A0A061IPS9_CRIGR Loading...

Anoctamin

AlphaFold DB , UniProt , Accession A0A061IPS9, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Ano4, Length 955 aa.

						>A0A061IPS9_CRIGR|A0A061IPS9|Ano4
MEASSSGSTNGKNKVFHAEGGVDLQGHQLDMQILPDGPNSDVDFSEILNAIQEMAKDVNILFDELEAVNSPCKDDDSLLHPGNLTSTSEDASRLEAGGETVRERNKSNGLYFRDGKCRIDYILVYRKSNPQTEKREVFERNIRAEGLQMEKESSLINSDIIFVKLHAPWEVLGRYAEQMNVRMPFRRKIYYLPRRYKFMSRIDKQISRFRRWLPKKPMRLDKETLPDLEENDCYTAPFSQQRIHHFIIHNKDTFFNNATRSRIVHHILQRIKYEEGKNKIGLNRLLTNGSYEAAFPLHEGSYRSKNSIKTHGAVNHRHLLYECWASWGVWYKYQPLDLVRRYFGEKIGLYFAWLGWYTGMLFPAAFIGLFVFLYGVTTLDHCQVSKEVCQATDIIMCPVCDKYCPFMRLSDSCVYAKVTHLFDNGATVFFAVFMAVWATVFLEFWKRRRAVIAYDWDLIDWEEEEEEIRPQFEAKYSKKERMNPISGKPEPYQAFTDKCSRLIVSASGIFFMICVVIAAVFGIVIYRVVTVSTFAAFKWALIRNNSQVATTGTAVCINFCIIMLLNVLYEKVALLLTNLEQPRTESEWENSFTLKMFLFQFVNLNSSTFYIAFFLGRFTGHPGAYLRLINRWRLEECHPSGCLIDLCMQMGIIMVLKQTWNNFMELGYPLIQNWWTRRKVRQEHGTERKINFPQWEKDYNLQPMNAYGLFDEYLEMILQFGFTTIFVAAFPLAPLLALLNNIIEIRLDAYKFVTQWRRPLASRAKDIGIWYGILEGIGILSVITNAFVIAITSDFIPRLVYAYKYGPCAGQGEAGQKCMVGYVNASLSVFRISDFENRSEPESDGSEFSGTPLKYCRYRDYRDPPHSLAPYGYTLQFWHVLAARLAFIIVFEHLVFCIKHLISYLIPDLPKDLRDRMRREKYLIQEMMYEAELERLQKERKERKKNGKAHHNEWP
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.2	Very low	30	Very low	217 Å²	217	126.3 Å²	126.3	100%	1.069	83%	0.826	S	S	*	*				0	62.7	0	-54.3	175.2	-172.6	0	0	107.6
2	E	29.6	Very low	29.8	Very low	176 Å²	176	131.7 Å²	131.7	82%	0.822	83%	0.827	S	S	*	*				66.9	116.6	60	-62.3	151.3	131.4	0	0	110.7
3	A	34.3	Very low	29.5	Very low	91 Å²	91	131.8 Å²	131.8	75%	0.752	82%	0.818	S	S	*	*			cis	90.6	159	26.9	0	0	0	0	0	115.1
4	S	32.8	Very low	29.4	Very low	118 Å²	118	135.1 Å²	135.1	83%	0.825	82%	0.815	S	S	*	*			trans	77.1	147.8	-171.4	80.2	0	0	0	0	115.5
5	S	33.4	Very low	29.3	Very low	120 Å²	120	133.3 Å²	133.3	84%	0.839	80%	0.804	S	S	*	*			cis	-161.7	177.1	-14.2	42.5	0	0	0	0	113.1
6	S	33.2	Very low	28.9	Very low	126 Å²	126	136.1 Å²	136.1	88%	0.881	80%	0.803	S	S	*	*			trans	-94.5	163.4	-166.2	53.6	0	0	0	0	118.6
7	G	28.8	Very low	28.6	Very low	78 Å²	78	137.6 Å²	137.6	80%	0.804	80%	0.8	S	S	*	*			trans	165.5	152.2	159.7	0	0	0	0	0	111.5
8	S	24.5	Very low	28.5	Very low	120 Å²	120	134.1 Å²	134.1	84%	0.839	79%	0.789	S	S	*	*			cis	-149.2	-157.6	-0	-166.4	0	0	0	0	111.2
9	T	29.6	Very low	28.4	Very low	111 Å²	111	136.7 Å²	136.7	68%	0.681	79%	0.793	S	S	*	*			trans	-128	167.7	-151.5	59.5	0	0	0	0	119.2
10	N	28	Very low	28.1	Very low	164 Å²	164	133.9 Å²	133.9	88%	0.877	79%	0.794	S	S	*	*			trans	73.6	152.2	161.3	-57.7	-41.5	0	0	0	119.9
11	G	26.4	Very low	27.8	Very low	68 Å²	68	131 Å²	131	70%	0.701	79%	0.792	S	S	*	*			cis	161.7	143.7	-16.4	0	0	0	0	0	117.5
12	K	27.6	Very low	27.6	Very low	191 Å²	191	127 Å²	127	83%	0.83	78%	0.78	S	S	*	*			trans	78.4	127.8	157	-66.6	178.8	177.4	173.6	0	124
13	N	25.6	Very low	27.2	Very low	134 Å²	134	125.4 Å²	125.4	72%	0.717	78%	0.777	S	S	*	*			trans	67.9	151.4	134.4	-63.8	-5.1	0	0	0	121.5
14	K	28.1	Very low	26.7	Very low	177 Å²	177	127.7 Å²	127.7	77%	0.77	78%	0.776	S	S	*	*			cis	-164.3	139.1	-11.4	-117.9	-167.2	175.5	-171.1	0	112.5
15	V	28.1	Very low	26.3	Very low	108 Å²	108	129.7 Å²	129.7	66%	0.655	77%	0.772	S	S	*	*			trans	49.3	131.3	133.6	175.2	0	0	0	0	122.4
16	F	23.6	Very low	25.7	Very low	179 Å²	179	127.2 Å²	127.2	79%	0.785	77%	0.766	S	S	*	*				-168.2	163.4	118.6	-111.1	-77.3	0	0	0	114.3
17	H	24.4	Very low	25.3	Very low	161 Å²	161	129.9 Å²	129.9	75%	0.745	76%	0.764	S	S	*	*			trans	-47.5	167.8	-177	-68.5	-58.1	0	0	0	118.2
18	A	26.3	Very low	25	Very low	74 Å²	74	132.8 Å²	132.8	61%	0.612	76%	0.757	S	S	*	*			cis	-176.5	-168.1	-17.8	0	0	0	0	0	108.3
19	E	25.7	Very low	24.9	Very low	185 Å²	185	135.4 Å²	135.4	86%	0.864	76%	0.76	S	S	*	*			cis	-146.8	-114.1	4.8	-159.1	73.6	-89.4	0	0	112.2
20	G	23.5	Very low	24.5	Very low	79 Å²	79	134.5 Å²	134.5	81%	0.814	75%	0.752	S	S	*	*			trans	-148.3	176.1	-173.5	0	0	0	0	0	117.7
21	G	22	Very low	24.2	Very low	73 Å²	73	135.4 Å²	135.4	75%	0.753	75%	0.752	S	S	*	*			trans	172.5	68.4	-177.7	0	0	0	0	0	120.3
22	V	23.3	Very low	23.9	Very low	133 Å²	133	140 Å²	140	81%	0.806	76%	0.756	S	S	*	*			trans	60.7	139.1	132.3	177.7	0	0	0	0	123.2
23	D	22.6	Very low	23.7	Very low	144 Å²	144	138.7 Å²	138.7	77%	0.77	76%	0.756	S	S	*	*			trans	94.9	159.1	150.1	-87.3	-6.5	0	0	0	126
24	L	23.4	Very low	23.6	Very low	139 Å²	139	139.9 Å²	139.9	73%	0.728	76%	0.762	S	S	*	*			trans	-46.4	167.4	-175	-82.6	65.7	0	0	0	115.7
25	Q	24.2	Very low	23.9	Very low	159 Å²	159	136.1 Å²	136.1	74%	0.743	76%	0.755	S	S	*	*			cis	-159.6	142.7	34.1	-155.6	160.2	5.3	0	0	112.8
26	G	21.9	Very low	23.7	Very low	69 Å²	69	138.5 Å²	138.5	71%	0.711	77%	0.765	S	S	*	*			trans	-95.2	149.6	161.3	0	0	0	0	0	110.7
27	H	23.8	Very low	23.7	Very low	181 Å²	181	133 Å²	133	84%	0.838	76%	0.758	S	S	*	*			trans	-123.6	117.8	163.6	-125.8	-57.8	0	0	0	111.3
28	Q	22.8	Very low	24.1	Very low	139 Å²	139	131.5 Å²	131.5	65%	0.65	76%	0.763	S	S	*	*			trans	-92.8	146.6	-177.2	-178.6	176.7	3.3	0	0	109.8	D30	Q28-D30 VanDerWaalsContact CG-OD1 3.3Å; Q28-D30 WeakPolarHBondContact CG-OD1 3.36Å; Q28-D30 PolarHBondContact NE2-OD1 2.89Å; Q28-D30 PolarHBondContact NE2-OD2 3.4Å
29	L	22	Very low	24.1	Very low	175 Å²	175	135.2 Å²	135.2	92%	0.916	77%	0.772	S	S	*	*			trans	-144.4	97.3	158.9	-120.8	172.7	0	0	0	107.8
30	D	20.8	Very low	24.5	Very low	93 Å²	93	131.2 Å²	131.2	50%	0.497	77%	0.765	S	S	.	*			trans	-69.3	152.7	-176.6	-65.4	-32.2	0	0	0	112	Q28 Q32	Q28-D30 VanDerWaalsContact CG-OD1 3.3Å; Q28-D30 WeakPolarHBondContact CG-OD1 3.36Å; Q28-D30 PolarHBondContact NE2-OD1 2.89Å; Q28-D30 PolarHBondContact NE2-OD2 3.4Å; D30-Q32 HydrophobicContact CB-CG 4.26Å
31	M	21.6	Very low	24.8	Very low	182 Å²	182	134.8 Å²	134.8	90%	0.897	77%	0.765	S	S	*	*			trans	-126.3	105.4	144.4	-155.8	-174.2	-50.9	0	0	108
32	Q	20.8	Very low	25.7	Very low	166 Å²	166	136 Å²	136	78%	0.776	76%	0.757	S	S	*	*			trans	-73.3	128.6	-173.1	-64.7	174.1	-16.8	0	0	111.5	D30	D30-Q32 HydrophobicContact CB-CG 4.26Å
33	I	23.8	Very low	26.4	Very low	163 Å²	163	134.2 Å²	134.2	84%	0.836	74%	0.743	S	S	*	*			trans	-135.1	124.2	159.2	-59.5	-176.9	0	0	0	108
34	L	23.4	Very low	27.1	Very low	159 Å²	159	134.8 Å²	134.8	83%	0.832	74%	0.74	S	S	*	*			trans	-102.1	168.4	172.9	-128.1	78.3	0	0	0	109
35	P	33.4	Very low	27.8	Very low	98 Å²	98	131.1 Å²	131.1	64%	0.636	73%	0.726	S	S	*	*				-127.7	-152.7	-101.9	41.3	-24.3	0	0	0	113.4
36	D	24.2	Very low	28.7	Very low	158 Å²	158	129.8 Å²	129.8	85%	0.845	72%	0.719	S	S	*	*			trans	75.8	87.8	162.1	-58.7	-15	0	0	0	119
37	G	24.7	Very low	29.7	Very low	63 Å²	63	130 Å²	130	65%	0.649	70%	0.703	S	S	*	*			trans	-127.1	142.8	144.9	0	0	0	0	0	108.8
38	P	31.2	Very low	30.5	Very low	130 Å²	130	126.9 Å²	126.9	84%	0.844	69%	0.692	S	S	*	*			trans	-72.7	135.5	-172	28.6	-34.6	0	0	0	112.4
39	N	27.3	Very low	31.6	Very low	152 Å²	152	124.8 Å²	124.8	81%	0.813	69%	0.686	S	S	*	*			trans	-60	141.7	166.8	-74.4	-8.1	0	0	0	110.6
40	S	33.5	Very low	32.5	Very low	101 Å²	101	118.1 Å²	118.1	71%	0.706	66%	0.655	S	S	*	*			trans	-135.1	102.3	159.9	57.8	0	0	0	0	108.1	V42	S40-V42 PolarHBondContact O-N 3.34Å
41	D	31.1	Very low	33.5	Very low	154 Å²	154	118.3 Å²	118.3	82%	0.824	66%	0.656	S	S	*	*			trans	-63.4	122.7	172.3	-65.7	-61.2	0	0	0	109	D43	D41-D43 PolarHBondContact O-N 2.9Å
42	V	40.1	Very low	34.1	Very low	97 Å²	97	116 Å²	116	59%	0.588	64%	0.642	S	S	*	*			trans	-87.2	101.2	-176.8	179.4	0	0	0	0	108.9	S40 F44 I47	S40-V42 PolarHBondContact O-N 3.34Å; V42-F44 PolarHBondContact O-N 3.06Å; V42-F44 VanDerWaalsContact O-N 3.14Å; V42-I47 HydrophobicContact CG1-CD1 3.8Å
43	D	39	Very low	35	Very low	96 Å²	96	113.4 Å²	113.4	51%	0.513	63%	0.63	S	S	.	*			trans	-70.6	107.7	178.6	-165.2	-33.1	0	0	0	110.9	D41 S45 E46	D41-D43 PolarHBondContact O-N 2.9Å; D43-S45 VanDerWaalsContact CG-OG 3.22Å; D43-S45 PolarHBondContact O-N 3.34Å; D43-S45 VanDerWaalsContact O-N 3.12Å; D43-S45 WeakPolarHBondContact OD1-CB 3.43Å; D43-S45 PolarHBondContact OD1-N 3.24Å; D43-S45 PolarHBondContact OD1-OG 2.82Å; D43-S45 PolarHBondContact OD2-OG 3.01Å; D43-E46 PolarHBondContact O-N 2.89Å; D43-E46 VanDerWaalsContact O-N 3.1Å
44	F	35.9	Very low	35.9	Very low	157 Å²	157	110.4 Å²	110.4	69%	0.689	61%	0.614	S	S	*	*	H	α-helix	trans	-61.3	-18	178.5	-88.3	-96.8	0	0	0	113.5	V42 I47 L48	V42-F44 PolarHBondContact O-N 3.06Å; V42-F44 VanDerWaalsContact O-N 3.14Å; F44-I47 HydrophobicContact CD1-CD1 4.34Å; F44-I47 PolarHBondContact O-N 3.05Å; F44-L48 PolarHBondContact O-N 3.3Å; F44-L48 VanDerWaalsContact O-N 3.08Å
45	S	37.8	Very low	36.5	Very low	62 Å²	62	105.2 Å²	105.2	43%	0.434	59%	0.594	S	S	.	*	H	α-helix	trans	-70.5	-32.9	174.4	74	0	0	0	0	112.5	D43 I47 N49	D43-S45 VanDerWaalsContact CG-OG 3.22Å; D43-S45 PolarHBondContact O-N 3.34Å; D43-S45 VanDerWaalsContact O-N 3.12Å; D43-S45 WeakPolarHBondContact OD1-CB 3.43Å; D43-S45 PolarHBondContact OD1-N 3.24Å; D43-S45 PolarHBondContact OD1-OG 2.82Å; D43-S45 PolarHBondContact OD2-OG 3.01Å; S45-I47 VanDerWaalsContact C-N 3.33Å; S45-N49 PolarHBondContact O-N 2.83Å; S45-N49 VanDerWaalsContact O-N 3.16Å; S45-N49 PolarHBondContact O-ND2 3.01Å
46	E	43.6	Very low	36.7	Very low	131 Å²	131	106 Å²	106	61%	0.612	59%	0.587	S	S	*	*	H	α-helix	trans	-66	-38.7	171.1	-73.3	-148.7	121.7	0	0	111	D43 N49 A50	D43-E46 PolarHBondContact O-N 2.89Å; D43-E46 VanDerWaalsContact O-N 3.1Å; E46-N49 PolarHBondContact O-N 3.48Å; E46-A50 WeakPolarHBondContact O-CB 3.49Å; E46-A50 PolarHBondContact O-N 3.33Å
47	I	43.6	Very low	37.2	Very low	72 Å²	72	103.5 Å²	103.5	37%	0.369	57%	0.574	S	S	.	*	H	α-helix	trans	-64.2	-45.4	179	-59.3	178.9	0	0	0	110.9	V42 F44 S45 N49 A50 I51	V42-I47 HydrophobicContact CG1-CD1 3.8Å; F44-I47 HydrophobicContact CD1-CD1 4.34Å; F44-I47 PolarHBondContact O-N 3.05Å; S45-I47 VanDerWaalsContact C-N 3.33Å; I47-N49 PolarHBondContact O-N 2.93Å; I47-A50 PolarHBondContact O-N 3.32Å; I47-I51 HydrophobicContact CG2-CD1 4.17Å; I47-I51 WeakPolarHBondContact O-CG1 3.41Å; I47-I51 PolarHBondContact O-N 2.96Å
48	L	40	Very low	37.9	Very low	116 Å²	116	104 Å²	104	61%	0.607	56%	0.564	S	S	*	*	H	α-helix	trans	-62.1	-44	177.2	-120.7	82.3	0	0	0	111.8	F44 A50 I51 Q52	F44-L48 PolarHBondContact O-N 3.3Å; F44-L48 VanDerWaalsContact O-N 3.08Å; L48-A50 VanDerWaalsContact C-N 3.32Å; L48-A50 PolarHBondContact O-N 2.92Å; L48-I51 PolarHBondContact O-N 2.89Å; L48-Q52 PolarHBondContact O-N 2.74Å
