND1-NH1 3.14Å; H206-D280 IonicContact CE1-OD1 3.46Å; H206-D280 IonicContact CE1-OD2 2.71Å; H206-D280 IonicContact CG-OD1 3.36Å; H206-D280 IonicContact CG-OD2 3.38Å; H206-D280 IonicContact ND1-OD1 3.3Å; H206-D280 PolarHBondContact ND1-OD1 3.06Å; H206-D280 IonicContact ND1-OD2 2.72Å; H206-D280 PolarHBondContact ND1-OD2 3.48Å; H206-T284 PolarHBondContact CE1-OG1 3.07Å
207	C	73.8	Confident	72.9	Confident	4 Å²	4	21 Å²	21	3%	0.027	10%	0.103	C	C	.	.	H	α-helix	trans	-57.4	-37.2	175.8	178.3	0	0	0	0	111.4	F203 I210 M211 D280 Y283	F203-C207 VanDerWaalsContact O-CB 3.22Å; F203-C207 WeakPolarHBondContact O-CB 2.98Å; F203-C207 PolarHBondContact O-N 3.38Å; C207-I210 PolarHBondContact O-N 3.46Å; C207-M211 WeakPolarHBondContact O-CB 3.01Å; C207-M211 VanDerWaalsContact O-CG 3.28Å; C207-M211 WeakPolarHBondContact O-CG 3.46Å; C207-M211 PolarHBondContact O-N 2.78Å; C207-D280 VanDerWaalsContact CA-OD1 3.3Å; C207-D280 WeakPolarHBondContact CA-OD1 3.46Å; C207-D280 HydrophobicContact CB-CB 4.28Å; C207-D280 PolarHBondContact N-OD1 3.08Å; C207-Y283 VanDerWaalsContact SG-CD2 3.51Å
208	R	69.8	Low	70.6	Confident	80 Å²	80	23 Å²	23	30%	0.302	11%	0.112	S	C	.	.	H	α-helix	trans	-70.4	-40	174.7	-77.4	166.7	171.8	-101	4.7	113.3	L94 Y164 G204 L205 H206 I210 M211 T212	L94-R208 VanDerWaalsContact O-CZ 3.23Å; L94-R208 PolarHBondContact O-NH1 2.99Å; L94-R208 PolarHBondContact O-NH2 3.35Å; Y164-R208 HydrophobicContact CE1-CB 4.38Å; Y164-R208 HydrophobicContact CE1-CG 4.44Å; G204-R208 WeakPolarHBondContact O-CB 3.44Å; G204-R208 WeakPolarHBondContact O-CD 3.26Å; G204-R208 VanDerWaalsContact O-CG 3.28Å; G204-R208 WeakPolarHBondContact O-CG 3.2Å; G204-R208 PolarHBondContact O-N 3.33Å; G204-R208 VanDerWaalsContact O-N 3.15Å; L205-R208 PolarHBondContact O-N 3.19Å; H206-R208 PolarHBondContact O-N 2.77Å; R208-I210 VanDerWaalsContact C-N 3.3Å; R208-M211 HydrophobicContact CB-CE 4.38Å; R208-M211 HydrophobicContact CG-CE 3.81Å; R208-M211 PolarHBondContact O-N 2.63Å; R208-T212 WeakPolarHBondContact O-CB 3.18Å; R208-T212 PolarHBondContact O-N 2.7Å; R208-T212 PolarHBondContact O-OG1 3.47Å
209	L	71.6	Confident	68.2	Low	10 Å²	10	25.5 Å²	25.5	5%	0.052	13%	0.129	C	C	.	.	H	α-helix	trans	-57.2	-48.9	171.9	174.3	59.8	0	0	0	109.9	I169 I173 L205 H206 T212 M213 F231	I169-L209 HydrophobicContact CD1-CB 4.25Å; I169-L209 HydrophobicContact CD1-CD1 4.35Å; I169-L209 HydrophobicContact CG2-CD1 3.56Å; I169-L209 HydrophobicContact CG2-CD2 4.17Å; I169-L209 HydrophobicContact CG2-CG 4.42Å; I173-L209 HydrophobicContact CD1-CB 4.28Å; I173-L209 HydrophobicContact CD1-CD2 3.64Å; L205-L209 PolarHBondContact O-N 2.67Å; H206-L209 WeakPolarHBondContact O-CB 3.31Å; H206-L209 PolarHBondContact O-N 3.32Å; L209-T212 WeakPolarHBondContact O-CB 3.34Å; L209-T212 PolarHBondContact O-N 2.71Å; L209-M213 HydrophobicContact CD1-CE 3.78Å; L209-M213 HydrophobicContact CD1-CG 4.06Å; L209-M213 HydrophobicContact CG-CG 4.47Å; L209-M213 WeakPolarHBondContact O-CB 3.48Å; L209-M213 VanDerWaalsContact O-CG 3.23Å; L209-M213 WeakPolarHBondContact O-CG 3.47Å; L209-M213 PolarHBondContact O-N 3.48Å; L209-F231 HydrophobicContact CD2-CE1 4.22Å; L209-F231 HydrophobicContact CD2-CZ 4.18Å; L209-F231 HydrophobicContact CG-CE1 4.48Å; L209-F231 HydrophobicContact CG-CZ 4.02Å
210	I	64.7	Low	65.7	Low	1 Å²	1	28.3 Å²	28.3	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-58.6	-51.7	176.7	-74.6	172.1	0	0	0	111.6	H206 C207 R208 T212 M213 S214 F231 T284 L287	H206-I210 WeakPolarHBondContact CE1-CD1 3.34Å; H206-I210 VanDerWaalsContact ND1-CD1 3.3Å; H206-I210 WeakPolarHBondContact ND1-CD1 3.47Å; H206-I210 WeakPolarHBondContact O-CG1 3.33Å; H206-I210 PolarHBondContact O-N 2.89Å; C207-I210 PolarHBondContact O-N 3.46Å; R208-I210 VanDerWaalsContact C-N 3.3Å; I210-T212 PolarHBondContact O-N 3.3Å; I210-M213 CarbonylContact O-C 3.58Å; I210-M213 PolarHBondContact O-N 2.72Å; I210-M213 VanDerWaalsContact O-N 3.14Å; I210-S214 WeakPolarHBondContact O-CB 3.45Å; I210-S214 PolarHBondContact O-N 2.89Å; I210-F231 HydrophobicContact CB-CZ 4.37Å; I210-F231 HydrophobicContact CD1-CE1 4.14Å; I210-F231 HydrophobicContact CD1-CZ 4.43Å; I210-F231 HydrophobicContact CG1-CD1 4.45Å; I210-F231 HydrophobicContact CG1-CE1 3.51Å; I210-F231 HydrophobicContact CG1-CE2 4.21Å; I210-F231 HydrophobicContact CG1-CZ 3.37Å; I210-T284 HydrophobicContact CD1-CG2 4.07Å; I210-T284 WeakPolarHBondContact CD1-OG1 3.3Å; I210-L287 HydrophobicContact CB-CD1 4.12Å; I210-L287 HydrophobicContact CG2-CD1 3.35Å; I210-L287 HydrophobicContact CG2-CG 4.1Å; I210-L287 VanDerWaalsContact O-CD1 3.3Å; I210-L287 WeakPolarHBondContact O-CD1 3.32Å
211	M	57.7	Low	63.4	Low	38 Å²	38	31 Å²	31	19%	0.187	16%	0.162	C	C	.	.	H	α-helix	trans	-60.7	-35.3	177.4	-73.4	-176	-61	0	0	112.1	C207 R208 S214 I215 Y283	C207-M211 WeakPolarHBondContact O-CB 3.01Å; C207-M211 VanDerWaalsContact O-CG 3.28Å; C207-M211 WeakPolarHBondContact O-CG 3.46Å; C207-M211 PolarHBondContact O-N 2.78Å; R208-M211 HydrophobicContact CB-CE 4.38Å; R208-M211 HydrophobicContact CG-CE 3.81Å; R208-M211 PolarHBondContact O-N 2.63Å; M211-S214 WeakPolarHBondContact CA-OG 3.34Å; M211-S214 PolarHBondContact O-OG 3.18Å; M211-I215 WeakPolarHBondContact O-CD1 3.25Å; M211-I215 WeakPolarHBondContact O-CG1 2.89Å; M211-I215 PolarHBondContact O-N 3.5Å; M211-Y283 HydrophobicContact CG-CD1 4.36Å; M211-Y283 HydrophobicContact CG-CE1 4.49Å
212	T	57.2	Low	61	Low	34 Å²	34	37.6 Å²	37.6	21%	0.209	19%	0.187	C	C	.	.	H	α-helix	trans	-67.3	-44.7	175.8	-56.8	0	0	0	0	110.5	V98 R208 L209 I210 I215 L216	V98-T212 HydrophobicContact CB-CG2 4.04Å; V98-T212 HydrophobicContact CG2-CG2 3.74Å; R208-T212 WeakPolarHBondContact O-CB 3.18Å; R208-T212 PolarHBondContact O-N 2.7Å; R208-T212 PolarHBondContact O-OG1 3.47Å; L209-T212 WeakPolarHBondContact O-CB 3.34Å; L209-T212 PolarHBondContact O-N 2.71Å; I210-T212 PolarHBondContact O-N 3.3Å; T212-I215 PolarHBondContact O-N 2.9Å; T212-L216 WeakPolarHBondContact O-CG 3.19Å; T212-L216 PolarHBondContact O-N 2.97Å
213	M	57	Low	58.6	Low	10 Å²	10	44.8 Å²	44.8	5%	0.049	22%	0.218	C	C	.	.	H	α-helix	trans	-67.8	-33.1	177.9	-68.7	-63.3	-178.9	0	0	112.6	L209 I210 I215 L216 Y217 Y227 V230 F231 I312	L209-M213 HydrophobicContact CD1-CE 3.78Å; L209-M213 HydrophobicContact CD1-CG 4.06Å; L209-M213 HydrophobicContact CG-CG 4.47Å; L209-M213 WeakPolarHBondContact O-CB 3.48Å; L209-M213 VanDerWaalsContact O-CG 3.23Å; L209-M213 WeakPolarHBondContact O-CG 3.47Å; L209-M213 PolarHBondContact O-N 3.48Å; I210-M213 CarbonylContact O-C 3.58Å; I210-M213 PolarHBondContact O-N 2.72Å; I210-M213 VanDerWaalsContact O-N 3.14Å; M213-I215 VanDerWaalsContact C-N 3.31Å; M213-I215 PolarHBondContact O-N 3.3Å; M213-L216 PolarHBondContact O-N 2.93Å; M213-L216 HydrophobicContact SD-CD1 4.23Å; M213-Y217 PolarHBondContact O-N 3.39Å; M213-Y217 VanDerWaalsContact O-N 3.15Å; M213-Y227 HydrophobicContact CB-CE1 3.95Å; M213-Y227 WeakPolarHBondContact O-CE1 3.35Å; M213-Y227 PolarHBondContact O-OH 3.35Å; M213-V230 HydrophobicContact CE-CG1 4.47Å; M213-V230 HydrophobicContact CE-CG2 4.5Å; M213-F231 HydrophobicContact CB-CE2 4.24Å; M213-F231 HydrophobicContact CG-CE2 4.2Å; M213-F231 HydrophobicContact CG-CZ 4.47Å; M213-I312 HydrophobicContact CE-CD1 4.21Å
214	S	51.5	Low	56.3	Low	9 Å²	9	52.4 Å²	52.4	6%	0.063	25%	0.251	C	S	.	.	H	α-helix	trans	-68.1	-30.2	178.6	71	0	0	0	0	113.1	I210 M211 Y217	I210-S214 WeakPolarHBondContact O-CB 3.45Å; I210-S214 PolarHBondContact O-N 2.89Å; M211-S214 WeakPolarHBondContact CA-OG 3.34Å; M211-S214 PolarHBondContact O-OG 3.18Å; S214-Y217 WeakPolarHBondContact O-CB 3.48Å; S214-Y217 PolarHBondContact O-N 3.3Å
215	I	47.5	Very low	54.3	Low	31 Å²	31	55.1 Å²	55.1	16%	0.159	27%	0.267	C	S	.	.	H	α-helix	trans	-82.6	-26.6	178	-49.3	152.6	0	0	0	110.4	N97 L99 M211 T212 M213 Y217 Y298 L300	N97-I215 HydrophobicContact CB-CD1 3.71Å; N97-I215 WeakPolarHBondContact ND2-CD1 3.49Å; L99-I215 HydrophobicContact CD1-CB 3.46Å; L99-I215 VanDerWaalsContact CD1-CB 3.46Å; L99-I215 HydrophobicContact CD1-CG2 3.11Å; L99-I215 HydrophobicContact CG-CG2 4.44Å; M211-I215 WeakPolarHBondContact O-CD1 3.25Å; M211-I215 WeakPolarHBondContact O-CG1 2.89Å; M211-I215 PolarHBondContact O-N 3.5Å; T212-I215 PolarHBondContact O-N 2.9Å; M213-I215 VanDerWaalsContact C-N 3.31Å; M213-I215 PolarHBondContact O-N 3.3Å; I215-Y217 PolarHBondContact O-N 2.93Å; I215-Y298 HydrophobicContact CG1-CE2 4.02Å; I215-L300 HydrophobicContact CG2-CD2 4.03Å
216	L	46.3	Very low	52.5	Low	56 Å²	56	58.2 Å²	58.2	29%	0.293	29%	0.286	S	S	.	.	S	Bend	trans	-72.8	-10.4	168.1	-64.1	171.9	0	0	0	112.8	L99 T212 M213 Q218 I308	L99-L216 HydrophobicContact CD1-CD2 4.13Å; L99-L216 HydrophobicContact CD1-CG 4.47Å; L99-L216 HydrophobicContact CD2-CD2 3.91Å; L99-L216 HydrophobicContact CG-CD2 4.36Å; T212-L216 WeakPolarHBondContact O-CG 3.19Å; T212-L216 PolarHBondContact O-N 2.97Å; M213-L216 PolarHBondContact O-N 2.93Å; M213-L216 HydrophobicContact SD-CD1 4.23Å; L216-Q218 PolarHBondContact O-N 2.87Å; L216-I308 HydrophobicContact CD2-CD1 4.11Å
217	Y	46.1	Very low	50.8	Low	75 Å²	75	60.4 Å²	60.4	29%	0.294	29%	0.294	S	S	.	.			trans	-70.6	115.9	-177.5	-177.7	-99.4	0	0	0	111.1	M213 S214 I215 P219 Y227 L300	M213-Y217 PolarHBondContact O-N 3.39Å; M213-Y217 VanDerWaalsContact O-N 3.15Å; S214-Y217 WeakPolarHBondContact O-CB 3.48Å; S214-Y217 PolarHBondContact O-N 3.3Å; I215-Y217 PolarHBondContact O-N 2.93Å; Y217-P219 HydrophobicContact CE1-CG 4.45Å; Y217-Y227 WeakPolarHBondContact CA-OH 3.46Å; Y217-Y227 WeakPolarHBondContact CB-OH 3.45Å; Y217-Y227 HydrophobicContact CD2-CD2 4.09Å; Y217-Y227 HydrophobicContact CD2-CE1 4.27Å; Y217-Y227 AromaticContact CD2-CE2 3.56Å; Y217-Y227 HydrophobicContact CD2-CE2 3.56Å; Y217-Y227 AromaticContact CD2-CZ 3.68Å; Y217-Y227 HydrophobicContact CE2-CD2 4.48Å; Y217-Y227 HydrophobicContact CE2-CE2 4.32Å; Y217-Y227 HydrophobicContact CG-CE2 4.49Å; Y217-Y227 PolarHBondContact N-OH 3.22Å; Y217-L300 VanDerWaalsContact O-CD1 3.23Å; Y217-L300 WeakPolarHBondContact O-CD1 3.33Å
218	Q	43.7	Very low	49.4	Very low	56 Å²	56	63.9 Å²	63.9	26%	0.262	32%	0.318	S	S	.	.			trans	-100.6	119.1	173.1	-72.3	-177.9	-13.7	0	0	110.4	L216 S220 N221 F303 S304	L216-Q218 PolarHBondContact O-N 2.87Å; Q218-S220 PolarHBondContact O-N 3.38Å; Q218-N221 PolarHBondContact O-N 3.14Å; Q218-N221 PolarHBondContact OE1-ND2 3.08Å; Q218-F303 WeakPolarHBondContact CG-O 3.38Å; Q218-F303 PolarHBondContact NE2-O 3.38Å; Q218-S304 PolarHBondContact NE2-O 3.31Å
219	P	43.4	Very low	48.3	Very low	54 Å²	54	61 Å²	61	35%	0.351	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-27	177.7	-23.3	32.5	0	0	0	114.5	Y217 R222	Y217-P219 HydrophobicContact CE1-CG 4.45Å; P219-R222 WeakPolarHBondContact O-CG 3.15Å
220	S	41.3	Very low	47.4	Very low	60 Å²	60	61.1 Å²	61.1	42%	0.42	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-31.3	-177.5	53.5	0	0	0	0	113.3	Q218 R222	Q218-S220 PolarHBondContact O-N 3.38Å; S220-R222 PolarHBondContact O-N 3.44Å
221	N	40.9	Very low	47	Very low	63 Å²	63	61.8 Å²	61.8	34%	0.337	32%	0.318	S	S	.	.			trans	-94	69.8	176.4	-87.5	-38.4	0	0	0	110.6	Q218 K223	Q218-N221 PolarHBondContact O-N 3.14Å; Q218-N221 PolarHBondContact OE1-ND2 3.08Å; N221-K223 PolarHBondContact O-N 3.18Å
222	R	39.5	Very low	47.2	Very low	190 Å²	190	62.5 Å²	62.5	72%	0.717	32%	0.323	S	S	*	.			trans	-66.1	29.8	174.4	-66	-172.5	-178.9	-178.7	-1.1	114.4	P219 S220 K224	P219-R222 WeakPolarHBondContact O-CG 3.15Å; S220-R222 PolarHBondContact O-N 3.44Å; R222-K224 VanDerWaalsContact C-N 3.35Å; R222-K224 PolarHBondContact O-N 3.1Å
223	K	39.7	Very low	47.3	Very low	150 Å²	150	63.1 Å²	63.1	65%	0.652	33%	0.328	S	S	*	.			trans	-74.8	95	166.7	-73.9	-169.8	-179.7	180	0	107.5	N221 S225	N221-K223 PolarHBondContact O-N 3.18Å; K223-S225 PolarHBondContact O-N 2.97Å
224	K	40.7	Very low	47.6	Very low	160 Å²	160	65.3 Å²	65.3	70%	0.696	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-38.9	-28.7	168.5	-87.7	-178.2	169.8	-175.8	0	113.5	R222 V226 Y227 S228	R222-K224 VanDerWaalsContact C-N 3.35Å; R222-K224 PolarHBondContact O-N 3.1Å; K224-V226 PolarHBondContact O-N 3.28Å; K224-Y227 PolarHBondContact O-N 2.64Å; K224-S228 VanDerWaalsContact O-CB 3.31Å; K224-S228 WeakPolarHBondContact O-CB 3.38Å; K224-S228 PolarHBondContact O-N 2.9Å; K224-S228 PolarHBondContact O-OG 3.16Å
225	S	42.2	Very low	48.2	Very low	75 Å²	75	65.2 Å²	65.2	52%	0.524	34%	0.339	S	S	.	.	H	α-helix	trans	-58.4	-34.8	-170.7	63.9	0	0	0	0	116.1	K223 S228 G229	K223-S225 PolarHBondContact O-N 2.97Å; S225-S228 WeakPolarHBondContact CA-OG 3.41Å; S225-G229 PolarHBondContact O-N 2.8Å
226	V	44.5	Very low	49.3	Very low	65 Å²	65	63.9 Å²	63.9	39%	0.394	33%	0.332	S	S	.	.	H	α-helix	trans	-73.8	-39.3	-176.2	-176.1	0	0	0	0	110.9	K224 V230 L314	K224-V226 PolarHBondContact O-N 3.28Å; V226-V230 WeakPolarHBondContact O-CG2 3.39Å; V226-L314 HydrophobicContact CG1-CD1 4.37Å
227	Y	47.5	Very low	50.3	Low	47 Å²	47	62.1 Å²	62.1	18%	0.184	32%	0.324	C	S	.	.	H	α-helix	trans	-86.4	-38.5	-179.3	-71.1	-90.2	0	0	0	113	M213 Y217 K224 G229 V230 F231	M213-Y227 HydrophobicContact CB-CE1 3.95Å; M213-Y227 WeakPolarHBondContact O-CE1 3.35Å; M213-Y227 PolarHBondContact O-OH 3.35Å; Y217-Y227 WeakPolarHBondContact CA-OH 3.46Å; Y217-Y227 WeakPolarHBondContact CB-OH 3.45Å; Y217-Y227 HydrophobicContact CD2-CD2 4.09Å; Y217-Y227 HydrophobicContact CD2-CE1 4.27Å; Y217-Y227 AromaticContact CD2-CE2 3.56Å; Y217-Y227 HydrophobicContact CD2-CE2 3.56Å; Y217-Y227 AromaticContact CD2-CZ 3.68Å; Y217-Y227 HydrophobicContact CE2-CD2 4.48Å; Y217-Y227 HydrophobicContact CE2-CE2 4.32Å; Y217-Y227 HydrophobicContact CG-CE2 4.49Å; Y217-Y227 PolarHBondContact N-OH 3.22Å; K224-Y227 PolarHBondContact O-N 2.64Å; Y227-G229 PolarHBondContact O-N 3.14Å; Y227-V230 PolarHBondContact O-N 2.94Å; Y227-F231 PolarHBondContact O-N 3.37Å
228	S	44.8	Very low	51.4	Low	77 Å²	77	59.5 Å²	59.5	54%	0.538	32%	0.315	S	S	.	.	H	α-helix	trans	-62.7	-21.2	173.1	68	0	0	0	0	112.3	K224 S225	K224-S228 VanDerWaalsContact O-CB 3.31Å; K224-S228 WeakPolarHBondContact O-CB 3.38Å; K224-S228 PolarHBondContact O-N 2.9Å; K224-S228 PolarHBondContact O-OG 3.16Å; S225-S228 WeakPolarHBondContact CA-OG 3.41Å
229	G	47.1	Very low	53	Low	21 Å²	21	57 Å²	57	22%	0.216	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-24.5	172.5	0	0	0	0	0	114.5	S225 Y227 G316	S225-G229 PolarHBondContact O-N 2.8Å; Y227-G229 PolarHBondContact O-N 3.14Å; G229-G316 WeakPolarHBondContact O-CA 3.23Å; G229-G316 PolarHBondContact O-N 2.94Å
230	V	51.4	Low	54.7	Low	12 Å²	12	55.1 Å²	55.1	7%	0.073	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-41.3	-178.9	179.1	0	0	0	0	111.7	M213 V226 Y227 L314	M213-V230 HydrophobicContact CE-CG1 4.47Å; M213-V230 HydrophobicContact CE-CG2 4.5Å; V226-V230 WeakPolarHBondContact O-CG2 3.39Å; Y227-V230 PolarHBondContact O-N 2.94Å; V230-L314 HydrophobicContact CG2-CD2 3.42Å; V230-L314 VanDerWaalsContact CG2-CD2 3.42Å
231	F	58	Low	56.5	Low	15 Å²	15	56.1 Å²	56.1	7%	0.066	28%	0.284	C	S	.	.			trans	-121.5	98.1	-179.6	-55.6	-75.2	0	0	0	109	H206 L209 I210 M213 Y227 S233	H206-F231 AromaticContact NE2-CD1 3.84Å; H206-F231 AromaticContact NE2-CE1 3.58Å; L209-F231 HydrophobicContact CD2-CE1 4.22Å; L209-F231 HydrophobicContact CD2-CZ 4.18Å; L209-F231 HydrophobicContact CG-CE1 4.48Å; L209-F231 HydrophobicContact CG-CZ 4.02Å; I210-F231 HydrophobicContact CB-CZ 4.37Å; I210-F231 HydrophobicContact CD1-CE1 4.14Å; I210-F231 HydrophobicContact CD1-CZ 4.43Å; I210-F231 HydrophobicContact CG1-CD1 4.45Å; I210-F231 HydrophobicContact CG1-CE1 3.51Å; I210-F231 HydrophobicContact CG1-CE2 4.21Å; I210-F231 HydrophobicContact CG1-CZ 3.37Å; M213-F231 HydrophobicContact CB-CE2 4.24Å; M213-F231 HydrophobicContact CG-CE2 4.2Å; M213-F231 HydrophobicContact CG-CZ 4.47Å; Y227-F231 PolarHBondContact O-N 3.37Å; F231-S233 PolarHBondContact O-N 3.02Å
232	D	60.1	Low	58.4	Low	52 Å²	52	53.4 Å²	53.4	28%	0.278	27%	0.271	S	S	.	.			trans	-72.5	118.2	165.6	178.8	-4.6	0	0	0	108.4	L234 Q235 Q236	D232-L234 PolarHBondContact O-N 3.45Å; D232-L234 WeakPolarHBondContact OD1-CB 3.48Å; D232-L234 PolarHBondContact OD1-N 3.01Å; D232-Q235 HydrophobicContact CB-CB 4.1Å; D232-Q235 HydrophobicContact CB-CG 3.65Å; D232-Q235 PolarHBondContact O-N 3Å; D232-Q235 VanDerWaalsContact O-N 3.09Å; D232-Q235 WeakPolarHBondContact OD2-CG 3.45Å; D232-Q236 WeakPolarHBondContact O-CG 3.43Å; D232-Q236 PolarHBondContact O-N 3.44Å
233	S	60.3	Low	60.7	Low	47 Å²	47	44.4 Å²	44.4	33%	0.329	24%	0.237	S	C	.	.	H	α-helix	trans	-56.1	-35.4	178.9	51.7	0	0	0	0	112.6	F231 Q236 S237	F231-S233 PolarHBondContact O-N 3.02Å; S233-Q236 PolarHBondContact O-N 3.05Å; S233-S237 PolarHBondContact O-N 3.45Å
234	L	62.5	Low	62.9	Low	56 Å²	56	37.4 Å²	37.4	29%	0.293	21%	0.207	S	C	.	.	H	α-helix	trans	-66.3	-45	177.8	-179	64.4	0	0	0	110.5	D232 Q236 S237 I238 F332 L336	D232-L234 PolarHBondContact O-N 3.45Å; D232-L234 WeakPolarHBondContact OD1-CB 3.48Å; D232-L234 PolarHBondContact OD1-N 3.01Å; L234-Q236 VanDerWaalsContact C-N 3.32Å; L234-Q236 PolarHBondContact O-N 2.86Å; L234-S237 PolarHBondContact O-N 3.42Å; L234-I238 HydrophobicContact CD1-CD1 4.31Å; L234-I238 HydrophobicContact CG-CD1 3.92Å; L234-I238 WeakPolarHBondContact O-CD1 3.17Å; L234-I238 VanDerWaalsContact O-CG1 3.26Å; L234-I238 WeakPolarHBondContact O-CG1 3.13Å; L234-I238 PolarHBondContact O-N 2.91Å; L234-F332 HydrophobicContact CD1-CD1 3.74Å; L234-F332 HydrophobicContact CD1-CE1 3.45Å; L234-F332 VanDerWaalsContact CD1-CE1 3.45Å; L234-F332 HydrophobicContact CD1-CZ 4.04Å; L234-L336 HydrophobicContact CD1-CD1 4.4Å
235	Q	63.9	Low	65	Low	8 Å²	8	31.3 Å²	31.3	4%	0.037	18%	0.18	C	C	.	.	H	α-helix	trans	-66.4	-36.4	178.7	-54.9	-55	-14.9	0	0	112.2	D232 I238 R239 Y317 L319	D232-Q235 HydrophobicContact CB-CB 4.1Å; D232-Q235 HydrophobicContact CB-CG 3.65Å; D232-Q235 PolarHBondContact O-N 3Å; D232-Q235 VanDerWaalsContact O-N 3.09Å; D232-Q235 WeakPolarHBondContact OD2-CG 3.45Å; Q235-I238 PolarHBondContact O-N 2.75Å; Q235-R239 WeakPolarHBondContact O-CB 3.13Å; Q235-R239 PolarHBondContact O-N 3.14Å; Q235-Y317 HydrophobicContact CB-CE2 4.47Å; Q235-L319 HydrophobicContact CB-CB 4.21Å; Q235-L319 HydrophobicContact CG-CB 4.3Å
236	Q	70.5	Confident	67.2	Low	2 Å²	2	27.9 Å²	27.9	1%	0.009	16%	0.156	C	C	.	.	H	α-helix	trans	-65.3	-44.2	174.7	-66.7	-60	-31.7	0	0	111.5	H206 D232 S233 L234 I238 R239 F240 T284 Y317	H206-Q236 PolarHBondContact CE1-OE1 3.39Å; H206-Q236 PolarHBondContact NE2-NE2 2.71Å; H206-Q236 PolarHBondContact NE2-OE1 2.87Å; D232-Q236 WeakPolarHBondContact O-CG 3.43Å; D232-Q236 PolarHBondContact O-N 3.44Å; S233-Q236 PolarHBondContact O-N 3.05Å; L234-Q236 VanDerWaalsContact C-N 3.32Å; L234-Q236 PolarHBondContact O-N 2.86Å; Q236-I238 PolarHBondContact O-N 3.47Å; Q236-R239 PolarHBondContact O-N 2.88Å; Q236-F240 HydrophobicContact CB-CD2 4.4Å; Q236-F240 HydrophobicContact CB-CE2 4.04Å; Q236-F240 WeakPolarHBondContact O-CB 3.35Å; Q236-F240 WeakPolarHBondContact O-CD2 3.4Å; Q236-F240 WeakPolarHBondContact O-CG 3.17Å; Q236-F240 PolarHBondContact O-N 2.84Å; Q236-T284 HydrophobicContact CB-CG2 4.26Å; Q236-T284 HydrophobicContact CG-CG2 3.94Å; Q236-Y317 PolarHBondContact NE2-OH 2.67Å
237	S	67.8	Low	69.3	Low	19 Å²	19	24.8 Å²	24.8	13%	0.133	14%	0.137	C	C	.	.	H	α-helix	trans	-61.5	-43.9	174.6	175.9	0	0	0	0	111.9	S233 L234 R239 F240 R241 E391	S233-S237 PolarHBondContact O-N 3.45Å; L234-S237 PolarHBondContact O-N 3.42Å; S237-R239 PolarHBondContact O-N 3.13Å; S237-F240 PolarHBondContact O-N 2.61Å; S237-R241 VanDerWaalsContact O-CB 3.3Å; S237-R241 WeakPolarHBondContact O-CB 3.37Å; S237-R241 PolarHBondContact O-N 3.35Å; S237-E391 PolarHBondContact OG-OE1 2.78Å
238	I	69.5	Low	71.2	Confident	20 Å²	20	22.6 Å²	22.6	10%	0.103	13%	0.129	C	C	.	.	H	α-helix	trans	-60	-48.2	175.2	-66.9	158.1	0	0	0	111	L234 Q235 Q236 R241 A242 L319 I323	L234-I238 HydrophobicContact CD1-CD1 4.31Å; L234-I238 HydrophobicContact CG-CD1 3.92Å; L234-I238 WeakPolarHBondContact O-CD1 3.17Å; L234-I238 VanDerWaalsContact O-CG1 3.26Å; L234-I238 WeakPolarHBondContact O-CG1 3.13Å; L234-I238 PolarHBondContact O-N 2.91Å; Q235-I238 PolarHBondContact O-N 2.75Å; Q236-I238 PolarHBondContact O-N 3.47Å; I238-R241 PolarHBondContact O-N 2.72Å; I238-A242 WeakPolarHBondContact O-CB 3.24Å; I238-A242 PolarHBondContact O-N 3.3Å; I238-L319 HydrophobicContact CG2-CD2 4.03Å; I238-I323 HydrophobicContact CD1-CD1 3.7Å; I238-I323 HydrophobicContact CD1-CG1 4.2Å; I238-I323 HydrophobicContact CG1-CD1 4.29Å; I238-I323 HydrophobicContact CG2-CG1 4.22Å
239	R	76.9	Confident	73.3	Confident	3 Å²	3	23.1 Å²	23.1	1%	0.011	12%	0.123	C	C	.	.	H	α-helix	trans	-57.9	-51	178.5	-178.6	179.6	-174.4	-110	-5.9	110.8	D177 H206 Q235 Q236 S237 R241 A242 Y243 D280 L319	D177-R239 IonicContact OD1-CZ 3.9Å; D177-R239 IonicContact OD1-NE 2.79Å; D177-R239 PolarHBondContact OD1-NE 2.92Å; D177-R239 IonicContact OD1-NH2 2.89Å; D177-R239 PolarHBondContact OD1-NH2 3.26Å; D177-R239 IonicContact OD2-CZ 2.84Å; D177-R239 IonicContact OD2-NE 2.97Å; D177-R239 PolarHBondContact OD2-NE 3.14Å; D177-R239 IonicContact OD2-NH2 2.89Å; H206-R239 PolarHBondContact CE1-NH1 3.3Å; H206-R239 VanDerWaalsContact CG-NH1 3.32Å; H206-R239 PolarHBondContact ND1-NH1 3.15Å; H206-R239 VanDerWaalsContact ND1-NH1 3.14Å; Q235-R239 WeakPolarHBondContact O-CB 3.13Å; Q235-R239 PolarHBondContact O-N 3.14Å; Q236-R239 PolarHBondContact O-N 2.88Å; S237-R239 PolarHBondContact O-N 3.13Å; R239-R241 VanDerWaalsContact C-N 3.35Å; R239-R241 PolarHBondContact O-N 3.32Å; R239-A242 PolarHBondContact O-N 3.01Å; R239-Y243 HydrophobicContact CG-CD2 3.87Å; R239-Y243 HydrophobicContact CG-CE2 3.9Å; R239-Y243 VanDerWaalsContact O-CD2 3.23Å; R239-Y243 WeakPolarHBondContact O-CD2 3.48Å; R239-Y243 PolarHBondContact O-N 3.38Å; R239-D280 IonicContact CZ-OD2 3.91Å; R239-D280 IonicContact NH1-OD2 3.86Å; R239-D280 PolarHBondContact NH1-OD2 2.83Å; R239-L319 HydrophobicContact CB-CD2 4.43Å
240	F	79	Confident	75.3	Confident	15 Å²	15	22.1 Å²	22.1	7%	0.066	11%	0.113	C	C	.	.	H	α-helix	trans	-62.5	-42	-179.8	-68.8	-47.2	0	0	0	112.1	Q236 S237 Y243 S244 Y277 N281 T284	Q236-F240 HydrophobicContact CB-CD2 4.4Å; Q236-F240 HydrophobicContact CB-CE2 4.04Å; Q236-F240 WeakPolarHBondContact O-CB 3.35Å; Q236-F240 WeakPolarHBondContact O-CD2 3.4Å; Q236-F240 WeakPolarHBondContact O-CG 3.17Å; Q236-F240 PolarHBondContact O-N 2.84Å; S237-F240 PolarHBondContact O-N 2.61Å; F240-Y243 PolarHBondContact O-N 2.77Å; F240-S244 WeakPolarHBondContact O-CB 3.11Å; F240-S244 PolarHBondContact O-N 2.88Å; F240-S244 PolarHBondContact O-OG 3.19Å; F240-Y277 HydrophobicContact CB-CE2 4.26Å; F240-Y277 HydrophobicContact CD1-CD2 4.28Å; F240-Y277 AromaticContact CD1-CE2 3.65Å; F240-Y277 HydrophobicContact CD1-CE2 3.65Å; F240-Y277 HydrophobicContact CG-CE2 4.4Å; F240-Y277 PolarHBondContact O-OH 3.49Å; F240-N281 HydrophobicContact CD1-CB 4.21Å; F240-N281 HydrophobicContact CE1-CB 3.9Å; F240-N281 HydrophobicContact CZ-CB 4.11Å; F240-T284 HydrophobicContact CE2-CG2 3.86Å; F240-T284 HydrophobicContact CZ-CG2 3.9Å; F240-T284 WeakPolarHBondContact CZ-OG1 3.25Å
241	R	79.2	Confident	77.1	Confident	81 Å²	81	21.8 Å²	21.8	31%	0.306	11%	0.11	S	C	.	.	H	α-helix	trans	-66	-39.7	177.9	-168.8	175	-174.2	-171.2	-1.7	113.5	S237 I238 R239 S244 H245	S237-R241 VanDerWaalsContact O-CB 3.3Å; S237-R241 WeakPolarHBondContact O-CB 3.37Å; S237-R241 PolarHBondContact O-N 3.35Å; I238-R241 PolarHBondContact O-N 2.72Å; R239-R241 VanDerWaalsContact C-N 3.35Å; R239-R241 PolarHBondContact O-N 3.32Å; R241-S244 WeakPolarHBondContact CA-OG 3.03Å; R241-S244 PolarHBondContact O-OG 2.86Å; R241-H245 VanDerWaalsContact O-CG 3.25Å; R241-H245 PolarHBondContact O-N 2.77Å; R241-H245 PolarHBondContact O-ND1 3.3Å
242	A	80.8	Confident	78.5	Confident	7 Å²	7	22 Å²	22	6%	0.058	11%	0.112	C	C	.	.	H	α-helix	trans	-62.9	-45.5	175.4	0	0	0	0	0	110.7	I238 R239 L246	I238-A242 WeakPolarHBondContact O-CB 3.24Å; I238-A242 PolarHBondContact O-N 3.3Å; R239-A242 PolarHBondContact O-N 3.01Å; A242-L246 WeakPolarHBondContact O-CD1 3.32Å; A242-L246 VanDerWaalsContact O-CG 3.29Å; A242-L246 WeakPolarHBondContact O-CG 3.25Å; A242-L246 PolarHBondContact O-N 2.84Å; A242-L246 VanDerWaalsContact O-N 3.17Å
243	Y	88.6	Confident	79.7	Confident	1 Å²	1	21.1 Å²	21.1	0%	0.004	11%	0.107	C	C	.	.	H	α-helix	trans	-69.1	-42.3	179.2	-82.9	-65.8	0	0	0	113.5	D177 V180 L181 L184 F203 R239 F240 H245 L246 I247	D177-Y243 PolarHBondContact OD1-OH 3.38Å; V180-Y243 HydrophobicContact CG1-CE1 3.69Å; V180-Y243 WeakPolarHBondContact CG1-OH 3.05Å; L181-Y243 HydrophobicContact CD2-CD1 4.47Å; L181-Y243 HydrophobicContact CD2-CE1 4.12Å; L184-Y243 HydrophobicContact CD1-CD1 3.96Å; L184-Y243 HydrophobicContact CD1-CE1 3.74Å; F203-Y243 HydrophobicContact CE1-CD1 4.3Å; F203-Y243 AromaticContact CE1-CD2 3.59Å; F203-Y243 HydrophobicContact CE1-CD2 3.59Å; F203-Y243 HydrophobicContact CE1-CE1 4.48Å; F203-Y243 AromaticContact CE1-CE2 3.81Å; F203-Y243 HydrophobicContact CE1-CE2 3.81Å; F203-Y243 AromaticContact CE1-CG 3.87Å; F203-Y243 HydrophobicContact CE1-CG 3.87Å; F203-Y243 HydrophobicContact CE2-CD1 4.24Å; F203-Y243 HydrophobicContact CE2-CE1 4.46Å; F203-Y243 HydrophobicContact CE2-CG 4.48Å; F203-Y243 AromaticContact CZ-CD1 3.49Å; F203-Y243 HydrophobicContact CZ-CD1 3.49Å; F203-Y243 VanDerWaalsContact CZ-CD1 3.49Å; F203-Y243 AromaticContact CZ-CD2 3.61Å; F203-Y243 HydrophobicContact CZ-CD2 3.61Å; F203-Y243 AromaticContact CZ-CE1 3.84Å; F203-Y243 HydrophobicContact CZ-CE1 3.84Å; F203-Y243 AromaticContact CZ-CE2 3.96Å; F203-Y243 HydrophobicContact CZ-CE2 3.96Å; F203-Y243 AromaticContact CZ-CG 3.37Å; F203-Y243 HydrophobicContact CZ-CG 3.37Å; R239-Y243 HydrophobicContact CG-CD2 3.87Å; R239-Y243 HydrophobicContact CG-CE2 3.9Å; R239-Y243 VanDerWaalsContact O-CD2 3.23Å; R239-Y243 WeakPolarHBondContact O-CD2 3.48Å; R239-Y243 PolarHBondContact O-N 3.38Å; F240-Y243 PolarHBondContact O-N 2.77Å; Y243-H245 PolarHBondContact O-N 2.95Å; Y243-L246 PolarHBondContact O-N 3.44Å; Y243-I247 WeakPolarHBondContact O-CB 3.02Å; Y243-I247 WeakPolarHBondContact O-CD1 3.38Å; Y243-I247 WeakPolarHBondContact O-CG1 3.34Å; Y243-I247 PolarHBondContact O-N 3.44Å
244	S	86.4	Confident	80.8	Confident	3 Å²	3	19.1 Å²	19.1	2%	0.021	9%	0.093	C	C	.	.	H	α-helix	trans	-57.4	-51.2	177.7	66	0	0	0	0	110.1	F240 R241 L246 I247 I248	F240-S244 WeakPolarHBondContact O-CB 3.11Å; F240-S244 PolarHBondContact O-N 2.88Å; F240-S244 PolarHBondContact O-OG 3.19Å; R241-S244 WeakPolarHBondContact CA-OG 3.03Å; R241-S244 PolarHBondContact O-OG 2.86Å; S244-L246 PolarHBondContact O-N 3.33Å; S244-I247 PolarHBondContact O-N 3.22Å; S244-I248 VanDerWaalsContact O-CB 3.29Å; S244-I248 WeakPolarHBondContact O-CB 3.38Å; S244-I248 WeakPolarHBondContact O-CD1 3.39Å; S244-I248 WeakPolarHBondContact O-CG1 3.28Å; S244-I248 PolarHBondContact O-N 3.48Å
245	H	84.6	Confident	81.7	Confident	31 Å²	31	21.2 Å²	21.2	14%	0.144	10%	0.097	C	C	.	.	H	α-helix	trans	-56.7	-45.8	176.9	-69.7	157.8	0	0	0	113.1	R241 Y243 I248 Q249 H326 D394 Y454	R241-H245 VanDerWaalsContact O-CG 3.25Å; R241-H245 PolarHBondContact O-N 2.77Å; R241-H245 PolarHBondContact O-ND1 3.3Å; Y243-H245 PolarHBondContact O-N 2.95Å; H245-I248 WeakPolarHBondContact O-CB 3.4Å; H245-I248 PolarHBondContact O-N 2.96Å; H245-Q249 WeakPolarHBondContact O-CG 3.46Å; H245-Q249 PolarHBondContact O-N 3.04Å; H245-H326 AromaticContact ND1-CE1 3.59Å; H245-D394 IonicContact CD2-OD2 2.92Å; H245-D394 IonicContact NE2-OD2 2.73Å; H245-D394 PolarHBondContact NE2-OD2 3.22Å; H245-Y454 PolarHBondContact CD2-OH 3.03Å; H245-Y454 VanDerWaalsContact CD2-OH 3.22Å
246	L	87.6	Confident	82.5	Confident	3 Å²	3	27.5 Å²	27.5	2%	0.016	13%	0.126	C	C	.	.	H	α-helix	trans	-68.8	-39	-178.8	-71	167.4	0	0	0	112.2	L181 L184 A242 Y243 S244 Q249 C250	L181-L246 HydrophobicContact CD2-CD1 3.39Å; L184-L246 HydrophobicContact CB-CB 4.37Å; L184-L246 HydrophobicContact CB-CD1 3.86Å; L184-L246 HydrophobicContact CB-CD2 4.25Å; L184-L246 HydrophobicContact CB-CG 4.4Å; L184-L246 HydrophobicContact CD1-CB 4.24Å; L184-L246 HydrophobicContact CD1-CD1 3.96Å; A242-L246 WeakPolarHBondContact O-CD1 3.32Å; A242-L246 VanDerWaalsContact O-CG 3.29Å; A242-L246 WeakPolarHBondContact O-CG 3.25Å; A242-L246 PolarHBondContact O-N 2.84Å; A242-L246 VanDerWaalsContact O-N 3.17Å; Y243-L246 PolarHBondContact O-N 3.44Å; S244-L246 PolarHBondContact O-N 3.33Å; L246-Q249 PolarHBondContact O-N 3.09Å; L246-C250 PolarHBondContact O-N 3.48Å; L246-C250 PolarHBondContact O-SG 2.82Å
247	I	89.8	Confident	82.8	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-64.7	-44.3	174.7	-69.7	167.9	0	0	0	110.1	Y243 S244 Q249 C250 Y251 L270 T273 Y277 M398	Y243-I247 WeakPolarHBondContact O-CB 3.02Å; Y243-I247 WeakPolarHBondContact O-CD1 3.38Å; Y243-I247 WeakPolarHBondContact O-CG1 3.34Å; Y243-I247 PolarHBondContact O-N 3.44Å; S244-I247 PolarHBondContact O-N 3.22Å; I247-Q249 VanDerWaalsContact C-N 3.3Å; I247-Q249 PolarHBondContact O-N 3.17Å; I247-C250 WeakPolarHBondContact O-CA 3.02Å; I247-C250 WeakPolarHBondContact O-CB 3.48Å; I247-C250 PolarHBondContact O-N 3.44Å; I247-Y251 HydrophobicContact CG2-CD2 3.92Å; I247-Y251 HydrophobicContact CG2-CE2 3.6Å; I247-Y251 WeakPolarHBondContact O-CD2 3.04Å; I247-Y251 PolarHBondContact O-N 2.92Å; I247-L270 HydrophobicContact CG2-CD1 3.94Å; I247-T273 HydrophobicContact CD1-CG2 4.06Å; I247-T273 HydrophobicContact CG1-CG2 4.36Å; I247-Y277 HydrophobicContact CD1-CD2 4.29Å; I247-Y277 HydrophobicContact CD1-CG 4.13Å; I247-M398 HydrophobicContact CB-SD 4.29Å; I247-M398 HydrophobicContact CD1-SD 4.4Å; I247-M398 HydrophobicContact CG2-CG 3.84Å; I247-M398 HydrophobicContact CG2-SD 3.69Å
248	I	87.4	Confident	82.5	Confident	2 Å²	2	38.3 Å²	38.3	1%	0.01	17%	0.169	C	C	.	.	H	α-helix	trans	-56.5	-44.6	174.8	-72.8	167.5	0	0	0	110.8	S244 H245 C250 Y251 N252 D394 V397 M398 Y454 W457	S244-I248 VanDerWaalsContact O-CB 3.29Å; S244-I248 WeakPolarHBondContact O-CB 3.38Å; S244-I248 WeakPolarHBondContact O-CD1 3.39Å; S244-I248 WeakPolarHBondContact O-CG1 3.28Å; S244-I248 PolarHBondContact O-N 3.48Å; H245-I248 WeakPolarHBondContact O-CB 3.4Å; H245-I248 PolarHBondContact O-N 2.96Å; I248-C250 VanDerWaalsContact C-N 3.32Å; I248-C250 PolarHBondContact O-N 2.84Å; I248-Y251 PolarHBondContact O-N 3.04Å; I248-N252 PolarHBondContact O-N 2.62Å; I248-N252 VanDerWaalsContact O-N 3.08Å; I248-D394 HydrophobicContact CD1-CB 4.11Å; I248-D394 VanDerWaalsContact CD1-O 3.32Å; I248-D394 WeakPolarHBondContact CD1-O 3.18Å; I248-V397 HydrophobicContact CD1-CB 4.3Å; I248-V397 HydrophobicContact CD1-CG1 4.22Å; I248-V397 HydrophobicContact CG1-CG1 4.24Å; I248-V397 HydrophobicContact CG2-CG1 3.78Å; I248-M398 HydrophobicContact CD1-CB 4.45Å; I248-M398 HydrophobicContact CG1-CB 3.87Å; I248-Y454 HydrophobicContact CG2-CE1 4.34Å; I248-W457 HydrophobicContact CG2-CZ2 4.35Å
249	Q	87.4	Confident	81.9	Confident	88 Å²	88	42 Å²	42	41%	0.411	19%	0.193	S	C	.	.	H	α-helix	trans	-63.4	-36.2	174.5	-70.6	177.1	6.2	0	0	112.8	H245 L246 I247 Y251 N252 N253	H245-Q249 WeakPolarHBondContact O-CG 3.46Å; H245-Q249 PolarHBondContact O-N 3.04Å; L246-Q249 PolarHBondContact O-N 3.09Å; I247-Q249 VanDerWaalsContact C-N 3.3Å; I247-Q249 PolarHBondContact O-N 3.17Å; Q249-Y251 VanDerWaalsContact C-N 3.34Å; Q249-N252 WeakPolarHBondContact O-CB 3.07Å; Q249-N252 PolarHBondContact O-N 2.75Å; Q249-N253 VanDerWaalsContact O-CG 3.32Å; Q249-N253 PolarHBondContact O-N 3.32Å
250	C	89.7	Confident	80.9	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-64.6	-38.2	175.4	-69.5	0	0	0	0	112.1	K192 F193 C196 L246 I247 I248 N253 L254 L270	K192-C250 WeakPolarHBondContact CE-SG 3.32Å; F193-C250 HydrophobicContact CE1-CB 4.04Å; C196-C250 PolarHBondContact SG-SG 3.19Å; L246-C250 PolarHBondContact O-N 3.48Å; L246-C250 PolarHBondContact O-SG 2.82Å; I247-C250 WeakPolarHBondContact O-CA 3.02Å; I247-C250 WeakPolarHBondContact O-CB 3.48Å; I247-C250 PolarHBondContact O-N 3.44Å; I248-C250 VanDerWaalsContact C-N 3.32Å; I248-C250 PolarHBondContact O-N 2.84Å; C250-N253 PolarHBondContact O-N 3.35Å; C250-L254 PolarHBondContact O-N 3.04Å; C250-L270 HydrophobicContact CB-CD1 3.51Å; C250-L270 HydrophobicContact CB-CD2 3.99Å; C250-L270 HydrophobicContact CB-CG 4.4Å
251	Y	90.1	Very high	79.7	Confident	5 Å²	5	56 Å²	56	2%	0.02	25%	0.253	C	S	.	.	H	α-helix	trans	-62.3	-43.4	171.7	-79.9	-68.3	0	0	0	111.6	I247 I248 Q249 N253 L254 R255 L270 T274 M398 G401 L402 E405	I247-Y251 HydrophobicContact CG2-CD2 3.92Å; I247-Y251 HydrophobicContact CG2-CE2 3.6Å; I247-Y251 WeakPolarHBondContact O-CD2 3.04Å; I247-Y251 PolarHBondContact O-N 2.92Å; I248-Y251 PolarHBondContact O-N 3.04Å; Q249-Y251 VanDerWaalsContact C-N 3.34Å; Y251-N253 VanDerWaalsContact C-N 3.31Å; Y251-N253 PolarHBondContact O-N 3.01Å; Y251-L254 PolarHBondContact O-N 3.23Å; Y251-R255 WeakPolarHBondContact O-CB 3.3Å; Y251-R255 PolarHBondContact O-N 3.48Å; Y251-L270 HydrophobicContact CD1-CD2 3.4Å; Y251-L270 HydrophobicContact CD1-CG 4.3Å; Y251-L270 HydrophobicContact CD2-CD2 3.88Å; Y251-L270 HydrophobicContact CD2-CG 4.33Å; Y251-L270 HydrophobicContact CE1-CD2 3.49Å; Y251-L270 VanDerWaalsContact CE1-CD2 3.49Å; Y251-L270 HydrophobicContact CE1-CG 3.94Å; Y251-L270 HydrophobicContact CE2-CD1 4.29Å; Y251-L270 HydrophobicContact CE2-CD2 3.97Å; Y251-L270 HydrophobicContact CE2-CG 3.97Å; Y251-L270 HydrophobicContact CG-CD2 3.59Å; Y251-L270 HydrophobicContact CG-CG 4.47Å; Y251-T274 PolarHBondContact OH-OG1 2.92Å; Y251-M398 HydrophobicContact CD2-CG 4.44Å; Y251-M398 HydrophobicContact CE2-CG 3.99Å; Y251-G401 VanDerWaalsContact CD1-C 3.49Å; Y251-G401 WeakPolarHBondContact CD1-O 3.49Å; Y251-L402 HydrophobicContact CE1-CB 4.37Å; Y251-L402 VanDerWaalsContact OH-CD1 3.25Å; Y251-L402 WeakPolarHBondContact OH-CD1 3.15Å; Y251-E405 HydrophobicContact CD1-CG 3.85Å; Y251-E405 HydrophobicContact CE1-CB 4.46Å; Y251-E405 HydrophobicContact CE1-CG 3.83Å
252	N	85.6	Confident	78.7	Confident	18 Å²	18	56.6 Å²	56.6	10%	0.096	27%	0.267	C	S	.	.	H	α-helix	trans	-60.1	-41.8	175	-73.7	-18.9	0	0	0	112.6	I248 Q249 L254 R255 Q256 G456 W457	I248-N252 PolarHBondContact O-N 2.62Å; I248-N252 VanDerWaalsContact O-N 3.08Å; Q249-N252 WeakPolarHBondContact O-CB 3.07Å; Q249-N252 PolarHBondContact O-N 2.75Å; N252-L254 PolarHBondContact O-N 3.41Å; N252-R255 PolarHBondContact O-N 2.99Å; N252-Q256 WeakPolarHBondContact O-CG 3.26Å; N252-Q256 PolarHBondContact O-N 3.32Å; N252-G456 PolarHBondContact ND2-O 2.99Å; N252-W457 PolarHBondContact ND2-NE1 3.1Å; N252-W457 PolarHBondContact OD1-NE1 2.96Å; N252-W457 VanDerWaalsContact OD1-NE1 3.08Å
253	N	85.8	Confident	78.2	Confident	34 Å²	34	56.8 Å²	56.8	18%	0.182	27%	0.266	C	S	.	.	H	α-helix	trans	-64.7	-38.7	178.1	-75.1	-9.6	0	0	0	112.5	L189 F193 Q249 C250 Y251 N257	L189-N253 HydrophobicContact CD2-CB 3.8Å; F193-N253 HydrophobicContact CZ-CB 4.38Å; Q249-N253 VanDerWaalsContact O-CG 3.32Å; Q249-N253 PolarHBondContact O-N 3.32Å; C250-N253 PolarHBondContact O-N 3.35Å; Y251-N253 VanDerWaalsContact C-N 3.31Å; Y251-N253 PolarHBondContact O-N 3.01Å; N253-N257 WeakPolarHBondContact O-CB 3.39Å; N253-N257 PolarHBondContact O-N 2.72Å; N253-N257 VanDerWaalsContact O-N 3.1Å; N253-N257 PolarHBondContact O-ND2 3.06Å
254	L	84	Confident	77.7	Confident	6 Å²	6	57.2 Å²	57.2	3%	0.031	27%	0.27	C	S	.	.	H	α-helix	trans	-65.2	-43.3	172	-76.3	-179.2	0	0	0	111.4	F193 C250 Y251 N252 Q256 N257 L263 R267 L270 E405	F193-L254 HydrophobicContact CE1-CD1 4.13Å; F193-L254 HydrophobicContact CE1-CD2 3.94Å; F193-L254 HydrophobicContact CE1-CG 3.78Å; F193-L254 HydrophobicContact CE2-CD2 4.24Å; F193-L254 HydrophobicContact CZ-CD1 4.42Å; F193-L254 HydrophobicContact CZ-CD2 3.58Å; F193-L254 HydrophobicContact CZ-CG 3.57Å; C250-L254 PolarHBondContact O-N 3.04Å; Y251-L254 PolarHBondContact O-N 3.23Å; N252-L254 PolarHBondContact O-N 3.41Å; L254-Q256 VanDerWaalsContact C-N 3.31Å; L254-Q256 PolarHBondContact O-N 3.04Å; L254-N257 CarbonylContact O-C 3.45Å; L254-N257 PolarHBondContact O-N 3.19Å; L254-L263 HydrophobicContact CD2-CB 4.4Å; L254-L263 HydrophobicContact CD2-CD2 3.97Å; L254-R267 HydrophobicContact CD1-CB 4.14Å; L254-R267 HydrophobicContact CD1-CG 4.32Å; L254-L270 HydrophobicContact CD1-CB 4.39Å; L254-L270 HydrophobicContact CD1-CD2 3.54Å; L254-L270 HydrophobicContact CG-CD2 4.38Å; L254-E405 HydrophobicContact CD1-CG 4.34Å
255	R	81.1	Confident	77.5	Confident	99 Å²	99	61.8 Å²	61.8	37%	0.374	29%	0.289	S	S	.	.	H	α-helix	trans	-61.8	-39	-179.8	-174.6	177.8	174.9	-179.7	-0.3	112.4	Y251 N252 R258	Y251-R255 WeakPolarHBondContact O-CB 3.3Å; Y251-R255 PolarHBondContact O-N 3.48Å; N252-R255 PolarHBondContact O-N 2.99Å; R255-R258 WeakPolarHBondContact O-CG 3.37Å; R255-R258 PolarHBondContact O-NE 3.13Å
256	Q	80.4	Confident	77.6	Confident	140 Å²	140	61.9 Å²	61.9	65%	0.654	29%	0.289	S	S	*	.	H	α-helix	trans	-74.7	-38.8	179	-71	175.4	5.3	0	0	112.7	N252 L254	N252-Q256 WeakPolarHBondContact O-CG 3.26Å; N252-Q256 PolarHBondContact O-N 3.32Å; L254-Q256 VanDerWaalsContact C-N 3.31Å; L254-Q256 PolarHBondContact O-N 3.04Å
257	N	76.3	Confident	77.6	Confident	64 Å²	64	62.3 Å²	62.3	34%	0.342	29%	0.29	S	S	.	.			trans	-100.2	92.5	-179.8	-62.4	-67.7	0	0	0	109	L189 N253 L254 L263	L189-N257 WeakPolarHBondContact CD1-ND2 3.2Å; N253-N257 WeakPolarHBondContact O-CB 3.39Å; N253-N257 PolarHBondContact O-N 2.72Å; N253-N257 VanDerWaalsContact O-N 3.1Å; N253-N257 PolarHBondContact O-ND2 3.06Å; L254-N257 CarbonylContact O-C 3.45Å; L254-N257 PolarHBondContact O-N 3.19Å; N257-L263 WeakPolarHBondContact O-CD1 3.39Å
258	R	62.4	Low	77.4	Confident	185 Å²	185	62.9 Å²	62.9	70%	0.698	30%	0.295	S	S	*	.			trans	-92.5	18.2	-175.3	-67.3	-171.6	176.5	-171.5	-4.7	116.2	R255 F260	R255-R258 WeakPolarHBondContact O-CG 3.37Å; R255-R258 PolarHBondContact O-NE 3.13Å; R258-F260 PolarHBondContact O-N 2.81Å
259	T	57.9	Low	77.5	Confident	98 Å²	98	65 Å²	65	60%	0.601	30%	0.303	S	S	*	.			trans	-70.8	97.4	-179.2	55.4	0	0	0	0	113.5	K261 L263	T259-K261 PolarHBondContact O-N 2.87Å; T259-L263 VanDerWaalsContact C-CD1 3.45Å; T259-L263 WeakPolarHBondContact O-CD1 3.3Å; T259-L263 WeakPolarHBondContact O-CG 3.31Å
260	F	54.7	Low	77.7	Confident	109 Å²	109	60.9 Å²	60.9	48%	0.478	28%	0.284	S	S	.	.	H	α-helix	trans	-41.2	-52.5	-166.2	-89.3	-91.9	0	0	0	118.6	R258 V408 E412	R258-F260 PolarHBondContact O-N 2.81Å; F260-V408 HydrophobicContact CE1-CG1 4.39Å; F260-E412 HydrophobicContact CD1-CG 3.97Å; F260-E412 WeakPolarHBondContact CD1-OE1 3.36Å; F260-E412 HydrophobicContact CE1-CG 3.78Å
261	K	53.7	Low	77.9	Confident	201 Å²	201	60.9 Å²	60.9	87%	0.874	28%	0.284	S	S	*	.	H	α-helix	trans	-73.9	-40.5	-163.9	-75.3	-174.6	178.5	179.2	0	115.5	T259 L263	T259-K261 PolarHBondContact O-N 2.87Å; K261-L263 VanDerWaalsContact C-N 3.29Å
262	T	58.8	Low	77.9	Confident	95 Å²	95	64.2 Å²	64.2	58%	0.583	30%	0.296	S	S	*	.	H	α-helix	trans	-78.4	-21.5	-176.9	-38.4	0	0	0	0	111.6
263	L	70.9	Confident	78.2	Confident	10 Å²	10	63.4 Å²	63.4	5%	0.052	29%	0.292	C	S	.	.	H	α-helix	trans	-87	-21.7	-172.6	-62	168.2	0	0	0	113.9	L254 N257 T259 K261 K265 Y266 R267	L254-L263 HydrophobicContact CD2-CB 4.4Å; L254-L263 HydrophobicContact CD2-CD2 3.97Å; N257-L263 WeakPolarHBondContact O-CD1 3.39Å; T259-L263 VanDerWaalsContact C-CD1 3.45Å; T259-L263 WeakPolarHBondContact O-CD1 3.3Å; T259-L263 WeakPolarHBondContact O-CG 3.31Å; K261-L263 VanDerWaalsContact C-N 3.29Å; L263-K265 PolarHBondContact O-N 2.92Å; L263-Y266 HydrophobicContact CD2-CD2 4.13Å; L263-Y266 PolarHBondContact O-N 3.04Å; L263-R267 WeakPolarHBondContact O-CB 3.28Å; L263-R267 PolarHBondContact O-N 3.26Å
264	S	76.6	Confident	78.6	Confident	11 Å²	11	61.8 Å²	61.8	8%	0.077	28%	0.283	C	S	.	.	H	α-helix	trans	-56.2	-41.1	-179.7	-161.9	0	0	0	0	111.6	R267 A268 E412	S264-R267 PolarHBondContact O-N 2.81Å; S264-A268 WeakPolarHBondContact O-CB 3.39Å; S264-A268 PolarHBondContact O-N 3.09Å; S264-E412 PolarHBondContact OG-OE2 3.07Å
265	K	82.2	Confident	78.9	Confident	98 Å²	98	62.7 Å²	62.7	43%	0.426	29%	0.288	S	S	.	.	H	α-helix	trans	-61.5	-44.6	173	-176.4	-179.7	178.5	-175.7	0	113.2	L263 A268 Y269	L263-K265 PolarHBondContact O-N 2.92Å; K265-A268 PolarHBondContact O-N 2.7Å; K265-Y269 HydrophobicContact CD-CE2 4.32Å; K265-Y269 VanDerWaalsContact CE-CZ 3.41Å; K265-Y269 WeakPolarHBondContact CE-OH 3.41Å; K265-Y269 HydrophobicContact CG-CD2 4.47Å; K265-Y269 HydrophobicContact CG-CE1 4.34Å; K265-Y269 HydrophobicContact CG-CE2 3.9Å; K265-Y269 VanDerWaalsContact O-CG 3.29Å; K265-Y269 PolarHBondContact O-N 3.01Å
266	Y	86.3	Confident	79.2	Confident	34 Å²	34	58.9 Å²	58.9	13%	0.133	28%	0.275	C	S	.	.	H	α-helix	trans	-69.3	-38.4	179.6	-65.9	-22.9	0	0	0	112.4	V190 F193 L263 Y269 L270	V190-Y266 WeakPolarHBondContact CG2-OH 3.29Å; F193-Y266 HydrophobicContact CB-CD1 3.48Å; F193-Y266 VanDerWaalsContact CB-CD1 3.48Å; F193-Y266 HydrophobicContact CB-CD2 4.48Å; F193-Y266 HydrophobicContact CB-CE1 4.07Å; F193-Y266 HydrophobicContact CB-CG 3.74Å; F193-Y266 HydrophobicContact CD1-CG 4.27Å; F193-Y266 HydrophobicContact CD2-CD1 4.16Å; F193-Y266 AromaticContact CD2-CD2 3.6Å; F193-Y266 HydrophobicContact CD2-CD2 3.6Å; F193-Y266 HydrophobicContact CD2-CE2 4.24Å; F193-Y266 AromaticContact CD2-CG 3.58Å; F193-Y266 HydrophobicContact CD2-CG 3.58Å; F193-Y266 HydrophobicContact CE2-CD2 4.1Å; F193-Y266 HydrophobicContact CE2-CG 4.3Å; F193-Y266 AromaticContact CG-CD1 3.91Å; F193-Y266 HydrophobicContact CG-CD1 3.91Å; F193-Y266 HydrophobicContact CG-CD2 4.13Å; F193-Y266 AromaticContact CG-CG 3.6Å; F193-Y266 HydrophobicContact CG-CG 3.6Å; L263-Y266 HydrophobicContact CD2-CD2 4.13Å; L263-Y266 PolarHBondContact O-N 3.04Å; Y266-Y269 HydrophobicContact CD1-CD2 4.37Å; Y266-Y269 PolarHBondContact O-N 3.4Å; Y266-L270 WeakPolarHBondContact O-CB 3.35Å; Y266-L270 PolarHBondContact O-N 2.97Å
267	R	87.7	Confident	79.7	Confident	11 Å²	11	52.4 Å²	52.4	4%	0.042	25%	0.245	C	C	.	.	H	α-helix	trans	-60.5	-46.7	171.1	-170.5	-172.5	-56.3	122	-6.6	111	L254 L263 S264 Y269 L270 V271 E405 E412	L254-R267 HydrophobicContact CD1-CB 4.14Å; L254-R267 HydrophobicContact CD1-CG 4.32Å; L263-R267 WeakPolarHBondContact O-CB 3.28Å; L263-R267 PolarHBondContact O-N 3.26Å; S264-R267 PolarHBondContact O-N 2.81Å; R267-Y269 VanDerWaalsContact C-N 3.29Å; R267-Y269 PolarHBondContact O-N 3.41Å; R267-L270 PolarHBondContact O-N 3.34Å; R267-L270 VanDerWaalsContact O-N 3.14Å; R267-V271 HydrophobicContact CG-CG2 4.18Å; R267-V271 WeakPolarHBondContact O-CB 3.17Å; R267-V271 WeakPolarHBondContact O-CG2 3.38Å; R267-V271 PolarHBondContact O-N 2.79Å; R267-E405 WeakPolarHBondContact CD-OE2 3.25Å; R267-E405 HydrophobicContact CG-CB 4.17Å; R267-E405 HydrophobicContact CG-CG 4.3Å; R267-E405 WeakPolarHBondContact CG-OE2 3.05Å; R267-E405 IonicContact CZ-OE2 3.04Å; R267-E405 IonicContact NE-OE2 2.84Å; R267-E405 PolarHBondContact NE-OE2 3.26Å; R267-E412 IonicContact CZ-OE1 2.87Å; R267-E412 IonicContact CZ-OE2 3.87Å; R267-E412 IonicContact NH1-OE1 3.58Å; R267-E412 PolarHBondContact NH1-OE1 3.22Å; R267-E412 IonicContact NH1-OE2 3.46Å; R267-E412 PolarHBondContact NH1-OE2 2.83Å; R267-E412 IonicContact NH2-OE1 2.77Å; R267-E412 PolarHBondContact NH2-OE1 3.33Å
268	A	86.7	Confident	80.1	Confident	13 Å²	13	49.8 Å²	49.8	11%	0.107	23%	0.231	C	C	.	.	H	α-helix	trans	-58.7	-41.4	176.6	0	0	0	0	0	112	S264 K265 R272 S424	S264-A268 WeakPolarHBondContact O-CB 3.39Å; S264-A268 PolarHBondContact O-N 3.09Å; K265-A268 PolarHBondContact O-N 2.7Å; A268-R272 WeakPolarHBondContact O-CB 3.35Å; A268-R272 PolarHBondContact O-N 2.57Å; A268-R272 VanDerWaalsContact O-N 3.08Å; A268-S424 VanDerWaalsContact CA-OG 3.3Å; A268-S424 WeakPolarHBondContact CA-OG 3.42Å; A268-S424 VanDerWaalsContact CB-OG 3.26Å; A268-S424 WeakPolarHBondContact CB-OG 3.36Å
269	Y	89.4	Confident	80.9	Confident	47 Å²	47	44.4 Å²	44.4	18%	0.184	21%	0.213	C	C	.	.	H	α-helix	trans	-63.4	-45.1	174.2	-65.6	-16.7	0	0	0	112.4	H197 K265 Y266 R267 T273	H197-Y269 HydrophobicContact CB-CD1 4.09Å; H197-Y269 HydrophobicContact CB-CD2 3.73Å; H197-Y269 HydrophobicContact CB-CE1 4.33Å; H197-Y269 HydrophobicContact CB-CE2 3.99Å; H197-Y269 HydrophobicContact CB-CG 3.75Å; H197-Y269 AromaticContact CE1-CE1 3.74Å; H197-Y269 AromaticContact CG-CD1 3.91Å; H197-Y269 AromaticContact CG-CE1 3.8Å; H197-Y269 AromaticContact CG-CZ 3.88Å; H197-Y269 AromaticContact ND1-CD1 3.35Å; H197-Y269 VanDerWaalsContact ND1-CD1 3.35Å; H197-Y269 WeakPolarHBondContact ND1-CD1 3.16Å; H197-Y269 AromaticContact ND1-CE1 3.28Å; H197-Y269 VanDerWaalsContact ND1-CE1 3.28Å; H197-Y269 WeakPolarHBondContact ND1-CE1 3.27Å; H197-Y269 AromaticContact ND1-CG 3.95Å; H197-Y269 AromaticContact ND1-CZ 3.83Å; K265-Y269 HydrophobicContact CD-CE2 4.32Å; K265-Y269 VanDerWaalsContact CE-CZ 3.41Å; K265-Y269 WeakPolarHBondContact CE-OH 3.41Å; K265-Y269 HydrophobicContact CG-CD2 4.47Å; K265-Y269 HydrophobicContact CG-CE1 4.34Å; K265-Y269 HydrophobicContact CG-CE2 3.9Å; K265-Y269 VanDerWaalsContact O-CG 3.29Å; K265-Y269 PolarHBondContact O-N 3.01Å; Y266-Y269 HydrophobicContact CD1-CD2 4.37Å; Y266-Y269 PolarHBondContact O-N 3.4Å; R267-Y269 VanDerWaalsContact C-N 3.29Å; R267-Y269 PolarHBondContact O-N 3.41Å; Y269-T273 VanDerWaalsContact O-CB 3.28Å; Y269-T273 WeakPolarHBondContact O-CB 3.2Å; Y269-T273 PolarHBondContact O-N 3.13Å; Y269-T273 PolarHBondContact O-OG1 3.27Å
270	L	92.2	Very high	82	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-65.8	-51.3	-179.3	-172.5	61.4	0	0	0	111.8	F193 I247 C250 Y251 L254 Y266 R267 R272 T273 T274	F193-L270 HydrophobicContact CE1-CB 4.49Å; F193-L270 HydrophobicContact CE1-CD2 4.38Å; I247-L270 HydrophobicContact CG2-CD1 3.94Å; C250-L270 HydrophobicContact CB-CD1 3.51Å; C250-L270 HydrophobicContact CB-CD2 3.99Å; C250-L270 HydrophobicContact CB-CG 4.4Å; Y251-L270 HydrophobicContact CD1-CD2 3.4Å; Y251-L270 HydrophobicContact CD1-CG 4.3Å; Y251-L270 HydrophobicContact CD2-CD2 3.88Å; Y251-L270 HydrophobicContact CD2-CG 4.33Å; Y251-L270 HydrophobicContact CE1-CD2 3.49Å; Y251-L270 VanDerWaalsContact CE1-CD2 3.49Å; Y251-L270 HydrophobicContact CE1-CG 3.94Å; Y251-L270 HydrophobicContact CE2-CD1 4.29Å; Y251-L270 HydrophobicContact CE2-CD2 3.97Å; Y251-L270 HydrophobicContact CE2-CG 3.97Å; Y251-L270 HydrophobicContact CG-CD2 3.59Å; Y251-L270 HydrophobicContact CG-CG 4.47Å; L254-L270 HydrophobicContact CD1-CB 4.39Å; L254-L270 HydrophobicContact CD1-CD2 3.54Å; L254-L270 HydrophobicContact CG-CD2 4.38Å; Y266-L270 WeakPolarHBondContact O-CB 3.35Å; Y266-L270 PolarHBondContact O-N 2.97Å; R267-L270 PolarHBondContact O-N 3.34Å; R267-L270 VanDerWaalsContact O-N 3.14Å; L270-R272 VanDerWaalsContact C-N 3.35Å; L270-R272 PolarHBondContact O-N 3.5Å; L270-T273 WeakPolarHBondContact O-CB 3.44Å; L270-T273 PolarHBondContact O-N 3.13Å; L270-T273 VanDerWaalsContact O-N 3.09Å; L270-T274 PolarHBondContact O-N 3.01Å; L270-T274 PolarHBondContact O-OG1 2.96Å
271	V	92.2	Very high	83	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-60.2	-44	-179.8	174.5	0	0	0	0	111.4	R267 T273 T274 M275 L402 S424 L428	R267-V271 HydrophobicContact CG-CG2 4.18Å; R267-V271 WeakPolarHBondContact O-CB 3.17Å; R267-V271 WeakPolarHBondContact O-CG2 3.38Å; R267-V271 PolarHBondContact O-N 2.79Å; V271-T273 VanDerWaalsContact C-N 3.32Å; V271-T273 PolarHBondContact O-N 3.46Å; V271-T274 PolarHBondContact O-N 3.37Å; V271-M275 PolarHBondContact O-N 2.91Å; V271-L402 HydrophobicContact CB-CD1 4.33Å; V271-L402 HydrophobicContact CG1-CD1 3.9Å; V271-L402 HydrophobicContact CG2-CD1 4.08Å; V271-S424 WeakPolarHBondContact CG1-O 3.43Å; V271-L428 HydrophobicContact CG1-CB 3.92Å
272	R	90.7	Very high	83.7	Confident	76 Å²	76	26.8 Å²	26.8	29%	0.287	13%	0.129	S	C	.	.	H	α-helix	trans	-61.4	-43	175.1	-179.7	178.2	173.7	-179.4	-3.6	111.4	A268 L270 M275 V276 Y427	A268-R272 WeakPolarHBondContact O-CB 3.35Å; A268-R272 PolarHBondContact O-N 2.57Å; A268-R272 VanDerWaalsContact O-N 3.08Å; L270-R272 VanDerWaalsContact C-N 3.35Å; L270-R272 PolarHBondContact O-N 3.5Å; R272-M275 PolarHBondContact O-N 3Å; R272-V276 WeakPolarHBondContact O-CG2 3.43Å; R272-V276 PolarHBondContact O-N 3.1Å; R272-V276 VanDerWaalsContact O-N 3.1Å; R272-Y427 HydrophobicContact CB-CD2 3.9Å; R272-Y427 HydrophobicContact CB-CE2 4.15Å; R272-Y427 HydrophobicContact CB-CG 4.19Å; R272-Y427 HydrophobicContact CG-CD1 4.42Å; R272-Y427 HydrophobicContact CG-CD2 4.24Å; R272-Y427 HydrophobicContact CG-CE1 4.23Å; R272-Y427 HydrophobicContact CG-CE2 4.09Å; R272-Y427 HydrophobicContact CG-CG 4.43Å
273	T	92.6	Very high	83.9	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-61.1	-49.7	178.5	-62.5	0	0	0	0	111.2	C196 S199 F203 I247 Y269 L270 V271 M275 V276 Y277	C196-T273 PolarHBondContact O-OG1 2.91Å; S199-T273 WeakPolarHBondContact OG-CG2 3.47Å; F203-T273 HydrophobicContact CD2-CG2 4.46Å; F203-T273 HydrophobicContact CE2-CG2 3.99Å; I247-T273 HydrophobicContact CD1-CG2 4.06Å; I247-T273 HydrophobicContact CG1-CG2 4.36Å; Y269-T273 VanDerWaalsContact O-CB 3.28Å; Y269-T273 WeakPolarHBondContact O-CB 3.2Å; Y269-T273 PolarHBondContact O-N 3.13Å; Y269-T273 PolarHBondContact O-OG1 3.27Å; L270-T273 WeakPolarHBondContact O-CB 3.44Å; L270-T273 PolarHBondContact O-N 3.13Å; L270-T273 VanDerWaalsContact O-N 3.09Å; V271-T273 VanDerWaalsContact C-N 3.32Å; V271-T273 PolarHBondContact O-N 3.46Å; T273-M275 VanDerWaalsContact C-N 3.3Å; T273-M275 PolarHBondContact O-N 3.17Å; T273-V276 PolarHBondContact O-N 3.16Å; T273-V276 VanDerWaalsContact O-N 3.14Å; T273-Y277 WeakPolarHBondContact O-CB 2.94Å; T273-Y277 PolarHBondContact O-N 3.5Å
274	T	93.2	Very high	83.6	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-56.4	-44.7	177.5	-55.3	0	0	0	0	111.3	Y251 L270 V271 V276 Y277 L278 M398 L402	Y251-T274 PolarHBondContact OH-OG1 2.92Å; L270-T274 PolarHBondContact O-N 3.01Å; L270-T274 PolarHBondContact O-OG1 2.96Å; V271-T274 PolarHBondContact O-N 3.37Å; T274-V276 PolarHBondContact O-N 3.17Å; T274-Y277 PolarHBondContact O-N 3.23Å; T274-L278 HydrophobicContact CG2-CD1 4.01Å; T274-L278 HydrophobicContact CG2-CG 4.44Å; T274-L278 WeakPolarHBondContact O-CB 3.18Å; T274-L278 VanDerWaalsContact O-CG 3.26Å; T274-L278 WeakPolarHBondContact O-CG 3.32Å; T274-L278 PolarHBondContact O-N 2.95Å; T274-M398 HydrophobicContact CG2-CE 4.25Å; T274-M398 HydrophobicContact CG2-CG 4.06Å; T274-M398 HydrophobicContact CG2-SD 3.88Å; T274-L402 HydrophobicContact CG2-CD1 4.46Å; T274-L402 HydrophobicContact CG2-CD2 4.29Å
275	M	91.3	Very high	82.8	Confident	26 Å²	26	27.3 Å²	27.3	13%	0.128	13%	0.125	C	C	.	.	H	α-helix	trans	-58.5	-47.8	176	-177.1	-80.4	-71.8	0	0	112.2	V271 R272 T273 K279 Y427 R430 A431	V271-M275 PolarHBondContact O-N 2.91Å; R272-M275 PolarHBondContact O-N 3Å; T273-M275 VanDerWaalsContact C-N 3.3Å; T273-M275 PolarHBondContact O-N 3.17Å; M275-K279 WeakPolarHBondContact O-CB 3.42Å; M275-K279 PolarHBondContact O-N 3.36Å; M275-Y427 HydrophobicContact CE-CD1 3.39Å; M275-Y427 HydrophobicContact CE-CE1 3.66Å; M275-R430 HydrophobicContact CG-CB 3.95Å; M275-A431 HydrophobicContact CB-CB 3.95Å; M275-A431 HydrophobicContact CG-CB 4.28Å
276	V	86.8	Confident	81.4	Confident	19 Å²	19	23.2 Å²	23.2	12%	0.115	11%	0.109	C	C	.	.	H	α-helix	trans	-71.5	-35.7	-178.3	-172.5	0	0	0	0	111.2	F203 R272 T273 T274 K279 D280	F203-V276 HydrophobicContact CB-CB 4.32Å; F203-V276 HydrophobicContact CB-CG1 3.55Å; R272-V276 WeakPolarHBondContact O-CG2 3.43Å; R272-V276 PolarHBondContact O-N 3.1Å; R272-V276 VanDerWaalsContact O-N 3.1Å; T273-V276 PolarHBondContact O-N 3.16Å; T273-V276 VanDerWaalsContact O-N 3.14Å; T274-V276 PolarHBondContact O-N 3.17Å; V276-K279 PolarHBondContact O-N 2.99Å; V276-D280 VanDerWaalsContact O-CB 3.29Å; V276-D280 WeakPolarHBondContact O-CB 3.1Å; V276-D280 PolarHBondContact O-N 2.78Å
277	Y	90.9	Very high	79.8	Confident	4 Å²	4	23.1 Å²	23.1	2%	0.016	11%	0.111	C	C	.	.	H	α-helix	trans	-58.4	-53	172.1	164.7	-92.1	0	0	0	111.3	F203 F240 I247 T273 T274 K279 D280 N281 M398	F203-Y277 AromaticContact CE1-CD2 3.94Å; F203-Y277 HydrophobicContact CE1-CD2 3.94Å; F203-Y277 HydrophobicContact CE2-CD2 4.32Å; F203-Y277 AromaticContact CZ-CD2 3.7Å; F203-Y277 HydrophobicContact CZ-CD2 3.7Å; F203-Y277 HydrophobicContact CZ-CG 4.39Å; F240-Y277 HydrophobicContact CB-CE2 4.26Å; F240-Y277 HydrophobicContact CD1-CD2 4.28Å; F240-Y277 AromaticContact CD1-CE2 3.65Å; F240-Y277 HydrophobicContact CD1-CE2 3.65Å; F240-Y277 HydrophobicContact CG-CE2 4.4Å; F240-Y277 PolarHBondContact O-OH 3.49Å; I247-Y277 HydrophobicContact CD1-CD2 4.29Å; I247-Y277 HydrophobicContact CD1-CG 4.13Å; T273-Y277 WeakPolarHBondContact O-CB 2.94Å; T273-Y277 PolarHBondContact O-N 3.5Å; T274-Y277 PolarHBondContact O-N 3.23Å; Y277-K279 VanDerWaalsContact C-N 3.27Å; Y277-K279 PolarHBondContact O-N 2.73Å; Y277-D280 PolarHBondContact O-N 3.25Å; Y277-D280 VanDerWaalsContact O-N 3.15Å; Y277-N281 WeakPolarHBondContact O-CB 3.16Å; Y277-N281 PolarHBondContact O-N 3.18Å; Y277-M398 HydrophobicContact CD1-CE 3.74Å; Y277-M398 HydrophobicContact CD1-SD 4.02Å; Y277-M398 HydrophobicContact CE1-CE 3.49Å; Y277-M398 VanDerWaalsContact CE1-CE 3.49Å; Y277-M398 HydrophobicContact CE1-SD 4.04Å
278	L	85	Confident	78	Confident	8 Å²	8	24.5 Å²	24.5	4%	0.042	12%	0.122	C	C	.	.	H	α-helix	trans	-59.9	-42.1	-179.7	-71.7	167.2	0	0	0	111	T274 N281 Q282 M398 I399 A431 V434 V435	T274-L278 HydrophobicContact CG2-CD1 4.01Å; T274-L278 HydrophobicContact CG2-CG 4.44Å; T274-L278 WeakPolarHBondContact O-CB 3.18Å; T274-L278 VanDerWaalsContact O-CG 3.26Å; T274-L278 WeakPolarHBondContact O-CG 3.32Å; T274-L278 PolarHBondContact O-N 2.95Å; L278-N281 PolarHBondContact O-N 2.96Å; L278-Q282 WeakPolarHBondContact O-CB 3.36Å; L278-Q282 PolarHBondContact O-N 3.04Å; L278-M398 HydrophobicContact CD2-CE 3.72Å; L278-M398 HydrophobicContact CG-CE 4.22Å; L278-I399 HydrophobicContact CD1-CD1 3.72Å; L278-I399 HydrophobicContact CD2-CD1 4.2Å; L278-A431 HydrophobicContact CD1-CB 3.89Å; L278-V434 HydrophobicContact CB-CB 4.35Å; L278-V434 HydrophobicContact CB-CG1 3.77Å; L278-V435 HydrophobicContact CD1-CG2 3.95Å; L278-V435 HydrophobicContact CD2-CG2 4.38Å
279	K	78.6	Confident	75.9	Confident	73 Å²	73	27.9 Å²	27.9	32%	0.317	13%	0.132	S	C	.	.	H	α-helix	trans	-62.8	-47.7	175.8	-173.2	-176.4	176	-172.4	0	111.3	M275 V276 Y277 N281 Q282 Y283	M275-K279 WeakPolarHBondContact O-CB 3.42Å; M275-K279 PolarHBondContact O-N 3.36Å; V276-K279 PolarHBondContact O-N 2.99Å; Y277-K279 VanDerWaalsContact C-N 3.27Å; Y277-K279 PolarHBondContact O-N 2.73Å; K279-N281 VanDerWaalsContact C-N 3.33Å; K279-N281 PolarHBondContact O-N 2.91Å; K279-Q282 WeakPolarHBondContact O-CB 3.28Å; K279-Q282 PolarHBondContact O-N 2.91Å; K279-Y283 HydrophobicContact CD-CE2 4.18Å; K279-Y283 VanDerWaalsContact CE-CE2 3.48Å; K279-Y283 HydrophobicContact CG-CD2 3.88Å; K279-Y283 HydrophobicContact CG-CE2 3.53Å; K279-Y283 WeakPolarHBondContact O-CD2 3.25Å; K279-Y283 PolarHBondContact O-N 2.87Å; K279-Y283 VanDerWaalsContact O-N 3.14Å
280	D	80.9	Confident	73.5	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-59.5	-45.8	177.6	-171.4	38.6	0	0	0	111.1	F203 H206 C207 R239 V276 Y277 Q282 Y283 T284	F203-D280 HydrophobicContact CB-CB 4.15Å; F203-D280 HydrophobicContact CD1-CB 4.41Å; F203-D280 WeakPolarHBondContact CD1-OD2 3.23Å; H206-D280 IonicContact CE1-OD1 3.46Å; H206-D280 IonicContact CE1-OD2 2.71Å; H206-D280 IonicContact CG-OD1 3.36Å; H206-D280 IonicContact CG-OD2 3.38Å; H206-D280 IonicContact ND1-OD1 3.3Å; H206-D280 PolarHBondContact ND1-OD1 3.06Å; H206-D280 IonicContact ND1-OD2 2.72Å; H206-D280 PolarHBondContact ND1-OD2 3.48Å; C207-D280 VanDerWaalsContact CA-OD1 3.3Å; C207-D280 WeakPolarHBondContact CA-OD1 3.46Å; C207-D280 HydrophobicContact CB-CB 4.28Å; C207-D280 PolarHBondContact N-OD1 3.08Å; R239-D280 IonicContact CZ-OD2 3.91Å; R239-D280 IonicContact NH1-OD2 3.86Å; R239-D280 PolarHBondContact NH1-OD2 2.83Å; V276-D280 VanDerWaalsContact O-CB 3.29Å; V276-D280 WeakPolarHBondContact O-CB 3.1Å; V276-D280 PolarHBondContact O-N 2.78Å; Y277-D280 PolarHBondContact O-N 3.25Å; Y277-D280 VanDerWaalsContact O-N 3.15Å; D280-Q282 PolarHBondContact O-N 3.43Å; D280-Y283 PolarHBondContact O-N 3.3Å; D280-T284 WeakPolarHBondContact O-CB 2.97Å; D280-T284 PolarHBondContact O-N 2.89Å; D280-T284 PolarHBondContact O-OG1 3.37Å
281	N	76.5	Confident	70.7	Confident	23 Å²	23	33.3 Å²	33.3	12%	0.123	16%	0.163	C	C	.	.	H	α-helix	trans	-59.1	-48.4	176.1	-167.3	6.3	0	0	0	111.5	F240 Y277 L278 K279 Y283 T284 V285	F240-N281 HydrophobicContact CD1-CB 4.21Å; F240-N281 HydrophobicContact CE1-CB 3.9Å; F240-N281 HydrophobicContact CZ-CB 4.11Å; Y277-N281 WeakPolarHBondContact O-CB 3.16Å; Y277-N281 PolarHBondContact O-N 3.18Å; L278-N281 PolarHBondContact O-N 2.96Å; K279-N281 VanDerWaalsContact C-N 3.33Å; K279-N281 PolarHBondContact O-N 2.91Å; N281-Y283 PolarHBondContact O-N 3.5Å; N281-T284 PolarHBondContact O-N 3.01Å; N281-V285 WeakPolarHBondContact O-CB 3.45Å; N281-V285 WeakPolarHBondContact O-CG2 3.4Å; N281-V285 PolarHBondContact O-N 3.44Å; N281-V285 WeakPolarHBondContact OD1-CG2 3.44Å
282	Q	68.8	Low	67.7	Low	15 Å²	15	35.1 Å²	35.1	7%	0.07	18%	0.176	C	C	.	.	H	α-helix	trans	-51	-53.2	175.1	175.2	177.9	27.4	0	0	112.5	L278 K279 D280 S286 H294 V434 E437 T438	L278-Q282 WeakPolarHBondContact O-CB 3.36Å; L278-Q282 PolarHBondContact O-N 3.04Å; K279-Q282 WeakPolarHBondContact O-CB 3.28Å; K279-Q282 PolarHBondContact O-N 2.91Å; D280-Q282 PolarHBondContact O-N 3.43Å; Q282-S286 WeakPolarHBondContact O-CB 3.22Å; Q282-S286 PolarHBondContact O-N 3Å; Q282-S286 VanDerWaalsContact O-N 3.08Å; Q282-S286 PolarHBondContact O-OG 3.48Å; Q282-H294 PolarHBondContact NE2-NE2 3.21Å; Q282-V434 HydrophobicContact CB-CG1 4.33Å; Q282-E437 PolarHBondContact NE2-OE2 3.22Å; Q282-T438 HydrophobicContact CB-CG2 3.71Å; Q282-T438 VanDerWaalsContact CD-CG2 3.44Å; Q282-T438 HydrophobicContact CG-CG2 3.35Å
283	Y	62.9	Low	65.1	Low	61 Å²	61	37 Å²	37	24%	0.239	19%	0.188	C	C	.	.	H	α-helix	trans	-70	-36.8	-178	-71	-74.8	0	0	0	111.8	C207 M211 K279 D280 N281 S286 L287	C207-Y283 VanDerWaalsContact SG-CD2 3.51Å; M211-Y283 HydrophobicContact CG-CD1 4.36Å; M211-Y283 HydrophobicContact CG-CE1 4.49Å; K279-Y283 HydrophobicContact CD-CE2 4.18Å; K279-Y283 VanDerWaalsContact CE-CE2 3.48Å; K279-Y283 HydrophobicContact CG-CD2 3.88Å; K279-Y283 HydrophobicContact CG-CE2 3.53Å; K279-Y283 WeakPolarHBondContact O-CD2 3.25Å; K279-Y283 PolarHBondContact O-N 2.87Å; K279-Y283 VanDerWaalsContact O-N 3.14Å; D280-Y283 PolarHBondContact O-N 3.3Å; N281-Y283 PolarHBondContact O-N 3.5Å; Y283-S286 PolarHBondContact O-N 3.27Å; Y283-S286 PolarHBondContact O-OG 3.03Å; Y283-L287 PolarHBondContact O-N 3.29Å; Y283-L287 VanDerWaalsContact O-N 3.16Å
284	T	65.1	Low	62.3	Low	1 Å²	1	38.3 Å²	38.3	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-63.2	-49.8	176.5	-51	0	0	0	0	111	H206 I210 Q236 F240 D280 N281 S286 L287 S288	H206-T284 PolarHBondContact CE1-OG1 3.07Å; I210-T284 HydrophobicContact CD1-CG2 4.07Å; I210-T284 WeakPolarHBondContact CD1-OG1 3.3Å; Q236-T284 HydrophobicContact CB-CG2 4.26Å; Q236-T284 HydrophobicContact CG-CG2 3.94Å; F240-T284 HydrophobicContact CE2-CG2 3.86Å; F240-T284 HydrophobicContact CZ-CG2 3.9Å; F240-T284 WeakPolarHBondContact CZ-OG1 3.25Å; D280-T284 WeakPolarHBondContact O-CB 2.97Å; D280-T284 PolarHBondContact O-N 2.89Å; D280-T284 PolarHBondContact O-OG1 3.37Å; N281-T284 PolarHBondContact O-N 3.01Å; T284-S286 VanDerWaalsContact C-N 3.3Å; T284-S286 PolarHBondContact O-N 2.91Å; T284-L287 PolarHBondContact O-N 3.5Å; T284-L287 VanDerWaalsContact O-N 3.1Å; T284-S288 VanDerWaalsContact O-CB 3.32Å; T284-S288 WeakPolarHBondContact O-CB 3.29Å; T284-S288 PolarHBondContact O-N 2.89Å; T284-S288 PolarHBondContact O-OG 3.22Å
285	V	58.3	Low	59.4	Low	64 Å²	64	40.5 Å²	40.5	39%	0.388	21%	0.208	S	C	.	.	H	α-helix	trans	-60.5	-42.7	-180	166.9	0	0	0	0	110.8	N281 L287 S288 Y289	N281-V285 WeakPolarHBondContact O-CB 3.45Å; N281-V285 WeakPolarHBondContact O-CG2 3.4Å; N281-V285 PolarHBondContact O-N 3.44Å; N281-V285 WeakPolarHBondContact OD1-CG2 3.44Å; V285-L287 VanDerWaalsContact C-N 3.28Å; V285-L287 PolarHBondContact O-N 3.48Å; V285-S288 PolarHBondContact O-N 3.16Å; V285-Y289 HydrophobicContact CB-CD2 4.18Å; V285-Y289 HydrophobicContact CG1-CD2 3.98Å; V285-Y289 HydrophobicContact CG2-CD2 4.2Å; V285-Y289 HydrophobicContact CG2-CE2 4.26Å; V285-Y289 WeakPolarHBondContact O-CB 3.33Å; V285-Y289 PolarHBondContact O-N 3.05Å
286	S	52.7	Low	56.6	Low	13 Å²	13	42.2 Å²	42.2	9%	0.091	21%	0.213	C	C	.	.	H	α-helix	trans	-59	-38.1	176.4	75.9	0	0	0	0	112.4	Q282 Y283 T284 S290	Q282-S286 WeakPolarHBondContact O-CB 3.22Å; Q282-S286 PolarHBondContact O-N 3Å; Q282-S286 VanDerWaalsContact O-N 3.08Å; Q282-S286 PolarHBondContact O-OG 3.48Å; Y283-S286 PolarHBondContact O-N 3.27Å; Y283-S286 PolarHBondContact O-OG 3.03Å; T284-S286 VanDerWaalsContact C-N 3.3Å; T284-S286 PolarHBondContact O-N 2.91Å; S286-S290 WeakPolarHBondContact O-CB 3.32Å; S286-S290 PolarHBondContact O-N 2.95Å; S286-S290 PolarHBondContact O-OG 3.38Å
287	L	53.3	Low	54	Low	32 Å²	32	42.9 Å²	42.9	17%	0.168	22%	0.216	C	C	.	.	H	α-helix	trans	-82.6	-40.9	178.4	-76.8	-172.5	0	0	0	114.5	I210 Y283 T284 V285	I210-L287 HydrophobicContact CB-CD1 4.12Å; I210-L287 HydrophobicContact CG2-CD1 3.35Å; I210-L287 HydrophobicContact CG2-CG 4.1Å; I210-L287 VanDerWaalsContact O-CD1 3.3Å; I210-L287 WeakPolarHBondContact O-CD1 3.32Å; Y283-L287 PolarHBondContact O-N 3.29Å; Y283-L287 VanDerWaalsContact O-N 3.16Å; T284-L287 PolarHBondContact O-N 3.5Å; T284-L287 VanDerWaalsContact O-N 3.1Å; V285-L287 VanDerWaalsContact C-N 3.28Å; V285-L287 PolarHBondContact O-N 3.48Å
288	S	49.3	Very low	51.3	Low	40 Å²	40	45.7 Å²	45.7	28%	0.28	23%	0.227	S	C	.	.	H	α-helix	trans	-73.1	-35.3	-175.1	-61.3	0	0	0	0	112	T284 V285	T284-S288 VanDerWaalsContact O-CB 3.32Å; T284-S288 WeakPolarHBondContact O-CB 3.29Å; T284-S288 PolarHBondContact O-N 2.89Å; T284-S288 PolarHBondContact O-OG 3.22Å; V285-S288 PolarHBondContact O-N 3.16Å
289	Y	44.2	Very low	48.5	Very low	83 Å²	83	48 Å²	48	33%	0.325	24%	0.243	S	C	.	.	H	α-helix	trans	-117.9	-29.4	-168.6	-57.9	-70.8	0	0	0	114.5	V285 V340	V285-Y289 HydrophobicContact CB-CD2 4.18Å; V285-Y289 HydrophobicContact CG1-CD2 3.98Å; V285-Y289 HydrophobicContact CG2-CD2 4.2Å; V285-Y289 HydrophobicContact CG2-CE2 4.26Å; V285-Y289 WeakPolarHBondContact O-CB 3.33Å; V285-Y289 PolarHBondContact O-N 3.05Å; Y289-V340 HydrophobicContact CD1-CG1 4.28Å
290	S	37.5	Very low	46.2	Very low	35 Å²	35	46.7 Å²	46.7	25%	0.245	24%	0.24	C	C	.	.			trans	-93	121.7	-175.8	84.7	0	0	0	0	112.8	S286 S292	S286-S290 WeakPolarHBondContact O-CB 3.32Å; S286-S290 PolarHBondContact O-N 2.95Å; S286-S290 PolarHBondContact O-OG 3.38Å; S290-S292 PolarHBondContact OG-O 3.08Å; S290-S292 VanDerWaalsContact OG-O 3.13Å
291	Q	34.1	Very low	43.6	Very low	127 Å²	127	49.7 Å²	49.7	59%	0.593	26%	0.259	S	S	*	.	S	Bend	trans	-77.5	2.8	158.6	-69.8	-173.4	-7	0	0	111.9
292	S	30.1	Very low	41.3	Very low	38 Å²	38	56.4 Å²	56.4	27%	0.266	28%	0.284	S	S	.	.	S	Bend	trans	-101.7	149.5	179.9	60.3	0	0	0	0	112.9	S290 H294 F346	S290-S292 PolarHBondContact OG-O 3.08Å; S290-S292 VanDerWaalsContact OG-O 3.13Å; S292-H294 PolarHBondContact O-N 3.48Å; S292-H294 VanDerWaalsContact O-N 3.13Å; S292-F346 WeakPolarHBondContact OG-CE1 3.32Å; S292-F346 WeakPolarHBondContact OG-CZ 3.34Å
293	H	34.8	Very low	39.4	Very low	116 Å²	116	58.7 Å²	58.7	54%	0.537	29%	0.293	S	S	.	.			trans	-65.3	111.1	168.6	-52.8	-71.1	0	0	0	108.9
294	H	33.8	Very low	37.8	Very low	27 Å²	27	56.8 Å²	56.8	13%	0.125	29%	0.289	C	S	.	.			trans	-43.3	145.9	159	-174.9	-98.7	0	0	0	109	Q282 S292 W296 L297 R961	Q282-H294 PolarHBondContact NE2-NE2 3.21Å; S292-H294 PolarHBondContact O-N 3.48Å; S292-H294 VanDerWaalsContact O-N 3.13Å; H294-W296 AromaticContact CE1-CD1 3.33Å; H294-W296 AromaticContact CE1-CG 3.9Å; H294-W296 WeakPolarHBondContact ND1-CB 3.49Å; H294-W296 AromaticContact ND1-CD1 3.6Å; H294-W296 AromaticContact ND1-CG 3.89Å; H294-W296 PolarHBondContact ND1-N 3.45Å; H294-W296 PolarHBondContact O-N 2.83Å; H294-L297 HydrophobicContact CB-CB 3.69Å; H294-L297 HydrophobicContact CB-CD1 3.49Å; H294-L297 VanDerWaalsContact CB-CD1 3.49Å; H294-L297 HydrophobicContact CB-CG 3.49Å; H294-L297 VanDerWaalsContact CB-CG 3.49Å; H294-L297 WeakPolarHBondContact O-CA 3.14Å; H294-L297 WeakPolarHBondContact O-CB 3.25Å; H294-L297 PolarHBondContact O-N 3.35Å; H294-R961 PolarHBondContact O-NH2 2.83Å
295	P	32.4	Very low	35.9	Very low	46 Å²	46	60.2 Å²	60.2	30%	0.299	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-27.6	-178.3	-23.9	31.7	0	0	0	112.9	F706 R961	P295-F706 HydrophobicContact CG-CE1 4.43Å; P295-R961 VanDerWaalsContact C-NH2 3.28Å; P295-R961 PolarHBondContact O-NE 2.81Å; P295-R961 PolarHBondContact O-NH2 3.15Å
296	W	33.4	Very low	34.6	Very low	61 Å²	61	62.2 Å²	62.2	23%	0.231	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-5.3	175.8	-49.1	86.6	0	0	0	114.7	H294 Y298 L698 R705	H294-W296 AromaticContact CE1-CD1 3.33Å; H294-W296 AromaticContact CE1-CG 3.9Å; H294-W296 WeakPolarHBondContact ND1-CB 3.49Å; H294-W296 AromaticContact ND1-CD1 3.6Å; H294-W296 AromaticContact ND1-CG 3.89Å; H294-W296 PolarHBondContact ND1-N 3.45Å; H294-W296 PolarHBondContact O-N 2.83Å; W296-Y298 PolarHBondContact O-N 3Å; W296-Y298 VanDerWaalsContact O-N 3.16Å; W296-L698 HydrophobicContact CH2-CD1 3.8Å; W296-L698 HydrophobicContact CZ2-CD1 3.57Å; W296-R705 VanDerWaalsContact CH2-NH1 3.3Å
297	L	31.7	Very low	33.5	Very low	33 Å²	33	70.1 Å²	70.1	17%	0.173	34%	0.342	C	S	.	.	S	Bend	trans	-69.2	114.2	166.2	-86.4	168.7	0	0	0	106.6	H294 R961	H294-L297 HydrophobicContact CB-CB 3.69Å; H294-L297 HydrophobicContact CB-CD1 3.49Å; H294-L297 VanDerWaalsContact CB-CD1 3.49Å; H294-L297 HydrophobicContact CB-CG 3.49Å; H294-L297 VanDerWaalsContact CB-CG 3.49Å; H294-L297 WeakPolarHBondContact O-CA 3.14Å; H294-L297 WeakPolarHBondContact O-CB 3.25Å; H294-L297 PolarHBondContact O-N 3.35Å; L297-R961 VanDerWaalsContact O-CZ 3.29Å; L297-R961 PolarHBondContact O-NH1 3.49Å; L297-R961 PolarHBondContact O-NH2 2.85Å
298	Y	34.7	Very low	32.3	Very low	63 Å²	63	73.5 Å²	73.5	25%	0.247	36%	0.359	C	S	.	.			trans	-35	148.5	-177.3	-47.6	-71.8	0	0	0	113.2	I215 W296 L300 P965	I215-Y298 HydrophobicContact CG1-CE2 4.02Å; W296-Y298 PolarHBondContact O-N 3Å; W296-Y298 VanDerWaalsContact O-N 3.16Å; Y298-L300 PolarHBondContact O-N 2.95Å; Y298-P965 HydrophobicContact CD1-CG 3.83Å; Y298-P965 HydrophobicContact CE1-CG 4.11Å
299	C	26.6	Very low	31.1	Very low	56 Å²	56	79.9 Å²	79.9	38%	0.378	38%	0.384	S	S	.	.			trans	-60.1	92.9	138.8	-70.2	0	0	0	0	104.4	P301	C299-P301 WeakPolarHBondContact O-CD 3.45Å
300	L	28.6	Very low	30.3	Very low	47 Å²	47	78.5 Å²	78.5	25%	0.246	38%	0.382	C	S	.	.			trans	-56	125.5	164.7	-76.9	163.5	0	0	0	104.4	I215 Y217 Y298 Y302	I215-L300 HydrophobicContact CG2-CD2 4.03Å; Y217-L300 VanDerWaalsContact O-CD1 3.23Å; Y217-L300 WeakPolarHBondContact O-CD1 3.33Å; Y298-L300 PolarHBondContact O-N 2.95Å; L300-Y302 PolarHBondContact O-N 3.07Å; L300-Y302 VanDerWaalsContact O-N 3.14Å
301	P	27.1	Very low	29.7	Very low	62 Å²	62	87.2 Å²	87.2	40%	0.403	41%	0.411	S	S	.	.			trans	-53.1	129.3	163.5	24.2	-32.4	0	0	0	106.7	C299 F303	C299-P301 WeakPolarHBondContact O-CD 3.45Å; P301-F303 VanDerWaalsContact C-N 3.32Å; P301-F303 HydrophobicContact CB-CD1 4.5Å; P301-F303 HydrophobicContact CB-CD2 3.9Å; P301-F303 HydrophobicContact CB-CE1 4.06Å; P301-F303 HydrophobicContact CB-CE2 3.37Å; P301-F303 HydrophobicContact CB-CG 4.47Å; P301-F303 HydrophobicContact CB-CZ 3.48Å; P301-F303 VanDerWaalsContact CB-CZ 3.48Å; P301-F303 HydrophobicContact CG-CD2 3.68Å; P301-F303 HydrophobicContact CG-CE2 3.2Å; P301-F303 HydrophobicContact CG-CZ 3.85Å; P301-F303 WeakPolarHBondContact O-CD2 3.34Å; P301-F303 WeakPolarHBondContact O-CG 3.34Å; P301-F303 PolarHBondContact O-N 2.93Å
302	Y	27.1	Very low	29.3	Very low	165 Å²	165	83.2 Å²	83.2	65%	0.647	39%	0.393	S	S	*	.			trans	-66	90.6	-170.8	-137.1	-86.8	0	0	0	108.6	L300	L300-Y302 PolarHBondContact O-N 3.07Å; L300-Y302 VanDerWaalsContact O-N 3.14Å
303	F	30.5	Very low	29	Very low	62 Å²	62	83.9 Å²	83.9	27%	0.272	40%	0.398	S	S	.	.			trans	-118.6	100	180	-58.5	-40.1	0	0	0	107.8	Q218 P301 L852 T856 V860	Q218-F303 WeakPolarHBondContact CG-O 3.38Å; Q218-F303 PolarHBondContact NE2-O 3.38Å; P301-F303 VanDerWaalsContact C-N 3.32Å; P301-F303 HydrophobicContact CB-CD1 4.5Å; P301-F303 HydrophobicContact CB-CD2 3.9Å; P301-F303 HydrophobicContact CB-CE1 4.06Å; P301-F303 HydrophobicContact CB-CE2 3.37Å; P301-F303 HydrophobicContact CB-CG 4.47Å; P301-F303 HydrophobicContact CB-CZ 3.48Å; P301-F303 VanDerWaalsContact CB-CZ 3.48Å; P301-F303 HydrophobicContact CG-CD2 3.68Å; P301-F303 HydrophobicContact CG-CE2 3.2Å; P301-F303 HydrophobicContact CG-CZ 3.85Å; P301-F303 WeakPolarHBondContact O-CD2 3.34Å; P301-F303 WeakPolarHBondContact O-CG 3.34Å; P301-F303 PolarHBondContact O-N 2.93Å; F303-L852 HydrophobicContact CD2-CD2 4.4Å; F303-L852 HydrophobicContact CE1-CD1 4.12Å; F303-L852 HydrophobicContact CE1-CD2 4.31Å; F303-L852 HydrophobicContact CE2-CD2 3.49Å; F303-L852 VanDerWaalsContact CE2-CD2 3.49Å; F303-L852 HydrophobicContact CZ-CD1 3.85Å; F303-L852 HydrophobicContact CZ-CD2 3.42Å; F303-L852 VanDerWaalsContact CZ-CD2 3.42Å; F303-L852 HydrophobicContact CZ-CG 4.32Å; F303-T856 HydrophobicContact CB-CG2 3.74Å; F303-T856 HydrophobicContact CD1-CG2 3.01Å; F303-T856 HydrophobicContact CD2-CG2 3.81Å; F303-T856 HydrophobicContact CE1-CG2 3.32Å; F303-T856 HydrophobicContact CE2-CG2 4.06Å; F303-T856 HydrophobicContact CG-CG2 3.25Å; F303-T856 HydrophobicContact CZ-CG2 3.84Å; F303-V860 HydrophobicContact CE1-CG2 4.29Å
304	S	29.1	Very low	28.5	Very low	22 Å²	22	82 Å²	82	15%	0.154	39%	0.392	C	S	.	.			trans	-80.2	176.8	-174.5	60.3	0	0	0	0	114.2	Q218 I859	Q218-S304 PolarHBondContact NE2-O 3.31Å; S304-I859 WeakPolarHBondContact O-CD1 3.47Å; S304-I859 WeakPolarHBondContact OG-CD1 3.45Å; S304-I859 WeakPolarHBondContact OG-CG1 3.5Å; S304-I859 WeakPolarHBondContact OG-CG2 3.46Å
305	N	25.5	Very low	28	Very low	72 Å²	72	88.6 Å²	88.6	39%	0.385	42%	0.42	S	S	.	.			trans	36.1	107.9	157.7	-67	-1.7	0	0	0	122.1
306	Q	30.8	Very low	27.7	Very low	106 Å²	106	87.7 Å²	87.7	50%	0.495	42%	0.419	S	S	.	.				92.6	109.5	127.9	-70.8	-175.3	7.9	0	0	119.8	E855	Q306-E855 VanDerWaalsContact O-OE2 3.05Å
307	Y	29.5	Very low	27.6	Very low	180 Å²	180	85.9 Å²	85.9	71%	0.706	41%	0.412	S	S	*	.			trans	72.2	64.8	156.6	-51.8	-73.6	0	0	0	120	Q309	Y307-Q309 PolarHBondContact O-N 3.08Å; Y307-Q309 VanDerWaalsContact O-N 3.09Å
308	I	28.3	Very low	27.4	Very low	103 Å²	103	93.1 Å²	93.1	53%	0.528	44%	0.439	S	S	.	.			trans	-69.4	103.3	141.6	-60.5	173.7	0	0	0	106.8	L216 L310	L216-I308 HydrophobicContact CD2-CD1 4.11Å; I308-L310 VanDerWaalsContact C-N 3.31Å; I308-L310 PolarHBondContact O-N 2.99Å
309	Q	23.3	Very low	27.1	Very low	173 Å²	173	90.2 Å²	90.2	81%	0.808	43%	0.428	S	S	*	.			trans	-66.5	96.5	169.3	-152.9	174.6	14.8	0	0	107.4	Y307 Y311	Y307-Q309 PolarHBondContact O-N 3.08Å; Y307-Q309 VanDerWaalsContact O-N 3.09Å; Q309-Y311 PolarHBondContact O-N 3.22Å
310	L	27.1	Very low	27.2	Very low	54 Å²	54	95 Å²	95	28%	0.283	44%	0.442	S	S	.	.			trans	-59.4	120.6	176.3	-74.9	158.8	0	0	0	108.5	I308 I312 L314	I308-L310 VanDerWaalsContact C-N 3.31Å; I308-L310 PolarHBondContact O-N 2.99Å; L310-I312 HydrophobicContact CB-CB 4.2Å; L310-I312 HydrophobicContact CD2-CB 4.48Å; L310-I312 HydrophobicContact CD2-CD1 4.11Å; L310-I312 HydrophobicContact CD2-CG1 4.34Å; L310-I312 PolarHBondContact O-N 3.19Å; L310-L314 HydrophobicContact CD1-CD1 4.03Å; L310-L314 HydrophobicContact CD1-CD2 4.04Å; L310-L314 HydrophobicContact CD1-CG 4.31Å
311	Y	25.5	Very low	27.2	Very low	219 Å²	219	99.6 Å²	99.6	86%	0.859	46%	0.462	S	S	*	.	S	Bend	trans	-70.5	13.7	160.6	-76.1	-83.4	0	0	0	112.1	P167 Q309	P167-Y311 WeakPolarHBondContact CB-O 3.36Å; Q309-Y311 PolarHBondContact O-N 3.22Å
312	I	24.9	Very low	27.4	Very low	42 Å²	42	97.3 Å²	97.3	22%	0.215	45%	0.447	C	S	.	.	S	Bend	trans	-96.8	113.1	172.6	-58.6	-177.7	0	0	0	106.4	P167 M213 L310 L314	P167-I312 VanDerWaalsContact O-CA 3.25Å; P167-I312 WeakPolarHBondContact O-CA 3.46Å; P167-I312 WeakPolarHBondContact O-CB 3.41Å; P167-I312 WeakPolarHBondContact O-CG2 3.48Å; M213-I312 HydrophobicContact CE-CD1 4.21Å; L310-I312 HydrophobicContact CB-CB 4.2Å; L310-I312 HydrophobicContact CD2-CB 4.48Å; L310-I312 HydrophobicContact CD2-CD1 4.11Å; L310-I312 HydrophobicContact CD2-CG1 4.34Å; L310-I312 PolarHBondContact O-N 3.19Å; I312-L314 PolarHBondContact O-N 2.95Å
313	S	23.6	Very low	27.5	Very low	53 Å²	53	92 Å²	92	37%	0.371	43%	0.429	S	S	.	.			trans	-63.9	110.1	170.4	57.7	0	0	0	0	109	K315	S313-K315 PolarHBondContact O-N 3.1Å
314	L	25.3	Very low	27.6	Very low	76 Å²	76	95.6 Å²	95.6	40%	0.398	45%	0.451	S	S	.	.			trans	-76.1	56.4	-177.7	-66.3	167.5	0	0	0	112.6	V226 V230 L310 I312	V226-L314 HydrophobicContact CG1-CD1 4.37Å; V230-L314 HydrophobicContact CG2-CD2 3.42Å; V230-L314 VanDerWaalsContact CG2-CD2 3.42Å; L310-L314 HydrophobicContact CD1-CD1 4.03Å; L310-L314 HydrophobicContact CD1-CD2 4.04Å; L310-L314 HydrophobicContact CD1-CG 4.31Å; I312-L314 PolarHBondContact O-N 2.95Å
315	K	23.8	Very low	27.5	Very low	165 Å²	165	101.5 Å²	101.5	72%	0.717	47%	0.474	S	S	*	.			trans	-91.7	115	164.9	-76	-171.2	176.8	-175.9	0	107.9	S313	S313-K315 PolarHBondContact O-N 3.1Å
316	G	25.1	Very low	27.5	Very low	28 Å²	28	101 Å²	101	29%	0.289	47%	0.469	S	S	.	.			trans	-62.1	140.8	165.5	0	0	0	0	0	109.5	G229	G229-G316 WeakPolarHBondContact O-CA 3.23Å; G229-G316 PolarHBondContact O-N 2.94Å
317	Y	31.5	Very low	27.3	Very low	22 Å²	22	101.9 Å²	101.9	9%	0.086	48%	0.484	C	S	.	.			trans	-87.4	143.8	176	59.9	-97.8	0	0	0	110.2	F174 Q235 Q236 L319	F174-Y317 HydrophobicContact CB-CD1 4.25Å; F174-Y317 HydrophobicContact CB-CD2 4.08Å; F174-Y317 HydrophobicContact CB-CG 3.92Å; F174-Y317 AromaticContact CD2-CD2 3.42Å; F174-Y317 HydrophobicContact CD2-CD2 3.42Å; F174-Y317 VanDerWaalsContact CD2-CD2 3.42Å; F174-Y317 HydrophobicContact CD2-CE2 4.01Å; F174-Y317 AromaticContact CD2-CG 3.98Å; F174-Y317 HydrophobicContact CD2-CG 3.98Å; F174-Y317 HydrophobicContact CE2-CD2 4.19Å; F174-Y317 HydrophobicContact CG-CD2 4.08Å; F174-Y317 HydrophobicContact CG-CG 4.19Å; Q235-Y317 HydrophobicContact CB-CE2 4.47Å; Q236-Y317 PolarHBondContact NE2-OH 2.67Å; Y317-L319 HydrophobicContact CD2-CD1 3.75Å; Y317-L319 HydrophobicContact CE2-CD1 3.38Å
318	Y	26.5	Very low	27.2	Very low	186 Å²	186	97 Å²	97	73%	0.729	47%	0.473	S	S	*	.			trans	-99.9	106.1	178.8	-64.3	-87.8	0	0	0	109	K320	Y318-K320 PolarHBondContact O-N 3.08Å
319	L	30.4	Very low	26.9	Very low	2 Å²	2	98 Å²	98	1%	0.01	49%	0.49	C	S	.	.	G	3₁₀ helix	trans	-81.4	12.6	175.4	-129.6	107.3	0	0	0	113.6	F174 Q235 I238 R239 Y317 E321 L322	F174-L319 HydrophobicContact CD2-CD1 3.35Å; F174-L319 HydrophobicContact CD2-CG 4.13Å; F174-L319 HydrophobicContact CE2-CB 4.22Å; F174-L319 HydrophobicContact CE2-CD1 3.44Å; F174-L319 VanDerWaalsContact CE2-CD1 3.44Å; F174-L319 HydrophobicContact CE2-CG 3.68Å; Q235-L319 HydrophobicContact CB-CB 4.21Å; Q235-L319 HydrophobicContact CG-CB 4.3Å; I238-L319 HydrophobicContact CG2-CD2 4.03Å; R239-L319 HydrophobicContact CB-CD2 4.43Å; Y317-L319 HydrophobicContact CD2-CD1 3.75Å; Y317-L319 HydrophobicContact CE2-CD1 3.38Å; L319-E321 PolarHBondContact O-N 2.89Å; L319-E321 VanDerWaalsContact O-N 3.11Å; L319-L322 HydrophobicContact CD1-CD1 4.46Å; L319-L322 HydrophobicContact CD2-CB 3.93Å; L319-L322 HydrophobicContact CD2-CD1 3.27Å; L319-L322 HydrophobicContact CD2-CG 4.21Å; L319-L322 HydrophobicContact CG-CB 4.36Å; L319-L322 HydrophobicContact CG-CD1 3.68Å; L319-L322 WeakPolarHBondContact O-CB 3.46Å; L319-L322 PolarHBondContact O-N 2.98Å
320	K	28.2	Very low	27.1	Very low	156 Å²	156	98.1 Å²	98.1	68%	0.678	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-56.7	-31.3	-176.5	-165	179.5	178.8	-174.7	0	112.4	Y318 L322 I323	Y318-K320 PolarHBondContact O-N 3.08Å; K320-L322 PolarHBondContact O-N 3.22Å; K320-I323 WeakPolarHBondContact O-CB 3.28Å; K320-I323 PolarHBondContact O-N 3.43Å
321	E	28.7	Very low	27	Very low	144 Å²	144	101.9 Å²	101.9	67%	0.673	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-69.2	-15.5	179	-64.6	179.9	174.6	0	0	114	L319	L319-E321 PolarHBondContact O-N 2.89Å; L319-E321 VanDerWaalsContact O-N 3.11Å
322	L	30.1	Very low	27.1	Very low	14 Å²	14	96.4 Å²	96.4	7%	0.073	49%	0.489	C	S	.	.	G	3₁₀ helix	trans	-77.8	-21.8	173.6	-103.3	161.2	0	0	0	113.1	L181 L319 K320 D324 F325	L181-L322 HydrophobicContact CD1-CD1 3.38Å; L181-L322 HydrophobicContact CD1-CD2 3.58Å; L181-L322 HydrophobicContact CD1-CG 4.14Å; L319-L322 HydrophobicContact CD1-CD1 4.46Å; L319-L322 HydrophobicContact CD2-CB 3.93Å; L319-L322 HydrophobicContact CD2-CD1 3.27Å; L319-L322 HydrophobicContact CD2-CG 4.21Å; L319-L322 HydrophobicContact CG-CB 4.36Å; L319-L322 HydrophobicContact CG-CD1 3.68Å; L319-L322 WeakPolarHBondContact O-CB 3.46Å; L319-L322 PolarHBondContact O-N 2.98Å; K320-L322 PolarHBondContact O-N 3.22Å; L322-D324 VanDerWaalsContact C-N 3.27Å; L322-D324 PolarHBondContact O-N 3.12Å; L322-F325 PolarHBondContact O-N 2.89Å
323	I	30.5	Very low	27.1	Very low	53 Å²	53	100.4 Å²	100.4	27%	0.272	51%	0.51	S	S	.	.	G	3₁₀ helix	trans	-68.2	-30.5	177.8	-57.1	177.7	0	0	0	110.7	I238 K320 F325 H326 F332	I238-I323 HydrophobicContact CD1-CD1 3.7Å; I238-I323 HydrophobicContact CD1-CG1 4.2Å; I238-I323 HydrophobicContact CG1-CD1 4.29Å; I238-I323 HydrophobicContact CG2-CG1 4.22Å; K320-I323 WeakPolarHBondContact O-CB 3.28Å; K320-I323 PolarHBondContact O-N 3.43Å; I323-F325 PolarHBondContact O-N 3.07Å; I323-F325 VanDerWaalsContact O-N 3.07Å; I323-H326 PolarHBondContact O-N 3.3Å; I323-F332 HydrophobicContact CD1-CE2 4.47Å
324	D	31	Very low	27.4	Very low	138 Å²	138	103.1 Å²	103.1	74%	0.738	53%	0.529	S	S	*	.	G	3₁₀ helix	trans	-66.5	-12.6	-178.3	-68.4	-22.8	0	0	0	113.3	L322	L322-D324 VanDerWaalsContact C-N 3.27Å; L322-D324 PolarHBondContact O-N 3.12Å
325	F	28.3	Very low	27.6	Very low	145 Å²	145	100.7 Å²	100.7	64%	0.636	52%	0.523	S	S	*	.	G	3₁₀ helix	trans	-98.8	-1	172.3	-74.5	-80	0	0	0	114.3	L322 I323	L322-F325 PolarHBondContact O-N 2.89Å; I323-F325 PolarHBondContact O-N 3.07Å; I323-F325 VanDerWaalsContact O-N 3.07Å
326	H	24.8	Very low	28	Very low	62 Å²	62	95.4 Å²	95.4	29%	0.287	50%	0.503	S	S	.	.	S	Bend	trans	-99.5	120.4	176.4	-109.1	-72	0	0	0	110.9	H245 I323 T328	H245-H326 AromaticContact ND1-CE1 3.59Å; I323-H326 PolarHBondContact O-N 3.3Å; H326-T328 PolarHBondContact O-N 3.36Å
327	P	27	Very low	28.1	Very low	125 Å²	125	102.1 Å²	102.1	81%	0.812	52%	0.524	S	S	*	.			trans	-79.4	68.6	174	33.6	-32.8	0	0	0	109.5
328	T	26.2	Very low	27.9	Very low	78 Å²	78	104.3 Å²	104.3	48%	0.479	54%	0.542	S	S	.	.			trans	-138.6	104.6	161.6	45.5	0	0	0	0	109.3	H326 R330	H326-T328 PolarHBondContact O-N 3.36Å; T328-R330 PolarHBondContact O-N 2.83Å; T328-R330 VanDerWaalsContact O-N 3.08Å
329	S	23.9	Very low	28.3	Very low	124 Å²	124	97.6 Å²	97.6	87%	0.867	52%	0.521	S	S	*	.			trans	-69.2	95.6	168.4	57.8	0	0	0	0	109.6
330	R	26.6	Very low	28.2	Very low	174 Å²	174	100 Å²	100	66%	0.657	54%	0.535	S	S	*	.			trans	-135.7	118.5	159.6	-73.6	-165.4	-175.1	-177.3	2.9	110.2	T328 F332	T328-R330 PolarHBondContact O-N 2.83Å; T328-R330 VanDerWaalsContact O-N 3.08Å; R330-F332 PolarHBondContact O-N 3.31Å
331	T	25.8	Very low	28.1	Very low	134 Å²	134	100.5 Å²	100.5	82%	0.822	54%	0.538	S	S	*	.			trans	-53.7	111.5	165.1	40.9	0	0	0	0	109.2	D333	T331-D333 VanDerWaalsContact C-N 3.32Å; T331-D333 PolarHBondContact O-N 3.1Å
332	F	27.7	Very low	28	Very low	103 Å²	103	101.6 Å²	101.6	45%	0.452	54%	0.543	S	S	.	.			trans	-71.1	92.1	167.9	-88	-87.9	0	0	0	108.1	L234 I323 R330 L336	L234-F332 HydrophobicContact CD1-CD1 3.74Å; L234-F332 HydrophobicContact CD1-CE1 3.45Å; L234-F332 VanDerWaalsContact CD1-CE1 3.45Å; L234-F332 HydrophobicContact CD1-CZ 4.04Å; I323-F332 HydrophobicContact CD1-CE2 4.47Å; R330-F332 PolarHBondContact O-N 3.31Å; F332-L336 HydrophobicContact CD1-CD1 3.45Å; F332-L336 VanDerWaalsContact CD1-CD1 3.45Å; F332-L336 HydrophobicContact CE1-CD1 3.81Å
333	D	24.6	Very low	27.8	Very low	126 Å²	126	104.8 Å²	104.8	67%	0.674	57%	0.566	S	S	*	*			trans	-74.8	144	175	-129.1	-27.6	0	0	0	110.2	T331 G335	T331-D333 VanDerWaalsContact C-N 3.32Å; T331-D333 PolarHBondContact O-N 3.1Å; D333-G335 PolarHBondContact O-N 3.25Å
334	S	30.3	Very low	27.5	Very low	110 Å²	110	106 Å²	106	77%	0.769	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.7	4.9	-174.1	56.9	0	0	0	0	115.8	L336	S334-L336 VanDerWaalsContact C-N 3.28Å; S334-L336 PolarHBondContact O-N 3.15Å
335	G	29	Very low	27.2	Very low	26 Å²	26	104 Å²	104	27%	0.268	57%	0.567	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.2	-7.8	173.8	0	0	0	0	0	115.7	D333 F337 S338 V339	D333-G335 PolarHBondContact O-N 3.25Å; G335-F337 PolarHBondContact O-N 3.12Å; G335-S338 PolarHBondContact O-N 3.15Å; G335-S338 VanDerWaalsContact O-N 3.11Å; G335-S338 PolarHBondContact O-OG 3.06Å; G335-V339 WeakPolarHBondContact O-CG2 3.32Å; G335-V339 PolarHBondContact O-N 3Å
336	L	31.5	Very low	27	Very low	54 Å²	54	102.6 Å²	102.6	28%	0.283	56%	0.561	S	S	.	*	H	α-helix	trans	-58.3	-34.7	176	-107.1	141.2	0	0	0	112.9	L234 F332 S334 V340	L234-L336 HydrophobicContact CD1-CD1 4.4Å; F332-L336 HydrophobicContact CD1-CD1 3.45Å; F332-L336 VanDerWaalsContact CD1-CD1 3.45Å; F332-L336 HydrophobicContact CE1-CD1 3.81Å; S334-L336 VanDerWaalsContact C-N 3.28Å; S334-L336 PolarHBondContact O-N 3.15Å; L336-V340 VanDerWaalsContact O-CG2 3.27Å; L336-V340 WeakPolarHBondContact O-CG2 3.32Å; L336-V340 PolarHBondContact O-N 3.22Å; L336-V340 VanDerWaalsContact O-N 3.12Å
337	F	27.2	Very low	27	Very low	168 Å²	168	106 Å²	106	74%	0.737	59%	0.589	S	S	*	*	H	α-helix	trans	-74.4	-25.7	177	-94.9	-81.7	0	0	0	113.9	G335	G335-F337 PolarHBondContact O-N 3.12Å
338	S	28.4	Very low	26.8	Very low	68 Å²	68	103.6 Å²	103.6	48%	0.476	58%	0.575	S	S	.	*	H	α-helix	trans	-82	-34.6	174.3	54.5	0	0	0	0	112.2	G335 K341 Q342	G335-S338 PolarHBondContact O-N 3.15Å; G335-S338 VanDerWaalsContact O-N 3.11Å; G335-S338 PolarHBondContact O-OG 3.06Å; S338-K341 PolarHBondContact O-N 3.48Å; S338-Q342 PolarHBondContact O-N 3.34Å
339	V	33.4	Very low	26.6	Very low	46 Å²	46	105.7 Å²	105.7	28%	0.279	59%	0.593	S	S	.	*	H	α-helix	trans	-70.1	-43.8	178.2	175.7	0	0	0	0	111.3	G335 K341 Q342 S343	G335-V339 WeakPolarHBondContact O-CG2 3.32Å; G335-V339 PolarHBondContact O-N 3Å; V339-K341 PolarHBondContact O-N 2.89Å; V339-Q342 PolarHBondContact O-N 3.39Å; V339-Q342 VanDerWaalsContact O-N 3.14Å; V339-S343 PolarHBondContact O-N 2.74Å; V339-S343 PolarHBondContact O-OG 2.87Å
340	V	29.5	Very low	26.6	Very low	52 Å²	52	105.7 Å²	105.7	32%	0.315	58%	0.582	S	S	.	*	H	α-helix	trans	-66.9	-27.4	177.1	177.3	0	0	0	0	111.6	Y289 L336 S343 L344	Y289-V340 HydrophobicContact CD1-CG1 4.28Å; L336-V340 VanDerWaalsContact O-CG2 3.27Å; L336-V340 WeakPolarHBondContact O-CG2 3.32Å; L336-V340 PolarHBondContact O-N 3.22Å; L336-V340 VanDerWaalsContact O-N 3.12Å; V340-S343 PolarHBondContact O-OG 3.44Å; V340-L344 WeakPolarHBondContact O-CD1 3.34Å
341	K	25.6	Very low	26.5	Very low	166 Å²	166	106.5 Å²	106.5	72%	0.722	59%	0.59	S	S	*	*	H	α-helix	trans	-71.5	-29.5	173.4	-106.9	-175.7	175.7	-177.4	0	113.5	S338 V339	S338-K341 PolarHBondContact O-N 3.48Å; V339-K341 PolarHBondContact O-N 2.89Å
342	Q	25.8	Very low	26.4	Very low	168 Å²	168	106.4 Å²	106.4	79%	0.785	59%	0.585	S	S	*	*	H	α-helix	trans	-87.5	-16.7	-179.1	-74	-176.5	-10	0	0	113.4	S338 V339	S338-Q342 PolarHBondContact O-N 3.34Å; V339-Q342 PolarHBondContact O-N 3.39Å; V339-Q342 VanDerWaalsContact O-N 3.14Å
343	S	26.1	Very low	26.3	Very low	81 Å²	81	108.6 Å²	108.6	57%	0.566	61%	0.606	S	S	*	*	S	Bend	trans	-91.8	5.8	176.1	53.3	0	0	0	0	114.8	V339 V340	V339-S343 PolarHBondContact O-N 2.74Å; V339-S343 PolarHBondContact O-OG 2.87Å; V340-S343 PolarHBondContact O-OG 3.44Å
344	L	24.2	Very low	26.2	Very low	78 Å²	78	108.4 Å²	108.4	41%	0.408	61%	0.61	S	S	.	*			trans	-96.3	98.8	160.2	-81.6	126.8	0	0	0	107.3	V340	V340-L344 WeakPolarHBondContact O-CD1 3.34Å
345	P	25	Very low	25.9	Very low	96 Å²	96	109.5 Å²	109.5	62%	0.623	61%	0.607	S	S	*	*				-147.2	148	95.9	33.3	-14.7	0	0	0	115.3
346	F	23.4	Very low	25.7	Very low	115 Å²	115	115.5 Å²	115.5	50%	0.504	63%	0.633	S	S	.	*			trans	-29.9	154.5	154.3	-73.8	-78.2	0	0	0	114.9	S292 S348	S292-F346 WeakPolarHBondContact OG-CE1 3.32Å; S292-F346 WeakPolarHBondContact OG-CZ 3.34Å; F346-S348 PolarHBondContact O-N 3.11Å
347	P	25.9	Very low	25.7	Very low	133 Å²	133	122 Å²	122	86%	0.864	66%	0.658	S	S	*	*			trans	-63.4	102.5	-170.5	28.2	-34.5	0	0	0	109.7
348	S	21.8	Very low	25.7	Very low	76 Å²	76	122.5 Å²	122.5	53%	0.531	66%	0.663	S	S	.	*			trans	-118.8	124.2	151.1	53.5	0	0	0	0	105.4	F346 I350	F346-S348 PolarHBondContact O-N 3.11Å; S348-I350 PolarHBondContact O-N 3.37Å
349	S	22.5	Very low	25.7	Very low	122 Å²	122	124.5 Å²	124.5	85%	0.853	68%	0.677	S	S	*	*			trans	-60.3	81.1	177.2	41.9	0	0	0	0	110.5	K351	S349-K351 PolarHBondContact O-N 2.81Å
350	I	25.1	Very low	25.2	Very low	124 Å²	124	129.7 Å²	129.7	64%	0.636	70%	0.698	S	S	*	*			trans	-83.7	79.6	170.3	-58.5	174.1	0	0	0	107.4	S348 N352	S348-I350 PolarHBondContact O-N 3.37Å; I350-N352 HydrophobicContact CG2-CB 4.14Å; I350-N352 PolarHBondContact O-N 3.12Å
351	K	23.5	Very low	25	Very low	190 Å²	190	135.2 Å²	135.2	83%	0.826	72%	0.72	S	S	*	*			trans	-52.2	100	136.7	-76.8	178.2	175	178.1	0	105.6	S349	S349-K351 PolarHBondContact O-N 2.81Å
352	N	23.6	Very low	25.1	Very low	133 Å²	133	137.1 Å²	137.1	71%	0.711	73%	0.728	S	S	*	*			trans	166.5	67.7	154.7	-81.4	-13.5	0	0	0	110.9	I350	I350-N352 HydrophobicContact CG2-CB 4.14Å; I350-N352 PolarHBondContact O-N 3.12Å
353	V	25.2	Very low	25.2	Very low	148 Å²	148	141.1 Å²	141.1	90%	0.897	74%	0.736	S	S	*	*			trans	-127.8	54.9	141.4	-169.1	0	0	0	0	107.4
354	V	24.2	Very low	25.2	Very low	123 Å²	123	144.3 Å²	144.3	75%	0.745	75%	0.747	S	S	*	*			trans	-100.8	94.1	156.2	178.1	0	0	0	0	104.9
355	N	23.4	Very low	25.2	Very low	133 Å²	133	149 Å²	149	71%	0.711	77%	0.767	S	S	*	*			trans	175.8	78.9	145.8	-90.7	-11.8	0	0	0	109.4
356	N	24.6	Very low	25.3	Very low	152 Å²	152	153.9 Å²	153.9	81%	0.813	78%	0.778	S	S	*	*			trans	-138.2	40.5	148.5	-118.3	-0.1	0	0	0	111.2
357	K	31.3	Very low	25.6	Very low	189 Å²	189	156.4 Å²	156.4	82%	0.822	80%	0.797	S	S	*	*			trans	-93.4	16.8	165.3	-83.3	-170.1	174.8	-178.8	0	113.2
358	H	27.6	Very low	25.5	Very low	180 Å²	180	158.5 Å²	158.5	83%	0.833	80%	0.795	S	S	*	*			trans	-123.1	40.4	177.9	-78	-24.7	0	0	0	115.1
359	S	27.9	Very low	25.7	Very low	109 Å²	109	165.7 Å²	165.7	76%	0.762	81%	0.81	S	S	*	*			trans	-123.3	53.3	151	69.5	0	0	0	0	110.5
360	Q	23.8	Very low	25.8	Very low	156 Å²	156	165.1 Å²	165.1	73%	0.729	81%	0.806	S	S	*	*			trans	-80.5	137.2	155.2	-85.8	-172	-21.4	0	0	108.9
361	H	24.3	Very low	25.9	Very low	168 Å²	168	164.6 Å²	164.6	78%	0.778	81%	0.814	S	S	*	*			trans	66.3	101.3	160.1	-65.5	-64	0	0	0	119.1
362	K	27.3	Very low	26	Very low	205 Å²	205	163.1 Å²	163.1	89%	0.891	82%	0.821	S	S	*	*				165.1	94.6	120.1	-91.4	174	-179.8	178.9	0	110.8
363	R	29.5	Very low	26.3	Very low	253 Å²	253	161 Å²	161	96%	0.955	82%	0.817	S	S	*	*			trans	-163.5	85	138.5	-115.1	174.1	178.8	171.5	0	109.5
364	N	24.9	Very low	26.3	Very low	148 Å²	148	158 Å²	158	79%	0.791	82%	0.816	S	S	*	*			trans	-56.7	145	156.1	-77.1	-4.3	0	0	0	110
365	E	25.4	Very low	26.4	Very low	177 Å²	177	160.9 Å²	160.9	83%	0.827	82%	0.818	S	S	*	*	S	Bend	trans	27.8	100	133.6	-59.4	-178.8	153.5	0	0	117.5
366	K	26.3	Very low	26.6	Very low	198 Å²	198	161.8 Å²	161.8	86%	0.861	82%	0.821	S	S	*	*			trans	167.5	99.1	132.4	-94.6	170.9	-176.2	-178.9	0	107.3
367	N	29.7	Very low	26.7	Very low	168 Å²	168	158.5 Å²	158.5	90%	0.898	81%	0.81	S	S	*	*			trans	-167	71.7	143.1	-89	-14.7	0	0	0	107.3
368	Q	23.9	Very low	26.6	Very low	176 Å²	176	156.4 Å²	156.4	82%	0.822	81%	0.808	S	S	*	*			trans	-68.9	145.5	149.5	-76.1	-176.2	-4.5	0	0	108.5
369	R	24.7	Very low	26.5	Very low	227 Å²	227	154.5 Å²	154.5	86%	0.857	80%	0.804	S	S	*	*			trans	96.2	106.9	160.6	-65.2	-179.4	176.7	-179.8	-1.9	118.4
370	S	24.8	Very low	26.6	Very low	110 Å²	110	153.8 Å²	153.8	77%	0.769	80%	0.799	S	S	*	*			trans	68.2	101	134.8	63.4	0	0	0	0	118.8
371	S	29.2	Very low	26.8	Very low	114 Å²	114	151.1 Å²	151.1	80%	0.797	80%	0.797	S	S	*	*				-170.3	111.2	116.9	20.4	0	0	0	0	110.2	S373	S371-S373 PolarHBondContact O-N 3.24Å
372	T	25.1	Very low	27.1	Very low	159 Å²	159	148.1 Å²	148.1	98%	0.975	79%	0.791	S	S	*	*			trans	-52.8	95.3	161.6	10.1	0	0	0	0	110
373	S	29.3	Very low	27.3	Very low	89 Å²	89	142.6 Å²	142.6	62%	0.622	77%	0.774	S	S	*	*			trans	-138.8	112.2	147.2	70.1	0	0	0	0	105.8	S371 K375	S371-S373 PolarHBondContact O-N 3.24Å; S373-K375 PolarHBondContact O-N 3.17Å
374	G	26	Very low	27.5	Very low	84 Å²	84	137.7 Å²	137.7	87%	0.866	76%	0.757	S	S	*	*			trans	-67.3	75.2	-178.2	0	0	0	0	0	110.6	I376	G374-I376 VanDerWaalsContact C-N 3.33Å; G374-I376 PolarHBondContact O-N 3.33Å
375	K	25.9	Very low	28.3	Very low	184 Å²	184	132.7 Å²	132.7	80%	0.8	73%	0.729	S	S	*	*			trans	-69	105	149	-75.1	-174.7	178.5	-178.8	0	104.7	S373 S377	S373-K375 PolarHBondContact O-N 3.17Å; K375-S377 VanDerWaalsContact C-N 3.31Å; K375-S377 PolarHBondContact O-N 3.09Å
376	I	28	Very low	29.6	Very low	151 Å²	151	125.9 Å²	125.9	77%	0.774	70%	0.701	S	S	*	*			trans	-39.1	105	163.1	-64.9	164.5	0	0	0	105.5	G374 D378	G374-I376 VanDerWaalsContact C-N 3.33Å; G374-I376 PolarHBondContact O-N 3.33Å; I376-D378 PolarHBondContact O-N 2.82Å; I376-D378 VanDerWaalsContact O-N 3.1Å
377	S	25.6	Very low	30.9	Very low	83 Å²	83	119.1 Å²	119.1	58%	0.58	68%	0.676	S	S	*	*			trans	-62.2	115.6	173.3	49.7	0	0	0	0	105.5	K375 N379	K375-S377 VanDerWaalsContact C-N 3.31Å; K375-S377 PolarHBondContact O-N 3.09Å; S377-N379 PolarHBondContact O-N 2.86Å
378	D	29.3	Very low	32.2	Very low	145 Å²	145	117.4 Å²	117.4	78%	0.775	66%	0.657	S	S	*	*			trans	-62.5	49.9	166.6	-72.6	-38	0	0	0	111.1	I376	I376-D378 PolarHBondContact O-N 2.82Å; I376-D378 VanDerWaalsContact O-N 3.1Å
379	N	24.8	Very low	34.1	Very low	141 Å²	141	110.7 Å²	110.7	75%	0.754	63%	0.629	S	S	*	*			trans	-94.6	4.7	177.2	-86.7	7.4	0	0	0	112.4	S377 S381	S377-N379 PolarHBondContact O-N 2.86Å; N379-S381 PolarHBondContact O-N 3.03Å
380	S	29.9	Very low	36.1	Very low	94 Å²	94	101.4 Å²	101.4	66%	0.657	60%	0.595	S	S	*	*			trans	-81.4	81.4	148.7	62.9	0	0	0	0	106.8	V382	S380-V382 PolarHBondContact O-N 2.8Å
381	S	29.1	Very low	38.3	Very low	99 Å²	99	99.2 Å²	99.2	69%	0.692	57%	0.573	S	S	*	*			trans	-58.6	85.3	154.4	58.8	0	0	0	0	105.8	N379 V383	N379-S381 PolarHBondContact O-N 3.03Å; S381-V383 PolarHBondContact O-N 3.47Å
382	V	30.9	Very low	40.5	Very low	105 Å²	105	96 Å²	96	64%	0.636	55%	0.547	S	S	*	.			trans	-59.2	99.6	164.7	177.8	0	0	0	0	102.4	S380 Y384	S380-V382 PolarHBondContact O-N 2.8Å; V382-Y384 PolarHBondContact O-N 2.86Å
383	V	31.9	Very low	43	Very low	89 Å²	89	89 Å²	89	54%	0.539	50%	0.503	S	S	.	.			trans	-49.7	112.1	173	175.6	0	0	0	0	104.1	S381 I385 M450	S381-V383 PolarHBondContact O-N 3.47Å; V383-I385 HydrophobicContact CG1-CG1 4.36Å; V383-I385 PolarHBondContact O-N 3.48Å; V383-M450 HydrophobicContact CG1-CE 4.49Å
384	Y	33.3	Very low	45.5	Very low	151 Å²	151	84.9 Å²	84.9	59%	0.592	47%	0.473	S	S	*	.			trans	-67.2	91.3	177.5	-178.3	-91.7	0	0	0	105.4	V382 P386	V382-Y384 PolarHBondContact O-N 2.86Å; Y384-P386 WeakPolarHBondContact O-CD 3.42Å
385	I	41.8	Very low	48.3	Very low	43 Å²	43	81 Å²	81	22%	0.221	43%	0.433	C	S	.	.			trans	-70.8	115	173.3	-62.9	168.2	0	0	0	104.5	V383 T387 C389 M450	V383-I385 HydrophobicContact CG1-CG1 4.36Å; V383-I385 PolarHBondContact O-N 3.48Å; I385-T387 PolarHBondContact O-N 2.9Å; I385-C389 HydrophobicContact CG2-CB 3.73Å; I385-M450 HydrophobicContact CD1-SD 4.23Å; I385-M450 HydrophobicContact CG1-SD 4.41Å
386	P	51.2	Low	51.2	Low	34 Å²	34	72.4 Å²	72.4	22%	0.221	40%	0.396	C	S	.	.			trans	-54.2	140.1	174.5	-22.3	33.2	0	0	0	109.8	Y384 W388 C389	Y384-P386 WeakPolarHBondContact O-CD 3.42Å; P386-W388 HydrophobicContact CB-CD2 4.2Å; P386-W388 HydrophobicContact CB-CG 4Å; P386-W388 HydrophobicContact CB-CZ2 4.3Å; P386-W388 HydrophobicContact CG-CZ2 4.15Å; P386-W388 PolarHBondContact O-N 3.22Å; P386-W388 VanDerWaalsContact O-N 3.08Å; P386-C389 WeakPolarHBondContact O-CB 3.35Å; P386-C389 PolarHBondContact O-N 3Å
387	T	54.3	Low	54	Low	56 Å²	56	65.3 Å²	65.3	34%	0.344	36%	0.359	S	S	.	.	H	α-helix	trans	-53.5	-33.6	-179.3	47.4	0	0	0	0	112.7	I385 C389 Q390 E391	I385-T387 PolarHBondContact O-N 2.9Å; T387-C389 PolarHBondContact O-N 3.33Å; T387-Q390 PolarHBondContact O-N 3.26Å; T387-E391 WeakPolarHBondContact O-CG 3.31Å; T387-E391 PolarHBondContact O-N 3.38Å
388	W	57.9	Low	57	Low	131 Å²	131	61.3 Å²	61.3	50%	0.496	33%	0.332	S	S	.	.	H	α-helix	trans	-64.6	-33.2	177.3	64	-99.8	0	0	0	113.5	P386 Q390 E391 D392	P386-W388 HydrophobicContact CB-CD2 4.2Å; P386-W388 HydrophobicContact CB-CG 4Å; P386-W388 HydrophobicContact CB-CZ2 4.3Å; P386-W388 HydrophobicContact CG-CZ2 4.15Å; P386-W388 PolarHBondContact O-N 3.22Å; P386-W388 VanDerWaalsContact O-N 3.08Å; W388-Q390 VanDerWaalsContact C-N 3.29Å; W388-Q390 PolarHBondContact O-N 3.44Å; W388-E391 PolarHBondContact O-N 3.34Å; W388-D392 WeakPolarHBondContact O-CB 3.49Å; W388-D392 PolarHBondContact O-N 3.42Å
389	C	62.4	Low	59.9	Low	35 Å²	35	54.5 Å²	54.5	24%	0.236	30%	0.295	C	S	.	.	H	α-helix	trans	-65.8	-36.5	175.7	-61.1	0	0	0	0	111.3	I385 P386 T387 Y393	I385-C389 HydrophobicContact CG2-CB 3.73Å; P386-C389 WeakPolarHBondContact O-CB 3.35Å; P386-C389 PolarHBondContact O-N 3Å; T387-C389 PolarHBondContact O-N 3.33Å; C389-Y393 VanDerWaalsContact O-CB 3.32Å; C389-Y393 WeakPolarHBondContact O-CB 3.45Å; C389-Y393 PolarHBondContact O-N 3.36Å
390	Q	67.4	Low	63	Low	33 Å²	33	49.4 Å²	49.4	15%	0.154	27%	0.267	C	S	.	.	H	α-helix	trans	-70.8	-41.3	175.7	-172.4	64.9	49.5	0	0	111.1	T387 W388 Y393 D394 H452	T387-Q390 PolarHBondContact O-N 3.26Å; W388-Q390 VanDerWaalsContact C-N 3.29Å; W388-Q390 PolarHBondContact O-N 3.44Å; Q390-Y393 PolarHBondContact O-N 3.42Å; Q390-D394 PolarHBondContact NE2-OD1 3.08Å; Q390-D394 WeakPolarHBondContact O-CB 3.46Å; Q390-D394 PolarHBondContact O-N 3.14Å; Q390-H452 PolarHBondContact OE1-CE1 3.02Å; Q390-H452 PolarHBondContact OE1-ND1 3.31Å
391	E	71.5	Confident	65.8	Low	63 Å²	63	45.4 Å²	45.4	29%	0.294	24%	0.24	S	C	.	.	H	α-helix	trans	-60.7	-44.6	175.8	-71	173.7	175.9	0	0	111.4	S237 T387 W388 D394 D395	S237-E391 PolarHBondContact OG-OE1 2.78Å; T387-E391 WeakPolarHBondContact O-CG 3.31Å; T387-E391 PolarHBondContact O-N 3.38Å; W388-E391 PolarHBondContact O-N 3.34Å; E391-D394 PolarHBondContact O-N 3.33Å; E391-D395 WeakPolarHBondContact O-CB 3.48Å; E391-D395 PolarHBondContact O-N 3Å
392	D	74.4	Confident	68.9	Low	47 Å²	47	40.7 Å²	40.7	25%	0.251	21%	0.207	S	C	.	.	H	α-helix	trans	-64.4	-42.6	175.1	-81	-24.2	0	0	0	111.8	W388 D395 Q396 K439 F443	W388-D392 WeakPolarHBondContact O-CB 3.49Å; W388-D392 PolarHBondContact O-N 3.42Å; D392-D395 PolarHBondContact O-N 3.28Å; D392-Q396 VanDerWaalsContact O-CG 3.27Å; D392-Q396 WeakPolarHBondContact O-CG 3.31Å; D392-Q396 PolarHBondContact O-N 2.68Å; D392-K439 IonicContact OD1-NZ 2.67Å; D392-K439 PolarHBondContact OD1-NZ 3.46Å; D392-F443 HydrophobicContact CB-CD2 4.24Å; D392-F443 HydrophobicContact CB-CE2 4.25Å; D392-F443 WeakPolarHBondContact O-CE2 3.39Å
393	Y	79	Confident	71.8	Confident	13 Å²	13	35.8 Å²	35.8	5%	0.051	18%	0.177	C	C	.	.	H	α-helix	trans	-61.4	-44.9	175.5	-178.2	-91.2	0	0	0	112.3	C389 Q390 D395 Q396 V397 H452 Y454	C389-Y393 VanDerWaalsContact O-CB 3.32Å; C389-Y393 WeakPolarHBondContact O-CB 3.45Å; C389-Y393 PolarHBondContact O-N 3.36Å; Q390-Y393 PolarHBondContact O-N 3.42Å; Y393-D395 VanDerWaalsContact C-N 3.33Å; Y393-D395 PolarHBondContact O-N 3.11Å; Y393-Q396 WeakPolarHBondContact O-CB 3.44Å; Y393-Q396 PolarHBondContact O-N 3.06Å; Y393-Q396 VanDerWaalsContact O-N 3.14Å; Y393-V397 HydrophobicContact CD1-CG2 4.07Å; Y393-V397 HydrophobicContact CE1-CG2 3.61Å; Y393-V397 WeakPolarHBondContact O-CG2 3.29Å; Y393-V397 PolarHBondContact O-N 3.26Å; Y393-H452 AromaticContact CD2-CD2 3.79Å; Y393-H452 HydrophobicContact CE1-CB 3.91Å; Y393-H452 HydrophobicContact CE2-CB 4.49Å; Y393-H452 AromaticContact CE2-CD2 3.75Å; Y393-Y454 HydrophobicContact CD1-CD2 4.5Å; Y393-Y454 AromaticContact CD1-CE2 3.93Å; Y393-Y454 HydrophobicContact CD1-CE2 3.93Å; Y393-Y454 AromaticContact CE1-CD2 3.68Å; Y393-Y454 HydrophobicContact CE1-CD2 3.68Å; Y393-Y454 AromaticContact CE1-CE2 3.53Å; Y393-Y454 HydrophobicContact CE1-CE2 3.53Å
394	D	81.5	Confident	74.5	Confident	1 Å²	1	33 Å²	33	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-62.3	-43.3	177.5	-64.7	-17	0	0	0	110.6	H245 I248 Q390 E391 Q396 V397 M398 Y454	H245-D394 IonicContact CD2-OD2 2.92Å; H245-D394 IonicContact NE2-OD2 2.73Å; H245-D394 PolarHBondContact NE2-OD2 3.22Å; I248-D394 HydrophobicContact CD1-CB 4.11Å; I248-D394 VanDerWaalsContact CD1-O 3.32Å; I248-D394 WeakPolarHBondContact CD1-O 3.18Å; Q390-D394 PolarHBondContact NE2-OD1 3.08Å; Q390-D394 WeakPolarHBondContact O-CB 3.46Å; Q390-D394 PolarHBondContact O-N 3.14Å; E391-D394 PolarHBondContact O-N 3.33Å; D394-Q396 PolarHBondContact O-N 3.23Å; D394-V397 PolarHBondContact O-N 3.37Å; D394-M398 WeakPolarHBondContact O-CB 3.48Å; D394-M398 PolarHBondContact O-N 3.12Å; D394-Y454 VanDerWaalsContact CG-OH 3.25Å; D394-Y454 PolarHBondContact OD1-OH 3.22Å
395	D	85	Confident	77.2	Confident	4 Å²	4	26.6 Å²	26.6	2%	0.021	14%	0.142	C	C	.	.	H	α-helix	trans	-60.4	-43.7	172.3	-78.1	-16.7	0	0	0	110.8	E391 D392 Y393 V397 M398 I399 K439 F443	E391-D395 WeakPolarHBondContact O-CB 3.48Å; E391-D395 PolarHBondContact O-N 3Å; D392-D395 PolarHBondContact O-N 3.28Å; Y393-D395 VanDerWaalsContact C-N 3.33Å; Y393-D395 PolarHBondContact O-N 3.11Å; D395-V397 PolarHBondContact O-N 2.96Å; D395-M398 WeakPolarHBondContact O-CB 3.38Å; D395-M398 PolarHBondContact O-N 3.22Å; D395-I399 WeakPolarHBondContact O-CB 3.11Å; D395-I399 VanDerWaalsContact O-CG1 3.25Å; D395-I399 WeakPolarHBondContact O-CG1 3.49Å; D395-I399 PolarHBondContact O-N 3.38Å; D395-K439 VanDerWaalsContact OD2-CE 3.31Å; D395-K439 WeakPolarHBondContact OD2-CE 3.26Å; D395-K439 IonicContact OD2-NZ 2.89Å; D395-K439 PolarHBondContact OD2-NZ 2.9Å; D395-F443 HydrophobicContact CB-CE2 3.93Å; D395-F443 HydrophobicContact CB-CZ 3.87Å
396	Q	85.8	Confident	79.6	Confident	2 Å²	2	24.6 Å²	24.6	1%	0.009	13%	0.132	C	C	.	.	H	α-helix	trans	-59	-46.1	177.5	-73.1	176	-17.6	0	0	111.7	D392 Y393 D394 M398 I399 H400 F443 P466 L468	D392-Q396 VanDerWaalsContact O-CG 3.27Å; D392-Q396 WeakPolarHBondContact O-CG 3.31Å; D392-Q396 PolarHBondContact O-N 2.68Å; Y393-Q396 WeakPolarHBondContact O-CB 3.44Å; Y393-Q396 PolarHBondContact O-N 3.06Å; Y393-Q396 VanDerWaalsContact O-N 3.14Å; D394-Q396 PolarHBondContact O-N 3.23Å; Q396-M398 VanDerWaalsContact C-N 3.32Å; Q396-M398 PolarHBondContact O-N 3.33Å; Q396-I399 PolarHBondContact O-N 3.27Å; Q396-H400 WeakPolarHBondContact O-CB 3.42Å; Q396-H400 PolarHBondContact O-N 2.67Å; Q396-F443 HydrophobicContact CB-CZ 4.34Å; Q396-F443 HydrophobicContact CG-CD2 4.04Å; Q396-F443 HydrophobicContact CG-CE1 4.15Å; Q396-F443 HydrophobicContact CG-CE2 3.62Å; Q396-F443 HydrophobicContact CG-CG 4.47Å; Q396-F443 HydrophobicContact CG-CZ 3.67Å; Q396-F443 PolarHBondContact NE2-O 3.38Å; Q396-P466 HydrophobicContact CB-CG 4Å; Q396-L468 HydrophobicContact CB-CD1 3.86Å; Q396-L468 HydrophobicContact CB-CG 4.45Å; Q396-L468 HydrophobicContact CG-CD1 3.68Å; Q396-L468 WeakPolarHBondContact O-CD2 3.32Å
397	V	86.1	Confident	81.4	Confident	2 Å²	2	25 Å²	25	1%	0.012	13%	0.132	C	C	.	.	H	α-helix	trans	-61.2	-43.2	177.1	174	0	0	0	0	110.8	I248 Y393 D394 D395 H400 G401 W457 P466	I248-V397 HydrophobicContact CD1-CB 4.3Å; I248-V397 HydrophobicContact CD1-CG1 4.22Å; I248-V397 HydrophobicContact CG1-CG1 4.24Å; I248-V397 HydrophobicContact CG2-CG1 3.78Å; Y393-V397 HydrophobicContact CD1-CG2 4.07Å; Y393-V397 HydrophobicContact CE1-CG2 3.61Å; Y393-V397 WeakPolarHBondContact O-CG2 3.29Å; Y393-V397 PolarHBondContact O-N 3.26Å; D394-V397 PolarHBondContact O-N 3.37Å; D395-V397 PolarHBondContact O-N 2.96Å; V397-H400 PolarHBondContact O-N 2.89Å; V397-G401 PolarHBondContact O-N 2.98Å; V397-W457 HydrophobicContact CG1-CD2 3.67Å; V397-W457 HydrophobicContact CG1-CE3 4.16Å; V397-W457 HydrophobicContact CG1-CG 4.19Å; V397-W457 HydrophobicContact CG1-CH2 3.83Å; V397-W457 HydrophobicContact CG1-CZ2 3.29Å; V397-W457 HydrophobicContact CG1-CZ3 4.23Å; V397-W457 WeakPolarHBondContact O-CH2 3.48Å; V397-P466 HydrophobicContact CG2-CG 4.07Å
398	M	89.7	Confident	83	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-63.4	-44.5	176.3	-176.4	-177.7	57.3	0	0	112.1	I247 I248 Y251 T274 Y277 L278 D394 D395 Q396 H400 G401 L402	I247-M398 HydrophobicContact CB-SD 4.29Å; I247-M398 HydrophobicContact CD1-SD 4.4Å; I247-M398 HydrophobicContact CG2-CG 3.84Å; I247-M398 HydrophobicContact CG2-SD 3.69Å; I248-M398 HydrophobicContact CD1-CB 4.45Å; I248-M398 HydrophobicContact CG1-CB 3.87Å; Y251-M398 HydrophobicContact CD2-CG 4.44Å; Y251-M398 HydrophobicContact CE2-CG 3.99Å; T274-M398 HydrophobicContact CG2-CE 4.25Å; T274-M398 HydrophobicContact CG2-CG 4.06Å; T274-M398 HydrophobicContact CG2-SD 3.88Å; Y277-M398 HydrophobicContact CD1-CE 3.74Å; Y277-M398 HydrophobicContact CD1-SD 4.02Å; Y277-M398 HydrophobicContact CE1-CE 3.49Å; Y277-M398 VanDerWaalsContact CE1-CE 3.49Å; Y277-M398 HydrophobicContact CE1-SD 4.04Å; L278-M398 HydrophobicContact CD2-CE 3.72Å; L278-M398 HydrophobicContact CG-CE 4.22Å; D394-M398 WeakPolarHBondContact O-CB 3.48Å; D394-M398 PolarHBondContact O-N 3.12Å; D395-M398 WeakPolarHBondContact O-CB 3.38Å; D395-M398 PolarHBondContact O-N 3.22Å; Q396-M398 VanDerWaalsContact C-N 3.32Å; Q396-M398 PolarHBondContact O-N 3.33Å; M398-H400 VanDerWaalsContact C-N 3.35Å; M398-G401 PolarHBondContact O-N 2.93Å; M398-L402 WeakPolarHBondContact O-CB 3.3Å; M398-L402 PolarHBondContact O-N 3.28Å
399	I	90.9	Very high	84.5	Confident	1 Å²	1	18 Å²	18	1%	0.005	10%	0.103	C	C	.	.	H	α-helix	trans	-66.2	-37.9	177.7	-64.1	-44.9	0	0	0	111.1	L278 D395 Q396 G401 L402 I403 L432 V435 F443 L468	L278-I399 HydrophobicContact CD1-CD1 3.72Å; L278-I399 HydrophobicContact CD2-CD1 4.2Å; D395-I399 WeakPolarHBondContact O-CB 3.11Å; D395-I399 VanDerWaalsContact O-CG1 3.25Å; D395-I399 WeakPolarHBondContact O-CG1 3.49Å; D395-I399 PolarHBondContact O-N 3.38Å; Q396-I399 PolarHBondContact O-N 3.27Å; I399-G401 VanDerWaalsContact C-N 3.34Å; I399-G401 PolarHBondContact O-N 2.59Å; I399-L402 HydrophobicContact CD1-CD2 4.11Å; I399-L402 WeakPolarHBondContact O-CB 3.46Å; I399-L402 PolarHBondContact O-N 2.97Å; I399-I403 HydrophobicContact CG2-CD1 3.9Å; I399-I403 HydrophobicContact CG2-CG1 4.32Å; I399-I403 WeakPolarHBondContact O-CG1 3.19Å; I399-I403 PolarHBondContact O-N 3.09Å; I399-L432 HydrophobicContact CG2-CD2 4.31Å; I399-V435 HydrophobicContact CD1-CG2 3.42Å; I399-V435 VanDerWaalsContact CD1-CG2 3.42Å; I399-V435 HydrophobicContact CG1-CG2 3.77Å; I399-F443 HydrophobicContact CG1-CE1 4.42Å; I399-F443 HydrophobicContact CG1-CZ 4.43Å; I399-L468 HydrophobicContact CB-CD2 4.14Å; I399-L468 HydrophobicContact CG2-CD2 3.93Å
400	H	89.6	Confident	85.8	Confident	34 Å²	34	16.3 Å²	16.3	16%	0.157	9%	0.092	C	C	.	.	H	α-helix	trans	-60.8	-44.8	173.8	-177.3	-86	0	0	0	111.3	Q396 V397 M398 L402 I403 G404 W457 P466 L468 S471	Q396-H400 WeakPolarHBondContact O-CB 3.42Å; Q396-H400 PolarHBondContact O-N 2.67Å; V397-H400 PolarHBondContact O-N 2.89Å; M398-H400 VanDerWaalsContact C-N 3.35Å; H400-L402 VanDerWaalsContact C-N 3.35Å; H400-L402 PolarHBondContact O-N 3.08Å; H400-I403 PolarHBondContact O-N 2.88Å; H400-G404 PolarHBondContact O-N 3.21Å; H400-W457 AromaticContact ND1-CH2 3.76Å; H400-W457 AromaticContact ND1-CZ3 3.54Å; H400-P466 HydrophobicContact CB-CB 3.74Å; H400-L468 HydrophobicContact CB-CD2 3.79Å; H400-S471 PolarHBondContact CD2-OG 3.03Å; H400-S471 PolarHBondContact NE2-OG 3.38Å
401	G	89	Confident	86.7	Confident	10 Å²	10	18 Å²	18	10%	0.103	10%	0.102	C	C	.	.	H	α-helix	trans	-59.9	-43.1	172.9	0	0	0	0	0	112.7	Y251 V397 M398 I399 G404 E405	Y251-G401 VanDerWaalsContact CD1-C 3.49Å; Y251-G401 WeakPolarHBondContact CD1-O 3.49Å; V397-G401 PolarHBondContact O-N 2.98Å; M398-G401 PolarHBondContact O-N 2.93Å; I399-G401 VanDerWaalsContact C-N 3.34Å; I399-G401 PolarHBondContact O-N 2.59Å; G401-G404 PolarHBondContact O-N 3.28Å; G401-E405 PolarHBondContact O-N 3.48Å; G401-E405 VanDerWaalsContact O-N 3.07Å
402	L	92.7	Very high	87.3	Confident	0 Å²	0	15.8 Å²	15.8	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-58.8	-49.2	175.4	176.3	71.4	0	0	0	111.9	Y251 V271 T274 M398 I399 H400 G404 E405 G406 L428 A431	Y251-L402 HydrophobicContact CE1-CB 4.37Å; Y251-L402 VanDerWaalsContact OH-CD1 3.25Å; Y251-L402 WeakPolarHBondContact OH-CD1 3.15Å; V271-L402 HydrophobicContact CB-CD1 4.33Å; V271-L402 HydrophobicContact CG1-CD1 3.9Å; V271-L402 HydrophobicContact CG2-CD1 4.08Å; T274-L402 HydrophobicContact CG2-CD1 4.46Å; T274-L402 HydrophobicContact CG2-CD2 4.29Å; M398-L402 WeakPolarHBondContact O-CB 3.3Å; M398-L402 PolarHBondContact O-N 3.28Å; I399-L402 HydrophobicContact CD1-CD2 4.11Å; I399-L402 WeakPolarHBondContact O-CB 3.46Å; I399-L402 PolarHBondContact O-N 2.97Å; H400-L402 VanDerWaalsContact C-N 3.35Å; H400-L402 PolarHBondContact O-N 3.08Å; L402-G404 VanDerWaalsContact C-N 3.32Å; L402-G404 PolarHBondContact O-N 2.58Å; L402-E405 PolarHBondContact O-N 2.8Å; L402-G406 PolarHBondContact O-N 3.2Å; L402-L428 HydrophobicContact CD1-CB 4.47Å; L402-L428 HydrophobicContact CD1-CD1 3.84Å; L402-L428 HydrophobicContact CD1-CG 4.23Å; L402-L428 HydrophobicContact CG-CD1 3.93Å; L402-L428 HydrophobicContact CG-CG 4.26Å; L402-L428 WeakPolarHBondContact O-CD1 3.43Å; L402-A431 HydrophobicContact CD2-CB 3.58Å
403	I	92.2	Very high	87.8	Confident	2 Å²	2	13.8 Å²	13.8	1%	0.01	8%	0.081	C	C	.	.	H	α-helix	trans	-62.7	-41.1	178.7	-67.5	167.9	0	0	0	110.8	I399 H400 E405 G406 L407 L432 L468 S471 L472 F475	I399-I403 HydrophobicContact CG2-CD1 3.9Å; I399-I403 HydrophobicContact CG2-CG1 4.32Å; I399-I403 WeakPolarHBondContact O-CG1 3.19Å; I399-I403 PolarHBondContact O-N 3.09Å; H400-I403 PolarHBondContact O-N 2.88Å; I403-E405 VanDerWaalsContact C-N 3.34Å; I403-E405 PolarHBondContact O-N 3.14Å; I403-G406 CarbonylContact O-C 3.56Å; I403-G406 VanDerWaalsContact O-CA 3.31Å; I403-G406 WeakPolarHBondContact O-CA 3.31Å; I403-G406 PolarHBondContact O-N 3.35Å; I403-L407 PolarHBondContact O-N 3.35Å; I403-L432 HydrophobicContact CD1-CD2 4.28Å; I403-L432 HydrophobicContact CG1-CD2 3.98Å; I403-L468 HydrophobicContact CD1-CD2 4.28Å; I403-S471 VanDerWaalsContact CG2-O 3.31Å; I403-S471 WeakPolarHBondContact CG2-O 3.32Å; I403-L472 HydrophobicContact CD1-CB 4.24Å; I403-F475 HydrophobicContact CG2-CB 3.86Å
404	G	89.2	Confident	87.6	Confident	30 Å²	30	16 Å²	16	31%	0.309	9%	0.094	S	C	.	.	H	α-helix	trans	-56.3	-45.4	174.8	0	0	0	0	0	112.6	H400 G401 L402 G406 L407 V408	H400-G404 PolarHBondContact O-N 3.21Å; G401-G404 PolarHBondContact O-N 3.28Å; L402-G404 VanDerWaalsContact C-N 3.32Å; L402-G404 PolarHBondContact O-N 2.58Å; G404-G406 VanDerWaalsContact C-N 3.3Å; G404-G406 PolarHBondContact O-N 3.31Å; G404-L407 PolarHBondContact O-N 2.67Å; G404-V408 PolarHBondContact O-N 3.39Å
405	E	89.9	Confident	87.2	Confident	18 Å²	18	23 Å²	23	8%	0.084	13%	0.126	C	C	.	.	H	α-helix	trans	-67.8	-30.1	173.1	-67.1	-57.1	137.8	0	0	112.5	Y251 L254 R267 G401 L402 I403 V408 L409	Y251-E405 HydrophobicContact CD1-CG 3.85Å; Y251-E405 HydrophobicContact CE1-CB 4.46Å; Y251-E405 HydrophobicContact CE1-CG 3.83Å; L254-E405 HydrophobicContact CD1-CG 4.34Å; R267-E405 WeakPolarHBondContact CD-OE2 3.25Å; R267-E405 HydrophobicContact CG-CB 4.17Å; R267-E405 HydrophobicContact CG-CG 4.3Å; R267-E405 WeakPolarHBondContact CG-OE2 3.05Å; R267-E405 IonicContact CZ-OE2 3.04Å; R267-E405 IonicContact NE-OE2 2.84Å; R267-E405 PolarHBondContact NE-OE2 3.26Å; G401-E405 PolarHBondContact O-N 3.48Å; G401-E405 VanDerWaalsContact O-N 3.07Å; L402-E405 PolarHBondContact O-N 2.8Å; I403-E405 VanDerWaalsContact C-N 3.34Å; I403-E405 PolarHBondContact O-N 3.14Å; E405-V408 PolarHBondContact O-N 3.35Å; E405-L409 VanDerWaalsContact O-CG 3.31Å; E405-L409 WeakPolarHBondContact O-CG 3.27Å; E405-L409 PolarHBondContact O-N 3.15Å
406	G	91	Very high	86.4	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-58.4	-44.8	171.2	0	0	0	0	0	113	L402 I403 G404 V408 L409 L410	L402-G406 PolarHBondContact O-N 3.2Å; I403-G406 CarbonylContact O-C 3.56Å; I403-G406 VanDerWaalsContact O-CA 3.31Å; I403-G406 WeakPolarHBondContact O-CA 3.31Å; I403-G406 PolarHBondContact O-N 3.35Å; G404-G406 VanDerWaalsContact C-N 3.3Å; G404-G406 PolarHBondContact O-N 3.31Å; G406-V408 VanDerWaalsContact C-N 3.29Å; G406-V408 PolarHBondContact O-N 2.91Å; G406-L409 WeakPolarHBondContact O-CB 3.24Å; G406-L409 PolarHBondContact O-N 3.49Å; G406-L410 WeakPolarHBondContact O-CG 3.47Å; G406-L410 PolarHBondContact O-N 2.84Å
407	L	90.5	Very high	85.7	Confident	42 Å²	42	28.2 Å²	28.2	22%	0.22	16%	0.155	C	C	.	.	H	α-helix	trans	-60.8	-39.1	176.6	-70.5	170.7	0	0	0	112.4	I403 G404 L410 D411 F475 K478	I403-L407 PolarHBondContact O-N 3.35Å; G404-L407 PolarHBondContact O-N 2.67Å; L407-L410 PolarHBondContact O-N 3.42Å; L407-D411 PolarHBondContact O-N 3.05Å; L407-F475 HydrophobicContact CD2-CB 4.24Å; L407-K478 HydrophobicContact CD2-CD 3.99Å; L407-K478 PolarHBondContact O-NZ 3.41Å
408	V	88.1	Confident	85.3	Confident	40 Å²	40	31.5 Å²	31.5	24%	0.242	17%	0.173	C	C	.	.	H	α-helix	trans	-67.8	-41.1	175.8	179.8	0	0	0	0	111.2	F260 G404 E405 G406 L410 D411 E412	F260-V408 HydrophobicContact CE1-CG1 4.39Å; G404-V408 PolarHBondContact O-N 3.39Å; E405-V408 PolarHBondContact O-N 3.35Å; G406-V408 VanDerWaalsContact C-N 3.29Å; G406-V408 PolarHBondContact O-N 2.91Å; V408-L410 VanDerWaalsContact C-N 3.27Å; V408-L410 PolarHBondContact O-N 3.23Å; V408-D411 WeakPolarHBondContact O-CB 3.46Å; V408-D411 PolarHBondContact O-N 3.32Å; V408-D411 VanDerWaalsContact O-N 3.16Å; V408-E412 PolarHBondContact O-N 2.91Å
409	L	89.2	Confident	84.7	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61.7	-36.3	175.7	-73.6	168.4	0	0	0	112.1	E405 G406 E412 L413 V421	E405-L409 VanDerWaalsContact O-CG 3.31Å; E405-L409 WeakPolarHBondContact O-CG 3.27Å; E405-L409 PolarHBondContact O-N 3.15Å; G406-L409 WeakPolarHBondContact O-CB 3.24Å; G406-L409 PolarHBondContact O-N 3.49Å; L409-E412 PolarHBondContact O-N 3.02Å; L409-L413 VanDerWaalsContact O-CB 3.3Å; L409-L413 WeakPolarHBondContact O-CB 3.32Å; L409-L413 PolarHBondContact O-N 3.44Å; L409-V421 HydrophobicContact CD2-CB 4.48Å; L409-V421 HydrophobicContact CD2-CG1 4.06Å
410	L	89.3	Confident	84.4	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-67	-36.1	175	-63.8	174.8	0	0	0	112	G406 L407 V408 N414 L425 F475 K478 F479 I482	G406-L410 WeakPolarHBondContact O-CG 3.47Å; G406-L410 PolarHBondContact O-N 2.84Å; L407-L410 PolarHBondContact O-N 3.42Å; V408-L410 VanDerWaalsContact C-N 3.27Å; V408-L410 PolarHBondContact O-N 3.23Å; L410-N414 PolarHBondContact O-N 3.39Å; L410-N414 PolarHBondContact O-ND2 2.64Å; L410-L425 HydrophobicContact CD2-CD1 4.01Å; L410-L425 HydrophobicContact CD2-CD2 4.12Å; L410-F475 HydrophobicContact CD1-CD2 3.76Å; L410-F475 HydrophobicContact CD1-CE2 3.68Å; L410-F475 HydrophobicContact CG-CE2 4.17Å; L410-K478 HydrophobicContact CB-CD 3.94Å; L410-K478 HydrophobicContact CB-CG 4.25Å; L410-K478 HydrophobicContact CD1-CB 3.96Å; L410-K478 HydrophobicContact CD1-CD 3.94Å; L410-K478 HydrophobicContact CD1-CG 3.89Å; L410-F479 HydrophobicContact CD1-CB 4.17Å; L410-F479 HydrophobicContact CD2-CD2 3.83Å; L410-I482 HydrophobicContact CD2-CD1 3.58Å
411	D	85.9	Confident	84.2	Confident	70 Å²	70	34.7 Å²	34.7	37%	0.374	19%	0.193	S	C	.	.	H	α-helix	trans	-65.8	-48.2	171.9	-70.7	-40.7	0	0	0	111.7	L407 V408 L413 N414 E415 K478	L407-D411 PolarHBondContact O-N 3.05Å; V408-D411 WeakPolarHBondContact O-CB 3.46Å; V408-D411 PolarHBondContact O-N 3.32Å; V408-D411 VanDerWaalsContact O-N 3.16Å; D411-L413 PolarHBondContact O-N 3.43Å; D411-N414 WeakPolarHBondContact O-CB 3.24Å; D411-N414 PolarHBondContact O-N 3.19Å; D411-N414 VanDerWaalsContact O-N 3.14Å; D411-E415 PolarHBondContact O-N 3.27Å; D411-E415 VanDerWaalsContact O-N 3.15Å; D411-K478 WeakPolarHBondContact OD1-CE 3.41Å; D411-K478 IonicContact OD1-NZ 3.73Å; D411-K478 PolarHBondContact OD1-NZ 2.78Å; D411-K478 IonicContact OD2-NZ 3.59Å; D411-K478 PolarHBondContact OD2-NZ 3.36Å
412	E	84	Confident	84.2	Confident	15 Å²	15	34.3 Å²	34.3	7%	0.07	19%	0.189	C	C	.	.	H	α-helix	trans	-61.7	-34	178.6	-72.8	-177.4	-167.7	0	0	112	F260 S264 R267 V408 L409 N414 E415 N416 V421	F260-E412 HydrophobicContact CD1-CG 3.97Å; F260-E412 WeakPolarHBondContact CD1-OE1 3.36Å; F260-E412 HydrophobicContact CE1-CG 3.78Å; S264-E412 PolarHBondContact OG-OE2 3.07Å; R267-E412 IonicContact CZ-OE1 2.87Å; R267-E412 IonicContact CZ-OE2 3.87Å; R267-E412 IonicContact NH1-OE1 3.58Å; R267-E412 PolarHBondContact NH1-OE1 3.22Å; R267-E412 IonicContact NH1-OE2 3.46Å; R267-E412 PolarHBondContact NH1-OE2 2.83Å; R267-E412 IonicContact NH2-OE1 2.77Å; R267-E412 PolarHBondContact NH2-OE1 3.33Å; V408-E412 PolarHBondContact O-N 2.91Å; L409-E412 PolarHBondContact O-N 3.02Å; E412-N414 VanDerWaalsContact C-N 3.34Å; E412-E415 PolarHBondContact O-N 3.49Å; E412-N416 CarbonylContact O-C 3.58Å; E412-N416 PolarHBondContact O-N 3.14Å; E412-V421 HydrophobicContact CB-CG1 4.23Å; E412-V421 HydrophobicContact CB-CG2 4.1Å
413	L	84.3	Confident	83.9	Confident	6 Å²	6	35 Å²	35	3%	0.031	19%	0.194	C	C	.	.	H	α-helix	trans	-64.6	-39.5	176.9	-174	63.7	0	0	0	112	L409 D411 E415 P417 V421 L422 L425 I482 L485	L409-L413 VanDerWaalsContact O-CB 3.3Å; L409-L413 WeakPolarHBondContact O-CB 3.32Å; L409-L413 PolarHBondContact O-N 3.44Å; D411-L413 PolarHBondContact O-N 3.43Å; L413-E415 VanDerWaalsContact C-N 3.31Å; L413-P417 HydrophobicContact CD1-CB 4.12Å; L413-V421 HydrophobicContact CB-CG1 4.11Å; L413-V421 HydrophobicContact CD1-CG1 4.39Å; L413-L422 HydrophobicContact CD1-CD2 3.55Å; L413-L422 HydrophobicContact CD1-CG 4.21Å; L413-L425 HydrophobicContact CD2-CD2 3.94Å; L413-I482 HydrophobicContact CD2-CD1 3.75Å; L413-L485 HydrophobicContact CD2-CD1 3.95Å; L413-L485 HydrophobicContact CD2-CD2 3.65Å; L413-L485 HydrophobicContact CD2-CG 4.48Å
414	N	76	Confident	83.9	Confident	59 Å²	59	35 Å²	35	32%	0.316	19%	0.193	S	C	.	.	H	α-helix	trans	-68.7	-30.7	175.7	-69.9	-23.1	0	0	0	112	L410 D411 E412 N520	L410-N414 PolarHBondContact O-N 3.39Å; L410-N414 PolarHBondContact O-ND2 2.64Å; D411-N414 WeakPolarHBondContact O-CB 3.24Å; D411-N414 PolarHBondContact O-N 3.19Å; D411-N414 VanDerWaalsContact O-N 3.14Å; E412-N414 VanDerWaalsContact C-N 3.34Å; N414-N520 PolarHBondContact O-ND2 3.26Å