49	N	46.1	Very low	37.8	Very low	96 Å²	96	102.5 Å²	102.5	51%	0.513	55%	0.549	S	S	.	.	H	α-helix	trans	-63.5	-37.1	175.7	-76.7	-59.5	0	0	0	112	S45 E46 I47 Q52 E53	S45-N49 PolarHBondContact O-N 2.83Å; S45-N49 VanDerWaalsContact O-N 3.16Å; S45-N49 PolarHBondContact O-ND2 3.01Å; E46-N49 PolarHBondContact O-N 3.48Å; I47-N49 PolarHBondContact O-N 2.93Å; N49-Q52 PolarHBondContact O-N 3.45Å; N49-E53 WeakPolarHBondContact O-CG 3.41Å; N49-E53 PolarHBondContact O-N 3.46Å
50	A	40.8	Very low	38.3	Very low	34 Å²	34	99.5 Å²	99.5	28%	0.281	53%	0.532	S	S	.	.	H	α-helix	trans	-65.3	-39	175.9	0	0	0	0	0	112.2	E46 I47 L48 Q52 M54	E46-A50 WeakPolarHBondContact O-CB 3.49Å; E46-A50 PolarHBondContact O-N 3.33Å; I47-A50 PolarHBondContact O-N 3.32Å; L48-A50 VanDerWaalsContact C-N 3.32Å; L48-A50 PolarHBondContact O-N 2.92Å; A50-Q52 VanDerWaalsContact C-N 3.35Å; A50-M54 WeakPolarHBondContact O-CB 3.29Å; A50-M54 WeakPolarHBondContact O-CG 3.25Å; A50-M54 PolarHBondContact O-N 2.87Å
51	I	41	Very low	38.2	Very low	98 Å²	98	99.4 Å²	99.4	50%	0.503	52%	0.523	S	S	.	.	H	α-helix	trans	-63.5	-42.3	173.2	-67.4	165.3	0	0	0	110.5	I47 L48 E53 M54 A55	I47-I51 HydrophobicContact CG2-CD1 4.17Å; I47-I51 WeakPolarHBondContact O-CG1 3.41Å; I47-I51 PolarHBondContact O-N 2.96Å; L48-I51 PolarHBondContact O-N 2.89Å; I51-E53 PolarHBondContact O-N 2.94Å; I51-M54 HydrophobicContact CG1-CE 4.26Å; I51-M54 PolarHBondContact O-N 3.47Å; I51-A55 PolarHBondContact O-N 3.34Å
52	Q	35.2	Very low	38.4	Very low	132 Å²	132	98.1 Å²	98.1	62%	0.617	51%	0.511	S	S	*	.	H	α-helix	trans	-74.1	-23.4	-178.2	-163.8	165.4	-1.5	0	0	113.8	L48 N49 A50	L48-Q52 PolarHBondContact O-N 2.74Å; N49-Q52 PolarHBondContact O-N 3.45Å; A50-Q52 VanDerWaalsContact C-N 3.35Å
53	E	40.3	Very low	38	Very low	112 Å²	112	98.5 Å²	98.5	52%	0.523	51%	0.51	S	S	.	.	H	α-helix	trans	-81.5	-38.7	167.6	-66.8	-113.1	107.2	0	0	112.1	N49 I51 A55 K56 D57	N49-E53 WeakPolarHBondContact O-CG 3.41Å; N49-E53 PolarHBondContact O-N 3.46Å; I51-E53 PolarHBondContact O-N 2.94Å; E53-A55 PolarHBondContact O-N 3Å; E53-K56 WeakPolarHBondContact O-CA 3.41Å; E53-K56 WeakPolarHBondContact O-CB 3.45Å; E53-K56 PolarHBondContact O-N 3.19Å; E53-K56 IonicContact OE1-NZ 3.77Å; E53-K56 PolarHBondContact OE1-NZ 2.75Å; E53-D57 PolarHBondContact O-N 2.93Å; E53-D57 VanDerWaalsContact O-N 3.07Å
54	M	41.4	Very low	37.9	Very low	101 Å²	101	98.6 Å²	98.6	50%	0.498	51%	0.507	S	S	.	.	H	α-helix	trans	-58.8	-35.4	172.4	-79.8	-171.4	-67.8	0	0	112	A50 I51 K56 D57 V58	A50-M54 WeakPolarHBondContact O-CB 3.29Å; A50-M54 WeakPolarHBondContact O-CG 3.25Å; A50-M54 PolarHBondContact O-N 2.87Å; I51-M54 HydrophobicContact CG1-CE 4.26Å; I51-M54 PolarHBondContact O-N 3.47Å; M54-K56 VanDerWaalsContact C-N 3.25Å; M54-K56 PolarHBondContact O-N 3.44Å; M54-D57 PolarHBondContact O-N 2.86Å; M54-V58 WeakPolarHBondContact O-CB 3.49Å; M54-V58 VanDerWaalsContact O-CG2 3.31Å; M54-V58 WeakPolarHBondContact O-CG2 3.49Å; M54-V58 PolarHBondContact O-N 2.95Å
55	A	36.8	Very low	37.9	Very low	50 Å²	50	95.9 Å²	95.9	41%	0.413	50%	0.499	S	S	.	.	H	α-helix	trans	-61	-31.4	172.3	0	0	0	0	0	113.2	I51 E53 N59	I51-A55 PolarHBondContact O-N 3.34Å; E53-A55 PolarHBondContact O-N 3Å; A55-N59 WeakPolarHBondContact O-CB 3.27Å; A55-N59 PolarHBondContact O-N 2.65Å; A55-N59 PolarHBondContact O-OD1 3.42Å
56	K	36.2	Very low	37.7	Very low	113 Å²	113	100.2 Å²	100.2	49%	0.491	51%	0.513	S	S	.	.	H	α-helix	trans	-75.2	-44.4	174.4	-60.3	174.1	-166.6	163.1	0	111.6	E53 M54 V58 N59 I60	E53-K56 WeakPolarHBondContact O-CA 3.41Å; E53-K56 WeakPolarHBondContact O-CB 3.45Å; E53-K56 PolarHBondContact O-N 3.19Å; E53-K56 IonicContact OE1-NZ 3.77Å; E53-K56 PolarHBondContact OE1-NZ 2.75Å; M54-K56 VanDerWaalsContact C-N 3.25Å; M54-K56 PolarHBondContact O-N 3.44Å; K56-V58 VanDerWaalsContact C-N 3.27Å; K56-V58 PolarHBondContact O-N 2.88Å; K56-N59 PolarHBondContact O-N 2.74Å; K56-N59 VanDerWaalsContact O-N 3.14Å; K56-I60 WeakPolarHBondContact O-CG1 3.28Å; K56-I60 PolarHBondContact O-N 3.05Å
57	D	36.5	Very low	37.1	Very low	106 Å²	106	97.9 Å²	97.9	57%	0.567	52%	0.515	S	S	*	.	H	α-helix	trans	-64.5	-32.8	177.1	-82.2	-5.5	0	0	0	111.8	E53 M54 L61	E53-D57 PolarHBondContact O-N 2.93Å; E53-D57 VanDerWaalsContact O-N 3.07Å; M54-D57 PolarHBondContact O-N 2.86Å; D57-L61 PolarHBondContact O-N 3.28Å; D57-L61 VanDerWaalsContact O-N 3.1Å
58	V	37.7	Very low	36.8	Very low	73 Å²	73	100.1 Å²	100.1	44%	0.442	53%	0.532	S	S	.	.	H	α-helix	trans	-70.7	-38.6	170.8	170.5	0	0	0	0	111.7	M54 K56 I60 L61 F62	M54-V58 WeakPolarHBondContact O-CB 3.49Å; M54-V58 VanDerWaalsContact O-CG2 3.31Å; M54-V58 WeakPolarHBondContact O-CG2 3.49Å; M54-V58 PolarHBondContact O-N 2.95Å; K56-V58 VanDerWaalsContact C-N 3.27Å; K56-V58 PolarHBondContact O-N 2.88Å; V58-I60 VanDerWaalsContact C-N 3.33Å; V58-I60 PolarHBondContact O-N 2.92Å; V58-L61 VanDerWaalsContact O-CB 3.3Å; V58-L61 WeakPolarHBondContact O-CB 3.48Å; V58-L61 PolarHBondContact O-N 2.98Å; V58-L61 VanDerWaalsContact O-N 3.12Å; V58-F62 HydrophobicContact CG1-CD2 4.04Å; V58-F62 HydrophobicContact CG1-CE2 4.07Å; V58-F62 WeakPolarHBondContact O-CD2 3.31Å; V58-F62 PolarHBondContact O-N 3.01Å
59	N	30.2	Very low	36.2	Very low	99 Å²	99	100.8 Å²	100.8	53%	0.529	54%	0.536	S	S	.	.	H	α-helix	trans	-64	-38.8	172.5	-74	-3.2	0	0	0	111.7	A55 K56 L61 F62 D63	A55-N59 WeakPolarHBondContact O-CB 3.27Å; A55-N59 PolarHBondContact O-N 2.65Å; A55-N59 PolarHBondContact O-OD1 3.42Å; K56-N59 PolarHBondContact O-N 2.74Å; K56-N59 VanDerWaalsContact O-N 3.14Å; N59-L61 PolarHBondContact O-N 3.37Å; N59-F62 CarbonylContact O-C 3.58Å; N59-F62 WeakPolarHBondContact O-CA 3.27Å; N59-F62 PolarHBondContact O-N 3.44Å; N59-D63 PolarHBondContact O-N 2.87Å
60	I	37.5	Very low	35.2	Very low	89 Å²	89	100.8 Å²	100.8	46%	0.456	54%	0.544	S	S	.	.	H	α-helix	trans	-60.3	-35.3	172.1	-68.5	164.9	0	0	0	111.1	K56 V58 F62 D63 E64	K56-I60 WeakPolarHBondContact O-CG1 3.28Å; K56-I60 PolarHBondContact O-N 3.05Å; V58-I60 VanDerWaalsContact C-N 3.33Å; V58-I60 PolarHBondContact O-N 2.92Å; I60-F62 VanDerWaalsContact C-N 3.34Å; I60-D63 PolarHBondContact O-N 3.45Å; I60-E64 WeakPolarHBondContact O-CB 3.37Å; I60-E64 WeakPolarHBondContact O-CG 3.35Å; I60-E64 PolarHBondContact O-N 3.42Å
61	L	32.4	Very low	34.5	Very low	100 Å²	100	104.5 Å²	104.5	52%	0.524	57%	0.565	S	S	.	*	H	α-helix	trans	-68	-31.2	173.7	-168.5	72.7	0	0	0	112.9	D57 V58 N59 L65	D57-L61 PolarHBondContact O-N 3.28Å; D57-L61 VanDerWaalsContact O-N 3.1Å; V58-L61 VanDerWaalsContact O-CB 3.3Å; V58-L61 WeakPolarHBondContact O-CB 3.48Å; V58-L61 PolarHBondContact O-N 2.98Å; V58-L61 VanDerWaalsContact O-N 3.12Å; N59-L61 PolarHBondContact O-N 3.37Å; L61-L65 PolarHBondContact O-N 3.09Å
62	F	34	Very low	33.7	Very low	126 Å²	126	105.8 Å²	105.8	55%	0.553	58%	0.582	S	S	*	*	H	α-helix	trans	-77.8	-37.4	173.1	-86.8	-80	0	0	0	112.6	V58 N59 I60 E64 L65 E66	V58-F62 HydrophobicContact CG1-CD2 4.04Å; V58-F62 HydrophobicContact CG1-CE2 4.07Å; V58-F62 WeakPolarHBondContact O-CD2 3.31Å; V58-F62 PolarHBondContact O-N 3.01Å; N59-F62 CarbonylContact O-C 3.58Å; N59-F62 WeakPolarHBondContact O-CA 3.27Å; N59-F62 PolarHBondContact O-N 3.44Å; I60-F62 VanDerWaalsContact C-N 3.34Å; F62-E64 VanDerWaalsContact C-N 3.34Å; F62-L65 HydrophobicContact CD1-CD1 4.25Å; F62-L65 HydrophobicContact CE1-CD1 4.49Å; F62-L65 WeakPolarHBondContact O-CA 3.47Å; F62-L65 WeakPolarHBondContact O-CB 3.32Å; F62-L65 PolarHBondContact O-N 2.91Å; F62-E66 PolarHBondContact O-N 3.46Å; F62-E66 VanDerWaalsContact O-N 3.16Å
63	D	31.9	Very low	33.3	Very low	106 Å²	106	108.9 Å²	108.9	57%	0.567	59%	0.593	S	S	*	*	H	α-helix	trans	-64.3	-38.6	171.3	-65.5	-20.6	0	0	0	110.9	N59 I60 L65 E66 A67	N59-D63 PolarHBondContact O-N 2.87Å; I60-D63 PolarHBondContact O-N 3.45Å; D63-L65 PolarHBondContact O-N 3.39Å; D63-E66 PolarHBondContact O-N 3.26Å; D63-A67 WeakPolarHBondContact O-CB 3.45Å; D63-A67 PolarHBondContact O-N 2.95Å; D63-A67 VanDerWaalsContact O-N 3.08Å
64	E	38.3	Very low	32.6	Very low	97 Å²	97	110.7 Å²	110.7	45%	0.453	61%	0.606	S	S	.	*	H	α-helix	trans	-62.7	-24.5	170.5	-81.4	-165.9	157.3	0	0	112.5	I60 F62 V68	I60-E64 WeakPolarHBondContact O-CB 3.37Å; I60-E64 WeakPolarHBondContact O-CG 3.35Å; I60-E64 PolarHBondContact O-N 3.42Å; F62-E64 VanDerWaalsContact C-N 3.34Å; E64-V68 WeakPolarHBondContact O-CG2 3.25Å
65	L	35.4	Very low	31.9	Very low	101 Å²	101	113.7 Å²	113.7	53%	0.529	62%	0.624	S	S	.	*	H	α-helix	trans	-79.2	-35	175.1	-85.8	161.6	0	0	0	112.9	L61 F62 D63 N69	L61-L65 PolarHBondContact O-N 3.09Å; F62-L65 HydrophobicContact CD1-CD1 4.25Å; F62-L65 HydrophobicContact CE1-CD1 4.49Å; F62-L65 WeakPolarHBondContact O-CA 3.47Å; F62-L65 WeakPolarHBondContact O-CB 3.32Å; F62-L65 PolarHBondContact O-N 2.91Å; D63-L65 PolarHBondContact O-N 3.39Å; L65-N69 PolarHBondContact O-ND2 2.89Å
66	E	32.1	Very low	31.5	Very low	153 Å²	153	119.1 Å²	119.1	72%	0.715	65%	0.647	S	S	*	*	H	α-helix	trans	-72.4	-39.2	173.9	-65.7	-153.4	144.9	0	0	112	F62 D63 V68 N69	F62-E66 PolarHBondContact O-N 3.46Å; F62-E66 VanDerWaalsContact O-N 3.16Å; D63-E66 PolarHBondContact O-N 3.26Å; E66-V68 PolarHBondContact O-N 3.44Å; E66-N69 PolarHBondContact O-N 3.4Å
67	A	31.9	Very low	30.9	Very low	81 Å²	81	118.7 Å²	118.7	67%	0.669	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	-20.8	-179.9	0	0	0	0	0	114.6	D63	D63-A67 WeakPolarHBondContact O-CB 3.45Å; D63-A67 PolarHBondContact O-N 2.95Å; D63-A67 VanDerWaalsContact O-N 3.08Å
68	V	37.3	Very low	30.4	Very low	120 Å²	120	121.3 Å²	121.3	73%	0.727	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-14.6	179	173.5	0	0	0	0	112.9	E64 E66 S70	E64-V68 WeakPolarHBondContact O-CG2 3.25Å; E66-V68 PolarHBondContact O-N 3.44Å; V68-S70 PolarHBondContact O-N 3.11Å
69	N	28	Very low	29.7	Very low	129 Å²	129	126 Å²	126	69%	0.69	69%	0.693	S	S	*	*			trans	-90.2	10.8	-172.6	-75.4	-41.2	0	0	0	115.4	L65 E66 P71	L65-N69 PolarHBondContact O-ND2 2.89Å; E66-N69 PolarHBondContact O-N 3.4Å; N69-P71 VanDerWaalsContact O-CD 3.29Å; N69-P71 WeakPolarHBondContact O-CD 3.27Å
70	S	24.4	Very low	29.4	Very low	97 Å²	97	129.7 Å²	129.7	68%	0.678	71%	0.706	S	S	*	*			trans	-81.1	116.2	176.8	-173.1	0	0	0	0	112.2	V68 C72	V68-S70 PolarHBondContact O-N 3.11Å; S70-C72 PolarHBondContact O-N 2.93Å
71	P	26.6	Very low	29.1	Very low	112 Å²	112	131.6 Å²	131.6	73%	0.727	72%	0.724	S	S	*	*			trans	-81.1	100.6	175.1	32.5	-31.9	0	0	0	110.3	N69 K73	N69-P71 VanDerWaalsContact O-CD 3.29Å; N69-P71 WeakPolarHBondContact O-CD 3.27Å; P71-K73 PolarHBondContact O-N 2.99Å
72	C	23.9	Very low	28.6	Very low	125 Å²	125	130.4 Å²	130.4	85%	0.845	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-60.5	128.7	162.6	-91.4	0	0	0	0	109.5	S70	S70-C72 PolarHBondContact O-N 2.93Å
73	K	26.1	Very low	28.2	Very low	196 Å²	196	132.1 Å²	132.1	85%	0.852	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-64.4	145.9	-176.9	-65.7	174.5	177.6	177.2	0	111.7	P71	P71-K73 PolarHBondContact O-N 2.99Å
74	D	27.1	Very low	27.8	Very low	151 Å²	151	135 Å²	135	81%	0.807	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-69.8	137	162.9	-51.5	-74	0	0	0	110.1
75	D	25.1	Very low	27	Very low	163 Å²	163	135.9 Å²	135.9	87%	0.872	78%	0.778	S	S	*	*			trans	-126	89.4	160.7	-98.9	-44.3	0	0	0	107.7	S77	D75-S77 PolarHBondContact O-N 3.05Å
76	D	28.5	Very low	26.5	Very low	165 Å²	165	136.1 Å²	136.1	88%	0.882	79%	0.788	S	S	*	*			trans	-70.9	108.1	176.9	-105.7	-36.5	0	0	0	110.5
77	S	25	Very low	26	Very low	103 Å²	103	135.9 Å²	135.9	72%	0.72	80%	0.797	S	S	*	*			trans	-158.2	150.4	158.4	61.1	0	0	0	0	114.8	D75	D75-S77 PolarHBondContact O-N 3.05Å
78	L	24.9	Very low	25.8	Very low	162 Å²	162	137 Å²	137	85%	0.848	80%	0.8	S	S	*	*			trans	67	57	166.1	-53.9	-176.1	0	0	0	118.7
79	L	24.4	Very low	25.3	Very low	172 Å²	172	140.3 Å²	140.3	90%	0.901	81%	0.808	S	S	*	*			trans	-77.8	119.9	144.7	-85.7	170.2	0	0	0	110.5
80	H	23.7	Very low	25	Very low	175 Å²	175	141.2 Å²	141.2	81%	0.81	81%	0.813	S	S	*	*			trans	-146.4	128	155.8	-99.6	-70.7	0	0	0	111.2
81	P	30.2	Very low	25.2	Very low	129 Å²	129	141.9 Å²	141.9	84%	0.838	82%	0.824	S	S	*	*			trans	-88.8	136.4	178.6	33.8	-32.7	0	0	0	111.9
82	G	22.9	Very low	25.2	Very low	76 Å²	76	141.4 Å²	141.4	78%	0.784	82%	0.823	S	S	*	*			trans	-127.7	117.3	173.2	0	0	0	0	0	111.6
83	N	24.3	Very low	25.3	Very low	162 Å²	162	146.4 Å²	146.4	87%	0.866	82%	0.824	S	S	*	*			trans	-76.8	144.4	163.6	-71.4	-33.5	0	0	0	109.1
84	L	23	Very low	25.2	Very low	167 Å²	167	145 Å²	145	87%	0.874	83%	0.825	S	S	*	*				-169.6	164.9	125.8	-103.9	161.5	0	0	0	113.5
85	T	22.3	Very low	25.2	Very low	114 Å²	114	147 Å²	147	70%	0.699	83%	0.83	S	S	*	*			trans	-74	139.8	-168.3	46.4	0	0	0	0	115.6
86	S	24.7	Very low	25.2	Very low	106 Å²	106	144.4 Å²	144.4	74%	0.741	83%	0.831	S	S	*	*			trans	23.6	124.6	141.4	63.6	0	0	0	0	121.2
87	T	22.6	Very low	25	Very low	149 Å²	149	138.8 Å²	138.8	91%	0.914	81%	0.811	S	S	*	*			trans	-141	158.9	130.2	32.6	0	0	0	0	109.7
88	S	26.6	Very low	25.1	Very low	104 Å²	104	136.3 Å²	136.3	73%	0.727	80%	0.803	S	S	*	*			trans	-90.4	133.5	170.4	52	0	0	0	0	110.6
89	E	26.7	Very low	25.2	Very low	190 Å²	190	136.5 Å²	136.5	89%	0.888	80%	0.799	S	S	*	*			trans	168.3	101.5	143.1	-98.1	166.5	-160.1	0	0	110.2
90	D	23.1	Very low	25.4	Very low	148 Å²	148	133.5 Å²	133.5	79%	0.791	79%	0.788	S	S	*	*			trans	-170	59	151.1	-123.5	-20.1	0	0	0	111.8
91	A	26.8	Very low	25.7	Very low	110 Å²	110	129.6 Å²	129.6	91%	0.909	78%	0.776	S	S	*	*			trans	-100.1	40.2	-173.7	0	0	0	0	0	113.6
92	S	26.8	Very low	25.6	Very low	102 Å²	102	131.6 Å²	131.6	71%	0.713	77%	0.767	S	S	*	*	S	Bend	trans	-150.7	23.8	-169.4	58.3	0	0	0	0	116.8
93	R	25.9	Very low	25.9	Very low	231 Å²	231	134.7 Å²	134.7	87%	0.872	76%	0.761	S	S	*	*			trans	-139.6	18.4	-179.4	-109.7	170.4	-171.7	176.7	2.7	117.7
94	L	25	Very low	26.5	Very low	165 Å²	165	135.4 Å²	135.4	86%	0.864	75%	0.752	S	S	*	*			trans	-112.4	30.2	-167.5	-127.6	168	0	0	0	116.1
95	E	27	Very low	27.3	Very low	195 Å²	195	130.5 Å²	130.5	91%	0.911	73%	0.726	S	S	*	*	S	Bend	trans	-107.8	-12.4	171.4	-66.4	-156.7	132.8	0	0	114.6	G97	E95-G97 VanDerWaalsContact C-N 3.29Å; E95-G97 PolarHBondContact O-N 2.93Å
96	A	25.9	Very low	28.2	Very low	108 Å²	108	132.1 Å²	132.1	89%	0.893	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	12.2	-179.1	0	0	0	0	0	114.9
97	G	24.3	Very low	29.3	Very low	46 Å²	46	131.4 Å²	131.4	47%	0.474	72%	0.719	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.7	-5.9	-174.5	0	0	0	0	0	116.2	E95 E99	E95-G97 VanDerWaalsContact C-N 3.29Å; E95-G97 PolarHBondContact O-N 2.93Å; G97-E99 PolarHBondContact O-N 3.22Å
98	G	26	Very low	30.9	Very low	52 Å²	52	127.5 Å²	127.5	54%	0.536	69%	0.692	S	S	.	*	H	α-helix	trans	-75.7	-21.2	-164.8	0	0	0	0	0	116.8
99	E	26.6	Very low	33	Very low	165 Å²	165	123 Å²	123	77%	0.771	66%	0.663	S	S	*	*	H	α-helix	trans	-88.2	-41.3	-167.5	-60.3	-167.8	119.4	0	0	113.4	G97 V101 R102 E103	G97-E99 PolarHBondContact O-N 3.22Å; E99-V101 VanDerWaalsContact C-N 3.31Å; E99-V101 PolarHBondContact O-N 2.92Å; E99-R102 WeakPolarHBondContact O-CB 3.27Å; E99-R102 PolarHBondContact O-N 3.11Å; E99-E103 PolarHBondContact O-N 3.44Å; E99-E103 VanDerWaalsContact O-N 3.14Å
100	T	28.1	Very low	35.7	Very low	109 Å²	109	114.9 Å²	114.9	67%	0.669	63%	0.625	S	S	*	*	H	α-helix	trans	-64	-31.5	-173.9	56.6	0	0	0	0	113.7
101	V	31.6	Very low	38.7	Very low	94 Å²	94	111 Å²	111	57%	0.57	60%	0.6	S	S	*	*	H	α-helix	trans	-72.1	-35.2	172.8	-179	0	0	0	0	111.2	E99 R104 N105	E99-V101 VanDerWaalsContact C-N 3.31Å; E99-V101 PolarHBondContact O-N 2.92Å; V101-R104 PolarHBondContact O-N 3.06Å; V101-N105 PolarHBondContact O-N 3.48Å
102	R	27.3	Very low	41.6	Very low	170 Å²	170	106.7 Å²	106.7	64%	0.642	56%	0.561	S	S	*	*	H	α-helix	trans	-76.4	-35.3	-171	-153.7	173.8	-172	-176.8	2.5	112.6	E99	E99-R102 WeakPolarHBondContact O-CB 3.27Å; E99-R102 PolarHBondContact O-N 3.11Å
103	E	29.7	Very low	44.2	Very low	141 Å²	141	110.4 Å²	110.4	66%	0.659	56%	0.559	S	S	*	*	H	α-helix	trans	-68.7	-40.9	171.6	-62.4	-153.1	120.7	0	0	112.3	E99 N105 K106 S107	E99-E103 PolarHBondContact O-N 3.44Å; E99-E103 VanDerWaalsContact O-N 3.14Å; E103-N105 PolarHBondContact O-N 3.4Å; E103-K106 WeakPolarHBondContact O-CB 3.42Å; E103-K106 PolarHBondContact O-N 3.25Å; E103-S107 PolarHBondContact O-N 2.95Å; E103-S107 VanDerWaalsContact O-N 3.16Å
104	R	36.4	Very low	46.8	Very low	178 Å²	178	103.2 Å²	103.2	67%	0.672	54%	0.538	S	S	*	.	H	α-helix	trans	-61.1	-30.4	-179	-147.9	175.8	-166.4	-177.3	4.2	113.1	V101 S107	V101-R104 PolarHBondContact O-N 3.06Å; R104-S107 PolarHBondContact O-OG 2.95Å
105	N	39.8	Very low	49.3	Very low	63 Å²	63	96.8 Å²	96.8	34%	0.337	51%	0.512	S	S	.	.	H	α-helix	trans	-75.7	-32.6	173.4	-76.8	-16.6	0	0	0	113.3	V101 E103 S107 N108 Y111	V101-N105 PolarHBondContact O-N 3.48Å; E103-N105 PolarHBondContact O-N 3.4Å; N105-S107 VanDerWaalsContact C-N 3.34Å; N105-N108 PolarHBondContact O-N 3.26Å; N105-Y111 HydrophobicContact CB-CD2 4.46Å; N105-Y111 HydrophobicContact CB-CE2 4.39Å
106	K	41.3	Very low	51.9	Low	148 Å²	148	94.7 Å²	94.7	64%	0.643	50%	0.5	S	S	*	.	H	α-helix	trans	-63.2	-40	171.8	-71.7	179.7	174.9	176.6	0	111.5	E103 N108	E103-K106 WeakPolarHBondContact O-CB 3.42Å; E103-K106 PolarHBondContact O-N 3.25Å; K106-N108 VanDerWaalsContact C-N 3.28Å; K106-N108 PolarHBondContact O-N 3.41Å
107	S	48.5	Very low	54.7	Low	92 Å²	92	90.5 Å²	90.5	64%	0.643	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-17.1	-178.7	50.5	0	0	0	0	115.4	E103 R104 N105	E103-S107 PolarHBondContact O-N 2.95Å; E103-S107 VanDerWaalsContact O-N 3.16Å; R104-S107 PolarHBondContact O-OG 2.95Å; N105-S107 VanDerWaalsContact C-N 3.34Å
108	N	55	Low	57.7	Low	66 Å²	66	90.8 Å²	90.8	35%	0.353	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-13.4	-172.5	-77.4	-5.8	0	0	0	114.9	N105 K106 L110	N105-N108 PolarHBondContact O-N 3.26Å; K106-N108 VanDerWaalsContact C-N 3.28Å; K106-N108 PolarHBondContact O-N 3.41Å; N108-L110 VanDerWaalsContact C-N 3.32Å; N108-L110 HydrophobicContact CB-CG 4.46Å; N108-L110 PolarHBondContact O-N 2.92Å
109	G	70.6	Confident	60.8	Low	11 Å²	11	88.7 Å²	88.7	11%	0.113	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.3	31.6	176.2	0	0	0	0	0	115.1	W695	G109-W695 VanDerWaalsContact O-CE3 3.27Å; G109-W695 WeakPolarHBondContact O-CZ3 3.47Å
110	L	83.3	Confident	63.9	Low	19 Å²	19	81 Å²	81	10%	0.099	39%	0.391	C	S	.	.			trans	-102.1	-5.2	175.9	-61.9	176.9	0	0	0	113.3	N108 I119 L297 H298 Q694	N108-L110 VanDerWaalsContact C-N 3.32Å; N108-L110 HydrophobicContact CB-CG 4.46Å; N108-L110 PolarHBondContact O-N 2.92Å; L110-I119 PolarHBondContact O-N 3.08Å; L110-L297 HydrophobicContact CD2-CD1 4.47Å; L110-H298 WeakPolarHBondContact CD2-O 3.47Å; L110-Q694 HydrophobicContact CD2-CB 4.14Å; L110-Q694 HydrophobicContact CD2-CG 3.92Å
111	Y	86.1	Confident	67.1	Low	66 Å²	66	76.1 Å²	76.1	26%	0.259	36%	0.36	S	S	.	.	B	Isolated β-bridge	trans	-124.5	164	-178	-65.6	-91.5	0	0	0	110.3	N105 C117 R118	N105-Y111 HydrophobicContact CB-CD2 4.46Å; N105-Y111 HydrophobicContact CB-CE2 4.39Å; Y111-C117 CarbonylContact C-O 3.54Å; Y111-C117 VanDerWaalsContact CA-O 3.29Å; Y111-C117 WeakPolarHBondContact CA-O 3.43Å; Y111-R118 HydrophobicContact CD1-CB 3.89Å; Y111-R118 HydrophobicContact CD1-CG 4.27Å; Y111-R118 HydrophobicContact CE1-CB 3.77Å; Y111-R118 HydrophobicContact CE1-CG 4.03Å
112	F	88.3	Confident	70.1	Confident	20 Å²	20	71.7 Å²	71.7	9%	0.088	33%	0.333	C	S	.	.			trans	-66.4	170.7	167.7	-71.8	21.6	0	0	0	109.9	D114 G115 C117 I119 Q148 E150 K164 H166	F112-D114 PolarHBondContact O-N 2.74Å; F112-G115 PolarHBondContact O-N 3.37Å; F112-C117 HydrophobicContact CB-CB 4.11Å; F112-C117 HydrophobicContact CD1-CB 4.34Å; F112-C117 HydrophobicContact CD2-CB 3.77Å; F112-C117 HydrophobicContact CE2-CB 4.27Å; F112-C117 HydrophobicContact CG-CB 3.83Å; F112-C117 PolarHBondContact N-O 3.1Å; F112-I119 HydrophobicContact CD1-CG1 3.85Å; F112-I119 HydrophobicContact CE1-CG1 4.07Å; F112-Q148 HydrophobicContact CE2-CB 4.41Å; F112-E150 WeakPolarHBondContact CA-OE2 3.46Å; F112-E150 HydrophobicContact CD1-CB 4.47Å; F112-E150 HydrophobicContact CD2-CB 3.75Å; F112-E150 HydrophobicContact CE2-CB 3.79Å; F112-E150 HydrophobicContact CG-CB 4.1Å; F112-E150 HydrophobicContact CZ-CB 4.18Å; F112-K164 HydrophobicContact CD1-CB 4.16Å; F112-K164 HydrophobicContact CD1-CD 4.18Å; F112-K164 HydrophobicContact CE1-CB 3.61Å; F112-K164 HydrophobicContact CE1-CD 4.46Å; F112-K164 HydrophobicContact CZ-CB 4.18Å; F112-H166 HydrophobicContact CE1-CB 3.88Å; F112-H166 HydrophobicContact CE2-CB 4.23Å; F112-H166 HydrophobicContact CZ-CB 3.57Å