415	E	73.4	Confident	84	Confident	147 Å²	147	33.5 Å²	33.5	69%	0.687	18%	0.179	S	C	*	.	H	α-helix	trans	-84.9	-45.7	-178.9	-68.8	-174.3	175.8	0	0	113.7	D411 E412 L413	D411-E415 PolarHBondContact O-N 3.27Å; D411-E415 VanDerWaalsContact O-N 3.15Å; E412-E415 PolarHBondContact O-N 3.49Å; L413-E415 VanDerWaalsContact C-N 3.31Å
416	N	68.5	Low	84.2	Confident	97 Å²	97	34.3 Å²	34.3	52%	0.519	18%	0.181	S	C	.	.			trans	-159.1	105.1	-179.4	-172.6	12.9	0	0	0	112	E412 N418	E412-N416 CarbonylContact O-C 3.58Å; E412-N416 PolarHBondContact O-N 3.14Å; N416-N418 PolarHBondContact O-N 2.97Å
417	P	71	Confident	84.3	Confident	19 Å²	19	36.1 Å²	36.1	12%	0.123	19%	0.188	C	C	.	.			trans	-70.5	93.1	-179.4	32.3	-39.6	0	0	0	111.7	L413 L519	L413-P417 HydrophobicContact CD1-CB 4.12Å; P417-L519 HydrophobicContact CB-CD1 3.4Å; P417-L519 VanDerWaalsContact CB-CD1 3.4Å; P417-L519 HydrophobicContact CG-CD1 3.34Å; P417-L519 HydrophobicContact CG-CG 4.02Å
418	N	76.8	Confident	84.5	Confident	72 Å²	72	34.1 Å²	34.1	39%	0.385	18%	0.178	S	C	.	.			trans	-92.5	151.8	170.8	-170	13.1	0	0	0	111.1	N416 E420 V421 L422	N416-N418 PolarHBondContact O-N 2.97Å; N418-E420 PolarHBondContact O-N 2.79Å; N418-V421 HydrophobicContact CB-CG2 4.24Å; N418-V421 PolarHBondContact O-N 2.67Å; N418-V421 VanDerWaalsContact O-N 3.15Å; N418-L422 WeakPolarHBondContact O-CG 3.45Å; N418-L422 PolarHBondContact O-N 3.05Å; N418-L422 VanDerWaalsContact O-N 3.08Å
419	G	78.2	Confident	84.7	Confident	18 Å²	18	32.2 Å²	32.2	19%	0.186	17%	0.166	C	C	.	.	H	α-helix	trans	-57.9	-31.6	174.4	0	0	0	0	0	113.2	S423	G419-S423 VanDerWaalsContact O-CB 3.28Å; G419-S423 WeakPolarHBondContact O-CB 3.39Å; G419-S423 PolarHBondContact O-N 3.49Å; G419-S423 PolarHBondContact O-OG 2.69Å
420	E	82.8	Confident	84.7	Confident	79 Å²	79	35 Å²	35	37%	0.369	18%	0.177	S	C	.	.	H	α-helix	trans	-66.6	-45.1	175.1	-67.4	-176.1	162.3	0	0	112.2	N418 S423 S424	N418-E420 PolarHBondContact O-N 2.79Å; E420-S423 PolarHBondContact O-N 2.73Å; E420-S423 PolarHBondContact O-OG 2.67Å; E420-S424 WeakPolarHBondContact O-CB 3.36Å; E420-S424 PolarHBondContact O-N 2.89Å; E420-S424 PolarHBondContact O-OG 3.04Å
421	V	85.9	Confident	84.8	Confident	5 Å²	5	35 Å²	35	3%	0.03	18%	0.177	C	C	.	.	H	α-helix	trans	-61.7	-48.1	177.8	176.5	0	0	0	0	109.9	L409 E412 L413 N418 S424 L425	L409-V421 HydrophobicContact CD2-CB 4.48Å; L409-V421 HydrophobicContact CD2-CG1 4.06Å; E412-V421 HydrophobicContact CB-CG1 4.23Å; E412-V421 HydrophobicContact CB-CG2 4.1Å; L413-V421 HydrophobicContact CB-CG1 4.11Å; L413-V421 HydrophobicContact CD1-CG1 4.39Å; N418-V421 HydrophobicContact CB-CG2 4.24Å; N418-V421 PolarHBondContact O-N 2.67Å; N418-V421 VanDerWaalsContact O-N 3.15Å; V421-S424 PolarHBondContact O-N 2.89Å; V421-L425 PolarHBondContact O-N 3.25Å
422	L	88.7	Confident	85.1	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-62.4	-45.8	178.4	-68.2	167.5	0	0	0	112	L413 N418 S424 L425 Y426 L485 I619 W622 I623 I626	L413-L422 HydrophobicContact CD1-CD2 3.55Å; L413-L422 HydrophobicContact CD1-CG 4.21Å; N418-L422 WeakPolarHBondContact O-CG 3.45Å; N418-L422 PolarHBondContact O-N 3.05Å; N418-L422 VanDerWaalsContact O-N 3.08Å; L422-S424 VanDerWaalsContact C-N 3.27Å; L422-S424 PolarHBondContact O-N 2.8Å; L422-L425 PolarHBondContact O-N 2.92Å; L422-Y426 PolarHBondContact O-N 3.1Å; L422-L485 HydrophobicContact CD2-CD1 4.25Å; L422-I619 HydrophobicContact CD1-CB 4.22Å; L422-I619 HydrophobicContact CD1-CG1 4.19Å; L422-I619 HydrophobicContact CD1-CG2 3.82Å; L422-W622 HydrophobicContact CB-CB 3.62Å; L422-W622 HydrophobicContact CB-CG 4.08Å; L422-W622 HydrophobicContact CD1-CB 4.24Å; L422-W622 HydrophobicContact CG-CB 4.47Å; L422-I623 HydrophobicContact CD2-CG1 4.16Å; L422-I626 HydrophobicContact CB-CD1 4.04Å; L422-I626 HydrophobicContact CD2-CD1 3.6Å; L422-I626 HydrophobicContact CG-CD1 4.46Å; L422-I626 WeakPolarHBondContact O-CD1 3.47Å
423	S	88.1	Confident	85.1	Confident	16 Å²	16	31.8 Å²	31.8	11%	0.112	16%	0.159	C	C	.	.	H	α-helix	trans	-61.7	-37.7	176.5	74.5	0	0	0	0	112.2	G419 E420 Y426 Y427 W622	G419-S423 VanDerWaalsContact O-CB 3.28Å; G419-S423 WeakPolarHBondContact O-CB 3.39Å; G419-S423 PolarHBondContact O-N 3.49Å; G419-S423 PolarHBondContact O-OG 2.69Å; E420-S423 PolarHBondContact O-N 2.73Å; E420-S423 PolarHBondContact O-OG 2.67Å; S423-Y426 WeakPolarHBondContact O-CB 3.2Å; S423-Y426 PolarHBondContact O-N 3.08Å; S423-Y427 WeakPolarHBondContact O-CD2 3.28Å; S423-Y427 PolarHBondContact O-N 3.17Å; S423-W622 VanDerWaalsContact CB-CZ2 3.47Å
424	S	90.9	Very high	84.9	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-67.8	-43.4	178	-56.6	0	0	0	0	111.2	A268 V271 E420 V421 L422 Y426 Y427 L428	A268-S424 VanDerWaalsContact CA-OG 3.3Å; A268-S424 WeakPolarHBondContact CA-OG 3.42Å; A268-S424 VanDerWaalsContact CB-OG 3.26Å; A268-S424 WeakPolarHBondContact CB-OG 3.36Å; V271-S424 WeakPolarHBondContact CG1-O 3.43Å; E420-S424 WeakPolarHBondContact O-CB 3.36Å; E420-S424 PolarHBondContact O-N 2.89Å; E420-S424 PolarHBondContact O-OG 3.04Å; V421-S424 PolarHBondContact O-N 2.89Å; L422-S424 VanDerWaalsContact C-N 3.27Å; L422-S424 PolarHBondContact O-N 2.8Å; S424-Y426 VanDerWaalsContact C-N 3.32Å; S424-Y426 PolarHBondContact O-N 3.36Å; S424-Y427 PolarHBondContact O-N 3.24Å; S424-L428 WeakPolarHBondContact O-CB 3.4Å; S424-L428 PolarHBondContact O-N 3.06Å
425	L	92.6	Very high	85.3	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-62	-41	175.6	-176	58.9	0	0	0	111.4	L410 L413 V421 L422 L428 L429 F475 F479 L485 I626	L410-L425 HydrophobicContact CD2-CD1 4.01Å; L410-L425 HydrophobicContact CD2-CD2 4.12Å; L413-L425 HydrophobicContact CD2-CD2 3.94Å; V421-L425 PolarHBondContact O-N 3.25Å; L422-L425 PolarHBondContact O-N 2.92Å; L425-L428 HydrophobicContact CD1-CD2 4.3Å; L425-L428 PolarHBondContact O-N 3.44Å; L425-L429 HydrophobicContact CG-CD1 4.47Å; L425-L429 WeakPolarHBondContact O-CG 3.46Å; L425-L429 PolarHBondContact O-N 2.93Å; L425-F475 HydrophobicContact CD1-CE2 4.37Å; L425-F475 HydrophobicContact CD1-CZ 4.27Å; L425-F479 HydrophobicContact CD2-CE2 4.33Å; L425-L485 HydrophobicContact CD2-CD1 4.29Å; L425-I626 HydrophobicContact CB-CD1 4.34Å; L425-I626 HydrophobicContact CD2-CD1 4.23Å; L425-I626 HydrophobicContact CD2-CG2 4.21Å; L425-I626 HydrophobicContact CG-CD1 4.46Å; L425-I626 HydrophobicContact CG-CG2 4.42Å
426	Y	92.5	Very high	85.7	Confident	35 Å²	35	22.5 Å²	22.5	14%	0.137	11%	0.114	C	C	.	.	H	α-helix	trans	-57.2	-51.5	171.8	167.2	-101.2	0	0	0	111.9	L422 S423 S424 L428 L429 R430 W622 L625 S629	L422-Y426 PolarHBondContact O-N 3.1Å; S423-Y426 WeakPolarHBondContact O-CB 3.2Å; S423-Y426 PolarHBondContact O-N 3.08Å; S424-Y426 VanDerWaalsContact C-N 3.32Å; S424-Y426 PolarHBondContact O-N 3.36Å; Y426-L428 VanDerWaalsContact C-N 3.28Å; Y426-L428 PolarHBondContact O-N 3.39Å; Y426-L429 PolarHBondContact O-N 3.33Å; Y426-R430 HydrophobicContact CD2-CG 4.15Å; Y426-R430 HydrophobicContact CE1-CG 4.11Å; Y426-R430 HydrophobicContact CE2-CG 3.74Å; Y426-R430 VanDerWaalsContact O-CG 3.25Å; Y426-R430 WeakPolarHBondContact O-CG 3.23Å; Y426-R430 PolarHBondContact O-N 3.32Å; Y426-R430 PolarHBondContact OH-NE 2.83Å; Y426-W622 HydrophobicContact CD1-CE3 4.38Å; Y426-W622 AromaticContact CD1-CZ3 3.7Å; Y426-W622 HydrophobicContact CD1-CZ3 3.7Å; Y426-W622 HydrophobicContact CE1-CZ3 4.35Å; Y426-W622 HydrophobicContact CG-CE3 4.27Å; Y426-W622 HydrophobicContact CG-CZ3 4.04Å; Y426-L625 HydrophobicContact CD2-CB 3.6Å; Y426-L625 HydrophobicContact CD2-CD1 4.43Å; Y426-L625 HydrophobicContact CE2-CB 3.75Å; Y426-L625 HydrophobicContact CE2-CD1 4.21Å; Y426-L625 HydrophobicContact CE2-CD2 4.37Å; Y426-L625 HydrophobicContact CE2-CG 4.36Å; Y426-L625 HydrophobicContact CG-CB 4.37Å; Y426-S629 VanDerWaalsContact CD2-OG 3.31Å; Y426-S629 WeakPolarHBondContact CD2-OG 3.1Å; Y426-S629 WeakPolarHBondContact CE2-OG 3.31Å
427	Y	92.9	Very high	85.9	Confident	38 Å²	38	19.9 Å²	19.9	15%	0.149	10%	0.099	C	C	.	.	H	α-helix	trans	-63.4	-35.2	-179.9	-70	-53.2	0	0	0	112.6	R272 M275 S423 S424 R430 A431	R272-Y427 HydrophobicContact CB-CD2 3.9Å; R272-Y427 HydrophobicContact CB-CE2 4.15Å; R272-Y427 HydrophobicContact CB-CG 4.19Å; R272-Y427 HydrophobicContact CG-CD1 4.42Å; R272-Y427 HydrophobicContact CG-CD2 4.24Å; R272-Y427 HydrophobicContact CG-CE1 4.23Å; R272-Y427 HydrophobicContact CG-CE2 4.09Å; R272-Y427 HydrophobicContact CG-CG 4.43Å; M275-Y427 HydrophobicContact CE-CD1 3.39Å; M275-Y427 HydrophobicContact CE-CE1 3.66Å; S423-Y427 WeakPolarHBondContact O-CD2 3.28Å; S423-Y427 PolarHBondContact O-N 3.17Å; S424-Y427 PolarHBondContact O-N 3.24Å; Y427-R430 PolarHBondContact O-N 2.93Å; Y427-A431 WeakPolarHBondContact O-CB 3.3Å; Y427-A431 PolarHBondContact O-N 3.18Å
428	L	94.9	Very high	86	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-63.6	-49.6	175.2	179.7	131.6	0	0	0	111.7	V271 L402 S424 L425 Y426 R430 A431 L432 F475	V271-L428 HydrophobicContact CG1-CB 3.92Å; L402-L428 HydrophobicContact CD1-CB 4.47Å; L402-L428 HydrophobicContact CD1-CD1 3.84Å; L402-L428 HydrophobicContact CD1-CG 4.23Å; L402-L428 HydrophobicContact CG-CD1 3.93Å; L402-L428 HydrophobicContact CG-CG 4.26Å; L402-L428 WeakPolarHBondContact O-CD1 3.43Å; S424-L428 WeakPolarHBondContact O-CB 3.4Å; S424-L428 PolarHBondContact O-N 3.06Å; L425-L428 HydrophobicContact CD1-CD2 4.3Å; L425-L428 PolarHBondContact O-N 3.44Å; Y426-L428 VanDerWaalsContact C-N 3.28Å; Y426-L428 PolarHBondContact O-N 3.39Å; L428-R430 VanDerWaalsContact C-N 3.25Å; L428-R430 PolarHBondContact O-N 3.21Å; L428-A431 WeakPolarHBondContact O-CB 2.87Å; L428-A431 PolarHBondContact O-N 2.98Å; L428-A431 VanDerWaalsContact O-N 3.16Å; L428-L432 HydrophobicContact CD2-CD1 3.95Å; L428-L432 WeakPolarHBondContact O-CG 3.14Å; L428-L432 PolarHBondContact O-N 3.4Å; L428-F475 HydrophobicContact CD2-CD2 4.41Å; L428-F475 HydrophobicContact CD2-CE1 4.1Å; L428-F475 HydrophobicContact CD2-CE2 3.5Å; L428-F475 VanDerWaalsContact CD2-CE2 3.5Å; L428-F475 HydrophobicContact CD2-CZ 3.31Å
429	L	93.6	Very high	85.9	Confident	0 Å²	0	20 Å²	20	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-60.5	-37.7	176.6	-69.1	170.6	0	0	0	111.7	L425 Y426 R433 F475 F479 I626 A630 L633	L425-L429 HydrophobicContact CG-CD1 4.47Å; L425-L429 WeakPolarHBondContact O-CG 3.46Å; L425-L429 PolarHBondContact O-N 2.93Å; Y426-L429 PolarHBondContact O-N 3.33Å; L429-R433 WeakPolarHBondContact O-CB 3.3Å; L429-R433 PolarHBondContact O-N 3.36Å; L429-F475 HydrophobicContact CD2-CE1 4.11Å; L429-F475 HydrophobicContact CD2-CZ 4.08Å; L429-F479 HydrophobicContact CD1-CE2 4.31Å; L429-F479 HydrophobicContact CD1-CZ 4.04Å; L429-F479 HydrophobicContact CD2-CZ 4.38Å; L429-I626 HydrophobicContact CD1-CG2 3.74Å; L429-A630 HydrophobicContact CD1-CB 4.1Å; L429-L633 HydrophobicContact CD2-CD2 3.82Å
430	R	88.9	Confident	85.7	Confident	57 Å²	57	26.3 Å²	26.3	22%	0.215	12%	0.124	C	C	.	.	H	α-helix	trans	-69	-38.1	175.9	-66.5	-70.2	-94.2	-175.2	-3.1	112.5	M275 Y426 Y427 L428 R433 V434 S629 E632	M275-R430 HydrophobicContact CG-CB 3.95Å; Y426-R430 HydrophobicContact CD2-CG 4.15Å; Y426-R430 HydrophobicContact CE1-CG 4.11Å; Y426-R430 HydrophobicContact CE2-CG 3.74Å; Y426-R430 VanDerWaalsContact O-CG 3.25Å; Y426-R430 WeakPolarHBondContact O-CG 3.23Å; Y426-R430 PolarHBondContact O-N 3.32Å; Y426-R430 PolarHBondContact OH-NE 2.83Å; Y427-R430 PolarHBondContact O-N 2.93Å; L428-R430 VanDerWaalsContact C-N 3.25Å; L428-R430 PolarHBondContact O-N 3.21Å; R430-R433 WeakPolarHBondContact O-CB 3.41Å; R430-R433 PolarHBondContact O-N 3.15Å; R430-V434 WeakPolarHBondContact O-CG2 3.48Å; R430-V434 PolarHBondContact O-N 3.34Å; R430-S629 WeakPolarHBondContact CD-OG 3.25Å; R430-E632 IonicContact CZ-OE2 3.64Å; R430-E632 IonicContact NH1-OE1 2.79Å; R430-E632 IonicContact NH1-OE2 3.6Å; R430-E632 PolarHBondContact NH1-OE2 3.44Å
431	A	91	Very high	85.2	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-63.4	-48.5	173.3	0	0	0	0	0	111	M275 L278 L402 Y427 L428 R433 V434 V435	M275-A431 HydrophobicContact CB-CB 3.95Å; M275-A431 HydrophobicContact CG-CB 4.28Å; L278-A431 HydrophobicContact CD1-CB 3.89Å; L402-A431 HydrophobicContact CD2-CB 3.58Å; Y427-A431 WeakPolarHBondContact O-CB 3.3Å; Y427-A431 PolarHBondContact O-N 3.18Å; L428-A431 WeakPolarHBondContact O-CB 2.87Å; L428-A431 PolarHBondContact O-N 2.98Å; L428-A431 VanDerWaalsContact O-N 3.16Å; A431-R433 VanDerWaalsContact C-N 3.3Å; A431-R433 PolarHBondContact O-N 3.43Å; A431-V434 WeakPolarHBondContact O-CB 3.1Å; A431-V434 PolarHBondContact O-N 2.95Å; A431-V435 WeakPolarHBondContact O-CG2 3.08Å; A431-V435 PolarHBondContact O-N 3.08Å
432	L	91.3	Very high	84.6	Confident	1 Å²	1	26.4 Å²	26.4	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-57.4	-44.5	175.3	-69.6	176.8	0	0	0	111.3	I399 I403 L428 V434 V435 F436 L472 F475 L633	I399-L432 HydrophobicContact CG2-CD2 4.31Å; I403-L432 HydrophobicContact CD1-CD2 4.28Å; I403-L432 HydrophobicContact CG1-CD2 3.98Å; L428-L432 HydrophobicContact CD2-CD1 3.95Å; L428-L432 WeakPolarHBondContact O-CG 3.14Å; L428-L432 PolarHBondContact O-N 3.4Å; L432-V434 VanDerWaalsContact C-N 3.3Å; L432-V434 PolarHBondContact O-N 2.84Å; L432-V435 WeakPolarHBondContact O-CB 3.35Å; L432-V435 PolarHBondContact O-N 3.47Å; L432-V435 VanDerWaalsContact O-N 3.11Å; L432-F436 WeakPolarHBondContact O-CD2 3.26Å; L432-F436 PolarHBondContact O-N 2.92Å; L432-L472 HydrophobicContact CD1-CD1 4.28Å; L432-F475 HydrophobicContact CD1-CD1 4.26Å; L432-F475 HydrophobicContact CD1-CE1 3.94Å; L432-L633 HydrophobicContact CB-CD1 4.1Å; L432-L633 HydrophobicContact CB-CD2 4.16Å; L432-L633 HydrophobicContact CD1-CD2 4.31Å
433	R	84	Confident	84.1	Confident	18 Å²	18	26.7 Å²	26.7	7%	0.068	13%	0.133	C	C	.	.	H	α-helix	trans	-55	-45.5	174.4	-179.2	-167	152.4	162.9	5.8	111.7	L429 R430 A431 V435 F436 E437 E632 L633 Y636	L429-R433 WeakPolarHBondContact O-CB 3.3Å; L429-R433 PolarHBondContact O-N 3.36Å; R430-R433 WeakPolarHBondContact O-CB 3.41Å; R430-R433 PolarHBondContact O-N 3.15Å; A431-R433 VanDerWaalsContact C-N 3.3Å; A431-R433 PolarHBondContact O-N 3.43Å; R433-V435 VanDerWaalsContact C-N 3.33Å; R433-V435 PolarHBondContact O-N 2.96Å; R433-F436 PolarHBondContact O-N 3.09Å; R433-E437 IonicContact CZ-OE1 3.98Å; R433-E437 IonicContact NE-OE1 2.72Å; R433-E437 PolarHBondContact NE-OE1 2.67Å; R433-E437 IonicContact NH2-OE1 3.79Å; R433-E437 PolarHBondContact NH2-OE1 3.25Å; R433-E437 WeakPolarHBondContact O-CB 3.4Å; R433-E437 WeakPolarHBondContact O-CG 3.4Å; R433-E437 PolarHBondContact O-N 3.46Å; R433-E632 IonicContact CZ-OE2 2.93Å; R433-E632 IonicContact NH1-OE1 3.31Å; R433-E632 PolarHBondContact NH1-OE1 3.47Å; R433-E632 IonicContact NH1-OE2 3.79Å; R433-E632 PolarHBondContact NH1-OE2 2.87Å; R433-L633 HydrophobicContact CB-CD1 4.44Å; R433-Y636 HydrophobicContact CG-CD2 3.97Å; R433-Y636 HydrophobicContact CG-CE2 3.73Å
434	V	81.7	Confident	83.5	Confident	13 Å²	13	26.1 Å²	26.1	8%	0.079	13%	0.129	C	C	.	.	H	α-helix	trans	-62.4	-40.1	177.9	172.6	0	0	0	0	111.4	L278 Q282 R430 A431 L432 E437 T438	L278-V434 HydrophobicContact CB-CB 4.35Å; L278-V434 HydrophobicContact CB-CG1 3.77Å; Q282-V434 HydrophobicContact CB-CG1 4.33Å; R430-V434 WeakPolarHBondContact O-CG2 3.48Å; R430-V434 PolarHBondContact O-N 3.34Å; A431-V434 WeakPolarHBondContact O-CB 3.1Å; A431-V434 PolarHBondContact O-N 2.95Å; L432-V434 VanDerWaalsContact C-N 3.3Å; L432-V434 PolarHBondContact O-N 2.84Å; V434-E437 PolarHBondContact O-N 3.24Å; V434-T438 HydrophobicContact CG1-CG2 4.43Å; V434-T438 WeakPolarHBondContact O-CB 3.22Å; V434-T438 WeakPolarHBondContact O-CG2 3.41Å; V434-T438 PolarHBondContact O-N 2.71Å; V434-T438 PolarHBondContact O-OG1 3.16Å
435	V	83.7	Confident	82.4	Confident	1 Å²	1	28 Å²	28	1%	0.006	14%	0.14	C	C	.	.	H	α-helix	trans	-60.4	-51	175.4	178.4	0	0	0	0	110.5	L278 I399 A431 L432 R433 E437 T438 K439 F443 F444	L278-V435 HydrophobicContact CD1-CG2 3.95Å; L278-V435 HydrophobicContact CD2-CG2 4.38Å; I399-V435 HydrophobicContact CD1-CG2 3.42Å; I399-V435 VanDerWaalsContact CD1-CG2 3.42Å; I399-V435 HydrophobicContact CG1-CG2 3.77Å; A431-V435 WeakPolarHBondContact O-CG2 3.08Å; A431-V435 PolarHBondContact O-N 3.08Å; L432-V435 WeakPolarHBondContact O-CB 3.35Å; L432-V435 PolarHBondContact O-N 3.47Å; L432-V435 VanDerWaalsContact O-N 3.11Å; R433-V435 VanDerWaalsContact C-N 3.33Å; R433-V435 PolarHBondContact O-N 2.96Å; V435-E437 PolarHBondContact O-N 3.11Å; V435-T438 PolarHBondContact O-N 3.42Å; V435-T438 PolarHBondContact O-OG1 3.2Å; V435-K439 HydrophobicContact CG1-CB 4.27Å; V435-K439 HydrophobicContact CG1-CG 3.96Å; V435-K439 WeakPolarHBondContact O-CB 3.45Å; V435-K439 PolarHBondContact O-N 2.99Å; V435-F443 HydrophobicContact CG1-CD1 4.03Å; V435-F443 HydrophobicContact CG1-CE1 3.69Å; V435-F444 HydrophobicContact CG1-CE1 4.23Å; V435-F444 HydrophobicContact CG1-CZ 3.81Å
436	F	81.8	Confident	80.8	Confident	2 Å²	2	30.8 Å²	30.8	1%	0.009	16%	0.16	C	C	.	.	H	α-helix	trans	-62.7	-24.2	177	-89.5	-77.8	0	0	0	114.1	L432 R433 F444 L472 L633 Y636 I637 Y640 F653	L432-F436 WeakPolarHBondContact O-CD2 3.26Å; L432-F436 PolarHBondContact O-N 2.92Å; R433-F436 PolarHBondContact O-N 3.09Å; F436-F444 HydrophobicContact CD1-CE2 4.18Å; F436-F444 AromaticContact CD1-CZ 3.97Å; F436-F444 HydrophobicContact CD1-CZ 3.97Å; F436-F444 AromaticContact CD2-CZ 3.99Å; F436-F444 HydrophobicContact CD2-CZ 3.99Å; F436-F444 HydrophobicContact CE1-CE1 4.4Å; F436-F444 AromaticContact CE1-CE2 3.99Å; F436-F444 HydrophobicContact CE1-CE2 3.99Å; F436-F444 AromaticContact CE1-CZ 3.75Å; F436-F444 HydrophobicContact CE1-CZ 3.75Å; F436-F444 AromaticContact CE2-CE1 3.96Å; F436-F444 HydrophobicContact CE2-CE1 3.96Å; F436-F444 AromaticContact CE2-CZ 3.78Å; F436-F444 HydrophobicContact CE2-CZ 3.78Å; F436-F444 HydrophobicContact CG-CZ 4.07Å; F436-F444 AromaticContact CZ-CE1 3.88Å; F436-F444 HydrophobicContact CZ-CE1 3.88Å; F436-F444 HydrophobicContact CZ-CE2 4.29Å; F436-F444 AromaticContact CZ-CZ 3.64Å; F436-F444 HydrophobicContact CZ-CZ 3.64Å; F436-L472 HydrophobicContact CE2-CD2 3.63Å; F436-L472 HydrophobicContact CZ-CD2 3.42Å; F436-L472 VanDerWaalsContact CZ-CD2 3.42Å; F436-L633 HydrophobicContact CD2-CD1 3.59Å; F436-L633 HydrophobicContact CE2-CD1 4.1Å; F436-L633 HydrophobicContact CG-CD1 4.26Å; F436-Y636 HydrophobicContact CB-CG 4.16Å; F436-I637 HydrophobicContact CE1-CG1 4.16Å; F436-I637 HydrophobicContact CE2-CG1 4.17Å; F436-I637 HydrophobicContact CZ-CG1 3.89Å; F436-Y640 AromaticContact CD1-CD1 3.98Å; F436-Y640 HydrophobicContact CD1-CD1 3.98Å; F436-Y640 AromaticContact CD1-CD2 3.68Å; F436-Y640 HydrophobicContact CD1-CD2 3.68Å; F436-Y640 HydrophobicContact CD1-CE1 4.19Å; F436-Y640 AromaticContact CD1-CE2 3.88Å; F436-Y640 HydrophobicContact CD1-CE2 3.88Å; F436-Y640 AromaticContact CD1-CG 3.75Å; F436-Y640 HydrophobicContact CD1-CG 3.75Å; F436-Y640 AromaticContact CE1-CD1 3.94Å; F436-Y640 HydrophobicContact CE1-CD1 3.94Å; F436-Y640 HydrophobicContact CE1-CD2 4.18Å; F436-Y640 AromaticContact CE1-CG 3.79Å; F436-Y640 HydrophobicContact CE1-CG 3.79Å; F436-Y640 WeakPolarHBondContact O-CE2 3.32Å; F436-Y640 PolarHBondContact O-OH 3.08Å; F436-F653 HydrophobicContact CE1-CD2 4.47Å; F436-F653 HydrophobicContact CE1-CE2 4.29Å
437	E	73	Confident	78.9	Confident	43 Å²	43	33.2 Å²	33.2	20%	0.201	17%	0.172	C	C	.	.	H	α-helix	trans	-78.9	-24	174.5	-82.2	-179.9	-174.5	0	0	113.5	Q282 R433 V434 V435 Y636	Q282-E437 PolarHBondContact NE2-OE2 3.22Å; R433-E437 IonicContact CZ-OE1 3.98Å; R433-E437 IonicContact NE-OE1 2.72Å; R433-E437 PolarHBondContact NE-OE1 2.67Å; R433-E437 IonicContact NH2-OE1 3.79Å; R433-E437 PolarHBondContact NH2-OE1 3.25Å; R433-E437 WeakPolarHBondContact O-CB 3.4Å; R433-E437 WeakPolarHBondContact O-CG 3.4Å; R433-E437 PolarHBondContact O-N 3.46Å; V434-E437 PolarHBondContact O-N 3.24Å; V435-E437 PolarHBondContact O-N 3.11Å; E437-Y636 HydrophobicContact CB-CE1 4.45Å; E437-Y636 HydrophobicContact CG-CD1 4.12Å; E437-Y636 HydrophobicContact CG-CD2 4.47Å; E437-Y636 HydrophobicContact CG-CE1 3.39Å; E437-Y636 HydrophobicContact CG-CE2 3.78Å; E437-Y636 WeakPolarHBondContact CG-OH 3.44Å; E437-Y636 WeakPolarHBondContact OE1-CE2 3.32Å; E437-Y636 PolarHBondContact OE1-OH 2.77Å
438	T	71.7	Confident	76.5	Confident	60 Å²	60	35.9 Å²	35.9	37%	0.368	20%	0.196	S	C	.	.	H	α-helix	trans	-118	-31.2	-164.3	53	0	0	0	0	114.7	Q282 V434 V435	Q282-T438 HydrophobicContact CB-CG2 3.71Å; Q282-T438 VanDerWaalsContact CD-CG2 3.44Å; Q282-T438 HydrophobicContact CG-CG2 3.35Å; V434-T438 HydrophobicContact CG1-CG2 4.43Å; V434-T438 WeakPolarHBondContact O-CB 3.22Å; V434-T438 WeakPolarHBondContact O-CG2 3.41Å; V434-T438 PolarHBondContact O-N 2.71Å; V434-T438 PolarHBondContact O-OG1 3.16Å; V435-T438 PolarHBondContact O-N 3.42Å; V435-T438 PolarHBondContact O-OG1 3.2Å
439	K	76.1	Confident	73.8	Confident	34 Å²	34	40.6 Å²	40.6	15%	0.148	23%	0.229	C	C	.	.	S	Bend	trans	-102.1	139.4	-172.5	-61.7	-61	-167.7	171.1	0	110.8	D392 D395 V435 F443 Y640	D392-K439 IonicContact OD1-NZ 2.67Å; D392-K439 PolarHBondContact OD1-NZ 3.46Å; D395-K439 VanDerWaalsContact OD2-CE 3.31Å; D395-K439 WeakPolarHBondContact OD2-CE 3.26Å; D395-K439 IonicContact OD2-NZ 2.89Å; D395-K439 PolarHBondContact OD2-NZ 2.9Å; V435-K439 HydrophobicContact CG1-CB 4.27Å; V435-K439 HydrophobicContact CG1-CG 3.96Å; V435-K439 WeakPolarHBondContact O-CB 3.45Å; V435-K439 PolarHBondContact O-N 2.99Å; K439-F443 HydrophobicContact CB-CB 3.68Å; K439-F443 HydrophobicContact CB-CD1 3.77Å; K439-F443 HydrophobicContact CB-CD2 4.07Å; K439-F443 HydrophobicContact CB-CE1 4.43Å; K439-F443 HydrophobicContact CB-CG 3.56Å; K439-F443 HydrophobicContact CD-CD2 3.74Å; K439-F443 HydrophobicContact CD-CE2 3.87Å; K439-F443 HydrophobicContact CD-CG 4.15Å; K439-F443 HydrophobicContact CD-CZ 4.4Å; K439-F443 HydrophobicContact CG-CB 4.45Å; K439-F443 HydrophobicContact CG-CD1 3.9Å; K439-F443 HydrophobicContact CG-CD2 3.9Å; K439-F443 HydrophobicContact CG-CE1 4.08Å; K439-F443 HydrophobicContact CG-CE2 4.06Å; K439-F443 HydrophobicContact CG-CG 3.82Å; K439-F443 HydrophobicContact CG-CZ 4.16Å; K439-Y640 PolarHBondContact O-OH 3.2Å
440	E	73.9	Confident	71.3	Confident	150 Å²	150	44 Å²	44	70%	0.701	25%	0.246	S	C	*	.			trans	-67.6	167	177.8	-64.7	-168.4	160.8	0	0	112.9	S442 F443	E440-S442 PolarHBondContact O-N 3.4Å; E440-F443 WeakPolarHBondContact O-CB 3.49Å; E440-F443 PolarHBondContact O-N 3.45Å
441	V	72.9	Confident	68.8	Low	28 Å²	28	49.9 Å²	49.9	17%	0.17	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-55.7	-35.4	177.3	179.5	0	0	0	0	111.9	F443 F444 Y640 R643 C644	V441-F443 PolarHBondContact O-N 2.97Å; V441-F444 PolarHBondContact O-N 3.16Å; V441-Y640 HydrophobicContact CB-CD1 4.3Å; V441-Y640 HydrophobicContact CB-CE1 4.42Å; V441-Y640 HydrophobicContact CG2-CD1 3.62Å; V441-Y640 HydrophobicContact CG2-CE1 3.83Å; V441-Y640 HydrophobicContact CG2-CG 4.32Å; V441-R643 HydrophobicContact CG2-CB 3.85Å; V441-C644 WeakPolarHBondContact CG1-SG 3.22Å
442	S	72.5	Confident	66.5	Low	57 Å²	57	51.9 Å²	51.9	40%	0.399	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-60	-27.1	176.7	53.2	0	0	0	0	113.3	E440 F444 T445	E440-S442 PolarHBondContact O-N 3.4Å; S442-F444 PolarHBondContact O-N 2.92Å; S442-T445 PolarHBondContact O-N 3.41Å; S442-T445 PolarHBondContact O-OG1 2.91Å
443	F	77.4	Confident	64	Low	8 Å²	8	59.8 Å²	59.8	4%	0.035	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-61.2	-27.6	177.7	-179.6	-95.2	0	0	0	112.9	D392 D395 Q396 I399 V435 K439 E440 V441 T445 L468	D392-F443 HydrophobicContact CB-CD2 4.24Å; D392-F443 HydrophobicContact CB-CE2 4.25Å; D392-F443 WeakPolarHBondContact O-CE2 3.39Å; D395-F443 HydrophobicContact CB-CE2 3.93Å; D395-F443 HydrophobicContact CB-CZ 3.87Å; Q396-F443 HydrophobicContact CB-CZ 4.34Å; Q396-F443 HydrophobicContact CG-CD2 4.04Å; Q396-F443 HydrophobicContact CG-CE1 4.15Å; Q396-F443 HydrophobicContact CG-CE2 3.62Å; Q396-F443 HydrophobicContact CG-CG 4.47Å; Q396-F443 HydrophobicContact CG-CZ 3.67Å; Q396-F443 PolarHBondContact NE2-O 3.38Å; I399-F443 HydrophobicContact CG1-CE1 4.42Å; I399-F443 HydrophobicContact CG1-CZ 4.43Å; V435-F443 HydrophobicContact CG1-CD1 4.03Å; V435-F443 HydrophobicContact CG1-CE1 3.69Å; K439-F443 HydrophobicContact CB-CB 3.68Å; K439-F443 HydrophobicContact CB-CD1 3.77Å; K439-F443 HydrophobicContact CB-CD2 4.07Å; K439-F443 HydrophobicContact CB-CE1 4.43Å; K439-F443 HydrophobicContact CB-CG 3.56Å; K439-F443 HydrophobicContact CD-CD2 3.74Å; K439-F443 HydrophobicContact CD-CE2 3.87Å; K439-F443 HydrophobicContact CD-CG 4.15Å; K439-F443 HydrophobicContact CD-CZ 4.4Å; K439-F443 HydrophobicContact CG-CB 4.45Å; K439-F443 HydrophobicContact CG-CD1 3.9Å; K439-F443 HydrophobicContact CG-CD2 3.9Å; K439-F443 HydrophobicContact CG-CE1 4.08Å; K439-F443 HydrophobicContact CG-CE2 4.06Å; K439-F443 HydrophobicContact CG-CG 3.82Å; K439-F443 HydrophobicContact CG-CZ 4.16Å; E440-F443 WeakPolarHBondContact O-CB 3.49Å; E440-F443 PolarHBondContact O-N 3.45Å; V441-F443 PolarHBondContact O-N 2.97Å; F443-T445 VanDerWaalsContact C-N 3.31Å; F443-L468 HydrophobicContact CD1-CD1 4.11Å; F443-L468 HydrophobicContact CE1-CD1 3.73Å; F443-L468 HydrophobicContact CZ-CD1 4.39Å
444	F	76.2	Confident	61.8	Low	4 Å²	4	61.3 Å²	61.3	2%	0.018	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-85.4	-4	179.3	-64.3	-85.4	0	0	0	113.3	V435 F436 V441 S442 L468 S469 L472 Y640 F653	V435-F444 HydrophobicContact CG1-CE1 4.23Å; V435-F444 HydrophobicContact CG1-CZ 3.81Å; F436-F444 HydrophobicContact CD1-CE2 4.18Å; F436-F444 AromaticContact CD1-CZ 3.97Å; F436-F444 HydrophobicContact CD1-CZ 3.97Å; F436-F444 AromaticContact CD2-CZ 3.99Å; F436-F444 HydrophobicContact CD2-CZ 3.99Å; F436-F444 HydrophobicContact CE1-CE1 4.4Å; F436-F444 AromaticContact CE1-CE2 3.99Å; F436-F444 HydrophobicContact CE1-CE2 3.99Å; F436-F444 AromaticContact CE1-CZ 3.75Å; F436-F444 HydrophobicContact CE1-CZ 3.75Å; F436-F444 AromaticContact CE2-CE1 3.96Å; F436-F444 HydrophobicContact CE2-CE1 3.96Å; F436-F444 AromaticContact CE2-CZ 3.78Å; F436-F444 HydrophobicContact CE2-CZ 3.78Å; F436-F444 HydrophobicContact CG-CZ 4.07Å; F436-F444 AromaticContact CZ-CE1 3.88Å; F436-F444 HydrophobicContact CZ-CE1 3.88Å; F436-F444 HydrophobicContact CZ-CE2 4.29Å; F436-F444 AromaticContact CZ-CZ 3.64Å; F436-F444 HydrophobicContact CZ-CZ 3.64Å; V441-F444 PolarHBondContact O-N 3.16Å; S442-F444 PolarHBondContact O-N 2.92Å; F444-L468 HydrophobicContact CD1-CB 4.33Å; F444-S469 PolarHBondContact O-N 3.24Å; F444-L472 HydrophobicContact CE1-CD2 4.32Å; F444-Y640 HydrophobicContact CD2-CD1 4.3Å; F444-Y640 HydrophobicContact CD2-CE1 4.21Å; F444-Y640 HydrophobicContact CE2-CD1 4.04Å; F444-Y640 AromaticContact CE2-CE1 3.74Å; F444-Y640 HydrophobicContact CE2-CE1 3.74Å; F444-F653 HydrophobicContact CB-CE1 3.98Å; F444-F653 HydrophobicContact CB-CZ 3.73Å; F444-F653 HydrophobicContact CD1-CE1 4.06Å; F444-F653 HydrophobicContact CD1-CZ 4.17Å; F444-F653 AromaticContact CD2-CZ 3.92Å; F444-F653 HydrophobicContact CD2-CZ 3.92Å; F444-F653 AromaticContact CG-CE1 3.98Å; F444-F653 HydrophobicContact CG-CE1 3.98Å; F444-F653 AromaticContact CG-CZ 3.67Å; F444-F653 HydrophobicContact CG-CZ 3.67Å
445	T	68.1	Low	59.7	Low	39 Å²	39	67.1 Å²	67.1	24%	0.239	37%	0.372	C	S	.	.	S	Bend	trans	-88.9	145.6	178.5	58.5	0	0	0	0	112.9	S442 F443 H447 H650	S442-T445 PolarHBondContact O-N 3.41Å; S442-T445 PolarHBondContact O-OG1 2.91Å; F443-T445 VanDerWaalsContact C-N 3.31Å; T445-H447 PolarHBondContact O-N 2.98Å; T445-H650 WeakPolarHBondContact CG2-CE1 3.43Å; T445-H650 WeakPolarHBondContact CG2-ND1 3.24Å
446	S	59.6	Low	57.5	Low	58 Å²	58	69.1 Å²	69.1	41%	0.406	39%	0.393	S	S	.	.			trans	-66.5	116	168.6	46.2	0	0	0	0	110.2	S448 S465	S446-S448 PolarHBondContact O-N 2.85Å; S446-S465 WeakPolarHBondContact CA-OG 3.28Å; S446-S465 WeakPolarHBondContact CB-OG 3.47Å
447	H	50.9	Low	55.4	Low	87 Å²	87	70.1 Å²	70.1	40%	0.403	40%	0.396	S	S	.	.			trans	-73.9	81.8	163.6	-69	-31	0	0	0	108.6	T445 S449	T445-H447 PolarHBondContact O-N 2.98Å; H447-S449 PolarHBondContact O-N 3.14Å
448	S	42.3	Very low	53.6	Low	93 Å²	93	78.5 Å²	78.5	65%	0.65	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-3.1	-178.2	60.8	0	0	0	0	115.1	S446	S446-S448 PolarHBondContact O-N 2.85Å
449	S	38.6	Very low	52.1	Low	99 Å²	99	76.6 Å²	76.6	69%	0.692	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.1	-2.1	-170.5	59	0	0	0	0	116.4	H447	H447-S449 PolarHBondContact O-N 3.14Å
450	M	41.3	Very low	50.1	Low	72 Å²	72	81.1 Å²	81.1	36%	0.355	44%	0.44	S	S	.	.			trans	-123.7	102.4	-176.2	-72	-83.4	136.2	0	0	111.3	V383 I385 H452	V383-M450 HydrophobicContact CG1-CE 4.49Å; I385-M450 HydrophobicContact CD1-SD 4.23Å; I385-M450 HydrophobicContact CG1-SD 4.41Å; M450-H452 PolarHBondContact O-CD2 3.3Å; M450-H452 PolarHBondContact O-N 2.89Å
451	K	37.6	Very low	48.4	Very low	181 Å²	181	80.6 Å²	80.6	79%	0.787	45%	0.446	S	S	*	.			trans	-68.9	110	168.1	-75.5	-175	176.7	-176.9	0	108.8
452	H	42	Very low	46.6	Very low	42 Å²	42	86.4 Å²	86.4	19%	0.194	48%	0.476	C	S	.	.			trans	-101.4	123.2	169.7	-69.5	-82.3	0	0	0	110.1	Q390 Y393 M450 Y454	Q390-H452 PolarHBondContact OE1-CE1 3.02Å; Q390-H452 PolarHBondContact OE1-ND1 3.31Å; Y393-H452 AromaticContact CD2-CD2 3.79Å; Y393-H452 HydrophobicContact CE1-CB 3.91Å; Y393-H452 HydrophobicContact CE2-CB 4.49Å; Y393-H452 AromaticContact CE2-CD2 3.75Å; M450-H452 PolarHBondContact O-CD2 3.3Å; M450-H452 PolarHBondContact O-N 2.89Å; H452-Y454 VanDerWaalsContact C-N 3.34Å; H452-Y454 PolarHBondContact O-N 3.06Å
453	D	38.2	Very low	45	Very low	167 Å²	167	89.4 Å²	89.4	89%	0.893	48%	0.484	S	S	*	.			trans	-74.8	83.2	174.8	-76.8	-24	0	0	0	110.8	S455	D453-S455 PolarHBondContact O-N 3.41Å
454	Y	37.4	Very low	43.6	Very low	50 Å²	50	92.9 Å²	92.9	20%	0.196	50%	0.502	C	S	.	.			trans	-87.3	90.2	156.9	-94.6	-91.8	0	0	0	108.6	H245 I248 Y393 D394 H452 G456 W457	H245-Y454 PolarHBondContact CD2-OH 3.03Å; H245-Y454 VanDerWaalsContact CD2-OH 3.22Å; I248-Y454 HydrophobicContact CG2-CE1 4.34Å; Y393-Y454 HydrophobicContact CD1-CD2 4.5Å; Y393-Y454 AromaticContact CD1-CE2 3.93Å; Y393-Y454 HydrophobicContact CD1-CE2 3.93Å; Y393-Y454 AromaticContact CE1-CD2 3.68Å; Y393-Y454 HydrophobicContact CE1-CD2 3.68Å; Y393-Y454 AromaticContact CE1-CE2 3.53Å; Y393-Y454 HydrophobicContact CE1-CE2 3.53Å; D394-Y454 VanDerWaalsContact CG-OH 3.25Å; D394-Y454 PolarHBondContact OD1-OH 3.22Å; H452-Y454 VanDerWaalsContact C-N 3.34Å; H452-Y454 PolarHBondContact O-N 3.06Å; Y454-G456 PolarHBondContact O-N 3.22Å; Y454-W457 PolarHBondContact O-N 3.48Å; Y454-W457 VanDerWaalsContact O-N 3.15Å
455	S	39.3	Very low	42.7	Very low	134 Å²	134	93.3 Å²	93.3	94%	0.937	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	1.8	176.7	57.5	0	0	0	0	114.8	D453	D453-S455 PolarHBondContact O-N 3.41Å
456	G	37.6	Very low	42.5	Very low	43 Å²	43	91.5 Å²	91.5	44%	0.443	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	-15	173.8	0	0	0	0	0	116	N252 Y454 R458	N252-G456 PolarHBondContact ND2-O 2.99Å; Y454-G456 PolarHBondContact O-N 3.22Å; G456-R458 PolarHBondContact O-N 2.85Å
457	W	37.7	Very low	43.1	Very low	24 Å²	24	91.5 Å²	91.5	9%	0.091	49%	0.49	C	S	.	.			trans	-92	90.7	167.4	-90.1	71.3	0	0	0	107.8	I248 N252 V397 H400 Y454 L459	I248-W457 HydrophobicContact CG2-CZ2 4.35Å; N252-W457 PolarHBondContact ND2-NE1 3.1Å; N252-W457 PolarHBondContact OD1-NE1 2.96Å; N252-W457 VanDerWaalsContact OD1-NE1 3.08Å; V397-W457 HydrophobicContact CG1-CD2 3.67Å; V397-W457 HydrophobicContact CG1-CE3 4.16Å; V397-W457 HydrophobicContact CG1-CG 4.19Å; V397-W457 HydrophobicContact CG1-CH2 3.83Å; V397-W457 HydrophobicContact CG1-CZ2 3.29Å; V397-W457 HydrophobicContact CG1-CZ3 4.23Å; V397-W457 WeakPolarHBondContact O-CH2 3.48Å; H400-W457 AromaticContact ND1-CH2 3.76Å; H400-W457 AromaticContact ND1-CZ3 3.54Å; Y454-W457 PolarHBondContact O-N 3.48Å; Y454-W457 VanDerWaalsContact O-N 3.15Å; W457-L459 HydrophobicContact CE3-CD2 4.02Å; W457-L459 HydrophobicContact CE3-CG 4.02Å; W457-L459 HydrophobicContact CZ3-CD2 4.26Å; W457-L459 PolarHBondContact O-N 2.94Å
458	R	35	Very low	44.6	Very low	219 Å²	219	87.4 Å²	87.4	83%	0.826	47%	0.471	S	S	*	.			trans	-69.4	77.8	153.1	-71.4	-172.3	-177.7	-177.2	0.8	107.2	G456	G456-R458 PolarHBondContact O-N 2.85Å
459	L	39.4	Very low	46.5	Very low	20 Å²	20	83.7 Å²	83.7	11%	0.105	45%	0.445	C	S	.	.			trans	-55.7	134.3	138.1	-69.3	163.5	0	0	0	104.2	W457 V461 E463	W457-L459 HydrophobicContact CE3-CD2 4.02Å; W457-L459 HydrophobicContact CE3-CG 4.02Å; W457-L459 HydrophobicContact CZ3-CD2 4.26Å; W457-L459 PolarHBondContact O-N 2.94Å; L459-V461 PolarHBondContact O-N 3.41Å; L459-E463 HydrophobicContact CB-CB 4.2Å
460	D	35.1	Very low	48.5	Very low	129 Å²	129	81.1 Å²	81.1	69%	0.69	43%	0.425	S	S	*	.			trans	-48.8	136.5	173	-74.4	-46.9	0	0	0	107.6	N462 E463	D460-N462 PolarHBondContact O-N 3.16Å; D460-E463 PolarHBondContact O-N 3.03Å; D460-E463 VanDerWaalsContact O-N 3.16Å
461	V	37.8	Very low	50.6	Low	138 Å²	138	78.5 Å²	78.5	84%	0.836	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	7.1	-147.9	179.1	0	0	0	0	116.3	L459	L459-V461 PolarHBondContact O-N 3.41Å
462	N	35.4	Very low	53.1	Low	150 Å²	150	69.9 Å²	69.9	80%	0.802	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.1	5.9	179.6	-67.2	-25.7	0	0	0	116.6	D460	D460-N462 PolarHBondContact O-N 3.16Å
463	E	37.3	Very low	55.3	Low	121 Å²	121	69.9 Å²	69.9	57%	0.565	38%	0.376	S	S	*	.			trans	-91.9	106.9	173.3	-74.9	179.7	175.1	0	0	111.6	L459 D460 S465	L459-E463 HydrophobicContact CB-CB 4.2Å; D460-E463 PolarHBondContact O-N 3.03Å; D460-E463 VanDerWaalsContact O-N 3.16Å; E463-S465 VanDerWaalsContact C-N 3.3Å; E463-S465 PolarHBondContact O-N 3.46Å
464	I	49.5	Very low	57.7	Low	81 Å²	81	69.9 Å²	69.9	42%	0.415	36%	0.364	S	S	.	.	S	Bend	trans	-76.1	-10.5	-172.7	-67.2	169	0	0	0	113.1
465	S	55.7	Low	60.4	Low	12 Å²	12	67.5 Å²	67.5	8%	0.084	35%	0.354	C	S	.	.	S	Bend	trans	-165.2	147.3	175.3	57.1	0	0	0	0	109.8	S446 E463 D467	S446-S465 WeakPolarHBondContact CA-OG 3.28Å; S446-S465 WeakPolarHBondContact CB-OG 3.47Å; E463-S465 VanDerWaalsContact C-N 3.3Å; E463-S465 PolarHBondContact O-N 3.46Å; S465-D467 PolarHBondContact O-N 3.48Å; S465-D467 VanDerWaalsContact O-N 3.12Å
466	P	65	Low	62.9	Low	2 Å²	2	61.1 Å²	61.1	1%	0.013	31%	0.31	C	S	.	.			trans	-60.3	117.6	173.6	25.6	-33	0	0	0	110.2	Q396 V397 H400 L468	Q396-P466 HydrophobicContact CB-CG 4Å; V397-P466 HydrophobicContact CG2-CG 4.07Å; H400-P466 HydrophobicContact CB-CB 3.74Å; P466-L468 VanDerWaalsContact C-N 3.33Å; P466-L468 PolarHBondContact O-N 2.91Å
467	D	71.8	Confident	65.4	Low	58 Å²	58	63.9 Å²	63.9	31%	0.31	32%	0.315	S	S	.	.			trans	-76.9	89.9	171.9	-173.7	-5.9	0	0	0	109.4	S465 S469 T470 S471	S465-D467 PolarHBondContact O-N 3.48Å; S465-D467 VanDerWaalsContact O-N 3.12Å; D467-S469 VanDerWaalsContact C-N 3.3Å; D467-S469 WeakPolarHBondContact OD1-CB 3.21Å; D467-S469 PolarHBondContact OD1-N 3.44Å; D467-S469 VanDerWaalsContact OD1-N 3.12Å; D467-T470 VanDerWaalsContact CG-OG1 3.27Å; D467-T470 PolarHBondContact OD1-N 3.46Å; D467-T470 WeakPolarHBondContact OD2-CB 3.25Å; D467-T470 PolarHBondContact OD2-OG1 2.91Å; D467-S471 WeakPolarHBondContact O-CB 3.3Å; D467-S471 PolarHBondContact O-N 3.35Å; D467-S471 VanDerWaalsContact O-N 3.13Å; D467-S471 PolarHBondContact O-OG 3.04Å
468	L	82.9	Confident	68.1	Low	1 Å²	1	65.1 Å²	65.1	1%	0.005	32%	0.321	C	S	.	.	H	α-helix	trans	-65.7	-33.8	177.5	-74.1	-177	0	0	0	112.6	Q396 I399 H400 I403 F443 F444 P466 S471 L472	Q396-L468 HydrophobicContact CB-CD1 3.86Å; Q396-L468 HydrophobicContact CB-CG 4.45Å; Q396-L468 HydrophobicContact CG-CD1 3.68Å; Q396-L468 WeakPolarHBondContact O-CD2 3.32Å; I399-L468 HydrophobicContact CB-CD2 4.14Å; I399-L468 HydrophobicContact CG2-CD2 3.93Å; H400-L468 HydrophobicContact CB-CD2 3.79Å; I403-L468 HydrophobicContact CD1-CD2 4.28Å; F443-L468 HydrophobicContact CD1-CD1 4.11Å; F443-L468 HydrophobicContact CE1-CD1 3.73Å; F443-L468 HydrophobicContact CZ-CD1 4.39Å; F444-L468 HydrophobicContact CD1-CB 4.33Å; P466-L468 VanDerWaalsContact C-N 3.33Å; P466-L468 PolarHBondContact O-N 2.91Å; L468-S471 PolarHBondContact O-N 2.63Å; L468-L472 WeakPolarHBondContact O-CB 3.44Å; L468-L472 PolarHBondContact O-N 2.77Å
469	S	81.2	Confident	70.9	Confident	14 Å²	14	54.7 Å²	54.7	10%	0.098	28%	0.281	C	S	.	.	H	α-helix	trans	-62.9	-55.3	180	-161.7	0	0	0	0	110	F444 D467 S471 L472 E473 S651	F444-S469 PolarHBondContact O-N 3.24Å; D467-S469 VanDerWaalsContact C-N 3.3Å; D467-S469 WeakPolarHBondContact OD1-CB 3.21Å; D467-S469 PolarHBondContact OD1-N 3.44Å; D467-S469 VanDerWaalsContact OD1-N 3.12Å; S469-S471 VanDerWaalsContact C-N 3.31Å; S469-S471 PolarHBondContact O-N 3.28Å; S469-L472 PolarHBondContact O-N 2.7Å; S469-E473 WeakPolarHBondContact O-CG 3.43Å; S469-E473 PolarHBondContact O-N 3.1Å; S469-S651 PolarHBondContact OG-OG 2.72Å
470	T	82.2	Confident	73.4	Confident	46 Å²	46	53.9 Å²	53.9	28%	0.282	28%	0.277	S	S	.	.	H	α-helix	trans	-61.4	-39.7	178.7	-64.9	0	0	0	0	112	D467 E473 R474	D467-T470 VanDerWaalsContact CG-OG1 3.27Å; D467-T470 PolarHBondContact OD1-N 3.46Å; D467-T470 WeakPolarHBondContact OD2-CB 3.25Å; D467-T470 PolarHBondContact OD2-OG1 2.91Å; T470-E473 PolarHBondContact O-N 3.02Å; T470-R474 WeakPolarHBondContact O-CG 3.18Å; T470-R474 PolarHBondContact O-N 3.04Å
471	S	85.7	Confident	76	Confident	16 Å²	16	51.2 Å²	51.2	11%	0.112	27%	0.268	C	S	.	.	H	α-helix	trans	-63.9	-43.2	178	-62.2	0	0	0	0	111.7	H400 I403 D467 L468 S469 F475	H400-S471 PolarHBondContact CD2-OG 3.03Å; H400-S471 PolarHBondContact NE2-OG 3.38Å; I403-S471 VanDerWaalsContact CG2-O 3.31Å; I403-S471 WeakPolarHBondContact CG2-O 3.32Å; D467-S471 WeakPolarHBondContact O-CB 3.3Å; D467-S471 PolarHBondContact O-N 3.35Å; D467-S471 VanDerWaalsContact O-N 3.13Å; D467-S471 PolarHBondContact O-OG 3.04Å; L468-S471 PolarHBondContact O-N 2.63Å; S469-S471 VanDerWaalsContact C-N 3.31Å; S469-S471 PolarHBondContact O-N 3.28Å; S471-F475 PolarHBondContact O-N 3.22Å; S471-F475 VanDerWaalsContact O-N 3.1Å
472	L	89.3	Confident	78.4	Confident	1 Å²	1	46 Å²	46	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-68.3	-42	178.4	-178.7	62.1	0	0	0	111.5	I403 L432 F436 F444 L468 S469 R474 F475 L476 F653	I403-L472 HydrophobicContact CD1-CB 4.24Å; L432-L472 HydrophobicContact CD1-CD1 4.28Å; F436-L472 HydrophobicContact CE2-CD2 3.63Å; F436-L472 HydrophobicContact CZ-CD2 3.42Å; F436-L472 VanDerWaalsContact CZ-CD2 3.42Å; F444-L472 HydrophobicContact CE1-CD2 4.32Å; L468-L472 WeakPolarHBondContact O-CB 3.44Å; L468-L472 PolarHBondContact O-N 2.77Å; S469-L472 PolarHBondContact O-N 2.7Å; L472-R474 PolarHBondContact O-N 3.18Å; L472-F475 HydrophobicContact CD1-CD1 4.31Å; L472-F475 WeakPolarHBondContact O-CB 3.34Å; L472-F475 PolarHBondContact O-N 3.47Å; L472-L476 HydrophobicContact CD1-CD1 4.28Å; L472-L476 HydrophobicContact CD1-CG 4.12Å; L472-L476 HydrophobicContact CD2-CD1 4.48Å; L472-L476 HydrophobicContact CG-CD1 3.94Å; L472-L476 HydrophobicContact CG-CG 4.23Å; L472-L476 WeakPolarHBondContact O-CB 3.38Å; L472-L476 VanDerWaalsContact O-CG 3.31Å; L472-L476 WeakPolarHBondContact O-CG 3.38Å; L472-L476 PolarHBondContact O-N 3.19Å; L472-F653 HydrophobicContact CD2-CD1 3.58Å; L472-F653 HydrophobicContact CD2-CE1 3.86Å; L472-F653 HydrophobicContact CD2-CG 4.38Å; L472-F653 HydrophobicContact CG-CD1 4.43Å
473	E	87.8	Confident	81.1	Confident	41 Å²	41	39 Å²	39	19%	0.192	20%	0.198	C	C	.	.	H	α-helix	trans	-57.8	-47.4	174.9	-73.6	178.7	-176.6	0	0	111.5	S469 T470 F475 L476 D477 S651 L654	S469-E473 WeakPolarHBondContact O-CG 3.43Å; S469-E473 PolarHBondContact O-N 3.1Å; T470-E473 PolarHBondContact O-N 3.02Å; E473-F475 VanDerWaalsContact C-N 3.29Å; E473-F475 PolarHBondContact O-N 3.48Å; E473-L476 PolarHBondContact O-N 3.24Å; E473-D477 WeakPolarHBondContact O-CB 3.48Å; E473-D477 PolarHBondContact O-N 3.29Å; E473-S651 WeakPolarHBondContact OE1-CB 3.43Å; E473-S651 PolarHBondContact OE1-OG 2.76Å; E473-L654 HydrophobicContact CB-CD1 4.04Å; E473-L654 HydrophobicContact CB-CG 4.2Å; E473-L654 HydrophobicContact CG-CG 4.14Å; E473-L654 WeakPolarHBondContact O-CD1 3.45Å
474	R	88.8	Confident	83.5	Confident	167 Å²	167	33.5 Å²	33.5	63%	0.63	17%	0.173	S	C	*	.	H	α-helix	trans	-59.2	-40.2	175.5	-72.7	176.7	-179.1	177.7	3.3	112.6	T470 L472 K478	T470-R474 WeakPolarHBondContact O-CG 3.18Å; T470-R474 PolarHBondContact O-N 3.04Å; L472-R474 PolarHBondContact O-N 3.18Å; R474-K478 WeakPolarHBondContact O-CB 3.38Å; R474-K478 PolarHBondContact O-N 3.21Å
475	F	93.4	Very high	85.2	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-65.6	-45.9	175.9	171.5	-94.5	0	0	0	111.6	I403 L407 L410 L425 L428 L429 L432 S471 L472 E473 F479	I403-F475 HydrophobicContact CG2-CB 3.86Å; L407-F475 HydrophobicContact CD2-CB 4.24Å; L410-F475 HydrophobicContact CD1-CD2 3.76Å; L410-F475 HydrophobicContact CD1-CE2 3.68Å; L410-F475 HydrophobicContact CG-CE2 4.17Å; L425-F475 HydrophobicContact CD1-CE2 4.37Å; L425-F475 HydrophobicContact CD1-CZ 4.27Å; L428-F475 HydrophobicContact CD2-CD2 4.41Å; L428-F475 HydrophobicContact CD2-CE1 4.1Å; L428-F475 HydrophobicContact CD2-CE2 3.5Å; L428-F475 VanDerWaalsContact CD2-CE2 3.5Å; L428-F475 HydrophobicContact CD2-CZ 3.31Å; L429-F475 HydrophobicContact CD2-CE1 4.11Å; L429-F475 HydrophobicContact CD2-CZ 4.08Å; L432-F475 HydrophobicContact CD1-CD1 4.26Å; L432-F475 HydrophobicContact CD1-CE1 3.94Å; S471-F475 PolarHBondContact O-N 3.22Å; S471-F475 VanDerWaalsContact O-N 3.1Å; L472-F475 HydrophobicContact CD1-CD1 4.31Å; L472-F475 WeakPolarHBondContact O-CB 3.34Å; L472-F475 PolarHBondContact O-N 3.47Å; E473-F475 VanDerWaalsContact C-N 3.29Å; E473-F475 PolarHBondContact O-N 3.48Å; F475-F479 HydrophobicContact CE1-CB 4.35Å; F475-F479 HydrophobicContact CZ-CB 4.42Å; F475-F479 HydrophobicContact CZ-CG 4.48Å; F475-F479 WeakPolarHBondContact O-CB 3.4Å; F475-F479 PolarHBondContact O-N 3.37Å
476	L	93	Very high	86.2	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-65	-45.2	-179.3	-71.8	174.2	0	0	0	111.9	L472 E473 K478 F479 Y480 I637 F653 L654	L472-L476 HydrophobicContact CD1-CD1 4.28Å; L472-L476 HydrophobicContact CD1-CG 4.12Å; L472-L476 HydrophobicContact CD2-CD1 4.48Å; L472-L476 HydrophobicContact CG-CD1 3.94Å; L472-L476 HydrophobicContact CG-CG 4.23Å; L472-L476 WeakPolarHBondContact O-CB 3.38Å; L472-L476 VanDerWaalsContact O-CG 3.31Å; L472-L476 WeakPolarHBondContact O-CG 3.38Å; L472-L476 PolarHBondContact O-N 3.19Å; E473-L476 PolarHBondContact O-N 3.24Å; L476-K478 VanDerWaalsContact C-N 3.34Å; L476-K478 PolarHBondContact O-N 2.87Å; L476-F479 PolarHBondContact O-N 3.01Å; L476-Y480 HydrophobicContact CB-CD2 4.41Å; L476-Y480 HydrophobicContact CB-CE2 3.93Å; L476-Y480 HydrophobicContact CD2-CE1 4.47Å; L476-Y480 WeakPolarHBondContact O-CB 3.48Å; L476-Y480 WeakPolarHBondContact O-CD2 3.47Å; L476-Y480 PolarHBondContact O-N 3.05Å; L476-I637 HydrophobicContact CD1-CD1 3.91Å; L476-I637 HydrophobicContact CD2-CD1 3.74Å; L476-I637 HydrophobicContact CG-CD1 4.47Å; L476-F653 HydrophobicContact CD1-CB 4.35Å; L476-L654 HydrophobicContact CB-CD1 4.45Å
477	D	90.4	Very high	86.3	Confident	102 Å²	102	35.3 Å²	35.3	55%	0.545	18%	0.179	S	C	.	.	H	α-helix	trans	-55.4	-50.9	177.2	-175	43.6	0	0	0	111.3	E473 F479 Y480 S481 L654	E473-D477 WeakPolarHBondContact O-CB 3.48Å; E473-D477 PolarHBondContact O-N 3.29Å; D477-F479 PolarHBondContact O-N 2.65Å; D477-Y480 PolarHBondContact O-N 3.24Å; D477-S481 PolarHBondContact O-N 2.99Å; D477-L654 HydrophobicContact CB-CD1 3.71Å
478	K	92.5	Very high	85.5	Confident	50 Å²	50	33.3 Å²	33.3	22%	0.217	17%	0.17	C	C	.	.	H	α-helix	trans	-64.4	-40.8	177	-167.4	176.5	-173.5	177.8	0	112.2	L407 L410 D411 R474 L476 S481	L407-K478 HydrophobicContact CD2-CD 3.99Å; L407-K478 PolarHBondContact O-NZ 3.41Å; L410-K478 HydrophobicContact CB-CD 3.94Å; L410-K478 HydrophobicContact CB-CG 4.25Å; L410-K478 HydrophobicContact CD1-CB 3.96Å; L410-K478 HydrophobicContact CD1-CD 3.94Å; L410-K478 HydrophobicContact CD1-CG 3.89Å; D411-K478 WeakPolarHBondContact OD1-CE 3.41Å; D411-K478 IonicContact OD1-NZ 3.73Å; D411-K478 PolarHBondContact OD1-NZ 2.78Å; D411-K478 IonicContact OD2-NZ 3.59Å; D411-K478 PolarHBondContact OD2-NZ 3.36Å; R474-K478 WeakPolarHBondContact O-CB 3.38Å; R474-K478 PolarHBondContact O-N 3.21Å; L476-K478 VanDerWaalsContact C-N 3.34Å; L476-K478 PolarHBondContact O-N 2.87Å; K478-S481 PolarHBondContact O-N 2.48Å; K478-S481 PolarHBondContact O-OG 3.06Å
479	F	93.9	Very high	83.8	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-66.7	-41.4	178.6	-177.9	-109.3	0	0	0	111.9	L410 L425 L429 F475 L476 D477 S481 I482 Y483 I626 A630 F634	L410-F479 HydrophobicContact CD1-CB 4.17Å; L410-F479 HydrophobicContact CD2-CD2 3.83Å; L425-F479 HydrophobicContact CD2-CE2 4.33Å; L429-F479 HydrophobicContact CD1-CE2 4.31Å; L429-F479 HydrophobicContact CD1-CZ 4.04Å; L429-F479 HydrophobicContact CD2-CZ 4.38Å; F475-F479 HydrophobicContact CE1-CB 4.35Å; F475-F479 HydrophobicContact CZ-CB 4.42Å; F475-F479 HydrophobicContact CZ-CG 4.48Å; F475-F479 WeakPolarHBondContact O-CB 3.4Å; F475-F479 PolarHBondContact O-N 3.37Å; L476-F479 PolarHBondContact O-N 3.01Å; D477-F479 PolarHBondContact O-N 2.65Å; F479-S481 PolarHBondContact O-N 2.87Å; F479-I482 VanDerWaalsContact O-CG1 3.25Å; F479-I482 WeakPolarHBondContact O-CG1 3.28Å; F479-I482 PolarHBondContact O-N 3.21Å; F479-I482 VanDerWaalsContact O-N 3.13Å; F479-Y483 HydrophobicContact CD1-CD2 4.47Å; F479-Y483 HydrophobicContact CD1-CG 4.49Å; F479-Y483 AromaticContact CE1-CD2 3.44Å; F479-Y483 HydrophobicContact CE1-CD2 3.44Å; F479-Y483 VanDerWaalsContact CE1-CD2 3.44Å; F479-Y483 HydrophobicContact CE1-CE2 4.15Å; F479-Y483 AromaticContact CE1-CG 3.82Å; F479-Y483 HydrophobicContact CE1-CG 3.82Å; F479-Y483 HydrophobicContact CE2-CD2 4.35Å; F479-Y483 AromaticContact CZ-CD2 3.37Å; F479-Y483 HydrophobicContact CZ-CD2 3.37Å; F479-Y483 HydrophobicContact CZ-CE2 4.1Å; F479-Y483 HydrophobicContact CZ-CG 4.11Å; F479-Y483 VanDerWaalsContact O-CB 3.26Å; F479-Y483 WeakPolarHBondContact O-CB 3.25Å; F479-Y483 PolarHBondContact O-N 3.18Å; F479-I626 HydrophobicContact CE2-CG2 4.34Å; F479-I626 HydrophobicContact CZ-CG2 4.37Å; F479-A630 HydrophobicContact CE1-CB 3.61Å; F479-A630 HydrophobicContact CZ-CB 3.63Å; F479-F634 HydrophobicContact CD1-CZ 4.42Å; F479-F634 HydrophobicContact CE1-CE1 4.37Å; F479-F634 HydrophobicContact CE1-CZ 4.04Å
480	Y	93.6	Very high	81.9	Confident	3 Å²	3	41.9 Å²	41.9	1%	0.012	22%	0.22	C	C	.	.	H	α-helix	trans	-60.3	-35	176.1	-67.1	-31.6	0	0	0	111.9	L476 D477 I482 Y483 F634 L654 P657 P658 T661 R664	L476-Y480 HydrophobicContact CB-CD2 4.41Å; L476-Y480 HydrophobicContact CB-CE2 3.93Å; L476-Y480 HydrophobicContact CD2-CE1 4.47Å; L476-Y480 WeakPolarHBondContact O-CB 3.48Å; L476-Y480 WeakPolarHBondContact O-CD2 3.47Å; L476-Y480 PolarHBondContact O-N 3.05Å; D477-Y480 PolarHBondContact O-N 3.24Å; Y480-I482 PolarHBondContact O-N 3.47Å; Y480-I482 VanDerWaalsContact O-N 3.16Å; Y480-Y483 PolarHBondContact O-N 2.92Å; Y480-F634 HydrophobicContact CD1-CE1 4.44Å; Y480-F634 HydrophobicContact CD1-CZ 4.09Å; Y480-F634 HydrophobicContact CE1-CD1 4.43Å; Y480-F634 AromaticContact CE1-CE1 3.56Å; Y480-F634 HydrophobicContact CE1-CE1 3.56Å; Y480-F634 HydrophobicContact CE1-CE2 4.43Å; Y480-F634 AromaticContact CE1-CZ 3.56Å; Y480-F634 HydrophobicContact CE1-CZ 3.56Å; Y480-L654 HydrophobicContact CE2-CB 4.05Å; Y480-L654 WeakPolarHBondContact CE2-O 3.42Å; Y480-L654 PolarHBondContact OH-O 3.41Å; Y480-P657 HydrophobicContact CD1-CB 3.98Å; Y480-P657 HydrophobicContact CD2-CB 4.27Å; Y480-P657 HydrophobicContact CE1-CB 3.72Å; Y480-P657 HydrophobicContact CE2-CB 4.02Å; Y480-P657 HydrophobicContact CG-CB 4.25Å; Y480-P658 HydrophobicContact CD2-CG 4.45Å; Y480-T661 HydrophobicContact CD1-CG2 4.04Å; Y480-T661 HydrophobicContact CG-CG2 4.37Å; Y480-T661 PolarHBondContact O-OG1 2.92Å; Y480-T661 VanDerWaalsContact O-OG1 3.09Å; Y480-R664 PolarHBondContact O-NH2 3.46Å
481	S	89.4	Confident	80	Confident	72 Å²	72	40.5 Å²	40.5	50%	0.503	21%	0.212	S	C	.	.	H	α-helix	trans	-57.5	-31.5	177	77.8	0	0	0	0	113.3	D477 K478 F479 R664	D477-S481 PolarHBondContact O-N 2.99Å; K478-S481 PolarHBondContact O-N 2.48Å; K478-S481 PolarHBondContact O-OG 3.06Å; F479-S481 PolarHBondContact O-N 2.87Å; S481-R664 PolarHBondContact O-NH1 3.39Å; S481-R664 PolarHBondContact O-NH2 2.89Å
482	I	88.6	Confident	77.6	Confident	30 Å²	30	42.5 Å²	42.5	15%	0.154	22%	0.221	C	C	.	.	H	α-helix	trans	-108.4	-9.6	-177.5	65.4	174.5	0	0	0	114.3	L410 L413 F479 Y480 P484 L485	L410-I482 HydrophobicContact CD2-CD1 3.58Å; L413-I482 HydrophobicContact CD2-CD1 3.75Å; F479-I482 VanDerWaalsContact O-CG1 3.25Å; F479-I482 WeakPolarHBondContact O-CG1 3.28Å; F479-I482 PolarHBondContact O-N 3.21Å; F479-I482 VanDerWaalsContact O-N 3.13Å; Y480-I482 PolarHBondContact O-N 3.47Å; Y480-I482 VanDerWaalsContact O-N 3.16Å; I482-P484 CarbonylContact O-C 3.54Å; I482-L485 HydrophobicContact CB-CD2 4.31Å; I482-L485 HydrophobicContact CD1-CD2 3.99Å; I482-L485 HydrophobicContact CG1-CD2 4.11Å
483	Y	90.3	Very high	75	Confident	1 Å²	1	45 Å²	45	0%	0.004	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-86.5	143.4	-177.1	-178.7	-90	0	0	0	112.4	F479 Y480 N627 A630 F634 T661 R664 L665	F479-Y483 HydrophobicContact CD1-CD2 4.47Å; F479-Y483 HydrophobicContact CD1-CG 4.49Å; F479-Y483 AromaticContact CE1-CD2 3.44Å; F479-Y483 HydrophobicContact CE1-CD2 3.44Å; F479-Y483 VanDerWaalsContact CE1-CD2 3.44Å; F479-Y483 HydrophobicContact CE1-CE2 4.15Å; F479-Y483 AromaticContact CE1-CG 3.82Å; F479-Y483 HydrophobicContact CE1-CG 3.82Å; F479-Y483 HydrophobicContact CE2-CD2 4.35Å; F479-Y483 AromaticContact CZ-CD2 3.37Å; F479-Y483 HydrophobicContact CZ-CD2 3.37Å; F479-Y483 HydrophobicContact CZ-CE2 4.1Å; F479-Y483 HydrophobicContact CZ-CG 4.11Å; F479-Y483 VanDerWaalsContact O-CB 3.26Å; F479-Y483 WeakPolarHBondContact O-CB 3.25Å; F479-Y483 PolarHBondContact O-N 3.18Å; Y480-Y483 PolarHBondContact O-N 2.92Å; Y483-N627 HydrophobicContact CE2-CB 4.45Å; Y483-N627 PolarHBondContact OH-O 2.8Å; Y483-N627 VanDerWaalsContact OH-O 3.06Å; Y483-A630 HydrophobicContact CD2-CB 4.02Å; Y483-A630 HydrophobicContact CE2-CB 3.4Å; Y483-A630 VanDerWaalsContact CE2-CB 3.4Å; Y483-F634 HydrophobicContact CD1-CE2 4Å; Y483-F634 HydrophobicContact CD1-CZ 4.15Å; Y483-F634 AromaticContact CE1-CE2 3.53Å; Y483-F634 HydrophobicContact CE1-CE2 3.53Å; Y483-F634 HydrophobicContact CE1-CZ 4.07Å; Y483-F634 HydrophobicContact CG-CZ 4.44Å; Y483-F634 AromaticContact CZ-CE2 3.8Å; Y483-T661 HydrophobicContact CD1-CG2 3.83Å; Y483-R664 PolarHBondContact O-NE 2.86Å; Y483-R664 PolarHBondContact O-NH2 3.37Å; Y483-R664 VanDerWaalsContact O-NH2 3.12Å; Y483-L665 HydrophobicContact CE1-CB 4.1Å; Y483-L665 HydrophobicContact CE1-CD1 3.88Å; Y483-L665 HydrophobicContact CE1-CD2 3.96Å; Y483-L665 HydrophobicContact CE1-CG 4.17Å; Y483-L665 WeakPolarHBondContact OH-CD1 3.32Å
484	P	88.3	Confident	72.3	Confident	7 Å²	7	46.8 Å²	46.8	5%	0.045	25%	0.249	C	C	.	.	S	Bend	cis	-68.8	149.1	-10.5	32.8	-37.6	0	0	0	111.8	I482 Q486 R664 L665 L668	I482-P484 CarbonylContact O-C 3.54Å; P484-Q486 PolarHBondContact O-N 3.33Å; P484-R664 VanDerWaalsContact CD-CB 3.5Å; P484-R664 HydrophobicContact CG-CB 4.16Å; P484-L665 HydrophobicContact CB-CD1 4.44Å; P484-L668 HydrophobicContact CB-CD2 3.76Å; P484-L668 HydrophobicContact CG-CB 4.2Å; P484-L668 HydrophobicContact CG-CD2 4.12Å
485	L	86	Confident	69.7	Low	17 Å²	17	40.5 Å²	40.5	9%	0.089	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-68.8	126.7	173.5	-63.6	-178.9	0	0	0	109.2	L413 L422 L425 I482 I623 I626 N627	L413-L485 HydrophobicContact CD2-CD1 3.95Å; L413-L485 HydrophobicContact CD2-CD2 3.65Å; L413-L485 HydrophobicContact CD2-CG 4.48Å; L422-L485 HydrophobicContact CD2-CD1 4.25Å; L425-L485 HydrophobicContact CD2-CD1 4.29Å; I482-L485 HydrophobicContact CB-CD2 4.31Å; I482-L485 HydrophobicContact CD1-CD2 3.99Å; I482-L485 HydrophobicContact CG1-CD2 4.11Å; L485-I623 HydrophobicContact CB-CG1 4.35Å; L485-I623 HydrophobicContact CB-CG2 3.9Å; L485-I623 WeakPolarHBondContact O-CG2 3.36Å; L485-I626 HydrophobicContact CD1-CB 4.16Å; L485-I626 HydrophobicContact CD1-CD1 3.74Å; L485-I626 HydrophobicContact CD1-CG2 3.62Å; L485-I626 HydrophobicContact CG-CG2 4.35Å; L485-N627 PolarHBondContact N-OD1 3.39Å; L485-N627 PolarHBondContact O-ND2 2.95Å
486	Q	76.2	Confident	66.9	Low	86 Å²	86	45.5 Å²	45.5	40%	0.402	25%	0.247	S	C	.	.			trans	-129.1	145.7	174.5	-63.9	-173.1	9.4	0	0	110.1	P484 L519 L668	P484-Q486 PolarHBondContact O-N 3.33Å; Q486-L519 WeakPolarHBondContact O-CD2 3.23Å; Q486-L668 HydrophobicContact CG-CD1 4.2Å
487	L	66.7	Low	64.1	Low	29 Å²	29	49.2 Å²	49.2	15%	0.152	27%	0.266	C	S	.	.			trans	-76.2	148	166.4	-79	178.1	0	0	0	109	S491 L519 I619 F620 I623	L487-S491 WeakPolarHBondContact CB-OG 3.36Å; L487-L519 HydrophobicContact CD2-CD2 4.49Å; L487-I619 HydrophobicContact CD2-CG2 3.91Å; L487-F620 HydrophobicContact CD1-CB 4.16Å; L487-F620 HydrophobicContact CD1-CD2 4.03Å; L487-I623 HydrophobicContact CD2-CD1 3.84Å; L487-I623 HydrophobicContact CG-CD1 3.76Å
488	S	55.6	Low	61.3	Low	17 Å²	17	50.7 Å²	50.7	12%	0.119	27%	0.268	C	S	.	.			trans	-56.2	146.3	178.7	69.7	0	0	0	0	111.2	D490 S491 L492 L518	S488-D490 PolarHBondContact O-N 3.27Å; S488-S491 PolarHBondContact N-OG 3.24Å; S488-S491 PolarHBondContact O-N 3.13Å; S488-S491 PolarHBondContact O-OG 2.85Å; S488-S491 PolarHBondContact OG-OG 3.31Å; S488-L492 PolarHBondContact O-N 2.98Å; S488-L518 WeakPolarHBondContact CB-O 3.48Å
489	P	47	Very low	58.3	Low	99 Å²	99	52.1 Å²	52.1	64%	0.643	28%	0.283	S	S	*	.	H	α-helix	trans	-53.1	-33.9	-177	-26.1	33.1	0	0	0	113.9	S491 L492 S493	P489-S491 PolarHBondContact O-N 3.18Å; P489-L492 PolarHBondContact O-N 3.32Å; P489-S493 PolarHBondContact O-N 3.39Å; P489-S493 PolarHBondContact O-OG 2.86Å; P489-S493 VanDerWaalsContact O-OG 3.08Å
490	D	42.1	Very low	55.3	Low	96 Å²	96	56.6 Å²	56.6	51%	0.513	31%	0.307	S	S	.	.	H	α-helix	trans	-63	-28.5	176.9	-66	-17.9	0	0	0	113	S488 S493 L494	S488-D490 PolarHBondContact O-N 3.27Å; D490-S493 WeakPolarHBondContact CA-OG 3.46Å; D490-S493 PolarHBondContact O-OG 3.46Å; D490-L494 PolarHBondContact O-N 2.85Å
491	S	41.3	Very low	52.2	Low	16 Å²	16	62.6 Å²	62.6	11%	0.112	33%	0.333	C	S	.	.	H	α-helix	trans	-87.3	-30	179.2	61	0	0	0	0	113.3	L487 S488 P489 M495	L487-S491 WeakPolarHBondContact CB-OG 3.36Å; S488-S491 PolarHBondContact N-OG 3.24Å; S488-S491 PolarHBondContact O-N 3.13Å; S488-S491 PolarHBondContact O-OG 2.85Å; S488-S491 PolarHBondContact OG-OG 3.31Å; P489-S491 PolarHBondContact O-N 3.18Å; S491-M495 PolarHBondContact O-N 2.94Å; S491-M495 VanDerWaalsContact O-N 3.1Å
492	L	35	Very low	49.4	Very low	59 Å²	59	68 Å²	68	31%	0.309	35%	0.35	S	S	.	.	H	α-helix	trans	-64.2	-49.1	168.8	-86.5	153.5	0	0	0	110.7	S488 P489 L494 M495 Y496	S488-L492 PolarHBondContact O-N 2.98Å; P489-L492 PolarHBondContact O-N 3.32Å; L492-L494 VanDerWaalsContact C-N 3.32Å; L492-L494 PolarHBondContact O-N 3.44Å; L492-M495 PolarHBondContact O-N 3.31Å; L492-M495 VanDerWaalsContact O-N 3.15Å; L492-Y496 HydrophobicContact CD2-CD2 4.45Å; L492-Y496 HydrophobicContact CD2-CE2 3.93Å; L492-Y496 VanDerWaalsContact O-CD2 3.25Å; L492-Y496 WeakPolarHBondContact O-CD2 3.26Å; L492-Y496 PolarHBondContact O-N 3.5Å
493	S	35	Very low	46.6	Very low	54 Å²	54	76.1 Å²	76.1	38%	0.378	39%	0.385	S	S	.	.	H	α-helix	trans	-59.4	-40.2	177.7	53.7	0	0	0	0	112	P489 D490 Y496 I497	P489-S493 PolarHBondContact O-N 3.39Å; P489-S493 PolarHBondContact O-OG 2.86Å; P489-S493 VanDerWaalsContact O-OG 3.08Å; D490-S493 WeakPolarHBondContact CA-OG 3.46Å; D490-S493 PolarHBondContact O-OG 3.46Å; S493-Y496 PolarHBondContact O-N 2.9Å; S493-I497 WeakPolarHBondContact O-CB 3.28Å; S493-I497 VanDerWaalsContact O-CD1 3.29Å; S493-I497 WeakPolarHBondContact O-CD1 3.5Å; S493-I497 WeakPolarHBondContact O-CG1 3.49Å; S493-I497 PolarHBondContact O-N 3.31Å
494	L	30.6	Very low	43.5	Very low	78 Å²	78	79.9 Å²	79.9	41%	0.408	41%	0.411	S	S	.	.	H	α-helix	trans	-67.1	-34.9	174.5	-103.3	149.3	0	0	0	114.4	D490 L492 K498 Y515	D490-L494 PolarHBondContact O-N 2.85Å; L492-L494 VanDerWaalsContact C-N 3.32Å; L492-L494 PolarHBondContact O-N 3.44Å; L494-K498 WeakPolarHBondContact O-CB 3.2Å; L494-K498 PolarHBondContact O-N 3.23Å; L494-Y515 HydrophobicContact CD1-CE1 4.38Å
495	M	34.3	Very low	40.5	Very low	35 Å²	35	87.9 Å²	87.9	17%	0.172	45%	0.448	C	S	.	.	H	α-helix	trans	-69.1	-45.4	173.5	-88.9	-151.1	-175.4	0	0	112.1	S491 L492 K498 C499 N616 N617 F620	S491-M495 PolarHBondContact O-N 2.94Å; S491-M495 VanDerWaalsContact O-N 3.1Å; L492-M495 PolarHBondContact O-N 3.31Å; L492-M495 VanDerWaalsContact O-N 3.15Å; M495-K498 PolarHBondContact O-N 2.87Å; M495-C499 PolarHBondContact O-N 3.32Å; M495-N616 HydrophobicContact CE-CB 3.54Å; M495-N616 WeakPolarHBondContact CE-O 3.33Å; M495-N617 WeakPolarHBondContact CE-OD1 3.5Å; M495-F620 HydrophobicContact CE-CB 3.98Å
496	Y	35.4	Very low	37.7	Very low	104 Å²	104	96.1 Å²	96.1	41%	0.408	48%	0.483	S	S	.	.	H	α-helix	trans	-66.2	-40.1	177	-82.3	-71.2	0	0	0	111.6	L492 S493 K498 C499 N500 C675	L492-Y496 HydrophobicContact CD2-CD2 4.45Å; L492-Y496 HydrophobicContact CD2-CE2 3.93Å; L492-Y496 VanDerWaalsContact O-CD2 3.25Å; L492-Y496 WeakPolarHBondContact O-CD2 3.26Å; L492-Y496 PolarHBondContact O-N 3.5Å; S493-Y496 PolarHBondContact O-N 2.9Å; Y496-K498 VanDerWaalsContact C-N 3.29Å; Y496-K498 PolarHBondContact O-N 3.35Å; Y496-C499 PolarHBondContact O-N 3.5Å; Y496-N500 PolarHBondContact O-N 2.71Å; Y496-C675 HydrophobicContact CE1-CB 4.38Å; Y496-C675 WeakPolarHBondContact OH-CB 3.11Å