113	R	82.4	Confident	73.2	Confident	180 Å²	180	63.6 Å²	63.6	68%	0.679	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-21.7	-180	-70.8	173.8	-179.4	-161.5	-1.4	114.8	G115 E150 E152	R113-G115 VanDerWaalsContact C-N 3.29Å; R113-G115 PolarHBondContact O-N 3.18Å; R113-E150 WeakPolarHBondContact CB-OE1 3.34Å; R113-E150 WeakPolarHBondContact CD-OE1 3.45Å; R113-E150 WeakPolarHBondContact CG-OE1 3.3Å; R113-E150 PolarHBondContact N-OE1 2.91Å; R113-E150 PolarHBondContact N-OE2 3.06Å; R113-E152 IonicContact CZ-OE1 2.74Å; R113-E152 IonicContact NE-OE1 3.18Å; R113-E152 PolarHBondContact NE-OE1 3.01Å; R113-E152 IonicContact NH2-OE1 2.78Å; R113-E152 PolarHBondContact NH2-OE1 3.42Å
114	D	80.2	Confident	76.3	Confident	79 Å²	79	56.9 Å²	56.9	42%	0.422	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-15.6	177.9	76.7	-17.5	0	0	0	114.2	F112 K116 C117	F112-D114 PolarHBondContact O-N 2.74Å; D114-K116 PolarHBondContact O-N 2.8Å; D114-K116 PolarHBondContact OD1-N 3.17Å; D114-K116 WeakPolarHBondContact OD2-CB 3.33Å; D114-C117 PolarHBondContact OD1-N 3.41Å
115	G	77.5	Confident	78.9	Confident	30 Å²	30	49.2 Å²	49.2	31%	0.309	24%	0.243	S	C	.	.	S	Bend	trans	66.4	19.6	-175	0	0	0	0	0	114.4	F112 R113	F112-G115 PolarHBondContact O-N 3.37Å; R113-G115 VanDerWaalsContact C-N 3.29Å; R113-G115 PolarHBondContact O-N 3.18Å
116	K	81.5	Confident	81.2	Confident	152 Å²	152	51 Å²	51	66%	0.661	25%	0.245	S	C	*	.	S	Bend	trans	-121.3	-52.3	176.8	-53.8	175.5	179.8	176.5	0	111.7	D114 R118	D114-K116 PolarHBondContact O-N 2.8Å; D114-K116 PolarHBondContact OD1-N 3.17Å; D114-K116 WeakPolarHBondContact OD2-CB 3.33Å; K116-R118 PolarHBondContact O-N 2.93Å
117	C	85.2	Confident	83.2	Confident	19 Å²	19	49 Å²	49	13%	0.128	24%	0.236	C	C	.	.	S	Bend	trans	-75.4	121.8	-176.3	-67.4	0	0	0	0	110	Y111 F112 D114 Q148 H166	Y111-C117 CarbonylContact C-O 3.54Å; Y111-C117 VanDerWaalsContact CA-O 3.29Å; Y111-C117 WeakPolarHBondContact CA-O 3.43Å; F112-C117 HydrophobicContact CB-CB 4.11Å; F112-C117 HydrophobicContact CD1-CB 4.34Å; F112-C117 HydrophobicContact CD2-CB 3.77Å; F112-C117 HydrophobicContact CE2-CB 4.27Å; F112-C117 HydrophobicContact CG-CB 3.83Å; F112-C117 PolarHBondContact N-O 3.1Å; D114-C117 PolarHBondContact OD1-N 3.41Å; C117-Q148 PolarHBondContact SG-OE1 3.36Å; C117-H166 HydrophobicContact CB-CB 4.35Å
118	R	87.2	Confident	84.7	Confident	52 Å²	52	48.5 Å²	48.5	20%	0.196	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-88.8	136.4	-175.2	-171	174.4	175.5	-167.5	-6.3	111.6	Y111 K116 D120 H166 N257	Y111-R118 HydrophobicContact CD1-CB 3.89Å; Y111-R118 HydrophobicContact CD1-CG 4.27Å; Y111-R118 HydrophobicContact CE1-CB 3.77Å; Y111-R118 HydrophobicContact CE1-CG 4.03Å; K116-R118 PolarHBondContact O-N 2.93Å; R118-D120 PolarHBondContact O-N 2.86Å; R118-H166 PolarHBondContact N-ND1 3.19Å; R118-H166 WeakPolarHBondContact O-CB 3.27Å; R118-H166 PolarHBondContact O-ND1 3.35Å; R118-N257 PolarHBondContact NH1-OD1 2.72Å; R118-N257 PolarHBondContact NH2-ND2 3.44Å; R118-N257 PolarHBondContact NH2-OD1 3.48Å
119	I	91.3	Very high	85.9	Confident	9 Å²	9	46.9 Å²	46.9	5%	0.046	22%	0.223	C	C	.	.			trans	-73	114.4	176.8	-51.3	168.2	0	0	0	109.1	L110 F112 I122 K164 L297 W695	L110-I119 PolarHBondContact O-N 3.08Å; F112-I119 HydrophobicContact CD1-CG1 3.85Å; F112-I119 HydrophobicContact CE1-CG1 4.07Å; I119-I122 HydrophobicContact CG2-CD1 4.01Å; I119-I122 HydrophobicContact CG2-CG1 3.72Å; I119-K164 HydrophobicContact CD1-CD 3.7Å; I119-K164 HydrophobicContact CD1-CG 4Å; I119-K164 HydrophobicContact CG1-CB 4.22Å; I119-K164 HydrophobicContact CG1-CD 4.04Å; I119-K164 HydrophobicContact CG1-CG 4.24Å; I119-K164 HydrophobicContact CG2-CB 4.21Å; I119-K164 HydrophobicContact CG2-CG 4.48Å; I119-L297 HydrophobicContact CB-CD1 3.86Å; I119-L297 HydrophobicContact CD1-CD1 4Å; I119-L297 HydrophobicContact CG2-CD1 3.71Å; I119-L297 HydrophobicContact CG2-CG 4.23Å; I119-W695 HydrophobicContact CD1-CE3 3.6Å; I119-W695 HydrophobicContact CD1-CZ3 3.66Å
120	D	91.7	Very high	86.1	Confident	4 Å²	4	52.1 Å²	52.1	2%	0.021	26%	0.256	C	S	.	.			trans	-96.5	-30.6	178.9	-67.7	-53.7	0	0	0	112.5	R118 L165 H166 A167 R260 S261 V264	R118-D120 PolarHBondContact O-N 2.86Å; D120-L165 PolarHBondContact N-O 3.3Å; D120-H166 IonicContact OD2-ND1 3.88Å; D120-H166 PolarHBondContact OD2-ND1 3.03Å; D120-A167 PolarHBondContact OD2-N 3.28Å; D120-R260 IonicContact OD1-CZ 2.84Å; D120-R260 IonicContact OD1-NE 2.9Å; D120-R260 PolarHBondContact OD1-NE 3.4Å; D120-R260 IonicContact OD1-NH2 2.79Å; D120-R260 PolarHBondContact OD1-NH2 3.04Å; D120-R260 IonicContact OD2-CZ 3.32Å; D120-R260 IonicContact OD2-NE 3.16Å; D120-R260 IonicContact OD2-NH2 2.71Å; D120-R260 PolarHBondContact OD2-NH2 2.97Å; D120-S261 PolarHBondContact O-OG 3.47Å; D120-V264 HydrophobicContact CB-CG2 3.99Å
121	Y	93.6	Very high	85.9	Confident	6 Å²	6	54 Å²	54	2%	0.024	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	155.9	-175.4	-153.3	-96.7	0	0	0	111.1	L123 L165 V264 H265 L268 L282 A294 P296 L760	Y121-L123 HydrophobicContact CD1-CD2 4.21Å; Y121-L123 HydrophobicContact CE1-CD2 3.94Å; Y121-L165 HydrophobicContact CD1-CD1 4.4Å; Y121-L165 PolarHBondContact N-O 2.79Å; Y121-L165 PolarHBondContact O-N 2.97Å; Y121-V264 HydrophobicContact CG-CG1 4.06Å; Y121-H265 HydrophobicContact CE2-CB 4.12Å; Y121-H265 AromaticContact CE2-ND1 3.9Å; Y121-H265 AromaticContact CZ-ND1 3.5Å; Y121-H265 PolarHBondContact OH-ND1 3.15Å; Y121-L268 HydrophobicContact CD1-CD1 3.49Å; Y121-L268 VanDerWaalsContact CD1-CD1 3.49Å; Y121-L268 HydrophobicContact CE1-CD1 3.7Å; Y121-L268 HydrophobicContact CG-CD1 4.23Å; Y121-L282 HydrophobicContact CE1-CD2 4.41Å; Y121-A294 HydrophobicContact CE1-CB 4.02Å; Y121-P296 HydrophobicContact CD2-CB 4.19Å; Y121-P296 HydrophobicContact CE2-CB 4.4Å; Y121-L760 HydrophobicContact CE2-CD1 4.23Å
122	I	94.6	Very high	85.6	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	140.1	178.6	-64.7	-169.7	0	0	0	111.3	I119 V124 F162 V163 A294 F295 L297 W695	I119-I122 HydrophobicContact CG2-CD1 4.01Å; I119-I122 HydrophobicContact CG2-CG1 3.72Å; I122-V124 HydrophobicContact CG2-CG2 4.02Å; I122-F162 HydrophobicContact CG2-CD1 4.12Å; I122-V163 WeakPolarHBondContact CA-O 3.45Å; I122-A294 WeakPolarHBondContact O-CA 3.46Å; I122-F295 HydrophobicContact CG2-CZ 4.4Å; I122-F295 PolarHBondContact N-O 2.97Å; I122-F295 PolarHBondContact O-N 3.41Å; I122-L297 HydrophobicContact CD1-CD1 4.09Å; I122-L297 HydrophobicContact CD1-CD2 3.63Å; I122-L297 HydrophobicContact CD1-CG 3.87Å; I122-L297 HydrophobicContact CG1-CD2 4.46Å; I122-L297 HydrophobicContact CG1-CG 4.36Å; I122-W695 HydrophobicContact CD1-CB 3.21Å; I122-W695 HydrophobicContact CD1-CG 4.13Å
123	L	93.8	Very high	85.4	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	142.1	164	-50.8	176.3	0	0	0	109.1	Y121 F138 I142 V163 L165 L268 L282 Y291 A294	Y121-L123 HydrophobicContact CD1-CD2 4.21Å; Y121-L123 HydrophobicContact CE1-CD2 3.94Å; L123-F138 HydrophobicContact CD1-CE1 4.24Å; L123-I142 HydrophobicContact CD1-CD1 4.17Å; L123-V163 HydrophobicContact CB-CB 4.23Å; L123-V163 PolarHBondContact N-O 2.99Å; L123-V163 PolarHBondContact O-N 3.02Å; L123-L165 HydrophobicContact CD1-CD1 4.18Å; L123-L165 HydrophobicContact CG-CD1 4.13Å; L123-L268 HydrophobicContact CD1-CD2 4.3Å; L123-L268 HydrophobicContact CD2-CD1 4.31Å; L123-L282 HydrophobicContact CD2-CD1 3.82Å; L123-L282 HydrophobicContact CD2-CD2 3.84Å; L123-Y291 HydrophobicContact CB-CD1 3.73Å; L123-Y291 HydrophobicContact CB-CE1 3.64Å; L123-Y291 HydrophobicContact CD1-CD1 4.48Å; L123-Y291 HydrophobicContact CD1-CE1 3.88Å; L123-Y291 HydrophobicContact CD1-CE2 4.29Å; L123-Y291 HydrophobicContact CG-CE1 4.38Å; L123-A294 HydrophobicContact CD2-CB 3.69Å
124	V	93.2	Very high	85.5	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	133	178.9	-167.4	0	0	0	0	109.1	I122 I160 I161 F162 Y291 E292 A293 F295 Y699	I122-V124 HydrophobicContact CG2-CG2 4.02Å; V124-I160 HydrophobicContact CG1-CG2 3.61Å; V124-I161 WeakPolarHBondContact CA-O 3.46Å; V124-F162 HydrophobicContact CB-CD1 4.5Å; V124-F162 HydrophobicContact CG1-CD1 4.17Å; V124-F162 HydrophobicContact CG1-CE1 3.96Å; V124-F162 HydrophobicContact CG2-CD1 3.71Å; V124-F162 HydrophobicContact CG2-CE1 3.75Å; V124-Y291 CarbonylContact O-C 3.48Å; V124-E292 PolarHBondContact O-N 2.79Å; V124-A293 HydrophobicContact CB-CB 4.16Å; V124-A293 HydrophobicContact CG2-CB 4.1Å; V124-A293 PolarHBondContact N-O 3.29Å; V124-A293 PolarHBondContact O-N 3.38Å; V124-F295 HydrophobicContact CG2-CE1 3.72Å; V124-F295 HydrophobicContact CG2-CZ 4.24Å; V124-Y699 HydrophobicContact CB-CD2 4.47Å; V124-Y699 HydrophobicContact CB-CE2 4.07Å; V124-Y699 HydrophobicContact CG1-CD2 4.25Å; V124-Y699 HydrophobicContact CG1-CE2 3.73Å; V124-Y699 HydrophobicContact CG2-CD2 3.89Å; V124-Y699 HydrophobicContact CG2-CE2 3.98Å
125	Y	91.5	Very high	85.8	Confident	18 Å²	18	51.6 Å²	51.6	7%	0.071	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	161.7	174.9	73.7	-98.9	0	0	0	112.7	R135 K151 I161 V163 Y291	Y125-R135 VanDerWaalsContact CD2-NH1 3.28Å; Y125-K151 PolarHBondContact OH-NZ 3.41Å; Y125-I161 HydrophobicContact CD1-CB 4.34Å; Y125-I161 HydrophobicContact CD1-CG2 4.31Å; Y125-I161 HydrophobicContact CD2-CB 4.38Å; Y125-I161 HydrophobicContact CE1-CB 4Å; Y125-I161 HydrophobicContact CE1-CG2 3.67Å; Y125-I161 HydrophobicContact CE2-CB 4.03Å; Y125-I161 HydrophobicContact CE2-CD1 3.78Å; Y125-I161 HydrophobicContact CE2-CG1 4.35Å; Y125-I161 HydrophobicContact CE2-CG2 4.47Å; Y125-I161 PolarHBondContact N-O 2.87Å; Y125-I161 PolarHBondContact O-N 3.28Å; Y125-I161 WeakPolarHBondContact OH-CD1 3.38Å; Y125-V163 HydrophobicContact CD1-CG2 3.85Å; Y125-V163 HydrophobicContact CE1-CG2 3.55Å; Y125-Y291 HydrophobicContact CD1-CD1 4.22Å; Y125-Y291 AromaticContact CD1-CE1 3.81Å; Y125-Y291 HydrophobicContact CD1-CE1 3.81Å; Y125-Y291 HydrophobicContact CG-CD1 4.48Å; Y125-Y291 HydrophobicContact CG-CE1 4.42Å
126	R	89	Confident	86.3	Confident	100 Å²	100	54.5 Å²	54.5	38%	0.377	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	134	178.9	-157.3	178.1	-63.1	-159.6	-0.4	111.1	S128 N129 R135 D159 E292	R126-S128 VanDerWaalsContact CD-OG 3.32Å; R126-S128 WeakPolarHBondContact CD-OG 3.46Å; R126-S128 WeakPolarHBondContact CG-OG 3.33Å; R126-N129 PolarHBondContact O-N 3.47Å; R126-R135 PolarHBondContact O-NH1 2.57Å; R126-R135 VanDerWaalsContact O-NH1 3.12Å; R126-D159 CarbonylContact C-O 3.51Å; R126-D159 WeakPolarHBondContact CA-O 3.16Å; R126-D159 VanDerWaalsContact CD-OD2 3.3Å; R126-D159 WeakPolarHBondContact CD-OD2 3.49Å; R126-D159 HydrophobicContact CG-CB 4.26Å; R126-D159 WeakPolarHBondContact CG-OD1 3.45Å; R126-D159 WeakPolarHBondContact CG-OD2 3.36Å; R126-E292 IonicContact CZ-OE1 3.68Å; R126-E292 IonicContact CZ-OE2 2.82Å; R126-E292 IonicContact NE-OE2 3.55Å; R126-E292 PolarHBondContact NE-OE2 2.99Å; R126-E292 VanDerWaalsContact NH2-CD 3.26Å; R126-E292 IonicContact NH2-OE1 2.63Å; R126-E292 PolarHBondContact NH2-OE1 2.81Å; R126-E292 IonicContact NH2-OE2 3.06Å; R126-E292 PolarHBondContact NH2-OE2 3.01Å; R126-E292 VanDerWaalsContact NH2-OE2 3.07Å
127	K	83.8	Confident	86.7	Confident	106 Å²	106	49.1 Å²	49.1	46%	0.461	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-38.6	-178.9	-63.9	170.3	178.3	168.7	0	111.3	N129 S158 D159 I161	K127-N129 PolarHBondContact O-N 3.45Å; K127-N129 VanDerWaalsContact O-N 3.17Å; K127-S158 WeakPolarHBondContact CD-O 3.27Å; K127-S158 WeakPolarHBondContact CE-O 3.43Å; K127-S158 PolarHBondContact NZ-O 3.25Å; K127-D159 WeakPolarHBondContact CA-OD1 3.37Å; K127-D159 VanDerWaalsContact CB-OD1 3.28Å; K127-D159 WeakPolarHBondContact CB-OD1 3.47Å; K127-D159 WeakPolarHBondContact CG-O 3.37Å; K127-D159 PolarHBondContact N-O 3.42Å; K127-D159 PolarHBondContact N-OD1 3.05Å; K127-I161 HydrophobicContact CD-CD1 4.24Å; K127-I161 HydrophobicContact CG-CD1 3.68Å; K127-I161 HydrophobicContact CG-CG1 4.1Å
128	S	78.3	Confident	86.9	Confident	81 Å²	81	48.2 Å²	48.2	57%	0.566	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-10.8	178.8	56.8	0	0	0	0	114.9	R126 D159	R126-S128 VanDerWaalsContact CD-OG 3.32Å; R126-S128 WeakPolarHBondContact CD-OG 3.46Å; R126-S128 WeakPolarHBondContact CG-OG 3.33Å; S128-D159 WeakPolarHBondContact CB-OD2 3.1Å; S128-D159 PolarHBondContact N-OD1 2.81Å; S128-D159 PolarHBondContact OG-OD1 3.12Å; S128-D159 PolarHBondContact OG-OD2 3.26Å
129	N	80.6	Confident	87.1	Confident	32 Å²	32	46 Å²	46	17%	0.171	23%	0.234	C	C	.	.			trans	-75.8	123.5	175.7	-176.7	-34.8	0	0	0	111.2	R126 K127 Q131 R135 G289	R126-N129 PolarHBondContact O-N 3.47Å; K127-N129 PolarHBondContact O-N 3.45Å; K127-N129 VanDerWaalsContact O-N 3.17Å; N129-Q131 PolarHBondContact O-N 2.8Å; N129-Q131 VanDerWaalsContact O-N 3.16Å; N129-Q131 WeakPolarHBondContact OD1-CB 3.43Å; N129-Q131 WeakPolarHBondContact OD1-CG 3.14Å; N129-Q131 PolarHBondContact OD1-N 3.44Å; N129-R135 PolarHBondContact O-NH2 3.47Å; N129-G289 PolarHBondContact ND2-O 3.24Å
130	P	74.9	Confident	87.1	Confident	122 Å²	122	51.9 Å²	51.9	79%	0.792	26%	0.256	S	S	*	.	S	Bend	trans	-67.4	-11.4	-175.6	27.7	-36.6	0	0	0	115.6	T132	P130-T132 PolarHBondContact O-N 2.98Å
131	Q	78.9	Confident	87.1	Confident	57 Å²	57	54.3 Å²	54.3	27%	0.266	27%	0.269	S	S	.	.			trans	-77.1	37.4	-176.4	-60.5	-178.8	38.5	0	0	114.3	N129 N288 S290	N129-Q131 PolarHBondContact O-N 2.8Å; N129-Q131 VanDerWaalsContact O-N 3.16Å; N129-Q131 WeakPolarHBondContact OD1-CB 3.43Å; N129-Q131 WeakPolarHBondContact OD1-CG 3.14Å; N129-Q131 PolarHBondContact OD1-N 3.44Å; Q131-N288 PolarHBondContact NE2-O 3.36Å; Q131-S290 PolarHBondContact OE1-OG 3.3Å
132	T	81	Confident	87	Confident	55 Å²	55	54 Å²	54	34%	0.337	27%	0.268	S	S	.	.	H	α-helix	trans	-65.6	-40.2	-172.4	-65.7	0	0	0	0	113.6	P130 K134 R135 E136	P130-T132 PolarHBondContact O-N 2.98Å; T132-K134 PolarHBondContact O-N 2.93Å; T132-R135 WeakPolarHBondContact O-CB 3.29Å; T132-R135 PolarHBondContact O-N 3.05Å; T132-R135 PolarHBondContact OG1-NH2 3.14Å; T132-E136 HydrophobicContact CG2-CG 4.21Å; T132-E136 PolarHBondContact O-N 3.09Å
133	E	83.6	Confident	86.9	Confident	160 Å²	160	60.8 Å²	60.8	75%	0.748	29%	0.293	S	S	*	.	H	α-helix	trans	-58.6	-48.3	-177	-60.1	-179.9	130.3	0	0	112.8	R135 E136 V137	E133-R135 VanDerWaalsContact C-N 3.29Å; E133-R135 PolarHBondContact O-N 3.31Å; E133-E136 PolarHBondContact O-N 3.22Å; E133-V137 WeakPolarHBondContact O-CG2 3.29Å; E133-V137 PolarHBondContact O-N 3.25Å
134	K	84	Confident	86.8	Confident	76 Å²	76	64.8 Å²	64.8	33%	0.33	33%	0.326	S	S	.	.	H	α-helix	trans	-63.5	-36.7	179.3	-67.5	171.8	-177.7	167.8	0	111.8	T132 F138 Y273 E274	T132-K134 PolarHBondContact O-N 2.93Å; K134-F138 WeakPolarHBondContact O-CB 3.39Å; K134-F138 PolarHBondContact O-N 2.8Å; K134-Y273 HydrophobicContact CB-CD2 4.44Å; K134-E274 VanDerWaalsContact CE-OE2 3.3Å; K134-E274 WeakPolarHBondContact CE-OE2 3.24Å
135	R	87.3	Confident	86.6	Confident	5 Å²	5	68.4 Å²	68.4	2%	0.019	34%	0.343	C	S	.	.	H	α-helix	trans	-66.7	-42.8	175	171.4	168.3	55.8	-155.9	3.8	111.1	Y125 R126 N129 T132 E133 F138 E139 S290	Y125-R135 VanDerWaalsContact CD2-NH1 3.28Å; R126-R135 PolarHBondContact O-NH1 2.57Å; R126-R135 VanDerWaalsContact O-NH1 3.12Å; N129-R135 PolarHBondContact O-NH2 3.47Å; T132-R135 WeakPolarHBondContact O-CB 3.29Å; T132-R135 PolarHBondContact O-N 3.05Å; T132-R135 PolarHBondContact OG1-NH2 3.14Å; E133-R135 VanDerWaalsContact C-N 3.29Å; E133-R135 PolarHBondContact O-N 3.31Å; R135-F138 PolarHBondContact O-N 2.81Å; R135-E139 WeakPolarHBondContact O-CG 3.28Å; R135-E139 PolarHBondContact O-N 2.68Å; R135-S290 PolarHBondContact NH1-O 3.08Å
136	E	88	Confident	86.6	Confident	90 Å²	90	69.1 Å²	69.1	42%	0.421	36%	0.356	S	S	.	.	H	α-helix	trans	-66.9	-40.8	174.3	-72.6	-172	-168.9	0	0	113.8	T132 E133 F138 E139 R140	T132-E136 HydrophobicContact CG2-CG 4.21Å; T132-E136 PolarHBondContact O-N 3.09Å; E133-E136 PolarHBondContact O-N 3.22Å; E136-F138 VanDerWaalsContact C-N 3.32Å; E136-E139 PolarHBondContact O-N 3.24Å; E136-R140 WeakPolarHBondContact O-CB 3.42Å; E136-R140 VanDerWaalsContact O-CG 3.28Å; E136-R140 WeakPolarHBondContact O-CG 3.48Å; E136-R140 PolarHBondContact O-N 2.9Å; E136-R140 PolarHBondContact O-NE 3.01Å; E136-R140 IonicContact OE2-CZ 2.79Å; E136-R140 IonicContact OE2-NH2 2.93Å; E136-R140 PolarHBondContact OE2-NH2 2.81Å
137	V	89.4	Confident	86.8	Confident	40 Å²	40	64.5 Å²	64.5	24%	0.242	34%	0.339	C	S	.	.	H	α-helix	trans	-61.6	-44.3	175.6	171.3	0	0	0	0	110.1	E133 E139 R140 N141 Y273	E133-V137 WeakPolarHBondContact O-CG2 3.29Å; E133-V137 PolarHBondContact O-N 3.25Å; V137-E139 PolarHBondContact O-N 3.44Å; V137-R140 PolarHBondContact O-N 2.9Å; V137-N141 PolarHBondContact O-N 3.3Å; V137-N141 PolarHBondContact O-ND2 3.18Å; V137-Y273 WeakPolarHBondContact CB-O 3.38Å; V137-Y273 VanDerWaalsContact CG1-O 3.32Å; V137-Y273 WeakPolarHBondContact CG1-O 3.36Å
138	F	90.3	Very high	87.3	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-59.9	-45.2	174.1	-169.1	-108.7	0	0	0	112.2	L123 K134 R135 E136 N141 I142 L268 I271 L282 L285 Y291	L123-F138 HydrophobicContact CD1-CE1 4.24Å; K134-F138 WeakPolarHBondContact O-CB 3.39Å; K134-F138 PolarHBondContact O-N 2.8Å; R135-F138 PolarHBondContact O-N 2.81Å; E136-F138 VanDerWaalsContact C-N 3.32Å; F138-N141 PolarHBondContact O-N 3.1Å; F138-I142 HydrophobicContact CD1-CD1 3.76Å; F138-I142 HydrophobicContact CD1-CG1 4.44Å; F138-I142 HydrophobicContact CE1-CD1 3.69Å; F138-I142 HydrophobicContact CE1-CG1 4.39Å; F138-I142 WeakPolarHBondContact O-CG1 3.33Å; F138-I142 PolarHBondContact O-N 3.18Å; F138-L268 HydrophobicContact CE1-CD2 4.06Å; F138-L268 HydrophobicContact CZ-CD2 4.09Å; F138-I271 HydrophobicContact CD2-CB 4.28Å; F138-I271 HydrophobicContact CD2-CG2 3.51Å; F138-I271 HydrophobicContact CE2-CB 3.76Å; F138-I271 HydrophobicContact CE2-CG2 3.53Å; F138-I271 HydrophobicContact CG-CG2 4.36Å; F138-I271 HydrophobicContact CZ-CB 4.43Å; F138-I271 HydrophobicContact CZ-CG2 4.39Å; F138-L282 HydrophobicContact CE1-CD1 4.3Å; F138-L282 HydrophobicContact CZ-CB 4.11Å; F138-L282 HydrophobicContact CZ-CD1 4.43Å; F138-L285 HydrophobicContact CB-CD1 4.08Å; F138-L285 HydrophobicContact CD1-CD1 3.76Å; F138-L285 HydrophobicContact CD2-CD1 3.73Å; F138-L285 HydrophobicContact CE1-CD1 4.04Å; F138-L285 HydrophobicContact CE2-CD1 4.03Å; F138-L285 HydrophobicContact CG-CD1 3.59Å; F138-L285 HydrophobicContact CZ-CD1 4.18Å; F138-Y291 AromaticContact CD1-CE2 3.76Å; F138-Y291 HydrophobicContact CD1-CE2 3.76Å; F138-Y291 HydrophobicContact CE1-CE2 4.07Å
139	E	91.3	Very high	87.9	Confident	6 Å²	6	61.2 Å²	61.2	3%	0.028	32%	0.317	C	S	.	.	H	α-helix	trans	-66.1	-36.5	176.5	-74.7	-179.3	-168.3	0	0	114.3	R135 E136 V137 N141 I142 R143 M149 K151	R135-E139 WeakPolarHBondContact O-CG 3.28Å; R135-E139 PolarHBondContact O-N 2.68Å; E136-E139 PolarHBondContact O-N 3.24Å; V137-E139 PolarHBondContact O-N 3.44Å; E139-N141 VanDerWaalsContact C-N 3.3Å; E139-I142 PolarHBondContact O-N 3.3Å; E139-R143 PolarHBondContact O-N 2.99Å; E139-M149 HydrophobicContact CB-CE 4.18Å; E139-M149 HydrophobicContact CB-SD 4.36Å; E139-M149 HydrophobicContact CG-CE 3.85Å; E139-K151 VanDerWaalsContact CD-CE 3.41Å; E139-K151 WeakPolarHBondContact OE1-CE 3.32Å; E139-K151 IonicContact OE1-NZ 3.93Å; E139-K151 PolarHBondContact OE1-NZ 3.4Å; E139-K151 WeakPolarHBondContact OE2-CE 3.3Å; E139-K151 IonicContact OE2-NZ 2.83Å; E139-K151 PolarHBondContact OE2-NZ 2.84Å
140	R	91.3	Very high	88.5	Confident	132 Å²	132	61.3 Å²	61.3	50%	0.498	32%	0.316	S	S	.	.	H	α-helix	trans	-62.1	-42.4	172.7	-74.7	175.5	-123.3	152.9	-4.9	110.2	E136 V137 R143 A144	E136-R140 WeakPolarHBondContact O-CB 3.42Å; E136-R140 VanDerWaalsContact O-CG 3.28Å; E136-R140 WeakPolarHBondContact O-CG 3.48Å; E136-R140 PolarHBondContact O-N 2.9Å; E136-R140 PolarHBondContact O-NE 3.01Å; E136-R140 IonicContact OE2-CZ 2.79Å; E136-R140 IonicContact OE2-NH2 2.93Å; E136-R140 PolarHBondContact OE2-NH2 2.81Å; V137-R140 PolarHBondContact O-N 2.9Å; R140-R143 PolarHBondContact O-N 3.26Å; R140-A144 PolarHBondContact O-N 2.56Å