497	I	33.6	Very low	35.4	Very low	78 Å²	78	97.2 Å²	97.2	40%	0.4	50%	0.5	S	S	.	.	H	α-helix	trans	-62.6	-36.1	172.7	-70.8	165.5	0	0	0	110.6	S493 N500 K501	S493-I497 WeakPolarHBondContact O-CB 3.28Å; S493-I497 VanDerWaalsContact O-CD1 3.29Å; S493-I497 WeakPolarHBondContact O-CD1 3.5Å; S493-I497 WeakPolarHBondContact O-CG1 3.49Å; S493-I497 PolarHBondContact O-N 3.31Å; I497-N500 PolarHBondContact O-N 2.91Å; I497-K501 HydrophobicContact CG2-CD 3.48Å; I497-K501 VanDerWaalsContact CG2-CD 3.48Å; I497-K501 HydrophobicContact CG2-CG 3.85Å; I497-K501 WeakPolarHBondContact O-CA 3.5Å; I497-K501 WeakPolarHBondContact O-CB 3.38Å; I497-K501 VanDerWaalsContact O-CG 3.27Å; I497-K501 WeakPolarHBondContact O-CG 3.4Å; I497-K501 PolarHBondContact O-N 3.34Å
498	K	30.8	Very low	33.4	Very low	134 Å²	134	102.4 Å²	102.4	58%	0.583	53%	0.527	S	S	*	.	H	α-helix	trans	-68.6	-37	173.4	-98.9	-177.3	175.2	177.4	0	113.4	L494 M495 Y496 N500	L494-K498 WeakPolarHBondContact O-CB 3.2Å; L494-K498 PolarHBondContact O-N 3.23Å; M495-K498 PolarHBondContact O-N 2.87Å; Y496-K498 VanDerWaalsContact C-N 3.29Å; Y496-K498 PolarHBondContact O-N 3.35Å; K498-N500 VanDerWaalsContact C-N 3.34Å
499	C	31.1	Very low	32	Very low	79 Å²	79	108.5 Å²	108.5	53%	0.534	56%	0.558	S	S	.	*	H	α-helix	trans	-67.3	-36.4	174.1	-70.7	0	0	0	0	111.6	M495 Y496	M495-C499 PolarHBondContact O-N 3.32Å; Y496-C499 PolarHBondContact O-N 3.5Å
500	N	30.1	Very low	31.1	Very low	95 Å²	95	111.4 Å²	111.4	51%	0.508	57%	0.569	S	S	.	*	H	α-helix	trans	-84.2	-26.5	178.9	-75.9	-9.5	0	0	0	114.2	Y496 I497 K498 Q502	Y496-N500 PolarHBondContact O-N 2.71Å; I497-N500 PolarHBondContact O-N 2.91Å; K498-N500 VanDerWaalsContact C-N 3.34Å; N500-Q502 VanDerWaalsContact C-N 3.28Å; N500-Q502 PolarHBondContact O-N 3.24Å
501	K	29.7	Very low	30.3	Very low	128 Å²	128	112.5 Å²	112.5	56%	0.557	57%	0.571	S	S	*	*	G	3₁₀ helix	trans	-83.4	13.4	-177.6	-76.7	-170	178	178	0	115.3	I497 K503 S504	I497-K501 HydrophobicContact CG2-CD 3.48Å; I497-K501 VanDerWaalsContact CG2-CD 3.48Å; I497-K501 HydrophobicContact CG2-CG 3.85Å; I497-K501 WeakPolarHBondContact O-CA 3.5Å; I497-K501 WeakPolarHBondContact O-CB 3.38Å; I497-K501 VanDerWaalsContact O-CG 3.27Å; I497-K501 WeakPolarHBondContact O-CG 3.4Å; I497-K501 PolarHBondContact O-N 3.34Å; K501-K503 PolarHBondContact O-N 2.98Å; K501-K503 VanDerWaalsContact O-N 3.1Å; K501-S504 PolarHBondContact O-N 3.46Å
502	Q	29.3	Very low	29.9	Very low	186 Å²	186	119.1 Å²	119.1	87%	0.869	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-65.4	0.4	157.7	-79.1	-168.1	-4.2	0	0	113.3	N500	N500-Q502 VanDerWaalsContact C-N 3.28Å; N500-Q502 PolarHBondContact O-N 3.24Å
503	K	29.2	Very low	29.6	Very low	201 Å²	201	119.6 Å²	119.6	87%	0.874	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-117.9	8.1	172.7	-79.3	-172.9	175.6	-179.4	0	117.4	K501	K501-K503 PolarHBondContact O-N 2.98Å; K501-K503 VanDerWaalsContact O-N 3.1Å
504	S	26	Very low	29.4	Very low	80 Å²	80	123.2 Å²	123.2	56%	0.559	64%	0.638	S	S	*	*	S	Bend	trans	-150.7	130.2	170.5	57.7	0	0	0	0	114.7	K501	K501-S504 PolarHBondContact O-N 3.46Å
505	Q	25.7	Very low	29.4	Very low	174 Å²	174	123.4 Å²	123.4	81%	0.813	63%	0.634	S	S	*	*			trans	-73.2	152.9	-173	-80.5	177.8	-13.8	0	0	114.6
506	K	26.4	Very low	29.2	Very low	190 Å²	190	125.1 Å²	125.1	83%	0.826	65%	0.653	S	S	*	*			trans	72.2	132.5	149.1	-77.8	173.4	175.8	175.7	0	120.1
507	S	27.5	Very low	28.8	Very low	109 Å²	109	127.9 Å²	127.9	76%	0.762	67%	0.667	S	S	*	*			trans	81.8	94.6	163	157.1	0	0	0	0	118.1
508	L	26.2	Very low	28.7	Very low	138 Å²	138	126.7 Å²	126.7	72%	0.723	66%	0.662	S	S	*	*				-168.7	89.6	123.9	-132.5	91.3	0	0	0	110.7
509	N	25.5	Very low	28.6	Very low	145 Å²	145	123.1 Å²	123.1	78%	0.775	65%	0.649	S	S	*	*			trans	-98.2	107	163.4	-85.2	-13.2	0	0	0	106.9
510	N	28.5	Very low	28.6	Very low	160 Å²	160	123.5 Å²	123.5	86%	0.856	65%	0.645	S	S	*	*	S	Bend	trans	165.4	24.8	151.5	-85.7	-11.3	0	0	0	116.3
511	Q	25.7	Very low	28.5	Very low	120 Å²	120	123.5 Å²	123.5	56%	0.561	65%	0.653	S	S	*	*			trans	-121.3	15.1	176	-74	-172.7	-12.9	0	0	115.5	G513 Y515	Q511-G513 PolarHBondContact O-N 3.32Å; Q511-G513 VanDerWaalsContact O-N 3.08Å; Q511-Y515 HydrophobicContact CB-CE2 4.33Å; Q511-Y515 WeakPolarHBondContact O-CD2 3.13Å; Q511-Y515 WeakPolarHBondContact O-CE2 3.36Å
512	I	31.7	Very low	28.5	Very low	154 Å²	154	122.5 Å²	122.5	79%	0.79	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	-3.4	-173.2	-60.9	172.9	0	0	0	113.5
513	G	28.6	Very low	28.3	Very low	70 Å²	70	120.2 Å²	120.2	72%	0.722	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-15.6	-172.7	0	0	0	0	0	118.5	Q511	Q511-G513 PolarHBondContact O-N 3.32Å; Q511-G513 VanDerWaalsContact O-N 3.08Å
514	N	31.8	Very low	28	Very low	130 Å²	130	114.8 Å²	114.8	70%	0.695	66%	0.657	S	S	*	*	S	Bend	trans	-113.1	0.4	-167.1	-81.8	0.8	0	0	0	116.4	A516	N514-A516 PolarHBondContact O-N 3.28Å
515	Y	29.6	Very low	27.8	Very low	82 Å²	82	119.7 Å²	119.7	32%	0.322	67%	0.671	S	S	.	*	G	3₁₀ helix	trans	-85.2	-11.7	-165.6	-70.7	-73.2	0	0	0	116.4	L494 Q511 F517 L518	L494-Y515 HydrophobicContact CD1-CE1 4.38Å; Q511-Y515 HydrophobicContact CB-CE2 4.33Å; Q511-Y515 WeakPolarHBondContact O-CD2 3.13Å; Q511-Y515 WeakPolarHBondContact O-CE2 3.36Å; Y515-F517 PolarHBondContact O-N 3.23Å; Y515-L518 HydrophobicContact CD1-CD1 3.88Å; Y515-L518 HydrophobicContact CE1-CD1 4.19Å
516	A	30.2	Very low	27.7	Very low	70 Å²	70	121.5 Å²	121.5	58%	0.579	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-74.7	-11.7	172.8	0	0	0	0	0	113.3	N514	N514-A516 PolarHBondContact O-N 3.28Å
517	F	28	Very low	27.7	Very low	162 Å²	162	116.4 Å²	116.4	71%	0.711	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-94.9	-0.6	-175.6	-161.2	-102.2	0	0	0	113.9	Y515	Y515-F517 PolarHBondContact O-N 3.23Å
518	L	30	Very low	27.8	Very low	54 Å²	54	117.4 Å²	117.4	28%	0.283	67%	0.666	S	S	.	*	G	3₁₀ helix	trans	-104.1	15	-165.4	-73.2	169.7	0	0	0	115.9	S488 Y515 N520	S488-L518 WeakPolarHBondContact CB-O 3.48Å; Y515-L518 HydrophobicContact CD1-CD1 3.88Å; Y515-L518 HydrophobicContact CE1-CD1 4.19Å; L518-N520 PolarHBondContact O-N 3.21Å
519	L	28.8	Very low	27.9	Very low	59 Å²	59	118 Å²	118	31%	0.309	67%	0.67	S	S	.	*	G	3₁₀ helix	trans	-69.8	-14.3	165.7	-76.7	-174.3	0	0	0	113.2	P417 Q486 L487	P417-L519 HydrophobicContact CB-CD1 3.4Å; P417-L519 VanDerWaalsContact CB-CD1 3.4Å; P417-L519 HydrophobicContact CG-CD1 3.34Å; P417-L519 HydrophobicContact CG-CG 4.02Å; Q486-L519 WeakPolarHBondContact O-CD2 3.23Å; L487-L519 HydrophobicContact CD2-CD2 4.49Å
520	N	32.6	Very low	28.3	Very low	86 Å²	86	115 Å²	115	46%	0.46	65%	0.653	S	S	.	*	G	3₁₀ helix	trans	-110.3	16.8	-168.3	-72.9	-14	0	0	0	116.2	N414 L518 S522 N523	N414-N520 PolarHBondContact O-ND2 3.26Å; L518-N520 PolarHBondContact O-N 3.21Å; N520-S522 PolarHBondContact O-N 2.93Å; N520-S522 VanDerWaalsContact O-N 3.1Å; N520-N523 PolarHBondContact O-N 3.35Å
521	S	27.2	Very low	28.8	Very low	96 Å²	96	111.4 Å²	111.4	67%	0.671	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	9.9	-178.8	63.5	0	0	0	0	115.4
522	S	29.5	Very low	29.5	Very low	106 Å²	106	110.4 Å²	110.4	74%	0.741	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	-10.4	170.4	49.7	0	0	0	0	114.6	N520	N520-S522 PolarHBondContact O-N 2.93Å; N520-S522 VanDerWaalsContact O-N 3.1Å
523	N	24.9	Very low	30.4	Very low	138 Å²	138	111.1 Å²	111.1	74%	0.738	64%	0.641	S	S	*	*	S	Bend	trans	-110.1	106.6	175.6	-75.8	-11.2	0	0	0	110.7	N520 Q525	N520-N523 PolarHBondContact O-N 3.35Å; N523-Q525 VanDerWaalsContact C-N 3.27Å; N523-Q525 PolarHBondContact O-N 3.01Å
524	G	23.5	Very low	31.2	Very low	88 Å²	88	111.6 Å²	111.6	91%	0.907	62%	0.624	S	S	*	*			trans	-65.5	57.9	-169.2	0	0	0	0	0	117.6
525	Q	22.9	Very low	32	Very low	183 Å²	183	112.2 Å²	112.2	86%	0.855	62%	0.621	S	S	*	*			trans	-99.9	117.1	167.4	-74.3	-173.2	-16.3	0	0	111.2	N523 S527	N523-Q525 VanDerWaalsContact C-N 3.27Å; N523-Q525 PolarHBondContact O-N 3.01Å; Q525-S527 PolarHBondContact O-N 3.3Å; Q525-S527 VanDerWaalsContact O-N 3.14Å
526	K	22.2	Very low	33.6	Very low	212 Å²	212	116 Å²	116	92%	0.922	64%	0.639	S	S	*	*			trans	-63.9	107	177	-73.5	177.3	176.3	175.4	0	110.5
527	S	26.4	Very low	35.2	Very low	83 Å²	83	119.3 Å²	119.3	58%	0.58	64%	0.643	S	S	*	*			trans	-77.1	128.1	175.3	58.3	0	0	0	0	111.7	Q525 N529	Q525-S527 PolarHBondContact O-N 3.3Å; Q525-S527 VanDerWaalsContact O-N 3.14Å; S527-N529 PolarHBondContact O-N 2.85Å
528	V	29.6	Very low	37	Very low	130 Å²	130	114.8 Å²	114.8	79%	0.788	62%	0.624	S	S	*	*			trans	-67.9	115.7	175.6	177.6	0	0	0	0	110	L530	V528-L530 PolarHBondContact O-N 2.78Å; V528-L530 VanDerWaalsContact O-N 3.16Å
529	N	29.9	Very low	38.5	Very low	151 Å²	151	121.1 Å²	121.1	81%	0.807	64%	0.644	S	S	*	*			trans	-71.8	98.7	178.3	-78.2	-28.2	0	0	0	111.4	S527	S527-N529 PolarHBondContact O-N 2.85Å
530	L	33.2	Very low	40.5	Very low	80 Å²	80	126 Å²	126	42%	0.419	66%	0.663	S	S	.	*			trans	-91.7	136.2	167.3	-69.3	169	0	0	0	110.8	V528 Q534	V528-L530 PolarHBondContact O-N 2.78Å; V528-L530 VanDerWaalsContact O-N 3.16Å; L530-Q534 HydrophobicContact CB-CB 4.21Å; L530-Q534 HydrophobicContact CD2-CB 4.45Å
531	T	38.9	Very low	42.3	Very low	86 Å²	86	131.5 Å²	131.5	53%	0.528	68%	0.677	S	S	.	*			trans	-76	162.2	-175.1	56.3	0	0	0	0	113	K533 Q534 F535	T531-K533 VanDerWaalsContact C-N 3.26Å; T531-K533 PolarHBondContact O-N 3.45Å; T531-K533 VanDerWaalsContact O-N 3.14Å; T531-Q534 WeakPolarHBondContact O-CA 3.47Å; T531-Q534 WeakPolarHBondContact O-CB 3.36Å; T531-Q534 PolarHBondContact O-N 2.87Å; T531-Q534 PolarHBondContact OG1-OE1 3.46Å; T531-Q534 VanDerWaalsContact OG1-OE1 3.12Å; T531-F535 PolarHBondContact O-N 3.15Å
532	S	39.5	Very low	44.2	Very low	99 Å²	99	134 Å²	134	69%	0.692	67%	0.672	S	S	*	*	H	α-helix	trans	-58.7	-30.5	-174.7	78.8	0	0	0	0	114.7	F535 K536	S532-F535 PolarHBondContact O-N 3.33Å; S532-K536 PolarHBondContact O-N 3.45Å
533	K	50.4	Low	46	Very low	169 Å²	169	133.4 Å²	133.4	74%	0.735	66%	0.66	S	S	*	*	H	α-helix	trans	-65.5	-40.7	172.5	-82.5	-174.3	177.7	178.2	0	111.4	T531 K536 Q537	T531-K533 VanDerWaalsContact C-N 3.26Å; T531-K533 PolarHBondContact O-N 3.45Å; T531-K533 VanDerWaalsContact O-N 3.14Å; K533-K536 PolarHBondContact O-N 3.06Å; K533-Q537 PolarHBondContact O-N 3.06Å
534	Q	45.7	Very low	48.3	Very low	79 Å²	79	133.7 Å²	133.7	37%	0.369	66%	0.655	S	S	.	*	H	α-helix	trans	-67.7	-39.4	175.6	-69.9	166.7	-38.7	0	0	110.8	L530 T531 K536 Q537 E538	L530-Q534 HydrophobicContact CB-CB 4.21Å; L530-Q534 HydrophobicContact CD2-CB 4.45Å; T531-Q534 WeakPolarHBondContact O-CA 3.47Å; T531-Q534 WeakPolarHBondContact O-CB 3.36Å; T531-Q534 PolarHBondContact O-N 2.87Å; T531-Q534 PolarHBondContact OG1-OE1 3.46Å; T531-Q534 VanDerWaalsContact OG1-OE1 3.12Å; Q534-K536 PolarHBondContact O-N 2.77Å; Q534-Q537 CarbonylContact O-C 3.5Å; Q534-Q537 PolarHBondContact O-N 3.46Å; Q534-E538 WeakPolarHBondContact O-CB 3.44Å; Q534-E538 PolarHBondContact O-N 2.83Å
535	F	49.6	Very low	50.6	Low	143 Å²	143	135.1 Å²	135.1	63%	0.627	64%	0.638	S	S	*	*	H	α-helix	trans	-59.8	-43.8	173.2	-110.7	-77.7	0	0	0	113.1	T531 S532 E538 R539	T531-F535 PolarHBondContact O-N 3.15Å; S532-F535 PolarHBondContact O-N 3.33Å; F535-E538 PolarHBondContact O-N 2.82Å; F535-R539 VanDerWaalsContact O-CB 3.31Å; F535-R539 WeakPolarHBondContact O-CB 3.49Å; F535-R539 PolarHBondContact O-N 3.06Å
536	K	62	Low	52.6	Low	162 Å²	162	131.2 Å²	131.2	70%	0.704	62%	0.623	S	S	*	*	H	α-helix	trans	-64.7	-41.7	174.5	-82.9	-171.9	178.4	-177.1	0	111.4	S532 K533 Q534 K540	S532-K536 PolarHBondContact O-N 3.45Å; K533-K536 PolarHBondContact O-N 3.06Å; Q534-K536 PolarHBondContact O-N 2.77Å; K536-K540 WeakPolarHBondContact O-CB 3.27Å; K536-K540 WeakPolarHBondContact O-CG 3.31Å; K536-K540 PolarHBondContact O-N 3.45Å
537	Q	63.7	Low	54.5	Low	140 Å²	140	129.1 Å²	129.1	65%	0.654	61%	0.613	S	S	*	*	H	α-helix	trans	-63.4	-42.4	175.2	-84.4	-176.5	-11.4	0	0	111.8	K533 Q534 K540 R541	K533-Q537 PolarHBondContact O-N 3.06Å; Q534-Q537 CarbonylContact O-C 3.5Å; Q534-Q537 PolarHBondContact O-N 3.46Å; Q537-K540 CarbonylContact O-C 3.59Å; Q537-K540 PolarHBondContact O-N 3.49Å; Q537-R541 WeakPolarHBondContact O-CB 3.2Å; Q537-R541 PolarHBondContact O-N 2.83Å
538	E	67.2	Low	56.5	Low	67 Å²	67	133.2 Å²	133.2	31%	0.313	62%	0.616	S	S	.	*	H	α-helix	trans	-69.6	-39.6	-179.5	-158.4	-179.9	161.3	0	0	111.5	Q534 F535 R541 R542	Q534-E538 WeakPolarHBondContact O-CB 3.44Å; Q534-E538 PolarHBondContact O-N 2.83Å; F535-E538 PolarHBondContact O-N 2.82Å; E538-R541 WeakPolarHBondContact O-CB 3.34Å; E538-R541 PolarHBondContact O-N 3.3Å; E538-R542 WeakPolarHBondContact O-CB 3.19Å; E538-R542 WeakPolarHBondContact O-CG 3.19Å; E538-R542 PolarHBondContact O-N 2.94Å; E538-R542 IonicContact OE1-CZ 3.06Å; E538-R542 IonicContact OE1-NE 2.67Å; E538-R542 IonicContact OE1-NH2 3.92Å; E538-R542 PolarHBondContact OE1-NH2 3.43Å
539	R	61	Low	57.9	Low	186 Å²	186	132.8 Å²	132.8	70%	0.702	61%	0.606	S	S	*	*	H	α-helix	trans	-63.1	-41.8	171.5	-165.3	175.2	-175	152.1	-1.1	111.6	F535 N543	F535-R539 VanDerWaalsContact O-CB 3.31Å; F535-R539 WeakPolarHBondContact O-CB 3.49Å; F535-R539 PolarHBondContact O-N 3.06Å; R539-N543 WeakPolarHBondContact O-CB 3.43Å; R539-N543 PolarHBondContact O-N 2.97Å
540	K	71.3	Confident	59.1	Low	163 Å²	163	130.7 Å²	130.7	71%	0.709	59%	0.594	S	S	*	*	H	α-helix	trans	-63.6	-39.8	172.2	-78.5	-171.8	177.5	-169.2	0	111.6	K536 Q537 K544	K536-K540 WeakPolarHBondContact O-CB 3.27Å; K536-K540 WeakPolarHBondContact O-CG 3.31Å; K536-K540 PolarHBondContact O-N 3.45Å; Q537-K540 CarbonylContact O-C 3.59Å; Q537-K540 PolarHBondContact O-N 3.49Å; K540-K544 WeakPolarHBondContact O-CB 3.24Å; K540-K544 PolarHBondContact O-N 3.17Å
541	R	70.3	Confident	60	Low	200 Å²	200	133.2 Å²	133.2	76%	0.755	60%	0.601	S	S	*	*	H	α-helix	trans	-64.3	-49.2	176.9	-127.1	177.6	174.4	167.8	-2.1	111.1	Q537 E538 K544 Q545	Q537-R541 WeakPolarHBondContact O-CB 3.2Å; Q537-R541 PolarHBondContact O-N 2.83Å; E538-R541 WeakPolarHBondContact O-CB 3.34Å; E538-R541 PolarHBondContact O-N 3.3Å; R541-K544 WeakPolarHBondContact O-CB 3.2Å; R541-K544 PolarHBondContact O-N 3.23Å; R541-Q545 WeakPolarHBondContact O-CB 3.41Å; R541-Q545 PolarHBondContact O-N 2.9Å
542	R	66.2	Low	60.6	Low	150 Å²	150	134.1 Å²	134.1	57%	0.566	60%	0.603	S	S	*	*	H	α-helix	trans	-61.4	-45.1	176.1	-72.5	-175	-166.4	-177	5.4	111.3	E538 K544 Q545 L546	E538-R542 WeakPolarHBondContact O-CB 3.19Å; E538-R542 WeakPolarHBondContact O-CG 3.19Å; E538-R542 PolarHBondContact O-N 2.94Å; E538-R542 IonicContact OE1-CZ 3.06Å; E538-R542 IonicContact OE1-NE 2.67Å; E538-R542 IonicContact OE1-NH2 3.92Å; E538-R542 PolarHBondContact OE1-NH2 3.43Å; R542-K544 PolarHBondContact O-N 3.11Å; R542-Q545 WeakPolarHBondContact O-CB 3.49Å; R542-Q545 PolarHBondContact O-N 3.37Å; R542-Q545 VanDerWaalsContact O-N 3.15Å; R542-L546 WeakPolarHBondContact O-CB 3.34Å; R542-L546 PolarHBondContact O-N 3.18Å
543	N	68.1	Low	60.9	Low	93 Å²	93	132.7 Å²	132.7	50%	0.497	60%	0.597	S	S	.	*	H	α-helix	trans	-63.9	-38.7	175.5	-79.3	-6.9	0	0	0	112.6	R539 Q545 L546 K547	R539-N543 WeakPolarHBondContact O-CB 3.43Å; R539-N543 PolarHBondContact O-N 2.97Å; N543-Q545 VanDerWaalsContact C-N 3.33Å; N543-L546 PolarHBondContact O-N 3.35Å; N543-K547 WeakPolarHBondContact O-CB 3.49Å; N543-K547 PolarHBondContact O-N 3.15Å
544	K	73.2	Confident	60.4	Low	143 Å²	143	129.6 Å²	129.6	62%	0.622	59%	0.587	S	S	*	*	H	α-helix	trans	-62.8	-40.7	171.7	-103.4	-176.6	174.9	179.5	0	111.5	K540 R541 R542 R548	K540-K544 WeakPolarHBondContact O-CB 3.24Å; K540-K544 PolarHBondContact O-N 3.17Å; R541-K544 WeakPolarHBondContact O-CB 3.2Å; R541-K544 PolarHBondContact O-N 3.23Å; R542-K544 PolarHBondContact O-N 3.11Å; K544-R548 WeakPolarHBondContact O-CB 3.43Å; K544-R548 VanDerWaalsContact O-CG 3.32Å; K544-R548 WeakPolarHBondContact O-CG 3.26Å; K544-R548 PolarHBondContact O-N 3.41Å
545	Q	70.9	Confident	59.8	Low	119 Å²	119	130.6 Å²	130.6	56%	0.556	60%	0.595	S	S	*	*	H	α-helix	trans	-68.1	-40.9	179.2	-156.5	172.9	9.2	0	0	111.4	R541 R542 N543 R548 Q549	R541-Q545 WeakPolarHBondContact O-CB 3.41Å; R541-Q545 PolarHBondContact O-N 2.9Å; R542-Q545 WeakPolarHBondContact O-CB 3.49Å; R542-Q545 PolarHBondContact O-N 3.37Å; R542-Q545 VanDerWaalsContact O-N 3.15Å; N543-Q545 VanDerWaalsContact C-N 3.33Å; Q545-R548 WeakPolarHBondContact O-CB 3.01Å; Q545-R548 PolarHBondContact O-N 3.23Å; Q545-Q549 WeakPolarHBondContact O-CG 3.43Å; Q545-Q549 PolarHBondContact O-N 3.18Å
546	L	64.5	Low	59.3	Low	101 Å²	101	127.6 Å²	127.6	53%	0.529	60%	0.597	S	S	.	*	H	α-helix	trans	-66.7	-42	175.7	-134.8	151.3	0	0	0	111.2	R542 N543 R548 Q549 L550	R542-L546 WeakPolarHBondContact O-CB 3.34Å; R542-L546 PolarHBondContact O-N 3.18Å; N543-L546 PolarHBondContact O-N 3.35Å; L546-R548 PolarHBondContact O-N 3.01Å; L546-Q549 PolarHBondContact O-N 3.47Å; L546-L550 WeakPolarHBondContact O-CB 3.33Å; L546-L550 PolarHBondContact O-N 3.45Å
547	K	64.1	Low	57.9	Low	167 Å²	167	122.8 Å²	122.8	73%	0.726	59%	0.593	S	S	*	*	H	α-helix	trans	-62	-39.8	171.2	-82.3	-171.4	175	-173.4	0	112.2	N543 L550 K551	N543-K547 WeakPolarHBondContact O-CB 3.49Å; N543-K547 PolarHBondContact O-N 3.15Å; K547-L550 PolarHBondContact O-N 3.22Å; K547-K551 WeakPolarHBondContact O-CB 3.41Å; K547-K551 PolarHBondContact O-N 2.88Å
548	R	66.6	Low	56.4	Low	170 Å²	170	121.3 Å²	121.3	64%	0.642	59%	0.594	S	S	*	*	H	α-helix	trans	-65.5	-42.1	174.3	-76.9	175.8	179.9	-177.6	-2.5	111.8	K544 Q545 L546 L550 K551 N552	K544-R548 WeakPolarHBondContact O-CB 3.43Å; K544-R548 VanDerWaalsContact O-CG 3.32Å; K544-R548 WeakPolarHBondContact O-CG 3.26Å; K544-R548 PolarHBondContact O-N 3.41Å; Q545-R548 WeakPolarHBondContact O-CB 3.01Å; Q545-R548 PolarHBondContact O-N 3.23Å; L546-R548 PolarHBondContact O-N 3.01Å; R548-L550 VanDerWaalsContact C-N 3.35Å; R548-K551 PolarHBondContact O-N 3.23Å; R548-N552 VanDerWaalsContact O-CB 3.27Å; R548-N552 WeakPolarHBondContact O-CB 3.47Å; R548-N552 PolarHBondContact O-N 3.43Å; R548-N552 PolarHBondContact O-OD1 3.11Å
549	Q	59.3	Low	54.5	Low	121 Å²	121	124.8 Å²	124.8	57%	0.565	62%	0.62	S	S	*	*	H	α-helix	trans	-63.1	-41.6	174.6	-76.3	176.8	-15.5	0	0	111.5	Q545 L546 N552 A553	Q545-Q549 WeakPolarHBondContact O-CG 3.43Å; Q545-Q549 PolarHBondContact O-N 3.18Å; L546-Q549 PolarHBondContact O-N 3.47Å; Q549-N552 PolarHBondContact O-N 3.06Å; Q549-A553 VanDerWaalsContact O-CB 3.3Å; Q549-A553 WeakPolarHBondContact O-CB 3.44Å; Q549-A553 PolarHBondContact O-N 2.83Å
550	L	55.1	Low	52.9	Low	106 Å²	106	118.6 Å²	118.6	56%	0.555	61%	0.614	S	S	*	*	H	α-helix	trans	-64.7	-44	175.7	-140.9	97.2	0	0	0	111.4	L546 K547 R548 A553 I554	L546-L550 WeakPolarHBondContact O-CB 3.33Å; L546-L550 PolarHBondContact O-N 3.45Å; K547-L550 PolarHBondContact O-N 3.22Å; R548-L550 VanDerWaalsContact C-N 3.35Å; L550-A553 PolarHBondContact O-N 3.45Å; L550-I554 HydrophobicContact CD2-CD1 4.31Å; L550-I554 WeakPolarHBondContact O-CD1 3.35Å; L550-I554 WeakPolarHBondContact O-CG1 3.21Å; L550-I554 PolarHBondContact O-N 2.69Å
551	K	53.6	Low	50.8	Low	133 Å²	133	118.1 Å²	118.1	58%	0.578	62%	0.619	S	S	*	*	H	α-helix	trans	-65.6	-39.2	176.8	-164.9	174.2	-175.9	176.8	0	111.6	K547 R548 I554 N555	K547-K551 WeakPolarHBondContact O-CB 3.41Å; K547-K551 PolarHBondContact O-N 2.88Å; R548-K551 PolarHBondContact O-N 3.23Å; K551-I554 PolarHBondContact O-N 2.67Å; K551-N555 WeakPolarHBondContact O-CB 3.45Å; K551-N555 VanDerWaalsContact O-CG 3.25Å; K551-N555 PolarHBondContact O-N 3.39Å; K551-N555 PolarHBondContact O-OD1 3.2Å
552	N	49.7	Very low	48.7	Very low	106 Å²	106	116.4 Å²	116.4	57%	0.567	63%	0.625	S	S	*	*	H	α-helix	trans	-67.1	-37.5	174.2	-71.3	1.9	0	0	0	111.6	R548 Q549 N555 A556	R548-N552 VanDerWaalsContact O-CB 3.27Å; R548-N552 WeakPolarHBondContact O-CB 3.47Å; R548-N552 PolarHBondContact O-N 3.43Å; R548-N552 PolarHBondContact O-OD1 3.11Å; Q549-N552 PolarHBondContact O-N 3.06Å; N552-N555 PolarHBondContact O-N 3.28Å; N552-A556 WeakPolarHBondContact O-CB 3.23Å; N552-A556 PolarHBondContact O-N 2.93Å
553	A	46.3	Very low	46.8	Very low	68 Å²	68	117 Å²	117	56%	0.562	64%	0.639	S	S	*	*	H	α-helix	trans	-67.4	-36.9	174.7	0	0	0	0	0	112	Q549 L550 G557	Q549-A553 VanDerWaalsContact O-CB 3.3Å; Q549-A553 WeakPolarHBondContact O-CB 3.44Å; Q549-A553 PolarHBondContact O-N 2.83Å; L550-A553 PolarHBondContact O-N 3.45Å; A553-G557 PolarHBondContact O-N 3.41Å
554	I	40.6	Very low	44.8	Very low	104 Å²	104	120.5 Å²	120.5	53%	0.533	66%	0.658	S	S	.	*	H	α-helix	trans	-68.7	-45.1	174.2	-67.3	162.8	0	0	0	110.4	L550 K551 G557	L550-I554 HydrophobicContact CD2-CD1 4.31Å; L550-I554 WeakPolarHBondContact O-CD1 3.35Å; L550-I554 WeakPolarHBondContact O-CG1 3.21Å; L550-I554 PolarHBondContact O-N 2.69Å; K551-I554 PolarHBondContact O-N 2.67Å; I554-G557 PolarHBondContact O-N 3.33Å
555	N	32.7	Very low	42.5	Very low	101 Å²	101	120.4 Å²	120.4	54%	0.54	66%	0.664	S	S	.	*	H	α-helix	trans	-70.1	-33.3	178.9	-72	4.9	0	0	0	112.8	K551 N552 G557 V558	K551-N555 WeakPolarHBondContact O-CB 3.45Å; K551-N555 VanDerWaalsContact O-CG 3.25Å; K551-N555 PolarHBondContact O-N 3.39Å; K551-N555 PolarHBondContact O-OD1 3.2Å; N552-N555 PolarHBondContact O-N 3.28Å; N555-G557 PolarHBondContact O-N 3Å; N555-V558 PolarHBondContact O-N 3.06Å
556	A	38.9	Very low	40.3	Very low	79 Å²	79	120.9 Å²	120.9	65%	0.653	67%	0.67	S	S	*	*	H	α-helix	trans	-68.8	-19	174.4	0	0	0	0	0	112.7	N552	N552-A556 WeakPolarHBondContact O-CB 3.23Å; N552-A556 PolarHBondContact O-N 2.93Å
557	G	32.9	Very low	38.4	Very low	61 Å²	61	123.2 Å²	123.2	63%	0.629	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-0.7	175.8	0	0	0	0	0	115	A553 I554 N555	A553-G557 PolarHBondContact O-N 3.41Å; I554-G557 PolarHBondContact O-N 3.33Å; N555-G557 PolarHBondContact O-N 3Å
558	V	31.3	Very low	36.6	Very low	110 Å²	110	123.2 Å²	123.2	67%	0.667	69%	0.69	S	S	*	*			trans	-120.1	72.7	-179.6	-170.6	0	0	0	0	109.6	N555	N555-V558 PolarHBondContact O-N 3.06Å
559	T	28.6	Very low	34.8	Very low	140 Å²	140	121.8 Å²	121.8	86%	0.859	70%	0.695	S	S	*	*			trans	-84.9	108.9	158.6	46.8	0	0	0	0	108.3
560	G	27	Very low	33	Very low	56 Å²	56	122.6 Å²	122.6	58%	0.577	70%	0.703	S	S	*	*	S	Bend	trans	129.5	97.2	168.2	0	0	0	0	0	114.1
561	D	26.5	Very low	31.7	Very low	153 Å²	153	124.6 Å²	124.6	82%	0.818	72%	0.719	S	S	*	*			trans	48.5	93.6	142.4	-57.1	-18.3	0	0	0	118.8
562	N	27.6	Very low	30.3	Very low	164 Å²	164	124 Å²	124	88%	0.877	72%	0.723	S	S	*	*				-172.7	128	112.5	-97.1	-37.3	0	0	0	111.9	N564	N562-N564 PolarHBondContact O-N 3.18Å; N562-N564 VanDerWaalsContact O-N 3.16Å
563	N	24.8	Very low	28.9	Very low	162 Å²	162	126.8 Å²	126.8	87%	0.866	74%	0.737	S	S	*	*			trans	-48.7	113.4	164.1	-84.9	-32.9	0	0	0	110.7
564	N	26.9	Very low	27.8	Very low	167 Å²	167	131.2 Å²	131.2	89%	0.893	75%	0.746	S	S	*	*			trans	-156.2	111.4	139.2	-107	-18.6	0	0	0	111.1	N562	N562-N564 PolarHBondContact O-N 3.18Å; N562-N564 VanDerWaalsContact O-N 3.16Å
565	N	24.7	Very low	27.1	Very low	141 Å²	141	132.9 Å²	132.9	75%	0.754	76%	0.756	S	S	*	*			trans	-57.8	148.9	174	-92.2	-26.3	0	0	0	113.2
566	N	24	Very low	26.5	Very low	129 Å²	129	135.5 Å²	135.5	69%	0.69	77%	0.77	S	S	*	*			trans	62.8	104.7	138.8	-59.1	-12.7	0	0	0	119.6
567	N	24.7	Very low	25.7	Very low	149 Å²	149	136.8 Å²	136.8	80%	0.797	77%	0.774	S	S	*	*				155.3	68.3	119	-84.9	-12.8	0	0	0	111.9
568	I	27.8	Very low	25.1	Very low	168 Å²	168	140.1 Å²	140.1	86%	0.862	78%	0.782	S	S	*	*			trans	-122.9	54.7	157.1	-48	176.8	0	0	0	107.7
569	D	26.7	Very low	24.6	Very low	139 Å²	139	140.7 Å²	140.7	74%	0.743	79%	0.786	S	S	*	*			trans	-110.7	135.2	151	-74.9	-37.3	0	0	0	105
570	N	22.9	Very low	24.2	Very low	138 Å²	138	140.6 Å²	140.6	74%	0.738	78%	0.779	S	S	*	*			trans	97.9	68.6	-174.7	-49.4	-19	0	0	0	115.7
571	V	27.2	Very low	23.9	Very low	148 Å²	148	144.6 Å²	144.6	90%	0.897	79%	0.787	S	S	*	*			trans	-120.8	96.6	133.1	-179.4	0	0	0	0	105.9
572	D	24	Very low	23.7	Very low	122 Å²	122	144 Å²	144	65%	0.652	78%	0.783	S	S	*	*			trans	-58.3	144.3	-178	-76.1	-55	0	0	0	113.1	H574	D572-H574 PolarHBondContact O-N 3.2Å
573	D	21.6	Very low	23.3	Very low	163 Å²	163	139.4 Å²	139.4	87%	0.872	78%	0.776	S	S	*	*			trans	-55.3	110.3	157.7	-71.4	-49.8	0	0	0	109.5
574	H	23.1	Very low	23.3	Very low	162 Å²	162	140 Å²	140	75%	0.75	77%	0.773	S	S	*	*			trans	-132.5	106.2	159.2	-98.1	-59.5	0	0	0	111.6	D572	D572-H574 PolarHBondContact O-N 3.2Å
575	D	24.5	Very low	23.1	Very low	139 Å²	139	137.3 Å²	137.3	74%	0.743	77%	0.767	S	S	*	*			trans	75.4	92.6	141.5	-58.1	-35.2	0	0	0	120.6
576	D	20.5	Very low	23.2	Very low	156 Å²	156	138.7 Å²	138.7	83%	0.834	77%	0.772	S	S	*	*			trans	-37.5	152.8	132.3	-82.3	-40.3	0	0	0	114.2
577	S	22.7	Very low	23.1	Very low	106 Å²	106	136.6 Å²	136.6	74%	0.741	77%	0.768	S	S	*	*			trans	82.7	84.2	155.1	74.2	0	0	0	0	119.2
578	T	20.4	Very low	23	Very low	130 Å²	130	136.1 Å²	136.1	80%	0.798	77%	0.771	S	S	*	*			trans	-120	92.8	135.7	38.3	0	0	0	0	108.8	I580	T578-I580 PolarHBondContact O-N 3.49Å
579	V	20.3	Very low	22.7	Very low	122 Å²	122	133.5 Å²	133.5	74%	0.739	76%	0.763	S	S	*	*			trans	-64.4	106.6	157.5	174.3	0	0	0	0	105.9
580	I	21	Very low	22.5	Very low	138 Å²	138	134.9 Å²	134.9	71%	0.708	77%	0.77	S	S	*	*			trans	-102.2	94.2	162.6	-58.3	177.7	0	0	0	105.4	T578 D582	T578-I580 PolarHBondContact O-N 3.49Å; I580-D582 PolarHBondContact O-N 2.83Å
581	D	19.8	Very low	22.5	Very low	141 Å²	141	133.1 Å²	133.1	75%	0.754	77%	0.769	S	S	*	*			trans	-64.4	118.2	154.5	-97.1	-33.4	0	0	0	107.4
582	D	21.5	Very low	22.3	Very low	139 Å²	139	134.5 Å²	134.5	74%	0.743	77%	0.769	S	S	*	*			trans	-136.7	93.9	154.3	-95.2	-32.1	0	0	0	107.9	I580 H584	I580-D582 PolarHBondContact O-N 2.83Å; D582-H584 PolarHBondContact O-N 3.1Å
583	G	20	Very low	22.2	Very low	69 Å²	69	131.1 Å²	131.1	71%	0.711	76%	0.763	S	S	*	*			trans	-71.8	116.6	161.1	0	0	0	0	0	109.6
584	H	25.2	Very low	22.1	Very low	174 Å²	174	134.6 Å²	134.6	81%	0.806	77%	0.766	S	S	*	*			trans	-95.3	97.7	153.2	-83.7	-50.8	0	0	0	108.8	D582 I586	D582-H584 PolarHBondContact O-N 3.1Å; H584-I586 PolarHBondContact O-N 3.28Å
585	S	22.1	Very low	22.1	Very low	111 Å²	111	131.6 Å²	131.6	78%	0.776	76%	0.763	S	S	*	*			trans	-45.4	111.8	156.8	37.2	0	0	0	0	110.8	S587	S585-S587 PolarHBondContact O-N 3.08Å
586	I	26.5	Very low	22	Very low	169 Å²	169	131.1 Å²	131.1	87%	0.867	77%	0.765	S	S	*	*			trans	-79	113.9	155.8	-65	171.7	0	0	0	105.6	H584	H584-I586 PolarHBondContact O-N 3.28Å
587	S	23.4	Very low	22.1	Very low	86 Å²	86	130.8 Å²	130.8	60%	0.601	76%	0.762	S	S	*	*			trans	-58.9	130.2	179.8	38.1	0	0	0	0	112.3	S585 T589	S585-S587 PolarHBondContact O-N 3.08Å; S587-T589 PolarHBondContact O-N 3.36Å; S587-T589 VanDerWaalsContact O-N 3.08Å
588	T	21.2	Very low	22.1	Very low	139 Å²	139	131.3 Å²	131.3	85%	0.853	76%	0.756	S	S	*	*			trans	-54.2	106.1	155.6	38.9	0	0	0	0	108.8
589	T	22	Very low	22.4	Very low	112 Å²	112	130.6 Å²	130.6	69%	0.687	75%	0.752	S	S	*	*			trans	-127.6	107.6	160.2	31	0	0	0	0	107	S587 S591	S587-T589 PolarHBondContact O-N 3.36Å; S587-T589 VanDerWaalsContact O-N 3.08Å; T589-S591 PolarHBondContact O-N 3.06Å
590	D	23.1	Very low	22.7	Very low	169 Å²	169	128.5 Å²	128.5	90%	0.904	74%	0.742	S	S	*	*			trans	-52.9	107.2	171	-66.7	-47.7	0	0	0	109.1
591	S	22.8	Very low	22.9	Very low	101 Å²	101	126.2 Å²	126.2	71%	0.706	73%	0.732	S	S	*	*			trans	-139.6	107.3	160.6	52.2	0	0	0	0	107.9	T589 G593	T589-S591 PolarHBondContact O-N 3.06Å; S591-G593 PolarHBondContact O-N 3.14Å
592	I	23	Very low	23.1	Very low	176 Å²	176	123.1 Å²	123.1	90%	0.903	72%	0.721	S	S	*	*			trans	-61.5	92.5	166.3	-63.6	163.8	0	0	0	105.7
593	G	20.7	Very low	23.2	Very low	51 Å²	51	121.6 Å²	121.6	53%	0.526	72%	0.717	S	S	.	*			trans	-141	110	178.6	0	0	0	0	0	108	S591 S595	S591-G593 PolarHBondContact O-N 3.14Å; G593-S595 PolarHBondContact O-N 3.19Å
594	Y	21.4	Very low	23.5	Very low	237 Å²	237	125.8 Å²	125.8	93%	0.929	71%	0.711	S	S	*	*			trans	-54.2	81	172.6	-75.3	-96.5	0	0	0	110.5	T596	Y594-T596 PolarHBondContact O-N 2.92Å
595	S	22.3	Very low	23.5	Very low	98 Å²	98	125.4 Å²	125.4	69%	0.685	70%	0.703	S	S	*	*			trans	-86.3	109.3	167.7	56.7	0	0	0	0	107.1	G593 I597	G593-S595 PolarHBondContact O-N 3.19Å; S595-I597 PolarHBondContact O-N 3.36Å
596	T	22.1	Very low	23.7	Very low	130 Å²	130	124.2 Å²	124.2	80%	0.798	69%	0.687	S	S	*	*			trans	-39.1	106.9	160.8	32.2	0	0	0	0	108.9	Y594 D598	Y594-T596 PolarHBondContact O-N 2.92Å; T596-D598 PolarHBondContact O-N 2.94Å
597	I	23.2	Very low	23.7	Very low	148 Å²	148	123.4 Å²	123.4	76%	0.759	68%	0.684	S	S	*	*			trans	-60.9	103.5	173.8	-64.2	170.2	0	0	0	106.1	S595 T599	S595-I597 PolarHBondContact O-N 3.36Å; I597-T599 VanDerWaalsContact C-N 3.35Å; I597-T599 PolarHBondContact O-N 3.21Å; I597-T599 PolarHBondContact O-OG1 3.3Å
598	D	22.8	Very low	23.7	Very low	118 Å²	118	122.6 Å²	122.6	63%	0.631	67%	0.673	S	S	*	*			trans	-49.4	97.9	173.4	-86.9	-36.8	0	0	0	109.4	T596 S600 N601	T596-D598 PolarHBondContact O-N 2.94Å; D598-S600 PolarHBondContact O-N 3.45Å; D598-N601 PolarHBondContact O-N 3.4Å
599	T	26.7	Very low	24.2	Very low	115 Å²	115	121.7 Å²	121.7	71%	0.706	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-3.5	-172.4	-3.7	0	0	0	0	111.8	I597 N601 S602	I597-T599 VanDerWaalsContact C-N 3.35Å; I597-T599 PolarHBondContact O-N 3.21Å; I597-T599 PolarHBondContact O-OG1 3.3Å; T599-N601 VanDerWaalsContact C-N 3.26Å; T599-N601 PolarHBondContact O-N 3.18Å; T599-S602 PolarHBondContact O-N 3.47Å
600	S	27	Very low	24.4	Very low	77 Å²	77	120.7 Å²	120.7	54%	0.538	67%	0.667	S	S	.	*	H	α-helix	trans	-70.3	-19	171.8	56.2	0	0	0	0	113.3	D598 S602	D598-S600 PolarHBondContact O-N 3.45Å; S600-S602 VanDerWaalsContact C-N 3.25Å; S600-S602 PolarHBondContact O-N 2.72Å
601	N	23.4	Very low	24.9	Very low	91 Å²	91	115.2 Å²	115.2	49%	0.487	64%	0.64	S	S	.	*	H	α-helix	trans	-77.2	-5.2	173.9	-80.5	-25.8	0	0	0	114	D598 T599 R605	D598-N601 PolarHBondContact O-N 3.4Å; T599-N601 VanDerWaalsContact C-N 3.26Å; T599-N601 PolarHBondContact O-N 3.18Å; N601-R605 WeakPolarHBondContact O-CD 3.49Å; N601-R605 VanDerWaalsContact O-CG 3.23Å; N601-R605 WeakPolarHBondContact O-CG 3.31Å
602	S	24	Very low	25.2	Very low	76 Å²	76	121 Å²	121	53%	0.531	65%	0.652	S	S	.	*	H	α-helix	trans	-84.5	-42	175.8	-178.7	0	0	0	0	112.7	T599 S600 R605	T599-S602 PolarHBondContact O-N 3.47Å; S600-S602 VanDerWaalsContact C-N 3.25Å; S600-S602 PolarHBondContact O-N 2.72Å; S602-R605 PolarHBondContact O-N 3.45Å
603	T	25.3	Very low	26	Very low	107 Å²	107	114.7 Å²	114.7	66%	0.656	63%	0.631	S	S	*	*	H	α-helix	trans	-74.8	-31.9	-178.3	-3.4	0	0	0	0	112.5	R605	T603-R605 VanDerWaalsContact C-N 3.3Å; T603-R605 PolarHBondContact O-N 3.48Å
604	R	25.3	Very low	27.5	Very low	156 Å²	156	115.2 Å²	115.2	59%	0.589	62%	0.622	S	S	*	*	H	α-helix	trans	-72.1	-23.2	177.1	-143.4	177.7	-167.2	-180	2	113.4	I606	R604-I606 VanDerWaalsContact C-N 3.29Å; R604-I606 PolarHBondContact O-N 2.87Å
605	R	24.5	Very low	29.2	Very low	166 Å²	166	108.8 Å²	108.8	63%	0.626	60%	0.603	S	S	*	*	H	α-helix	trans	-73.7	-11.5	-178	-84.3	-179.7	-170.8	-168.8	4.6	115	N601 S602 T603 T611	N601-R605 WeakPolarHBondContact O-CD 3.49Å; N601-R605 VanDerWaalsContact O-CG 3.23Å; N601-R605 WeakPolarHBondContact O-CG 3.31Å; S602-R605 PolarHBondContact O-N 3.45Å; T603-R605 VanDerWaalsContact C-N 3.3Å; T603-R605 PolarHBondContact O-N 3.48Å; R605-T611 WeakPolarHBondContact CA-OG1 3.2Å; R605-T611 HydrophobicContact CG-CG2 4.34Å; R605-T611 PolarHBondContact O-OG1 2.95Å
606	I	27.9	Very low	31.1	Very low	87 Å²	87	106.8 Å²	106.8	45%	0.446	59%	0.585	S	S	.	*	H	α-helix	trans	-110.1	-32.5	-169.6	-57	179.6	0	0	0	113.3	R604	R604-I606 VanDerWaalsContact C-N 3.29Å; R604-I606 PolarHBondContact O-N 2.87Å
607	N	25.5	Very low	33.2	Very low	151 Å²	151	104.3 Å²	104.3	81%	0.807	57%	0.567	S	S	*	*	H	α-helix	trans	-98.7	-4.1	179.2	-71.6	-8	0	0	0	114.4	P609	N607-P609 WeakPolarHBondContact O-CD 3.29Å
608	D	24.2	Very low	35.3	Very low	70 Å²	70	100.5 Å²	100.5	37%	0.374	55%	0.546	S	S	.	.			trans	-98.3	109.2	169.3	-120.7	-40.9	0	0	0	108.9	S610 T611	D608-S610 PolarHBondContact O-N 2.99Å; D608-S610 PolarHBondContact OD1-OG 2.99Å; D608-T611 PolarHBondContact O-N 3.34Å; D608-T611 PolarHBondContact O-OG1 2.93Å
609	P	30.2	Very low	38	Very low	120 Å²	120	95.7 Å²	95.7	78%	0.779	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-0.9	171.9	23.8	-30.4	0	0	0	113.1	N607	N607-P609 WeakPolarHBondContact O-CD 3.29Å
610	S	28	Very low	40.4	Very low	90 Å²	90	92.7 Å²	92.7	63%	0.629	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-15.7	-179.7	65.8	0	0	0	0	114.9	D608 K612	D608-S610 PolarHBondContact O-N 2.99Å; D608-S610 PolarHBondContact OD1-OG 2.99Å; S610-K612 PolarHBondContact O-N 3.36Å
611	T	31.9	Very low	42.9	Very low	55 Å²	55	92.6 Å²	92.6	34%	0.337	49%	0.486	S	S	.	.	S	Bend	trans	-79.9	118.8	167.8	36.7	0	0	0	0	109.1	R605 D608 G613	R605-T611 WeakPolarHBondContact CA-OG1 3.2Å; R605-T611 HydrophobicContact CG-CG2 4.34Å; R605-T611 PolarHBondContact O-OG1 2.95Å; D608-T611 PolarHBondContact O-N 3.34Å; D608-T611 PolarHBondContact O-OG1 2.93Å; T611-G613 PolarHBondContact O-N 3.21Å
612	K	29.5	Very low	45.8	Very low	221 Å²	221	90.6 Å²	90.6	96%	0.961	47%	0.471	S	S	*	.			trans	-57.2	59.7	174.5	-67.8	177.1	176.3	176.6	0	112.8	S610	S610-K612 PolarHBondContact O-N 3.36Å
613	G	40.1	Very low	48.8	Very low	45 Å²	45	87.5 Å²	87.5	46%	0.464	45%	0.448	S	S	.	.			trans	-67.6	142.5	164.1	0	0	0	0	0	108.4	T611 L615	T611-G613 PolarHBondContact O-N 3.21Å; G613-L615 PolarHBondContact O-N 2.85Å; G613-L615 VanDerWaalsContact O-N 3.15Å
614	N	53	Low	51.6	Low	61 Å²	61	83.5 Å²	83.5	33%	0.326	42%	0.422	S	S	.	.			trans	-55	121.8	174.3	-172.1	11.2	0	0	0	108.5	N616 N617	N614-N616 PolarHBondContact O-N 3.49Å; N614-N617 WeakPolarHBondContact O-CB 3.48Å; N614-N617 PolarHBondContact O-N 3.41Å
615	L	56.2	Low	54.5	Low	102 Å²	102	77.1 Å²	77.1	53%	0.534	40%	0.4	S	S	.	.	H	α-helix	trans	-47.2	-36.9	179.5	-167.4	88.1	0	0	0	111.1	G613 N617 Q618 I619	G613-L615 PolarHBondContact O-N 2.85Å; G613-L615 VanDerWaalsContact O-N 3.15Å; L615-N617 VanDerWaalsContact C-N 3.35Å; L615-N617 PolarHBondContact O-N 3.18Å; L615-Q618 PolarHBondContact O-N 3.5Å; L615-I619 HydrophobicContact CD2-CD1 3.97Å; L615-I619 HydrophobicContact CG-CD1 4.01Å; L615-I619 WeakPolarHBondContact O-CG1 3.49Å; L615-I619 PolarHBondContact O-N 2.81Å
616	N	62.5	Low	57.6	Low	56 Å²	56	69.2 Å²	69.2	30%	0.299	37%	0.37	S	S	.	.	H	α-helix	trans	-61.3	-37.8	178.4	-59.9	3.4	0	0	0	113.1	M495 N614 Q618 I619 F620	M495-N616 HydrophobicContact CE-CB 3.54Å; M495-N616 WeakPolarHBondContact CE-O 3.33Å; N614-N616 PolarHBondContact O-N 3.49Å; N616-Q618 VanDerWaalsContact C-N 3.35Å; N616-I619 PolarHBondContact O-N 3.13Å; N616-F620 VanDerWaalsContact O-CB 3.31Å; N616-F620 WeakPolarHBondContact O-CB 3.37Å; N616-F620 PolarHBondContact O-N 3.43Å
617	N	65.6	Low	60.7	Low	78 Å²	78	65.3 Å²	65.3	42%	0.417	35%	0.35	S	S	.	.	H	α-helix	trans	-68.9	-36.6	179.7	-68.6	30.2	0	0	0	111.1	M495 N614 L615 Y621	M495-N617 WeakPolarHBondContact CE-OD1 3.5Å; N614-N617 WeakPolarHBondContact O-CB 3.48Å; N614-N617 PolarHBondContact O-N 3.41Å; L615-N617 VanDerWaalsContact C-N 3.35Å; L615-N617 PolarHBondContact O-N 3.18Å; N617-Y621 WeakPolarHBondContact O-CB 3.39Å; N617-Y621 PolarHBondContact O-N 3.08Å
618	Q	68.7	Low	63.7	Low	68 Å²	68	58.8 Å²	58.8	32%	0.318	32%	0.315	S	S	.	.	H	α-helix	trans	-68.2	-44	175.3	-69.7	-178.2	-13.2	0	0	111.3	L615 N616 Y621 W622	L615-Q618 PolarHBondContact O-N 3.5Å; N616-Q618 VanDerWaalsContact C-N 3.35Å; Q618-Y621 PolarHBondContact O-N 2.89Å; Q618-W622 PolarHBondContact O-N 2.83Å; Q618-W622 VanDerWaalsContact O-N 3.14Å
619	I	77.9	Confident	66.8	Low	17 Å²	17	55.6 Å²	55.6	9%	0.087	30%	0.298	C	S	.	.	H	α-helix	trans	-59.6	-48.7	176.5	-70.9	167.9	0	0	0	110.4	L422 L487 L615 N616 Y621 W622 I623	L422-I619 HydrophobicContact CD1-CB 4.22Å; L422-I619 HydrophobicContact CD1-CG1 4.19Å; L422-I619 HydrophobicContact CD1-CG2 3.82Å; L487-I619 HydrophobicContact CD2-CG2 3.91Å; L615-I619 HydrophobicContact CD2-CD1 3.97Å; L615-I619 HydrophobicContact CG-CD1 4.01Å; L615-I619 WeakPolarHBondContact O-CG1 3.49Å; L615-I619 PolarHBondContact O-N 2.81Å; N616-I619 PolarHBondContact O-N 3.13Å; I619-Y621 PolarHBondContact O-N 3.16Å; I619-W622 PolarHBondContact O-N 3.37Å; I619-I623 HydrophobicContact CG2-CD1 3.68Å; I619-I623 HydrophobicContact CG2-CG1 4.4Å; I619-I623 WeakPolarHBondContact O-CG1 3.38Å; I619-I623 PolarHBondContact O-N 3.18Å
620	F	77.4	Confident	69.8	Low	52 Å²	52	49.9 Å²	49.9	23%	0.228	26%	0.261	C	S	.	.	H	α-helix	trans	-59.3	-44.6	178.9	-178.4	-108.6	0	0	0	112.4	L487 M495 N616 W622 I623 Q624	L487-F620 HydrophobicContact CD1-CB 4.16Å; L487-F620 HydrophobicContact CD1-CD2 4.03Å; M495-F620 HydrophobicContact CE-CB 3.98Å; N616-F620 VanDerWaalsContact O-CB 3.31Å; N616-F620 WeakPolarHBondContact O-CB 3.37Å; N616-F620 PolarHBondContact O-N 3.43Å; F620-W622 VanDerWaalsContact C-N 3.33Å; F620-W622 PolarHBondContact O-N 3.21Å; F620-I623 PolarHBondContact O-N 3.06Å; F620-Q624 HydrophobicContact CD1-CG 4.5Å; F620-Q624 VanDerWaalsContact CE1-CD 3.44Å; F620-Q624 HydrophobicContact CE1-CG 4.21Å; F620-Q624 HydrophobicContact CE2-CG 4.43Å; F620-Q624 HydrophobicContact CZ-CG 4.17Å; F620-Q624 WeakPolarHBondContact O-CG 3.49Å; F620-Q624 PolarHBondContact O-N 3.38Å
621	Y	79.3	Confident	73	Confident	76 Å²	76	45.6 Å²	45.6	30%	0.298	23%	0.231	S	C	.	.	H	α-helix	trans	-56.6	-45.3	175.6	173.2	-106.2	0	0	0	112.4	N617 Q618 I619 Q624 L625	N617-Y621 WeakPolarHBondContact O-CB 3.39Å; N617-Y621 PolarHBondContact O-N 3.08Å; Q618-Y621 PolarHBondContact O-N 2.89Å; I619-Y621 PolarHBondContact O-N 3.16Å; Y621-Q624 PolarHBondContact O-N 3.33Å; Y621-L625 HydrophobicContact CD1-CD1 4.15Å; Y621-L625 HydrophobicContact CE1-CD1 3.51Å; Y621-L625 HydrophobicContact CE1-CG 4.43Å; Y621-L625 HydrophobicContact CE2-CD1 4.11Å; Y621-L625 HydrophobicContact CE2-CG 4.3Å; Y621-L625 VanDerWaalsContact CZ-CD1 3.49Å; Y621-L625 WeakPolarHBondContact O-CG 3.39Å; Y621-L625 PolarHBondContact O-N 3.41Å
622	W	84.6	Confident	75.7	Confident	48 Å²	48	43.3 Å²	43.3	18%	0.182	22%	0.217	C	C	.	.	H	α-helix	trans	-68.2	-40.2	177.6	-71	116.8	0	0	0	112.8	L422 S423 Y426 Q618 I619 F620 Q624 L625 I626	L422-W622 HydrophobicContact CB-CB 3.62Å; L422-W622 HydrophobicContact CB-CG 4.08Å; L422-W622 HydrophobicContact CD1-CB 4.24Å; L422-W622 HydrophobicContact CG-CB 4.47Å; S423-W622 VanDerWaalsContact CB-CZ2 3.47Å; Y426-W622 HydrophobicContact CD1-CE3 4.38Å; Y426-W622 AromaticContact CD1-CZ3 3.7Å; Y426-W622 HydrophobicContact CD1-CZ3 3.7Å; Y426-W622 HydrophobicContact CE1-CZ3 4.35Å; Y426-W622 HydrophobicContact CG-CE3 4.27Å; Y426-W622 HydrophobicContact CG-CZ3 4.04Å; Q618-W622 PolarHBondContact O-N 2.83Å; Q618-W622 VanDerWaalsContact O-N 3.14Å; I619-W622 PolarHBondContact O-N 3.37Å; F620-W622 VanDerWaalsContact C-N 3.33Å; F620-W622 PolarHBondContact O-N 3.21Å; W622-Q624 VanDerWaalsContact C-N 3.31Å; W622-Q624 PolarHBondContact O-N 3.08Å; W622-L625 HydrophobicContact CE3-CD1 3.93Å; W622-L625 HydrophobicContact CZ3-CD1 3.98Å; W622-L625 PolarHBondContact O-N 3.26Å; W622-I626 WeakPolarHBondContact O-CD1 3.02Å; W622-I626 VanDerWaalsContact O-CG1 3.23Å; W622-I626 WeakPolarHBondContact O-CG1 3.4Å; W622-I626 PolarHBondContact O-N 2.93Å
623	I	86.6	Confident	78.6	Confident	11 Å²	11	32.9 Å²	32.9	6%	0.056	17%	0.171	C	C	.	.	H	α-helix	trans	-56.8	-46.4	176	-75.2	170.7	0	0	0	110.8	L422 L485 L487 I619 F620 L625 I626 N627	L422-I623 HydrophobicContact CD2-CG1 4.16Å; L485-I623 HydrophobicContact CB-CG1 4.35Å; L485-I623 HydrophobicContact CB-CG2 3.9Å; L485-I623 WeakPolarHBondContact O-CG2 3.36Å; L487-I623 HydrophobicContact CD2-CD1 3.84Å; L487-I623 HydrophobicContact CG-CD1 3.76Å; I619-I623 HydrophobicContact CG2-CD1 3.68Å; I619-I623 HydrophobicContact CG2-CG1 4.4Å; I619-I623 WeakPolarHBondContact O-CG1 3.38Å; I619-I623 PolarHBondContact O-N 3.18Å; F620-I623 PolarHBondContact O-N 3.06Å; I623-L625 PolarHBondContact O-N 2.98Å; I623-I626 PolarHBondContact O-N 2.89Å; I623-N627 PolarHBondContact O-N 2.88Å
624	Q	84.4	Confident	81.2	Confident	23 Å²	23	30.8 Å²	30.8	11%	0.107	15%	0.149	C	C	.	.	H	α-helix	trans	-59.4	-47.1	176.4	-71.4	177.8	-29.6	0	0	112.1	F620 Y621 W622 I626 N627 Q628 E688	F620-Q624 HydrophobicContact CD1-CG 4.5Å; F620-Q624 VanDerWaalsContact CE1-CD 3.44Å; F620-Q624 HydrophobicContact CE1-CG 4.21Å; F620-Q624 HydrophobicContact CE2-CG 4.43Å; F620-Q624 HydrophobicContact CZ-CG 4.17Å; F620-Q624 WeakPolarHBondContact O-CG 3.49Å; F620-Q624 PolarHBondContact O-N 3.38Å; Y621-Q624 PolarHBondContact O-N 3.33Å; W622-Q624 VanDerWaalsContact C-N 3.31Å; W622-Q624 PolarHBondContact O-N 3.08Å; Q624-I626 VanDerWaalsContact C-N 3.33Å; Q624-I626 PolarHBondContact O-N 3.22Å; Q624-N627 PolarHBondContact O-N 2.91Å; Q624-Q628 WeakPolarHBondContact O-CB 3.48Å; Q624-Q628 WeakPolarHBondContact O-CG 3.43Å; Q624-Q628 PolarHBondContact O-N 3.49Å; Q624-E688 PolarHBondContact NE2-OE1 2.8Å; Q624-E688 PolarHBondContact NE2-OE2 2.83Å
625	L	86.1	Confident	82.8	Confident	23 Å²	23	27.9 Å²	27.9	12%	0.12	13%	0.134	C	C	.	.	H	α-helix	trans	-63.4	-38.4	179.1	-74	-176.5	0	0	0	112.7	Y426 Y621 W622 I623 S629	Y426-L625 HydrophobicContact CD2-CB 3.6Å; Y426-L625 HydrophobicContact CD2-CD1 4.43Å; Y426-L625 HydrophobicContact CE2-CB 3.75Å; Y426-L625 HydrophobicContact CE2-CD1 4.21Å; Y426-L625 HydrophobicContact CE2-CD2 4.37Å; Y426-L625 HydrophobicContact CE2-CG 4.36Å; Y426-L625 HydrophobicContact CG-CB 4.37Å; Y621-L625 HydrophobicContact CD1-CD1 4.15Å; Y621-L625 HydrophobicContact CE1-CD1 3.51Å; Y621-L625 HydrophobicContact CE1-CG 4.43Å; Y621-L625 HydrophobicContact CE2-CD1 4.11Å; Y621-L625 HydrophobicContact CE2-CG 4.3Å; Y621-L625 VanDerWaalsContact CZ-CD1 3.49Å; Y621-L625 WeakPolarHBondContact O-CG 3.39Å; Y621-L625 PolarHBondContact O-N 3.41Å; W622-L625 HydrophobicContact CE3-CD1 3.93Å; W622-L625 HydrophobicContact CZ3-CD1 3.98Å; W622-L625 PolarHBondContact O-N 3.26Å; I623-L625 PolarHBondContact O-N 2.98Å; L625-S629 VanDerWaalsContact O-CB 3.27Å; L625-S629 WeakPolarHBondContact O-CB 3.35Å; L625-S629 PolarHBondContact O-N 2.88Å; L625-S629 PolarHBondContact O-OG 3.28Å
626	I	90.6	Very high	84.3	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-63.2	-50.1	174.9	-69.8	160.3	0	0	0	109.6	L422 L425 L429 F479 L485 W622 I623 Q624 Q628 S629 A630	L422-I626 HydrophobicContact CB-CD1 4.04Å; L422-I626 HydrophobicContact CD2-CD1 3.6Å; L422-I626 HydrophobicContact CG-CD1 4.46Å; L422-I626 WeakPolarHBondContact O-CD1 3.47Å; L425-I626 HydrophobicContact CB-CD1 4.34Å; L425-I626 HydrophobicContact CD2-CD1 4.23Å; L425-I626 HydrophobicContact CD2-CG2 4.21Å; L425-I626 HydrophobicContact CG-CD1 4.46Å; L425-I626 HydrophobicContact CG-CG2 4.42Å; L429-I626 HydrophobicContact CD1-CG2 3.74Å; F479-I626 HydrophobicContact CE2-CG2 4.34Å; F479-I626 HydrophobicContact CZ-CG2 4.37Å; L485-I626 HydrophobicContact CD1-CB 4.16Å; L485-I626 HydrophobicContact CD1-CD1 3.74Å; L485-I626 HydrophobicContact CD1-CG2 3.62Å; L485-I626 HydrophobicContact CG-CG2 4.35Å; W622-I626 WeakPolarHBondContact O-CD1 3.02Å; W622-I626 VanDerWaalsContact O-CG1 3.23Å; W622-I626 WeakPolarHBondContact O-CG1 3.4Å; W622-I626 PolarHBondContact O-N 2.93Å; I623-I626 PolarHBondContact O-N 2.89Å; Q624-I626 VanDerWaalsContact C-N 3.33Å; Q624-I626 PolarHBondContact O-N 3.22Å; I626-Q628 VanDerWaalsContact C-N 3.3Å; I626-Q628 PolarHBondContact O-N 3.38Å; I626-S629 PolarHBondContact O-N 3.19Å; I626-A630 WeakPolarHBondContact O-CB 3.27Å; I626-A630 PolarHBondContact O-N 3.24Å
627	N	91.9	Very high	85.6	Confident	5 Å²	5	20.4 Å²	20.4	3%	0.027	9%	0.094	C	C	.	.	H	α-helix	trans	-59.1	-42.6	-178.2	-73.9	-18.7	0	0	0	112.2	Y483 L485 I623 Q624 F631 W692	Y483-N627 HydrophobicContact CE2-CB 4.45Å; Y483-N627 PolarHBondContact OH-O 2.8Å; Y483-N627 VanDerWaalsContact OH-O 3.06Å; L485-N627 PolarHBondContact N-OD1 3.39Å; L485-N627 PolarHBondContact O-ND2 2.95Å; I623-N627 PolarHBondContact O-N 2.88Å; Q624-N627 PolarHBondContact O-N 2.91Å; N627-F631 PolarHBondContact O-N 2.94Å; N627-F631 VanDerWaalsContact O-N 3.17Å; N627-W692 HydrophobicContact CB-CH2 4.42Å; N627-W692 HydrophobicContact CB-CZ2 4.3Å
628	Q	88.1	Confident	86.7	Confident	13 Å²	13	16.8 Å²	16.8	6%	0.061	8%	0.075	C	C	.	.	H	α-helix	trans	-66.1	-47.4	175.6	-72.2	171.4	-1	0	0	112.1	Q624 I626 A630 F631 E632 C691 W692	Q624-Q628 WeakPolarHBondContact O-CB 3.48Å; Q624-Q628 WeakPolarHBondContact O-CG 3.43Å; Q624-Q628 PolarHBondContact O-N 3.49Å; I626-Q628 VanDerWaalsContact C-N 3.3Å; I626-Q628 PolarHBondContact O-N 3.38Å; Q628-A630 VanDerWaalsContact C-N 3.3Å; Q628-A630 PolarHBondContact O-N 3.29Å; Q628-F631 PolarHBondContact O-N 3.38Å; Q628-E632 WeakPolarHBondContact O-CG 3.36Å; Q628-E632 PolarHBondContact O-N 2.94Å; Q628-C691 VanDerWaalsContact NE2-CB 3.32Å; Q628-W692 HydrophobicContact CG-CD2 3.96Å; Q628-W692 HydrophobicContact CG-CE3 4.2Å; Q628-W692 HydrophobicContact CG-CH2 4.19Å; Q628-W692 HydrophobicContact CG-CZ2 3.99Å; Q628-W692 HydrophobicContact CG-CZ3 4.3Å
629	S	90.7	Very high	87.5	Confident	4 Å²	4	15 Å²	15	3%	0.028	7%	0.065	C	C	.	.	H	α-helix	trans	-65.6	-35.2	-177.6	-57.8	0	0	0	0	112.3	Y426 R430 L625 I626 L633	Y426-S629 VanDerWaalsContact CD2-OG 3.31Å; Y426-S629 WeakPolarHBondContact CD2-OG 3.1Å; Y426-S629 WeakPolarHBondContact CE2-OG 3.31Å; R430-S629 WeakPolarHBondContact CD-OG 3.25Å; L625-S629 VanDerWaalsContact O-CB 3.27Å; L625-S629 WeakPolarHBondContact O-CB 3.35Å; L625-S629 PolarHBondContact O-N 2.88Å; L625-S629 PolarHBondContact O-OG 3.28Å; I626-S629 PolarHBondContact O-N 3.19Å; S629-L633 WeakPolarHBondContact O-CB 3.48Å; S629-L633 PolarHBondContact O-N 2.97Å
630	A	93.7	Very high	87.7	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-65.5	-45.3	173.1	0	0	0	0	0	111.9	L429 F479 Y483 I626 Q628 E632 L633 F634	L429-A630 HydrophobicContact CD1-CB 4.1Å; F479-A630 HydrophobicContact CE1-CB 3.61Å; F479-A630 HydrophobicContact CZ-CB 3.63Å; Y483-A630 HydrophobicContact CD2-CB 4.02Å; Y483-A630 HydrophobicContact CE2-CB 3.4Å; Y483-A630 VanDerWaalsContact CE2-CB 3.4Å; I626-A630 WeakPolarHBondContact O-CB 3.27Å; I626-A630 PolarHBondContact O-N 3.24Å; Q628-A630 VanDerWaalsContact C-N 3.3Å; Q628-A630 PolarHBondContact O-N 3.29Å; A630-E632 VanDerWaalsContact C-N 3.32Å; A630-E632 PolarHBondContact O-N 3.49Å; A630-L633 CarbonylContact O-C 3.51Å; A630-L633 WeakPolarHBondContact O-CA 3.47Å; A630-L633 WeakPolarHBondContact O-CB 3.21Å; A630-L633 PolarHBondContact O-N 3.18Å; A630-L633 VanDerWaalsContact O-N 3.11Å; A630-F634 HydrophobicContact CB-CZ 4.28Å; A630-F634 VanDerWaalsContact O-CD1 3.23Å; A630-F634 WeakPolarHBondContact O-CD1 3.5Å; A630-F634 WeakPolarHBondContact O-CG 3.49Å; A630-F634 PolarHBondContact O-N 3.19Å
631	F	94.1	Very high	88	Confident	0 Å²	0	13 Å²	13	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-63.2	-39.3	176.5	-179.7	-103.3	0	0	0	112.2	N627 Q628 L633 F634 T635 L665 W669 W692 F696 Y699 F717 V721	N627-F631 PolarHBondContact O-N 2.94Å; N627-F631 VanDerWaalsContact O-N 3.17Å; Q628-F631 PolarHBondContact O-N 3.38Å; F631-L633 VanDerWaalsContact C-N 3.35Å; F631-F634 WeakPolarHBondContact O-CB 3.34Å; F631-F634 PolarHBondContact O-N 3.4Å; F631-T635 PolarHBondContact O-N 2.71Å; F631-T635 PolarHBondContact O-OG1 2.96Å; F631-L665 HydrophobicContact CD2-CD2 3.98Å; F631-W669 AromaticContact CD2-CH2 3.95Å; F631-W669 HydrophobicContact CD2-CH2 3.95Å; F631-W669 AromaticContact CD2-CZ2 3.74Å; F631-W669 HydrophobicContact CD2-CZ2 3.74Å; F631-W669 AromaticContact CE2-CH2 3.48Å; F631-W669 HydrophobicContact CE2-CH2 3.48Å; F631-W669 VanDerWaalsContact CE2-CH2 3.48Å; F631-W669 AromaticContact CE2-CZ2 3.73Å; F631-W669 HydrophobicContact CE2-CZ2 3.73Å; F631-W669 HydrophobicContact CG-CZ2 4.17Å; F631-W669 AromaticContact CZ-CH2 3.9Å; F631-W669 HydrophobicContact CZ-CH2 3.9Å; F631-W669 HydrophobicContact CZ-CZ2 4.13Å; F631-W692 HydrophobicContact CB-CH2 4.48Å; F631-W692 HydrophobicContact CB-CZ3 4.03Å; F631-W692 HydrophobicContact CD1-CZ3 4.16Å; F631-W692 HydrophobicContact CG-CZ3 4.14Å; F631-F696 AromaticContact CE1-CD1 3.74Å; F631-F696 HydrophobicContact CE1-CD1 3.74Å; F631-F696 HydrophobicContact CE1-CE1 4.07Å; F631-F696 HydrophobicContact CZ-CD1 4.15Å; F631-F696 HydrophobicContact CZ-CE1 4.32Å; F631-Y699 HydrophobicContact CE1-CD2 4.44Å; F631-Y699 HydrophobicContact CE1-CG 4.09Å; F631-Y699 HydrophobicContact CE2-CD2 4.38Å; F631-Y699 HydrophobicContact CZ-CD1 4.05Å; F631-Y699 AromaticContact CZ-CD2 3.88Å; F631-Y699 HydrophobicContact CZ-CD2 3.88Å; F631-Y699 AromaticContact CZ-CG 3.62Å; F631-Y699 HydrophobicContact CZ-CG 3.62Å; F631-F717 HydrophobicContact CD2-CD2 4.49Å; F631-F717 HydrophobicContact CE2-CB 3.95Å; F631-F717 AromaticContact CE2-CD2 3.85Å; F631-F717 HydrophobicContact CE2-CD2 3.85Å; F631-F717 AromaticContact CE2-CG 3.95Å; F631-F717 HydrophobicContact CE2-CG 3.95Å; F631-F717 HydrophobicContact CZ-CB 4.37Å; F631-V721 HydrophobicContact CZ-CG2 4.17Å
632	E	89	Confident	88	Confident	7 Å²	7	12.8 Å²	12.8	3%	0.033	6%	0.058	C	C	.	.	H	α-helix	trans	-61.7	-42.6	171.4	-66.4	180	140.1	0	0	111.6	R430 R433 Q628 A630 F634 T635 Y636 L698	R430-E632 IonicContact CZ-OE2 3.64Å; R430-E632 IonicContact NH1-OE1 2.79Å; R430-E632 IonicContact NH1-OE2 3.6Å; R430-E632 PolarHBondContact NH1-OE2 3.44Å; R433-E632 IonicContact CZ-OE2 2.93Å; R433-E632 IonicContact NH1-OE1 3.31Å; R433-E632 PolarHBondContact NH1-OE1 3.47Å; R433-E632 IonicContact NH1-OE2 3.79Å; R433-E632 PolarHBondContact NH1-OE2 2.87Å; Q628-E632 WeakPolarHBondContact O-CG 3.36Å; Q628-E632 PolarHBondContact O-N 2.94Å; A630-E632 VanDerWaalsContact C-N 3.32Å; A630-E632 PolarHBondContact O-N 3.49Å; E632-F634 VanDerWaalsContact C-N 3.34Å; E632-F634 PolarHBondContact O-N 2.91Å; E632-T635 VanDerWaalsContact O-CB 3.23Å; E632-T635 WeakPolarHBondContact O-CB 3.41Å; E632-T635 PolarHBondContact O-N 2.67Å; E632-T635 PolarHBondContact O-OG1 2.86Å; E632-Y636 WeakPolarHBondContact O-CD2 3.44Å; E632-L698 HydrophobicContact CB-CD2 3.81Å; E632-L698 HydrophobicContact CG-CD2 3.88Å
633	L	90.9	Very high	87.5	Confident	1 Å²	1	16.1 Å²	16.1	1%	0.005	7%	0.07	C	C	.	.	H	α-helix	trans	-61.4	-40.8	174.8	176.2	63.1	0	0	0	111.7	L429 L432 R433 F436 S629 A630 F631 T635 Y636 I637	L429-L633 HydrophobicContact CD2-CD2 3.82Å; L432-L633 HydrophobicContact CB-CD1 4.1Å; L432-L633 HydrophobicContact CB-CD2 4.16Å; L432-L633 HydrophobicContact CD1-CD2 4.31Å; R433-L633 HydrophobicContact CB-CD1 4.44Å; F436-L633 HydrophobicContact CD2-CD1 3.59Å; F436-L633 HydrophobicContact CE2-CD1 4.1Å; F436-L633 HydrophobicContact CG-CD1 4.26Å; S629-L633 WeakPolarHBondContact O-CB 3.48Å; S629-L633 PolarHBondContact O-N 2.97Å; A630-L633 CarbonylContact O-C 3.51Å; A630-L633 WeakPolarHBondContact O-CA 3.47Å; A630-L633 WeakPolarHBondContact O-CB 3.21Å; A630-L633 PolarHBondContact O-N 3.18Å; A630-L633 VanDerWaalsContact O-N 3.11Å; F631-L633 VanDerWaalsContact C-N 3.35Å; L633-T635 PolarHBondContact O-N 3.07Å; L633-Y636 PolarHBondContact O-N 3Å; L633-I637 HydrophobicContact CD1-CD1 4.24Å; L633-I637 HydrophobicContact CD1-CG1 4.3Å; L633-I637 HydrophobicContact CD2-CD1 4.21Å; L633-I637 HydrophobicContact CG-CD1 3.77Å; L633-I637 HydrophobicContact CG-CG1 4.26Å; L633-I637 PolarHBondContact O-N 2.82Å
634	F	92.9	Very high	86.8	Confident	1 Å²	1	15.8 Å²	15.8	0%	0.004	7%	0.069	C	C	.	.	H	α-helix	trans	-60	-32.8	176.5	-64.2	-12.8	0	0	0	112.6	F479 Y480 Y483 A630 F631 E632 Y636 I637 E638 W655 F717	F479-F634 HydrophobicContact CD1-CZ 4.42Å; F479-F634 HydrophobicContact CE1-CE1 4.37Å; F479-F634 HydrophobicContact CE1-CZ 4.04Å; Y480-F634 HydrophobicContact CD1-CE1 4.44Å; Y480-F634 HydrophobicContact CD1-CZ 4.09Å; Y480-F634 HydrophobicContact CE1-CD1 4.43Å; Y480-F634 AromaticContact CE1-CE1 3.56Å; Y480-F634 HydrophobicContact CE1-CE1 3.56Å; Y480-F634 HydrophobicContact CE1-CE2 4.43Å; Y480-F634 AromaticContact CE1-CZ 3.56Å; Y480-F634 HydrophobicContact CE1-CZ 3.56Å; Y483-F634 HydrophobicContact CD1-CE2 4Å; Y483-F634 HydrophobicContact CD1-CZ 4.15Å; Y483-F634 AromaticContact CE1-CE2 3.53Å; Y483-F634 HydrophobicContact CE1-CE2 3.53Å; Y483-F634 HydrophobicContact CE1-CZ 4.07Å; Y483-F634 HydrophobicContact CG-CZ 4.44Å; Y483-F634 AromaticContact CZ-CE2 3.8Å; A630-F634 HydrophobicContact CB-CZ 4.28Å; A630-F634 VanDerWaalsContact O-CD1 3.23Å; A630-F634 WeakPolarHBondContact O-CD1 3.5Å; A630-F634 WeakPolarHBondContact O-CG 3.49Å; A630-F634 PolarHBondContact O-N 3.19Å; F631-F634 WeakPolarHBondContact O-CB 3.34Å; F631-F634 PolarHBondContact O-N 3.4Å; E632-F634 VanDerWaalsContact C-N 3.34Å; E632-F634 PolarHBondContact O-N 2.91Å; F634-Y636 PolarHBondContact O-N 3.15Å; F634-I637 HydrophobicContact CD1-CD1 4.32Å; F634-I637 PolarHBondContact O-N 3.05Å; F634-E638 VanDerWaalsContact O-CB 3.24Å; F634-E638 WeakPolarHBondContact O-CB 3.3Å; F634-E638 PolarHBondContact O-N 3.3Å; F634-W655 HydrophobicContact CB-CH2 4.39Å; F634-W655 HydrophobicContact CB-CZ3 3.9Å; F634-W655 HydrophobicContact CG-CZ3 4.32Å; F634-F717 HydrophobicContact CD2-CE2 4.48Å
635	T	88.3	Confident	85.8	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-56.9	-41	173.3	-50.9	0	0	0	0	111.3	F631 E632 L633 Y639 L698 Y699	F631-T635 PolarHBondContact O-N 2.71Å; F631-T635 PolarHBondContact O-OG1 2.96Å; E632-T635 VanDerWaalsContact O-CB 3.23Å; E632-T635 WeakPolarHBondContact O-CB 3.41Å; E632-T635 PolarHBondContact O-N 2.67Å; E632-T635 PolarHBondContact O-OG1 2.86Å; L633-T635 PolarHBondContact O-N 3.07Å; T635-Y639 PolarHBondContact O-N 2.87Å; T635-L698 HydrophobicContact CG2-CG 4.27Å; T635-Y699 HydrophobicContact CG2-CD2 4.02Å; T635-Y699 WeakPolarHBondContact OG1-CD2 3.47Å
636	Y	87.2	Confident	84.4	Confident	2 Å²	2	23.6 Å²	23.6	1%	0.008	12%	0.123	C	C	.	.	H	α-helix	trans	-79.5	-40.1	179.1	-64.6	-78	0	0	0	112.4	R433 F436 E437 E632 L633 F634 E638 Y639 Y640 L698 F706	R433-Y636 HydrophobicContact CG-CD2 3.97Å; R433-Y636 HydrophobicContact CG-CE2 3.73Å; F436-Y636 HydrophobicContact CB-CG 4.16Å; E437-Y636 HydrophobicContact CB-CE1 4.45Å; E437-Y636 HydrophobicContact CG-CD1 4.12Å; E437-Y636 HydrophobicContact CG-CD2 4.47Å; E437-Y636 HydrophobicContact CG-CE1 3.39Å; E437-Y636 HydrophobicContact CG-CE2 3.78Å; E437-Y636 WeakPolarHBondContact CG-OH 3.44Å; E437-Y636 WeakPolarHBondContact OE1-CE2 3.32Å; E437-Y636 PolarHBondContact OE1-OH 2.77Å; E632-Y636 WeakPolarHBondContact O-CD2 3.44Å; L633-Y636 PolarHBondContact O-N 3Å; F634-Y636 PolarHBondContact O-N 3.15Å; Y636-E638 VanDerWaalsContact C-N 3.27Å; Y636-E638 PolarHBondContact O-N 3.2Å; Y636-Y639 WeakPolarHBondContact O-CB 3.23Å; Y636-Y639 PolarHBondContact O-N 3.07Å; Y636-Y639 VanDerWaalsContact O-N 3.13Å; Y636-Y640 WeakPolarHBondContact O-CD2 3.43Å; Y636-Y640 PolarHBondContact O-N 3.46Å; Y636-L698 HydrophobicContact CE2-CD2 3.99Å; Y636-F706 HydrophobicContact CD1-CZ 4.35Å; Y636-F706 HydrophobicContact CE1-CE1 4.31Å; Y636-F706 AromaticContact CE1-CE2 3.93Å; Y636-F706 HydrophobicContact CE1-CE2 3.93Å; Y636-F706 AromaticContact CE1-CZ 3.45Å; Y636-F706 HydrophobicContact CE1-CZ 3.45Å; Y636-F706 VanDerWaalsContact CE1-CZ 3.45Å
637	I	89	Confident	82.7	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-59.6	-42.4	175.3	-68.1	172.5	0	0	0	110.5	F436 L476 L633 F634 Y640 S641 F653 W655	F436-I637 HydrophobicContact CE1-CG1 4.16Å; F436-I637 HydrophobicContact CE2-CG1 4.17Å; F436-I637 HydrophobicContact CZ-CG1 3.89Å; L476-I637 HydrophobicContact CD1-CD1 3.91Å; L476-I637 HydrophobicContact CD2-CD1 3.74Å; L476-I637 HydrophobicContact CG-CD1 4.47Å; L633-I637 HydrophobicContact CD1-CD1 4.24Å; L633-I637 HydrophobicContact CD1-CG1 4.3Å; L633-I637 HydrophobicContact CD2-CD1 4.21Å; L633-I637 HydrophobicContact CG-CD1 3.77Å; L633-I637 HydrophobicContact CG-CG1 4.26Å; L633-I637 PolarHBondContact O-N 2.82Å; F634-I637 HydrophobicContact CD1-CD1 4.32Å; F634-I637 PolarHBondContact O-N 3.05Å; I637-Y640 PolarHBondContact O-N 2.93Å; I637-S641 WeakPolarHBondContact O-CB 3.44Å; I637-S641 PolarHBondContact O-N 3.21Å; I637-S641 PolarHBondContact O-OG 2.69Å; I637-F653 HydrophobicContact CG2-CB 3.85Å; I637-W655 HydrophobicContact CG2-CB 4.21Å; I637-W655 HydrophobicContact CG2-CE3 4.15Å
638	E	90.1	Very high	80.8	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-57.1	-52.3	171.5	-173.2	-175.6	-133.9	0	0	110.5	F634 Y636 Y640 S641 F642 W655 Y699 W708 R715 L716	F634-E638 VanDerWaalsContact O-CB 3.24Å; F634-E638 WeakPolarHBondContact O-CB 3.3Å; F634-E638 PolarHBondContact O-N 3.3Å; Y636-E638 VanDerWaalsContact C-N 3.27Å; Y636-E638 PolarHBondContact O-N 3.2Å; E638-Y640 VanDerWaalsContact C-N 3.29Å; E638-Y640 PolarHBondContact O-N 3.04Å; E638-S641 PolarHBondContact O-N 3.06Å; E638-S641 PolarHBondContact O-OG 3.48Å; E638-F642 HydrophobicContact CG-CD2 4.15Å; E638-F642 HydrophobicContact CG-CE2 4Å; E638-F642 VanDerWaalsContact O-CD2 3.31Å; E638-F642 WeakPolarHBondContact O-CD2 3.4Å; E638-F642 PolarHBondContact O-N 3.04Å; E638-W655 HydrophobicContact CB-CD2 4.13Å; E638-W655 HydrophobicContact CB-CE3 4.49Å; E638-W655 HydrophobicContact CB-CH2 3.99Å; E638-W655 HydrophobicContact CB-CZ2 3.58Å; E638-W655 HydrophobicContact CB-CZ3 4.44Å; E638-W655 HydrophobicContact CG-CD2 4.49Å; E638-W655 HydrophobicContact CG-CH2 4.33Å; E638-W655 HydrophobicContact CG-CZ2 3.49Å; E638-W655 VanDerWaalsContact CG-CZ2 3.49Å; E638-Y699 PolarHBondContact OE1-OH 3Å; E638-Y699 WeakPolarHBondContact OE2-CE2 3.44Å; E638-Y699 PolarHBondContact OE2-OH 3.01Å; E638-W708 HydrophobicContact CG-CH2 3.9Å; E638-R715 IonicContact OE1-NE 2.71Å; E638-R715 IonicContact OE2-CZ 3.47Å; E638-R715 VanDerWaalsContact OE2-CZ 3.31Å; E638-R715 IonicContact OE2-NE 3.82Å; E638-R715 PolarHBondContact OE2-NE 3.02Å; E638-R715 IonicContact OE2-NH2 3.85Å; E638-R715 PolarHBondContact OE2-NH2 3.25Å; E638-L716 PolarHBondContact OE1-N 3.01Å
639	Y	84.6	Confident	79	Confident	30 Å²	30	40.1 Å²	40.1	12%	0.118	21%	0.211	C	C	.	.	H	α-helix	trans	-55.2	-43.7	177.4	175.8	-110.5	0	0	0	113	T635 Y636 R643 F706 W708	T635-Y639 PolarHBondContact O-N 2.87Å; Y636-Y639 WeakPolarHBondContact O-CB 3.23Å; Y636-Y639 PolarHBondContact O-N 3.07Å; Y636-Y639 VanDerWaalsContact O-N 3.13Å; Y639-R643 HydrophobicContact CE1-CG 4.33Å; Y639-R643 HydrophobicContact CE2-CG 4.42Å; Y639-R643 WeakPolarHBondContact O-CG 3.37Å; Y639-R643 PolarHBondContact O-N 3.44Å; Y639-R643 PolarHBondContact OH-NE 3.19Å; Y639-R643 PolarHBondContact OH-NH2 3.32Å; Y639-F706 HydrophobicContact CE2-CB 4.05Å; Y639-W708 HydrophobicContact CD2-CB 4.15Å; Y639-W708 AromaticContact CD2-CD2 3.55Å; Y639-W708 HydrophobicContact CD2-CD2 3.55Å; Y639-W708 AromaticContact CD2-CE3 3.63Å; Y639-W708 HydrophobicContact CD2-CE3 3.63Å; Y639-W708 AromaticContact CD2-CG 3.78Å; Y639-W708 HydrophobicContact CD2-CG 3.78Å; Y639-W708 HydrophobicContact CD2-CZ3 4.3Å; Y639-W708 HydrophobicContact CE2-CB 3.84Å; Y639-W708 HydrophobicContact CE2-CD2 4.09Å; Y639-W708 HydrophobicContact CE2-CE3 4.47Å; Y639-W708 AromaticContact CE2-CG 3.8Å; Y639-W708 HydrophobicContact CE2-CG 3.8Å; Y639-W708 HydrophobicContact CG-CE3 4.47Å
640	Y	83	Confident	77.1	Confident	16 Å²	16	42.3 Å²	42.3	6%	0.063	22%	0.221	C	C	.	.	H	α-helix	trans	-71.2	-38.8	-179.3	-85.1	-116.9	0	0	0	111.8	F436 K439 V441 F444 Y636 I637 E638 F642 R643 C644 F653	F436-Y640 AromaticContact CD1-CD1 3.98Å; F436-Y640 HydrophobicContact CD1-CD1 3.98Å; F436-Y640 AromaticContact CD1-CD2 3.68Å; F436-Y640 HydrophobicContact CD1-CD2 3.68Å; F436-Y640 HydrophobicContact CD1-CE1 4.19Å; F436-Y640 AromaticContact CD1-CE2 3.88Å; F436-Y640 HydrophobicContact CD1-CE2 3.88Å; F436-Y640 AromaticContact CD1-CG 3.75Å; F436-Y640 HydrophobicContact CD1-CG 3.75Å; F436-Y640 AromaticContact CE1-CD1 3.94Å; F436-Y640 HydrophobicContact CE1-CD1 3.94Å; F436-Y640 HydrophobicContact CE1-CD2 4.18Å; F436-Y640 AromaticContact CE1-CG 3.79Å; F436-Y640 HydrophobicContact CE1-CG 3.79Å; F436-Y640 WeakPolarHBondContact O-CE2 3.32Å; F436-Y640 PolarHBondContact O-OH 3.08Å; K439-Y640 PolarHBondContact O-OH 3.2Å; V441-Y640 HydrophobicContact CB-CD1 4.3Å; V441-Y640 HydrophobicContact CB-CE1 4.42Å; V441-Y640 HydrophobicContact CG2-CD1 3.62Å; V441-Y640 HydrophobicContact CG2-CE1 3.83Å; V441-Y640 HydrophobicContact CG2-CG 4.32Å; F444-Y640 HydrophobicContact CD2-CD1 4.3Å; F444-Y640 HydrophobicContact CD2-CE1 4.21Å; F444-Y640 HydrophobicContact CE2-CD1 4.04Å; F444-Y640 AromaticContact CE2-CE1 3.74Å; F444-Y640 HydrophobicContact CE2-CE1 3.74Å; Y636-Y640 WeakPolarHBondContact O-CD2 3.43Å; Y636-Y640 PolarHBondContact O-N 3.46Å; I637-Y640 PolarHBondContact O-N 2.93Å; E638-Y640 VanDerWaalsContact C-N 3.29Å; E638-Y640 PolarHBondContact O-N 3.04Å; Y640-F642 VanDerWaalsContact C-N 3.29Å; Y640-F642 PolarHBondContact O-N 3.22Å; Y640-R643 CarbonylContact O-C 3.38Å; Y640-R643 WeakPolarHBondContact O-CB 3.19Å; Y640-R643 PolarHBondContact O-N 2.95Å; Y640-C644 WeakPolarHBondContact O-CB 3.5Å; Y640-C644 PolarHBondContact O-N 2.98Å; Y640-C644 PolarHBondContact O-SG 3.2Å; Y640-F653 HydrophobicContact CD1-CE2 4.24Å; Y640-F653 HydrophobicContact CG-CE2 4.47Å
641	S	83.4	Confident	75.3	Confident	12 Å²	12	44.7 Å²	44.7	8%	0.084	24%	0.238	C	C	.	.	H	α-helix	trans	-62.1	-38.6	178.5	69.8	0	0	0	0	111.7	I637 E638 C644 S645	I637-S641 WeakPolarHBondContact O-CB 3.44Å; I637-S641 PolarHBondContact O-N 3.21Å; I637-S641 PolarHBondContact O-OG 2.69Å; E638-S641 PolarHBondContact O-N 3.06Å; E638-S641 PolarHBondContact O-OG 3.48Å; S641-C644 PolarHBondContact O-N 3.24Å; S641-S645 PolarHBondContact O-N 3.26Å
642	F	78.8	Confident	73.8	Confident	72 Å²	72	48.3 Å²	48.3	32%	0.316	26%	0.261	S	S	.	.	H	α-helix	trans	-68.5	-29.2	172.5	-84.5	-83.6	0	0	0	113.9	E638 Y640 S645 W708 V710	E638-F642 HydrophobicContact CG-CD2 4.15Å; E638-F642 HydrophobicContact CG-CE2 4Å; E638-F642 VanDerWaalsContact O-CD2 3.31Å; E638-F642 WeakPolarHBondContact O-CD2 3.4Å; E638-F642 PolarHBondContact O-N 3.04Å; Y640-F642 VanDerWaalsContact C-N 3.29Å; Y640-F642 PolarHBondContact O-N 3.22Å; F642-S645 PolarHBondContact O-OG 2.79Å; F642-W708 HydrophobicContact CB-CZ2 3.82Å; F642-W708 HydrophobicContact CD1-CZ2 4.35Å; F642-W708 AromaticContact CD2-CH2 3.86Å; F642-W708 HydrophobicContact CD2-CH2 3.86Å; F642-W708 AromaticContact CD2-CZ2 3.32Å; F642-W708 HydrophobicContact CD2-CZ2 3.32Å; F642-W708 HydrophobicContact CE2-CH2 4.19Å; F642-W708 AromaticContact CE2-CZ2 3.85Å; F642-W708 HydrophobicContact CE2-CZ2 3.85Å; F642-W708 AromaticContact CG-CZ2 3.59Å; F642-W708 HydrophobicContact CG-CZ2 3.59Å; F642-V710 HydrophobicContact CE1-CG2 4.39Å; F642-V710 HydrophobicContact CZ-CG2 4.33Å
643	R	75.1	Confident	72.9	Confident	117 Å²	117	48 Å²	48	44%	0.442	26%	0.26	S	S	.	.	H	α-helix	trans	-75.1	-41.3	172.1	-71.7	-72.6	-162.1	175	3.9	111.1	V441 Y639 Y640 S645 T646	V441-R643 HydrophobicContact CG2-CB 3.85Å; Y639-R643 HydrophobicContact CE1-CG 4.33Å; Y639-R643 HydrophobicContact CE2-CG 4.42Å; Y639-R643 WeakPolarHBondContact O-CG 3.37Å; Y639-R643 PolarHBondContact O-N 3.44Å; Y639-R643 PolarHBondContact OH-NE 3.19Å; Y639-R643 PolarHBondContact OH-NH2 3.32Å; Y640-R643 CarbonylContact O-C 3.38Å; Y640-R643 WeakPolarHBondContact O-CB 3.19Å; Y640-R643 PolarHBondContact O-N 2.95Å; R643-S645 VanDerWaalsContact C-N 3.34Å; R643-S645 PolarHBondContact O-N 3.44Å; R643-T646 PolarHBondContact O-N 2.9Å; R643-T646 PolarHBondContact O-OG1 3.38Å
644	C	70	Confident	72	Confident	5 Å²	5	51.2 Å²	51.2	3%	0.034	28%	0.276	C	S	.	.	H	α-helix	trans	-62	-37.8	178	-73.6	0	0	0	0	112.4	V441 Y640 S641 T646 A647 H650	V441-C644 WeakPolarHBondContact CG1-SG 3.22Å; Y640-C644 WeakPolarHBondContact O-CB 3.5Å; Y640-C644 PolarHBondContact O-N 2.98Å; Y640-C644 PolarHBondContact O-SG 3.2Å; S641-C644 PolarHBondContact O-N 3.24Å; C644-T646 PolarHBondContact O-N 3.19Å; C644-A647 CarbonylContact O-C 3.39Å; C644-A647 PolarHBondContact O-N 3.38Å; C644-H650 HydrophobicContact CB-CB 3.74Å
645	S	64.1	Low	71.5	Confident	95 Å²	95	52.7 Å²	52.7	66%	0.664	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-18.6	177.7	62.9	0	0	0	0	113.7	S641 F642 R643	S641-S645 PolarHBondContact O-N 3.26Å; F642-S645 PolarHBondContact O-OG 2.79Å; R643-S645 VanDerWaalsContact C-N 3.34Å; R643-S645 PolarHBondContact O-N 3.44Å
646	T	56.6	Low	71.5	Confident	114 Å²	114	56.6 Å²	56.6	70%	0.699	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-9.3	173.1	67.8	0	0	0	0	114.1	R643 C644	R643-T646 PolarHBondContact O-N 2.9Å; R643-T646 PolarHBondContact O-OG1 3.38Å; C644-T646 PolarHBondContact O-N 3.19Å
647	A	56	Low	71.6	Confident	38 Å²	38	56.6 Å²	56.6	31%	0.314	31%	0.308	S	S	.	.	S	Bend	trans	-116.8	120.4	-176	0	0	0	0	0	110.7	C644 H649 H650	C644-A647 CarbonylContact O-C 3.39Å; C644-A647 PolarHBondContact O-N 3.38Å; A647-H649 PolarHBondContact O-N 3.19Å; A647-H650 VanDerWaalsContact CB-CD2 3.44Å; A647-H650 WeakPolarHBondContact CB-CD2 3.38Å
648	N	50.5	Low	71.7	Confident	154 Å²	154	59.5 Å²	59.5	82%	0.824	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-0.5	-167.9	-70.6	-15	0	0	0	117
649	H	50.6	Low	71.6	Confident	173 Å²	173	67.2 Å²	67.2	80%	0.801	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.2	16.6	-166.7	-61.4	-47.2	0	0	0	115.8	A647	A647-H649 PolarHBondContact O-N 3.19Å
650	H	51.4	Low	71.8	Confident	51 Å²	51	70.3 Å²	70.3	24%	0.236	38%	0.381	C	S	.	.			trans	-111.7	131.4	178.2	-57.6	-78.8	0	0	0	112.1	T445 C644 A647	T445-H650 WeakPolarHBondContact CG2-CE1 3.43Å; T445-H650 WeakPolarHBondContact CG2-ND1 3.24Å; C644-H650 HydrophobicContact CB-CB 3.74Å; A647-H650 VanDerWaalsContact CB-CD2 3.44Å; A647-H650 WeakPolarHBondContact CB-CD2 3.38Å
651	S	55.4	Low	72.2	Confident	49 Å²	49	69.9 Å²	69.9	34%	0.343	38%	0.38	S	S	.	.			trans	-68.1	132.2	160.4	62.2	0	0	0	0	108.3	S469 E473 F653	S469-S651 PolarHBondContact OG-OG 2.72Å; E473-S651 WeakPolarHBondContact OE1-CB 3.43Å; E473-S651 PolarHBondContact OE1-OG 2.76Å; S651-F653 PolarHBondContact O-N 2.73Å
652	P	62.7	Low	72.6	Confident	76 Å²	76	69.9 Å²	69.9	49%	0.494	38%	0.379	S	S	.	.			trans	-65.2	130.9	174	26.2	-31.3	0	0	0	108.6	L654	P652-L654 PolarHBondContact O-N 2.85Å
653	F	69.6	Low	73.1	Confident	2 Å²	2	71.1 Å²	71.1	1%	0.009	39%	0.386	C	S	.	.			trans	-60.3	65.7	177.4	-60.1	-70.1	0	0	0	113.1	F436 F444 L472 L476 I637 Y640 S651 W655	F436-F653 HydrophobicContact CE1-CD2 4.47Å; F436-F653 HydrophobicContact CE1-CE2 4.29Å; F444-F653 HydrophobicContact CB-CE1 3.98Å; F444-F653 HydrophobicContact CB-CZ 3.73Å; F444-F653 HydrophobicContact CD1-CE1 4.06Å; F444-F653 HydrophobicContact CD1-CZ 4.17Å; F444-F653 AromaticContact CD2-CZ 3.92Å; F444-F653 HydrophobicContact CD2-CZ 3.92Å; F444-F653 AromaticContact CG-CE1 3.98Å; F444-F653 HydrophobicContact CG-CE1 3.98Å; F444-F653 AromaticContact CG-CZ 3.67Å; F444-F653 HydrophobicContact CG-CZ 3.67Å; L472-F653 HydrophobicContact CD2-CD1 3.58Å; L472-F653 HydrophobicContact CD2-CE1 3.86Å; L472-F653 HydrophobicContact CD2-CG 4.38Å; L472-F653 HydrophobicContact CG-CD1 4.43Å; L476-F653 HydrophobicContact CD1-CB 4.35Å; I637-F653 HydrophobicContact CG2-CB 3.85Å; Y640-F653 HydrophobicContact CD1-CE2 4.24Å; Y640-F653 HydrophobicContact CG-CE2 4.47Å; S651-F653 PolarHBondContact O-N 2.73Å; F653-W655 PolarHBondContact O-N 3.19Å
654	L	71.9	Confident	73.9	Confident	67 Å²	67	69 Å²	69	35%	0.351	38%	0.377	S	S	.	.	S	Bend	trans	30	52.6	-174.1	-66.1	173.8	0	0	0	112.7	E473 L476 D477 Y480 P652 P656	E473-L654 HydrophobicContact CB-CD1 4.04Å; E473-L654 HydrophobicContact CB-CG 4.2Å; E473-L654 HydrophobicContact CG-CG 4.14Å; E473-L654 WeakPolarHBondContact O-CD1 3.45Å; L476-L654 HydrophobicContact CB-CD1 4.45Å; D477-L654 HydrophobicContact CB-CD1 3.71Å; Y480-L654 HydrophobicContact CE2-CB 4.05Å; Y480-L654 WeakPolarHBondContact CE2-O 3.42Å; Y480-L654 PolarHBondContact OH-O 3.41Å; P652-L654 PolarHBondContact O-N 2.85Å; L654-P656 CarbonylContact O-C 3.52Å
655	W	84	Confident	74.9	Confident	33 Å²	33	68.7 Å²	68.7	13%	0.125	38%	0.376	C	S	.	.			trans	-114.8	125.8	176.8	-175.4	-91.3	0	0	0	108.5	F634 I637 E638 F653 P657 L716 F717	F634-W655 HydrophobicContact CB-CH2 4.39Å; F634-W655 HydrophobicContact CB-CZ3 3.9Å; F634-W655 HydrophobicContact CG-CZ3 4.32Å; I637-W655 HydrophobicContact CG2-CB 4.21Å; I637-W655 HydrophobicContact CG2-CE3 4.15Å; E638-W655 HydrophobicContact CB-CD2 4.13Å; E638-W655 HydrophobicContact CB-CE3 4.49Å; E638-W655 HydrophobicContact CB-CH2 3.99Å; E638-W655 HydrophobicContact CB-CZ2 3.58Å; E638-W655 HydrophobicContact CB-CZ3 4.44Å; E638-W655 HydrophobicContact CG-CD2 4.49Å; E638-W655 HydrophobicContact CG-CH2 4.33Å; E638-W655 HydrophobicContact CG-CZ2 3.49Å; E638-W655 VanDerWaalsContact CG-CZ2 3.49Å; F653-W655 PolarHBondContact O-N 3.19Å; W655-P657 HydrophobicContact CZ3-CG 4.27Å; W655-L716 HydrophobicContact CH2-CB 4.39Å; W655-L716 HydrophobicContact CH2-CD2 3.96Å; W655-L716 HydrophobicContact CZ2-CB 3.85Å; W655-L716 HydrophobicContact CZ2-CD2 3.88Å; W655-F717 HydrophobicContact CH2-CD2 4.17Å; W655-F717 AromaticContact CH2-CE2 3.8Å; W655-F717 HydrophobicContact CH2-CE2 3.8Å; W655-F717 HydrophobicContact CZ3-CE2 4.41Å
656	P	87.2	Confident	76.1	Confident	81 Å²	81	64.2 Å²	64.2	53%	0.526	34%	0.344	S	S	.	.	S	Bend	cis	-76.4	158.3	5.8	32.4	-36.4	0	0	0	113.9	L654 L716	L654-P656 CarbonylContact O-C 3.52Å; P656-L716 HydrophobicContact CB-CD2 3.92Å
657	P	90.3	Very high	77.6	Confident	2 Å²	2	60.6 Å²	60.6	1%	0.013	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-58.8	157.8	168	25.8	-35	0	0	0	111.1	Y480 W655 T661 Q662 L716 F717	Y480-P657 HydrophobicContact CD1-CB 3.98Å; Y480-P657 HydrophobicContact CD2-CB 4.27Å; Y480-P657 HydrophobicContact CE1-CB 3.72Å; Y480-P657 HydrophobicContact CE2-CB 4.02Å; Y480-P657 HydrophobicContact CG-CB 4.25Å; W655-P657 HydrophobicContact CZ3-CG 4.27Å; P657-T661 HydrophobicContact CB-CG2 4.31Å; P657-Q662 HydrophobicContact CG-CG 3.86Å; P657-Q662 PolarHBondContact O-NE2 3.41Å; P657-L716 HydrophobicContact CG-CD2 4.03Å; P657-F717 HydrophobicContact CG-CZ 4.27Å
658	P	90.4	Very high	79.1	Confident	62 Å²	62	59.7 Å²	59.7	40%	0.403	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-54.5	145.4	177.1	-25.1	33.1	0	0	0	112.9	Y480 N660 T661 Q662	Y480-P658 HydrophobicContact CD2-CG 4.45Å; P658-N660 VanDerWaalsContact C-N 3.3Å; P658-N660 PolarHBondContact O-N 3.29Å; P658-T661 WeakPolarHBondContact O-CA 3.47Å; P658-T661 VanDerWaalsContact O-CB 3.26Å; P658-T661 WeakPolarHBondContact O-CB 3.36Å; P658-T661 PolarHBondContact O-N 2.99Å; P658-Q662 PolarHBondContact O-N 2.94Å; P658-Q662 VanDerWaalsContact O-N 3.13Å
659	E	88.7	Confident	80.8	Confident	162 Å²	162	52.3 Å²	52.3	76%	0.757	27%	0.273	S	S	*	.	H	α-helix	trans	-53.5	-43.4	-176.6	-67.9	-180	172.8	0	0	112.9	T661 Q662 E663	E659-T661 VanDerWaalsContact C-N 3.29Å; E659-T661 PolarHBondContact O-N 3.11Å; E659-Q662 WeakPolarHBondContact O-CA 3.41Å; E659-Q662 WeakPolarHBondContact O-CB 3.41Å; E659-Q662 PolarHBondContact O-N 3.45Å; E659-E663 PolarHBondContact O-N 3.04Å
660	N	89	Confident	82.5	Confident	96 Å²	96	44.5 Å²	44.5	51%	0.513	24%	0.236	S	C	.	.	H	α-helix	trans	-57.8	-39.9	175.4	-179.2	-29.9	0	0	0	112.3	P658 Q662 E663 R664	P658-N660 VanDerWaalsContact C-N 3.3Å; P658-N660 PolarHBondContact O-N 3.29Å; N660-Q662 VanDerWaalsContact C-N 3.33Å; N660-Q662 PolarHBondContact O-N 3.31Å; N660-E663 PolarHBondContact O-N 3.11Å; N660-R664 WeakPolarHBondContact O-CB 3.25Å; N660-R664 VanDerWaalsContact O-CG 3.31Å; N660-R664 WeakPolarHBondContact O-CG 3.33Å; N660-R664 PolarHBondContact O-N 3.34Å; N660-R664 PolarHBondContact O-NE 3.07Å; N660-R664 WeakPolarHBondContact OD1-CD 3.5Å; N660-R664 PolarHBondContact OD1-NE 2.93Å
661	T	90.2	Very high	83.9	Confident	6 Å²	6	45.9 Å²	45.9	4%	0.037	25%	0.246	C	C	.	.	H	α-helix	trans	-65.9	-38.1	176.7	-55.8	0	0	0	0	111.5	Y480 Y483 P657 P658 E659 R664 L665	Y480-T661 HydrophobicContact CD1-CG2 4.04Å; Y480-T661 HydrophobicContact CG-CG2 4.37Å; Y480-T661 PolarHBondContact O-OG1 2.92Å; Y480-T661 VanDerWaalsContact O-OG1 3.09Å; Y483-T661 HydrophobicContact CD1-CG2 3.83Å; P657-T661 HydrophobicContact CB-CG2 4.31Å; P658-T661 WeakPolarHBondContact O-CA 3.47Å; P658-T661 VanDerWaalsContact O-CB 3.26Å; P658-T661 WeakPolarHBondContact O-CB 3.36Å; P658-T661 PolarHBondContact O-N 2.99Å; E659-T661 VanDerWaalsContact C-N 3.29Å; E659-T661 PolarHBondContact O-N 3.11Å; T661-R664 PolarHBondContact OG1-NH2 3.37Å; T661-R664 VanDerWaalsContact OG1-NH2 3.17Å; T661-L665 PolarHBondContact O-N 3.48Å
662	Q	91.9	Very high	84.9	Confident	13 Å²	13	45 Å²	45	6%	0.061	24%	0.236	C	C	.	.	H	α-helix	trans	-65.2	-49.2	174.8	-56.1	172	29.1	0	0	110.8	P657 P658 E659 N660 R664 L665 V666 L716 F717 Y814	P657-Q662 HydrophobicContact CG-CG 3.86Å; P657-Q662 PolarHBondContact O-NE2 3.41Å; P658-Q662 PolarHBondContact O-N 2.94Å; P658-Q662 VanDerWaalsContact O-N 3.13Å; E659-Q662 WeakPolarHBondContact O-CA 3.41Å; E659-Q662 WeakPolarHBondContact O-CB 3.41Å; E659-Q662 PolarHBondContact O-N 3.45Å; N660-Q662 VanDerWaalsContact C-N 3.33Å; N660-Q662 PolarHBondContact O-N 3.31Å; Q662-R664 PolarHBondContact O-N 2.8Å; Q662-L665 PolarHBondContact O-N 3.34Å; Q662-V666 WeakPolarHBondContact O-CG2 3.49Å; Q662-V666 PolarHBondContact O-N 3.42Å; Q662-L716 HydrophobicContact CG-CD2 4.05Å; Q662-F717 HydrophobicContact CB-CE1 4.22Å; Q662-F717 HydrophobicContact CG-CE1 4.38Å; Q662-F717 HydrophobicContact CG-CZ 4.25Å; Q662-Y814 HydrophobicContact CB-CD1 4.25Å; Q662-Y814 HydrophobicContact CB-CE1 3.56Å; Q662-Y814 PolarHBondContact OE1-OH 3.37Å
663	E	90.1	Very high	85.4	Confident	97 Å²	97	41.5 Å²	41.5	45%	0.453	21%	0.213	S	C	.	.	H	α-helix	trans	-57.7	-46.8	178.8	-169.4	-170.4	165.2	0	0	111.7	E659 N660 L665 V666 T667 Y814	E659-E663 PolarHBondContact O-N 3.04Å; N660-E663 PolarHBondContact O-N 3.11Å; E663-L665 VanDerWaalsContact C-N 3.33Å; E663-L665 PolarHBondContact O-N 2.85Å; E663-V666 PolarHBondContact O-N 3.19Å; E663-T667 WeakPolarHBondContact O-CB 3.38Å; E663-T667 PolarHBondContact O-N 2.96Å; E663-T667 PolarHBondContact O-OG1 2.94Å; E663-Y814 HydrophobicContact CB-CD1 4.45Å; E663-Y814 WeakPolarHBondContact CG-O 3.29Å
664	R	90.5	Very high	85.4	Confident	72 Å²	72	45.5 Å²	45.5	27%	0.272	24%	0.241	S	C	.	.	H	α-helix	trans	-62.5	-37.7	177.7	-71.2	-177.6	-69.8	168.6	0.7	112.6	Y480 S481 Y483 P484 N660 T661 Q662 L668	Y480-R664 PolarHBondContact O-NH2 3.46Å; S481-R664 PolarHBondContact O-NH1 3.39Å; S481-R664 PolarHBondContact O-NH2 2.89Å; Y483-R664 PolarHBondContact O-NE 2.86Å; Y483-R664 PolarHBondContact O-NH2 3.37Å; Y483-R664 VanDerWaalsContact O-NH2 3.12Å; P484-R664 VanDerWaalsContact CD-CB 3.5Å; P484-R664 HydrophobicContact CG-CB 4.16Å; N660-R664 WeakPolarHBondContact O-CB 3.25Å; N660-R664 VanDerWaalsContact O-CG 3.31Å; N660-R664 WeakPolarHBondContact O-CG 3.33Å; N660-R664 PolarHBondContact O-N 3.34Å; N660-R664 PolarHBondContact O-NE 3.07Å; N660-R664 WeakPolarHBondContact OD1-CD 3.5Å; N660-R664 PolarHBondContact OD1-NE 2.93Å; T661-R664 PolarHBondContact OG1-NH2 3.37Å; T661-R664 VanDerWaalsContact OG1-NH2 3.17Å; Q662-R664 PolarHBondContact O-N 2.8Å; R664-L668 WeakPolarHBondContact O-CB 3.21Å; R664-L668 PolarHBondContact O-N 2.75Å
665	L	91.6	Very high	84.9	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-67.3	-48.2	176.5	176.7	62.2	0	0	0	111.5	Y483 P484 F631 T661 Q662 E663 T667 L668 W669 W692 F717	Y483-L665 HydrophobicContact CE1-CB 4.1Å; Y483-L665 HydrophobicContact CE1-CD1 3.88Å; Y483-L665 HydrophobicContact CE1-CD2 3.96Å; Y483-L665 HydrophobicContact CE1-CG 4.17Å; Y483-L665 WeakPolarHBondContact OH-CD1 3.32Å; P484-L665 HydrophobicContact CB-CD1 4.44Å; F631-L665 HydrophobicContact CD2-CD2 3.98Å; T661-L665 PolarHBondContact O-N 3.48Å; Q662-L665 PolarHBondContact O-N 3.34Å; E663-L665 VanDerWaalsContact C-N 3.33Å; E663-L665 PolarHBondContact O-N 2.85Å; L665-T667 VanDerWaalsContact C-N 3.33Å; L665-T667 PolarHBondContact O-N 3.16Å; L665-L668 WeakPolarHBondContact O-CB 3.22Å; L665-L668 PolarHBondContact O-N 2.92Å; L665-W669 HydrophobicContact CD1-CZ2 3.88Å; L665-W669 HydrophobicContact CD2-CH2 3.86Å; L665-W669 HydrophobicContact CD2-CZ2 3.71Å; L665-W669 HydrophobicContact CG-CD2 4.45Å; L665-W669 HydrophobicContact CG-CH2 4.12Å; L665-W669 HydrophobicContact CG-CZ2 3.77Å; L665-W669 PolarHBondContact O-N 3.33Å; L665-W692 HydrophobicContact CD1-CH2 4.43Å; L665-F717 HydrophobicContact CD2-CD1 4.32Å; L665-F717 HydrophobicContact CD2-CE1 3.84Å; L665-F717 HydrophobicContact CD2-CZ 3.94Å
666	V	90	Very high	83.6	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60.1	-48.5	177.8	174	0	0	0	0	109.4	Q662 E663 L668 W669 F670 P720 L811 Y814 L815	Q662-V666 WeakPolarHBondContact O-CG2 3.49Å; Q662-V666 PolarHBondContact O-N 3.42Å; E663-V666 PolarHBondContact O-N 3.19Å; V666-L668 VanDerWaalsContact C-N 3.29Å; V666-L668 PolarHBondContact O-N 2.87Å; V666-W669 WeakPolarHBondContact O-CB 3.47Å; V666-W669 PolarHBondContact O-N 3.42Å; V666-W669 VanDerWaalsContact O-N 3.08Å; V666-F670 HydrophobicContact CG1-CD2 3.71Å; V666-F670 HydrophobicContact CG1-CE2 3.68Å; V666-F670 VanDerWaalsContact O-CD2 3.25Å; V666-F670 WeakPolarHBondContact O-CD2 3.27Å; V666-F670 PolarHBondContact O-N 3.44Å; V666-F670 VanDerWaalsContact O-N 3.1Å; V666-P720 HydrophobicContact CG1-CB 4.11Å; V666-P720 HydrophobicContact CG2-CB 3.89Å; V666-P720 HydrophobicContact CG2-CG 4Å; V666-L811 HydrophobicContact CG1-CD1 3.99Å; V666-Y814 HydrophobicContact CB-CG 4.31Å; V666-Y814 HydrophobicContact CG1-CG 4.32Å; V666-Y814 HydrophobicContact CG2-CD1 4.28Å; V666-Y814 HydrophobicContact CG2-CD2 4.25Å; V666-Y814 HydrophobicContact CG2-CG 4.02Å; V666-L815 HydrophobicContact CG1-CD1 4.4Å; V666-L815 HydrophobicContact CG1-CD2 4.3Å; V666-L815 HydrophobicContact CG1-CG 4.14Å
667	T	87	Confident	82.1	Confident	39 Å²	39	41.4 Å²	41.4	24%	0.239	22%	0.224	C	C	.	.	H	α-helix	trans	-56.3	-40.4	175.9	-61.7	0	0	0	0	112.3	E663 L665 W669 F670 N671	E663-T667 WeakPolarHBondContact O-CB 3.38Å; E663-T667 PolarHBondContact O-N 2.96Å; E663-T667 PolarHBondContact O-OG1 2.94Å; L665-T667 VanDerWaalsContact C-N 3.33Å; L665-T667 PolarHBondContact O-N 3.16Å; T667-W669 PolarHBondContact O-N 3.13Å; T667-F670 PolarHBondContact O-N 3.29Å; T667-N671 WeakPolarHBondContact CG2-ND2 3.48Å; T667-N671 VanDerWaalsContact O-CB 3.23Å; T667-N671 WeakPolarHBondContact O-CB 3.22Å; T667-N671 PolarHBondContact O-N 3.45Å; T667-N671 PolarHBondContact O-ND2 3.19Å
668	L	87.9	Confident	80.2	Confident	18 Å²	18	46 Å²	46	9%	0.094	25%	0.254	C	S	.	.	H	α-helix	trans	-57.5	-49.6	174.7	174.9	68.6	0	0	0	111.4	P484 Q486 R664 L665 V666 N671 Q672	P484-L668 HydrophobicContact CB-CD2 3.76Å; P484-L668 HydrophobicContact CG-CB 4.2Å; P484-L668 HydrophobicContact CG-CD2 4.12Å; Q486-L668 HydrophobicContact CG-CD1 4.2Å; R664-L668 WeakPolarHBondContact O-CB 3.21Å; R664-L668 PolarHBondContact O-N 2.75Å; L665-L668 WeakPolarHBondContact O-CB 3.22Å; L665-L668 PolarHBondContact O-N 2.92Å; V666-L668 VanDerWaalsContact C-N 3.29Å; V666-L668 PolarHBondContact O-N 2.87Å; L668-N671 PolarHBondContact O-N 2.61Å; L668-Q672 HydrophobicContact CD1-CG 4.45Å; L668-Q672 VanDerWaalsContact O-CG 3.3Å; L668-Q672 WeakPolarHBondContact O-CG 3.46Å; L668-Q672 PolarHBondContact O-N 3.06Å
669	W	87.4	Confident	78.3	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-60.4	-48.2	-179.5	-66.5	-26.7	0	0	0	111.8	F631 L665 V666 T667 N671 Q672 L673 W692 F696 F717 P720 V721 F724	F631-W669 AromaticContact CD2-CH2 3.95Å; F631-W669 HydrophobicContact CD2-CH2 3.95Å; F631-W669 AromaticContact CD2-CZ2 3.74Å; F631-W669 HydrophobicContact CD2-CZ2 3.74Å; F631-W669 AromaticContact CE2-CH2 3.48Å; F631-W669 HydrophobicContact CE2-CH2 3.48Å; F631-W669 VanDerWaalsContact CE2-CH2 3.48Å; F631-W669 AromaticContact CE2-CZ2 3.73Å; F631-W669 HydrophobicContact CE2-CZ2 3.73Å; F631-W669 HydrophobicContact CG-CZ2 4.17Å; F631-W669 AromaticContact CZ-CH2 3.9Å; F631-W669 HydrophobicContact CZ-CH2 3.9Å; F631-W669 HydrophobicContact CZ-CZ2 4.13Å; L665-W669 HydrophobicContact CD1-CZ2 3.88Å; L665-W669 HydrophobicContact CD2-CH2 3.86Å; L665-W669 HydrophobicContact CD2-CZ2 3.71Å; L665-W669 HydrophobicContact CG-CD2 4.45Å; L665-W669 HydrophobicContact CG-CH2 4.12Å; L665-W669 HydrophobicContact CG-CZ2 3.77Å; L665-W669 PolarHBondContact O-N 3.33Å; V666-W669 WeakPolarHBondContact O-CB 3.47Å; V666-W669 PolarHBondContact O-N 3.42Å; V666-W669 VanDerWaalsContact O-N 3.08Å; T667-W669 PolarHBondContact O-N 3.13Å; W669-N671 PolarHBondContact O-N 3.48Å; W669-Q672 WeakPolarHBondContact O-CB 3.45Å; W669-Q672 PolarHBondContact O-N 3.45Å; W669-Q672 VanDerWaalsContact O-N 3.11Å; W669-L673 PolarHBondContact O-N 3.06Å; W669-L673 VanDerWaalsContact O-N 3.08Å; W669-W692 AromaticContact CD1-CZ2 3.92Å; W669-W692 AromaticContact CE2-CZ3 3.84Å; W669-W692 HydrophobicContact CZ2-CH2 4.42Å; W669-W692 AromaticContact CZ2-CZ3 3.94Å; W669-W692 HydrophobicContact CZ2-CZ3 3.94Å; W669-W692 AromaticContact NE1-CD2 3.95Å; W669-W692 AromaticContact NE1-CE2 3.85Å; W669-W692 AromaticContact NE1-CE3 3.59Å; W669-W692 AromaticContact NE1-CH2 3.12Å; W669-W692 AromaticContact NE1-CZ2 3.46Å; W669-W692 AromaticContact NE1-CZ3 3.18Å; W669-F696 HydrophobicContact CD2-CE1 4.38Å; W669-F696 HydrophobicContact CD2-CZ 4.19Å; W669-F696 AromaticContact CE2-CE1 3.88Å; W669-F696 AromaticContact CE2-CZ 3.98Å; W669-F696 AromaticContact CH2-CE1 4Å; W669-F696 HydrophobicContact CH2-CE1 4Å; W669-F696 AromaticContact CZ2-CE1 3.68Å; W669-F696 HydrophobicContact CZ2-CE1 3.68Å; W669-F696 HydrophobicContact CZ2-CZ 4.26Å; W669-F696 HydrophobicContact CZ3-CE1 4.45Å; W669-F717 HydrophobicContact CH2-CB 4.35Å; W669-F717 HydrophobicContact CH2-CD1 4.28Å; W669-F717 HydrophobicContact CH2-CG 4.42Å; W669-F717 HydrophobicContact CZ3-CD1 4.42Å; W669-P720 HydrophobicContact CZ3-CB 4.29Å; W669-P720 HydrophobicContact CZ3-CG 4.43Å; W669-V721 HydrophobicContact CH2-CG2 3.96Å; W669-V721 HydrophobicContact CZ3-CG2 3.91Å; W669-F724 HydrophobicContact CB-CD2 3.65Å; W669-F724 HydrophobicContact CB-CE2 3.75Å; W669-F724 HydrophobicContact CG-CD2 4.45Å; W669-F724 HydrophobicContact CG-CE2 4.48Å; W669-F724 WeakPolarHBondContact O-CE2 3.37Å
670	F	84.9	Confident	76.4	Confident	9 Å²	9	43.8 Å²	43.8	4%	0.039	25%	0.252	C	S	.	.	H	α-helix	trans	-70.6	-31	-178.9	-72.7	-80.8	0	0	0	112.9	V666 T667 Q672 L673 S674 P720 I723 F724 L811 L815 L823	V666-F670 HydrophobicContact CG1-CD2 3.71Å; V666-F670 HydrophobicContact CG1-CE2 3.68Å; V666-F670 VanDerWaalsContact O-CD2 3.25Å; V666-F670 WeakPolarHBondContact O-CD2 3.27Å; V666-F670 PolarHBondContact O-N 3.44Å; V666-F670 VanDerWaalsContact O-N 3.1Å; T667-F670 PolarHBondContact O-N 3.29Å; F670-Q672 VanDerWaalsContact C-N 3.3Å; F670-Q672 PolarHBondContact O-N 2.83Å; F670-L673 HydrophobicContact CD1-CD1 4.05Å; F670-L673 HydrophobicContact CE1-CD1 4.29Å; F670-L673 PolarHBondContact O-N 2.81Å; F670-S674 PolarHBondContact O-N 3.22Å; F670-P720 HydrophobicContact CE2-CB 4.43Å; F670-I723 HydrophobicContact CE1-CG2 4.07Å; F670-I723 HydrophobicContact CZ-CB 4.28Å; F670-I723 HydrophobicContact CZ-CG2 3.97Å; F670-F724 HydrophobicContact CZ-CB 4.33Å; F670-L811 HydrophobicContact CE2-CD1 3.9Å; F670-L811 HydrophobicContact CZ-CD1 4.14Å; F670-L811 HydrophobicContact CZ-CD2 4.25Å; F670-L815 HydrophobicContact CB-CD1 4.33Å; F670-L815 HydrophobicContact CD1-CD1 4.27Å; F670-L815 HydrophobicContact CD2-CD1 3.6Å; F670-L815 HydrophobicContact CD2-CD2 4.46Å; F670-L815 HydrophobicContact CD2-CG 4.48Å; F670-L815 HydrophobicContact CE2-CD1 3.94Å; F670-L815 HydrophobicContact CG-CD1 3.79Å; F670-L815 HydrophobicContact CZ-CD1 4.4Å; F670-L823 HydrophobicContact CD1-CD1 3.89Å; F670-L823 HydrophobicContact CE1-CD1 4.03Å
671	N	81	Confident	74.9	Confident	80 Å²	80	40.9 Å²	40.9	43%	0.428	24%	0.242	S	C	.	.	H	α-helix	trans	-65.1	-34	169.3	-74.3	-16.7	0	0	0	112.4	T667 L668 W669 L673 S674 C675	T667-N671 WeakPolarHBondContact CG2-ND2 3.48Å; T667-N671 VanDerWaalsContact O-CB 3.23Å; T667-N671 WeakPolarHBondContact O-CB 3.22Å; T667-N671 PolarHBondContact O-N 3.45Å; T667-N671 PolarHBondContact O-ND2 3.19Å; L668-N671 PolarHBondContact O-N 2.61Å; W669-N671 PolarHBondContact O-N 3.48Å; N671-L673 VanDerWaalsContact C-N 3.35Å; N671-S674 WeakPolarHBondContact CA-OG 3.49Å; N671-S674 PolarHBondContact O-N 3.14Å; N671-S674 PolarHBondContact O-OG 3.1Å; N671-C675 PolarHBondContact O-N 3.36Å; N671-C675 PolarHBondContact O-SG 3.04Å
672	Q	77.6	Confident	73.7	Confident	29 Å²	29	43.5 Å²	43.5	14%	0.136	26%	0.258	C	S	.	.	H	α-helix	trans	-67.9	-35.8	173.7	-71.8	-178	-19.2	0	0	111.9	L668 W669 F670 E688	L668-Q672 HydrophobicContact CD1-CG 4.45Å; L668-Q672 VanDerWaalsContact O-CG 3.3Å; L668-Q672 WeakPolarHBondContact O-CG 3.46Å; L668-Q672 PolarHBondContact O-N 3.06Å; W669-Q672 WeakPolarHBondContact O-CB 3.45Å; W669-Q672 PolarHBondContact O-N 3.45Å; W669-Q672 VanDerWaalsContact O-N 3.11Å; F670-Q672 VanDerWaalsContact C-N 3.3Å; F670-Q672 PolarHBondContact O-N 2.83Å; Q672-E688 PolarHBondContact NE2-OE1 3.2Å
673	L	73	Confident	72.5	Confident	3 Å²	3	46 Å²	46	2%	0.016	27%	0.274	C	S	.	.	H	α-helix	trans	-69.2	-39.5	173.1	-69.7	177.1	0	0	0	112.6	W669 F670 N671 C675 F676 F724 Q727 L728	W669-L673 PolarHBondContact O-N 3.06Å; W669-L673 VanDerWaalsContact O-N 3.08Å; F670-L673 HydrophobicContact CD1-CD1 4.05Å; F670-L673 HydrophobicContact CE1-CD1 4.29Å; F670-L673 PolarHBondContact O-N 2.81Å; N671-L673 VanDerWaalsContact C-N 3.35Å; L673-C675 VanDerWaalsContact C-N 3.28Å; L673-C675 PolarHBondContact O-N 3.4Å; L673-F676 WeakPolarHBondContact O-CB 3.49Å; L673-F676 PolarHBondContact O-N 3.44Å; L673-F724 HydrophobicContact CD1-CB 4.49Å; L673-F724 HydrophobicContact CD1-CD2 3.31Å; L673-F724 HydrophobicContact CD1-CE2 3.57Å; L673-F724 HydrophobicContact CD1-CG 3.93Å; L673-F724 HydrophobicContact CD1-CZ 4.31Å; L673-F724 HydrophobicContact CD2-CD2 4.26Å; L673-F724 HydrophobicContact CD2-CE1 4.31Å; L673-F724 HydrophobicContact CD2-CE2 3.72Å; L673-F724 HydrophobicContact CD2-CZ 3.73Å; L673-F724 HydrophobicContact CG-CD2 3.7Å; L673-F724 HydrophobicContact CG-CE2 3.36Å; L673-F724 HydrophobicContact CG-CZ 3.93Å; L673-Q727 HydrophobicContact CD1-CB 4.08Å; L673-Q727 VanDerWaalsContact CD1-OE1 3.25Å; L673-L728 HydrophobicContact CD2-CB 4.27Å; L673-L728 HydrophobicContact CD2-CD1 3.9Å
674	S	68.6	Low	71.4	Confident	87 Å²	87	47.2 Å²	47.2	61%	0.608	28%	0.28	S	S	*	.	H	α-helix	trans	-69.7	-26.5	-179.3	66.5	0	0	0	0	113	F670 N671 F676	F670-S674 PolarHBondContact O-N 3.22Å; N671-S674 WeakPolarHBondContact CA-OG 3.49Å; N671-S674 PolarHBondContact O-N 3.14Å; N671-S674 PolarHBondContact O-OG 3.1Å; S674-F676 PolarHBondContact O-N 2.89Å
675	C	61.7	Low	70.6	Confident	54 Å²	54	45 Å²	45	37%	0.365	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-11.7	171.4	-66.7	0	0	0	0	113.2	Y496 N671 L673 G677	Y496-C675 HydrophobicContact CE1-CB 4.38Å; Y496-C675 WeakPolarHBondContact OH-CB 3.11Å; N671-C675 PolarHBondContact O-N 3.36Å; N671-C675 PolarHBondContact O-SG 3.04Å; L673-C675 VanDerWaalsContact C-N 3.28Å; L673-C675 PolarHBondContact O-N 3.4Å; C675-G677 PolarHBondContact O-N 3.47Å
676	F	57.5	Low	69.8	Low	23 Å²	23	45.8 Å²	45.8	10%	0.101	28%	0.275	C	S	.	.			trans	-82.5	114.1	177.8	-173.8	-106.8	0	0	0	110.9	L673 S674 A681 F685 Q731 F732	L673-F676 WeakPolarHBondContact O-CB 3.49Å; L673-F676 PolarHBondContact O-N 3.44Å; S674-F676 PolarHBondContact O-N 2.89Å; F676-A681 HydrophobicContact CE2-CB 3.67Å; F676-A681 HydrophobicContact CZ-CB 4.35Å; F676-F685 HydrophobicContact CB-CE2 4.29Å; F676-F685 HydrophobicContact CB-CZ 3.91Å; F676-F685 AromaticContact CD2-CD1 3.72Å; F676-F685 HydrophobicContact CD2-CD1 3.72Å; F676-F685 AromaticContact CD2-CE1 3.16Å; F676-F685 HydrophobicContact CD2-CE1 3.16Å; F676-F685 HydrophobicContact CD2-CE2 4.15Å; F676-F685 HydrophobicContact CD2-CG 4.4Å; F676-F685 AromaticContact CD2-CZ 3.4Å; F676-F685 HydrophobicContact CD2-CZ 3.4Å; F676-F685 VanDerWaalsContact CD2-CZ 3.4Å; F676-F685 AromaticContact CE2-CD1 3.84Å; F676-F685 HydrophobicContact CE2-CD1 3.84Å; F676-F685 AromaticContact CE2-CE1 3.41Å; F676-F685 HydrophobicContact CE2-CE1 3.41Å; F676-F685 VanDerWaalsContact CE2-CE1 3.41Å; F676-F685 HydrophobicContact CE2-CZ 4.12Å; F676-F685 HydrophobicContact CG-CE1 4.01Å; F676-F685 AromaticContact CG-CZ 3.85Å; F676-F685 HydrophobicContact CG-CZ 3.85Å; F676-F685 HydrophobicContact CZ-CE1 4.41Å; F676-Q731 HydrophobicContact CD1-CB 4.34Å; F676-Q731 VanDerWaalsContact CD1-OE1 3.27Å; F676-Q731 HydrophobicContact CE1-CB 4.17Å; F676-F732 HydrophobicContact CE1-CE1 4.43Å; F676-F732 HydrophobicContact CE2-CE1 4.26Å; F676-F732 HydrophobicContact CZ-CD1 4.25Å; F676-F732 AromaticContact CZ-CE1 3.7Å; F676-F732 HydrophobicContact CZ-CE1 3.7Å; F676-F732 HydrophobicContact CZ-CZ 4.37Å
677	G	54.1	Low	69.1	Low	17 Å²	17	47.1 Å²	47.1	18%	0.175	28%	0.281	C	S	.	.			trans	-120.4	150.3	163	0	0	0	0	0	109.9	C675 S679 N680	C675-G677 PolarHBondContact O-N 3.47Å; G677-S679 PolarHBondContact O-N 3.09Å; G677-N680 PolarHBondContact O-N 2.99Å
678	P	50.8	Low	68.6	Low	99 Å²	99	46.1 Å²	46.1	64%	0.643	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-26.2	-179.2	18.2	-30	0	0	0	113.8
679	S	50.1	Low	68.4	Low	106 Å²	106	45.3 Å²	45.3	74%	0.741	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-14.1	175.9	51.2	0	0	0	0	115.1	G677	G677-S679 PolarHBondContact O-N 3.09Å
680	N	50.7	Low	68.1	Low	71 Å²	71	45.4 Å²	45.4	38%	0.38	27%	0.27	S	S	.	.			trans	-114.2	6.9	-167.7	-70.7	-11.8	0	0	0	114.3	G677 T682	G677-N680 PolarHBondContact O-N 2.99Å; N680-T682 PolarHBondContact O-N 3.35Å
681	A	56.1	Low	68	Low	35 Å²	35	45.8 Å²	45.8	29%	0.289	27%	0.274	S	S	.	.			trans	-69.4	85.9	-175.3	0	0	0	0	0	112.5	F676 Y686	F676-A681 HydrophobicContact CE2-CB 3.67Å; F676-A681 HydrophobicContact CZ-CB 4.35Å; A681-Y686 HydrophobicContact CB-CE2 3.75Å
682	T	65.9	Low	68.3	Low	61 Å²	61	42 Å²	42	37%	0.374	25%	0.254	S	S	.	.			trans	-74.9	156.8	178	67.6	0	0	0	0	111.8	N680 E684 F685 Y686	N680-T682 PolarHBondContact O-N 3.35Å; T682-E684 PolarHBondContact O-N 2.87Å; T682-E684 VanDerWaalsContact O-N 3.09Å; T682-F685 PolarHBondContact O-N 3.38Å; T682-F685 VanDerWaalsContact O-N 3.17Å; T682-F685 PolarHBondContact OG1-N 3.39Å; T682-Y686 WeakPolarHBondContact O-CD2 3.38Å; T682-Y686 PolarHBondContact O-N 3.33Å
683	T	66.6	Low	68.9	Low	66 Å²	66	40.7 Å²	40.7	41%	0.405	25%	0.248	S	C	.	.	H	α-helix	trans	-55.5	-24.8	171.7	40	0	0	0	0	114.2	H687	T683-H687 PolarHBondContact O-N 3Å
684	E	66.8	Low	69.4	Low	123 Å²	123	43.7 Å²	43.7	58%	0.575	26%	0.259	S	S	*	.	H	α-helix	trans	-76.4	-41.7	179.9	-65	-179.3	170.7	0	0	110.9	T682 H687 E688	T682-E684 PolarHBondContact O-N 2.87Å; T682-E684 VanDerWaalsContact O-N 3.09Å; E684-H687 WeakPolarHBondContact O-CB 3.44Å; E684-H687 PolarHBondContact O-N 2.89Å; E684-H687 VanDerWaalsContact O-N 3.15Å; E684-E688 PolarHBondContact O-N 2.94Å
685	F	72.4	Confident	70.4	Confident	24 Å²	24	39.6 Å²	39.6	11%	0.105	23%	0.23	C	C	.	.	H	α-helix	trans	-60	-49.8	174.7	178.6	-95.9	0	0	0	112.2	F676 T682 H687 E688 I689 F732	F676-F685 HydrophobicContact CB-CE2 4.29Å; F676-F685 HydrophobicContact CB-CZ 3.91Å; F676-F685 AromaticContact CD2-CD1 3.72Å; F676-F685 HydrophobicContact CD2-CD1 3.72Å; F676-F685 AromaticContact CD2-CE1 3.16Å; F676-F685 HydrophobicContact CD2-CE1 3.16Å; F676-F685 HydrophobicContact CD2-CE2 4.15Å; F676-F685 HydrophobicContact CD2-CG 4.4Å; F676-F685 AromaticContact CD2-CZ 3.4Å; F676-F685 HydrophobicContact CD2-CZ 3.4Å; F676-F685 VanDerWaalsContact CD2-CZ 3.4Å; F676-F685 AromaticContact CE2-CD1 3.84Å; F676-F685 HydrophobicContact CE2-CD1 3.84Å; F676-F685 AromaticContact CE2-CE1 3.41Å; F676-F685 HydrophobicContact CE2-CE1 3.41Å; F676-F685 VanDerWaalsContact CE2-CE1 3.41Å; F676-F685 HydrophobicContact CE2-CZ 4.12Å; F676-F685 HydrophobicContact CG-CE1 4.01Å; F676-F685 AromaticContact CG-CZ 3.85Å; F676-F685 HydrophobicContact CG-CZ 3.85Å; F676-F685 HydrophobicContact CZ-CE1 4.41Å; T682-F685 PolarHBondContact O-N 3.38Å; T682-F685 VanDerWaalsContact O-N 3.17Å; T682-F685 PolarHBondContact OG1-N 3.39Å; F685-H687 PolarHBondContact O-N 3.4Å; F685-H687 VanDerWaalsContact O-N 3.12Å; F685-E688 PolarHBondContact O-N 3.01Å; F685-I689 HydrophobicContact CD1-CG1 3.98Å; F685-I689 HydrophobicContact CD2-CG1 4.19Å; F685-I689 HydrophobicContact CE1-CD1 4.29Å; F685-I689 HydrophobicContact CE1-CG1 3.51Å; F685-I689 HydrophobicContact CE2-CD1 3.84Å; F685-I689 HydrophobicContact CE2-CG1 3.76Å; F685-I689 HydrophobicContact CG-CG1 4.3Å; F685-I689 HydrophobicContact CZ-CD1 3.67Å; F685-I689 HydrophobicContact CZ-CG1 3.4Å; F685-I689 WeakPolarHBondContact O-CG1 3.27Å; F685-I689 PolarHBondContact O-N 2.95Å; F685-F732 HydrophobicContact CE1-CZ 4.39Å
686	Y	76.1	Confident	71.9	Confident	17 Å²	17	37 Å²	37	7%	0.067	21%	0.213	C	C	.	.	H	α-helix	trans	-54.1	-36.3	175.8	-81.1	-79.8	0	0	0	112.3	A681 T682 S690 F732 R747 E748 L751 L971	A681-Y686 HydrophobicContact CB-CE2 3.75Å; T682-Y686 WeakPolarHBondContact O-CD2 3.38Å; T682-Y686 PolarHBondContact O-N 3.33Å; Y686-S690 WeakPolarHBondContact O-CB 3.16Å; Y686-S690 PolarHBondContact O-N 3.06Å; Y686-F732 AromaticContact CE1-CE1 3.96Å; Y686-F732 HydrophobicContact CE1-CE1 3.96Å; Y686-F732 HydrophobicContact CE1-CZ 4.31Å; Y686-R747 HydrophobicContact CD1-CB 3.77Å; Y686-R747 HydrophobicContact CE1-CB 3.91Å; Y686-R747 HydrophobicContact CG-CB 4.4Å; Y686-E748 HydrophobicContact CE1-CG 4.14Å; Y686-L751 HydrophobicContact CD1-CD1 3.39Å; Y686-L751 HydrophobicContact CD1-CG 4.31Å; Y686-L751 HydrophobicContact CE1-CD1 3.88Å; Y686-L751 HydrophobicContact CG-CD1 4.4Å; Y686-L971 HydrophobicContact CD1-CD1 4.46Å
687	H	74.3	Confident	73.3	Confident	28 Å²	28	36.1 Å²	36.1	13%	0.13	21%	0.209	C	C	.	.	H	α-helix	trans	-72.5	-45.4	177.3	170.1	-85.2	0	0	0	111.9	T683 E684 F685 S690 C691 K972	T683-H687 PolarHBondContact O-N 3Å; E684-H687 WeakPolarHBondContact O-CB 3.44Å; E684-H687 PolarHBondContact O-N 2.89Å; E684-H687 VanDerWaalsContact O-N 3.15Å; F685-H687 PolarHBondContact O-N 3.4Å; F685-H687 VanDerWaalsContact O-N 3.12Å; H687-S690 WeakPolarHBondContact O-CB 3.35Å; H687-S690 PolarHBondContact O-N 3.26Å; H687-C691 PolarHBondContact O-N 3.08Å; H687-C691 PolarHBondContact O-SG 3.23Å; H687-C691 VanDerWaalsContact O-SG 3.34Å; H687-K972 WeakPolarHBondContact CD2-CD 3.12Å; H687-K972 WeakPolarHBondContact CD2-CE 3.47Å; H687-K972 VanDerWaalsContact CD2-CG 3.48Å; H687-K972 WeakPolarHBondContact CD2-CG 3.37Å; H687-K972 VanDerWaalsContact NE2-CD 3.32Å; H687-K972 WeakPolarHBondContact NE2-CD 3.27Å; H687-K972 WeakPolarHBondContact NE2-CE 3.5Å; H687-K972 PolarHBondContact NE2-NZ 2.96Å; H687-K972 VanDerWaalsContact NE2-NZ 3.14Å
688	E	76.8	Confident	74.8	Confident	19 Å²	19	35.3 Å²	35.3	9%	0.089	20%	0.201	C	C	.	.	H	α-helix	trans	-59.4	-50.2	177.5	175.9	171.3	-155.7	0	0	111.9	Q624 Q672 E684 F685 S690 C691 W692	Q624-E688 PolarHBondContact NE2-OE1 2.8Å; Q624-E688 PolarHBondContact NE2-OE2 2.83Å; Q672-E688 PolarHBondContact NE2-OE1 3.2Å; E684-E688 PolarHBondContact O-N 2.94Å; F685-E688 PolarHBondContact O-N 3.01Å; E688-S690 VanDerWaalsContact C-N 3.31Å; E688-S690 PolarHBondContact O-N 2.9Å; E688-C691 WeakPolarHBondContact O-CB 3.42Å; E688-C691 PolarHBondContact O-N 3.21Å; E688-C691 VanDerWaalsContact O-N 3.08Å; E688-W692 PolarHBondContact O-N 3.26Å
689	I	84	Confident	76.8	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-60.2	-44.1	176.1	-64.3	-58.4	0	0	0	110.4	F685 C691 W692 L693 F724 L728 L751	F685-I689 HydrophobicContact CD1-CG1 3.98Å; F685-I689 HydrophobicContact CD2-CG1 4.19Å; F685-I689 HydrophobicContact CE1-CD1 4.29Å; F685-I689 HydrophobicContact CE1-CG1 3.51Å; F685-I689 HydrophobicContact CE2-CD1 3.84Å; F685-I689 HydrophobicContact CE2-CG1 3.76Å; F685-I689 HydrophobicContact CG-CG1 4.3Å; F685-I689 HydrophobicContact CZ-CD1 3.67Å; F685-I689 HydrophobicContact CZ-CG1 3.4Å; F685-I689 WeakPolarHBondContact O-CG1 3.27Å; F685-I689 PolarHBondContact O-N 2.95Å; I689-C691 PolarHBondContact O-N 3.36Å; I689-W692 PolarHBondContact O-N 3.42Å; I689-W692 VanDerWaalsContact O-N 3.12Å; I689-L693 HydrophobicContact CG2-CD1 4.23Å; I689-L693 HydrophobicContact CG2-CG 4.21Å; I689-L693 VanDerWaalsContact O-CG 3.32Å; I689-L693 WeakPolarHBondContact O-CG 3.31Å; I689-L693 PolarHBondContact O-N 2.97Å; I689-F724 HydrophobicContact CD1-CZ 4.1Å; I689-L728 HydrophobicContact CD1-CD1 4.46Å; I689-L728 HydrophobicContact CG2-CD1 4.06Å; I689-L728 HydrophobicContact CG2-CD2 3.35Å; I689-L728 HydrophobicContact CG2-CG 4.3Å; I689-L751 HydrophobicContact CB-CD1 4.37Å; I689-L751 HydrophobicContact CG2-CD1 4.04Å; I689-L751 HydrophobicContact CG2-CD2 4.06Å
690	S	81.7	Confident	78.8	Confident	2 Å²	2	26 Å²	26	1%	0.014	14%	0.137	C	C	.	.	H	α-helix	trans	-59.2	-32	176.6	-177.6	0	0	0	0	113	Y686 H687 E688 R694 F750 P970 L971	Y686-S690 WeakPolarHBondContact O-CB 3.16Å; Y686-S690 PolarHBondContact O-N 3.06Å; H687-S690 WeakPolarHBondContact O-CB 3.35Å; H687-S690 PolarHBondContact O-N 3.26Å; E688-S690 VanDerWaalsContact C-N 3.31Å; E688-S690 PolarHBondContact O-N 2.9Å; S690-R694 PolarHBondContact O-N 3.22Å; S690-F750 WeakPolarHBondContact OG-CE1 3.28Å; S690-P970 WeakPolarHBondContact OG-CA 3.48Å; S690-L971 PolarHBondContact OG-N 2.9Å
691	C	82.2	Confident	80.6	Confident	17 Å²	17	22.7 Å²	22.7	12%	0.115	12%	0.119	C	C	.	.	H	α-helix	trans	-75.1	-42.6	173.8	-69.4	0	0	0	0	111.9	Q628 H687 E688 I689 L693 R694 S695	Q628-C691 VanDerWaalsContact NE2-CB 3.32Å; H687-C691 PolarHBondContact O-N 3.08Å; H687-C691 PolarHBondContact O-SG 3.23Å; H687-C691 VanDerWaalsContact O-SG 3.34Å; E688-C691 WeakPolarHBondContact O-CB 3.42Å; E688-C691 PolarHBondContact O-N 3.21Å; E688-C691 VanDerWaalsContact O-N 3.08Å; I689-C691 PolarHBondContact O-N 3.36Å; C691-L693 VanDerWaalsContact C-N 3.33Å; C691-L693 PolarHBondContact O-N 3Å; C691-R694 WeakPolarHBondContact O-CB 3.41Å; C691-R694 PolarHBondContact O-N 3.41Å; C691-R694 VanDerWaalsContact O-N 3.08Å; C691-S695 PolarHBondContact O-N 2.93Å; C691-S695 PolarHBondContact O-OG 3.31Å
692	W	88.4	Confident	82	Confident	2 Å²	2	21 Å²	21	1%	0.008	11%	0.106	C	C	.	.	H	α-helix	trans	-60.7	-40.9	173.9	-84	119.2	0	0	0	112.5	N627 Q628 F631 L665 W669 E688 I689 R694 S695 F696	N627-W692 HydrophobicContact CB-CH2 4.42Å; N627-W692 HydrophobicContact CB-CZ2 4.3Å; Q628-W692 HydrophobicContact CG-CD2 3.96Å; Q628-W692 HydrophobicContact CG-CE3 4.2Å; Q628-W692 HydrophobicContact CG-CH2 4.19Å; Q628-W692 HydrophobicContact CG-CZ2 3.99Å; Q628-W692 HydrophobicContact CG-CZ3 4.3Å; F631-W692 HydrophobicContact CB-CH2 4.48Å; F631-W692 HydrophobicContact CB-CZ3 4.03Å; F631-W692 HydrophobicContact CD1-CZ3 4.16Å; F631-W692 HydrophobicContact CG-CZ3 4.14Å; L665-W692 HydrophobicContact CD1-CH2 4.43Å; W669-W692 AromaticContact CD1-CZ2 3.92Å; W669-W692 AromaticContact CE2-CZ3 3.84Å; W669-W692 HydrophobicContact CZ2-CH2 4.42Å; W669-W692 AromaticContact CZ2-CZ3 3.94Å; W669-W692 HydrophobicContact CZ2-CZ3 3.94Å; W669-W692 AromaticContact NE1-CD2 3.95Å; W669-W692 AromaticContact NE1-CE2 3.85Å; W669-W692 AromaticContact NE1-CE3 3.59Å; W669-W692 AromaticContact NE1-CH2 3.12Å; W669-W692 AromaticContact NE1-CZ2 3.46Å; W669-W692 AromaticContact NE1-CZ3 3.18Å; E688-W692 PolarHBondContact O-N 3.26Å; I689-W692 PolarHBondContact O-N 3.42Å; I689-W692 VanDerWaalsContact O-N 3.12Å; W692-R694 PolarHBondContact O-N 3.45Å; W692-S695 CarbonylContact O-C 3.6Å; W692-S695 WeakPolarHBondContact O-CA 3.42Å; W692-S695 PolarHBondContact O-N 2.88Å; W692-F696 HydrophobicContact CB-CD2 4.43Å; W692-F696 HydrophobicContact CB-CE2 3.91Å; W692-F696 HydrophobicContact CB-CZ 4.26Å; W692-F696 HydrophobicContact CD2-CZ 4.38Å; W692-F696 AromaticContact CE3-CE1 3.93Å; W692-F696 HydrophobicContact CE3-CE1 3.93Å; W692-F696 AromaticContact CE3-CZ 3.91Å; W692-F696 HydrophobicContact CE3-CZ 3.91Å; W692-F696 HydrophobicContact CZ3-CE1 4.43Å; W692-F696 WeakPolarHBondContact O-CD2 3.46Å; W692-F696 VanDerWaalsContact O-CG 3.3Å; W692-F696 WeakPolarHBondContact O-CG 3.44Å; W692-F696 PolarHBondContact O-N 3.42Å
693	L	88.9	Confident	82.8	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-59.7	-28.9	174	-71.2	-179.5	0	0	0	113.1	I689 C691 F696 D697 L725 L728 L751 R754	I689-L693 HydrophobicContact CG2-CD1 4.23Å; I689-L693 HydrophobicContact CG2-CG 4.21Å; I689-L693 VanDerWaalsContact O-CG 3.32Å; I689-L693 WeakPolarHBondContact O-CG 3.31Å; I689-L693 PolarHBondContact O-N 2.97Å; C691-L693 VanDerWaalsContact C-N 3.33Å; C691-L693 PolarHBondContact O-N 3Å; L693-F696 HydrophobicContact CD2-CD2 4.44Å; L693-D697 WeakPolarHBondContact O-CB 3.43Å; L693-D697 PolarHBondContact O-N 2.86Å; L693-L725 HydrophobicContact CD2-CD2 3.22Å; L693-L728 HydrophobicContact CD2-CD2 4.11Å; L693-L751 HydrophobicContact CD1-CB 4.42Å; L693-L751 HydrophobicContact CD1-CD2 3.5Å; L693-R754 HydrophobicContact CD1-CB 3.82Å; L693-R754 HydrophobicContact CD1-CG 4.43Å; L693-R754 PolarHBondContact O-NH2 3.27Å
694	R	84.7	Confident	83.3	Confident	66 Å²	66	16.4 Å²	16.4	25%	0.249	8%	0.075	C	C	.	.	H	α-helix	trans	-72	-40.9	172.6	174.7	-174	171.8	150.6	5.4	110.9	S690 C691 W692 D697 L698	S690-R694 PolarHBondContact O-N 3.22Å; C691-R694 WeakPolarHBondContact O-CB 3.41Å; C691-R694 PolarHBondContact O-N 3.41Å; C691-R694 VanDerWaalsContact O-N 3.08Å; W692-R694 PolarHBondContact O-N 3.45Å; R694-D697 WeakPolarHBondContact O-CB 3.39Å; R694-D697 PolarHBondContact O-N 2.96Å; R694-L698 PolarHBondContact O-N 3.48Å
695	S	88.1	Confident	83.6	Confident	2 Å²	2	12.1 Å²	12.1	1%	0.014	5%	0.053	C	C	.	.	H	α-helix	trans	-68.9	-37.7	176.9	-51.4	0	0	0	0	112	C691 W692 L698 Y699	C691-S695 PolarHBondContact O-N 2.93Å; C691-S695 PolarHBondContact O-OG 3.31Å; W692-S695 CarbonylContact O-C 3.6Å; W692-S695 WeakPolarHBondContact O-CA 3.42Å; W692-S695 PolarHBondContact O-N 2.88Å; S695-L698 WeakPolarHBondContact O-CB 3.3Å; S695-L698 PolarHBondContact O-N 3.49Å; S695-Y699 PolarHBondContact O-N 2.84Å
696	F	93.5	Very high	83.5	Confident	0 Å²	0	12.9 Å²	12.9	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-68.6	-37.9	173.8	-61.3	-32.5	0	0	0	112.6	F631 W669 W692 L693 Y699 L700 V721 F724 L725	F631-F696 AromaticContact CE1-CD1 3.74Å; F631-F696 HydrophobicContact CE1-CD1 3.74Å; F631-F696 HydrophobicContact CE1-CE1 4.07Å; F631-F696 HydrophobicContact CZ-CD1 4.15Å; F631-F696 HydrophobicContact CZ-CE1 4.32Å; W669-F696 HydrophobicContact CD2-CE1 4.38Å; W669-F696 HydrophobicContact CD2-CZ 4.19Å; W669-F696 AromaticContact CE2-CE1 3.88Å; W669-F696 AromaticContact CE2-CZ 3.98Å; W669-F696 AromaticContact CH2-CE1 4Å; W669-F696 HydrophobicContact CH2-CE1 4Å; W669-F696 AromaticContact CZ2-CE1 3.68Å; W669-F696 HydrophobicContact CZ2-CE1 3.68Å; W669-F696 HydrophobicContact CZ2-CZ 4.26Å; W669-F696 HydrophobicContact CZ3-CE1 4.45Å; W692-F696 HydrophobicContact CB-CD2 4.43Å; W692-F696 HydrophobicContact CB-CE2 3.91Å; W692-F696 HydrophobicContact CB-CZ 4.26Å; W692-F696 HydrophobicContact CD2-CZ 4.38Å; W692-F696 AromaticContact CE3-CE1 3.93Å; W692-F696 HydrophobicContact CE3-CE1 3.93Å; W692-F696 AromaticContact CE3-CZ 3.91Å; W692-F696 HydrophobicContact CE3-CZ 3.91Å; W692-F696 HydrophobicContact CZ3-CE1 4.43Å; W692-F696 WeakPolarHBondContact O-CD2 3.46Å; W692-F696 VanDerWaalsContact O-CG 3.3Å; W692-F696 WeakPolarHBondContact O-CG 3.44Å; W692-F696 PolarHBondContact O-N 3.42Å; L693-F696 HydrophobicContact CD2-CD2 4.44Å; F696-Y699 PolarHBondContact O-N 2.91Å; F696-L700 VanDerWaalsContact O-CB 3.32Å; F696-L700 WeakPolarHBondContact O-CB 3.42Å; F696-L700 WeakPolarHBondContact O-CG 3.33Å; F696-L700 PolarHBondContact O-N 2.83Å; F696-V721 HydrophobicContact CB-CG1 3.81Å; F696-V721 HydrophobicContact CD1-CB 4.32Å; F696-V721 HydrophobicContact CD1-CG1 3.74Å; F696-V721 HydrophobicContact CD1-CG2 3.59Å; F696-V721 HydrophobicContact CD2-CG1 4.34Å; F696-V721 HydrophobicContact CE1-CG1 4.41Å; F696-V721 HydrophobicContact CE1-CG2 3.7Å; F696-V721 HydrophobicContact CG-CG1 3.71Å; F696-V721 HydrophobicContact CG-CG2 4.4Å; F696-F724 HydrophobicContact CD2-CD1 4.34Å; F696-F724 AromaticContact CE2-CD1 3.51Å; F696-F724 HydrophobicContact CE2-CD1 3.51Å; F696-F724 AromaticContact CE2-CE1 3.56Å; F696-F724 HydrophobicContact CE2-CE1 3.56Å; F696-F724 HydrophobicContact CE2-CG 4.28Å; F696-F724 HydrophobicContact CE2-CZ 4.31Å; F696-F724 HydrophobicContact CZ-CD1 4.14Å; F696-F724 HydrophobicContact CZ-CE1 4.3Å; F696-L725 HydrophobicContact CD2-CD2 4.05Å
697	D	88.2	Confident	83.4	Confident	3 Å²	3	21.3 Å²	21.3	2%	0.016	9%	0.093	C	C	.	.	H	α-helix	trans	-58.2	-48.7	170.2	173.4	176.1	0	0	0	111.2	L693 R694 Y699 L701 R705 R754 L758 Y962	L693-D697 WeakPolarHBondContact O-CB 3.43Å; L693-D697 PolarHBondContact O-N 2.86Å; R694-D697 WeakPolarHBondContact O-CB 3.39Å; R694-D697 PolarHBondContact O-N 2.96Å; D697-Y699 PolarHBondContact O-N 3.49Å; D697-L701 VanDerWaalsContact O-CB 3.22Å; D697-L701 WeakPolarHBondContact O-CB 3.23Å; D697-L701 WeakPolarHBondContact O-CG 3.38Å; D697-L701 PolarHBondContact O-N 3.3Å; D697-L701 WeakPolarHBondContact OD2-CD1 3.26Å; D697-R705 IonicContact OD1-NH2 3.7Å; D697-R705 IonicContact OD2-CZ 2.71Å; D697-R705 IonicContact OD2-NH1 3.95Å; D697-R705 PolarHBondContact OD2-NH1 3.39Å; D697-R705 IonicContact OD2-NH2 3.67Å; D697-R705 PolarHBondContact OD2-NH2 3.21Å; D697-R754 VanDerWaalsContact CB-NH2 3.26Å; D697-R754 IonicContact OD1-CZ 3.83Å; D697-R754 IonicContact OD1-NH1 3.81Å; D697-R754 PolarHBondContact OD1-NH1 3.04Å; D697-R754 IonicContact OD1-NH2 3.26Å; D697-R754 PolarHBondContact OD1-NH2 3.23Å; D697-L758 HydrophobicContact CB-CD1 4.29Å; D697-L758 HydrophobicContact CB-CD2 4.09Å; D697-Y962 VanDerWaalsContact CG-OH 3.25Å; D697-Y962 WeakPolarHBondContact OD1-CE2 3.48Å; D697-Y962 PolarHBondContact OD1-OH 3.46Å
698	L	85.4	Confident	83.5	Confident	1 Å²	1	21 Å²	21	1%	0.005	9%	0.091	C	C	.	.	H	α-helix	trans	-56.1	-49.9	172.9	173.7	56.2	0	0	0	111.6	W296 E632 T635 Y636 R694 S695 S702	W296-L698 HydrophobicContact CH2-CD1 3.8Å; W296-L698 HydrophobicContact CZ2-CD1 3.57Å; E632-L698 HydrophobicContact CB-CD2 3.81Å; E632-L698 HydrophobicContact CG-CD2 3.88Å; T635-L698 HydrophobicContact CG2-CG 4.27Å; Y636-L698 HydrophobicContact CE2-CD2 3.99Å; R694-L698 PolarHBondContact O-N 3.48Å; S695-L698 WeakPolarHBondContact O-CB 3.3Å; S695-L698 PolarHBondContact O-N 3.49Å; L698-S702 VanDerWaalsContact O-CB 3.28Å; L698-S702 WeakPolarHBondContact O-CB 3.47Å; L698-S702 PolarHBondContact O-N 3.29Å
699	Y	92.6	Very high	83.6	Confident	0 Å²	0	27 Å²	27	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-63.5	-53.3	-177.4	-173.1	-102.6	0	0	0	111.7	F631 T635 E638 S695 F696 D697 S702 R715 L716 F717 V718	F631-Y699 HydrophobicContact CE1-CD2 4.44Å; F631-Y699 HydrophobicContact CE1-CG 4.09Å; F631-Y699 HydrophobicContact CE2-CD2 4.38Å; F631-Y699 HydrophobicContact CZ-CD1 4.05Å; F631-Y699 AromaticContact CZ-CD2 3.88Å; F631-Y699 HydrophobicContact CZ-CD2 3.88Å; F631-Y699 AromaticContact CZ-CG 3.62Å; F631-Y699 HydrophobicContact CZ-CG 3.62Å; T635-Y699 HydrophobicContact CG2-CD2 4.02Å; T635-Y699 WeakPolarHBondContact OG1-CD2 3.47Å; E638-Y699 PolarHBondContact OE1-OH 3Å; E638-Y699 WeakPolarHBondContact OE2-CE2 3.44Å; E638-Y699 PolarHBondContact OE2-OH 3.01Å; S695-Y699 PolarHBondContact O-N 2.84Å; F696-Y699 PolarHBondContact O-N 2.91Å; D697-Y699 PolarHBondContact O-N 3.49Å; Y699-S702 PolarHBondContact O-OG 3.23Å; Y699-S702 VanDerWaalsContact O-OG 3.05Å; Y699-R715 PolarHBondContact O-NH1 3.29Å; Y699-R715 PolarHBondContact O-NH2 3.18Å; Y699-L716 PolarHBondContact OH-N 2.88Å; Y699-F717 HydrophobicContact CE1-CB 3.79Å; Y699-F717 HydrophobicContact CE2-CD2 4.48Å; Y699-F717 PolarHBondContact OH-N 3.48Å; Y699-V718 HydrophobicContact CD1-CG2 4.5Å; Y699-V718 HydrophobicContact CE1-CG2 3.73Å
700	L	92.4	Very high	83.5	Confident	9 Å²	9	27.4 Å²	27.4	5%	0.047	13%	0.126	C	C	.	.	H	α-helix	trans	-68.3	-36.1	-176.6	-67	176.2	0	0	0	113	F696 P703 V718 V721 L725 L758 V762	F696-L700 VanDerWaalsContact O-CB 3.32Å; F696-L700 WeakPolarHBondContact O-CB 3.42Å; F696-L700 WeakPolarHBondContact O-CG 3.33Å; F696-L700 PolarHBondContact O-N 2.83Å; L700-P703 VanDerWaalsContact O-CD 3.23Å; L700-P703 WeakPolarHBondContact O-CD 3.45Å; L700-V718 HydrophobicContact CD2-CG2 4.31Å; L700-V721 HydrophobicContact CD1-CG1 3.89Å; L700-V721 HydrophobicContact CD2-CG1 4.13Å; L700-V721 HydrophobicContact CG-CG1 4.01Å; L700-L725 HydrophobicContact CD1-CD1 3.66Å; L700-L758 HydrophobicContact CD1-CB 4.33Å; L700-V762 HydrophobicContact CB-CG2 4.42Å; L700-V762 HydrophobicContact CD1-CG2 4.06Å; L700-V762 HydrophobicContact CD2-CG2 4.16Å; L700-V762 HydrophobicContact CG-CG2 4.45Å
701	L	87.8	Confident	83.5	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-94.4	-4.2	-175.8	-53.9	-171.8	0	0	0	114.4	D697 P703 Y704 R705 L758 T761 P955 G960 Y962	D697-L701 VanDerWaalsContact O-CB 3.22Å; D697-L701 WeakPolarHBondContact O-CB 3.23Å; D697-L701 WeakPolarHBondContact O-CG 3.38Å; D697-L701 PolarHBondContact O-N 3.3Å; D697-L701 WeakPolarHBondContact OD2-CD1 3.26Å; L701-P703 VanDerWaalsContact C-N 3.25Å; L701-Y704 HydrophobicContact CB-CD2 4.44Å; L701-Y704 HydrophobicContact CD2-CD2 3.85Å; L701-Y704 HydrophobicContact CD2-CE2 3.92Å; L701-Y704 PolarHBondContact O-N 2.84Å; L701-Y704 VanDerWaalsContact O-N 3.17Å; L701-R705 WeakPolarHBondContact O-CG 3.19Å; L701-R705 PolarHBondContact O-N 3.23Å; L701-L758 HydrophobicContact CD1-CD2 4.15Å; L701-L758 HydrophobicContact CD2-CD2 4.44Å; L701-L758 HydrophobicContact CG-CD2 4.18Å; L701-T761 HydrophobicContact CD2-CG2 3.74Å; L701-P955 HydrophobicContact CD1-CB 3.54Å; L701-P955 HydrophobicContact CD1-CG 3.53Å; L701-P955 HydrophobicContact CD2-CG 4.38Å; L701-G960 WeakPolarHBondContact CD1-O 3.45Å; L701-Y962 HydrophobicContact CD1-CE2 4.45Å
702	S	84.7	Confident	83.6	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-51.9	-38.8	174.5	68.8	0	0	0	0	113	L698 Y699 Y704 R705 F706 R715	L698-S702 VanDerWaalsContact O-CB 3.28Å; L698-S702 WeakPolarHBondContact O-CB 3.47Å; L698-S702 PolarHBondContact O-N 3.29Å; Y699-S702 PolarHBondContact O-OG 3.23Å; Y699-S702 VanDerWaalsContact O-OG 3.05Å; S702-Y704 VanDerWaalsContact C-N 3.33Å; S702-Y704 PolarHBondContact O-N 3.35Å; S702-R705 PolarHBondContact O-N 2.95Å; S702-F706 WeakPolarHBondContact O-CB 3.37Å; S702-F706 WeakPolarHBondContact O-CD2 3.46Å; S702-F706 PolarHBondContact O-N 3.14Å; S702-R715 PolarHBondContact OG-NH2 3.25Å
703	P	83.9	Confident	83.3	Confident	4 Å²	4	31.4 Å²	31.4	3%	0.026	15%	0.149	C	C	.	.	H	α-helix	trans	-66	-37	-178.7	-23.1	37.8	0	0	0	113.2	L700 L701 K707 W708 V710 R765	L700-P703 VanDerWaalsContact O-CD 3.23Å; L700-P703 WeakPolarHBondContact O-CD 3.45Å; L701-P703 VanDerWaalsContact C-N 3.25Å; P703-K707 CarbonylContact O-C 3.35Å; P703-K707 WeakPolarHBondContact O-CA 3.33Å; P703-K707 PolarHBondContact O-N 3.25Å; P703-K707 VanDerWaalsContact O-N 3.09Å; P703-W708 HydrophobicContact CG-CE3 4.35Å; P703-W708 PolarHBondContact O-N 3.45Å; P703-V710 HydrophobicContact CB-CG1 4.09Å; P703-V710 HydrophobicContact CG-CG1 3.99Å; P703-R765 VanDerWaalsContact CB-NH1 3.26Å
704	Y	77.3	Confident	83	Confident	27 Å²	27	34.9 Å²	34.9	11%	0.106	17%	0.171	C	C	.	.	H	α-helix	trans	-68.5	-46.2	174.1	-60.3	-74.6	0	0	0	111.9	L701 S702 F706 K707 T761 R765 I957	L701-Y704 HydrophobicContact CB-CD2 4.44Å; L701-Y704 HydrophobicContact CD2-CD2 3.85Å; L701-Y704 HydrophobicContact CD2-CE2 3.92Å; L701-Y704 PolarHBondContact O-N 2.84Å; L701-Y704 VanDerWaalsContact O-N 3.17Å; S702-Y704 VanDerWaalsContact C-N 3.33Å; S702-Y704 PolarHBondContact O-N 3.35Å; Y704-F706 PolarHBondContact O-N 3.43Å; Y704-K707 PolarHBondContact O-N 3.41Å; Y704-T761 HydrophobicContact CE2-CG2 3.81Å; Y704-T761 PolarHBondContact OH-O 3.01Å; Y704-T761 VanDerWaalsContact OH-O 3.14Å; Y704-R765 HydrophobicContact CE1-CG 4.36Å; Y704-R765 WeakPolarHBondContact OH-CB 3.38Å; Y704-R765 VanDerWaalsContact OH-CD 3.25Å; Y704-R765 WeakPolarHBondContact OH-CD 3.23Å; Y704-I957 WeakPolarHBondContact CD1-O 3.41Å; Y704-I957 HydrophobicContact CE1-CG2 3.72Å; Y704-I957 WeakPolarHBondContact CE1-O 3.41Å
705	R	73.2	Confident	83.3	Confident	32 Å²	32	32 Å²	32	12%	0.121	16%	0.16	C	C	.	.	H	α-helix	trans	-68.7	-34	-175	-70.6	177.7	-179.5	158	7	113.1	W296 D697 L701 S702 D959 G960	W296-R705 VanDerWaalsContact CH2-NH1 3.3Å; D697-R705 IonicContact OD1-NH2 3.7Å; D697-R705 IonicContact OD2-CZ 2.71Å; D697-R705 IonicContact OD2-NH1 3.95Å; D697-R705 PolarHBondContact OD2-NH1 3.39Å; D697-R705 IonicContact OD2-NH2 3.67Å; D697-R705 PolarHBondContact OD2-NH2 3.21Å; L701-R705 WeakPolarHBondContact O-CG 3.19Å; L701-R705 PolarHBondContact O-N 3.23Å; S702-R705 PolarHBondContact O-N 2.95Å; R705-D959 WeakPolarHBondContact CG-O 3.3Å; R705-G960 PolarHBondContact NE-O 3.26Å; R705-G960 VanDerWaalsContact NE-O 3.14Å; R705-G960 PolarHBondContact NH2-O 2.91Å
706	F	69.8	Low	83.4	Confident	40 Å²	40	33.8 Å²	33.8	18%	0.175	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	3.6	178.4	-57.8	-58.8	0	0	0	113.5	P295 Y636 Y639 S702 Y704 W708	P295-F706 HydrophobicContact CG-CE1 4.43Å; Y636-F706 HydrophobicContact CD1-CZ 4.35Å; Y636-F706 HydrophobicContact CE1-CE1 4.31Å; Y636-F706 AromaticContact CE1-CE2 3.93Å; Y636-F706 HydrophobicContact CE1-CE2 3.93Å; Y636-F706 AromaticContact CE1-CZ 3.45Å; Y636-F706 HydrophobicContact CE1-CZ 3.45Å; Y636-F706 VanDerWaalsContact CE1-CZ 3.45Å; Y639-F706 HydrophobicContact CE2-CB 4.05Å; S702-F706 WeakPolarHBondContact O-CB 3.37Å; S702-F706 WeakPolarHBondContact O-CD2 3.46Å; S702-F706 PolarHBondContact O-N 3.14Å; Y704-F706 PolarHBondContact O-N 3.43Å; F706-W708 HydrophobicContact CB-CB 4.38Å; F706-W708 PolarHBondContact O-N 3Å
707	K	73.7	Confident	83.4	Confident	194 Å²	194	33.8 Å²	33.8	84%	0.843	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	49	41.4	-171.9	-58	-177.7	178.3	-175.9	0	111.7	P703 Y704	P703-K707 CarbonylContact O-C 3.35Å; P703-K707 WeakPolarHBondContact O-CA 3.33Å; P703-K707 PolarHBondContact O-N 3.25Å; P703-K707 VanDerWaalsContact O-N 3.09Å; Y704-K707 PolarHBondContact O-N 3.41Å
708	W	75.8	Confident	83.6	Confident	22 Å²	22	33.7 Å²	33.7	8%	0.083	17%	0.168	C	C	.	.			trans	-88.3	110.9	-177.5	177.3	21.4	0	0	0	109	E638 Y639 F642 P703 F706 V710	E638-W708 HydrophobicContact CG-CH2 3.9Å; Y639-W708 HydrophobicContact CD2-CB 4.15Å; Y639-W708 AromaticContact CD2-CD2 3.55Å; Y639-W708 HydrophobicContact CD2-CD2 3.55Å; Y639-W708 AromaticContact CD2-CE3 3.63Å; Y639-W708 HydrophobicContact CD2-CE3 3.63Å; Y639-W708 AromaticContact CD2-CG 3.78Å; Y639-W708 HydrophobicContact CD2-CG 3.78Å; Y639-W708 HydrophobicContact CD2-CZ3 4.3Å; Y639-W708 HydrophobicContact CE2-CB 3.84Å; Y639-W708 HydrophobicContact CE2-CD2 4.09Å; Y639-W708 HydrophobicContact CE2-CE3 4.47Å; Y639-W708 AromaticContact CE2-CG 3.8Å; Y639-W708 HydrophobicContact CE2-CG 3.8Å; Y639-W708 HydrophobicContact CG-CE3 4.47Å; F642-W708 HydrophobicContact CB-CZ2 3.82Å; F642-W708 HydrophobicContact CD1-CZ2 4.35Å; F642-W708 AromaticContact CD2-CH2 3.86Å; F642-W708 HydrophobicContact CD2-CH2 3.86Å; F642-W708 AromaticContact CD2-CZ2 3.32Å; F642-W708 HydrophobicContact CD2-CZ2 3.32Å; F642-W708 HydrophobicContact CE2-CH2 4.19Å; F642-W708 AromaticContact CE2-CZ2 3.85Å; F642-W708 HydrophobicContact CE2-CZ2 3.85Å; F642-W708 AromaticContact CG-CZ2 3.59Å; F642-W708 HydrophobicContact CG-CZ2 3.59Å; P703-W708 HydrophobicContact CG-CE3 4.35Å; P703-W708 PolarHBondContact O-N 3.45Å; F706-W708 HydrophobicContact CB-CB 4.38Å; F706-W708 PolarHBondContact O-N 3Å; W708-V710 HydrophobicContact CD2-CB 4.07Å; W708-V710 HydrophobicContact CD2-CG1 3.56Å; W708-V710 HydrophobicContact CE3-CG1 3.88Å; W708-V710 HydrophobicContact CG-CB 4.32Å; W708-V710 HydrophobicContact CG-CG1 4.01Å; W708-V710 HydrophobicContact CH2-CG1 4.06Å; W708-V710 HydrophobicContact CH2-CG2 4.47Å; W708-V710 HydrophobicContact CZ2-CB 3.82Å; W708-V710 HydrophobicContact CZ2-CG1 3.77Å; W708-V710 HydrophobicContact CZ2-CG2 3.8Å; W708-V710 HydrophobicContact CZ3-CG1 4.14Å; W708-V710 PolarHBondContact O-N 3.26Å