141	N	91.3	Very high	89.3	Confident	55 Å²	55	59.5 Å²	59.5	29%	0.294	30%	0.296	S	S	.	.	H	α-helix	trans	-70.3	-34.9	178.1	-64.1	-17.4	0	0	0	112.6	V137 F138 E139 R143 A144 E145 I271 K272	V137-N141 PolarHBondContact O-N 3.3Å; V137-N141 PolarHBondContact O-ND2 3.18Å; F138-N141 PolarHBondContact O-N 3.1Å; E139-N141 VanDerWaalsContact C-N 3.3Å; N141-R143 VanDerWaalsContact C-N 3.28Å; N141-R143 PolarHBondContact O-N 2.89Å; N141-A144 WeakPolarHBondContact O-CB 3.48Å; N141-A144 PolarHBondContact O-N 2.98Å; N141-A144 VanDerWaalsContact O-N 3.11Å; N141-E145 PolarHBondContact O-N 2.61Å; N141-I271 HydrophobicContact CB-CG2 3.62Å; N141-K272 PolarHBondContact ND2-O 3.33Å
142	I	91.8	Very high	89.7	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-54	-44.5	169.5	-75	170.7	0	0	0	111.3	L123 F138 E139 L147 L165 L268 I271	L123-I142 HydrophobicContact CD1-CD1 4.17Å; F138-I142 HydrophobicContact CD1-CD1 3.76Å; F138-I142 HydrophobicContact CD1-CG1 4.44Å; F138-I142 HydrophobicContact CE1-CD1 3.69Å; F138-I142 HydrophobicContact CE1-CG1 4.39Å; F138-I142 WeakPolarHBondContact O-CG1 3.33Å; F138-I142 PolarHBondContact O-N 3.18Å; E139-I142 PolarHBondContact O-N 3.3Å; I142-L147 HydrophobicContact CG2-CB 3.81Å; I142-L147 HydrophobicContact CG2-CD1 4.24Å; I142-L147 PolarHBondContact O-N 2.79Å; I142-L165 HydrophobicContact CG2-CD2 4Å; I142-L268 HydrophobicContact CD1-CD2 3.62Å; I142-L268 HydrophobicContact CG1-CD2 3.93Å; I142-I271 HydrophobicContact CB-CD1 4.34Å; I142-I271 HydrophobicContact CG1-CD1 3.66Å
143	R	92.2	Very high	89.9	Confident	142 Å²	142	58.8 Å²	58.8	54%	0.536	30%	0.296	S	S	.	.	H	α-helix	trans	-70.6	-34.6	176.8	-62	179.3	-149.8	164.2	10.9	112.4	E139 R140 N141 E145 G146 M149	E139-R143 PolarHBondContact O-N 2.99Å; R140-R143 PolarHBondContact O-N 3.26Å; N141-R143 VanDerWaalsContact C-N 3.28Å; N141-R143 PolarHBondContact O-N 2.89Å; R143-E145 VanDerWaalsContact C-N 3.34Å; R143-E145 PolarHBondContact O-N 2.91Å; R143-G146 WeakPolarHBondContact O-CA 3.44Å; R143-G146 PolarHBondContact O-N 3.23Å; R143-M149 HydrophobicContact CG-CG 4.3Å; R143-M149 HydrophobicContact CG-SD 3.85Å; R143-M149 PolarHBondContact NE-SD 3.28Å
144	A	91.1	Very high	89.9	Confident	84 Å²	84	51.8 Å²	51.8	69%	0.694	27%	0.265	S	S	*	.	H	α-helix	trans	-64.8	-35.8	178.2	0	0	0	0	0	112.7	R140 N141 G146	R140-A144 PolarHBondContact O-N 2.56Å; N141-A144 WeakPolarHBondContact O-CB 3.48Å; N141-A144 PolarHBondContact O-N 2.98Å; N141-A144 VanDerWaalsContact O-N 3.11Å; A144-G146 PolarHBondContact O-N 2.71Å
145	E	89.6	Confident	89.5	Confident	75 Å²	75	52.9 Å²	52.9	35%	0.35	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-2.9	171.5	-59.7	-63.9	176	0	0	113.4	N141 R143 Y175 I267 I271	N141-E145 PolarHBondContact O-N 2.61Å; R143-E145 VanDerWaalsContact C-N 3.34Å; R143-E145 PolarHBondContact O-N 2.91Å; E145-Y175 PolarHBondContact OE2-OH 3.02Å; E145-I267 HydrophobicContact CB-CG2 4.34Å; E145-I271 HydrophobicContact CG-CD1 4.09Å; E145-I271 HydrophobicContact CG-CG1 3.98Å
146	G	90.9	Very high	88.8	Confident	33 Å²	33	54.1 Å²	54.1	34%	0.34	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.8	8.3	174.9	0	0	0	0	0	115.9	R143 A144	R143-G146 WeakPolarHBondContact O-CA 3.44Å; R143-G146 PolarHBondContact O-N 3.23Å; A144-G146 PolarHBondContact O-N 2.71Å
147	L	93.4	Very high	88.2	Confident	4 Å²	4	53 Å²	53	2%	0.021	28%	0.278	C	S	.	.			trans	-74.1	136.1	173.6	-68.5	176.3	0	0	0	110.9	I142 A167 V171 V264 I267	I142-L147 HydrophobicContact CG2-CB 3.81Å; I142-L147 HydrophobicContact CG2-CD1 4.24Å; I142-L147 PolarHBondContact O-N 2.79Å; L147-A167 HydrophobicContact CD2-CB 3.81Å; L147-V171 HydrophobicContact CD2-CG1 4.08Å; L147-V264 HydrophobicContact CD1-CG1 4.36Å; L147-V264 HydrophobicContact CD2-CG2 4.31Å; L147-I267 HydrophobicContact CD1-CB 4.32Å; L147-I267 HydrophobicContact CD1-CD1 4.36Å; L147-I267 HydrophobicContact CD1-CG2 3.76Å; L147-I267 HydrophobicContact CD2-CD1 4.14Å; L147-I267 HydrophobicContact CG-CD1 4.44Å; L147-I267 HydrophobicContact CG-CG2 4.48Å
148	Q	93.3	Very high	87.7	Confident	82 Å²	82	55.4 Å²	55.4	38%	0.383	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	142.6	174.6	-66	-177.6	0.1	0	0	110.2	F112 C117 L165 H166 P168	F112-Q148 HydrophobicContact CE2-CB 4.41Å; C117-Q148 PolarHBondContact SG-OE1 3.36Å; Q148-L165 WeakPolarHBondContact O-CA 3.48Å; Q148-H166 HydrophobicContact CB-CB 4.28Å; Q148-H166 PolarHBondContact N-O 3.22Å; Q148-H166 PolarHBondContact O-N 2.74Å; Q148-P168 HydrophobicContact CG-CG 4.08Å
149	M	92.7	Very high	87.5	Confident	36 Å²	36	57.2 Å²	57.2	18%	0.177	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	139.1	-177.5	65.9	-178.7	-62.4	0	0	113	E139 R143 K151 V163 K164 L165	E139-M149 HydrophobicContact CB-CE 4.18Å; E139-M149 HydrophobicContact CB-SD 4.36Å; E139-M149 HydrophobicContact CG-CE 3.85Å; R143-M149 HydrophobicContact CG-CG 4.3Å; R143-M149 HydrophobicContact CG-SD 3.85Å; R143-M149 PolarHBondContact NE-SD 3.28Å; M149-K151 HydrophobicContact CE-CG 4.37Å; M149-V163 HydrophobicContact CB-CG1 4.34Å; M149-V163 HydrophobicContact CE-CG1 3.62Å; M149-K164 VanDerWaalsContact CA-O 3.26Å; M149-K164 WeakPolarHBondContact CA-O 3.45Å; M149-L165 HydrophobicContact CB-CD2 3.77Å
150	E	92.9	Very high	87.4	Confident	34 Å²	34	57.8 Å²	57.8	16%	0.159	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	138.2	170.9	177.4	176.5	-114.8	0	0	108.7	F112 R113 K164	F112-E150 WeakPolarHBondContact CA-OE2 3.46Å; F112-E150 HydrophobicContact CD1-CB 4.47Å; F112-E150 HydrophobicContact CD2-CB 3.75Å; F112-E150 HydrophobicContact CE2-CB 3.79Å; F112-E150 HydrophobicContact CG-CB 4.1Å; F112-E150 HydrophobicContact CZ-CB 4.18Å; R113-E150 WeakPolarHBondContact CB-OE1 3.34Å; R113-E150 WeakPolarHBondContact CD-OE1 3.45Å; R113-E150 WeakPolarHBondContact CG-OE1 3.3Å; R113-E150 PolarHBondContact N-OE1 2.91Å; R113-E150 PolarHBondContact N-OE2 3.06Å; E150-K164 HydrophobicContact CB-CB 4.35Å; E150-K164 HydrophobicContact CB-CD 4.26Å; E150-K164 HydrophobicContact CG-CD 4.33Å; E150-K164 PolarHBondContact N-O 3.46Å; E150-K164 PolarHBondContact O-N 2.94Å; E150-K164 VanDerWaalsContact OE2-CD 3.23Å; E150-K164 WeakPolarHBondContact OE2-CD 3.48Å; E150-K164 WeakPolarHBondContact OE2-CE 3.31Å; E150-K164 IonicContact OE2-NZ 3.51Å; E150-K164 PolarHBondContact OE2-NZ 3.49Å
151	K	91	Very high	87.4	Confident	84 Å²	84	52.5 Å²	52.5	37%	0.365	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	134.4	177.2	-68.1	-164.1	175.4	-168.7	0	111.1	Y125 E139 M149 I161 F162 V163	Y125-K151 PolarHBondContact OH-NZ 3.41Å; E139-K151 VanDerWaalsContact CD-CE 3.41Å; E139-K151 WeakPolarHBondContact OE1-CE 3.32Å; E139-K151 IonicContact OE1-NZ 3.93Å; E139-K151 PolarHBondContact OE1-NZ 3.4Å; E139-K151 WeakPolarHBondContact OE2-CE 3.3Å; E139-K151 IonicContact OE2-NZ 2.83Å; E139-K151 PolarHBondContact OE2-NZ 2.84Å; M149-K151 HydrophobicContact CE-CG 4.37Å; K151-I161 HydrophobicContact CB-CG2 4.37Å; K151-I161 HydrophobicContact CD-CG2 4.44Å; K151-F162 WeakPolarHBondContact CA-O 3.32Å; K151-V163 HydrophobicContact CG-CG2 4.32Å
152	E	87.7	Confident	87.4	Confident	27 Å²	27	49.9 Å²	49.9	13%	0.126	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	140.2	171.6	-64	-169.9	131.6	0	0	111	R113 I161 F162 K164 W695	R113-E152 IonicContact CZ-OE1 2.74Å; R113-E152 IonicContact NE-OE1 3.18Å; R113-E152 PolarHBondContact NE-OE1 3.01Å; R113-E152 IonicContact NH2-OE1 2.78Å; R113-E152 PolarHBondContact NH2-OE1 3.42Å; E152-I161 CarbonylContact O-C 3.59Å; E152-I161 WeakPolarHBondContact O-CA 3.36Å; E152-F162 PolarHBondContact N-O 3.07Å; E152-F162 PolarHBondContact O-N 3.46Å; E152-K164 IonicContact OE1-NZ 2.98Å; E152-K164 WeakPolarHBondContact OE2-CE 3.2Å; E152-K164 IonicContact OE2-NZ 3.26Å; E152-K164 PolarHBondContact OE2-NZ 3.07Å; E152-W695 WeakPolarHBondContact OE2-CZ2 3.25Å
153	S	85.3	Confident	87.5	Confident	70 Å²	70	49.9 Å²	49.9	49%	0.49	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	148.5	165.7	50.6	0	0	0	0	110.6	I160	S153-I160 WeakPolarHBondContact CA-O 3.08Å
154	S	82.7	Confident	87.6	Confident	12 Å²	12	43.2 Å²	43.2	8%	0.084	25%	0.251	C	S	.	.			trans	-60.9	148.4	170.7	-179.3	0	0	0	0	111.8	I156 N157 I160 E696	S154-I156 VanDerWaalsContact C-N 3.28Å; S154-I156 PolarHBondContact OG-N 3Å; S154-N157 WeakPolarHBondContact CB-O 3.29Å; S154-N157 PolarHBondContact OG-N 3.31Å; S154-I160 PolarHBondContact N-O 3.47Å; S154-E696 WeakPolarHBondContact CA-OE1 3.36Å; S154-E696 VanDerWaalsContact CB-OE1 3.26Å; S154-E696 WeakPolarHBondContact CB-OE1 3.47Å; S154-E696 PolarHBondContact OG-OE1 2.63Å
155	L	77	Confident	87.8	Confident	100 Å²	100	39.2 Å²	39.2	52%	0.524	22%	0.218	S	C	.	.	S	Bend	trans	-73.5	-20.7	168.8	-59.1	178.8	0	0	0	112.4	I690 E696	L155-I690 HydrophobicContact CD1-CG2 3.98Å; L155-E696 PolarHBondContact N-OE1 3.21Å
156	I	71.6	Confident	88	Confident	31 Å²	31	36.8 Å²	36.8	16%	0.159	21%	0.206	C	C	.	.	S	Bend	trans	-94.3	-44.4	-176.2	-55.5	171.3	0	0	0	111	S154 V680 H684 F692	S154-I156 VanDerWaalsContact C-N 3.28Å; S154-I156 PolarHBondContact OG-N 3Å; I156-V680 HydrophobicContact CD1-CG1 3.95Å; I156-V680 HydrophobicContact CD1-CG2 4.23Å; I156-V680 HydrophobicContact CG1-CG1 4.31Å; I156-V680 HydrophobicContact CG2-CG1 4.29Å; I156-V680 HydrophobicContact CG2-CG2 4.24Å; I156-H684 PolarHBondContact O-CE1 3.48Å; I156-H684 VanDerWaalsContact O-CE1 3.23Å; I156-F692 HydrophobicContact CD1-CD1 4.29Å; I156-F692 HydrophobicContact CD1-CE1 3.87Å; I156-F692 HydrophobicContact CD1-CZ 4.38Å; I156-F692 HydrophobicContact CG1-CD1 4.3Å; I156-F692 HydrophobicContact CG1-CE1 3.63Å; I156-F692 HydrophobicContact CG1-CZ 4.33Å
157	N	76	Confident	88.1	Confident	67 Å²	67	35.2 Å²	35.2	36%	0.358	19%	0.19	S	C	.	.			trans	-137.4	114	-178.3	-176.9	-12	0	0	0	111.1	S154 D159 I160	S154-N157 WeakPolarHBondContact CB-O 3.29Å; S154-N157 PolarHBondContact OG-N 3.31Å; N157-D159 PolarHBondContact O-N 3.26Å; N157-D159 VanDerWaalsContact O-N 3.1Å; N157-D159 VanDerWaalsContact OD1-CB 3.26Å; N157-D159 WeakPolarHBondContact OD1-CB 3.3Å; N157-D159 PolarHBondContact OD1-N 3.25Å; N157-I160 HydrophobicContact CB-CD1 4.07Å; N157-I160 HydrophobicContact CB-CG1 4.13Å; N157-I160 PolarHBondContact O-N 3.19Å
158	S	79	Confident	88.1	Confident	90 Å²	90	36.4 Å²	36.4	63%	0.629	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65	-13.4	-178	65.2	0	0	0	0	114.4	K127	K127-S158 WeakPolarHBondContact CD-O 3.27Å; K127-S158 WeakPolarHBondContact CE-O 3.43Å; K127-S158 PolarHBondContact NZ-O 3.25Å
159	D	85.3	Confident	87.9	Confident	38 Å²	38	34.9 Å²	34.9	20%	0.203	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-24	171.2	-164.7	12.3	0	0	0	112.5	R126 K127 S128 N157	R126-D159 CarbonylContact C-O 3.51Å; R126-D159 WeakPolarHBondContact CA-O 3.16Å; R126-D159 VanDerWaalsContact CD-OD2 3.3Å; R126-D159 WeakPolarHBondContact CD-OD2 3.49Å; R126-D159 HydrophobicContact CG-CB 4.26Å; R126-D159 WeakPolarHBondContact CG-OD1 3.45Å; R126-D159 WeakPolarHBondContact CG-OD2 3.36Å; K127-D159 WeakPolarHBondContact CA-OD1 3.37Å; K127-D159 VanDerWaalsContact CB-OD1 3.28Å; K127-D159 WeakPolarHBondContact CB-OD1 3.47Å; K127-D159 WeakPolarHBondContact CG-O 3.37Å; K127-D159 PolarHBondContact N-O 3.42Å; K127-D159 PolarHBondContact N-OD1 3.05Å; S128-D159 WeakPolarHBondContact CB-OD2 3.1Å; S128-D159 PolarHBondContact N-OD1 2.81Å; S128-D159 PolarHBondContact OG-OD1 3.12Å; S128-D159 PolarHBondContact OG-OD2 3.26Å; N157-D159 PolarHBondContact O-N 3.26Å; N157-D159 VanDerWaalsContact O-N 3.1Å; N157-D159 VanDerWaalsContact OD1-CB 3.26Å; N157-D159 WeakPolarHBondContact OD1-CB 3.3Å; N157-D159 PolarHBondContact OD1-N 3.25Å
160	I	88.9	Confident	87.7	Confident	18 Å²	18	39.5 Å²	39.5	9%	0.092	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	130.8	179.5	-59.6	179.6	0	0	0	110.3	V124 S153 S154 N157 F162 Y699	V124-I160 HydrophobicContact CG1-CG2 3.61Å; S153-I160 WeakPolarHBondContact CA-O 3.08Å; S154-I160 PolarHBondContact N-O 3.47Å; N157-I160 HydrophobicContact CB-CD1 4.07Å; N157-I160 HydrophobicContact CB-CG1 4.13Å; N157-I160 PolarHBondContact O-N 3.19Å; I160-F162 HydrophobicContact CG2-CE2 4.19Å; I160-F162 HydrophobicContact CG2-CZ 4.19Å; I160-Y699 HydrophobicContact CD1-CE1 4.19Å
161	I	91.3	Very high	87.7	Confident	20 Å²	20	38.2 Å²	38.2	10%	0.103	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	130.2	170.6	-67.7	176.7	0	0	0	109.9	V124 Y125 K127 K151 E152 V163	V124-I161 WeakPolarHBondContact CA-O 3.46Å; Y125-I161 HydrophobicContact CD1-CB 4.34Å; Y125-I161 HydrophobicContact CD1-CG2 4.31Å; Y125-I161 HydrophobicContact CD2-CB 4.38Å; Y125-I161 HydrophobicContact CE1-CB 4Å; Y125-I161 HydrophobicContact CE1-CG2 3.67Å; Y125-I161 HydrophobicContact CE2-CB 4.03Å; Y125-I161 HydrophobicContact CE2-CD1 3.78Å; Y125-I161 HydrophobicContact CE2-CG1 4.35Å; Y125-I161 HydrophobicContact CE2-CG2 4.47Å; Y125-I161 PolarHBondContact N-O 2.87Å; Y125-I161 PolarHBondContact O-N 3.28Å; Y125-I161 WeakPolarHBondContact OH-CD1 3.38Å; K127-I161 HydrophobicContact CD-CD1 4.24Å; K127-I161 HydrophobicContact CG-CD1 3.68Å; K127-I161 HydrophobicContact CG-CG1 4.1Å; K151-I161 HydrophobicContact CB-CG2 4.37Å; K151-I161 HydrophobicContact CD-CG2 4.44Å; E152-I161 CarbonylContact O-C 3.59Å; E152-I161 WeakPolarHBondContact O-CA 3.36Å; I161-V163 HydrophobicContact CG2-CG2 4.34Å
162	F	92.8	Very high	87.6	Confident	1 Å²	1	34.2 Å²	34.2	0%	0.004	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	128.4	165	-63.5	-77.8	0	0	0	109.8	I122 V124 K151 E152 I160 W695 E696 Y699	I122-F162 HydrophobicContact CG2-CD1 4.12Å; V124-F162 HydrophobicContact CB-CD1 4.5Å; V124-F162 HydrophobicContact CG1-CD1 4.17Å; V124-F162 HydrophobicContact CG1-CE1 3.96Å; V124-F162 HydrophobicContact CG2-CD1 3.71Å; V124-F162 HydrophobicContact CG2-CE1 3.75Å; K151-F162 WeakPolarHBondContact CA-O 3.32Å; E152-F162 PolarHBondContact N-O 3.07Å; E152-F162 PolarHBondContact O-N 3.46Å; I160-F162 HydrophobicContact CG2-CE2 4.19Å; I160-F162 HydrophobicContact CG2-CZ 4.19Å; F162-W695 AromaticContact CD2-CD1 3.69Å; F162-W695 AromaticContact CG-CD1 3.66Å; F162-E696 HydrophobicContact CD2-CG 4.38Å; F162-E696 HydrophobicContact CE2-CG 3.57Å; F162-E696 HydrophobicContact CZ-CG 3.86Å; F162-Y699 HydrophobicContact CE1-CD1 4.42Å; F162-Y699 HydrophobicContact CE1-CD2 4.15Å; F162-Y699 AromaticContact CE1-CG 3.9Å; F162-Y699 HydrophobicContact CE1-CG 3.9Å; F162-Y699 HydrophobicContact CZ-CD1 4.15Å; F162-Y699 HydrophobicContact CZ-CG 4.05Å
163	V	93.3	Very high	87.7	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	108.8	169.2	-173.6	0	0	0	0	107.7	I122 L123 Y125 M149 K151 I161 L165	I122-V163 WeakPolarHBondContact CA-O 3.45Å; L123-V163 HydrophobicContact CB-CB 4.23Å; L123-V163 PolarHBondContact N-O 2.99Å; L123-V163 PolarHBondContact O-N 3.02Å; Y125-V163 HydrophobicContact CD1-CG2 3.85Å; Y125-V163 HydrophobicContact CE1-CG2 3.55Å; M149-V163 HydrophobicContact CB-CG1 4.34Å; M149-V163 HydrophobicContact CE-CG1 3.62Å; K151-V163 HydrophobicContact CG-CG2 4.32Å; I161-V163 HydrophobicContact CG2-CG2 4.34Å; V163-L165 HydrophobicContact CG1-CD2 4.07Å
164	K	94.1	Very high	87.9	Confident	1 Å²	1	35.2 Å²	35.2	0%	0.004	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	136.5	172.7	-56.7	169.3	-175.2	174.4	0	108.9	F112 I119 M149 E150 E152 W695	F112-K164 HydrophobicContact CD1-CB 4.16Å; F112-K164 HydrophobicContact CD1-CD 4.18Å; F112-K164 HydrophobicContact CE1-CB 3.61Å; F112-K164 HydrophobicContact CE1-CD 4.46Å; F112-K164 HydrophobicContact CZ-CB 4.18Å; I119-K164 HydrophobicContact CD1-CD 3.7Å; I119-K164 HydrophobicContact CD1-CG 4Å; I119-K164 HydrophobicContact CG1-CB 4.22Å; I119-K164 HydrophobicContact CG1-CD 4.04Å; I119-K164 HydrophobicContact CG1-CG 4.24Å; I119-K164 HydrophobicContact CG2-CB 4.21Å; I119-K164 HydrophobicContact CG2-CG 4.48Å; M149-K164 VanDerWaalsContact CA-O 3.26Å; M149-K164 WeakPolarHBondContact CA-O 3.45Å; E150-K164 HydrophobicContact CB-CB 4.35Å; E150-K164 HydrophobicContact CB-CD 4.26Å; E150-K164 HydrophobicContact CG-CD 4.33Å; E150-K164 PolarHBondContact N-O 3.46Å; E150-K164 PolarHBondContact O-N 2.94Å; E150-K164 VanDerWaalsContact OE2-CD 3.23Å; E150-K164 WeakPolarHBondContact OE2-CD 3.48Å; E150-K164 WeakPolarHBondContact OE2-CE 3.31Å; E150-K164 IonicContact OE2-NZ 3.51Å; E150-K164 PolarHBondContact OE2-NZ 3.49Å; E152-K164 IonicContact OE1-NZ 2.98Å; E152-K164 WeakPolarHBondContact OE2-CE 3.2Å; E152-K164 IonicContact OE2-NZ 3.26Å; E152-K164 PolarHBondContact OE2-NZ 3.07Å; K164-W695 VanDerWaalsContact CE-CH2 3.49Å
165	L	94.3	Very high	88.2	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	139.8	176.2	-59.5	175.8	0	0	0	110.8	D120 Y121 L123 I142 Q148 M149 V163 V264 L268	D120-L165 PolarHBondContact N-O 3.3Å; Y121-L165 HydrophobicContact CD1-CD1 4.4Å; Y121-L165 PolarHBondContact N-O 2.79Å; Y121-L165 PolarHBondContact O-N 2.97Å; L123-L165 HydrophobicContact CD1-CD1 4.18Å; L123-L165 HydrophobicContact CG-CD1 4.13Å; I142-L165 HydrophobicContact CG2-CD2 4Å; Q148-L165 WeakPolarHBondContact O-CA 3.48Å; M149-L165 HydrophobicContact CB-CD2 3.77Å; V163-L165 HydrophobicContact CG1-CD2 4.07Å; L165-V264 HydrophobicContact CB-CG1 4.41Å; L165-V264 HydrophobicContact CD1-CG1 4.3Å; L165-L268 HydrophobicContact CD1-CD1 3.75Å; L165-L268 HydrophobicContact CD1-CD2 3.97Å; L165-L268 HydrophobicContact CD1-CG 4.37Å
166	H	94	Very high	88.6	Confident	24 Å²	24	31 Å²	31	11%	0.111	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	136.1	174.5	175	61.8	0	0	0	110.2	F112 C117 R118 D120 Q148 P168 R260	F112-H166 HydrophobicContact CE1-CB 3.88Å; F112-H166 HydrophobicContact CE2-CB 4.23Å; F112-H166 HydrophobicContact CZ-CB 3.57Å; C117-H166 HydrophobicContact CB-CB 4.35Å; R118-H166 PolarHBondContact N-ND1 3.19Å; R118-H166 WeakPolarHBondContact O-CB 3.27Å; R118-H166 PolarHBondContact O-ND1 3.35Å; D120-H166 IonicContact OD2-ND1 3.88Å; D120-H166 PolarHBondContact OD2-ND1 3.03Å; Q148-H166 HydrophobicContact CB-CB 4.28Å; Q148-H166 PolarHBondContact N-O 3.22Å; Q148-H166 PolarHBondContact O-N 2.74Å; H166-P168 WeakPolarHBondContact O-CD 3.35Å; H166-R260 PolarHBondContact CE1-NH2 2.93Å; H166-R260 VanDerWaalsContact CE1-NH2 3.26Å; H166-R260 PolarHBondContact ND1-NH2 3.14Å
167	A	93.3	Very high	89.3	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.161	C	C	.	.			trans	-101.7	114.6	173.4	0	0	0	0	0	111.4	D120 L147 L172 R260 V264	D120-A167 PolarHBondContact OD2-N 3.28Å; L147-A167 HydrophobicContact CD2-CB 3.81Å; A167-L172 HydrophobicContact CB-CD1 4.23Å; A167-L172 HydrophobicContact CB-CD2 3.72Å; A167-L172 HydrophobicContact CB-CG 3.72Å; A167-L172 WeakPolarHBondContact O-CD1 3.47Å; A167-R260 PolarHBondContact O-NH2 2.8Å; A167-V264 HydrophobicContact CB-CG2 3.7Å
168	P	92.9	Very high	89.6	Confident	30 Å²	30	35.2 Å²	35.2	20%	0.195	17%	0.172	C	C	.	.			trans	-61.9	157.6	170.8	-23.4	34.7	0	0	0	112.6	Q148 H166 E170 V171 L172	Q148-P168 HydrophobicContact CG-CG 4.08Å; H166-P168 WeakPolarHBondContact O-CD 3.35Å; P168-E170 PolarHBondContact O-N 3.37Å; P168-V171 HydrophobicContact CG-CG2 4.43Å; P168-V171 PolarHBondContact O-N 3.4Å; P168-V171 VanDerWaalsContact O-N 3.14Å; P168-L172 PolarHBondContact O-N 2.87Å
169	W	89.2	Confident	89.6	Confident	49 Å²	49	32.2 Å²	32.2	19%	0.186	15%	0.149	C	C	.	.	H	α-helix	trans	-53.2	-37.9	179.1	174.1	-91.8	0	0	0	113.8	L172 G173 F238 I248 K251 F254 F255	W169-L172 PolarHBondContact O-N 3.02Å; W169-G173 PolarHBondContact O-N 2.92Å; W169-F238 HydrophobicContact CZ2-CZ 4.31Å; W169-I248 HydrophobicContact CH2-CD1 4.19Å; W169-I248 HydrophobicContact CZ2-CD1 4.26Å; W169-K251 HydrophobicContact CD2-CB 4.2Å; W169-K251 HydrophobicContact CD2-CD 4.2Å; W169-K251 HydrophobicContact CD2-CG 4.29Å; W169-K251 HydrophobicContact CE3-CB 3.71Å; W169-K251 HydrophobicContact CE3-CG 4.18Å; W169-K251 HydrophobicContact CG-CD 4.43Å; W169-K251 HydrophobicContact CH2-CG 4.41Å; W169-K251 HydrophobicContact CZ3-CB 3.89Å; W169-K251 HydrophobicContact CZ3-CG 4.24Å; W169-K251 VanDerWaalsContact CZ3-O 3.27Å; W169-K251 WeakPolarHBondContact CZ3-O 3.24Å; W169-F254 HydrophobicContact CH2-CB 4.46Å; W169-F254 AromaticContact CH2-CD1 3.62Å; W169-F254 HydrophobicContact CH2-CD1 3.62Å; W169-F254 HydrophobicContact CH2-CE1 4.15Å; W169-F254 HydrophobicContact CH2-CG 4.23Å; W169-F254 HydrophobicContact CZ3-CB 4.21Å; W169-F254 AromaticContact CZ3-CD1 3.88Å; W169-F254 HydrophobicContact CZ3-CD1 3.88Å; W169-F254 HydrophobicContact CZ3-CG 4.4Å; W169-F255 AromaticContact CE3-CD2 4Å; W169-F255 HydrophobicContact CE3-CD2 4Å; W169-F255 AromaticContact CE3-CE2 3.86Å; W169-F255 HydrophobicContact CE3-CE2 3.86Å; W169-F255 HydrophobicContact CH2-CD2 4.31Å; W169-F255 AromaticContact CH2-CE2 3.77Å; W169-F255 HydrophobicContact CH2-CE2 3.77Å; W169-F255 HydrophobicContact CZ2-CE2 4.45Å; W169-F255 AromaticContact CZ3-CD2 3.58Å; W169-F255 HydrophobicContact CZ3-CD2 3.58Å; W169-F255 AromaticContact CZ3-CE2 3.43Å; W169-F255 HydrophobicContact CZ3-CE2 3.43Å; W169-F255 VanDerWaalsContact CZ3-CE2 3.43Å