709	N	79.7	Confident	83.9	Confident	145 Å²	145	33.7 Å²	33.7	78%	0.775	17%	0.169	S	C	*	.			trans	-77.6	85.4	178.1	-166.7	16	0	0	0	110.2
710	V	81.6	Confident	83.9	Confident	8 Å²	8	33.7 Å²	33.7	5%	0.048	17%	0.169	C	C	.	.			trans	-132.5	134.1	177.7	65.4	0	0	0	0	109.7	F642 P703 W708 I712 T714 R715 R765	F642-V710 HydrophobicContact CE1-CG2 4.39Å; F642-V710 HydrophobicContact CZ-CG2 4.33Å; P703-V710 HydrophobicContact CB-CG1 4.09Å; P703-V710 HydrophobicContact CG-CG1 3.99Å; W708-V710 HydrophobicContact CD2-CB 4.07Å; W708-V710 HydrophobicContact CD2-CG1 3.56Å; W708-V710 HydrophobicContact CE3-CG1 3.88Å; W708-V710 HydrophobicContact CG-CB 4.32Å; W708-V710 HydrophobicContact CG-CG1 4.01Å; W708-V710 HydrophobicContact CH2-CG1 4.06Å; W708-V710 HydrophobicContact CH2-CG2 4.47Å; W708-V710 HydrophobicContact CZ2-CB 3.82Å; W708-V710 HydrophobicContact CZ2-CG1 3.77Å; W708-V710 HydrophobicContact CZ2-CG2 3.8Å; W708-V710 HydrophobicContact CZ3-CG1 4.14Å; W708-V710 PolarHBondContact O-N 3.26Å; V710-I712 PolarHBondContact O-N 2.98Å; V710-T714 VanDerWaalsContact CG2-OG1 3.24Å; V710-T714 WeakPolarHBondContact CG2-OG1 3.2Å; V710-R715 HydrophobicContact CG1-CG 4.36Å; V710-R715 HydrophobicContact CG2-CG 4.13Å; V710-R765 PolarHBondContact O-NH2 2.91Å
711	D	82.4	Confident	83.9	Confident	64 Å²	64	33.3 Å²	33.3	34%	0.342	17%	0.166	S	C	.	.			trans	-64.3	129.6	172.1	178.9	3.1	0	0	0	109.2	S713 T714	D711-S713 PolarHBondContact O-N 3.49Å; D711-S713 PolarHBondContact OD1-N 2.99Å; D711-S713 PolarHBondContact OD1-OG 2.92Å; D711-S713 PolarHBondContact OD2-OG 3.03Å; D711-T714 HydrophobicContact CB-CG2 4.01Å; D711-T714 PolarHBondContact O-N 2.92Å; D711-T714 PolarHBondContact O-OG1 3.25Å
712	I	83.3	Confident	84.2	Confident	8 Å²	8	33.2 Å²	33.2	4%	0.041	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-55.8	-36.1	178.7	-70.1	169	0	0	0	110.4	V710 T714 R715 V718 V762 R765 E766	V710-I712 PolarHBondContact O-N 2.98Å; I712-T714 PolarHBondContact O-N 3.44Å; I712-R715 PolarHBondContact O-N 3.34Å; I712-V718 HydrophobicContact CG2-CB 4.31Å; I712-V718 HydrophobicContact CG2-CG1 3.27Å; I712-V718 HydrophobicContact CG2-CG2 4.19Å; I712-V762 HydrophobicContact CD1-CG1 4.4Å; I712-V762 HydrophobicContact CG2-CG1 4.47Å; I712-R765 HydrophobicContact CD1-CB 3.67Å; I712-R765 VanDerWaalsContact CD1-CD 3.45Å; I712-R765 HydrophobicContact CD1-CG 3.71Å; I712-R765 VanDerWaalsContact CG1-NH1 3.33Å; I712-E766 WeakPolarHBondContact CB-OE1 3.49Å; I712-E766 HydrophobicContact CD1-CG 4.04Å; I712-E766 WeakPolarHBondContact CD1-OE1 3.42Å
713	S	81.6	Confident	84.5	Confident	33 Å²	33	33.2 Å²	33.2	23%	0.231	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-62	-30.4	-180	84.9	0	0	0	0	112.4	D711 R715 K810	D711-S713 PolarHBondContact O-N 3.49Å; D711-S713 PolarHBondContact OD1-N 2.99Å; D711-S713 PolarHBondContact OD1-OG 2.92Å; D711-S713 PolarHBondContact OD2-OG 3.03Å; S713-R715 VanDerWaalsContact C-N 3.28Å; S713-R715 PolarHBondContact O-N 3.34Å; S713-K810 PolarHBondContact O-NZ 3.23Å
714	T	84.3	Confident	84.9	Confident	74 Å²	74	33 Å²	33	45%	0.454	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-77.7	-13.4	-176	64.1	0	0	0	0	113.9	V710 D711 I712	V710-T714 VanDerWaalsContact CG2-OG1 3.24Å; V710-T714 WeakPolarHBondContact CG2-OG1 3.2Å; D711-T714 HydrophobicContact CB-CG2 4.01Å; D711-T714 PolarHBondContact O-N 2.92Å; D711-T714 PolarHBondContact O-OG1 3.25Å; I712-T714 PolarHBondContact O-N 3.44Å
715	R	90.3	Very high	85.6	Confident	5 Å²	5	31.8 Å²	31.8	2%	0.019	16%	0.16	C	C	.	.	S	Bend	trans	-86.6	133.6	-174.3	-67	-172.6	66	-156	2.7	111.8	E638 Y699 S702 V710 I712 S713 F717 V718	E638-R715 IonicContact OE1-NE 2.71Å; E638-R715 IonicContact OE2-CZ 3.47Å; E638-R715 VanDerWaalsContact OE2-CZ 3.31Å; E638-R715 IonicContact OE2-NE 3.82Å; E638-R715 PolarHBondContact OE2-NE 3.02Å; E638-R715 IonicContact OE2-NH2 3.85Å; E638-R715 PolarHBondContact OE2-NH2 3.25Å; Y699-R715 PolarHBondContact O-NH1 3.29Å; Y699-R715 PolarHBondContact O-NH2 3.18Å; S702-R715 PolarHBondContact OG-NH2 3.25Å; V710-R715 HydrophobicContact CG1-CG 4.36Å; V710-R715 HydrophobicContact CG2-CG 4.13Å; I712-R715 PolarHBondContact O-N 3.34Å; S713-R715 VanDerWaalsContact C-N 3.28Å; S713-R715 PolarHBondContact O-N 3.34Å; R715-F717 PolarHBondContact O-N 3.08Å; R715-V718 HydrophobicContact CB-CB 4.3Å; R715-V718 HydrophobicContact CB-CG2 3.47Å; R715-V718 VanDerWaalsContact CB-CG2 3.47Å; R715-V718 HydrophobicContact CG-CG2 4.46Å; R715-V718 PolarHBondContact O-N 2.73Å
716	L	89.8	Confident	86.4	Confident	39 Å²	39	30.9 Å²	30.9	20%	0.204	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-49	-162.3	-171.6	62.5	0	0	0	113.6	E638 W655 P656 P657 Q662 Y699	E638-L716 PolarHBondContact OE1-N 3.01Å; W655-L716 HydrophobicContact CH2-CB 4.39Å; W655-L716 HydrophobicContact CH2-CD2 3.96Å; W655-L716 HydrophobicContact CZ2-CB 3.85Å; W655-L716 HydrophobicContact CZ2-CD2 3.88Å; P656-L716 HydrophobicContact CB-CD2 3.92Å; P657-L716 HydrophobicContact CG-CD2 4.03Å; Q662-L716 HydrophobicContact CG-CD2 4.05Å; Y699-L716 PolarHBondContact OH-N 2.88Å
717	F	93.2	Very high	87.3	Confident	1 Å²	1	29.9 Å²	29.9	0%	0.004	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	4.3	-172.5	-62.2	-67.3	0	0	0	113.6	F631 F634 W655 P657 Q662 L665 W669 Y699 R715 P720 V721	F631-F717 HydrophobicContact CD2-CD2 4.49Å; F631-F717 HydrophobicContact CE2-CB 3.95Å; F631-F717 AromaticContact CE2-CD2 3.85Å; F631-F717 HydrophobicContact CE2-CD2 3.85Å; F631-F717 AromaticContact CE2-CG 3.95Å; F631-F717 HydrophobicContact CE2-CG 3.95Å; F631-F717 HydrophobicContact CZ-CB 4.37Å; F634-F717 HydrophobicContact CD2-CE2 4.48Å; W655-F717 HydrophobicContact CH2-CD2 4.17Å; W655-F717 AromaticContact CH2-CE2 3.8Å; W655-F717 HydrophobicContact CH2-CE2 3.8Å; W655-F717 HydrophobicContact CZ3-CE2 4.41Å; P657-F717 HydrophobicContact CG-CZ 4.27Å; Q662-F717 HydrophobicContact CB-CE1 4.22Å; Q662-F717 HydrophobicContact CG-CE1 4.38Å; Q662-F717 HydrophobicContact CG-CZ 4.25Å; L665-F717 HydrophobicContact CD2-CD1 4.32Å; L665-F717 HydrophobicContact CD2-CE1 3.84Å; L665-F717 HydrophobicContact CD2-CZ 3.94Å; W669-F717 HydrophobicContact CH2-CB 4.35Å; W669-F717 HydrophobicContact CH2-CD1 4.28Å; W669-F717 HydrophobicContact CH2-CG 4.42Å; W669-F717 HydrophobicContact CZ3-CD1 4.42Å; Y699-F717 HydrophobicContact CE1-CB 3.79Å; Y699-F717 HydrophobicContact CE2-CD2 4.48Å; Y699-F717 PolarHBondContact OH-N 3.48Å; R715-F717 PolarHBondContact O-N 3.08Å; F717-P720 HydrophobicContact CB-CG 4.42Å; F717-P720 HydrophobicContact CD1-CG 4.39Å; F717-P720 WeakPolarHBondContact O-CD 3.45Å; F717-P720 WeakPolarHBondContact O-CG 3.39Å; F717-V721 HydrophobicContact CB-CG2 4.39Å; F717-V721 VanDerWaalsContact O-CB 3.26Å; F717-V721 WeakPolarHBondContact O-CB 3.47Å; F717-V721 WeakPolarHBondContact O-CG2 3.34Å; F717-V721 PolarHBondContact O-N 3.42Å
718	V	93.1	Very high	87.9	Confident	1 Å²	1	20.6 Å²	20.6	1%	0.006	12%	0.115	C	C	.	.	H	α-helix	trans	-61.3	-50.8	-177	159.3	0	0	0	0	111.2	Y699 L700 I712 R715 V721 I722 W806	Y699-V718 HydrophobicContact CD1-CG2 4.5Å; Y699-V718 HydrophobicContact CE1-CG2 3.73Å; L700-V718 HydrophobicContact CD2-CG2 4.31Å; I712-V718 HydrophobicContact CG2-CB 4.31Å; I712-V718 HydrophobicContact CG2-CG1 3.27Å; I712-V718 HydrophobicContact CG2-CG2 4.19Å; R715-V718 HydrophobicContact CB-CB 4.3Å; R715-V718 HydrophobicContact CB-CG2 3.47Å; R715-V718 VanDerWaalsContact CB-CG2 3.47Å; R715-V718 HydrophobicContact CG-CG2 4.46Å; R715-V718 PolarHBondContact O-N 2.73Å; V718-V721 PolarHBondContact O-N 2.95Å; V718-I722 HydrophobicContact CG1-CD1 3.52Å; V718-I722 HydrophobicContact CG1-CG1 4.37Å; V718-I722 VanDerWaalsContact O-CG1 3.29Å; V718-I722 WeakPolarHBondContact O-CG1 3.21Å; V718-I722 PolarHBondContact O-N 3.35Å; V718-W806 HydrophobicContact CG1-CH2 4.05Å
719	S	91.5	Very high	88.6	Confident	1 Å²	1	19.7 Å²	19.7	1%	0.007	11%	0.112	C	C	.	.	H	α-helix	trans	-56.3	-57.5	179.6	158.7	0	0	0	0	112.3	V721 I722 I723 L807	S719-V721 VanDerWaalsContact C-N 3.26Å; S719-V721 PolarHBondContact O-N 2.9Å; S719-I722 PolarHBondContact O-N 3Å; S719-I722 VanDerWaalsContact O-N 3.16Å; S719-I723 WeakPolarHBondContact O-CG1 3.37Å; S719-I723 PolarHBondContact O-N 3.36Å; S719-L807 PolarHBondContact OG-O 2.87Å
720	P	91.8	Very high	88.8	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-61.9	-32.9	-179.3	20.7	-31.7	0	0	0	112.7	V666 W669 F670 F717 F724 L811	V666-P720 HydrophobicContact CG1-CB 4.11Å; V666-P720 HydrophobicContact CG2-CB 3.89Å; V666-P720 HydrophobicContact CG2-CG 4Å; W669-P720 HydrophobicContact CZ3-CB 4.29Å; W669-P720 HydrophobicContact CZ3-CG 4.43Å; F670-P720 HydrophobicContact CE2-CB 4.43Å; F717-P720 HydrophobicContact CB-CG 4.42Å; F717-P720 HydrophobicContact CD1-CG 4.39Å; F717-P720 WeakPolarHBondContact O-CD 3.45Å; F717-P720 WeakPolarHBondContact O-CG 3.39Å; P720-F724 VanDerWaalsContact O-CB 3.22Å; P720-F724 WeakPolarHBondContact O-CB 3.48Å; P720-F724 PolarHBondContact O-N 3.16Å; P720-L811 HydrophobicContact CB-CD1 4.03Å
721	V	94.1	Very high	88.8	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-66.5	-45	174.9	170.6	0	0	0	0	111.8	F631 W669 F696 L700 F717 V718 S719 I723 F724 L725	F631-V721 HydrophobicContact CZ-CG2 4.17Å; W669-V721 HydrophobicContact CH2-CG2 3.96Å; W669-V721 HydrophobicContact CZ3-CG2 3.91Å; F696-V721 HydrophobicContact CB-CG1 3.81Å; F696-V721 HydrophobicContact CD1-CB 4.32Å; F696-V721 HydrophobicContact CD1-CG1 3.74Å; F696-V721 HydrophobicContact CD1-CG2 3.59Å; F696-V721 HydrophobicContact CD2-CG1 4.34Å; F696-V721 HydrophobicContact CE1-CG1 4.41Å; F696-V721 HydrophobicContact CE1-CG2 3.7Å; F696-V721 HydrophobicContact CG-CG1 3.71Å; F696-V721 HydrophobicContact CG-CG2 4.4Å; L700-V721 HydrophobicContact CD1-CG1 3.89Å; L700-V721 HydrophobicContact CD2-CG1 4.13Å; L700-V721 HydrophobicContact CG-CG1 4.01Å; F717-V721 HydrophobicContact CB-CG2 4.39Å; F717-V721 VanDerWaalsContact O-CB 3.26Å; F717-V721 WeakPolarHBondContact O-CB 3.47Å; F717-V721 WeakPolarHBondContact O-CG2 3.34Å; F717-V721 PolarHBondContact O-N 3.42Å; V718-V721 PolarHBondContact O-N 2.95Å; S719-V721 VanDerWaalsContact C-N 3.26Å; S719-V721 PolarHBondContact O-N 2.9Å; V721-I723 VanDerWaalsContact C-N 3.34Å; V721-I723 PolarHBondContact O-N 2.85Å; V721-F724 PolarHBondContact O-N 3.39Å; V721-L725 HydrophobicContact CG1-CD1 4.02Å; V721-L725 HydrophobicContact CG1-CG 4.33Å; V721-L725 WeakPolarHBondContact O-CB 3.1Å; V721-L725 VanDerWaalsContact O-CG 3.25Å; V721-L725 WeakPolarHBondContact O-CG 2.94Å; V721-L725 PolarHBondContact O-N 2.84Å
722	I	93.4	Very high	88.6	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-60.7	-46.3	177.7	-70.2	164.7	0	0	0	110.2	V718 S719 F724 L725 A726 L759 V762 L807 I827 F828	V718-I722 HydrophobicContact CG1-CD1 3.52Å; V718-I722 HydrophobicContact CG1-CG1 4.37Å; V718-I722 VanDerWaalsContact O-CG1 3.29Å; V718-I722 WeakPolarHBondContact O-CG1 3.21Å; V718-I722 PolarHBondContact O-N 3.35Å; S719-I722 PolarHBondContact O-N 3Å; S719-I722 VanDerWaalsContact O-N 3.16Å; I722-F724 PolarHBondContact O-N 3.15Å; I722-L725 PolarHBondContact O-N 3.15Å; I722-A726 WeakPolarHBondContact O-CB 3.37Å; I722-A726 PolarHBondContact O-N 3.1Å; I722-L759 HydrophobicContact CG2-CD2 3.91Å; I722-V762 HydrophobicContact CD1-CG1 3.73Å; I722-V762 HydrophobicContact CG1-CG1 4.3Å; I722-L807 HydrophobicContact CB-CD2 4.3Å; I722-L807 HydrophobicContact CD1-CD2 3.64Å; I722-L807 HydrophobicContact CG2-CD1 3.82Å; I722-L807 HydrophobicContact CG2-CD2 4.34Å; I722-I827 HydrophobicContact CG2-CD1 4.49Å; I722-F828 HydrophobicContact CG2-CZ 4.18Å
723	I	91	Very high	88.4	Confident	0 Å²	0	15 Å²	15	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-65.5	-41.9	-179.1	-62.6	168.4	0	0	0	110.6	F670 S719 V721 A726 Q727 L807 W808 L811 I827	F670-I723 HydrophobicContact CE1-CG2 4.07Å; F670-I723 HydrophobicContact CZ-CB 4.28Å; F670-I723 HydrophobicContact CZ-CG2 3.97Å; S719-I723 WeakPolarHBondContact O-CG1 3.37Å; S719-I723 PolarHBondContact O-N 3.36Å; V721-I723 VanDerWaalsContact C-N 3.34Å; V721-I723 PolarHBondContact O-N 2.85Å; I723-A726 PolarHBondContact O-N 3.22Å; I723-Q727 VanDerWaalsContact CG2-NE2 3.31Å; I723-Q727 WeakPolarHBondContact O-CG 3.46Å; I723-Q727 PolarHBondContact O-N 3.07Å; I723-L807 HydrophobicContact CD1-CB 4.2Å; I723-L807 HydrophobicContact CG1-CB 4.4Å; I723-W808 HydrophobicContact CD1-CD2 4.27Å; I723-W808 HydrophobicContact CD1-CE3 3.9Å; I723-W808 HydrophobicContact CD1-CZ3 4.15Å; I723-W808 HydrophobicContact CG1-CZ3 4.4Å; I723-W808 HydrophobicContact CG2-CE3 4.48Å; I723-W808 HydrophobicContact CG2-CH2 3.74Å; I723-W808 HydrophobicContact CG2-CZ3 3.66Å; I723-L811 HydrophobicContact CB-CD2 4.38Å; I723-L811 HydrophobicContact CD1-CB 3.69Å; I723-L811 HydrophobicContact CD1-CD1 4.4Å; I723-L811 HydrophobicContact CD1-CD2 3.55Å; I723-L811 HydrophobicContact CD1-CG 4.07Å; I723-L811 HydrophobicContact CG2-CD2 3.87Å; I723-I827 HydrophobicContact CG1-CD1 3.84Å
724	F	91.2	Very high	88.2	Confident	0 Å²	0	15 Å²	15	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-58.5	-48.6	173.5	179.8	-80.4	0	0	0	111.9	W669 F670 L673 I689 F696 P720 V721 I722 A726 Q727 L728	W669-F724 HydrophobicContact CB-CD2 3.65Å; W669-F724 HydrophobicContact CB-CE2 3.75Å; W669-F724 HydrophobicContact CG-CD2 4.45Å; W669-F724 HydrophobicContact CG-CE2 4.48Å; W669-F724 WeakPolarHBondContact O-CE2 3.37Å; F670-F724 HydrophobicContact CZ-CB 4.33Å; L673-F724 HydrophobicContact CD1-CB 4.49Å; L673-F724 HydrophobicContact CD1-CD2 3.31Å; L673-F724 HydrophobicContact CD1-CE2 3.57Å; L673-F724 HydrophobicContact CD1-CG 3.93Å; L673-F724 HydrophobicContact CD1-CZ 4.31Å; L673-F724 HydrophobicContact CD2-CD2 4.26Å; L673-F724 HydrophobicContact CD2-CE1 4.31Å; L673-F724 HydrophobicContact CD2-CE2 3.72Å; L673-F724 HydrophobicContact CD2-CZ 3.73Å; L673-F724 HydrophobicContact CG-CD2 3.7Å; L673-F724 HydrophobicContact CG-CE2 3.36Å; L673-F724 HydrophobicContact CG-CZ 3.93Å; I689-F724 HydrophobicContact CD1-CZ 4.1Å; F696-F724 HydrophobicContact CD2-CD1 4.34Å; F696-F724 AromaticContact CE2-CD1 3.51Å; F696-F724 HydrophobicContact CE2-CD1 3.51Å; F696-F724 AromaticContact CE2-CE1 3.56Å; F696-F724 HydrophobicContact CE2-CE1 3.56Å; F696-F724 HydrophobicContact CE2-CG 4.28Å; F696-F724 HydrophobicContact CE2-CZ 4.31Å; F696-F724 HydrophobicContact CZ-CD1 4.14Å; F696-F724 HydrophobicContact CZ-CE1 4.3Å; P720-F724 VanDerWaalsContact O-CB 3.22Å; P720-F724 WeakPolarHBondContact O-CB 3.48Å; P720-F724 PolarHBondContact O-N 3.16Å; V721-F724 PolarHBondContact O-N 3.39Å; I722-F724 PolarHBondContact O-N 3.15Å; F724-A726 VanDerWaalsContact C-N 3.32Å; F724-A726 PolarHBondContact O-N 3.08Å; F724-Q727 PolarHBondContact O-N 3.33Å; F724-L728 HydrophobicContact CE1-CD2 4.08Å; F724-L728 WeakPolarHBondContact O-CB 3.41Å; F724-L728 PolarHBondContact O-N 3.35Å
725	L	93	Very high	87.3	Confident	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-61.9	-40.4	178.7	-72.2	175.7	0	0	0	111.8	L693 F696 L700 V721 I722 L728 F729 L758 L759	L693-L725 HydrophobicContact CD2-CD2 3.22Å; F696-L725 HydrophobicContact CD2-CD2 4.05Å; L700-L725 HydrophobicContact CD1-CD1 3.66Å; V721-L725 HydrophobicContact CG1-CD1 4.02Å; V721-L725 HydrophobicContact CG1-CG 4.33Å; V721-L725 WeakPolarHBondContact O-CB 3.1Å; V721-L725 VanDerWaalsContact O-CG 3.25Å; V721-L725 WeakPolarHBondContact O-CG 2.94Å; V721-L725 PolarHBondContact O-N 2.84Å; I722-L725 PolarHBondContact O-N 3.15Å; L725-L728 PolarHBondContact O-N 2.97Å; L725-F729 VanDerWaalsContact O-CB 3.25Å; L725-F729 WeakPolarHBondContact O-CB 3.44Å; L725-F729 PolarHBondContact O-N 2.83Å; L725-L758 HydrophobicContact CD1-CB 4.06Å; L725-L758 HydrophobicContact CD1-CD1 4.15Å; L725-L758 HydrophobicContact CD2-CD1 4.43Å; L725-L759 HydrophobicContact CB-CD1 4.38Å; L725-L759 HydrophobicContact CB-CD2 3.97Å; L725-L759 HydrophobicContact CB-CG 4.13Å
726	A	90.7	Very high	85.9	Confident	13 Å²	13	15.1 Å²	15.1	11%	0.107	8%	0.079	C	C	.	.	H	α-helix	trans	-63.1	-44.1	178.1	0	0	0	0	0	112	I722 I723 F724 F729 H730 I827	I722-A726 WeakPolarHBondContact O-CB 3.37Å; I722-A726 PolarHBondContact O-N 3.1Å; I723-A726 PolarHBondContact O-N 3.22Å; F724-A726 VanDerWaalsContact C-N 3.32Å; F724-A726 PolarHBondContact O-N 3.08Å; A726-F729 PolarHBondContact O-N 3.43Å; A726-H730 VanDerWaalsContact O-CB 3.32Å; A726-H730 WeakPolarHBondContact O-CB 3.42Å; A726-H730 PolarHBondContact O-N 2.64Å; A726-I827 HydrophobicContact CB-CB 4.18Å; A726-I827 HydrophobicContact CB-CD1 4.25Å; A726-I827 HydrophobicContact CB-CG1 3.92Å; A726-I827 HydrophobicContact CB-CG2 3.41Å; A726-I827 VanDerWaalsContact CB-CG2 3.41Å
727	Q	87.6	Confident	84.2	Confident	19 Å²	19	15.9 Å²	15.9	9%	0.089	9%	0.087	C	C	.	.	H	α-helix	trans	-67.5	-44	177.1	-72.4	170.9	14.9	0	0	112.1	L673 I723 F724 F729 H730 Q731 L823	L673-Q727 HydrophobicContact CD1-CB 4.08Å; L673-Q727 VanDerWaalsContact CD1-OE1 3.25Å; I723-Q727 VanDerWaalsContact CG2-NE2 3.31Å; I723-Q727 WeakPolarHBondContact O-CG 3.46Å; I723-Q727 PolarHBondContact O-N 3.07Å; F724-Q727 PolarHBondContact O-N 3.33Å; Q727-F729 VanDerWaalsContact C-N 3.3Å; Q727-F729 PolarHBondContact O-N 3.31Å; Q727-H730 PolarHBondContact O-N 2.99Å; Q727-Q731 WeakPolarHBondContact O-CB 3.2Å; Q727-Q731 VanDerWaalsContact O-CG 3.3Å; Q727-Q731 WeakPolarHBondContact O-CG 2.92Å; Q727-Q731 PolarHBondContact O-N 3.3Å; Q727-L823 HydrophobicContact CG-CD2 4.05Å; Q727-L823 VanDerWaalsContact NE2-CB 3.25Å
728	L	87.5	Confident	82.1	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-59.9	-44.6	176.2	-174	68.3	0	0	0	110.8	L673 I689 L693 F724 L725 F732	L673-L728 HydrophobicContact CD2-CB 4.27Å; L673-L728 HydrophobicContact CD2-CD1 3.9Å; I689-L728 HydrophobicContact CD1-CD1 4.46Å; I689-L728 HydrophobicContact CG2-CD1 4.06Å; I689-L728 HydrophobicContact CG2-CD2 3.35Å; I689-L728 HydrophobicContact CG2-CG 4.3Å; L693-L728 HydrophobicContact CD2-CD2 4.11Å; F724-L728 HydrophobicContact CE1-CD2 4.08Å; F724-L728 WeakPolarHBondContact O-CB 3.41Å; F724-L728 PolarHBondContact O-N 3.35Å; L725-L728 PolarHBondContact O-N 2.97Å; L728-F732 HydrophobicContact CD1-CD2 4.04Å; L728-F732 HydrophobicContact CD1-CE2 3.32Å; L728-F732 HydrophobicContact CD1-CZ 3.93Å; L728-F732 HydrophobicContact CD2-CE2 4.22Å; L728-F732 HydrophobicContact CG-CD2 3.92Å; L728-F732 HydrophobicContact CG-CE2 3.52Å; L728-F732 WeakPolarHBondContact O-CD2 3.43Å; L728-F732 PolarHBondContact O-N 3.34Å; L728-F732 VanDerWaalsContact O-N 3.09Å
729	F	89.1	Confident	79.9	Confident	3 Å²	3	26.5 Å²	26.5	1%	0.013	14%	0.143	C	C	.	.	H	α-helix	trans	-59.6	-49.5	173.7	176.1	-95.4	0	0	0	111.5	L725 A726 Q727 Q731 F732 A733 T752 C755 A756 L759 L831 Y834 F838 W884	L725-F729 VanDerWaalsContact O-CB 3.25Å; L725-F729 WeakPolarHBondContact O-CB 3.44Å; L725-F729 PolarHBondContact O-N 2.83Å; A726-F729 PolarHBondContact O-N 3.43Å; Q727-F729 VanDerWaalsContact C-N 3.3Å; Q727-F729 PolarHBondContact O-N 3.31Å; F729-Q731 PolarHBondContact O-N 3.42Å; F729-F732 PolarHBondContact O-N 3.05Å; F729-A733 VanDerWaalsContact O-CB 3.25Å; F729-A733 WeakPolarHBondContact O-CB 3.45Å; F729-A733 PolarHBondContact O-N 3.42Å; F729-T752 HydrophobicContact CD2-CG2 3.52Å; F729-T752 HydrophobicContact CE2-CG2 3.49Å; F729-T752 VanDerWaalsContact CE2-CG2 3.49Å; F729-C755 HydrophobicContact CB-CB 3.86Å; F729-C755 HydrophobicContact CD2-CB 4.25Å; F729-A756 HydrophobicContact CD2-CB 4.2Å; F729-A756 HydrophobicContact CE2-CB 3.85Å; F729-L759 HydrophobicContact CB-CD1 4.39Å; F729-L831 HydrophobicContact CD1-CD1 4.13Å; F729-L831 HydrophobicContact CD2-CD1 4.37Å; F729-L831 HydrophobicContact CE1-CD1 3.73Å; F729-L831 HydrophobicContact CE2-CD1 4Å; F729-L831 HydrophobicContact CG-CD1 4.44Å; F729-L831 HydrophobicContact CZ-CD1 3.66Å; F729-Y834 AromaticContact CE1-CD2 3.75Å; F729-Y834 HydrophobicContact CE1-CD2 3.75Å; F729-Y834 HydrophobicContact CE1-CG 4.06Å; F729-Y834 HydrophobicContact CZ-CG 4.39Å; F729-F838 HydrophobicContact CE2-CE2 4.23Å; F729-F838 HydrophobicContact CZ-CE2 4.05Å; F729-W884 HydrophobicContact CE2-CZ3 4.45Å
730	H	85.3	Confident	77.9	Confident	79 Å²	79	31.3 Å²	31.3	37%	0.366	18%	0.176	S	C	.	.	H	α-helix	trans	-60.1	-45.7	179.7	-178.1	80.6	0	0	0	111.9	A726 Q727 F732 A733 T734 Y834	A726-H730 VanDerWaalsContact O-CB 3.32Å; A726-H730 WeakPolarHBondContact O-CB 3.42Å; A726-H730 PolarHBondContact O-N 2.64Å; Q727-H730 PolarHBondContact O-N 2.99Å; H730-F732 PolarHBondContact O-N 2.85Å; H730-A733 PolarHBondContact O-N 2.75Å; H730-T734 VanDerWaalsContact CE1-CG2 3.47Å; H730-T734 WeakPolarHBondContact CE1-CG2 3.18Å; H730-T734 VanDerWaalsContact NE2-CG2 3.35Å; H730-T734 WeakPolarHBondContact NE2-CG2 3.41Å; H730-T734 WeakPolarHBondContact O-CG2 3.23Å; H730-T734 PolarHBondContact O-N 3.26Å; H730-T734 PolarHBondContact O-OG1 3.48Å; H730-Y834 AromaticContact ND1-CE2 3.67Å
731	Q	80.9	Confident	76.1	Confident	46 Å²	46	38.7 Å²	38.7	22%	0.215	22%	0.216	C	C	.	.	H	α-helix	trans	-61.5	-42.2	177.9	-75	179.6	-12	0	0	112.5	F676 Q727 F729 A733 T734 N735	F676-Q731 HydrophobicContact CD1-CB 4.34Å; F676-Q731 VanDerWaalsContact CD1-OE1 3.27Å; F676-Q731 HydrophobicContact CE1-CB 4.17Å; Q727-Q731 WeakPolarHBondContact O-CB 3.2Å; Q727-Q731 VanDerWaalsContact O-CG 3.3Å; Q727-Q731 WeakPolarHBondContact O-CG 2.92Å; Q727-Q731 PolarHBondContact O-N 3.3Å; F729-Q731 PolarHBondContact O-N 3.42Å; Q731-A733 VanDerWaalsContact C-N 3.33Å; Q731-T734 PolarHBondContact O-OG1 3.08Å; Q731-N735 WeakPolarHBondContact O-CB 3.5Å; Q731-N735 PolarHBondContact O-N 2.98Å; Q731-N735 PolarHBondContact O-ND2 2.77Å
732	F	78.8	Confident	74.6	Confident	1 Å²	1	44.7 Å²	44.7	0%	0.004	24%	0.242	C	C	.	.	H	α-helix	trans	-72.3	-29.2	175.2	-70.8	-56	0	0	0	112.6	F676 F685 Y686 L728 F729 H730 N736 E748 L751 T752	F676-F732 HydrophobicContact CE1-CE1 4.43Å; F676-F732 HydrophobicContact CE2-CE1 4.26Å; F676-F732 HydrophobicContact CZ-CD1 4.25Å; F676-F732 AromaticContact CZ-CE1 3.7Å; F676-F732 HydrophobicContact CZ-CE1 3.7Å; F676-F732 HydrophobicContact CZ-CZ 4.37Å; F685-F732 HydrophobicContact CE1-CZ 4.39Å; Y686-F732 AromaticContact CE1-CE1 3.96Å; Y686-F732 HydrophobicContact CE1-CE1 3.96Å; Y686-F732 HydrophobicContact CE1-CZ 4.31Å; L728-F732 HydrophobicContact CD1-CD2 4.04Å; L728-F732 HydrophobicContact CD1-CE2 3.32Å; L728-F732 HydrophobicContact CD1-CZ 3.93Å; L728-F732 HydrophobicContact CD2-CE2 4.22Å; L728-F732 HydrophobicContact CG-CD2 3.92Å; L728-F732 HydrophobicContact CG-CE2 3.52Å; L728-F732 WeakPolarHBondContact O-CD2 3.43Å; L728-F732 PolarHBondContact O-N 3.34Å; L728-F732 VanDerWaalsContact O-N 3.09Å; F729-F732 PolarHBondContact O-N 3.05Å; H730-F732 PolarHBondContact O-N 2.85Å; F732-N736 PolarHBondContact O-ND2 3.21Å; F732-E748 HydrophobicContact CD1-CG 4.22Å; F732-L751 HydrophobicContact CD2-CB 4.19Å; F732-L751 HydrophobicContact CE1-CD1 4.3Å; F732-L751 HydrophobicContact CE2-CB 3.77Å; F732-L751 HydrophobicContact CE2-CD1 3.65Å; F732-L751 HydrophobicContact CE2-CG 4.39Å; F732-L751 HydrophobicContact CZ-CB 4.3Å; F732-L751 HydrophobicContact CZ-CD1 3.42Å; F732-L751 VanDerWaalsContact CZ-CD1 3.42Å; F732-T752 WeakPolarHBondContact CB-OG1 3.38Å
733	A	79.2	Confident	73.5	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-76.1	-47.1	179.1	0	0	0	0	0	112.5	F729 H730 Q731 N735 N736 S737 Y834 F838	F729-A733 VanDerWaalsContact O-CB 3.25Å; F729-A733 WeakPolarHBondContact O-CB 3.45Å; F729-A733 PolarHBondContact O-N 3.42Å; H730-A733 PolarHBondContact O-N 2.75Å; Q731-A733 VanDerWaalsContact C-N 3.33Å; A733-N735 PolarHBondContact O-N 2.81Å; A733-N736 PolarHBondContact O-N 2.68Å; A733-N736 VanDerWaalsContact O-N 3.15Å; A733-S737 PolarHBondContact O-N 3.49Å; A733-Y834 HydrophobicContact CB-CD1 3.65Å; A733-Y834 HydrophobicContact CB-CD2 3.83Å; A733-Y834 HydrophobicContact CB-CE1 3.7Å; A733-Y834 HydrophobicContact CB-CE2 3.87Å; A733-Y834 HydrophobicContact CB-CG 3.72Å; A733-F838 HydrophobicContact CB-CE2 4.11Å; A733-F838 HydrophobicContact CB-CZ 3.78Å
734	T	76.3	Confident	72.8	Confident	33 Å²	33	47.9 Å²	47.9	20%	0.202	26%	0.264	C	S	.	.	H	α-helix	trans	-62.3	-42.8	179.3	46.8	0	0	0	0	112.6	H730 Q731 N736 S737 Y834	H730-T734 VanDerWaalsContact CE1-CG2 3.47Å; H730-T734 WeakPolarHBondContact CE1-CG2 3.18Å; H730-T734 VanDerWaalsContact NE2-CG2 3.35Å; H730-T734 WeakPolarHBondContact NE2-CG2 3.41Å; H730-T734 WeakPolarHBondContact O-CG2 3.23Å; H730-T734 PolarHBondContact O-N 3.26Å; H730-T734 PolarHBondContact O-OG1 3.48Å; Q731-T734 PolarHBondContact O-OG1 3.08Å; T734-N736 PolarHBondContact O-N 3.05Å; T734-S737 PolarHBondContact O-N 3.38Å; T734-S737 VanDerWaalsContact O-N 3.16Å; T734-S737 PolarHBondContact O-OG 3.43Å; T734-Y834 WeakPolarHBondContact CG2-OH 3.26Å
735	N	66.2	Low	72.1	Confident	57 Å²	57	50.2 Å²	50.2	31%	0.305	28%	0.28	S	S	.	.	H	α-helix	trans	-60.3	-21	178.6	-73.9	-21.8	0	0	0	113	Q731 A733	Q731-N735 WeakPolarHBondContact O-CB 3.5Å; Q731-N735 PolarHBondContact O-N 2.98Å; Q731-N735 PolarHBondContact O-ND2 2.77Å; A733-N735 PolarHBondContact O-N 2.81Å
736	N	60.3	Low	71.2	Confident	25 Å²	25	57.3 Å²	57.3	13%	0.134	31%	0.311	C	S	.	.	H	α-helix	trans	-106.3	-12.7	-180	-69.9	-62.6	0	0	0	113.6	F732 A733 T734 L744	F732-N736 PolarHBondContact O-ND2 3.21Å; A733-N736 PolarHBondContact O-N 2.68Å; A733-N736 VanDerWaalsContact O-N 3.15Å; T734-N736 PolarHBondContact O-N 3.05Å; N736-L744 HydrophobicContact CB-CD2 3.69Å; N736-L744 VanDerWaalsContact CG-CD2 3.45Å; N736-L744 WeakPolarHBondContact ND2-CD2 3.34Å
737	S	53.4	Low	70.6	Confident	54 Å²	54	61 Å²	61	38%	0.378	32%	0.322	S	S	.	.	H	α-helix	trans	-83.9	-21.6	177.2	71.2	0	0	0	0	113.6	A733 T734	A733-S737 PolarHBondContact O-N 3.49Å; T734-S737 PolarHBondContact O-N 3.38Å; T734-S737 VanDerWaalsContact O-N 3.16Å; T734-S737 PolarHBondContact O-OG 3.43Å
738	I	49.2	Very low	70.3	Confident	139 Å²	139	61.6 Å²	61.6	71%	0.713	33%	0.325	S	S	*	.	S	Bend	trans	-73.2	-27.6	-175.8	-63.7	168	0	0	0	112
739	D	47.4	Very low	70.2	Confident	87 Å²	87	62.1 Å²	62.1	47%	0.465	33%	0.328	S	S	.	.	S	Bend	trans	-113.4	92.9	170.9	-78.9	-20.3	0	0	0	108.8	D741 K742	D739-D741 PolarHBondContact O-N 3.41Å; D739-K742 HydrophobicContact CB-CD 4.1Å; D739-K742 HydrophobicContact CB-CG 4.46Å; D739-K742 PolarHBondContact O-N 2.85Å; D739-K742 IonicContact OD2-NZ 3.57Å; D739-K742 PolarHBondContact OD2-NZ 3.3Å
740	S	49.9	Very low	69.9	Low	102 Å²	102	62.4 Å²	62.4	71%	0.713	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-10.9	-165.2	54.3	0	0	0	0	117.7
741	D	53.6	Low	69.9	Low	154 Å²	154	58.6 Å²	58.6	82%	0.824	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.3	-1.5	-175.6	-67.4	-19.6	0	0	0	114.6	D739 S743	D739-D741 PolarHBondContact O-N 3.41Å; D741-S743 PolarHBondContact O-N 2.93Å
742	K	63.2	Low	70.3	Confident	126 Å²	126	56.4 Å²	56.4	55%	0.548	30%	0.301	S	S	.	.			trans	-83.3	110	-179.3	-75.7	177.1	-176	157.6	0	111.1	D739 L744	D739-K742 HydrophobicContact CB-CD 4.1Å; D739-K742 HydrophobicContact CB-CG 4.46Å; D739-K742 PolarHBondContact O-N 2.85Å; D739-K742 IonicContact OD2-NZ 3.57Å; D739-K742 PolarHBondContact OD2-NZ 3.3Å; K742-L744 PolarHBondContact O-N 2.79Å
743	S	70	Confident	70.9	Confident	65 Å²	65	56.4 Å²	56.4	46%	0.455	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-57.6	136.5	165.9	66.4	0	0	0	0	110.4	D741 S745	D741-S743 PolarHBondContact O-N 2.93Å; S743-S745 PolarHBondContact O-N 3.14Å
744	L	75.5	Confident	71.4	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.01	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-50.7	136.6	177.2	-65.3	170.6	0	0	0	110.6	N736 K742 E748 H749 R845 W884	N736-L744 HydrophobicContact CB-CD2 3.69Å; N736-L744 VanDerWaalsContact CG-CD2 3.45Å; N736-L744 WeakPolarHBondContact ND2-CD2 3.34Å; K742-L744 PolarHBondContact O-N 2.79Å; L744-E748 HydrophobicContact CB-CB 4.39Å; L744-E748 HydrophobicContact CD2-CB 4.32Å; L744-H749 HydrophobicContact CB-CB 4.02Å; L744-H749 HydrophobicContact CD1-CB 4.38Å; L744-R845 VanDerWaalsContact O-CZ 3.23Å; L744-R845 PolarHBondContact O-NH1 3.34Å; L744-R845 PolarHBondContact O-NH2 2.86Å; L744-W884 HydrophobicContact CD1-CH2 4.39Å; L744-W884 HydrophobicContact CD1-CZ2 3.74Å
745	S	76.9	Confident	72.2	Confident	50 Å²	50	54.9 Å²	54.9	35%	0.35	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-60.1	159.6	171.2	73.6	0	0	0	0	110.4	S743 R747 E748 H749	S743-S745 PolarHBondContact O-N 3.14Å; S745-R747 PolarHBondContact O-N 2.9Å; S745-R747 VanDerWaalsContact O-N 3.08Å; S745-E748 WeakPolarHBondContact CB-OE2 3.43Å; S745-E748 PolarHBondContact N-OE2 3.49Å; S745-E748 PolarHBondContact O-N 2.66Å; S745-E748 VanDerWaalsContact OG-CG 3.3Å; S745-E748 WeakPolarHBondContact OG-CG 3.29Å; S745-E748 PolarHBondContact OG-N 3.45Å; S745-E748 PolarHBondContact OG-OE2 3.34Å; S745-H749 WeakPolarHBondContact O-CB 3.49Å; S745-H749 PolarHBondContact O-N 3.07Å
746	K	75.6	Confident	73.5	Confident	148 Å²	148	52.2 Å²	52.2	64%	0.643	28%	0.277	S	S	*	.	H	α-helix	trans	-55.3	-30.9	178.4	-66.9	-175	179.8	-176.1	0	112.9	F750 I978	K746-F750 WeakPolarHBondContact O-CB 3.31Å; K746-F750 PolarHBondContact O-N 3Å; K746-I978 VanDerWaalsContact NZ-CD1 3.31Å
747	R	77.6	Confident	75.1	Confident	90 Å²	90	51 Å²	51	34%	0.34	27%	0.271	S	S	.	.	H	α-helix	trans	-79.7	-42	180	-63.6	-179.5	-173.3	159.2	3.9	112	Y686 S745 F750 L751 L971	Y686-R747 HydrophobicContact CD1-CB 3.77Å; Y686-R747 HydrophobicContact CE1-CB 3.91Å; Y686-R747 HydrophobicContact CG-CB 4.4Å; S745-R747 PolarHBondContact O-N 2.9Å; S745-R747 VanDerWaalsContact O-N 3.08Å; R747-F750 PolarHBondContact O-N 3.37Å; R747-L751 WeakPolarHBondContact O-CG 3.35Å; R747-L751 PolarHBondContact O-N 2.96Å; R747-L971 HydrophobicContact CB-CD1 4.15Å; R747-L971 HydrophobicContact CG-CD1 4.23Å; R747-L971 HydrophobicContact CG-CD2 4.35Å
748	E	81.4	Confident	77.1	Confident	33 Å²	33	48.4 Å²	48.4	15%	0.154	25%	0.253	C	S	.	.	H	α-helix	trans	-66.6	-46.7	176.5	-68.7	158.2	149.7	0	0	110.4	Y686 F732 L744 S745 F750 L751 T752	Y686-E748 HydrophobicContact CE1-CG 4.14Å; F732-E748 HydrophobicContact CD1-CG 4.22Å; L744-E748 HydrophobicContact CB-CB 4.39Å; L744-E748 HydrophobicContact CD2-CB 4.32Å; S745-E748 WeakPolarHBondContact CB-OE2 3.43Å; S745-E748 PolarHBondContact N-OE2 3.49Å; S745-E748 PolarHBondContact O-N 2.66Å; S745-E748 VanDerWaalsContact OG-CG 3.3Å; S745-E748 WeakPolarHBondContact OG-CG 3.29Å; S745-E748 PolarHBondContact OG-N 3.45Å; S745-E748 PolarHBondContact OG-OE2 3.34Å; E748-F750 PolarHBondContact O-N 3.22Å; E748-L751 PolarHBondContact O-N 2.93Å; E748-L751 VanDerWaalsContact O-N 3.1Å; E748-T752 VanDerWaalsContact O-CB 3.27Å; E748-T752 WeakPolarHBondContact O-CB 3.28Å; E748-T752 PolarHBondContact O-N 3.37Å; E748-T752 PolarHBondContact O-OG1 3.3Å
749	H	84	Confident	79.2	Confident	10 Å²	10	41.9 Å²	41.9	5%	0.046	22%	0.219	C	C	.	.	H	α-helix	trans	-53.6	-44.1	174.9	-178.6	88.5	0	0	0	112.1	L744 S745 G753 R845 D881 W884 F953	L744-H749 HydrophobicContact CB-CB 4.02Å; L744-H749 HydrophobicContact CD1-CB 4.38Å; S745-H749 WeakPolarHBondContact O-CB 3.49Å; S745-H749 PolarHBondContact O-N 3.07Å; H749-G753 WeakPolarHBondContact O-CA 3.48Å; H749-G753 PolarHBondContact O-N 3.21Å; H749-R845 PolarHBondContact ND1-NE 3.47Å; H749-D881 IonicContact CD2-OD2 2.72Å; H749-D881 IonicContact CE1-OD2 3.3Å; H749-D881 IonicContact NE2-OD2 2.69Å; H749-D881 PolarHBondContact NE2-OD2 3.4Å; H749-W884 AromaticContact CE1-CE2 3.83Å; H749-W884 AromaticContact CE1-CZ2 3.77Å; H749-W884 AromaticContact CE1-NE1 3.53Å; H749-W884 AromaticContact ND1-CE2 3.98Å; H749-W884 AromaticContact ND1-CZ2 3.6Å; H749-W884 AromaticContact ND1-NE1 3.78Å; H749-F953 AromaticContact CD2-CE2 3.81Å; H749-F953 AromaticContact NE2-CE2 3.85Å
750	F	83.8	Confident	81.5	Confident	9 Å²	9	37.7 Å²	37.7	4%	0.039	20%	0.197	C	C	.	.	H	α-helix	trans	-60.7	-53.7	174.8	174.8	-85.8	0	0	0	111.8	S690 K746 R747 E748 R754 F953 R969 L971	S690-F750 WeakPolarHBondContact OG-CE1 3.28Å; K746-F750 WeakPolarHBondContact O-CB 3.31Å; K746-F750 PolarHBondContact O-N 3Å; R747-F750 PolarHBondContact O-N 3.37Å; E748-F750 PolarHBondContact O-N 3.22Å; F750-R754 HydrophobicContact CD1-CG 4.34Å; F750-R754 HydrophobicContact CE1-CG 4.02Å; F750-R754 HydrophobicContact CE2-CG 4.36Å; F750-R754 HydrophobicContact CZ-CG 4.01Å; F750-R754 WeakPolarHBondContact O-CB 3.2Å; F750-R754 WeakPolarHBondContact O-CG 3.19Å; F750-R754 PolarHBondContact O-N 3.29Å; F750-F953 HydrophobicContact CB-CZ 4.2Å; F750-F953 AromaticContact CD2-CE1 3.4Å; F750-F953 HydrophobicContact CD2-CE1 3.4Å; F750-F953 VanDerWaalsContact CD2-CE1 3.4Å; F750-F953 AromaticContact CD2-CZ 3.59Å; F750-F953 HydrophobicContact CD2-CZ 3.59Å; F750-F953 AromaticContact CE2-CE1 3.68Å; F750-F953 HydrophobicContact CE2-CE1 3.68Å; F750-F953 HydrophobicContact CE2-CZ 4.32Å; F750-F953 HydrophobicContact CG-CE1 4.21Å; F750-F953 HydrophobicContact CG-CZ 4.21Å; F750-R969 VanDerWaalsContact CE2-O 3.28Å; F750-R969 WeakPolarHBondContact CE2-O 3.32Å; F750-R969 WeakPolarHBondContact CZ-O 3.5Å; F750-L971 HydrophobicContact CB-CD2 3.92Å; F750-L971 HydrophobicContact CD1-CD1 4.07Å; F750-L971 HydrophobicContact CD1-CD2 3.71Å; F750-L971 HydrophobicContact CD1-CG 3.59Å; F750-L971 HydrophobicContact CD2-CD2 4.26Å; F750-L971 HydrophobicContact CE1-CD2 4.36Å; F750-L971 HydrophobicContact CE1-CG 3.89Å; F750-L971 HydrophobicContact CG-CD2 3.68Å; F750-L971 HydrophobicContact CG-CG 4.11Å
751	L	86.1	Confident	83.6	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-66.9	-46.7	-176.4	-66.8	-175.2	0	0	0	112.3	Y686 I689 L693 F732 R747 E748 G753 R754 C755 L971	Y686-L751 HydrophobicContact CD1-CD1 3.39Å; Y686-L751 HydrophobicContact CD1-CG 4.31Å; Y686-L751 HydrophobicContact CE1-CD1 3.88Å; Y686-L751 HydrophobicContact CG-CD1 4.4Å; I689-L751 HydrophobicContact CB-CD1 4.37Å; I689-L751 HydrophobicContact CG2-CD1 4.04Å; I689-L751 HydrophobicContact CG2-CD2 4.06Å; L693-L751 HydrophobicContact CD1-CB 4.42Å; L693-L751 HydrophobicContact CD1-CD2 3.5Å; F732-L751 HydrophobicContact CD2-CB 4.19Å; F732-L751 HydrophobicContact CE1-CD1 4.3Å; F732-L751 HydrophobicContact CE2-CB 3.77Å; F732-L751 HydrophobicContact CE2-CD1 3.65Å; F732-L751 HydrophobicContact CE2-CG 4.39Å; F732-L751 HydrophobicContact CZ-CB 4.3Å; F732-L751 HydrophobicContact CZ-CD1 3.42Å; F732-L751 VanDerWaalsContact CZ-CD1 3.42Å; R747-L751 WeakPolarHBondContact O-CG 3.35Å; R747-L751 PolarHBondContact O-N 2.96Å; E748-L751 PolarHBondContact O-N 2.93Å; E748-L751 VanDerWaalsContact O-N 3.1Å; L751-G753 VanDerWaalsContact C-N 3.34Å; L751-G753 PolarHBondContact O-N 3.2Å; L751-R754 WeakPolarHBondContact O-CB 3.45Å; L751-R754 PolarHBondContact O-N 3.42Å; L751-C755 PolarHBondContact O-N 2.87Å; L751-C755 PolarHBondContact O-SG 3.17Å; L751-L971 HydrophobicContact CD2-CD1 4.38Å; L751-L971 HydrophobicContact CG-CD1 4.44Å
752	T	88.8	Confident	85.4	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-62.5	-41.9	178.3	-51.6	0	0	0	0	110.9	F729 F732 E748 C755 A756 F838 W884	F729-T752 HydrophobicContact CD2-CG2 3.52Å; F729-T752 HydrophobicContact CE2-CG2 3.49Å; F729-T752 VanDerWaalsContact CE2-CG2 3.49Å; F732-T752 WeakPolarHBondContact CB-OG1 3.38Å; E748-T752 VanDerWaalsContact O-CB 3.27Å; E748-T752 WeakPolarHBondContact O-CB 3.28Å; E748-T752 PolarHBondContact O-N 3.37Å; E748-T752 PolarHBondContact O-OG1 3.3Å; T752-C755 PolarHBondContact O-N 2.81Å; T752-A756 WeakPolarHBondContact O-CB 3.32Å; T752-A756 PolarHBondContact O-N 3.29Å; T752-F838 HydrophobicContact CG2-CE2 4.03Å; T752-W884 HydrophobicContact CG2-CH2 3.68Å; T752-W884 HydrophobicContact CG2-CZ3 4.18Å
753	G	90.2	Very high	86.8	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-63.8	-42.1	177.9	0	0	0	0	0	112.1	H749 L751 A756 G757 W884 F953	H749-G753 WeakPolarHBondContact O-CA 3.48Å; H749-G753 PolarHBondContact O-N 3.21Å; L751-G753 VanDerWaalsContact C-N 3.34Å; L751-G753 PolarHBondContact O-N 3.2Å; G753-A756 PolarHBondContact O-N 3.42Å; G753-G757 PolarHBondContact O-N 2.85Å; G753-W884 VanDerWaalsContact CA-CH2 3.48Å; G753-F953 VanDerWaalsContact C-CB 3.42Å; G753-F953 VanDerWaalsContact O-CB 3.32Å; G753-F953 WeakPolarHBondContact O-CB 3.32Å
754	R	89.7	Confident	87.8	Confident	2 Å²	2	16.7 Å²	16.7	1%	0.008	8%	0.078	C	C	.	.	H	α-helix	trans	-60.3	-46.6	173.9	-70.1	-76.4	-61.2	169.7	3.4	112.4	L693 D697 F750 L751 L758 F953 Y962 F967 W968	L693-R754 HydrophobicContact CD1-CB 3.82Å; L693-R754 HydrophobicContact CD1-CG 4.43Å; L693-R754 PolarHBondContact O-NH2 3.27Å; D697-R754 VanDerWaalsContact CB-NH2 3.26Å; D697-R754 IonicContact OD1-CZ 3.83Å; D697-R754 IonicContact OD1-NH1 3.81Å; D697-R754 PolarHBondContact OD1-NH1 3.04Å; D697-R754 IonicContact OD1-NH2 3.26Å; D697-R754 PolarHBondContact OD1-NH2 3.23Å; F750-R754 HydrophobicContact CD1-CG 4.34Å; F750-R754 HydrophobicContact CE1-CG 4.02Å; F750-R754 HydrophobicContact CE2-CG 4.36Å; F750-R754 HydrophobicContact CZ-CG 4.01Å; F750-R754 WeakPolarHBondContact O-CB 3.2Å; F750-R754 WeakPolarHBondContact O-CG 3.19Å; F750-R754 PolarHBondContact O-N 3.29Å; L751-R754 WeakPolarHBondContact O-CB 3.45Å; L751-R754 PolarHBondContact O-N 3.42Å; R754-L758 WeakPolarHBondContact O-CG 3.43Å; R754-L758 PolarHBondContact O-N 3.39Å; R754-L758 VanDerWaalsContact O-N 3.13Å; R754-F953 VanDerWaalsContact CD-CD1 3.45Å; R754-F953 HydrophobicContact CG-CD1 3.67Å; R754-F953 HydrophobicContact CG-CE1 4.04Å; R754-F953 HydrophobicContact CG-CG 4.38Å; R754-Y962 VanDerWaalsContact NH1-CE1 3.28Å; R754-Y962 PolarHBondContact NH1-OH 3.24Å; R754-F967 WeakPolarHBondContact CD-O 3.4Å; R754-F967 PolarHBondContact NH1-O 3.36Å; R754-W968 VanDerWaalsContact NH1-CB 3.31Å
755	C	93.1	Very high	88.3	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-62	-47.3	176.6	-64.2	0	0	0	0	111	F729 L751 T752 G757 L758 L759	F729-C755 HydrophobicContact CB-CB 3.86Å; F729-C755 HydrophobicContact CD2-CB 4.25Å; L751-C755 PolarHBondContact O-N 2.87Å; L751-C755 PolarHBondContact O-SG 3.17Å; T752-C755 PolarHBondContact O-N 2.81Å; C755-G757 PolarHBondContact O-N 3.35Å; C755-L758 PolarHBondContact O-N 2.76Å; C755-L759 WeakPolarHBondContact O-CB 3.29Å; C755-L759 VanDerWaalsContact O-CG 3.24Å; C755-L759 WeakPolarHBondContact O-CG 3.31Å; C755-L759 PolarHBondContact O-N 3.09Å
756	A	93.8	Very high	88.8	Confident	0 Å²	0	16.7 Å²	16.7	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-60.4	-45.9	-179.5	0	0	0	0	0	112.4	F729 T752 G753 T760 L831 L835 W884	F729-A756 HydrophobicContact CD2-CB 4.2Å; F729-A756 HydrophobicContact CE2-CB 3.85Å; T752-A756 WeakPolarHBondContact O-CB 3.32Å; T752-A756 PolarHBondContact O-N 3.29Å; G753-A756 PolarHBondContact O-N 3.42Å; A756-T760 WeakPolarHBondContact O-CB 3.42Å; A756-T760 PolarHBondContact O-N 3.31Å; A756-T760 PolarHBondContact O-OG1 2.77Å; A756-L831 HydrophobicContact CB-CD1 4.29Å; A756-L835 HydrophobicContact CB-CD2 4.21Å; A756-W884 HydrophobicContact CB-CE3 4.33Å; A756-W884 HydrophobicContact CB-CZ3 3.77Å
757	G	94.5	Very high	89.3	Confident	0 Å²	0	9.9 Å²	9.9	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-64.1	-42.3	179	0	0	0	0	0	113	G753 C755 T761 F953	G753-G757 PolarHBondContact O-N 2.85Å; C755-G757 PolarHBondContact O-N 3.35Å; G757-T761 WeakPolarHBondContact O-CB 3.42Å; G757-T761 PolarHBondContact O-N 3.02Å; G757-T761 PolarHBondContact O-OG1 3.28Å; G757-F953 WeakPolarHBondContact CA-O 3.31Å
758	L	94.2	Very high	89.6	Confident	0 Å²	0	8.5 Å²	8.5	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-65.8	-48.5	176.3	-71.2	175	0	0	0	112	D697 L700 L701 L725 R754 C755 T760 T761 V762 P955	D697-L758 HydrophobicContact CB-CD1 4.29Å; D697-L758 HydrophobicContact CB-CD2 4.09Å; L700-L758 HydrophobicContact CD1-CB 4.33Å; L701-L758 HydrophobicContact CD1-CD2 4.15Å; L701-L758 HydrophobicContact CD2-CD2 4.44Å; L701-L758 HydrophobicContact CG-CD2 4.18Å; L725-L758 HydrophobicContact CD1-CB 4.06Å; L725-L758 HydrophobicContact CD1-CD1 4.15Å; L725-L758 HydrophobicContact CD2-CD1 4.43Å; R754-L758 WeakPolarHBondContact O-CG 3.43Å; R754-L758 PolarHBondContact O-N 3.39Å; R754-L758 VanDerWaalsContact O-N 3.13Å; C755-L758 PolarHBondContact O-N 2.76Å; L758-T760 VanDerWaalsContact C-N 3.32Å; L758-T760 PolarHBondContact O-N 3.17Å; L758-T761 PolarHBondContact O-N 3.25Å; L758-V762 WeakPolarHBondContact O-CG2 3.41Å; L758-V762 PolarHBondContact O-N 3.42Å; L758-P955 HydrophobicContact CD2-CG 4.31Å
759	L	95.1	Very high	89	Confident	1 Å²	1	8.9 Å²	8.9	1%	0.005	4%	0.042	C	C	.	.	H	α-helix	trans	-60.5	-43.1	178	-70.9	169	0	0	0	111.4	I722 L725 F729 C755 V762 L763 L831	I722-L759 HydrophobicContact CG2-CD2 3.91Å; L725-L759 HydrophobicContact CB-CD1 4.38Å; L725-L759 HydrophobicContact CB-CD2 3.97Å; L725-L759 HydrophobicContact CB-CG 4.13Å; F729-L759 HydrophobicContact CB-CD1 4.39Å; C755-L759 WeakPolarHBondContact O-CB 3.29Å; C755-L759 VanDerWaalsContact O-CG 3.24Å; C755-L759 WeakPolarHBondContact O-CG 3.31Å; C755-L759 PolarHBondContact O-N 3.09Å; L759-V762 PolarHBondContact O-N 3.41Å; L759-L763 WeakPolarHBondContact O-CB 3.29Å; L759-L763 PolarHBondContact O-N 3.01Å; L759-L831 HydrophobicContact CB-CD2 3.76Å; L759-L831 HydrophobicContact CD1-CD1 4.28Å; L759-L831 HydrophobicContact CD1-CD2 4.46Å
760	T	95.5	Very high	87.6	Confident	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-61.6	-45.3	176.2	-60.8	0	0	0	0	111.1	A756 L758 V762 L763 T764 C887 Q890 L891 L954	A756-T760 WeakPolarHBondContact O-CB 3.42Å; A756-T760 PolarHBondContact O-N 3.31Å; A756-T760 PolarHBondContact O-OG1 2.77Å; L758-T760 VanDerWaalsContact C-N 3.32Å; L758-T760 PolarHBondContact O-N 3.17Å; T760-V762 VanDerWaalsContact C-N 3.33Å; T760-V762 PolarHBondContact O-N 2.9Å; T760-L763 PolarHBondContact O-N 3.23Å; T760-T764 WeakPolarHBondContact O-CB 3.41Å; T760-T764 PolarHBondContact O-N 3.39Å; T760-T764 PolarHBondContact O-OG1 3.13Å; T760-C887 HydrophobicContact CG2-CB 4.08Å; T760-Q890 HydrophobicContact CG2-CB 4.48Å; T760-L891 HydrophobicContact CG2-CD1 4.03Å; T760-L891 HydrophobicContact CG2-CD2 4Å; T760-L891 HydrophobicContact CG2-CG 3.78Å; T760-L954 HydrophobicContact CG2-CD1 3.86Å
761	T	92.4	Very high	85.8	Confident	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-62.8	-39.6	179.5	-57.8	0	0	0	0	112.1	L701 Y704 G757 L758 R765 P955	L701-T761 HydrophobicContact CD2-CG2 3.74Å; Y704-T761 HydrophobicContact CE2-CG2 3.81Å; Y704-T761 PolarHBondContact OH-O 3.01Å; Y704-T761 VanDerWaalsContact OH-O 3.14Å; G757-T761 WeakPolarHBondContact O-CB 3.42Å; G757-T761 PolarHBondContact O-N 3.02Å; G757-T761 PolarHBondContact O-OG1 3.28Å; L758-T761 PolarHBondContact O-N 3.25Å; T761-R765 PolarHBondContact O-N 3.12Å; T761-P955 HydrophobicContact CG2-CG 4.49Å; T761-P955 VanDerWaalsContact OG1-CD 3.29Å; T761-P955 WeakPolarHBondContact OG1-CD 3.03Å; T761-P955 WeakPolarHBondContact OG1-CG 3.29Å; T761-P955 PolarHBondContact OG1-O 2.83Å
762	V	91.3	Very high	83.6	Confident	6 Å²	6	21.2 Å²	21.2	4%	0.036	11%	0.111	C	C	.	.	H	α-helix	trans	-66.5	-52	176.1	172.4	0	0	0	0	110.6	L700 I712 I722 L758 L759 T760 T764 R765 E766	L700-V762 HydrophobicContact CB-CG2 4.42Å; L700-V762 HydrophobicContact CD1-CG2 4.06Å; L700-V762 HydrophobicContact CD2-CG2 4.16Å; L700-V762 HydrophobicContact CG-CG2 4.45Å; I712-V762 HydrophobicContact CD1-CG1 4.4Å; I712-V762 HydrophobicContact CG2-CG1 4.47Å; I722-V762 HydrophobicContact CD1-CG1 3.73Å; I722-V762 HydrophobicContact CG1-CG1 4.3Å; L758-V762 WeakPolarHBondContact O-CG2 3.41Å; L758-V762 PolarHBondContact O-N 3.42Å; L759-V762 PolarHBondContact O-N 3.41Å; T760-V762 VanDerWaalsContact C-N 3.33Å; T760-V762 PolarHBondContact O-N 2.9Å; V762-T764 VanDerWaalsContact C-N 3.26Å; V762-T764 PolarHBondContact O-N 2.95Å; V762-R765 WeakPolarHBondContact O-CB 3.21Å; V762-R765 PolarHBondContact O-N 2.76Å; V762-R765 VanDerWaalsContact O-N 3.1Å; V762-E766 WeakPolarHBondContact O-CG 3.17Å; V762-E766 PolarHBondContact O-N 3.48Å; V762-E766 VanDerWaalsContact O-N 3.08Å
763	L	92.6	Very high	80.9	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-57.3	-42.5	178.7	179	60.6	0	0	0	111.5	L759 T760 R765 E766 L767 Y802 F828 L891 Y896	L759-L763 WeakPolarHBondContact O-CB 3.29Å; L759-L763 PolarHBondContact O-N 3.01Å; T760-L763 PolarHBondContact O-N 3.23Å; L763-R765 VanDerWaalsContact C-N 3.29Å; L763-R765 PolarHBondContact O-N 2.86Å; L763-E766 PolarHBondContact O-N 2.84Å; L763-L767 HydrophobicContact CD1-CD1 4.03Å; L763-L767 HydrophobicContact CD1-CG 4.13Å; L763-L767 HydrophobicContact CG-CD1 3.91Å; L763-L767 HydrophobicContact CG-CG 4.41Å; L763-L767 VanDerWaalsContact O-CG 3.29Å; L763-L767 WeakPolarHBondContact O-CG 3.06Å; L763-L767 PolarHBondContact O-N 3.16Å; L763-Y802 HydrophobicContact CD1-CD1 3.83Å; L763-Y802 HydrophobicContact CD1-CD2 3.97Å; L763-Y802 HydrophobicContact CD1-CE1 4.37Å; L763-Y802 HydrophobicContact CD1-CE2 4.49Å; L763-Y802 HydrophobicContact CD1-CG 3.58Å; L763-F828 HydrophobicContact CB-CD1 3.98Å; L763-F828 HydrophobicContact CB-CE1 3.71Å; L763-F828 HydrophobicContact CB-CZ 4.36Å; L763-F828 HydrophobicContact CD1-CD1 4.15Å; L763-F828 HydrophobicContact CD1-CD2 4.4Å; L763-F828 HydrophobicContact CD1-CE1 4.31Å; L763-F828 HydrophobicContact CD1-CG 4.17Å; L763-F828 HydrophobicContact CD2-CB 4.22Å; L763-F828 HydrophobicContact CD2-CD1 3.64Å; L763-F828 HydrophobicContact CD2-CE1 4.27Å; L763-F828 HydrophobicContact CD2-CG 4.06Å; L763-F828 HydrophobicContact CG-CD1 4.13Å; L763-F828 HydrophobicContact CG-CE1 4.31Å; L763-L891 HydrophobicContact CB-CD2 4.32Å; L763-L891 HydrophobicContact CD2-CD1 4.24Å; L763-L891 HydrophobicContact CD2-CD2 3.64Å; L763-L891 HydrophobicContact CG-CD2 3.99Å; L763-Y896 HydrophobicContact CD2-CD1 4.28Å; L763-Y896 HydrophobicContact CD2-CE1 4.21Å; L763-Y896 HydrophobicContact CD2-CG 4.48Å
764	T	91.1	Very high	78	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-62.8	-39.5	-180	-48.8	0	0	0	0	111.4	T760 V762 L767 L768 Q890 V894 I957	T760-T764 WeakPolarHBondContact O-CB 3.41Å; T760-T764 PolarHBondContact O-N 3.39Å; T760-T764 PolarHBondContact O-OG1 3.13Å; V762-T764 VanDerWaalsContact C-N 3.26Å; V762-T764 PolarHBondContact O-N 2.95Å; T764-L767 PolarHBondContact O-N 3.37Å; T764-L768 HydrophobicContact CG2-CD1 4.1Å; T764-L768 VanDerWaalsContact O-CG 3.27Å; T764-L768 WeakPolarHBondContact O-CG 3.45Å; T764-L768 PolarHBondContact O-N 2.94Å; T764-L768 VanDerWaalsContact O-N 3.09Å; T764-Q890 HydrophobicContact CG2-CG 3.99Å; T764-Q890 PolarHBondContact OG1-NE2 2.88Å; T764-V894 HydrophobicContact CG2-CB 4.1Å; T764-V894 HydrophobicContact CG2-CG1 4.27Å; T764-V894 HydrophobicContact CG2-CG2 3.41Å; T764-V894 VanDerWaalsContact CG2-CG2 3.41Å; T764-I957 HydrophobicContact CG2-CD1 3.38Å; T764-I957 HydrophobicContact CG2-CG1 4.33Å
765	R	86.8	Confident	75.4	Confident	27 Å²	27	39.4 Å²	39.4	10%	0.102	20%	0.2	C	C	.	.	H	α-helix	trans	-61	-49.3	174.8	-162.8	160.6	159.7	-152.3	1.9	112.3	P703 Y704 V710 I712 T761 V762 L763 L767 L768 H769	P703-R765 VanDerWaalsContact CB-NH1 3.26Å; Y704-R765 HydrophobicContact CE1-CG 4.36Å; Y704-R765 WeakPolarHBondContact OH-CB 3.38Å; Y704-R765 VanDerWaalsContact OH-CD 3.25Å; Y704-R765 WeakPolarHBondContact OH-CD 3.23Å; V710-R765 PolarHBondContact O-NH2 2.91Å; I712-R765 HydrophobicContact CD1-CB 3.67Å; I712-R765 VanDerWaalsContact CD1-CD 3.45Å; I712-R765 HydrophobicContact CD1-CG 3.71Å; I712-R765 VanDerWaalsContact CG1-NH1 3.33Å; T761-R765 PolarHBondContact O-N 3.12Å; V762-R765 WeakPolarHBondContact O-CB 3.21Å; V762-R765 PolarHBondContact O-N 2.76Å; V762-R765 VanDerWaalsContact O-N 3.1Å; L763-R765 VanDerWaalsContact C-N 3.29Å; L763-R765 PolarHBondContact O-N 2.86Å; R765-L767 PolarHBondContact O-N 3.4Å; R765-L768 PolarHBondContact O-N 3.47Å; R765-L768 VanDerWaalsContact O-N 3.08Å; R765-H769 PolarHBondContact O-N 2.93Å
766	E	86.9	Confident	72.4	Confident	25 Å²	25	42.3 Å²	42.3	12%	0.117	23%	0.23	C	C	.	.	H	α-helix	trans	-63.5	-29.3	-177.1	-69.2	-65.9	93.6	0	0	111.8	I712 V762 L763 P770 Y802	I712-E766 WeakPolarHBondContact CB-OE1 3.49Å; I712-E766 HydrophobicContact CD1-CG 4.04Å; I712-E766 WeakPolarHBondContact CD1-OE1 3.42Å; V762-E766 WeakPolarHBondContact O-CG 3.17Å; V762-E766 PolarHBondContact O-N 3.48Å; V762-E766 VanDerWaalsContact O-N 3.08Å; L763-E766 PolarHBondContact O-N 2.84Å; E766-P770 WeakPolarHBondContact O-CD 3.21Å; E766-P770 WeakPolarHBondContact O-CG 3.32Å; E766-Y802 HydrophobicContact CB-CD2 4.2Å; E766-Y802 HydrophobicContact CB-CE2 3.57Å; E766-Y802 HydrophobicContact CG-CE2 4.02Å
767	L	87.3	Confident	69.4	Low	5 Å²	5	47.2 Å²	47.2	3%	0.026	26%	0.264	C	S	.	.	H	α-helix	trans	-79.9	-27.2	175	-68.6	173.6	0	0	0	113.2	L763 T764 R765 T771 M800 Y802 V894 Y896	L763-L767 HydrophobicContact CD1-CD1 4.03Å; L763-L767 HydrophobicContact CD1-CG 4.13Å; L763-L767 HydrophobicContact CG-CD1 3.91Å; L763-L767 HydrophobicContact CG-CG 4.41Å; L763-L767 VanDerWaalsContact O-CG 3.29Å; L763-L767 WeakPolarHBondContact O-CG 3.06Å; L763-L767 PolarHBondContact O-N 3.16Å; T764-L767 PolarHBondContact O-N 3.37Å; R765-L767 PolarHBondContact O-N 3.4Å; L767-T771 PolarHBondContact O-OG1 3.47Å; L767-M800 HydrophobicContact CB-CE 4.16Å; L767-M800 HydrophobicContact CD2-CB 3.92Å; L767-M800 WeakPolarHBondContact O-CE 3.46Å; L767-Y802 HydrophobicContact CD2-CD2 4.46Å; L767-V894 HydrophobicContact CB-CG1 3.49Å; L767-V894 VanDerWaalsContact CB-CG1 3.49Å; L767-V894 HydrophobicContact CD1-CG1 4.14Å; L767-V894 HydrophobicContact CG-CG1 4.49Å; L767-Y896 HydrophobicContact CD1-CD2 3.8Å; L767-Y896 HydrophobicContact CD1-CG 4.11Å; L767-Y896 HydrophobicContact CD2-CD2 4.4Å
768	L	84	Confident	66.3	Low	61 Å²	61	54.8 Å²	54.8	32%	0.319	30%	0.299	S	S	.	.	H	α-helix	trans	-83.6	-28.6	176.2	-68.9	172.8	0	0	0	113.1	T764 R765 T771 E772 V894 I957	T764-L768 HydrophobicContact CG2-CD1 4.1Å; T764-L768 VanDerWaalsContact O-CG 3.27Å; T764-L768 WeakPolarHBondContact O-CG 3.45Å; T764-L768 PolarHBondContact O-N 2.94Å; T764-L768 VanDerWaalsContact O-N 3.09Å; R765-L768 PolarHBondContact O-N 3.47Å; R765-L768 VanDerWaalsContact O-N 3.08Å; L768-T771 PolarHBondContact O-N 3.11Å; L768-T771 VanDerWaalsContact O-N 3.14Å; L768-T771 PolarHBondContact O-OG1 3.48Å; L768-E772 PolarHBondContact O-N 3.01Å; L768-V894 HydrophobicContact CD1-CG2 4.49Å; L768-V894 HydrophobicContact CD2-CG1 4.02Å; L768-V894 HydrophobicContact CD2-CG2 4.1Å; L768-V894 HydrophobicContact CG-CG1 4.1Å; L768-V894 HydrophobicContact CG-CG2 4.31Å; L768-I957 HydrophobicContact CD1-CD1 4.32Å; L768-I957 HydrophobicContact CD1-CG2 4.32Å
769	H	68.5	Low	63.1	Low	40 Å²	40	65.5 Å²	65.5	19%	0.185	34%	0.34	C	S	.	.	H	α-helix	trans	-61.8	-37.8	-177.7	-150.2	-47.6	0	0	0	114.7	R765 T771	R765-H769 PolarHBondContact O-N 2.93Å; H769-T771 VanDerWaalsContact C-N 3.25Å; H769-T771 PolarHBondContact O-N 3.31Å
770	P	54.3	Low	59.9	Low	72 Å²	72	72 Å²	72	47%	0.468	38%	0.375	S	S	.	.	H	α-helix	trans	-64.9	-27.2	174.3	-22	31.7	0	0	0	113.3	E766	E766-P770 WeakPolarHBondContact O-CD 3.21Å; E766-P770 WeakPolarHBondContact O-CG 3.32Å
771	T	44.8	Very low	56.7	Low	68 Å²	68	79.6 Å²	79.6	42%	0.417	42%	0.415	S	S	.	.	H	α-helix	trans	-80.2	-31.5	-177.1	5.2	0	0	0	0	112.1	L767 L768 H769 T775	L767-T771 PolarHBondContact O-OG1 3.47Å; L768-T771 PolarHBondContact O-N 3.11Å; L768-T771 VanDerWaalsContact O-N 3.14Å; L768-T771 PolarHBondContact O-OG1 3.48Å; H769-T771 VanDerWaalsContact C-N 3.25Å; H769-T771 PolarHBondContact O-N 3.31Å; T771-T775 WeakPolarHBondContact O-CG2 3.43Å; T771-T775 PolarHBondContact O-N 3.37Å; T771-T775 PolarHBondContact O-OG1 3.45Å
772	E	40.2	Very low	53.7	Low	139 Å²	139	86.9 Å²	86.9	65%	0.65	45%	0.452	S	S	*	.	H	α-helix	trans	-72.3	-33.2	176.8	-69.8	-173.5	171.2	0	0	113.2	L768 T775 G776	L768-E772 PolarHBondContact O-N 3.01Å; E772-T775 WeakPolarHBondContact CA-OG1 3.43Å; E772-T775 PolarHBondContact O-OG1 3.16Å; E772-T775 VanDerWaalsContact O-OG1 3.14Å; E772-G776 PolarHBondContact O-N 2.79Å
773	Q	32.5	Very low	50.7	Low	140 Å²	140	94.8 Å²	94.8	65%	0.654	49%	0.494	S	S	*	.	H	α-helix	trans	-74.3	-32.3	176.6	-73.8	-174.3	-3.1	0	0	113.1
774	K	30.4	Very low	47.9	Very low	155 Å²	155	100.6 Å²	100.6	67%	0.674	53%	0.529	S	S	*	.	H	α-helix	trans	-71.6	-38.7	175.8	-74.6	-175.8	175.8	-176.5	0	112.4	G776 S777	K774-G776 VanDerWaalsContact C-N 3.25Å; K774-G776 PolarHBondContact O-N 3.5Å; K774-S777 PolarHBondContact O-N 2.8Å
775	T	34.7	Very low	44.9	Very low	88 Å²	88	107.4 Å²	107.4	54%	0.54	57%	0.566	S	S	.	*	H	α-helix	trans	-70.4	-18	179.7	47.4	0	0	0	0	114.1	T771 E772 S777	T771-T775 WeakPolarHBondContact O-CG2 3.43Å; T771-T775 PolarHBondContact O-N 3.37Å; T771-T775 PolarHBondContact O-OG1 3.45Å; E772-T775 WeakPolarHBondContact CA-OG1 3.43Å; E772-T775 PolarHBondContact O-OG1 3.16Å; E772-T775 VanDerWaalsContact O-OG1 3.14Å; T775-S777 VanDerWaalsContact C-N 3.35Å
776	G	29.6	Very low	42.1	Very low	61 Å²	61	113.8 Å²	113.8	63%	0.629	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-21.7	171.8	0	0	0	0	0	114.7	E772 K774	E772-G776 PolarHBondContact O-N 2.79Å; K774-G776 VanDerWaalsContact C-N 3.25Å; K774-G776 PolarHBondContact O-N 3.5Å
777	S	31.6	Very low	39.4	Very low	104 Å²	104	118.5 Å²	118.5	73%	0.727	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.1	-15.9	-175.5	-53.5	0	0	0	0	113.7	K774 T775	K774-S777 PolarHBondContact O-N 2.8Å; T775-S777 VanDerWaalsContact C-N 3.35Å
778	E	28.7	Very low	36.5	Very low	158 Å²	158	123.4 Å²	123.4	74%	0.738	67%	0.666	S	S	*	*			trans	-110.3	22.6	-177.5	-72.5	-177.4	167.6	0	0	113.7	N780	E778-N780 PolarHBondContact O-N 2.65Å
779	R	26.7	Very low	33.9	Very low	226 Å²	226	125.9 Å²	125.9	85%	0.853	68%	0.684	S	S	*	*			trans	-80.6	11.1	170.7	-94.6	-170.6	-178.9	-177.6	1.8	115.1
780	N	27.8	Very low	31.8	Very low	138 Å²	138	128.2 Å²	128.2	74%	0.738	71%	0.705	S	S	*	*	S	Bend	trans	-108	119.4	163.6	-71.3	-17.8	0	0	0	107.9	E778	E778-N780 PolarHBondContact O-N 2.65Å
781	L	28.7	Very low	30.6	Very low	159 Å²	159	133.5 Å²	133.5	83%	0.832	73%	0.726	S	S	*	*	S	Bend	trans	89.6	94.5	176.3	-51.5	151.9	0	0	0	113.7
782	I	29.6	Very low	29.7	Very low	152 Å²	152	137.3 Å²	137.3	78%	0.779	74%	0.743	S	S	*	*				177.7	97.1	110.7	-79.3	150.9	0	0	0	106.2	V784	I782-V784 HydrophobicContact CG2-CB 4.12Å; I782-V784 HydrophobicContact CG2-CG2 3.75Å; I782-V784 PolarHBondContact O-N 2.97Å
783	D	27.3	Very low	29.2	Very low	172 Å²	172	135 Å²	135	92%	0.92	74%	0.739	S	S	*	*			trans	-70.1	106.8	151.4	-81.5	-39.6	0	0	0	106.6
784	V	33.9	Very low	29.1	Very low	123 Å²	123	137.2 Å²	137.2	75%	0.745	75%	0.749	S	S	*	*			trans	-141.7	118.2	156.7	177	0	0	0	0	108.5	I782	I782-V784 HydrophobicContact CG2-CB 4.12Å; I782-V784 HydrophobicContact CG2-CG2 3.75Å; I782-V784 PolarHBondContact O-N 2.97Å
785	D	29.5	Very low	29.4	Very low	143 Å²	143	135.8 Å²	135.8	77%	0.765	74%	0.743	S	S	*	*			trans	-54.6	154.3	171.6	-63.5	-57.7	0	0	0	113.9
786	D	27.7	Very low	29.7	Very low	161 Å²	161	135.4 Å²	135.4	86%	0.861	74%	0.744	S	S	*	*			trans	35.9	90.3	147.9	-77.6	-22	0	0	0	118.1
787	V	30.5	Very low	30.6	Very low	123 Å²	123	136.6 Å²	136.6	75%	0.745	74%	0.742	S	S	*	*			trans	-136.3	112.3	141.2	-171.9	0	0	0	0	108.9	V789	V787-V789 PolarHBondContact O-N 3.15Å
788	S	25.9	Very low	31.8	Very low	108 Å²	108	139.1 Å²	139.1	76%	0.755	74%	0.742	S	S	*	*			trans	-42.9	108.5	162.5	49.5	0	0	0	0	110.5	S790	S788-S790 VanDerWaalsContact C-N 3.32Å; S788-S790 PolarHBondContact O-N 3.08Å
789	V	29.4	Very low	33.7	Very low	113 Å²	113	132.6 Å²	132.6	69%	0.685	72%	0.717	S	S	*	*			trans	-70	91.1	177.9	-177.9	0	0	0	0	108.6	V787 M791 V793	V787-V789 PolarHBondContact O-N 3.15Å; V789-M791 PolarHBondContact O-N 2.92Å; V789-V793 HydrophobicContact CG1-CG2 3.89Å
790	S	25	Very low	36.3	Very low	90 Å²	90	124.7 Å²	124.7	63%	0.629	69%	0.691	S	S	*	*			trans	-52	130	150	46.8	0	0	0	0	108.2	S788 D792	S788-S790 VanDerWaalsContact C-N 3.32Å; S788-S790 PolarHBondContact O-N 3.08Å; S790-D792 PolarHBondContact O-N 3.14Å
791	M	28	Very low	38.9	Very low	183 Å²	183	126.2 Å²	126.2	90%	0.901	69%	0.694	S	S	*	*	S	Bend	trans	-63.8	21.2	-176.4	-87.5	-173	-178.5	0	0	115.8	V789	V789-M791 PolarHBondContact O-N 2.92Å
792	D	25	Very low	41.7	Very low	148 Å²	148	120.3 Å²	120.3	79%	0.791	66%	0.661	S	S	*	*			trans	-107.3	50.4	170.5	-65.9	-37.2	0	0	0	109.6	S790 E794	S790-D792 PolarHBondContact O-N 3.14Å; D792-E794 VanDerWaalsContact C-N 3.31Å; D792-E794 PolarHBondContact O-N 3.35Å
793	V	31.7	Very low	44.3	Very low	91 Å²	91	118 Å²	118	55%	0.552	65%	0.65	S	S	*	*			trans	-64.6	106.9	154.2	178.7	0	0	0	0	104.2	V789 F795	V789-V793 HydrophobicContact CG1-CG2 3.89Å; V793-F795 VanDerWaalsContact O-CD2 3.23Å; V793-F795 WeakPolarHBondContact O-CD2 3.37Å; V793-F795 PolarHBondContact O-N 3.3Å
794	E	28.8	Very low	47.1	Very low	185 Å²	185	111 Å²	111	86%	0.864	61%	0.611	S	S	*	*			trans	-46	96.1	163.5	-74.1	-177.5	151	0	0	107.2	D792 S796	D792-E794 VanDerWaalsContact C-N 3.31Å; D792-E794 PolarHBondContact O-N 3.35Å; E794-S796 VanDerWaalsContact C-N 3.3Å; E794-S796 PolarHBondContact O-N 2.74Å
795	F	36.8	Very low	49.6	Very low	126 Å²	126	110.7 Å²	110.7	55%	0.553	60%	0.604	S	S	*	*			trans	-61.7	99.4	-178.5	-87.3	-96.5	0	0	0	105.8	V793 S797	V793-F795 VanDerWaalsContact O-CD2 3.23Å; V793-F795 WeakPolarHBondContact O-CD2 3.37Å; V793-F795 PolarHBondContact O-N 3.3Å; F795-S797 PolarHBondContact O-N 3.06Å
796	S	40.6	Very low	52.3	Low	79 Å²	79	106.4 Å²	106.4	55%	0.552	58%	0.577	S	S	*	*			trans	-36.2	112.4	172.5	59	0	0	0	0	108.3	E794 H798	E794-S796 VanDerWaalsContact C-N 3.3Å; E794-S796 PolarHBondContact O-N 2.74Å; S796-H798 PolarHBondContact O-N 3.31Å
797	S	48.6	Very low	55.2	Low	86 Å²	86	98.7 Å²	98.7	60%	0.601	54%	0.536	S	S	*	.	S	Bend	trans	-64.8	-3.9	-167.1	55.1	0	0	0	0	114.1	F795 G799	F795-S797 PolarHBondContact O-N 3.06Å; S797-G799 PolarHBondContact O-N 2.9Å
798	H	57.6	Low	57.8	Low	157 Å²	157	93.4 Å²	93.4	73%	0.727	50%	0.502	S	S	*	.			trans	-85.2	91.9	-177	-60.9	4.3	0	0	0	109	S796	S796-H798 PolarHBondContact O-N 3.31Å
799	G	69.2	Low	60.6	Low	21 Å²	21	92 Å²	92	22%	0.216	49%	0.486	C	S	.	.	P	Polyproline II helix	trans	-63.8	152	163.3	0	0	0	0	0	110.6	S797 K895	S797-G799 PolarHBondContact O-N 2.9Å; G799-K895 CarbonylContact C-O 3.57Å; G799-K895 WeakPolarHBondContact CA-O 3.27Å
800	M	80.6	Confident	63.2	Low	60 Å²	60	90.9 Å²	90.9	30%	0.296	47%	0.472	S	S	.	.	B	Isolated β-bridge	trans	-74.8	126.8	178.2	-64.8	-163.5	-83.6	0	0	110	L767 V894 K895 Y896 S897	L767-M800 HydrophobicContact CB-CE 4.16Å; L767-M800 HydrophobicContact CD2-CB 3.92Å; L767-M800 WeakPolarHBondContact O-CE 3.46Å; M800-V894 HydrophobicContact CE-CG1 3.9Å; M800-V894 WeakPolarHBondContact CE-O 3.32Å; M800-K895 PolarHBondContact N-O 3.37Å; M800-Y896 VanDerWaalsContact O-CD2 3.22Å; M800-Y896 WeakPolarHBondContact O-CD2 3.41Å; M800-S897 PolarHBondContact O-N 3.08Å; M800-S897 PolarHBondContact O-OG 3.23Å
801	E	83	Confident	66	Low	170 Å²	170	86.6 Å²	86.6	79%	0.794	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-86.9	147.2	169	-65.6	-172.7	167.3	0	0	110
802	Y	86.5	Confident	68.4	Low	35 Å²	35	84 Å²	84	14%	0.137	42%	0.423	C	S	.	.			trans	-119.9	122.8	178.5	179.5	-99.3	0	0	0	109.8	L763 E766 L767 E804 W806 F828	L763-Y802 HydrophobicContact CD1-CD1 3.83Å; L763-Y802 HydrophobicContact CD1-CD2 3.97Å; L763-Y802 HydrophobicContact CD1-CE1 4.37Å; L763-Y802 HydrophobicContact CD1-CE2 4.49Å; L763-Y802 HydrophobicContact CD1-CG 3.58Å; E766-Y802 HydrophobicContact CB-CD2 4.2Å; E766-Y802 HydrophobicContact CB-CE2 3.57Å; E766-Y802 HydrophobicContact CG-CE2 4.02Å; L767-Y802 HydrophobicContact CD2-CD2 4.46Å; Y802-E804 HydrophobicContact CD1-CB 4.21Å; Y802-E804 HydrophobicContact CE1-CB 3.93Å; Y802-W806 AromaticContact CZ-NE1 3.78Å; Y802-W806 WeakPolarHBondContact OH-CZ2 3.42Å; Y802-W806 PolarHBondContact OH-NE1 2.92Å; Y802-F828 AromaticContact CD1-CD2 3.59Å; Y802-F828 HydrophobicContact CD1-CD2 3.59Å; Y802-F828 AromaticContact CD1-CE2 3.8Å; Y802-F828 HydrophobicContact CD1-CE2 3.8Å; Y802-F828 HydrophobicContact CD1-CG 4.46Å; Y802-F828 AromaticContact CE1-CD2 3.62Å; Y802-F828 HydrophobicContact CE1-CD2 3.62Å; Y802-F828 AromaticContact CE1-CE2 3.32Å; Y802-F828 HydrophobicContact CE1-CE2 3.32Å; Y802-F828 HydrophobicContact CE1-CZ 4.24Å
803	N	84.6	Confident	71	Confident	103 Å²	103	80.9 Å²	80.9	55%	0.551	41%	0.412	S	S	*	.			trans	-86.1	110.6	175.6	-176.9	4	0	0	0	110.3	M805 W806	N803-M805 VanDerWaalsContact OD1-CB 3.25Å; N803-M805 WeakPolarHBondContact OD1-CB 3.46Å; N803-M805 VanDerWaalsContact OD1-CG 3.28Å; N803-M805 WeakPolarHBondContact OD1-CG 3.25Å; N803-M805 PolarHBondContact OD1-N 3.35Å; N803-W806 VanDerWaalsContact O-CD1 3.22Å
804	E	86.8	Confident	73.3	Confident	25 Å²	25	77.7 Å²	77.7	12%	0.117	39%	0.39	C	S	.	.			trans	-92	1.2	177.3	56.8	173.3	-125.2	0	0	114.5	Y802 W806 L807 S826 I827 F828	Y802-E804 HydrophobicContact CD1-CB 4.21Å; Y802-E804 HydrophobicContact CE1-CB 3.93Å; E804-W806 VanDerWaalsContact C-N 3.26Å; E804-W806 PolarHBondContact O-N 2.96Å; E804-L807 HydrophobicContact CB-CD1 4.08Å; E804-L807 WeakPolarHBondContact O-CB 3.31Å; E804-L807 PolarHBondContact O-N 2.99Å; E804-L807 VanDerWaalsContact O-N 3.08Å; E804-S826 WeakPolarHBondContact OE1-CA 3.26Å; E804-I827 VanDerWaalsContact CD-N 3.31Å; E804-I827 PolarHBondContact OE1-N 2.94Å; E804-I827 WeakPolarHBondContact OE2-CB 3.5Å; E804-I827 PolarHBondContact OE2-N 3.44Å; E804-F828 HydrophobicContact CB-CD2 4.2Å; E804-F828 HydrophobicContact CB-CE2 4.39Å; E804-F828 WeakPolarHBondContact OE2-CD2 3.46Å; E804-F828 PolarHBondContact OE2-N 3.22Å
805	M	85.5	Confident	75.6	Confident	118 Å²	118	69.9 Å²	69.9	58%	0.581	35%	0.354	S	S	*	.	H	α-helix	trans	-57.5	-37.7	-177.6	-72.9	-176.5	63.8	0	0	113.1	N803 L807 W808 D809	N803-M805 VanDerWaalsContact OD1-CB 3.25Å; N803-M805 WeakPolarHBondContact OD1-CB 3.46Å; N803-M805 VanDerWaalsContact OD1-CG 3.28Å; N803-M805 WeakPolarHBondContact OD1-CG 3.25Å; N803-M805 PolarHBondContact OD1-N 3.35Å; M805-L807 PolarHBondContact O-N 3.45Å; M805-W808 PolarHBondContact O-N 3.06Å; M805-D809 PolarHBondContact O-N 3.36Å
806	W	86.6	Confident	77.4	Confident	52 Å²	52	67.1 Å²	67.1	20%	0.197	35%	0.351	C	S	.	.	H	α-helix	trans	-61.4	-28.1	-179.5	74.7	-96.2	0	0	0	112.9	V718 Y802 N803 E804 K810	V718-W806 HydrophobicContact CG1-CH2 4.05Å; Y802-W806 AromaticContact CZ-NE1 3.78Å; Y802-W806 WeakPolarHBondContact OH-CZ2 3.42Å; Y802-W806 PolarHBondContact OH-NE1 2.92Å; N803-W806 VanDerWaalsContact O-CD1 3.22Å; E804-W806 VanDerWaalsContact C-N 3.26Å; E804-W806 PolarHBondContact O-N 2.96Å; W806-K810 HydrophobicContact CE3-CD 4.08Å; W806-K810 HydrophobicContact CZ3-CD 4.22Å; W806-K810 WeakPolarHBondContact O-CG 3.45Å; W806-K810 PolarHBondContact O-N 2.91Å
807	L	88.4	Confident	78.5	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-63.3	-50.2	174.9	-65.6	171	0	0	0	109.2	S719 I722 I723 E804 M805 K810 L811 I827 F828	S719-L807 PolarHBondContact OG-O 2.87Å; I722-L807 HydrophobicContact CB-CD2 4.3Å; I722-L807 HydrophobicContact CD1-CD2 3.64Å; I722-L807 HydrophobicContact CG2-CD1 3.82Å; I722-L807 HydrophobicContact CG2-CD2 4.34Å; I723-L807 HydrophobicContact CD1-CB 4.2Å; I723-L807 HydrophobicContact CG1-CB 4.4Å; E804-L807 HydrophobicContact CB-CD1 4.08Å; E804-L807 WeakPolarHBondContact O-CB 3.31Å; E804-L807 PolarHBondContact O-N 2.99Å; E804-L807 VanDerWaalsContact O-N 3.08Å; M805-L807 PolarHBondContact O-N 3.45Å; L807-K810 PolarHBondContact O-N 3.08Å; L807-L811 PolarHBondContact O-N 3.38Å; L807-L811 VanDerWaalsContact O-N 3.15Å; L807-I827 HydrophobicContact CD1-CD1 4.21Å; L807-F828 HydrophobicContact CD1-CE2 3.92Å
808	W	85.3	Confident	79.4	Confident	11 Å²	11	71.5 Å²	71.5	4%	0.042	36%	0.356	C	S	.	.	H	α-helix	trans	-67.7	-39.9	-178.3	-63.3	110	0	0	0	112.8	I723 M805 K810 L811 R812 I820 L823 G825 I827	I723-W808 HydrophobicContact CD1-CD2 4.27Å; I723-W808 HydrophobicContact CD1-CE3 3.9Å; I723-W808 HydrophobicContact CD1-CZ3 4.15Å; I723-W808 HydrophobicContact CG1-CZ3 4.4Å; I723-W808 HydrophobicContact CG2-CE3 4.48Å; I723-W808 HydrophobicContact CG2-CH2 3.74Å; I723-W808 HydrophobicContact CG2-CZ3 3.66Å; M805-W808 PolarHBondContact O-N 3.06Å; W808-K810 VanDerWaalsContact C-N 3.3Å; W808-K810 PolarHBondContact O-N 3.15Å; W808-L811 HydrophobicContact CE3-CD2 4.19Å; W808-L811 HydrophobicContact CZ3-CD2 4.12Å; W808-L811 PolarHBondContact O-N 3.04Å; W808-R812 PolarHBondContact O-N 3.28Å; W808-R812 VanDerWaalsContact O-N 3.1Å; W808-I820 HydrophobicContact CE3-CG2 4.26Å; W808-L823 HydrophobicContact CH2-CB 4.38Å; W808-L823 WeakPolarHBondContact CH2-O 3.46Å; W808-L823 HydrophobicContact CZ3-CB 4.24Å; W808-G825 WeakPolarHBondContact CZ2-O 3.37Å; W808-I827 HydrophobicContact CH2-CD1 4.41Å; W808-I827 HydrophobicContact CZ2-CD1 3.66Å; W808-I827 HydrophobicContact CZ2-CG1 3.68Å
809	D	84.9	Confident	79.7	Confident	80 Å²	80	66.5 Å²	66.5	43%	0.428	34%	0.337	S	S	.	.	H	α-helix	trans	-60.7	-40.4	177.5	-69.2	-28.7	0	0	0	111.7	M805 L811 R812	M805-D809 PolarHBondContact O-N 3.36Å; D809-L811 VanDerWaalsContact C-N 3.32Å; D809-L811 PolarHBondContact O-N 3.13Å; D809-R812 PolarHBondContact O-N 3.4Å; D809-R812 IonicContact OD1-NH1 2.76Å
810	K	83.1	Confident	79.2	Confident	88 Å²	88	65.7 Å²	65.7	38%	0.383	33%	0.327	S	S	.	.	H	α-helix	trans	-71.2	-24	173.5	-71.6	-168.9	-178.5	-158	0	113.8	S713 W806 L807 W808 S813 Y814	S713-K810 PolarHBondContact O-NZ 3.23Å; W806-K810 HydrophobicContact CE3-CD 4.08Å; W806-K810 HydrophobicContact CZ3-CD 4.22Å; W806-K810 WeakPolarHBondContact O-CG 3.45Å; W806-K810 PolarHBondContact O-N 2.91Å; L807-K810 PolarHBondContact O-N 3.08Å; W808-K810 VanDerWaalsContact C-N 3.3Å; W808-K810 PolarHBondContact O-N 3.15Å; K810-S813 PolarHBondContact O-OG 3.28Å; K810-Y814 WeakPolarHBondContact O-CD2 3.37Å; K810-Y814 VanDerWaalsContact O-CE2 3.31Å; K810-Y814 WeakPolarHBondContact O-CE2 3.18Å
811	L	83.6	Confident	78.4	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-76.8	-30.4	176.4	-169.9	67.3	0	0	0	112	V666 F670 P720 I723 L807 W808 D809 S813 Y814 L815 I820	V666-L811 HydrophobicContact CG1-CD1 3.99Å; F670-L811 HydrophobicContact CE2-CD1 3.9Å; F670-L811 HydrophobicContact CZ-CD1 4.14Å; F670-L811 HydrophobicContact CZ-CD2 4.25Å; P720-L811 HydrophobicContact CB-CD1 4.03Å; I723-L811 HydrophobicContact CB-CD2 4.38Å; I723-L811 HydrophobicContact CD1-CB 3.69Å; I723-L811 HydrophobicContact CD1-CD1 4.4Å; I723-L811 HydrophobicContact CD1-CD2 3.55Å; I723-L811 HydrophobicContact CD1-CG 4.07Å; I723-L811 HydrophobicContact CG2-CD2 3.87Å; L807-L811 PolarHBondContact O-N 3.38Å; L807-L811 VanDerWaalsContact O-N 3.15Å; W808-L811 HydrophobicContact CE3-CD2 4.19Å; W808-L811 HydrophobicContact CZ3-CD2 4.12Å; W808-L811 PolarHBondContact O-N 3.04Å; D809-L811 VanDerWaalsContact C-N 3.32Å; D809-L811 PolarHBondContact O-N 3.13Å; L811-S813 PolarHBondContact O-N 3.08Å; L811-Y814 PolarHBondContact O-N 3.45Å; L811-L815 HydrophobicContact CD1-CD1 3.92Å; L811-L815 HydrophobicContact CD1-CG 4.37Å; L811-L815 HydrophobicContact CD2-CD1 4.02Å; L811-L815 HydrophobicContact CG-CD1 4Å; L811-L815 PolarHBondContact O-N 3.31Å; L811-I820 HydrophobicContact CD2-CG1 4.36Å; L811-I820 HydrophobicContact CG-CD1 4.5Å
812	R	79.7	Confident	77.5	Confident	130 Å²	130	66.8 Å²	66.8	49%	0.491	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-24.2	177.1	-72.2	-180	-174.7	172.1	4.7	113.7	W808 D809 Y814 I820	W808-R812 PolarHBondContact O-N 3.28Å; W808-R812 VanDerWaalsContact O-N 3.1Å; D809-R812 PolarHBondContact O-N 3.4Å; D809-R812 IonicContact OD1-NH1 2.76Å; R812-Y814 PolarHBondContact O-N 2.65Å; R812-I820 HydrophobicContact CB-CD1 4.16Å; R812-I820 HydrophobicContact CG-CD1 3.67Å
813	S	79.3	Confident	76.3	Confident	82 Å²	82	67 Å²	67	57%	0.573	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-12.9	173.3	62.3	0	0	0	0	113.7	K810 L811	K810-S813 PolarHBondContact O-OG 3.28Å; L811-S813 PolarHBondContact O-N 3.08Å
814	Y	79.7	Confident	75	Confident	24 Å²	24	67.6 Å²	67.6	9%	0.094	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.9	-24.4	-173.7	-59.5	-63.3	0	0	0	114.8	Q662 E663 V666 K810 L811 R812	Q662-Y814 HydrophobicContact CB-CD1 4.25Å; Q662-Y814 HydrophobicContact CB-CE1 3.56Å; Q662-Y814 PolarHBondContact OE1-OH 3.37Å; E663-Y814 HydrophobicContact CB-CD1 4.45Å; E663-Y814 WeakPolarHBondContact CG-O 3.29Å; V666-Y814 HydrophobicContact CB-CG 4.31Å; V666-Y814 HydrophobicContact CG1-CG 4.32Å; V666-Y814 HydrophobicContact CG2-CD1 4.28Å; V666-Y814 HydrophobicContact CG2-CD2 4.25Å; V666-Y814 HydrophobicContact CG2-CG 4.02Å; K810-Y814 WeakPolarHBondContact O-CD2 3.37Å; K810-Y814 VanDerWaalsContact O-CE2 3.31Å; K810-Y814 WeakPolarHBondContact O-CE2 3.18Å; L811-Y814 PolarHBondContact O-N 3.45Å; R812-Y814 PolarHBondContact O-N 2.65Å
815	L	77.7	Confident	74.1	Confident	20 Å²	20	68 Å²	68	11%	0.105	35%	0.354	C	S	.	.	S	Bend	trans	-130.1	150.9	-174.4	-65.7	177.1	0	0	0	110.9	V666 F670 L811 T819 I820	V666-L815 HydrophobicContact CG1-CD1 4.4Å; V666-L815 HydrophobicContact CG1-CD2 4.3Å; V666-L815 HydrophobicContact CG1-CG 4.14Å; F670-L815 HydrophobicContact CB-CD1 4.33Å; F670-L815 HydrophobicContact CD1-CD1 4.27Å; F670-L815 HydrophobicContact CD2-CD1 3.6Å; F670-L815 HydrophobicContact CD2-CD2 4.46Å; F670-L815 HydrophobicContact CD2-CG 4.48Å; F670-L815 HydrophobicContact CE2-CD1 3.94Å; F670-L815 HydrophobicContact CG-CD1 3.79Å; F670-L815 HydrophobicContact CZ-CD1 4.4Å; L811-L815 HydrophobicContact CD1-CD1 3.92Å; L811-L815 HydrophobicContact CD1-CG 4.37Å; L811-L815 HydrophobicContact CD2-CD1 4.02Å; L811-L815 HydrophobicContact CG-CD1 4Å; L811-L815 PolarHBondContact O-N 3.31Å; L815-T819 HydrophobicContact CD1-CG2 4.48Å; L815-I820 HydrophobicContact CB-CD1 4.04Å; L815-I820 HydrophobicContact CB-CG1 3.88Å; L815-I820 WeakPolarHBondContact O-CD1 3.49Å
816	S	73.4	Confident	73.9	Confident	68 Å²	68	65 Å²	65	48%	0.476	34%	0.344	S	S	.	.			trans	-64.2	147	173.8	65.3	0	0	0	0	111.8	E818 T819 I820	S816-E818 PolarHBondContact O-N 2.86Å; S816-E818 VanDerWaalsContact O-N 3.14Å; S816-T819 PolarHBondContact O-N 3.07Å; S816-T819 PolarHBondContact OG-OG1 2.66Å; S816-I820 PolarHBondContact O-N 3.19Å; S816-I820 VanDerWaalsContact O-N 3.09Å
817	D	65.4	Low	73.9	Confident	95 Å²	95	63 Å²	63	51%	0.508	34%	0.338	S	S	.	.	H	α-helix	trans	-56	-31.7	179.7	-79.9	-21.8	0	0	0	113.3	I820 K821	D817-I820 PolarHBondContact O-N 3.33Å; D817-K821 WeakPolarHBondContact O-CB 3.18Å; D817-K821 WeakPolarHBondContact O-CG 3.33Å; D817-K821 PolarHBondContact O-N 2.93Å
818	E	66.7	Low	74.1	Confident	162 Å²	162	63 Å²	63	76%	0.757	34%	0.338	S	S	*	.	H	α-helix	trans	-65.3	-44.7	177	-66.7	-172.8	165.1	0	0	112.2	S816 I820 K821 S822	S816-E818 PolarHBondContact O-N 2.86Å; S816-E818 VanDerWaalsContact O-N 3.14Å; E818-I820 VanDerWaalsContact C-N 3.34Å; E818-K821 PolarHBondContact O-N 3.38Å; E818-S822 PolarHBondContact O-N 3.47Å
819	T	62.9	Low	74.3	Confident	53 Å²	53	64 Å²	64	33%	0.325	35%	0.345	S	S	.	.	H	α-helix	trans	-63.2	-46.9	177	-49.3	0	0	0	0	108.8	L815 S816 K821 S822 L823	L815-T819 HydrophobicContact CD1-CG2 4.48Å; S816-T819 PolarHBondContact O-N 3.07Å; S816-T819 PolarHBondContact OG-OG1 2.66Å; T819-K821 PolarHBondContact O-N 3.38Å; T819-S822 PolarHBondContact O-N 2.91Å; T819-S822 PolarHBondContact O-OG 3.17Å; T819-L823 HydrophobicContact CG2-CD1 4.09Å; T819-L823 WeakPolarHBondContact O-CD1 3.19Å; T819-L823 WeakPolarHBondContact O-CG 3.5Å; T819-L823 PolarHBondContact O-N 3.5Å
820	I	60	Low	74.5	Confident	4 Å²	4	61.6 Å²	61.6	2%	0.021	33%	0.334	C	S	.	.	H	α-helix	trans	-62.6	-41.3	179.3	-62.8	172.6	0	0	0	111.9	W808 L811 R812 L815 S816 D817 E818 S822 L823 H824	W808-I820 HydrophobicContact CE3-CG2 4.26Å; L811-I820 HydrophobicContact CD2-CG1 4.36Å; L811-I820 HydrophobicContact CG-CD1 4.5Å; R812-I820 HydrophobicContact CB-CD1 4.16Å; R812-I820 HydrophobicContact CG-CD1 3.67Å; L815-I820 HydrophobicContact CB-CD1 4.04Å; L815-I820 HydrophobicContact CB-CG1 3.88Å; L815-I820 WeakPolarHBondContact O-CD1 3.49Å; S816-I820 PolarHBondContact O-N 3.19Å; S816-I820 VanDerWaalsContact O-N 3.09Å; D817-I820 PolarHBondContact O-N 3.33Å; E818-I820 VanDerWaalsContact C-N 3.34Å; I820-S822 VanDerWaalsContact C-N 3.29Å; I820-S822 PolarHBondContact O-N 3.41Å; I820-L823 CarbonylContact O-C 3.59Å; I820-L823 WeakPolarHBondContact O-CA 3.29Å; I820-L823 WeakPolarHBondContact O-CB 3.25Å; I820-L823 PolarHBondContact O-N 3.24Å; I820-H824 PolarHBondContact O-N 2.96Å
821	K	62.9	Low	74.9	Confident	155 Å²	155	57.5 Å²	57.5	67%	0.674	32%	0.316	S	S	*	.	H	α-helix	trans	-59.5	-39.2	177.4	-80.2	170.7	-175.7	176.3	0	112.4	D817 E818 T819 L823 H824	D817-K821 WeakPolarHBondContact O-CB 3.18Å; D817-K821 WeakPolarHBondContact O-CG 3.33Å; D817-K821 PolarHBondContact O-N 2.93Å; E818-K821 PolarHBondContact O-N 3.38Å; T819-K821 PolarHBondContact O-N 3.38Å; K821-L823 PolarHBondContact O-N 2.93Å; K821-H824 PolarHBondContact O-N 3.19Å
822	S	63.6	Low	75.3	Confident	98 Å²	98	57.5 Å²	57.5	69%	0.685	32%	0.316	S	S	*	.	H	α-helix	trans	-66.1	-22.8	175.2	76.5	0	0	0	0	113.3	E818 T819 I820	E818-S822 PolarHBondContact O-N 3.47Å; T819-S822 PolarHBondContact O-N 2.91Å; T819-S822 PolarHBondContact O-OG 3.17Å; I820-S822 VanDerWaalsContact C-N 3.29Å; I820-S822 PolarHBondContact O-N 3.41Å
823	L	61.6	Low	75.8	Confident	40 Å²	40	54.1 Å²	54.1	21%	0.209	31%	0.307	C	S	.	.	H	α-helix	trans	-95.9	-15	-177.6	-64	171	0	0	0	113.1	F670 Q727 W808 T819 I820 K821 G825	F670-L823 HydrophobicContact CD1-CD1 3.89Å; F670-L823 HydrophobicContact CE1-CD1 4.03Å; Q727-L823 HydrophobicContact CG-CD2 4.05Å; Q727-L823 VanDerWaalsContact NE2-CB 3.25Å; W808-L823 HydrophobicContact CH2-CB 4.38Å; W808-L823 WeakPolarHBondContact CH2-O 3.46Å; W808-L823 HydrophobicContact CZ3-CB 4.24Å; T819-L823 HydrophobicContact CG2-CD1 4.09Å; T819-L823 WeakPolarHBondContact O-CD1 3.19Å; T819-L823 WeakPolarHBondContact O-CG 3.5Å; T819-L823 PolarHBondContact O-N 3.5Å; I820-L823 CarbonylContact O-C 3.59Å; I820-L823 WeakPolarHBondContact O-CA 3.29Å; I820-L823 WeakPolarHBondContact O-CB 3.25Å; I820-L823 PolarHBondContact O-N 3.24Å; K821-L823 PolarHBondContact O-N 2.93Å; L823-G825 PolarHBondContact O-N 2.7Å; L823-G825 VanDerWaalsContact O-N 3.07Å
824	H	57.7	Low	76.3	Confident	114 Å²	114	51.4 Å²	51.4	53%	0.528	29%	0.285	S	S	.	.			trans	-71.3	107.3	-168.1	-154.8	-72.5	0	0	0	110.5	I820 K821	I820-H824 PolarHBondContact O-N 2.96Å; K821-H824 PolarHBondContact O-N 3.19Å
825	G	67.3	Low	76.9	Confident	34 Å²	34	50.3 Å²	50.3	35%	0.351	28%	0.28	S	S	.	.	S	Bend	trans	-153.6	154.8	171.2	0	0	0	0	0	108.4	W808 L823 I827	W808-G825 WeakPolarHBondContact CZ2-O 3.37Å; L823-G825 PolarHBondContact O-N 2.7Å; L823-G825 VanDerWaalsContact O-N 3.07Å; G825-I827 PolarHBondContact O-N 2.95Å; G825-I827 VanDerWaalsContact O-N 3.14Å
826	S	81.6	Confident	77.5	Confident	55 Å²	55	50 Å²	50	39%	0.385	28%	0.28	S	S	.	.			trans	-65.4	115.8	179.3	59.9	0	0	0	0	110.1	E804 P829 T830	E804-S826 WeakPolarHBondContact OE1-CA 3.26Å; S826-P829 WeakPolarHBondContact OG-CB 3.49Å; S826-T830 WeakPolarHBondContact O-CB 3.44Å; S826-T830 PolarHBondContact O-N 3.32Å; S826-T830 PolarHBondContact O-OG1 2.8Å
827	I	87.8	Confident	78.2	Confident	11 Å²	11	50.9 Å²	50.9	6%	0.056	28%	0.276	C	S	.	.	H	α-helix	trans	-67.6	-61.1	-171.9	-66.7	171.5	0	0	0	110.6	I722 I723 A726 E804 L807 W808 G825 T830 L831	I722-I827 HydrophobicContact CG2-CD1 4.49Å; I723-I827 HydrophobicContact CG1-CD1 3.84Å; A726-I827 HydrophobicContact CB-CB 4.18Å; A726-I827 HydrophobicContact CB-CD1 4.25Å; A726-I827 HydrophobicContact CB-CG1 3.92Å; A726-I827 HydrophobicContact CB-CG2 3.41Å; A726-I827 VanDerWaalsContact CB-CG2 3.41Å; E804-I827 VanDerWaalsContact CD-N 3.31Å; E804-I827 PolarHBondContact OE1-N 2.94Å; E804-I827 WeakPolarHBondContact OE2-CB 3.5Å; E804-I827 PolarHBondContact OE2-N 3.44Å; L807-I827 HydrophobicContact CD1-CD1 4.21Å; W808-I827 HydrophobicContact CH2-CD1 4.41Å; W808-I827 HydrophobicContact CZ2-CD1 3.66Å; W808-I827 HydrophobicContact CZ2-CG1 3.68Å; G825-I827 PolarHBondContact O-N 2.95Å; G825-I827 VanDerWaalsContact O-N 3.14Å; I827-T830 PolarHBondContact O-N 3.41Å; I827-L831 PolarHBondContact O-N 2.57Å
828	F	91.5	Very high	79.3	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-73.6	-37	-172.7	-63.8	-70.4	0	0	0	113.4	I722 L763 Y802 E804 L807 T830 L831 I832	I722-F828 HydrophobicContact CG2-CZ 4.18Å; L763-F828 HydrophobicContact CB-CD1 3.98Å; L763-F828 HydrophobicContact CB-CE1 3.71Å; L763-F828 HydrophobicContact CB-CZ 4.36Å; L763-F828 HydrophobicContact CD1-CD1 4.15Å; L763-F828 HydrophobicContact CD1-CD2 4.4Å; L763-F828 HydrophobicContact CD1-CE1 4.31Å; L763-F828 HydrophobicContact CD1-CG 4.17Å; L763-F828 HydrophobicContact CD2-CB 4.22Å; L763-F828 HydrophobicContact CD2-CD1 3.64Å; L763-F828 HydrophobicContact CD2-CE1 4.27Å; L763-F828 HydrophobicContact CD2-CG 4.06Å; L763-F828 HydrophobicContact CG-CD1 4.13Å; L763-F828 HydrophobicContact CG-CE1 4.31Å; Y802-F828 AromaticContact CD1-CD2 3.59Å; Y802-F828 HydrophobicContact CD1-CD2 3.59Å; Y802-F828 AromaticContact CD1-CE2 3.8Å; Y802-F828 HydrophobicContact CD1-CE2 3.8Å; Y802-F828 HydrophobicContact CD1-CG 4.46Å; Y802-F828 AromaticContact CE1-CD2 3.62Å; Y802-F828 HydrophobicContact CE1-CD2 3.62Å; Y802-F828 AromaticContact CE1-CE2 3.32Å; Y802-F828 HydrophobicContact CE1-CE2 3.32Å; Y802-F828 HydrophobicContact CE1-CZ 4.24Å; E804-F828 HydrophobicContact CB-CD2 4.2Å; E804-F828 HydrophobicContact CB-CE2 4.39Å; E804-F828 WeakPolarHBondContact OE2-CD2 3.46Å; E804-F828 PolarHBondContact OE2-N 3.22Å; L807-F828 HydrophobicContact CD1-CE2 3.92Å; F828-T830 VanDerWaalsContact C-N 3.31Å; F828-T830 PolarHBondContact O-N 3.29Å; F828-L831 HydrophobicContact CD1-CD2 4.14Å; F828-L831 WeakPolarHBondContact O-CB 3.43Å; F828-L831 PolarHBondContact O-N 3Å; F828-I832 WeakPolarHBondContact O-CG1 3.28Å; F828-I832 PolarHBondContact O-N 2.81Å
829	P	89.9	Confident	80.4	Confident	30 Å²	30	39.3 Å²	39.3	20%	0.195	22%	0.219	C	C	.	.	H	α-helix	trans	-61.1	-40	171.1	-25.1	36	0	0	0	112.6	S826 I832 N833 L898	S826-P829 WeakPolarHBondContact OG-CB 3.49Å; P829-I832 PolarHBondContact O-N 2.56Å; P829-N833 PolarHBondContact O-N 3.12Å; P829-N833 PolarHBondContact O-ND2 3.42Å; P829-N833 PolarHBondContact O-OD1 2.81Å; P829-L898 HydrophobicContact CB-CD1 3.54Å; P829-L898 HydrophobicContact CG-CD1 3.61Å
830	T	88.1	Confident	81.5	Confident	31 Å²	31	38.5 Å²	38.5	19%	0.19	21%	0.212	C	C	.	.	H	α-helix	trans	-65	-42.3	175	-61.2	0	0	0	0	111.4	S826 I827 F828 I832 N833 Y834	S826-T830 WeakPolarHBondContact O-CB 3.44Å; S826-T830 PolarHBondContact O-N 3.32Å; S826-T830 PolarHBondContact O-OG1 2.8Å; I827-T830 PolarHBondContact O-N 3.41Å; F828-T830 VanDerWaalsContact C-N 3.31Å; F828-T830 PolarHBondContact O-N 3.29Å; T830-I832 PolarHBondContact O-N 2.94Å; T830-N833 PolarHBondContact O-N 2.88Å; T830-Y834 HydrophobicContact CG2-CD2 3.68Å; T830-Y834 HydrophobicContact CG2-CE2 3.46Å; T830-Y834 VanDerWaalsContact CG2-CE2 3.46Å; T830-Y834 WeakPolarHBondContact O-CD2 3.38Å; T830-Y834 PolarHBondContact O-N 3.13Å; T830-Y834 VanDerWaalsContact O-N 3.11Å
831	L	92.3	Very high	82.7	Confident	1 Å²	1	44 Å²	44	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-55.9	-49.9	173.6	175.8	67.1	0	0	0	111.2	F729 A756 L759 I827 F828 N833 Y834 L835	F729-L831 HydrophobicContact CD1-CD1 4.13Å; F729-L831 HydrophobicContact CD2-CD1 4.37Å; F729-L831 HydrophobicContact CE1-CD1 3.73Å; F729-L831 HydrophobicContact CE2-CD1 4Å; F729-L831 HydrophobicContact CG-CD1 4.44Å; F729-L831 HydrophobicContact CZ-CD1 3.66Å; A756-L831 HydrophobicContact CB-CD1 4.29Å; L759-L831 HydrophobicContact CB-CD2 3.76Å; L759-L831 HydrophobicContact CD1-CD1 4.28Å; L759-L831 HydrophobicContact CD1-CD2 4.46Å; I827-L831 PolarHBondContact O-N 2.57Å; F828-L831 HydrophobicContact CD1-CD2 4.14Å; F828-L831 WeakPolarHBondContact O-CB 3.43Å; F828-L831 PolarHBondContact O-N 3Å; L831-N833 PolarHBondContact O-N 3.49Å; L831-Y834 PolarHBondContact O-N 2.85Å; L831-L835 HydrophobicContact CD1-CD1 4.14Å; L831-L835 HydrophobicContact CD1-CG 4.12Å; L831-L835 HydrophobicContact CG-CD1 3.93Å; L831-L835 HydrophobicContact CG-CG 4.29Å; L831-L835 WeakPolarHBondContact O-CB 3.25Å; L831-L835 VanDerWaalsContact O-CG 3.3Å; L831-L835 WeakPolarHBondContact O-CG 3.34Å; L831-L835 PolarHBondContact O-N 2.88Å
832	I	92.1	Very high	83.7	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-60.6	-46.7	178.9	-66.8	-54.8	0	0	0	111.3	F828 P829 T830 Y834 L835 V836 L891 Y896 L898 A899 Y902	F828-I832 WeakPolarHBondContact O-CG1 3.28Å; F828-I832 PolarHBondContact O-N 2.81Å; P829-I832 PolarHBondContact O-N 2.56Å; T830-I832 PolarHBondContact O-N 2.94Å; I832-Y834 VanDerWaalsContact C-N 3.29Å; I832-Y834 PolarHBondContact O-N 3.47Å; I832-L835 HydrophobicContact CD1-CD1 4.39Å; I832-L835 PolarHBondContact O-N 2.99Å; I832-L835 VanDerWaalsContact O-N 3.11Å; I832-V836 HydrophobicContact CG2-CG2 4.17Å; I832-V836 VanDerWaalsContact O-CG2 3.31Å; I832-V836 WeakPolarHBondContact O-CG2 3.31Å; I832-V836 PolarHBondContact O-N 3.04Å; I832-L891 HydrophobicContact CD1-CD1 3.39Å; I832-Y896 HydrophobicContact CD1-CD1 4.04Å; I832-Y896 HydrophobicContact CD1-CE1 4.16Å; I832-Y896 HydrophobicContact CG1-CD1 3.97Å; I832-Y896 HydrophobicContact CG1-CE1 3.64Å; I832-L898 HydrophobicContact CG1-CB 4.39Å; I832-L898 HydrophobicContact CG2-CB 4.31Å; I832-A899 HydrophobicContact CD1-CB 4.25Å; I832-Y902 HydrophobicContact CG2-CD2 3.52Å; I832-Y902 HydrophobicContact CG2-CE2 3.89Å
833	N	90.3	Very high	84.6	Confident	59 Å²	59	34 Å²	34	32%	0.316	19%	0.189	S	C	.	.	H	α-helix	trans	-55.5	-46.2	-179.8	-68.6	-11.2	0	0	0	111.3	P829 T830 L831 V836 Q837 Y902	P829-N833 PolarHBondContact O-N 3.12Å; P829-N833 PolarHBondContact O-ND2 3.42Å; P829-N833 PolarHBondContact O-OD1 2.81Å; T830-N833 PolarHBondContact O-N 2.88Å; L831-N833 PolarHBondContact O-N 3.49Å; N833-V836 PolarHBondContact O-N 3.18Å; N833-Q837 WeakPolarHBondContact O-CG 3.35Å; N833-Q837 PolarHBondContact O-N 3.22Å; N833-Q837 VanDerWaalsContact O-N 3.08Å; N833-Y902 WeakPolarHBondContact OD1-CE2 3.48Å; N833-Y902 PolarHBondContact OD1-OH 3.29Å
834	Y	89.7	Confident	85.7	Confident	26 Å²	26	32.4 Å²	32.4	10%	0.102	18%	0.181	C	C	.	.	H	α-helix	trans	-72.4	-35.1	176.7	-74.1	-60.5	0	0	0	113.3	F729 H730 A733 T734 T830 L831 I832 V836 Q837 F838	F729-Y834 AromaticContact CE1-CD2 3.75Å; F729-Y834 HydrophobicContact CE1-CD2 3.75Å; F729-Y834 HydrophobicContact CE1-CG 4.06Å; F729-Y834 HydrophobicContact CZ-CG 4.39Å; H730-Y834 AromaticContact ND1-CE2 3.67Å; A733-Y834 HydrophobicContact CB-CD1 3.65Å; A733-Y834 HydrophobicContact CB-CD2 3.83Å; A733-Y834 HydrophobicContact CB-CE1 3.7Å; A733-Y834 HydrophobicContact CB-CE2 3.87Å; A733-Y834 HydrophobicContact CB-CG 3.72Å; T734-Y834 WeakPolarHBondContact CG2-OH 3.26Å; T830-Y834 HydrophobicContact CG2-CD2 3.68Å; T830-Y834 HydrophobicContact CG2-CE2 3.46Å; T830-Y834 VanDerWaalsContact CG2-CE2 3.46Å; T830-Y834 WeakPolarHBondContact O-CD2 3.38Å; T830-Y834 PolarHBondContact O-N 3.13Å; T830-Y834 VanDerWaalsContact O-N 3.11Å; L831-Y834 PolarHBondContact O-N 2.85Å; I832-Y834 VanDerWaalsContact C-N 3.29Å; I832-Y834 PolarHBondContact O-N 3.47Å; Y834-V836 VanDerWaalsContact C-N 3.3Å; Y834-V836 PolarHBondContact O-N 3.33Å; Y834-Q837 PolarHBondContact O-N 3.45Å; Y834-F838 HydrophobicContact CD1-CZ 4.43Å; Y834-F838 WeakPolarHBondContact O-CB 3.32Å; Y834-F838 WeakPolarHBondContact O-CD2 3.48Å; Y834-F838 VanDerWaalsContact O-CG 3.24Å; Y834-F838 WeakPolarHBondContact O-CG 3.38Å; Y834-F838 PolarHBondContact O-N 3.03Å
835	L	91.8	Very high	86.9	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-61.9	-39.1	173.6	-77.1	178.4	0	0	0	111.6	A756 L831 I832 S839 W884 C887 L891	A756-L835 HydrophobicContact CB-CD2 4.21Å; L831-L835 HydrophobicContact CD1-CD1 4.14Å; L831-L835 HydrophobicContact CD1-CG 4.12Å; L831-L835 HydrophobicContact CG-CD1 3.93Å; L831-L835 HydrophobicContact CG-CG 4.29Å; L831-L835 WeakPolarHBondContact O-CB 3.25Å; L831-L835 VanDerWaalsContact O-CG 3.3Å; L831-L835 WeakPolarHBondContact O-CG 3.34Å; L831-L835 PolarHBondContact O-N 2.88Å; I832-L835 HydrophobicContact CD1-CD1 4.39Å; I832-L835 PolarHBondContact O-N 2.99Å; I832-L835 VanDerWaalsContact O-N 3.11Å; L835-S839 WeakPolarHBondContact O-CB 3.47Å; L835-S839 PolarHBondContact O-N 2.85Å; L835-S839 PolarHBondContact O-OG 3.21Å; L835-W884 HydrophobicContact CD2-CE3 3.93Å; L835-C887 HydrophobicContact CD1-CB 4Å; L835-C887 HydrophobicContact CD2-CB 3.98Å; L835-L891 HydrophobicContact CD1-CD1 4.23Å
836	V	90.4	Very high	87.2	Confident	15 Å²	15	28.2 Å²	28.2	9%	0.091	15%	0.152	C	C	.	.	H	α-helix	trans	-63.1	-51.4	173.8	170	0	0	0	0	110	I832 N833 Y834 F838 S839 L840 L888 Y902 L909	I832-V836 HydrophobicContact CG2-CG2 4.17Å; I832-V836 VanDerWaalsContact O-CG2 3.31Å; I832-V836 WeakPolarHBondContact O-CG2 3.31Å; I832-V836 PolarHBondContact O-N 3.04Å; N833-V836 PolarHBondContact O-N 3.18Å; Y834-V836 VanDerWaalsContact C-N 3.3Å; Y834-V836 PolarHBondContact O-N 3.33Å; V836-F838 PolarHBondContact O-N 3.41Å; V836-S839 PolarHBondContact O-N 2.87Å; V836-L840 HydrophobicContact CG1-CD1 4.15Å; V836-L840 WeakPolarHBondContact O-CG 3.46Å; V836-L840 PolarHBondContact O-N 3.47Å; V836-L888 HydrophobicContact CG2-CD1 4.44Å; V836-L888 HydrophobicContact CG2-CD2 4.39Å; V836-Y902 HydrophobicContact CG2-CD2 4.26Å; V836-Y902 HydrophobicContact CG2-CG 4.01Å; V836-L909 HydrophobicContact CB-CD2 4.45Å; V836-L909 HydrophobicContact CG1-CD2 3.92Å; V836-L909 HydrophobicContact CG2-CD2 4.03Å
837	Q	88.4	Confident	86.4	Confident	86 Å²	86	27 Å²	27	40%	0.402	14%	0.143	S	C	.	.	H	α-helix	trans	-59.8	-46.2	178.5	-72.2	177.2	-4.5	0	0	112.6	N833 Y834 L840 N841	N833-Q837 WeakPolarHBondContact O-CG 3.35Å; N833-Q837 PolarHBondContact O-N 3.22Å; N833-Q837 VanDerWaalsContact O-N 3.08Å; Y834-Q837 PolarHBondContact O-N 3.45Å; Q837-L840 PolarHBondContact O-N 3.1Å; Q837-N841 VanDerWaalsContact O-CB 3.27Å; Q837-N841 WeakPolarHBondContact O-CB 3.46Å; Q837-N841 VanDerWaalsContact O-CG 3.3Å; Q837-N841 PolarHBondContact O-N 3.05Å
838	F	89.4	Confident	84.8	Confident	13 Å²	13	30.4 Å²	30.4	6%	0.057	17%	0.167	C	C	.	.	H	α-helix	trans	-69.4	-35.7	177.9	-65.3	-35	0	0	0	112.3	F729 A733 T752 Y834 V836 L840 Q842 W884	F729-F838 HydrophobicContact CE2-CE2 4.23Å; F729-F838 HydrophobicContact CZ-CE2 4.05Å; A733-F838 HydrophobicContact CB-CE2 4.11Å; A733-F838 HydrophobicContact CB-CZ 3.78Å; T752-F838 HydrophobicContact CG2-CE2 4.03Å; Y834-F838 HydrophobicContact CD1-CZ 4.43Å; Y834-F838 WeakPolarHBondContact O-CB 3.32Å; Y834-F838 WeakPolarHBondContact O-CD2 3.48Å; Y834-F838 VanDerWaalsContact O-CG 3.24Å; Y834-F838 WeakPolarHBondContact O-CG 3.38Å; Y834-F838 PolarHBondContact O-N 3.03Å; V836-F838 PolarHBondContact O-N 3.41Å; F838-L840 PolarHBondContact O-N 3.47Å; F838-Q842 HydrophobicContact CB-CG 4.24Å; F838-Q842 HydrophobicContact CD1-CG 3.92Å; F838-Q842 HydrophobicContact CG-CG 4.42Å; F838-Q842 WeakPolarHBondContact O-CA 3.41Å; F838-Q842 VanDerWaalsContact O-CB 3.27Å; F838-Q842 WeakPolarHBondContact O-CB 3.3Å; F838-Q842 PolarHBondContact O-N 3.19Å; F838-W884 HydrophobicContact CB-CB 4.22Å; F838-W884 HydrophobicContact CB-CD2 3.94Å; F838-W884 HydrophobicContact CB-CE3 4.45Å; F838-W884 HydrophobicContact CB-CG 3.81Å; F838-W884 HydrophobicContact CD2-CD2 4.36Å; F838-W884 HydrophobicContact CD2-CE3 4.18Å; F838-W884 HydrophobicContact CD2-CH2 4.42Å; F838-W884 HydrophobicContact CD2-CZ3 4.21Å; F838-W884 HydrophobicContact CG-CD2 4.47Å
839	S	88.7	Confident	82.8	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-63.5	-32.8	174.6	-65.4	0	0	0	0	111.6	L835 V836 W884 K912	L835-S839 WeakPolarHBondContact O-CB 3.47Å; L835-S839 PolarHBondContact O-N 2.85Å; L835-S839 PolarHBondContact O-OG 3.21Å; V836-S839 PolarHBondContact O-N 2.87Å; S839-W884 PolarHBondContact OG-O 2.91Å; S839-K912 WeakPolarHBondContact O-CD 3.36Å; S839-K912 WeakPolarHBondContact O-CE 3.48Å; S839-K912 PolarHBondContact O-NZ 3.26Å
840	L	86.8	Confident	80.6	Confident	36 Å²	36	32.4 Å²	32.4	19%	0.188	18%	0.182	C	C	.	.	H	α-helix	trans	-80.5	-51.4	175.6	-65.7	168.2	0	0	0	111.4	V836 Q837 F838 N906 E908 L909	V836-L840 HydrophobicContact CG1-CD1 4.15Å; V836-L840 WeakPolarHBondContact O-CG 3.46Å; V836-L840 PolarHBondContact O-N 3.47Å; Q837-L840 PolarHBondContact O-N 3.1Å; F838-L840 PolarHBondContact O-N 3.47Å; L840-N906 WeakPolarHBondContact CD1-ND2 3.35Å; L840-E908 HydrophobicContact CD2-CB 4.35Å; L840-E908 HydrophobicContact CD2-CG 4.11Å; L840-L909 HydrophobicContact CD2-CB 4.2Å; L840-L909 HydrophobicContact CD2-CD1 4.21Å; L840-L909 HydrophobicContact CG-CD1 4.3Å
841	N	84.9	Confident	78.5	Confident	119 Å²	119	32 Å²	32	64%	0.636	18%	0.179	S	C	*	.	H	α-helix	trans	-90.2	-22.9	-166	-59.5	-13.5	0	0	0	114.3	Q837	Q837-N841 VanDerWaalsContact O-CB 3.27Å; Q837-N841 WeakPolarHBondContact O-CB 3.46Å; Q837-N841 VanDerWaalsContact O-CG 3.3Å; Q837-N841 PolarHBondContact O-N 3.05Å
842	Q	83.3	Confident	76.1	Confident	22 Å²	22	33 Å²	33	10%	0.103	19%	0.185	C	C	.	.	S	Bend	trans	-103.5	121.9	179.2	-57.7	-72.5	-43.1	0	0	110.3	F838	F838-Q842 HydrophobicContact CB-CG 4.24Å; F838-Q842 HydrophobicContact CD1-CG 3.92Å; F838-Q842 HydrophobicContact CG-CG 4.42Å; F838-Q842 WeakPolarHBondContact O-CA 3.41Å; F838-Q842 VanDerWaalsContact O-CB 3.27Å; F838-Q842 WeakPolarHBondContact O-CB 3.3Å; F838-Q842 PolarHBondContact O-N 3.19Å
843	S	82.7	Confident	73.9	Confident	21 Å²	21	35.8 Å²	35.8	15%	0.147	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-67.8	146.2	169.8	43.6	0	0	0	0	112.1	N934 Q936	S843-N934 WeakPolarHBondContact CB-O 3.29Å; S843-Q936 VanDerWaalsContact OG-CB 3.24Å; S843-Q936 WeakPolarHBondContact OG-CB 3.26Å
844	P	84.8	Confident	71.8	Confident	8 Å²	8	37.8 Å²	37.8	5%	0.052	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-54.4	142.1	166.7	-22.6	33.4	0	0	0	111.2	V880 D881 L933 V935 Q936	P844-V880 HydrophobicContact CB-CG1 3.66Å; P844-D881 VanDerWaalsContact CA-O 3.22Å; P844-D881 WeakPolarHBondContact CA-O 3.18Å; P844-D881 WeakPolarHBondContact CB-O 3.36Å; P844-L933 WeakPolarHBondContact CD-O 3.49Å; P844-L933 HydrophobicContact CG-CB 4.24Å; P844-V935 HydrophobicContact CB-CG2 4.33Å; P844-Q936 PolarHBondContact O-N 3.29Å
845	R	82.5	Confident	69.6	Low	27 Å²	27	40.1 Å²	40.1	10%	0.102	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	139.8	-174.2	-64.9	-175	-177.6	-162.1	-3	111.6	L744 H749 C847 D881	L744-R845 VanDerWaalsContact O-CZ 3.23Å; L744-R845 PolarHBondContact O-NH1 3.34Å; L744-R845 PolarHBondContact O-NH2 2.86Å; H749-R845 PolarHBondContact ND1-NE 3.47Å; R845-C847 PolarHBondContact O-N 3.48Å; R845-D881 PolarHBondContact N-O 3.41Å; R845-D881 WeakPolarHBondContact O-CB 3.47Å; R845-D881 PolarHBondContact O-N 3.29Å
846	I	73.6	Confident	67.4	Low	32 Å²	32	40.7 Å²	40.7	16%	0.164	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	125.1	170.8	-61.3	-172	0	0	0	110.7	Q878 I879 V880 L926 V935 Y937 L941	I846-Q878 HydrophobicContact CD1-CB 4.3Å; I846-Q878 HydrophobicContact CD1-CG 4.4Å; I846-Q878 HydrophobicContact CG2-CB 3.73Å; I846-Q878 HydrophobicContact CG2-CG 4Å; I846-I879 CarbonylContact C-O 3.18Å; I846-I879 WeakPolarHBondContact CA-O 3.35Å; I846-V880 HydrophobicContact CG1-CG2 4.49Å; I846-L926 HydrophobicContact CD1-CD1 3.65Å; I846-L926 HydrophobicContact CD1-CD2 3.59Å; I846-L926 HydrophobicContact CD1-CG 4.21Å; I846-L926 HydrophobicContact CG1-CD1 4.38Å; I846-V935 HydrophobicContact CD1-CG1 4.26Å; I846-V935 HydrophobicContact CG1-CG1 3.77Å; I846-Y937 HydrophobicContact CD1-CD1 4.4Å; I846-Y937 HydrophobicContact CD1-CG 4.12Å; I846-L941 HydrophobicContact CD1-CD1 4.5Å
847	C	66.6	Low	65.2	Low	29 Å²	29	40.4 Å²	40.4	20%	0.196	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	122.4	163.6	-63.5	0	0	0	0	108.4	R845 A849 I879	R845-C847 PolarHBondContact O-N 3.48Å; C847-A849 PolarHBondContact O-N 2.82Å; C847-I879 HydrophobicContact CB-CB 4.17Å; C847-I879 HydrophobicContact CB-CG2 4.36Å; C847-I879 PolarHBondContact N-O 3.47Å; C847-I879 WeakPolarHBondContact O-CB 3.11Å; C847-I879 PolarHBondContact O-N 3.01Å
848	C	53.5	Low	63.4	Low	83 Å²	83	39 Å²	39	56%	0.561	22%	0.218	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-65.4	127.8	179.6	-56.8	0	0	0	0	111
849	A	48.4	Very low	61.4	Low	19 Å²	19	39.1 Å²	39.1	16%	0.157	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	154.2	163.8	0	0	0	0	0	110.2	C847 I877 I879	C847-A849 PolarHBondContact O-N 2.82Å; A849-I877 WeakPolarHBondContact CB-O 3.38Å; A849-I879 HydrophobicContact CB-CD1 3.75Å; A849-I879 HydrophobicContact CB-CG1 3.92Å
850	P	44.7	Very low	59.4	Low	53 Å²	53	39.4 Å²	39.4	34%	0.344	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	153.4	170.8	25.6	-32	0	0	0	111.5	L99 L852	L99-P850 VanDerWaalsContact O-CB 3.31Å; L99-P850 WeakPolarHBondContact O-CB 3.41Å; L99-P850 VanDerWaalsContact O-CG 3.26Å; L99-P850 WeakPolarHBondContact O-CG 3.3Å; P850-L852 PolarHBondContact O-N 3.17Å
851	P	44	Very low	57.6	Low	22 Å²	22	40.5 Å²	40.5	14%	0.143	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	135.4	177.8	22.6	-30	0	0	0	111.2	L874 E876	P851-L874 HydrophobicContact CB-CB 4.24Å; P851-E876 HydrophobicContact CB-CG 3.98Å; P851-E876 HydrophobicContact CG-CG 4.46Å
852	L	42.8	Very low	56	Low	24 Å²	24	41.3 Å²	41.3	13%	0.126	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-78.3	142.2	173.4	-62	-174.9	0	0	0	109.6	F303 P850 T856 L874 I877	F303-L852 HydrophobicContact CD2-CD2 4.4Å; F303-L852 HydrophobicContact CE1-CD1 4.12Å; F303-L852 HydrophobicContact CE1-CD2 4.31Å; F303-L852 HydrophobicContact CE2-CD2 3.49Å; F303-L852 VanDerWaalsContact CE2-CD2 3.49Å; F303-L852 HydrophobicContact CZ-CD1 3.85Å; F303-L852 HydrophobicContact CZ-CD2 3.42Å; F303-L852 VanDerWaalsContact CZ-CD2 3.42Å; F303-L852 HydrophobicContact CZ-CG 4.32Å; P850-L852 PolarHBondContact O-N 3.17Å; L852-T856 HydrophobicContact CB-CG2 3.97Å; L852-T856 HydrophobicContact CD1-CG2 3.93Å; L852-T856 HydrophobicContact CD2-CG2 4.09Å; L852-T856 HydrophobicContact CG-CG2 4.23Å; L852-L874 WeakPolarHBondContact O-CD2 3.08Å; L852-I877 HydrophobicContact CD1-CB 4.31Å; L852-I877 HydrophobicContact CD1-CD1 3.2Å; L852-I877 HydrophobicContact CD1-CG1 3.53Å; L852-I877 HydrophobicContact CG-CD1 4.25Å; L852-I877 HydrophobicContact CG-CG1 4.04Å
853	T	45.4	Very low	54	Low	58 Å²	58	44.8 Å²	44.8	36%	0.356	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-61.6	152.7	173.3	61.2	0	0	0	0	110.5	E855 T856 L857	T853-E855 PolarHBondContact O-N 3.26Å; T853-T856 WeakPolarHBondContact O-CB 3.21Å; T853-T856 PolarHBondContact O-N 3.04Å; T853-T856 VanDerWaalsContact O-N 3.1Å; T853-T856 WeakPolarHBondContact OG1-CB 3.35Å; T853-T856 PolarHBondContact OG1-N 3.35Å; T853-T856 PolarHBondContact OG1-OG1 2.98Å; T853-L857 PolarHBondContact O-N 3.42Å; T853-L857 VanDerWaalsContact O-N 3.09Å
854	E	44.7	Very low	52.2	Low	101 Å²	101	48.6 Å²	48.6	47%	0.472	26%	0.255	S	S	.	.	H	α-helix	trans	-53.9	-37.2	177.9	-171	178.7	161.8	0	0	112.2	L857 N858 I871	E854-L857 WeakPolarHBondContact O-CB 2.85Å; E854-L857 PolarHBondContact O-N 3.39Å; E854-N858 PolarHBondContact O-N 3.26Å; E854-N858 PolarHBondContact O-ND2 3.02Å; E854-I871 HydrophobicContact CG-CG2 4.02Å; E854-I871 WeakPolarHBondContact OE1-CG2 3.45Å
855	E	44	Very low	50.4	Low	74 Å²	74	53.4 Å²	53.4	35%	0.346	29%	0.286	S	S	.	.	H	α-helix	trans	-66.1	-47.4	175.9	-70.6	161.7	-177.8	0	0	112.8	Q306 T853 L857 N858 I859	Q306-E855 VanDerWaalsContact O-OE2 3.05Å; T853-E855 PolarHBondContact O-N 3.26Å; E855-L857 PolarHBondContact O-N 3.08Å; E855-N858 WeakPolarHBondContact O-CB 3.42Å; E855-N858 PolarHBondContact O-N 3.44Å; E855-N858 VanDerWaalsContact O-N 3.07Å; E855-I859 WeakPolarHBondContact O-CD1 3.19Å; E855-I859 PolarHBondContact O-N 2.9Å
856	T	45.1	Very low	48.5	Very low	12 Å²	12	57 Å²	57	7%	0.074	32%	0.315	C	S	.	.	H	α-helix	trans	-54.2	-41.4	175.7	-64.8	0	0	0	0	110.8	F303 L852 T853 I859 V860	F303-T856 HydrophobicContact CB-CG2 3.74Å; F303-T856 HydrophobicContact CD1-CG2 3.01Å; F303-T856 HydrophobicContact CD2-CG2 3.81Å; F303-T856 HydrophobicContact CE1-CG2 3.32Å; F303-T856 HydrophobicContact CE2-CG2 4.06Å; F303-T856 HydrophobicContact CG-CG2 3.25Å; F303-T856 HydrophobicContact CZ-CG2 3.84Å; L852-T856 HydrophobicContact CB-CG2 3.97Å; L852-T856 HydrophobicContact CD1-CG2 3.93Å; L852-T856 HydrophobicContact CD2-CG2 4.09Å; L852-T856 HydrophobicContact CG-CG2 4.23Å; T853-T856 WeakPolarHBondContact O-CB 3.21Å; T853-T856 PolarHBondContact O-N 3.04Å; T853-T856 VanDerWaalsContact O-N 3.1Å; T853-T856 WeakPolarHBondContact OG1-CB 3.35Å; T853-T856 PolarHBondContact OG1-N 3.35Å; T853-T856 PolarHBondContact OG1-OG1 2.98Å; T856-I859 PolarHBondContact O-N 3.29Å; T856-V860 WeakPolarHBondContact O-CG2 3.23Å; T856-V860 PolarHBondContact O-N 3.47Å
857	L	46.1	Very low	47	Very low	10 Å²	10	55.9 Å²	55.9	5%	0.052	31%	0.31	C	S	.	.	H	α-helix	trans	-70	-36.3	-178.6	-159.5	155.5	0	0	0	111.4	T853 E854 E855 I859 V860 R861 I869	T853-L857 PolarHBondContact O-N 3.42Å; T853-L857 VanDerWaalsContact O-N 3.09Å; E854-L857 WeakPolarHBondContact O-CB 2.85Å; E854-L857 PolarHBondContact O-N 3.39Å; E855-L857 PolarHBondContact O-N 3.08Å; L857-I859 VanDerWaalsContact C-N 3.34Å; L857-V860 PolarHBondContact O-N 3.34Å; L857-R861 VanDerWaalsContact CD2-NH2 3.33Å; L857-R861 WeakPolarHBondContact O-CG 3.29Å; L857-R861 PolarHBondContact O-N 2.97Å; L857-R861 VanDerWaalsContact O-N 3.09Å; L857-I869 HydrophobicContact CD1-CG2 3.84Å; L857-I869 HydrophobicContact CD2-CB 3.6Å; L857-I869 HydrophobicContact CD2-CD1 4.16Å; L857-I869 HydrophobicContact CD2-CG1 4.44Å; L857-I869 HydrophobicContact CD2-CG2 3.48Å; L857-I869 VanDerWaalsContact CD2-CG2 3.48Å; L857-I869 HydrophobicContact CG-CB 4.44Å; L857-I869 HydrophobicContact CG-CD1 4.21Å; L857-I869 HydrophobicContact CG-CG2 4Å
858	N	49	Very low	46	Very low	57 Å²	57	62.2 Å²	62.2	31%	0.305	34%	0.342	S	S	.	.	H	α-helix	trans	-64.7	-36.1	171.4	-71.5	-26.7	0	0	0	112.6	E854 E855 R861 N862	E854-N858 PolarHBondContact O-N 3.26Å; E854-N858 PolarHBondContact O-ND2 3.02Å; E855-N858 WeakPolarHBondContact O-CB 3.42Å; E855-N858 PolarHBondContact O-N 3.44Å; E855-N858 VanDerWaalsContact O-N 3.07Å; N858-R861 WeakPolarHBondContact O-CB 3.42Å; N858-R861 PolarHBondContact O-N 3Å; N858-N862 PolarHBondContact O-N 3.27Å; N858-N862 PolarHBondContact O-OD1 3.07Å
859	I	47.6	Very low	45.6	Very low	15 Å²	15	58.7 Å²	58.7	8%	0.077	32%	0.318	C	S	.	.	H	α-helix	trans	-69.8	-41.8	177.1	-70.9	150.5	0	0	0	111.7	S304 E855 T856 L857 R861 N862 Q863	S304-I859 WeakPolarHBondContact O-CD1 3.47Å; S304-I859 WeakPolarHBondContact OG-CD1 3.45Å; S304-I859 WeakPolarHBondContact OG-CG1 3.5Å; S304-I859 WeakPolarHBondContact OG-CG2 3.46Å; E855-I859 WeakPolarHBondContact O-CD1 3.19Å; E855-I859 PolarHBondContact O-N 2.9Å; T856-I859 PolarHBondContact O-N 3.29Å; L857-I859 VanDerWaalsContact C-N 3.34Å; I859-R861 PolarHBondContact O-N 3.37Å; I859-N862 WeakPolarHBondContact O-CB 3.39Å; I859-N862 PolarHBondContact O-N 2.95Å; I859-Q863 PolarHBondContact O-N 3Å
860	V	46.2	Very low	45.4	Very low	6 Å²	6	61.2 Å²	61.2	4%	0.036	33%	0.334	C	S	.	.	H	α-helix	trans	-56.2	-41.4	171.4	163.9	0	0	0	0	110.5	F303 T856 L857 N862 Q863 Y864 C867 L923	F303-V860 HydrophobicContact CE1-CG2 4.29Å; T856-V860 WeakPolarHBondContact O-CG2 3.23Å; T856-V860 PolarHBondContact O-N 3.47Å; L857-V860 PolarHBondContact O-N 3.34Å; V860-N862 VanDerWaalsContact C-N 3.33Å; V860-N862 PolarHBondContact O-N 3.49Å; V860-Q863 PolarHBondContact O-N 2.98Å; V860-Y864 HydrophobicContact CG1-CD2 4.49Å; V860-Y864 WeakPolarHBondContact O-CA 3.37Å; V860-Y864 WeakPolarHBondContact O-CB 3.42Å; V860-Y864 PolarHBondContact O-N 3.42Å; V860-C867 HydrophobicContact CG1-CB 4.36Å; V860-L923 HydrophobicContact CB-CD1 4.36Å; V860-L923 HydrophobicContact CG1-CD1 3.3Å; V860-L923 HydrophobicContact CG2-CD1 4.1Å
861	R	50	Low	45.2	Very low	59 Å²	59	62.9 Å²	62.9	22%	0.223	34%	0.339	C	S	.	.	H	α-helix	trans	-62.6	-38.9	173.2	-67.4	-173	-169.3	148.6	10.6	112.8	L857 N858 I859 Y864 P865 C867 S870	L857-R861 VanDerWaalsContact CD2-NH2 3.33Å; L857-R861 WeakPolarHBondContact O-CG 3.29Å; L857-R861 PolarHBondContact O-N 2.97Å; L857-R861 VanDerWaalsContact O-N 3.09Å; N858-R861 WeakPolarHBondContact O-CB 3.42Å; N858-R861 PolarHBondContact O-N 3Å; I859-R861 PolarHBondContact O-N 3.37Å; R861-Y864 CarbonylContact O-C 3.48Å; R861-Y864 PolarHBondContact O-N 2.84Å; R861-P865 WeakPolarHBondContact O-CA 3.45Å; R861-C867 WeakPolarHBondContact CG-O 3.27Å; R861-S870 VanDerWaalsContact NH2-C 3.28Å
862	N	51	Low	45	Very low	135 Å²	135	64.4 Å²	64.4	72%	0.722	36%	0.359	S	S	*	.	H	α-helix	trans	-68.9	-36.8	179.5	-68.3	-14.9	0	0	0	112.4	N858 I859 V860	N858-N862 PolarHBondContact O-N 3.27Å; N858-N862 PolarHBondContact O-OD1 3.07Å; I859-N862 WeakPolarHBondContact O-CB 3.39Å; I859-N862 PolarHBondContact O-N 2.95Å; V860-N862 VanDerWaalsContact C-N 3.33Å; V860-N862 PolarHBondContact O-N 3.49Å
863	Q	41.2	Very low	44.9	Very low	96 Å²	96	70.2 Å²	70.2	45%	0.449	39%	0.39	S	S	.	.	H	α-helix	trans	-79.2	-30.4	175.4	-73.6	-174.1	-18	0	0	112.7	I859 V860	I859-Q863 PolarHBondContact O-N 3Å; V860-Q863 PolarHBondContact O-N 2.98Å
864	Y	45.3	Very low	44.7	Very low	100 Å²	100	71.3 Å²	71.3	39%	0.392	39%	0.393	S	S	.	.			trans	-131.8	85.5	-177.6	-55.6	-84.1	0	0	0	109.7	V860 R861 S866 C867	V860-Y864 HydrophobicContact CG1-CD2 4.49Å; V860-Y864 WeakPolarHBondContact O-CA 3.37Å; V860-Y864 WeakPolarHBondContact O-CB 3.42Å; V860-Y864 PolarHBondContact O-N 3.42Å; R861-Y864 CarbonylContact O-C 3.48Å; R861-Y864 PolarHBondContact O-N 2.84Å; Y864-S866 PolarHBondContact O-N 3.37Å; Y864-C867 WeakPolarHBondContact O-CB 3.35Å; Y864-C867 PolarHBondContact O-N 3.32Å
865	P	46.2	Very low	44.9	Very low	110 Å²	110	68.5 Å²	68.5	71%	0.714	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-21.6	-176.3	-23.3	32.6	0	0	0	114.1	R861 C867	R861-P865 WeakPolarHBondContact O-CA 3.45Å; P865-C867 PolarHBondContact O-N 3.2Å
866	S	43.2	Very low	45.4	Very low	102 Å²	102	67.3 Å²	67.3	71%	0.713	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-11.2	174.2	50.7	0	0	0	0	113.8	Y864 N868	Y864-S866 PolarHBondContact O-N 3.37Å; S866-N868 PolarHBondContact O-N 3.45Å; S866-N868 VanDerWaalsContact O-N 3.07Å
867	C	41.5	Very low	46.2	Very low	9 Å²	9	67.2 Å²	67.2	6%	0.061	37%	0.373	C	S	.	.			trans	-84.1	76.6	-174.8	-145	0	0	0	0	111.9	V860 R861 Y864 P865 I869	V860-C867 HydrophobicContact CG1-CB 4.36Å; R861-C867 WeakPolarHBondContact CG-O 3.27Å; Y864-C867 WeakPolarHBondContact O-CB 3.35Å; Y864-C867 PolarHBondContact O-N 3.32Å; P865-C867 PolarHBondContact O-N 3.2Å; C867-I869 VanDerWaalsContact C-N 3.29Å; C867-I869 PolarHBondContact O-N 3.32Å; C867-I869 WeakPolarHBondContact SG-CD1 3.44Å
868	N	45.6	Very low	47.4	Very low	161 Å²	161	66.8 Å²	66.8	86%	0.861	37%	0.37	S	S	*	.			trans	-71.4	66.3	179.3	-84.6	-20.3	0	0	0	113.8	S866	S866-N868 PolarHBondContact O-N 3.45Å; S866-N868 VanDerWaalsContact O-N 3.07Å
869	I	44.8	Very low	48.5	Very low	9 Å²	9	64.4 Å²	64.4	5%	0.046	36%	0.358	C	S	.	.			trans	-82.4	-24.4	-167.9	-64	179.1	0	0	0	117.2	L857 C867 K875 T946	L857-I869 HydrophobicContact CD1-CG2 3.84Å; L857-I869 HydrophobicContact CD2-CB 3.6Å; L857-I869 HydrophobicContact CD2-CD1 4.16Å; L857-I869 HydrophobicContact CD2-CG1 4.44Å; L857-I869 HydrophobicContact CD2-CG2 3.48Å; L857-I869 VanDerWaalsContact CD2-CG2 3.48Å; L857-I869 HydrophobicContact CG-CB 4.44Å; L857-I869 HydrophobicContact CG-CD1 4.21Å; L857-I869 HydrophobicContact CG-CG2 4Å; C867-I869 VanDerWaalsContact C-N 3.29Å; C867-I869 PolarHBondContact O-N 3.32Å; C867-I869 WeakPolarHBondContact SG-CD1 3.44Å; I869-K875 HydrophobicContact CG2-CD 4.34Å; I869-K875 PolarHBondContact O-NZ 3.17Å; I869-T946 HydrophobicContact CD1-CG2 4.27Å; I869-T946 WeakPolarHBondContact CD1-OG1 3.42Å
870	S	45.3	Very low	50.1	Low	73 Å²	73	63.7 Å²	63.7	51%	0.51	35%	0.354	S	S	.	.			trans	55.2	134.4	-168.6	75.5	0	0	0	0	115.8	R861 G872 K875	R861-S870 VanDerWaalsContact NH2-C 3.28Å; S870-G872 VanDerWaalsContact C-N 3.33Å; S870-G872 PolarHBondContact O-N 3.41Å; S870-K875 PolarHBondContact OG-NZ 3.4Å
871	I	40.1	Very low	52	Low	88 Å²	88	63.6 Å²	63.6	45%	0.451	35%	0.353	S	S	.	.	S	Bend	trans	-80.2	-8.1	-168.9	-71.8	165.7	0	0	0	113.9	E854 N873	E854-I871 HydrophobicContact CG-CG2 4.02Å; E854-I871 WeakPolarHBondContact OE1-CG2 3.45Å; I871-N873 PolarHBondContact O-N 3.47Å
872	G	40.5	Very low	53.9	Low	53 Å²	53	60.9 Å²	60.9	55%	0.546	34%	0.344	S	S	.	.	S	Bend	trans	-64.7	104.9	-178.7	0	0	0	0	0	112.6	S870	S870-G872 VanDerWaalsContact C-N 3.33Å; S870-G872 PolarHBondContact O-N 3.41Å
873	N	39.8	Very low	55.9	Low	147 Å²	147	54.5 Å²	54.5	79%	0.786	31%	0.31	S	S	*	.	S	Bend	trans	64	126.4	-179.3	-61.7	-23.3	0	0	0	114.1	I871 K875	I871-N873 PolarHBondContact O-N 3.47Å; N873-K875 VanDerWaalsContact O-CG 3.31Å; N873-K875 WeakPolarHBondContact O-CG 3.12Å; N873-K875 PolarHBondContact O-N 3.19Å
874	L	41.7	Very low	58.3	Low	80 Å²	80	50.4 Å²	50.4	42%	0.419	29%	0.29	S	S	.	.			trans	-39.9	94.2	170.5	-67.4	155.9	0	0	0	111	P851 L852 E876	P851-L874 HydrophobicContact CB-CB 4.24Å; L852-L874 WeakPolarHBondContact O-CD2 3.08Å; L874-E876 PolarHBondContact O-N 2.92Å
875	K	48.9	Very low	60.5	Low	42 Å²	42	45.9 Å²	45.9	18%	0.183	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-80.1	121.7	-176.1	-72.2	-172.5	-174.5	165.1	0	108.8	I869 S870 N873 I877 N944	I869-K875 HydrophobicContact CG2-CD 4.34Å; I869-K875 PolarHBondContact O-NZ 3.17Å; S870-K875 PolarHBondContact OG-NZ 3.4Å; N873-K875 VanDerWaalsContact O-CG 3.31Å; N873-K875 WeakPolarHBondContact O-CG 3.12Å; N873-K875 PolarHBondContact O-N 3.19Å; K875-I877 PolarHBondContact O-N 3.34Å; K875-N944 WeakPolarHBondContact CD-O 3.43Å; K875-N944 PolarHBondContact NZ-O 3.38Å
876	E	54.1	Low	62.7	Low	49 Å²	49	40.8 Å²	40.8	23%	0.229	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56	122.9	170	-65.1	178.9	163	0	0	109.7	P851 L874	P851-E876 HydrophobicContact CB-CG 3.98Å; P851-E876 HydrophobicContact CG-CG 4.46Å; L874-E876 PolarHBondContact O-N 2.92Å
877	I	62.7	Low	65.2	Low	11 Å²	11	36 Å²	36	6%	0.056	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	129.7	166.8	-63.1	-154.3	0	0	0	107.6	A849 L852 K875 L923 T946 W948	A849-I877 WeakPolarHBondContact CB-O 3.38Å; L852-I877 HydrophobicContact CD1-CB 4.31Å; L852-I877 HydrophobicContact CD1-CD1 3.2Å; L852-I877 HydrophobicContact CD1-CG1 3.53Å; L852-I877 HydrophobicContact CG-CD1 4.25Å; L852-I877 HydrophobicContact CG-CG1 4.04Å; K875-I877 PolarHBondContact O-N 3.34Å; I877-L923 HydrophobicContact CD1-CD1 4.26Å; I877-L923 HydrophobicContact CD1-CD2 3.8Å; I877-L923 HydrophobicContact CG2-CD2 3.93Å; I877-T946 WeakPolarHBondContact CA-O 3.39Å; I877-W948 HydrophobicContact CG2-CB 4.07Å
878	Q	70.2	Confident	67.7	Low	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	124	177.2	-63.7	-56.7	-18.1	0	0	109.5	I846 T946 G947 W948	I846-Q878 HydrophobicContact CD1-CB 4.3Å; I846-Q878 HydrophobicContact CD1-CG 4.4Å; I846-Q878 HydrophobicContact CG2-CB 3.73Å; I846-Q878 HydrophobicContact CG2-CG 4Å; Q878-T946 PolarHBondContact N-O 3.42Å; Q878-G947 CarbonylContact O-C 3.56Å; Q878-G947 VanDerWaalsContact O-CA 3.22Å; Q878-G947 WeakPolarHBondContact O-CA 3.46Å; Q878-W948 PolarHBondContact O-N 2.76Å
879	I	72.9	Confident	70	Confident	8 Å²	8	28.2 Å²	28.2	4%	0.041	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	127.3	171.6	-67.7	165.5	0	0	0	107.4	I846 C847 A849 W948 V950 C964 F967	I846-I879 CarbonylContact C-O 3.18Å; I846-I879 WeakPolarHBondContact CA-O 3.35Å; C847-I879 HydrophobicContact CB-CB 4.17Å; C847-I879 HydrophobicContact CB-CG2 4.36Å; C847-I879 PolarHBondContact N-O 3.47Å; C847-I879 WeakPolarHBondContact O-CB 3.11Å; C847-I879 PolarHBondContact O-N 3.01Å; A849-I879 HydrophobicContact CB-CD1 3.75Å; A849-I879 HydrophobicContact CB-CG1 3.92Å; I879-W948 HydrophobicContact CG1-CE3 4.2Å; I879-V950 HydrophobicContact CG2-CG1 4.45Å; I879-V950 HydrophobicContact CG2-CG2 3.37Å; I879-C964 HydrophobicContact CD1-CB 4.1Å; I879-C964 VanDerWaalsContact CD1-SG 3.5Å; I879-F967 HydrophobicContact CG2-CE2 3.94Å; I879-F967 HydrophobicContact CG2-CZ 3.74Å
880	V	82.1	Confident	72.3	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	113	179	-173.7	0	0	0	0	108.4	P844 I846 S882 L926 L929 V935 W948 L949 V950	P844-V880 HydrophobicContact CB-CG1 3.66Å; I846-V880 HydrophobicContact CG1-CG2 4.49Å; V880-S882 PolarHBondContact O-N 2.62Å; V880-L926 HydrophobicContact CG2-CD1 4.13Å; V880-L929 HydrophobicContact CG2-CD1 4.01Å; V880-V935 HydrophobicContact CG1-CG1 3.96Å; V880-V935 HydrophobicContact CG1-CG2 4Å; V880-W948 PolarHBondContact N-O 3.19Å; V880-L949 HydrophobicContact CB-CD1 3.88Å; V880-L949 HydrophobicContact CG1-CD1 3.6Å; V880-V950 WeakPolarHBondContact O-CG2 3.05Å; V880-V950 PolarHBondContact O-N 3.45Å
881	D	85.5	Confident	74.6	Confident	3 Å²	3	25.8 Å²	25.8	2%	0.016	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	112.9	-179.8	174.4	9.2	0	0	0	111.1	H749 P844 R845 T883 F953 F967	H749-D881 IonicContact CD2-OD2 2.72Å; H749-D881 IonicContact CE1-OD2 3.3Å; H749-D881 IonicContact NE2-OD2 2.69Å; H749-D881 PolarHBondContact NE2-OD2 3.4Å; P844-D881 VanDerWaalsContact CA-O 3.22Å; P844-D881 WeakPolarHBondContact CA-O 3.18Å; P844-D881 WeakPolarHBondContact CB-O 3.36Å; R845-D881 PolarHBondContact N-O 3.41Å; R845-D881 WeakPolarHBondContact O-CB 3.47Å; R845-D881 PolarHBondContact O-N 3.29Å; D881-T883 VanDerWaalsContact OD1-CB 3.28Å; D881-T883 WeakPolarHBondContact OD1-CB 3.08Å; D881-T883 PolarHBondContact OD1-N 3.45Å; D881-T883 PolarHBondContact OD1-OG1 3.28Å; D881-F953 WeakPolarHBondContact OD2-CE2 3.38Å; D881-F967 HydrophobicContact CB-CE1 3.91Å; D881-F967 HydrophobicContact CB-CZ 4.17Å
882	S	90.1	Very high	77.1	Confident	3 Å²	3	24.2 Å²	24.2	2%	0.021	13%	0.133	C	C	.	.			trans	-111.5	34	174.2	67.4	0	0	0	0	113.4	V880 W884 T885 A886 V950	V880-S882 PolarHBondContact O-N 2.62Å; S882-W884 VanDerWaalsContact C-N 3.31Å; S882-W884 PolarHBondContact O-N 3.15Å; S882-T885 PolarHBondContact O-N 2.92Å; S882-T885 PolarHBondContact O-OG1 3.45Å; S882-A886 VanDerWaalsContact O-CB 3.22Å; S882-A886 WeakPolarHBondContact O-CB 3.37Å; S882-A886 PolarHBondContact O-N 2.99Å; S882-V950 PolarHBondContact N-O 2.89Å; S882-V950 VanDerWaalsContact N-O 3.12Å; S882-V950 PolarHBondContact OG-O 3.14Å
883	T	91.4	Very high	79.5	Confident	1 Å²	1	26.3 Å²	26.3	1%	0.006	13%	0.129	C	C	.	.	H	α-helix	trans	-46.3	-48.7	-175.8	-65.2	0	0	0	0	113.6	D881 A886 C887 F953	D881-T883 VanDerWaalsContact OD1-CB 3.28Å; D881-T883 WeakPolarHBondContact OD1-CB 3.08Å; D881-T883 PolarHBondContact OD1-N 3.45Å; D881-T883 PolarHBondContact OD1-OG1 3.28Å; T883-A886 PolarHBondContact O-N 3.24Å; T883-C887 WeakPolarHBondContact O-CB 3.37Å; T883-C887 PolarHBondContact O-N 3.29Å; T883-C887 PolarHBondContact O-SG 3.08Å; T883-F953 HydrophobicContact CG2-CB 3.86Å; T883-F953 HydrophobicContact CG2-CD2 4.23Å; T883-F953 VanDerWaalsContact OG1-CD2 3.26Å; T883-F953 WeakPolarHBondContact OG1-CD2 3.5Å; T883-F953 PolarHBondContact OG1-N 3.4Å
884	W	93.3	Very high	81.9	Confident	9 Å²	9	20.1 Å²	20.1	3%	0.034	10%	0.096	C	C	.	.	H	α-helix	trans	-64.2	-51.3	-173.3	-47.5	128.6	0	0	0	112.5	F729 L744 H749 T752 G753 A756 L835 F838 S839 S882 C887 L888	F729-W884 HydrophobicContact CE2-CZ3 4.45Å; L744-W884 HydrophobicContact CD1-CH2 4.39Å; L744-W884 HydrophobicContact CD1-CZ2 3.74Å; H749-W884 AromaticContact CE1-CE2 3.83Å; H749-W884 AromaticContact CE1-CZ2 3.77Å; H749-W884 AromaticContact CE1-NE1 3.53Å; H749-W884 AromaticContact ND1-CE2 3.98Å; H749-W884 AromaticContact ND1-CZ2 3.6Å; H749-W884 AromaticContact ND1-NE1 3.78Å; T752-W884 HydrophobicContact CG2-CH2 3.68Å; T752-W884 HydrophobicContact CG2-CZ3 4.18Å; G753-W884 VanDerWaalsContact CA-CH2 3.48Å; A756-W884 HydrophobicContact CB-CE3 4.33Å; A756-W884 HydrophobicContact CB-CZ3 3.77Å; L835-W884 HydrophobicContact CD2-CE3 3.93Å; F838-W884 HydrophobicContact CB-CB 4.22Å; F838-W884 HydrophobicContact CB-CD2 3.94Å; F838-W884 HydrophobicContact CB-CE3 4.45Å; F838-W884 HydrophobicContact CB-CG 3.81Å; F838-W884 HydrophobicContact CD2-CD2 4.36Å; F838-W884 HydrophobicContact CD2-CE3 4.18Å; F838-W884 HydrophobicContact CD2-CH2 4.42Å; F838-W884 HydrophobicContact CD2-CZ3 4.21Å; F838-W884 HydrophobicContact CG-CD2 4.47Å; S839-W884 PolarHBondContact OG-O 2.91Å; S882-W884 VanDerWaalsContact C-N 3.31Å; S882-W884 PolarHBondContact O-N 3.15Å; W884-C887 PolarHBondContact O-N 2.9Å; W884-L888 PolarHBondContact O-N 3.3Å; W884-L888 VanDerWaalsContact O-N 3.14Å
885	T	91.3	Very high	84.2	Confident	5 Å²	5	20.3 Å²	20.3	3%	0.031	9%	0.094	C	C	.	.	H	α-helix	trans	-69.9	-36.4	179.9	48.8	0	0	0	0	111.2	S882 L888 L889 K912 L913 T916	S882-T885 PolarHBondContact O-N 2.92Å; S882-T885 PolarHBondContact O-OG1 3.45Å; T885-L888 PolarHBondContact O-N 2.8Å; T885-L889 WeakPolarHBondContact O-CB 3.33Å; T885-L889 PolarHBondContact O-N 3.49Å; T885-K912 HydrophobicContact CG2-CD 4.21Å; T885-K912 HydrophobicContact CG2-CG 4.1Å; T885-L913 WeakPolarHBondContact O-CD2 3.28Å; T885-T916 WeakPolarHBondContact OG1-CG2 3.4Å; T885-T916 PolarHBondContact OG1-OG1 3.49Å
886	A	92.3	Very high	86.2	Confident	4 Å²	4	18.6 Å²	18.6	3%	0.033	9%	0.086	C	C	.	.	H	α-helix	trans	-64.2	-42.7	175.6	0	0	0	0	0	112.4	S882 T883 L889 Q890 P951 L954	S882-A886 VanDerWaalsContact O-CB 3.22Å; S882-A886 WeakPolarHBondContact O-CB 3.37Å; S882-A886 PolarHBondContact O-N 2.99Å; T883-A886 PolarHBondContact O-N 3.24Å; A886-L889 PolarHBondContact O-N 3.16Å; A886-Q890 WeakPolarHBondContact O-CB 3.2Å; A886-Q890 PolarHBondContact O-N 2.76Å; A886-P951 HydrophobicContact CB-CB 3.85Å; A886-L954 HydrophobicContact CB-CD2 3.96Å
887	C	95.3	Very high	87.9	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-61.3	-46.7	175.1	-73.9	0	0	0	0	111.3	T760 L835 T883 W884 Q890 L891	T760-C887 HydrophobicContact CG2-CB 4.08Å; L835-C887 HydrophobicContact CD1-CB 4Å; L835-C887 HydrophobicContact CD2-CB 3.98Å; T883-C887 WeakPolarHBondContact O-CB 3.37Å; T883-C887 PolarHBondContact O-N 3.29Å; T883-C887 PolarHBondContact O-SG 3.08Å; W884-C887 PolarHBondContact O-N 2.9Å; C887-Q890 PolarHBondContact O-N 2.98Å; C887-L891 WeakPolarHBondContact O-CG 3.36Å; C887-L891 PolarHBondContact O-N 3.38Å
888	L	94.4	Very high	89.2	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-65.8	-40.7	179.1	-176.7	64.5	0	0	0	112	V836 W884 T885 Q890 L891 Y892 A899 V903 L909 L913	V836-L888 HydrophobicContact CG2-CD1 4.44Å; V836-L888 HydrophobicContact CG2-CD2 4.39Å; W884-L888 PolarHBondContact O-N 3.3Å; W884-L888 VanDerWaalsContact O-N 3.14Å; T885-L888 PolarHBondContact O-N 2.8Å; L888-Q890 PolarHBondContact O-N 3.33Å; L888-L891 PolarHBondContact O-N 3.4Å; L888-Y892 WeakPolarHBondContact O-CB 3.37Å; L888-Y892 PolarHBondContact O-N 3.45Å; L888-A899 HydrophobicContact CD1-CB 4.11Å; L888-V903 HydrophobicContact CD1-CG2 4.43Å; L888-V903 HydrophobicContact CD2-CG2 4.15Å; L888-V903 HydrophobicContact CG-CG2 4.28Å; L888-L909 HydrophobicContact CD2-CD1 3.65Å; L888-L909 HydrophobicContact CD2-CD2 3.86Å; L888-L909 HydrophobicContact CD2-CG 3.94Å; L888-L913 HydrophobicContact CB-CD2 4.23Å; L888-L913 HydrophobicContact CD2-CD1 4.01Å; L888-L913 HydrophobicContact CD2-CD2 4.26Å; L888-L913 HydrophobicContact CD2-CG 4.46Å; L888-L913 HydrophobicContact CG-CD1 4.3Å; L888-L913 HydrophobicContact CG-CD2 4.19Å
889	L	93.5	Very high	90.1	Very high	8 Å²	8	19.2 Å²	19.2	4%	0.042	9%	0.093	C	C	.	.	H	α-helix	trans	-59.1	-45.9	175.6	-176.5	64.4	0	0	0	111.2	T885 A886 L891 Y892 H893 L913 E917	T885-L889 WeakPolarHBondContact O-CB 3.33Å; T885-L889 PolarHBondContact O-N 3.49Å; A886-L889 PolarHBondContact O-N 3.16Å; L889-L891 PolarHBondContact O-N 3.26Å; L889-Y892 WeakPolarHBondContact O-CB 3.31Å; L889-Y892 PolarHBondContact O-N 2.66Å; L889-H893 VanDerWaalsContact CD1-NE2 3.34Å; L889-H893 WeakPolarHBondContact CD1-NE2 3.35Å; L889-H893 WeakPolarHBondContact CG-NE2 3.5Å; L889-H893 PolarHBondContact O-CD2 3.21Å; L889-H893 PolarHBondContact O-N 3.3Å; L889-L913 HydrophobicContact CB-CD2 3.65Å; L889-L913 HydrophobicContact CD1-CB 4.4Å; L889-L913 HydrophobicContact CD1-CD2 4.08Å; L889-L913 HydrophobicContact CG-CD2 4.47Å; L889-E917 HydrophobicContact CD1-CB 4.26Å; L889-E917 HydrophobicContact CD2-CB 3.81Å; L889-E917 HydrophobicContact CD2-CG 4.21Å
890	Q	93.6	Very high	91	Very high	31 Å²	31	19.7 Å²	19.7	15%	0.145	10%	0.096	C	C	.	.	H	α-helix	trans	-60.6	-43.8	177.4	-175.3	171.3	-55.9	0	0	112.2	T760 T764 A886 C887 L888 Y892 H893 V894 L954 I957	T760-Q890 HydrophobicContact CG2-CB 4.48Å; T764-Q890 HydrophobicContact CG2-CG 3.99Å; T764-Q890 PolarHBondContact OG1-NE2 2.88Å; A886-Q890 WeakPolarHBondContact O-CB 3.2Å; A886-Q890 PolarHBondContact O-N 2.76Å; C887-Q890 PolarHBondContact O-N 2.98Å; L888-Q890 PolarHBondContact O-N 3.33Å; Q890-Y892 VanDerWaalsContact C-N 3.34Å; Q890-H893 PolarHBondContact O-N 3.09Å; Q890-V894 PolarHBondContact O-N 3.4Å; Q890-V894 VanDerWaalsContact O-N 3.12Å; Q890-L954 HydrophobicContact CB-CD2 4.28Å; Q890-I957 HydrophobicContact CG-CD1 4.16Å
891	L	93.4	Very high	91.4	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-70.1	-31.8	177.9	-65.1	173.8	0	0	0	112.6	T760 L763 I832 L835 C887 L888 L889 K895 Y896 A899	T760-L891 HydrophobicContact CG2-CD1 4.03Å; T760-L891 HydrophobicContact CG2-CD2 4Å; T760-L891 HydrophobicContact CG2-CG 3.78Å; L763-L891 HydrophobicContact CB-CD2 4.32Å; L763-L891 HydrophobicContact CD2-CD1 4.24Å; L763-L891 HydrophobicContact CD2-CD2 3.64Å; L763-L891 HydrophobicContact CG-CD2 3.99Å; I832-L891 HydrophobicContact CD1-CD1 3.39Å; L835-L891 HydrophobicContact CD1-CD1 4.23Å; C887-L891 WeakPolarHBondContact O-CG 3.36Å; C887-L891 PolarHBondContact O-N 3.38Å; L888-L891 PolarHBondContact O-N 3.4Å; L889-L891 PolarHBondContact O-N 3.26Å; L891-K895 PolarHBondContact O-N 3.41Å; L891-Y896 WeakPolarHBondContact O-CB 3.35Å; L891-Y896 PolarHBondContact O-N 2.96Å; L891-A899 HydrophobicContact CB-CB 4.02Å
892	Y	92.4	Very high	91.6	Very high	54 Å²	54	28 Å²	28	21%	0.212	13%	0.131	C	C	.	.	H	α-helix	trans	-65.5	-44.8	171.8	178.8	-101.6	0	0	0	111.7	L888 L889 Q890 V894 K895 V900 V903	L888-Y892 WeakPolarHBondContact O-CB 3.37Å; L888-Y892 PolarHBondContact O-N 3.45Å; L889-Y892 WeakPolarHBondContact O-CB 3.31Å; L889-Y892 PolarHBondContact O-N 2.66Å; Q890-Y892 VanDerWaalsContact C-N 3.34Å; Y892-V894 VanDerWaalsContact C-N 3.33Å; Y892-V894 PolarHBondContact O-N 3.25Å; Y892-K895 WeakPolarHBondContact O-CA 3.43Å; Y892-K895 PolarHBondContact O-N 3.48Å; Y892-V900 HydrophobicContact CD2-CG2 4.1Å; Y892-V900 HydrophobicContact CE2-CG2 4.33Å; Y892-V903 HydrophobicContact CD2-CB 3.96Å; Y892-V903 HydrophobicContact CD2-CG1 3.89Å; Y892-V903 HydrophobicContact CD2-CG2 4.18Å; Y892-V903 HydrophobicContact CE2-CB 4.1Å; Y892-V903 HydrophobicContact CE2-CG1 3.73Å
893	H	90.9	Very high	91.5	Very high	97 Å²	97	27.9 Å²	27.9	45%	0.449	13%	0.13	S	C	.	.	H	α-helix	trans	-63.2	-37.1	177.1	-74.1	-56.6	0	0	0	113.1	L889 Q890 K895 E917	L889-H893 VanDerWaalsContact CD1-NE2 3.34Å; L889-H893 WeakPolarHBondContact CD1-NE2 3.35Å; L889-H893 WeakPolarHBondContact CG-NE2 3.5Å; L889-H893 PolarHBondContact O-CD2 3.21Å; L889-H893 PolarHBondContact O-N 3.3Å; Q890-H893 PolarHBondContact O-N 3.09Å; H893-K895 PolarHBondContact O-N 3.2Å; H893-E917 IonicContact CE1-OE1 3.76Å; H893-E917 PolarHBondContact CE1-OE1 2.89Å; H893-E917 IonicContact NE2-OE1 3.69Å
894	V	89.7	Confident	91.3	Very high	17 Å²	17	34.2 Å²	34.2	10%	0.103	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	10.5	174.2	-177.6	0	0	0	0	111.9	T764 L767 L768 M800 Q890 Y892 Y896	T764-V894 HydrophobicContact CG2-CB 4.1Å; T764-V894 HydrophobicContact CG2-CG1 4.27Å; T764-V894 HydrophobicContact CG2-CG2 3.41Å; T764-V894 VanDerWaalsContact CG2-CG2 3.41Å; L767-V894 HydrophobicContact CB-CG1 3.49Å; L767-V894 VanDerWaalsContact CB-CG1 3.49Å; L767-V894 HydrophobicContact CD1-CG1 4.14Å; L767-V894 HydrophobicContact CG-CG1 4.49Å; L768-V894 HydrophobicContact CD1-CG2 4.49Å; L768-V894 HydrophobicContact CD2-CG1 4.02Å; L768-V894 HydrophobicContact CD2-CG2 4.1Å; L768-V894 HydrophobicContact CG-CG1 4.1Å; L768-V894 HydrophobicContact CG-CG2 4.31Å; M800-V894 HydrophobicContact CE-CG1 3.9Å; M800-V894 WeakPolarHBondContact CE-O 3.32Å; Q890-V894 PolarHBondContact O-N 3.4Å; Q890-V894 VanDerWaalsContact O-N 3.12Å; Y892-V894 VanDerWaalsContact C-N 3.33Å; Y892-V894 PolarHBondContact O-N 3.25Å; V894-Y896 VanDerWaalsContact C-N 3.28Å; V894-Y896 PolarHBondContact O-N 3.4Å
895	K	89.4	Confident	91.1	Very high	84 Å²	84	39.9 Å²	39.9	37%	0.365	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	35.5	173.9	-56.4	-176.7	178.3	-179.2	0	113.5	G799 M800 L891 Y892 H893 S897	G799-K895 CarbonylContact C-O 3.57Å; G799-K895 WeakPolarHBondContact CA-O 3.27Å; M800-K895 PolarHBondContact N-O 3.37Å; L891-K895 PolarHBondContact O-N 3.41Å; Y892-K895 WeakPolarHBondContact O-CA 3.43Å; Y892-K895 PolarHBondContact O-N 3.48Å; H893-K895 PolarHBondContact O-N 3.2Å; K895-S897 PolarHBondContact O-N 3.23Å
896	Y	91.8	Very high	91	Very high	7 Å²	7	41.8 Å²	41.8	3%	0.027	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-63.6	126.3	174.4	-177.6	-125.6	0	0	0	110.5	L763 L767 M800 I832 L891 V894 L898 A899 V900	L763-Y896 HydrophobicContact CD2-CD1 4.28Å; L763-Y896 HydrophobicContact CD2-CE1 4.21Å; L763-Y896 HydrophobicContact CD2-CG 4.48Å; L767-Y896 HydrophobicContact CD1-CD2 3.8Å; L767-Y896 HydrophobicContact CD1-CG 4.11Å; L767-Y896 HydrophobicContact CD2-CD2 4.4Å; M800-Y896 VanDerWaalsContact O-CD2 3.22Å; M800-Y896 WeakPolarHBondContact O-CD2 3.41Å; I832-Y896 HydrophobicContact CD1-CD1 4.04Å; I832-Y896 HydrophobicContact CD1-CE1 4.16Å; I832-Y896 HydrophobicContact CG1-CD1 3.97Å; I832-Y896 HydrophobicContact CG1-CE1 3.64Å; L891-Y896 WeakPolarHBondContact O-CB 3.35Å; L891-Y896 PolarHBondContact O-N 2.96Å; V894-Y896 VanDerWaalsContact C-N 3.28Å; V894-Y896 PolarHBondContact O-N 3.4Å; Y896-L898 HydrophobicContact CD1-CB 4.23Å; Y896-L898 HydrophobicContact CE1-CB 3.81Å; Y896-L898 HydrophobicContact CE1-CD1 4.15Å; Y896-L898 HydrophobicContact CE1-CG 4.31Å; Y896-L898 PolarHBondContact O-N 2.92Å; Y896-A899 HydrophobicContact CD1-CB 4.21Å; Y896-A899 PolarHBondContact O-N 3.49Å; Y896-V900 WeakPolarHBondContact O-CG2 3.47Å; Y896-V900 PolarHBondContact O-N 2.85Å
897	S	89.2	Confident	90.8	Very high	29 Å²	29	50.1 Å²	50.1	20%	0.203	23%	0.226	C	C	.	.	H	α-helix	trans	-54	-46	-166.9	62	0	0	0	0	114	M800 K895 V900 K901	M800-S897 PolarHBondContact O-N 3.08Å; M800-S897 PolarHBondContact O-OG 3.23Å; K895-S897 PolarHBondContact O-N 3.23Å; S897-V900 PolarHBondContact O-N 2.71Å; S897-K901 WeakPolarHBondContact O-CB 3.49Å; S897-K901 PolarHBondContact O-N 3.38Å
898	L	89.5	Confident	90.5	Very high	44 Å²	44	56 Å²	56	23%	0.23	25%	0.254	C	S	.	.	H	α-helix	trans	-67.9	-40.5	179	-67.7	177.1	0	0	0	112.7	P829 I832 Y896 K901 Y902	P829-L898 HydrophobicContact CB-CD1 3.54Å; P829-L898 HydrophobicContact CG-CD1 3.61Å; I832-L898 HydrophobicContact CG1-CB 4.39Å; I832-L898 HydrophobicContact CG2-CB 4.31Å; Y896-L898 HydrophobicContact CD1-CB 4.23Å; Y896-L898 HydrophobicContact CE1-CB 3.81Å; Y896-L898 HydrophobicContact CE1-CD1 4.15Å; Y896-L898 HydrophobicContact CE1-CG 4.31Å; Y896-L898 PolarHBondContact O-N 2.92Å; L898-K901 PolarHBondContact O-N 3.35Å; L898-Y902 WeakPolarHBondContact O-CD2 3.32Å; L898-Y902 PolarHBondContact O-N 3.36Å
899	A	90.7	Very high	90.3	Very high	0 Å²	0	56 Å²	56	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-63.5	-45.7	177.2	0	0	0	0	0	110.5	I832 L888 L891 Y896 K901 V903	I832-A899 HydrophobicContact CD1-CB 4.25Å; L888-A899 HydrophobicContact CD1-CB 4.11Å; L891-A899 HydrophobicContact CB-CB 4.02Å; Y896-A899 HydrophobicContact CD1-CB 4.21Å; Y896-A899 PolarHBondContact O-N 3.49Å; A899-K901 VanDerWaalsContact C-N 3.33Å; A899-K901 PolarHBondContact O-N 2.94Å; A899-V903 VanDerWaalsContact O-CB 3.3Å; A899-V903 WeakPolarHBondContact O-CB 3.11Å; A899-V903 WeakPolarHBondContact O-CG2 3.31Å; A899-V903 PolarHBondContact O-N 2.93Å
900	V	90.4	Very high	90.1	Very high	17 Å²	17	61.2 Å²	61.2	10%	0.103	27%	0.274	C	S	.	.	H	α-helix	trans	-60	-43.4	176.2	175.4	0	0	0	0	111.2	Y892 Y896 S897 R904	Y892-V900 HydrophobicContact CD2-CG2 4.1Å; Y892-V900 HydrophobicContact CE2-CG2 4.33Å; Y896-V900 WeakPolarHBondContact O-CG2 3.47Å; Y896-V900 PolarHBondContact O-N 2.85Å; S897-V900 PolarHBondContact O-N 2.71Å; V900-R904 HydrophobicContact CG1-CG 4.48Å; V900-R904 WeakPolarHBondContact O-CB 3.47Å; V900-R904 VanDerWaalsContact O-CG 3.3Å; V900-R904 WeakPolarHBondContact O-CG 3.34Å; V900-R904 PolarHBondContact O-N 2.83Å; V900-R904 VanDerWaalsContact O-N 3.07Å
901	K	90.8	Very high	89.9	Confident	108 Å²	108	63 Å²	63	47%	0.47	29%	0.287	S	S	.	.	H	α-helix	trans	-58.6	-58.6	177.7	-178.6	-177.8	175	-176.6	0	111.7	S897 L898 A899 V903 R904 E905	S897-K901 WeakPolarHBondContact O-CB 3.49Å; S897-K901 PolarHBondContact O-N 3.38Å; L898-K901 PolarHBondContact O-N 3.35Å; A899-K901 VanDerWaalsContact C-N 3.33Å; A899-K901 PolarHBondContact O-N 2.94Å; K901-V903 VanDerWaalsContact C-N 3.31Å; K901-V903 PolarHBondContact O-N 2.74Å; K901-R904 PolarHBondContact O-N 3.19Å; K901-E905 WeakPolarHBondContact CE-OE1 3.47Å; K901-E905 VanDerWaalsContact CG-OE1 3.31Å; K901-E905 WeakPolarHBondContact CG-OE1 3.49Å; K901-E905 WeakPolarHBondContact O-CG 3.33Å; K901-E905 PolarHBondContact O-N 3.1Å
902	Y	89.3	Confident	89.8	Confident	70 Å²	70	64.4 Å²	64.4	28%	0.275	29%	0.293	S	S	.	.	H	α-helix	trans	-62.7	-36.8	-176.7	-78.1	-64	0	0	0	113.3	I832 N833 V836 L898 E905 N906	I832-Y902 HydrophobicContact CG2-CD2 3.52Å; I832-Y902 HydrophobicContact CG2-CE2 3.89Å; N833-Y902 WeakPolarHBondContact OD1-CE2 3.48Å; N833-Y902 PolarHBondContact OD1-OH 3.29Å; V836-Y902 HydrophobicContact CG2-CD2 4.26Å; V836-Y902 HydrophobicContact CG2-CG 4.01Å; L898-Y902 WeakPolarHBondContact O-CD2 3.32Å; L898-Y902 PolarHBondContact O-N 3.36Å; Y902-E905 PolarHBondContact O-N 2.71Å; Y902-N906 WeakPolarHBondContact O-CB 3.49Å; Y902-N906 PolarHBondContact O-N 2.95Å; Y902-N906 VanDerWaalsContact O-N 3.1Å
903	V	88.6	Confident	89.7	Confident	1 Å²	1	62.1 Å²	62.1	1%	0.006	28%	0.284	C	S	.	.	H	α-helix	trans	-68	-37.5	178.5	171.1	0	0	0	0	111.7	L888 Y892 A899 K901 L909 Y910 L913	L888-V903 HydrophobicContact CD1-CG2 4.43Å; L888-V903 HydrophobicContact CD2-CG2 4.15Å; L888-V903 HydrophobicContact CG-CG2 4.28Å; Y892-V903 HydrophobicContact CD2-CB 3.96Å; Y892-V903 HydrophobicContact CD2-CG1 3.89Å; Y892-V903 HydrophobicContact CD2-CG2 4.18Å; Y892-V903 HydrophobicContact CE2-CB 4.1Å; Y892-V903 HydrophobicContact CE2-CG1 3.73Å; A899-V903 VanDerWaalsContact O-CB 3.3Å; A899-V903 WeakPolarHBondContact O-CB 3.11Å; A899-V903 WeakPolarHBondContact O-CG2 3.31Å; A899-V903 PolarHBondContact O-N 2.93Å; K901-V903 VanDerWaalsContact C-N 3.31Å; K901-V903 PolarHBondContact O-N 2.74Å; V903-L909 HydrophobicContact CG2-CD2 3.99Å; V903-L909 HydrophobicContact CG2-CG 4.33Å; V903-Y910 HydrophobicContact CG1-CD2 3.81Å; V903-L913 HydrophobicContact CB-CD1 4.11Å; V903-L913 HydrophobicContact CG1-CD1 3.61Å; V903-L913 HydrophobicContact CG2-CD1 3.31Å
904	R	87.1	Confident	89.7	Confident	134 Å²	134	62.6 Å²	62.6	51%	0.506	29%	0.286	S	S	.	.	H	α-helix	trans	-73.5	-34.8	176.3	-73.3	179.3	176.6	-172.2	-0.9	112.7	V900 K901 N906	V900-R904 HydrophobicContact CG1-CG 4.48Å; V900-R904 WeakPolarHBondContact O-CB 3.47Å; V900-R904 VanDerWaalsContact O-CG 3.3Å; V900-R904 WeakPolarHBondContact O-CG 3.34Å; V900-R904 PolarHBondContact O-N 2.83Å; V900-R904 VanDerWaalsContact O-N 3.07Å; K901-R904 PolarHBondContact O-N 3.19Å; R904-N906 VanDerWaalsContact C-N 3.33Å
905	E	89.3	Confident	89.7	Confident	127 Å²	127	63.9 Å²	63.9	59%	0.593	29%	0.292	S	S	*	.	H	α-helix	trans	-73.3	-25.2	179.1	-72.4	173.8	178.4	0	0	112.7	K901 Y902	K901-E905 WeakPolarHBondContact CE-OE1 3.47Å; K901-E905 VanDerWaalsContact CG-OE1 3.31Å; K901-E905 WeakPolarHBondContact CG-OE1 3.49Å; K901-E905 WeakPolarHBondContact O-CG 3.33Å; K901-E905 PolarHBondContact O-N 3.1Å; Y902-E905 PolarHBondContact O-N 2.71Å
906	N	89.2	Confident	89.7	Confident	46 Å²	46	59.9 Å²	59.9	25%	0.246	28%	0.275	C	S	.	.			trans	-115.8	102.9	-177.5	-170.9	-31.6	0	0	0	112.5	L840 Y902 R904 E908 L909 Y910	L840-N906 WeakPolarHBondContact CD1-ND2 3.35Å; Y902-N906 WeakPolarHBondContact O-CB 3.49Å; Y902-N906 PolarHBondContact O-N 2.95Å; Y902-N906 VanDerWaalsContact O-N 3.1Å; R904-N906 VanDerWaalsContact C-N 3.33Å; N906-E908 VanDerWaalsContact C-N 3.32Å; N906-E908 PolarHBondContact O-N 3.45Å; N906-E908 WeakPolarHBondContact OD1-CB 3.31Å; N906-E908 PolarHBondContact OD1-N 3.12Å; N906-L909 HydrophobicContact CB-CB 3.81Å; N906-L909 HydrophobicContact CB-CD2 4.4Å; N906-L909 WeakPolarHBondContact O-CB 3.48Å; N906-L909 PolarHBondContact O-N 3.21Å; N906-L909 PolarHBondContact OD1-N 2.57Å; N906-Y910 PolarHBondContact O-N 3.39Å
907	K	89.1	Confident	89.6	Confident	178 Å²	178	63.9 Å²	63.9	77%	0.774	29%	0.294	S	S	*	.	H	α-helix	trans	-60.4	-35.8	179.4	-172.8	177.9	179.8	180	0	113.7	T911	K907-T911 PolarHBondContact O-N 3.29Å; K907-T911 VanDerWaalsContact O-N 3.07Å; K907-T911 PolarHBondContact O-OG1 3.04Å
908	E	89	Confident	89.5	Confident	125 Å²	125	65.9 Å²	65.9	58%	0.584	31%	0.305	S	S	*	.	H	α-helix	trans	-66	-45.5	177.6	-175	-175.4	168.6	0	0	110.5	L840 N906 Y910 T911 K912	L840-E908 HydrophobicContact CD2-CB 4.35Å; L840-E908 HydrophobicContact CD2-CG 4.11Å; N906-E908 VanDerWaalsContact C-N 3.32Å; N906-E908 PolarHBondContact O-N 3.45Å; N906-E908 WeakPolarHBondContact OD1-CB 3.31Å; N906-E908 PolarHBondContact OD1-N 3.12Å; E908-Y910 PolarHBondContact O-N 3.08Å; E908-T911 PolarHBondContact O-N 3.33Å; E908-K912 WeakPolarHBondContact O-CB 3.43Å; E908-K912 PolarHBondContact O-N 2.93Å
909	L	89.6	Confident	89.3	Confident	0 Å²	0	66 Å²	66	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-61.4	-45.3	177.4	-171.5	63.2	0	0	0	112	V836 L840 L888 V903 N906 T911 K912 L913	V836-L909 HydrophobicContact CB-CD2 4.45Å; V836-L909 HydrophobicContact CG1-CD2 3.92Å; V836-L909 HydrophobicContact CG2-CD2 4.03Å; L840-L909 HydrophobicContact CD2-CB 4.2Å; L840-L909 HydrophobicContact CD2-CD1 4.21Å; L840-L909 HydrophobicContact CG-CD1 4.3Å; L888-L909 HydrophobicContact CD2-CD1 3.65Å; L888-L909 HydrophobicContact CD2-CD2 3.86Å; L888-L909 HydrophobicContact CD2-CG 3.94Å; V903-L909 HydrophobicContact CG2-CD2 3.99Å; V903-L909 HydrophobicContact CG2-CG 4.33Å; N906-L909 HydrophobicContact CB-CB 3.81Å; N906-L909 HydrophobicContact CB-CD2 4.4Å; N906-L909 WeakPolarHBondContact O-CB 3.48Å; N906-L909 PolarHBondContact O-N 3.21Å; N906-L909 PolarHBondContact OD1-N 2.57Å; L909-T911 VanDerWaalsContact C-N 3.33Å; L909-T911 PolarHBondContact O-N 2.94Å; L909-K912 PolarHBondContact O-N 3.24Å; L909-L913 HydrophobicContact CG-CD1 4.16Å; L909-L913 WeakPolarHBondContact O-CB 3.13Å; L909-L913 WeakPolarHBondContact O-CG 3.3Å; L909-L913 PolarHBondContact O-N 3.5Å
910	Y	90	Very high	88.8	Confident	117 Å²	117	67.8 Å²	67.8	46%	0.459	31%	0.312	S	S	.	.	H	α-helix	trans	-57	-46.3	174.9	-177.9	-98.6	0	0	0	111.9	V903 N906 E908 K912 L913 H914	V903-Y910 HydrophobicContact CG1-CD2 3.81Å; N906-Y910 PolarHBondContact O-N 3.39Å; E908-Y910 PolarHBondContact O-N 3.08Å; Y910-K912 PolarHBondContact O-N 3.01Å; Y910-L913 PolarHBondContact O-N 3.26Å; Y910-H914 PolarHBondContact O-N 3.19Å
911	T	89.3	Confident	88	Confident	68 Å²	68	70.9 Å²	70.9	42%	0.417	33%	0.328	S	S	.	.	H	α-helix	trans	-62.1	-44.2	177.9	-53.7	0	0	0	0	111.2	K907 E908 L909 L913 H914 L915	K907-T911 PolarHBondContact O-N 3.29Å; K907-T911 VanDerWaalsContact O-N 3.07Å; K907-T911 PolarHBondContact O-OG1 3.04Å; E908-T911 PolarHBondContact O-N 3.33Å; L909-T911 VanDerWaalsContact C-N 3.33Å; L909-T911 PolarHBondContact O-N 2.94Å; T911-L913 PolarHBondContact O-N 3.4Å; T911-H914 PolarHBondContact O-N 3.24Å; T911-L915 HydrophobicContact CG2-CD1 4.15Å; T911-L915 WeakPolarHBondContact O-CB 3.04Å; T911-L915 VanDerWaalsContact O-CG 3.31Å; T911-L915 WeakPolarHBondContact O-CG 3.43Å; T911-L915 PolarHBondContact O-N 2.64Å
912	K	89.9	Confident	87.1	Confident	30 Å²	30	68.9 Å²	68.9	13%	0.13	32%	0.323	C	S	.	.	H	α-helix	trans	-66.1	-35.8	179.6	-167	168.8	-174.9	169.2	0	112.7	S839 T885 E908 L909 Y910 T916	S839-K912 WeakPolarHBondContact O-CD 3.36Å; S839-K912 WeakPolarHBondContact O-CE 3.48Å; S839-K912 PolarHBondContact O-NZ 3.26Å; T885-K912 HydrophobicContact CG2-CD 4.21Å; T885-K912 HydrophobicContact CG2-CG 4.1Å; E908-K912 WeakPolarHBondContact O-CB 3.43Å; E908-K912 PolarHBondContact O-N 2.93Å; L909-K912 PolarHBondContact O-N 3.24Å; Y910-K912 PolarHBondContact O-N 3.01Å; K912-T916 WeakPolarHBondContact O-CB 3.43Å; K912-T916 PolarHBondContact O-N 3.39Å; K912-T916 PolarHBondContact O-OG1 3.19Å
913	L	91.2	Very high	86.3	Confident	5 Å²	5	67.3 Å²	67.3	3%	0.026	32%	0.319	C	S	.	.	H	α-helix	trans	-65	-49	174.1	-78.4	163	0	0	0	111.5	T885 L888 L889 V903 L909 Y910 T911 L915 T916 E917	T885-L913 WeakPolarHBondContact O-CD2 3.28Å; L888-L913 HydrophobicContact CB-CD2 4.23Å; L888-L913 HydrophobicContact CD2-CD1 4.01Å; L888-L913 HydrophobicContact CD2-CD2 4.26Å; L888-L913 HydrophobicContact CD2-CG 4.46Å; L888-L913 HydrophobicContact CG-CD1 4.3Å; L888-L913 HydrophobicContact CG-CD2 4.19Å; L889-L913 HydrophobicContact CB-CD2 3.65Å; L889-L913 HydrophobicContact CD1-CB 4.4Å; L889-L913 HydrophobicContact CD1-CD2 4.08Å; L889-L913 HydrophobicContact CG-CD2 4.47Å; V903-L913 HydrophobicContact CB-CD1 4.11Å; V903-L913 HydrophobicContact CG1-CD1 3.61Å; V903-L913 HydrophobicContact CG2-CD1 3.31Å; L909-L913 HydrophobicContact CG-CD1 4.16Å; L909-L913 WeakPolarHBondContact O-CB 3.13Å; L909-L913 WeakPolarHBondContact O-CG 3.3Å; L909-L913 PolarHBondContact O-N 3.5Å; Y910-L913 PolarHBondContact O-N 3.26Å; T911-L913 PolarHBondContact O-N 3.4Å; L913-L915 VanDerWaalsContact C-N 3.34Å; L913-L915 PolarHBondContact O-N 2.72Å; L913-T916 WeakPolarHBondContact O-CB 3.43Å; L913-T916 PolarHBondContact O-N 3.44Å; L913-T916 VanDerWaalsContact O-N 3.15Å; L913-E917 WeakPolarHBondContact O-CB 3.48Å; L913-E917 PolarHBondContact O-N 3.2Å
914	H	90.9	Very high	85.7	Confident	107 Å²	107	67.9 Å²	67.9	50%	0.495	32%	0.322	S	S	.	.	H	α-helix	trans	-62.5	-40.3	178.6	-172.8	57.3	0	0	0	112.4	Y910 T911 E917 T918	Y910-H914 PolarHBondContact O-N 3.19Å; T911-H914 PolarHBondContact O-N 3.24Å; H914-E917 PolarHBondContact O-N 2.97Å; H914-T918 WeakPolarHBondContact O-CB 3.16Å; H914-T918 PolarHBondContact O-N 2.79Å; H914-T918 PolarHBondContact O-OG1 3.16Å
915	L	90.1	Very high	85.3	Confident	44 Å²	44	64.7 Å²	64.7	23%	0.23	32%	0.319	C	S	.	.	H	α-helix	trans	-63.5	-45.4	172.6	-70.9	171.9	0	0	0	111.4	T911 L913 E917 T918 Y919 K932 L933	T911-L915 HydrophobicContact CG2-CD1 4.15Å; T911-L915 WeakPolarHBondContact O-CB 3.04Å; T911-L915 VanDerWaalsContact O-CG 3.31Å; T911-L915 WeakPolarHBondContact O-CG 3.43Å; T911-L915 PolarHBondContact O-N 2.64Å; L913-L915 VanDerWaalsContact C-N 3.34Å; L913-L915 PolarHBondContact O-N 2.72Å; L915-E917 VanDerWaalsContact C-N 3.34Å; L915-E917 PolarHBondContact O-N 2.89Å; L915-T918 PolarHBondContact O-N 2.73Å; L915-Y919 HydrophobicContact CD2-CE2 4.22Å; L915-Y919 WeakPolarHBondContact O-CD2 3.25Å; L915-Y919 PolarHBondContact O-N 3.14Å; L915-Y919 VanDerWaalsContact O-N 3.12Å; L915-K932 WeakPolarHBondContact CD1-O 3.32Å; L915-L933 HydrophobicContact CB-CD2 3.83Å
916	T	88.4	Confident	84.7	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.006	29%	0.292	C	S	.	.	H	α-helix	trans	-58.2	-48.6	176.8	-59.5	0	0	0	0	110.4	T885 K912 L913 T918 Y919 L920 L949	T885-T916 WeakPolarHBondContact OG1-CG2 3.4Å; T885-T916 PolarHBondContact OG1-OG1 3.49Å; K912-T916 WeakPolarHBondContact O-CB 3.43Å; K912-T916 PolarHBondContact O-N 3.39Å; K912-T916 PolarHBondContact O-OG1 3.19Å; L913-T916 WeakPolarHBondContact O-CB 3.43Å; L913-T916 PolarHBondContact O-N 3.44Å; L913-T916 VanDerWaalsContact O-N 3.15Å; T916-T918 VanDerWaalsContact C-N 3.31Å; T916-T918 PolarHBondContact O-N 3.45Å; T916-Y919 PolarHBondContact O-N 3.15Å; T916-L920 WeakPolarHBondContact O-CA 3.03Å; T916-L920 VanDerWaalsContact O-CB 3.28Å; T916-L920 WeakPolarHBondContact O-CB 3.36Å; T916-L920 PolarHBondContact O-N 2.92Å; T916-L949 HydrophobicContact CG2-CD2 4.39Å
917	E	89.3	Confident	84.3	Confident	91 Å²	91	59.9 Å²	59.9	43%	0.425	30%	0.303	S	S	.	.	H	α-helix	trans	-57	-42.6	177.8	-172.8	178	-166.9	0	0	112.2	L889 H893 L913 H914 L915 Y919	L889-E917 HydrophobicContact CD1-CB 4.26Å; L889-E917 HydrophobicContact CD2-CB 3.81Å; L889-E917 HydrophobicContact CD2-CG 4.21Å; H893-E917 IonicContact CE1-OE1 3.76Å; H893-E917 PolarHBondContact CE1-OE1 2.89Å; H893-E917 IonicContact NE2-OE1 3.69Å; L913-E917 WeakPolarHBondContact O-CB 3.48Å; L913-E917 PolarHBondContact O-N 3.2Å; H914-E917 PolarHBondContact O-N 2.97Å; L915-E917 VanDerWaalsContact C-N 3.34Å; L915-E917 PolarHBondContact O-N 2.89Å; E917-Y919 VanDerWaalsContact C-N 3.34Å; E917-Y919 PolarHBondContact O-N 3.44Å
918	T	87	Confident	84	Confident	71 Å²	71	53.5 Å²	53.5	44%	0.436	28%	0.279	S	S	.	.	H	α-helix	trans	-64.2	-37.1	179.1	-56.5	0	0	0	0	112.7	H914 L915 T916 N922	H914-T918 WeakPolarHBondContact O-CB 3.16Å; H914-T918 PolarHBondContact O-N 2.79Å; H914-T918 PolarHBondContact O-OG1 3.16Å; L915-T918 PolarHBondContact O-N 2.73Å; T916-T918 VanDerWaalsContact C-N 3.31Å; T916-T918 PolarHBondContact O-N 3.45Å; T918-N922 PolarHBondContact O-ND2 2.93Å
919	Y	85.5	Confident	83.7	Confident	45 Å²	45	47.6 Å²	47.6	18%	0.176	25%	0.251	C	S	.	.	H	α-helix	trans	-99.1	-9.9	-176.5	-67.3	-69.4	0	0	0	114	L915 T916 E917 D921 N922 T924 V928 L929 K932 L949	L915-Y919 HydrophobicContact CD2-CE2 4.22Å; L915-Y919 WeakPolarHBondContact O-CD2 3.25Å; L915-Y919 PolarHBondContact O-N 3.14Å; L915-Y919 VanDerWaalsContact O-N 3.12Å; T916-Y919 PolarHBondContact O-N 3.15Å; E917-Y919 VanDerWaalsContact C-N 3.34Å; E917-Y919 PolarHBondContact O-N 3.44Å; Y919-D921 PolarHBondContact O-N 3.04Å; Y919-N922 WeakPolarHBondContact O-CB 3.49Å; Y919-N922 PolarHBondContact O-N 2.87Å; Y919-N922 VanDerWaalsContact O-N 3.1Å; Y919-T924 HydrophobicContact CD1-CG2 3.92Å; Y919-T924 HydrophobicContact CE1-CG2 3.93Å; Y919-V928 HydrophobicContact CE1-CG1 4.28Å; Y919-L929 HydrophobicContact CD1-CD2 4.25Å; Y919-L929 HydrophobicContact CG-CD2 4.11Å; Y919-K932 HydrophobicContact CE2-CB 4.02Å; Y919-K932 HydrophobicContact CE2-CG 4.01Å; Y919-L949 WeakPolarHBondContact O-CB 2.79Å
920	L	81.4	Confident	83.5	Confident	38 Å²	38	49.8 Å²	49.8	20%	0.199	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	137.3	-176.6	-165.5	67.8	0	0	0	110.2	T916 N922 L949 P951	T916-L920 WeakPolarHBondContact O-CA 3.03Å; T916-L920 VanDerWaalsContact O-CB 3.28Å; T916-L920 WeakPolarHBondContact O-CB 3.36Å; T916-L920 PolarHBondContact O-N 2.92Å; L920-N922 PolarHBondContact O-N 3.27Å; L920-L949 HydrophobicContact CD1-CG 4.46Å; L920-P951 HydrophobicContact CD1-CB 4.42Å
921	D	72.6	Confident	83.2	Confident	83 Å²	83	50.8 Å²	50.8	44%	0.444	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.7	7.5	-176.6	-63.5	-35.7	0	0	0	115.1	Y919 W948 L949	Y919-D921 PolarHBondContact O-N 3.04Å; D921-W948 PolarHBondContact O-NE1 3.35Å; D921-L949 WeakPolarHBondContact CA-O 3.2Å; D921-L949 PolarHBondContact N-O 2.84Å
922	N	72.4	Confident	83.1	Confident	66 Å²	66	51.6 Å²	51.6	35%	0.353	27%	0.269	S	S	.	.			trans	-97.5	145.3	177.5	-68.5	-36.6	0	0	0	112.6	T918 Y919 L920	T918-N922 PolarHBondContact O-ND2 2.93Å; Y919-N922 WeakPolarHBondContact O-CB 3.49Å; Y919-N922 PolarHBondContact O-N 2.87Å; Y919-N922 VanDerWaalsContact O-N 3.1Å; L920-N922 PolarHBondContact O-N 3.27Å
923	L	72	Confident	82.8	Confident	36 Å²	36	50.4 Å²	50.4	19%	0.188	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	114.7	171	-74	173.6	0	0	0	110.3	V860 I877 T946 W948	V860-L923 HydrophobicContact CB-CD1 4.36Å; V860-L923 HydrophobicContact CG1-CD1 3.3Å; V860-L923 HydrophobicContact CG2-CD1 4.1Å; I877-L923 HydrophobicContact CD1-CD1 4.26Å; I877-L923 HydrophobicContact CD1-CD2 3.8Å; I877-L923 HydrophobicContact CG2-CD2 3.93Å; L923-T946 HydrophobicContact CB-CG2 4.35Å; L923-W948 HydrophobicContact CD2-CB 3.62Å; L923-W948 HydrophobicContact CD2-CG 4.04Å
924	T	75.7	Confident	82.4	Confident	13 Å²	13	55.7 Å²	55.7	8%	0.08	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	141	-171.2	-53.6	0	0	0	0	110	Y919 L926 V928 L929 G947	Y919-T924 HydrophobicContact CD1-CG2 3.92Å; Y919-T924 HydrophobicContact CE1-CG2 3.93Å; T924-L926 PolarHBondContact O-N 3.15Å; T924-V928 HydrophobicContact CG2-CB 3.88Å; T924-V928 HydrophobicContact CG2-CG1 3.82Å; T924-L929 HydrophobicContact CG2-CD2 3.87Å; T924-L929 HydrophobicContact CG2-CG 3.79Å; T924-G947 PolarHBondContact N-O 2.79Å; T924-G947 PolarHBondContact O-N 3.1Å; T924-G947 VanDerWaalsContact O-O 3.09Å
925	P	79.2	Confident	81.9	Confident	68 Å²	68	50.8 Å²	50.8	44%	0.442	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.9	135.6	173	-25.7	34.5	0	0	0	111.3	S927 V928 L929	P925-S927 PolarHBondContact O-N 3Å; P925-V928 HydrophobicContact CB-CG2 4.15Å; P925-V928 HydrophobicContact CG-CG2 4.36Å; P925-V928 PolarHBondContact O-N 3.33Å; P925-L929 PolarHBondContact O-N 3.16Å; P925-L929 VanDerWaalsContact O-N 3.07Å
926	L	76.6	Confident	80.9	Confident	5 Å²	5	53 Å²	53	3%	0.026	28%	0.279	C	S	.	.	H	α-helix	trans	-62.2	-29.1	-175.7	-168	69.7	0	0	0	112.1	I846 V880 T924 L929 N930 V935 Y937 Q945	I846-L926 HydrophobicContact CD1-CD1 3.65Å; I846-L926 HydrophobicContact CD1-CD2 3.59Å; I846-L926 HydrophobicContact CD1-CG 4.21Å; I846-L926 HydrophobicContact CG1-CD1 4.38Å; V880-L926 HydrophobicContact CG2-CD1 4.13Å; T924-L926 PolarHBondContact O-N 3.15Å; L926-L929 PolarHBondContact O-N 3.37Å; L926-N930 VanDerWaalsContact O-CB 3.24Å; L926-N930 WeakPolarHBondContact O-CB 3.2Å; L926-N930 PolarHBondContact O-N 3.21Å; L926-V935 HydrophobicContact CD1-CG1 4.46Å; L926-Y937 HydrophobicContact CD2-CD1 4.41Å; L926-Y937 HydrophobicContact CD2-CG 4.44Å; L926-Q945 WeakPolarHBondContact CB-O 3.42Å; L926-Q945 PolarHBondContact N-O 2.88Å
927	S	80.4	Confident	80	Confident	66 Å²	66	56.5 Å²	56.5	46%	0.462	29%	0.293	S	S	.	.	H	α-helix	trans	-60.5	-42.6	172.7	55.4	0	0	0	0	112.8	P925 N930 E931	P925-S927 PolarHBondContact O-N 3Å; S927-N930 PolarHBondContact O-N 3.43Å; S927-E931 WeakPolarHBondContact O-CB 3.36Å; S927-E931 PolarHBondContact O-N 2.86Å
928	V	83.6	Confident	78.5	Confident	45 Å²	45	57.5 Å²	57.5	27%	0.273	30%	0.301	S	S	.	.	H	α-helix	trans	-70.8	-44.9	178.7	175.8	0	0	0	0	110.1	Y919 T924 P925 N930 E931 K932	Y919-V928 HydrophobicContact CE1-CG1 4.28Å; T924-V928 HydrophobicContact CG2-CB 3.88Å; T924-V928 HydrophobicContact CG2-CG1 3.82Å; P925-V928 HydrophobicContact CB-CG2 4.15Å; P925-V928 HydrophobicContact CG-CG2 4.36Å; P925-V928 PolarHBondContact O-N 3.33Å; V928-N930 VanDerWaalsContact C-N 3.27Å; V928-N930 PolarHBondContact O-N 2.88Å; V928-E931 PolarHBondContact O-N 3.1Å; V928-K932 HydrophobicContact CG1-CG 4.33Å; V928-K932 WeakPolarHBondContact O-CB 3.43Å; V928-K932 WeakPolarHBondContact O-CG 3.48Å; V928-K932 PolarHBondContact O-N 2.97Å
929	L	83.4	Confident	76.9	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-60.1	-40.3	175.1	-69.4	176.2	0	0	0	111.4	V880 Y919 T924 P925 L926 K932 L933 V935	V880-L929 HydrophobicContact CG2-CD1 4.01Å; Y919-L929 HydrophobicContact CD1-CD2 4.25Å; Y919-L929 HydrophobicContact CG-CD2 4.11Å; T924-L929 HydrophobicContact CG2-CD2 3.87Å; T924-L929 HydrophobicContact CG2-CG 3.79Å; P925-L929 PolarHBondContact O-N 3.16Å; P925-L929 VanDerWaalsContact O-N 3.07Å; L926-L929 PolarHBondContact O-N 3.37Å; L929-K932 PolarHBondContact O-N 3.37Å; L929-L933 HydrophobicContact CD2-CD1 4.27Å; L929-L933 WeakPolarHBondContact O-CA 3.22Å; L929-L933 WeakPolarHBondContact O-CB 3.2Å; L929-L933 PolarHBondContact O-N 3.43Å; L929-V935 HydrophobicContact CB-CG2 4.01Å
930	N	84.2	Confident	75.3	Confident	46 Å²	46	66 Å²	66	25%	0.246	35%	0.347	C	S	.	.	H	α-helix	trans	-64.8	-46.8	176.6	-173	39.9	0	0	0	112.2	L926 S927 V928 K932 N934 V935 Y937	L926-N930 VanDerWaalsContact O-CB 3.24Å; L926-N930 WeakPolarHBondContact O-CB 3.2Å; L926-N930 PolarHBondContact O-N 3.21Å; S927-N930 PolarHBondContact O-N 3.43Å; V928-N930 VanDerWaalsContact C-N 3.27Å; V928-N930 PolarHBondContact O-N 2.88Å; N930-K932 VanDerWaalsContact C-N 3.31Å; N930-K932 PolarHBondContact O-N 2.76Å; N930-N934 WeakPolarHBondContact O-CA 3.48Å; N930-N934 PolarHBondContact O-N 2.62Å; N930-V935 PolarHBondContact OD1-N 3.18Å; N930-V935 PolarHBondContact OD1-O 3.14Å; N930-Y937 HydrophobicContact CB-CE1 3.88Å; N930-Y937 PolarHBondContact ND2-OH 3.02Å
931	E	84.1	Confident	74	Confident	138 Å²	138	66.2 Å²	66.2	65%	0.645	35%	0.348	S	S	*	.	H	α-helix	trans	-59.9	-41.1	177.6	-169.8	-161	130.2	0	0	111.9	S927 V928	S927-E931 WeakPolarHBondContact O-CB 3.36Å; S927-E931 PolarHBondContact O-N 2.86Å; V928-E931 PolarHBondContact O-N 3.1Å
932	K	86.5	Confident	73	Confident	85 Å²	85	68.1 Å²	68.1	37%	0.37	36%	0.358	S	S	.	.	H	α-helix	trans	-87	-34.2	-174.3	-61.6	-52.2	-175.2	-153.2	0	114.4	L915 Y919 V928 L929 N930	L915-K932 WeakPolarHBondContact CD1-O 3.32Å; Y919-K932 HydrophobicContact CE2-CB 4.02Å; Y919-K932 HydrophobicContact CE2-CG 4.01Å; V928-K932 HydrophobicContact CG1-CG 4.33Å; V928-K932 WeakPolarHBondContact O-CB 3.43Å; V928-K932 WeakPolarHBondContact O-CG 3.48Å; V928-K932 PolarHBondContact O-N 2.97Å; L929-K932 PolarHBondContact O-N 3.37Å; N930-K932 VanDerWaalsContact C-N 3.31Å; N930-K932 PolarHBondContact O-N 2.76Å
933	L	84	Confident	72.2	Confident	5 Å²	5	74.2 Å²	74.2	3%	0.026	38%	0.381	C	S	.	.	H	α-helix	trans	-120.8	-0.6	-171.6	-63	173.8	0	0	0	114.1	P844 L915 L929 V935 L949	P844-L933 WeakPolarHBondContact CD-O 3.49Å; P844-L933 HydrophobicContact CG-CB 4.24Å; L915-L933 HydrophobicContact CB-CD2 3.83Å; L929-L933 HydrophobicContact CD2-CD1 4.27Å; L929-L933 WeakPolarHBondContact O-CA 3.22Å; L929-L933 WeakPolarHBondContact O-CB 3.2Å; L929-L933 PolarHBondContact O-N 3.43Å; L933-V935 HydrophobicContact CB-CG2 4.4Å; L933-L949 HydrophobicContact CD1-CD1 4.1Å; L933-L949 HydrophobicContact CD1-CD2 3.59Å
934	N	83.9	Confident	71.7	Confident	117 Å²	117	78 Å²	78	63%	0.626	40%	0.402	S	S	*	.			trans	53	66.1	-177	-169.4	24.7	0	0	0	111.6	S843 N930	S843-N934 WeakPolarHBondContact CB-O 3.29Å; N930-N934 WeakPolarHBondContact O-CA 3.48Å; N930-N934 PolarHBondContact O-N 2.62Å
935	V	79	Confident	71.4	Confident	3 Å²	3	78.2 Å²	78.2	2%	0.018	40%	0.402	C	S	.	.			trans	-78.5	130.4	-175.5	178.5	0	0	0	0	109.8	P844 I846 V880 L926 L929 N930 L933 Y937	P844-V935 HydrophobicContact CB-CG2 4.33Å; I846-V935 HydrophobicContact CD1-CG1 4.26Å; I846-V935 HydrophobicContact CG1-CG1 3.77Å; V880-V935 HydrophobicContact CG1-CG1 3.96Å; V880-V935 HydrophobicContact CG1-CG2 4Å; L926-V935 HydrophobicContact CD1-CG1 4.46Å; L929-V935 HydrophobicContact CB-CG2 4.01Å; N930-V935 PolarHBondContact OD1-N 3.18Å; N930-V935 PolarHBondContact OD1-O 3.14Å; L933-V935 HydrophobicContact CB-CG2 4.4Å; V935-Y937 HydrophobicContact CG1-CD1 4.45Å; V935-Y937 VanDerWaalsContact O-CD1 3.25Å; V935-Y937 WeakPolarHBondContact O-CD1 3.5Å; V935-Y937 PolarHBondContact O-N 2.76Å
936	Q	70.2	Confident	71.1	Confident	90 Å²	90	75.5 Å²	75.5	42%	0.421	38%	0.384	S	S	.	.	B	Isolated β-bridge	trans	-83.1	119.1	177.2	-176.3	179.5	26.4	0	0	111.1	S843 P844	S843-Q936 VanDerWaalsContact OG-CB 3.24Å; S843-Q936 WeakPolarHBondContact OG-CB 3.26Å; P844-Q936 PolarHBondContact O-N 3.29Å
937	Y	68	Low	70.9	Confident	76 Å²	76	75.3 Å²	75.3	30%	0.298	38%	0.383	S	S	.	.			trans	-145.5	152.9	175.4	63.6	-91.5	0	0	0	112.9	I846 L926 N930 V935 T939 L941	I846-Y937 HydrophobicContact CD1-CD1 4.4Å; I846-Y937 HydrophobicContact CD1-CG 4.12Å; L926-Y937 HydrophobicContact CD2-CD1 4.41Å; L926-Y937 HydrophobicContact CD2-CG 4.44Å; N930-Y937 HydrophobicContact CB-CE1 3.88Å; N930-Y937 PolarHBondContact ND2-OH 3.02Å; V935-Y937 HydrophobicContact CG1-CD1 4.45Å; V935-Y937 VanDerWaalsContact O-CD1 3.25Å; V935-Y937 WeakPolarHBondContact O-CD1 3.5Å; V935-Y937 PolarHBondContact O-N 2.76Å; Y937-T939 PolarHBondContact O-N 3.16Å; Y937-L941 HydrophobicContact CD2-CB 4.13Å
938	D	59.4	Low	70.7	Confident	112 Å²	112	75 Å²	75	60%	0.599	37%	0.372	S	S	*	.			trans	-66.8	125.9	172.7	-75.1	-36.8	0	0	0	109.1	Q940 L941	D938-Q940 PolarHBondContact O-N 3.31Å; D938-L941 HydrophobicContact CB-CD1 4.46Å; D938-L941 WeakPolarHBondContact O-CB 3.33Å; D938-L941 PolarHBondContact O-N 2.94Å
939	T	52.2	Low	70.6	Confident	137 Å²	137	72.9 Å²	72.9	84%	0.84	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-13	-173.4	43.1	0	0	0	0	115.3	Y937 L941	Y937-T939 PolarHBondContact O-N 3.16Å; T939-L941 VanDerWaalsContact C-N 3.26Å; T939-L941 PolarHBondContact O-N 2.9Å
940	Q	53.3	Low	70.5	Confident	156 Å²	156	72.9 Å²	72.9	73%	0.729	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-11.6	172.5	-65	-175.6	-9.6	0	0	113.6	D938 L942	D938-Q940 PolarHBondContact O-N 3.31Å; Q940-L942 PolarHBondContact O-N 2.88Å
941	L	52.7	Low	70.5	Confident	44 Å²	44	71.4 Å²	71.4	23%	0.23	35%	0.351	C	S	.	.	S	Bend	trans	-77	114.5	177.9	-71.9	158.8	0	0	0	110.7	I846 Y937 D938 T939	I846-L941 HydrophobicContact CD1-CD1 4.5Å; Y937-L941 HydrophobicContact CD2-CB 4.13Å; D938-L941 HydrophobicContact CB-CD1 4.46Å; D938-L941 WeakPolarHBondContact O-CB 3.33Å; D938-L941 PolarHBondContact O-N 2.94Å; T939-L941 VanDerWaalsContact C-N 3.26Å; T939-L941 PolarHBondContact O-N 2.9Å
942	L	51.9	Low	70.5	Confident	123 Å²	123	64.8 Å²	64.8	64%	0.644	32%	0.321	S	S	*	.			trans	-52.4	137.5	-169	-67.2	148.3	0	0	0	114.2	Q940 N944 Q945	Q940-L942 PolarHBondContact O-N 2.88Å; L942-N944 PolarHBondContact O-N 3.42Å; L942-Q945 HydrophobicContact CB-CG 4.3Å; L942-Q945 PolarHBondContact O-N 3.02Å
943	K	55.7	Low	70.7	Confident	193 Å²	193	61.2 Å²	61.2	84%	0.839	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	-13	176	-72.5	-177.7	176	-179.5	0	116.1
944	N	61.9	Low	71	Confident	117 Å²	117	61.3 Å²	61.3	63%	0.626	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.4	17.5	-171	-62.5	-12.3	0	0	0	114	K875 L942	K875-N944 WeakPolarHBondContact CD-O 3.43Å; K875-N944 PolarHBondContact NZ-O 3.38Å; L942-N944 PolarHBondContact O-N 3.42Å
945	Q	69.4	Low	71.1	Confident	17 Å²	17	55.8 Å²	55.8	8%	0.079	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-88.7	149.3	177.4	-68.3	-173.6	-10	0	0	112.3	L926 L942	L926-Q945 WeakPolarHBondContact CB-O 3.42Å; L926-Q945 PolarHBondContact N-O 2.88Å; L942-Q945 HydrophobicContact CB-CG 4.3Å; L942-Q945 PolarHBondContact O-N 3.02Å
946	T	72.4	Confident	71.1	Confident	11 Å²	11	61.3 Å²	61.3	7%	0.067	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	131.5	176.7	-25.7	0	0	0	0	109.3	I869 I877 Q878 L923	I869-T946 HydrophobicContact CD1-CG2 4.27Å; I869-T946 WeakPolarHBondContact CD1-OG1 3.42Å; I877-T946 WeakPolarHBondContact CA-O 3.39Å; Q878-T946 PolarHBondContact N-O 3.42Å; L923-T946 HydrophobicContact CB-CG2 4.35Å
947	G	73.3	Confident	71.7	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	142.3	172.1	0	0	0	0	0	111.6	Q878 T924	Q878-G947 CarbonylContact O-C 3.56Å; Q878-G947 VanDerWaalsContact O-CA 3.22Å; Q878-G947 WeakPolarHBondContact O-CA 3.46Å; T924-G947 PolarHBondContact N-O 2.79Å; T924-G947 PolarHBondContact O-N 3.1Å; T924-G947 VanDerWaalsContact O-O 3.09Å
948	W	76.5	Confident	72	Confident	61 Å²	61	60.6 Å²	60.6	23%	0.231	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	107.8	166.4	-176.2	21.9	0	0	0	108.8	I877 Q878 I879 V880 D921 L923 V950	I877-W948 HydrophobicContact CG2-CB 4.07Å; Q878-W948 PolarHBondContact O-N 2.76Å; I879-W948 HydrophobicContact CG1-CE3 4.2Å; V880-W948 PolarHBondContact N-O 3.19Å; D921-W948 PolarHBondContact O-NE1 3.35Å; L923-W948 HydrophobicContact CD2-CB 3.62Å; L923-W948 HydrophobicContact CD2-CG 4.04Å; W948-V950 HydrophobicContact CD2-CG1 3.39Å; W948-V950 HydrophobicContact CE3-CG1 3.83Å; W948-V950 HydrophobicContact CG-CG1 3.79Å; W948-V950 HydrophobicContact CH2-CG1 4.06Å; W948-V950 HydrophobicContact CZ2-CG1 3.66Å; W948-V950 HydrophobicContact CZ3-CG1 4.14Å
949	L	81	Confident	72.6	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	125.3	175.5	-168.8	70.2	0	0	0	109.5	V880 T916 Y919 L920 D921 L933	V880-L949 HydrophobicContact CB-CD1 3.88Å; V880-L949 HydrophobicContact CG1-CD1 3.6Å; T916-L949 HydrophobicContact CG2-CD2 4.39Å; Y919-L949 WeakPolarHBondContact O-CB 2.79Å; L920-L949 HydrophobicContact CD1-CG 4.46Å; D921-L949 WeakPolarHBondContact CA-O 3.2Å; D921-L949 PolarHBondContact N-O 2.84Å; L933-L949 HydrophobicContact CD1-CD1 4.1Å; L933-L949 HydrophobicContact CD1-CD2 3.59Å
950	V	81.3	Confident	73.7	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	153.7	-176.4	-65.2	0	0	0	0	111.3	I879 V880 S882 W948 G952 A963 F967	I879-V950 HydrophobicContact CG2-CG1 4.45Å; I879-V950 HydrophobicContact CG2-CG2 3.37Å; V880-V950 WeakPolarHBondContact O-CG2 3.05Å; V880-V950 PolarHBondContact O-N 3.45Å; S882-V950 PolarHBondContact N-O 2.89Å; S882-V950 VanDerWaalsContact N-O 3.12Å; S882-V950 PolarHBondContact OG-O 3.14Å; W948-V950 HydrophobicContact CD2-CG1 3.39Å; W948-V950 HydrophobicContact CE3-CG1 3.83Å; W948-V950 HydrophobicContact CG-CG1 3.79Å; W948-V950 HydrophobicContact CH2-CG1 4.06Å; W948-V950 HydrophobicContact CZ2-CG1 3.66Å; W948-V950 HydrophobicContact CZ3-CG1 4.14Å; V950-G952 PolarHBondContact O-N 2.98Å; V950-A963 HydrophobicContact CB-CB 3.93Å; V950-A963 HydrophobicContact CG1-CB 4.18Å; V950-F967 HydrophobicContact CG2-CE2 3.59Å; V950-F967 HydrophobicContact CG2-CZ 3.73Å
951	P	84.1	Confident	74.6	Confident	14 Å²	14	45 Å²	45	9%	0.091	22%	0.217	C	C	.	.			trans	-65.2	1	177.7	28.6	-37.2	0	0	0	114	A886 L920 F953 L954 A963	A886-P951 HydrophobicContact CB-CB 3.85Å; L920-P951 HydrophobicContact CD1-CB 4.42Å; P951-F953 PolarHBondContact O-N 3.43Å; P951-L954 HydrophobicContact CB-CB 4.21Å; P951-L954 HydrophobicContact CB-CD2 4.32Å; P951-L954 VanDerWaalsContact O-CB 3.31Å; P951-L954 WeakPolarHBondContact O-CB 3.33Å; P951-L954 PolarHBondContact O-N 3.04Å; P951-L954 VanDerWaalsContact O-N 3.13Å; P951-A963 HydrophobicContact CG-CB 4.08Å
952	G	84.7	Confident	75.4	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.7	-121	168.3	0	0	0	0	0	113.2	V950 L954 F967	V950-G952 PolarHBondContact O-N 2.98Å; G952-L954 PolarHBondContact O-N 3.27Å; G952-F967 VanDerWaalsContact O-CB 3.31Å; G952-F967 WeakPolarHBondContact O-CB 3.38Å; G952-F967 VanDerWaalsContact O-CD2 3.26Å; G952-F967 WeakPolarHBondContact O-CD2 3.44Å; G952-F967 WeakPolarHBondContact O-CG 3.4Å
953	F	89.5	Confident	76	Confident	9 Å²	9	38.9 Å²	38.9	4%	0.039	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	6.2	178.7	-60.1	-73.7	0	0	0	114.1	H749 F750 G753 R754 G757 D881 T883 P951 P955 Y962 F967	H749-F953 AromaticContact CD2-CE2 3.81Å; H749-F953 AromaticContact NE2-CE2 3.85Å; F750-F953 HydrophobicContact CB-CZ 4.2Å; F750-F953 AromaticContact CD2-CE1 3.4Å; F750-F953 HydrophobicContact CD2-CE1 3.4Å; F750-F953 VanDerWaalsContact CD2-CE1 3.4Å; F750-F953 AromaticContact CD2-CZ 3.59Å; F750-F953 HydrophobicContact CD2-CZ 3.59Å; F750-F953 AromaticContact CE2-CE1 3.68Å; F750-F953 HydrophobicContact CE2-CE1 3.68Å; F750-F953 HydrophobicContact CE2-CZ 4.32Å; F750-F953 HydrophobicContact CG-CE1 4.21Å; F750-F953 HydrophobicContact CG-CZ 4.21Å; G753-F953 VanDerWaalsContact C-CB 3.42Å; G753-F953 VanDerWaalsContact O-CB 3.32Å; G753-F953 WeakPolarHBondContact O-CB 3.32Å; R754-F953 VanDerWaalsContact CD-CD1 3.45Å; R754-F953 HydrophobicContact CG-CD1 3.67Å; R754-F953 HydrophobicContact CG-CE1 4.04Å; R754-F953 HydrophobicContact CG-CG 4.38Å; G757-F953 WeakPolarHBondContact CA-O 3.31Å; D881-F953 WeakPolarHBondContact OD2-CE2 3.38Å; T883-F953 HydrophobicContact CG2-CB 3.86Å; T883-F953 HydrophobicContact CG2-CD2 4.23Å; T883-F953 VanDerWaalsContact OG1-CD2 3.26Å; T883-F953 WeakPolarHBondContact OG1-CD2 3.5Å; T883-F953 PolarHBondContact OG1-N 3.4Å; P951-F953 PolarHBondContact O-N 3.43Å; F953-P955 VanDerWaalsContact O-CD 3.29Å; F953-P955 WeakPolarHBondContact O-CD 3.36Å; F953-Y962 WeakPolarHBondContact O-CE1 3.49Å; F953-F967 HydrophobicContact CD1-CB 3.79Å; F953-F967 AromaticContact CD1-CD1 3.84Å; F953-F967 HydrophobicContact CD1-CD1 3.84Å; F953-F967 HydrophobicContact CD1-CG 4.29Å; F953-F967 VanDerWaalsContact CD1-O 3.23Å; F953-F967 WeakPolarHBondContact CD1-O 3.43Å; F953-F967 HydrophobicContact CD2-CD1 4.18Å; F953-F967 HydrophobicContact CE1-CB 4.09Å; F953-F967 AromaticContact CE1-CD1 3.72Å; F953-F967 HydrophobicContact CE1-CD1 3.72Å; F953-F967 HydrophobicContact CE1-CG 4.41Å; F953-F967 HydrophobicContact CE2-CD1 4.05Å; F953-F967 HydrophobicContact CE2-CE1 4.44Å; F953-F967 HydrophobicContact CG-CB 4.46Å; F953-F967 HydrophobicContact CG-CD1 4.07Å; F953-F967 AromaticContact CZ-CD1 3.81Å; F953-F967 HydrophobicContact CZ-CD1 3.81Å; F953-F967 HydrophobicContact CZ-CE1 4.45Å
954	L	91.1	Very high	76.2	Confident	7 Å²	7	30.4 Å²	30.4	4%	0.037	15%	0.152	C	C	.	.			trans	-88.1	112.9	173.3	179.3	62.3	0	0	0	110.7	T760 A886 Q890 P951 G952	T760-L954 HydrophobicContact CG2-CD1 3.86Å; A886-L954 HydrophobicContact CB-CD2 3.96Å; Q890-L954 HydrophobicContact CB-CD2 4.28Å; P951-L954 HydrophobicContact CB-CB 4.21Å; P951-L954 HydrophobicContact CB-CD2 4.32Å; P951-L954 VanDerWaalsContact O-CB 3.31Å; P951-L954 WeakPolarHBondContact O-CB 3.33Å; P951-L954 PolarHBondContact O-N 3.04Å; P951-L954 VanDerWaalsContact O-N 3.13Å; G952-L954 PolarHBondContact O-N 3.27Å
955	P	85.3	Confident	75.9	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.006	13%	0.134	C	C	.	.			trans	-67.3	145.8	169.7	-0.2	8.3	0	0	0	112	L701 L758 T761 F953 R961 Y962	L701-P955 HydrophobicContact CD1-CB 3.54Å; L701-P955 HydrophobicContact CD1-CG 3.53Å; L701-P955 HydrophobicContact CD2-CG 4.38Å; L758-P955 HydrophobicContact CD2-CG 4.31Å; T761-P955 HydrophobicContact CG2-CG 4.49Å; T761-P955 VanDerWaalsContact OG1-CD 3.29Å; T761-P955 WeakPolarHBondContact OG1-CD 3.03Å; T761-P955 WeakPolarHBondContact OG1-CG 3.29Å; T761-P955 PolarHBondContact OG1-O 2.83Å; F953-P955 VanDerWaalsContact O-CD 3.29Å; F953-P955 WeakPolarHBondContact O-CD 3.36Å; P955-R961 WeakPolarHBondContact CA-O 3.35Å; P955-Y962 HydrophobicContact CB-CE1 4.25Å; P955-Y962 HydrophobicContact CB-CE2 4.49Å; P955-Y962 HydrophobicContact CG-CE1 3.76Å; P955-Y962 HydrophobicContact CG-CE2 4.44Å
956	R	80.3	Confident	75.6	Confident	120 Å²	120	27.9 Å²	27.9	45%	0.453	14%	0.143	S	C	.	.			trans	-68.1	136.2	171.3	-74.8	175	49.3	177.8	-6.8	111.4	T958 D959 G960 R961	R956-T958 PolarHBondContact NE-OG1 3.43Å; R956-T958 PolarHBondContact NH2-OG1 3.36Å; R956-T958 PolarHBondContact O-N 2.87Å; R956-D959 WeakPolarHBondContact CB-OD1 3.4Å; R956-D959 IonicContact CZ-OD2 2.76Å; R956-D959 IonicContact NE-OD1 3.43Å; R956-G960 VanDerWaalsContact O-CA 3.22Å; R956-G960 WeakPolarHBondContact O-CA 3.42Å; R956-G960 PolarHBondContact O-N 3.42Å; R956-R961 PolarHBondContact N-O 3.31Å
957	I	82	Confident	75.4	Confident	47 Å²	47	27.4 Å²	27.4	24%	0.241	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-26.5	177.1	-51	163.3	0	0	0	111.6	Y704 T764 L768 Q890 D959	Y704-I957 WeakPolarHBondContact CD1-O 3.41Å; Y704-I957 HydrophobicContact CE1-CG2 3.72Å; Y704-I957 WeakPolarHBondContact CE1-O 3.41Å; T764-I957 HydrophobicContact CG2-CD1 3.38Å; T764-I957 HydrophobicContact CG2-CG1 4.33Å; L768-I957 HydrophobicContact CD1-CD1 4.32Å; L768-I957 HydrophobicContact CD1-CG2 4.32Å; Q890-I957 HydrophobicContact CG-CD1 4.16Å; I957-D959 PolarHBondContact O-N 2.86Å
958	T	74.3	Confident	75.1	Confident	103 Å²	103	29.8 Å²	29.8	63%	0.632	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-31.2	-175.2	53.6	0	0	0	0	114.1	R956	R956-T958 PolarHBondContact NE-OG1 3.43Å; R956-T958 PolarHBondContact NH2-OG1 3.36Å; R956-T958 PolarHBondContact O-N 2.87Å
959	D	72.4	Confident	74.5	Confident	32 Å²	32	29.6 Å²	29.6	17%	0.171	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-147.2	-1.6	-170.3	62.7	0.4	0	0	0	114.2	R705 R956 I957 R961	R705-D959 WeakPolarHBondContact CG-O 3.3Å; R956-D959 WeakPolarHBondContact CB-OD1 3.4Å; R956-D959 IonicContact CZ-OD2 2.76Å; R956-D959 IonicContact NE-OD1 3.43Å; I957-D959 PolarHBondContact O-N 2.86Å; D959-R961 VanDerWaalsContact C-N 3.26Å; D959-R961 HydrophobicContact CB-CG 4.25Å; D959-R961 PolarHBondContact O-N 3.49Å; D959-R961 WeakPolarHBondContact OD1-CB 3.45Å; D959-R961 PolarHBondContact OD1-N 2.92Å; D959-R961 VanDerWaalsContact OD1-N 3.11Å; D959-R961 WeakPolarHBondContact OD2-CD 3.21Å
960	G	74.6	Confident	73.3	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.152	C	C	.	.	S	Bend	trans	67.8	22.8	-179.3	0	0	0	0	0	113.8	L701 R705 R956	L701-G960 WeakPolarHBondContact CD1-O 3.45Å; R705-G960 PolarHBondContact NE-O 3.26Å; R705-G960 VanDerWaalsContact NE-O 3.14Å; R705-G960 PolarHBondContact NH2-O 2.91Å; R956-G960 VanDerWaalsContact O-CA 3.22Å; R956-G960 WeakPolarHBondContact O-CA 3.42Å; R956-G960 PolarHBondContact O-N 3.42Å
961	R	73.2	Confident	72	Confident	45 Å²	45	30.9 Å²	30.9	17%	0.17	16%	0.156	C	C	.	.			trans	-100.9	149.6	-178.9	-62.7	-175.1	176.4	-166.3	-8.8	112.1	H294 P295 L297 P955 R956 D959	H294-R961 PolarHBondContact O-NH2 2.83Å; P295-R961 VanDerWaalsContact C-NH2 3.28Å; P295-R961 PolarHBondContact O-NE 2.81Å; P295-R961 PolarHBondContact O-NH2 3.15Å; L297-R961 VanDerWaalsContact O-CZ 3.29Å; L297-R961 PolarHBondContact O-NH1 3.49Å; L297-R961 PolarHBondContact O-NH2 2.85Å; P955-R961 WeakPolarHBondContact CA-O 3.35Å; R956-R961 PolarHBondContact N-O 3.31Å; D959-R961 VanDerWaalsContact C-N 3.26Å; D959-R961 HydrophobicContact CB-CG 4.25Å; D959-R961 PolarHBondContact O-N 3.49Å; D959-R961 WeakPolarHBondContact OD1-CB 3.45Å; D959-R961 PolarHBondContact OD1-N 2.92Å; D959-R961 VanDerWaalsContact OD1-N 3.11Å; D959-R961 WeakPolarHBondContact OD2-CD 3.21Å
962	Y	69.2	Low	70.4	Confident	17 Å²	17	34.8 Å²	34.8	7%	0.067	17%	0.171	C	C	.	.			trans	-87.7	151.5	172.8	-61.7	-92.7	0	0	0	110.5	D697 L701 R754 F953 P955 C964 F967 W968	D697-Y962 VanDerWaalsContact CG-OH 3.25Å; D697-Y962 WeakPolarHBondContact OD1-CE2 3.48Å; D697-Y962 PolarHBondContact OD1-OH 3.46Å; L701-Y962 HydrophobicContact CD1-CE2 4.45Å; R754-Y962 VanDerWaalsContact NH1-CE1 3.28Å; R754-Y962 PolarHBondContact NH1-OH 3.24Å; F953-Y962 WeakPolarHBondContact O-CE1 3.49Å; P955-Y962 HydrophobicContact CB-CE1 4.25Å; P955-Y962 HydrophobicContact CB-CE2 4.49Å; P955-Y962 HydrophobicContact CG-CE1 3.76Å; P955-Y962 HydrophobicContact CG-CE2 4.44Å; Y962-C964 PolarHBondContact O-N 2.89Å; Y962-F967 HydrophobicContact CD1-CB 4Å; Y962-F967 HydrophobicContact CG-CB 4.4Å; Y962-W968 HydrophobicContact CD2-CB 3.61Å; Y962-W968 HydrophobicContact CD2-CG 4.16Å; Y962-W968 HydrophobicContact CE2-CB 3.67Å; Y962-W968 HydrophobicContact CG-CB 4.21Å
963	A	62.9	Low	68.6	Low	23 Å²	23	38 Å²	38	19%	0.19	19%	0.188	C	C	.	.	S	Bend	trans	-59.5	-33.7	176.1	0	0	0	0	0	112.8	V950 P951	V950-A963 HydrophobicContact CB-CB 3.93Å; V950-A963 HydrophobicContact CG1-CB 4.18Å; P951-A963 HydrophobicContact CG-CB 4.08Å
964	C	59.9	Low	66.2	Low	15 Å²	15	40.3 Å²	40.3	10%	0.101	20%	0.201	C	C	.	.	S	Bend	trans	-139.3	146.2	177.5	178.5	0	0	0	0	112.1	I879 Y962 V966 F967	I879-C964 HydrophobicContact CD1-CB 4.1Å; I879-C964 VanDerWaalsContact CD1-SG 3.5Å; Y962-C964 PolarHBondContact O-N 2.89Å; C964-V966 PolarHBondContact O-N 3.2Å; C964-V966 VanDerWaalsContact O-N 3.13Å; C964-F967 HydrophobicContact CB-CD2 3.68Å; C964-F967 HydrophobicContact CB-CE2 3.66Å; C964-F967 PolarHBondContact O-N 3.12Å
965	P	56	Low	63.6	Low	38 Å²	38	45.1 Å²	45.1	25%	0.247	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-57.8	-24.1	175.4	-27.4	35.4	0	0	0	115.8	Y298 F967 W968 R969	Y298-P965 HydrophobicContact CD1-CG 3.83Å; Y298-P965 HydrophobicContact CE1-CG 4.11Å; P965-F967 PolarHBondContact O-N 3.32Å; P965-W968 VanDerWaalsContact O-CD1 3.26Å; P965-W968 PolarHBondContact O-N 2.78Å; P965-W968 PolarHBondContact O-NE1 3.23Å; P965-R969 WeakPolarHBondContact O-CG 3.41Å; P965-R969 PolarHBondContact O-N 3.34Å
966	V	63.7	Low	60.9	Low	43 Å²	43	49.9 Å²	49.9	26%	0.261	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-61.4	-30	-180	176.4	0	0	0	0	111.7	C964 W968	C964-V966 PolarHBondContact O-N 3.2Å; C964-V966 VanDerWaalsContact O-N 3.13Å; V966-W968 VanDerWaalsContact C-N 3.33Å; V966-W968 PolarHBondContact O-N 2.77Å
967	F	68.7	Low	58.5	Low	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-81.9	-3.8	-175.5	-59.6	-65.2	0	0	0	114.7	R754 I879 D881 V950 G952 F953 Y962 C964 P965	R754-F967 WeakPolarHBondContact CD-O 3.4Å; R754-F967 PolarHBondContact NH1-O 3.36Å; I879-F967 HydrophobicContact CG2-CE2 3.94Å; I879-F967 HydrophobicContact CG2-CZ 3.74Å; D881-F967 HydrophobicContact CB-CE1 3.91Å; D881-F967 HydrophobicContact CB-CZ 4.17Å; V950-F967 HydrophobicContact CG2-CE2 3.59Å; V950-F967 HydrophobicContact CG2-CZ 3.73Å; G952-F967 VanDerWaalsContact O-CB 3.31Å; G952-F967 WeakPolarHBondContact O-CB 3.38Å; G952-F967 VanDerWaalsContact O-CD2 3.26Å; G952-F967 WeakPolarHBondContact O-CD2 3.44Å; G952-F967 WeakPolarHBondContact O-CG 3.4Å; F953-F967 HydrophobicContact CD1-CB 3.79Å; F953-F967 AromaticContact CD1-CD1 3.84Å; F953-F967 HydrophobicContact CD1-CD1 3.84Å; F953-F967 HydrophobicContact CD1-CG 4.29Å; F953-F967 VanDerWaalsContact CD1-O 3.23Å; F953-F967 WeakPolarHBondContact CD1-O 3.43Å; F953-F967 HydrophobicContact CD2-CD1 4.18Å; F953-F967 HydrophobicContact CE1-CB 4.09Å; F953-F967 AromaticContact CE1-CD1 3.72Å; F953-F967 HydrophobicContact CE1-CD1 3.72Å; F953-F967 HydrophobicContact CE1-CG 4.41Å; F953-F967 HydrophobicContact CE2-CD1 4.05Å; F953-F967 HydrophobicContact CE2-CE1 4.44Å; F953-F967 HydrophobicContact CG-CB 4.46Å; F953-F967 HydrophobicContact CG-CD1 4.07Å; F953-F967 AromaticContact CZ-CD1 3.81Å; F953-F967 HydrophobicContact CZ-CD1 3.81Å; F953-F967 HydrophobicContact CZ-CE1 4.45Å; Y962-F967 HydrophobicContact CD1-CB 4Å; Y962-F967 HydrophobicContact CG-CB 4.4Å; C964-F967 HydrophobicContact CB-CD2 3.68Å; C964-F967 HydrophobicContact CB-CE2 3.66Å; C964-F967 PolarHBondContact O-N 3.12Å; P965-F967 PolarHBondContact O-N 3.32Å
968	W	66.1	Low	55.7	Low	50 Å²	50	50.8 Å²	50.8	19%	0.189	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.2	-11.3	176.4	75.5	-93.2	0	0	0	115.9	R754 Y962 P965 V966	R754-W968 VanDerWaalsContact NH1-CB 3.31Å; Y962-W968 HydrophobicContact CD2-CB 3.61Å; Y962-W968 HydrophobicContact CD2-CG 4.16Å; Y962-W968 HydrophobicContact CE2-CB 3.67Å; Y962-W968 HydrophobicContact CG-CB 4.21Å; P965-W968 VanDerWaalsContact O-CD1 3.26Å; P965-W968 PolarHBondContact O-N 2.78Å; P965-W968 PolarHBondContact O-NE1 3.23Å; V966-W968 VanDerWaalsContact C-N 3.33Å; V966-W968 PolarHBondContact O-N 2.77Å
969	R	63.8	Low	53.4	Low	57 Å²	57	48.4 Å²	48.4	22%	0.215	24%	0.237	C	C	.	.	S	Bend	trans	-73.4	143.7	-179.8	-73.8	176.8	-175.8	-169	0.4	112	F750 P965 D973	F750-R969 VanDerWaalsContact CE2-O 3.28Å; F750-R969 WeakPolarHBondContact CE2-O 3.32Å; F750-R969 WeakPolarHBondContact CZ-O 3.5Å; P965-R969 WeakPolarHBondContact O-CG 3.41Å; P965-R969 PolarHBondContact O-N 3.34Å; R969-D973 HydrophobicContact CB-CB 4.11Å
970	P	56	Low	50.9	Low	12 Å²	12	52.8 Å²	52.8	8%	0.078	27%	0.267	C	S	.	.			trans	-58.9	151	173.4	-22.9	32.4	0	0	0	113.3	S690 K972 D973	S690-P970 WeakPolarHBondContact OG-CA 3.48Å; P970-K972 PolarHBondContact O-N 2.8Å; P970-D973 PolarHBondContact O-N 3.37Å
971	L	54.8	Low	48.5	Very low	15 Å²	15	58.5 Å²	58.5	8%	0.079	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-28.2	-177.5	-80.4	169.5	0	0	0	115	Y686 S690 R747 F750 L751 N974	Y686-L971 HydrophobicContact CD1-CD1 4.46Å; S690-L971 PolarHBondContact OG-N 2.9Å; R747-L971 HydrophobicContact CB-CD1 4.15Å; R747-L971 HydrophobicContact CG-CD1 4.23Å; R747-L971 HydrophobicContact CG-CD2 4.35Å; F750-L971 HydrophobicContact CB-CD2 3.92Å; F750-L971 HydrophobicContact CD1-CD1 4.07Å; F750-L971 HydrophobicContact CD1-CD2 3.71Å; F750-L971 HydrophobicContact CD1-CG 3.59Å; F750-L971 HydrophobicContact CD2-CD2 4.26Å; F750-L971 HydrophobicContact CE1-CD2 4.36Å; F750-L971 HydrophobicContact CE1-CG 3.89Å; F750-L971 HydrophobicContact CG-CD2 3.68Å; F750-L971 HydrophobicContact CG-CG 4.11Å; L751-L971 HydrophobicContact CD2-CD1 4.38Å; L751-L971 HydrophobicContact CG-CD1 4.44Å; L971-N974 PolarHBondContact O-N 3.28Å
972	K	50.8	Low	46	Very low	96 Å²	96	67.9 Å²	67.9	42%	0.417	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-34.8	177.2	-97.4	-174.3	-162.2	158	0	112.9	H687 P970 N974 R975	H687-K972 WeakPolarHBondContact CD2-CD 3.12Å; H687-K972 WeakPolarHBondContact CD2-CE 3.47Å; H687-K972 VanDerWaalsContact CD2-CG 3.48Å; H687-K972 WeakPolarHBondContact CD2-CG 3.37Å; H687-K972 VanDerWaalsContact NE2-CD 3.32Å; H687-K972 WeakPolarHBondContact NE2-CD 3.27Å; H687-K972 WeakPolarHBondContact NE2-CE 3.5Å; H687-K972 PolarHBondContact NE2-NZ 2.96Å; H687-K972 VanDerWaalsContact NE2-NZ 3.14Å; P970-K972 PolarHBondContact O-N 2.8Å; K972-N974 PolarHBondContact O-N 3.47Å; K972-R975 PolarHBondContact O-N 2.84Å
973	D	45.7	Very low	44.8	Very low	67 Å²	67	70.4 Å²	70.4	36%	0.358	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-23.5	-179.9	-61.8	-11.8	0	0	0	111.2	K96 R969 P970	K96-D973 WeakPolarHBondContact CE-O 3.34Å; K96-D973 PolarHBondContact NZ-O 3.37Å; R969-D973 HydrophobicContact CB-CB 4.11Å; P970-D973 PolarHBondContact O-N 3.37Å
974	N	38.7	Very low	43.9	Very low	59 Å²	59	72.9 Å²	72.9	32%	0.316	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-8.1	-179.8	-69.8	-12.7	0	0	0	113.9	L971 K972 N976	L971-N974 PolarHBondContact O-N 3.28Å; K972-N974 PolarHBondContact O-N 3.47Å; N974-N976 PolarHBondContact O-N 3.39Å
975	R	36.2	Very low	43	Very low	108 Å²	108	76.1 Å²	76.1	41%	0.408	39%	0.388	S	S	.	.			trans	-74.1	-4.2	-166.9	-88.5	-173.5	-171.4	-172.5	6.2	118	K972	K972-R975 PolarHBondContact O-N 2.84Å
976	N	29	Very low	42.2	Very low	100 Å²	100	78.4 Å²	78.4	54%	0.535	40%	0.396	S	S	.	.	S	Bend	trans	-122.2	122.7	179.2	-79.6	-14.8	0	0	0	113.2	P92 K96 N974	P92-N976 HydrophobicContact CB-CB 4.44Å; K96-N976 PolarHBondContact NZ-O 2.79Å; N974-N976 PolarHBondContact O-N 3.39Å
977	K	29.6	Very low	40.9	Very low	64 Å²	64	80.6 Å²	80.6	28%	0.278	41%	0.405	S	S	.	.			trans	103.1	70.9	172.1	-58.2	-175	-175.4	-178.4	0	116.4	F105 L979	F105-K977 HydrophobicContact CE2-CD 4Å; F105-K977 HydrophobicContact CZ-CD 4.45Å; K977-L979 HydrophobicContact CB-CD1 4.42Å; K977-L979 HydrophobicContact CD-CD1 4.3Å
978	I	25.1	Very low	39	Very low	123 Å²	123	85.9 Å²	85.9	63%	0.631	43%	0.432	S	S	*	.				-81.6	110.1	116.6	-57.9	170.3	0	0	0	103	K746 P980	K746-I978 VanDerWaalsContact NZ-CD1 3.31Å; I978-P980 WeakPolarHBondContact O-CD 3.47Å
979	L	24.2	Very low	37.1	Very low	52 Å²	52	88.5 Å²	88.5	27%	0.272	45%	0.449	S	S	.	.			trans	-59.4	127	165.9	-87.4	103	0	0	0	106.5	F105 K977 L981	F105-L979 HydrophobicContact CE2-CD1 4.34Å; F105-L979 HydrophobicContact CE2-CD2 4.02Å; F105-L979 HydrophobicContact CE2-CG 4.33Å; F105-L979 HydrophobicContact CZ-CD2 4.39Å; K977-L979 HydrophobicContact CB-CD1 4.42Å; K977-L979 HydrophobicContact CD-CD1 4.3Å; L979-L981 VanDerWaalsContact C-N 3.25Å; L979-L981 PolarHBondContact O-N 3.26Å
980	P	21.7	Very low	35	Very low	124 Å²	124	90.9 Å²	90.9	81%	0.805	47%	0.467	S	S	*	.			trans	-63.6	102.7	150.7	2.7	13.3	0	0	0	104.9	I978 L982	I978-P980 WeakPolarHBondContact O-CD 3.47Å; P980-L982 PolarHBondContact O-N 3.16Å
981	L	23.1	Very low	33.3	Very low	121 Å²	121	97.5 Å²	97.5	63%	0.634	50%	0.499	S	S	*	.			trans	-68.4	104.7	167.4	-80.6	154.8	0	0	0	106.5	L979	L979-L981 VanDerWaalsContact C-N 3.25Å; L979-L981 PolarHBondContact O-N 3.26Å
982	L	20.7	Very low	31.3	Very low	241 Å²	241	105 Å²	105	100%	1.262	54%	0.538	S	S	*	.			trans	-108.5	0	145.4	-90.3	165.9	0	0	0	106.6	P980	P980-L982 PolarHBondContact O-N 3.16Å

Retrieved 982 of 982 residues in 284.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).