170	E	89.6	Confident	89.2	Confident	134 Å²	134	33.6 Å²	33.6	63%	0.626	16%	0.156	S	C	*	.	H	α-helix	trans	-69.3	-38.5	-179	-64.1	177.4	-171.2	0	0	112.7	P168 R174	P168-E170 PolarHBondContact O-N 3.37Å; E170-R174 WeakPolarHBondContact O-CB 3.14Å; E170-R174 PolarHBondContact O-N 2.83Å; E170-R174 VanDerWaalsContact O-N 3.07Å
171	V	91.8	Very high	88.8	Confident	7 Å²	7	32.9 Å²	32.9	4%	0.042	15%	0.153	C	C	.	.	H	α-helix	trans	-67.4	-48.5	174.3	179	0	0	0	0	109.3	L147 P168 G173 R174 Y175 I267	L147-V171 HydrophobicContact CD2-CG1 4.08Å; P168-V171 HydrophobicContact CG-CG2 4.43Å; P168-V171 PolarHBondContact O-N 3.4Å; P168-V171 VanDerWaalsContact O-N 3.14Å; V171-G173 PolarHBondContact O-N 3Å; V171-R174 PolarHBondContact O-N 3.48Å; V171-Y175 HydrophobicContact CG1-CD2 3.72Å; V171-Y175 HydrophobicContact CG1-CE2 3.86Å; V171-Y175 WeakPolarHBondContact O-CD2 3.37Å; V171-Y175 PolarHBondContact O-N 2.97Å; V171-I267 HydrophobicContact CG1-CD1 3.85Å
172	L	90.8	Very high	88.1	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-58.3	-44.6	176.6	-72.1	170.8	0	0	0	112.3	A167 P168 W169 A176 F255 R260 I263	A167-L172 HydrophobicContact CB-CD1 4.23Å; A167-L172 HydrophobicContact CB-CD2 3.72Å; A167-L172 HydrophobicContact CB-CG 3.72Å; A167-L172 WeakPolarHBondContact O-CD1 3.47Å; P168-L172 PolarHBondContact O-N 2.87Å; W169-L172 PolarHBondContact O-N 3.02Å; L172-A176 WeakPolarHBondContact O-CA 3.42Å; L172-A176 WeakPolarHBondContact O-CB 3.39Å; L172-A176 PolarHBondContact O-N 3.07Å; L172-F255 HydrophobicContact CB-CD2 4.08Å; L172-F255 HydrophobicContact CB-CE2 3.93Å; L172-F255 HydrophobicContact CB-CZ 4.44Å; L172-F255 HydrophobicContact CD1-CD2 4.21Å; L172-R260 HydrophobicContact CD1-CG 4.25Å; L172-R260 VanDerWaalsContact CD1-CZ 3.48Å; L172-R260 VanDerWaalsContact CD1-NH1 3.28Å; L172-R260 HydrophobicContact CD2-CB 4.45Å; L172-R260 HydrophobicContact CD2-CG 4.36Å; L172-I263 HydrophobicContact CD2-CB 4.14Å; L172-I263 HydrophobicContact CD2-CD1 3.9Å; L172-I263 HydrophobicContact CD2-CG2 3.99Å
173	G	88.3	Confident	87.4	Confident	2 Å²	2	35.6 Å²	35.6	2%	0.021	16%	0.162	C	C	.	.	H	α-helix	trans	-62	-47.1	177.8	0	0	0	0	0	112.6	W169 V171 A176 E177	W169-G173 PolarHBondContact O-N 2.92Å; V171-G173 PolarHBondContact O-N 3Å; G173-A176 PolarHBondContact O-N 2.88Å; G173-E177 PolarHBondContact O-N 3.41Å
174	R	90	Very high	86.6	Confident	115 Å²	115	38.1 Å²	38.1	43%	0.434	18%	0.179	S	C	.	.	H	α-helix	trans	-60	-50.6	178.7	-173.6	-169.1	-58.8	165.7	2.7	112.1	E170 V171 E177 Q178	E170-R174 WeakPolarHBondContact O-CB 3.14Å; E170-R174 PolarHBondContact O-N 2.83Å; E170-R174 VanDerWaalsContact O-N 3.07Å; V171-R174 PolarHBondContact O-N 3.48Å; R174-E177 PolarHBondContact O-N 3.5Å; R174-Q178 WeakPolarHBondContact O-CG 3.44Å; R174-Q178 PolarHBondContact O-N 3.33Å; R174-Q178 VanDerWaalsContact O-N 3.12Å
175	Y	88.4	Confident	85.3	Confident	23 Å²	23	39.7 Å²	39.7	9%	0.09	19%	0.185	C	C	.	.	H	α-helix	trans	-75.9	-27.2	-179.9	-73.2	-77.8	0	0	0	112.6	E145 V171 E177 Q178 M179 I263 I267	E145-Y175 PolarHBondContact OE2-OH 3.02Å; V171-Y175 HydrophobicContact CG1-CD2 3.72Å; V171-Y175 HydrophobicContact CG1-CE2 3.86Å; V171-Y175 WeakPolarHBondContact O-CD2 3.37Å; V171-Y175 PolarHBondContact O-N 2.97Å; Y175-E177 VanDerWaalsContact C-N 3.33Å; Y175-E177 PolarHBondContact O-N 3.47Å; Y175-Q178 PolarHBondContact O-N 3.18Å; Y175-M179 VanDerWaalsContact O-CB 3.29Å; Y175-M179 WeakPolarHBondContact O-CB 3.48Å; Y175-M179 VanDerWaalsContact O-CG 3.23Å; Y175-M179 WeakPolarHBondContact O-CG 3.2Å; Y175-M179 PolarHBondContact O-N 3.14Å; Y175-I263 HydrophobicContact CG-CG2 4.41Å; Y175-I267 HydrophobicContact CD1-CG1 4.01Å; Y175-I267 HydrophobicContact CD2-CD1 3.49Å; Y175-I267 VanDerWaalsContact CD2-CD1 3.49Å; Y175-I267 HydrophobicContact CD2-CG1 3.82Å; Y175-I267 HydrophobicContact CE1-CG1 3.91Å; Y175-I267 HydrophobicContact CE2-CD1 3.58Å; Y175-I267 HydrophobicContact CE2-CG1 3.71Å; Y175-I267 HydrophobicContact CG-CD1 4.02Å; Y175-I267 HydrophobicContact CG-CG1 3.97Å
176	A	86.9	Confident	83.8	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-65.4	-35.3	171.9	0	0	0	0	0	112.7	L172 G173 N180 V181 F238 F255 I263	L172-A176 WeakPolarHBondContact O-CA 3.42Å; L172-A176 WeakPolarHBondContact O-CB 3.39Å; L172-A176 PolarHBondContact O-N 3.07Å; G173-A176 PolarHBondContact O-N 2.88Å; A176-N180 PolarHBondContact O-N 2.91Å; A176-V181 HydrophobicContact CB-CB 4.03Å; A176-V181 HydrophobicContact CB-CG2 4Å; A176-V181 WeakPolarHBondContact O-CG2 3Å; A176-V181 PolarHBondContact O-N 2.81Å; A176-F238 HydrophobicContact CB-CD1 3.99Å; A176-F255 HydrophobicContact CB-CE1 3.57Å; A176-F255 HydrophobicContact CB-CZ 3.77Å; A176-I263 HydrophobicContact CB-CD1 4.23Å
177	E	85.6	Confident	82.2	Confident	62 Å²	62	49 Å²	49	29%	0.29	22%	0.22	S	C	.	.	H	α-helix	trans	-71.4	-40.1	172.4	-175	158.5	-155.4	0	0	111.4	G173 R174 Y175 M179 N180 F238 S239 Q240	G173-E177 PolarHBondContact O-N 3.41Å; R174-E177 PolarHBondContact O-N 3.5Å; Y175-E177 VanDerWaalsContact C-N 3.33Å; Y175-E177 PolarHBondContact O-N 3.47Å; E177-M179 PolarHBondContact O-N 3.32Å; E177-N180 PolarHBondContact O-N 2.85Å; E177-F238 WeakPolarHBondContact CA-O 3.2Å; E177-F238 WeakPolarHBondContact CB-O 3.38Å; E177-S239 VanDerWaalsContact CD-CA 3.46Å; E177-S239 VanDerWaalsContact OE1-CA 3.29Å; E177-S239 WeakPolarHBondContact OE1-CA 3.05Å; E177-S239 WeakPolarHBondContact OE1-CB 3.33Å; E177-S239 PolarHBondContact OE1-OG 3.25Å; E177-Q240 VanDerWaalsContact OE2-CB 3.29Å; E177-Q240 WeakPolarHBondContact OE2-CB 3.42Å; E177-Q240 PolarHBondContact OE2-N 3.47Å
178	Q	82.6	Confident	80	Confident	125 Å²	125	54.3 Å²	54.3	58%	0.584	24%	0.243	S	C	*	.	H	α-helix	trans	-66	-32.4	173.6	-69.9	177.6	-2.2	0	0	113.9	R174 Y175	R174-Q178 WeakPolarHBondContact O-CG 3.44Å; R174-Q178 PolarHBondContact O-N 3.33Å; R174-Q178 VanDerWaalsContact O-N 3.12Å; Y175-Q178 PolarHBondContact O-N 3.18Å
179	M	77.5	Confident	77.7	Confident	27 Å²	27	59.1 Å²	59.1	13%	0.133	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	17.8	179.9	-61.8	179.7	83.2	0	0	113.4	Y175 E177 V181 I263 H266	Y175-M179 VanDerWaalsContact O-CB 3.29Å; Y175-M179 WeakPolarHBondContact O-CB 3.48Å; Y175-M179 VanDerWaalsContact O-CG 3.23Å; Y175-M179 WeakPolarHBondContact O-CG 3.2Å; Y175-M179 PolarHBondContact O-N 3.14Å; E177-M179 PolarHBondContact O-N 3.32Å; M179-V181 HydrophobicContact CB-CG2 3.96Å; M179-V181 PolarHBondContact O-N 3.01Å; M179-I263 HydrophobicContact SD-CG1 3.96Å; M179-H266 HydrophobicContact CE-CB 3.7Å; M179-H266 HydrophobicContact SD-CB 3.88Å
180	N	78.8	Confident	75.4	Confident	68 Å²	68	63.5 Å²	63.5	36%	0.364	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	42.9	46.2	179.8	-77.3	-30.5	0	0	0	113.5	A176 E177 R182 P237 E465	A176-N180 PolarHBondContact O-N 2.91Å; E177-N180 PolarHBondContact O-N 2.85Å; N180-R182 PolarHBondContact O-N 3.07Å; N180-P237 HydrophobicContact CB-CB 4.43Å; N180-E465 PolarHBondContact ND2-OE1 3.27Å
181	V	79.5	Confident	73.1	Confident	3 Å²	3	67.4 Å²	67.4	2%	0.018	29%	0.293	C	S	.	.			trans	-73.4	103	-173.9	-177.7	0	0	0	0	110	A176 M179 M183 F238 T259	A176-V181 HydrophobicContact CB-CB 4.03Å; A176-V181 HydrophobicContact CB-CG2 4Å; A176-V181 WeakPolarHBondContact O-CG2 3Å; A176-V181 PolarHBondContact O-N 2.81Å; M179-V181 HydrophobicContact CB-CG2 3.96Å; M179-V181 PolarHBondContact O-N 3.01Å; V181-M183 HydrophobicContact CG1-CE 4.05Å; V181-F238 WeakPolarHBondContact O-CB 3.49Å; V181-F238 PolarHBondContact O-N 3.32Å; V181-T259 HydrophobicContact CG1-CG2 3.92Å
182	R	77.5	Confident	70.8	Confident	62 Å²	62	71.5 Å²	71.5	23%	0.234	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	133.5	174.5	-68.4	-174.1	175	-142.1	-8.6	112.1	N180 A236 D457 D460	N180-R182 PolarHBondContact O-N 3.07Å; R182-A236 CarbonylContact C-O 3.57Å; R182-A236 VanDerWaalsContact CA-O 3.31Å; R182-A236 WeakPolarHBondContact CA-O 3.39Å; R182-D457 HydrophobicContact CB-CB 4.42Å; R182-D460 IonicContact CZ-OD2 3.59Å; R182-D460 IonicContact NH1-OD2 3.36Å; R182-D460 PolarHBondContact NH1-OD2 2.81Å; R182-D460 IonicContact NH2-OD2 3.7Å; R182-D460 PolarHBondContact NH2-OD2 3.05Å
183	M	77.9	Confident	68.2	Low	16 Å²	16	75.4 Å²	75.4	8%	0.079	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	155.2	-177.7	-74.4	-62.2	-166.9	0	0	111.8	V181 F185 T235 A236 F238 F246 F254 F255	V181-M183 HydrophobicContact CG1-CE 4.05Å; M183-F185 PolarHBondContact O-N 3.41Å; M183-T235 VanDerWaalsContact O-CA 3.32Å; M183-T235 WeakPolarHBondContact O-CA 3.38Å; M183-A236 PolarHBondContact N-O 3.28Å; M183-A236 PolarHBondContact O-N 2.95Å; M183-F238 HydrophobicContact CG-CB 4.19Å; M183-F238 HydrophobicContact CG-CD2 4.39Å; M183-F246 HydrophobicContact CB-CD1 3.82Å; M183-F246 HydrophobicContact CB-CE1 4Å; M183-F254 HydrophobicContact CB-CE1 4.49Å; M183-F254 HydrophobicContact CB-CE2 4.38Å; M183-F254 HydrophobicContact CB-CZ 3.74Å; M183-F254 HydrophobicContact CE-CD1 4.19Å; M183-F254 HydrophobicContact CE-CE1 3.91Å; M183-F254 HydrophobicContact CE-CZ 4.41Å; M183-F254 HydrophobicContact CG-CE1 3.89Å; M183-F254 HydrophobicContact CG-CE2 4.48Å; M183-F254 HydrophobicContact CG-CZ 3.63Å; M183-F254 HydrophobicContact SD-CE1 4.12Å; M183-F254 HydrophobicContact SD-CE2 4.45Å; M183-F254 HydrophobicContact SD-CZ 4.01Å; M183-F255 HydrophobicContact CE-CD1 3.29Å; M183-F255 HydrophobicContact CE-CE1 3.51Å; M183-F255 HydrophobicContact CE-CG 4.21Å
184	P	75.2	Confident	65.8	Low	53 Å²	53	86.4 Å²	86.4	34%	0.344	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	124.8	-176.9	-24.7	35.4	0	0	0	114.2	C233 I247	P184-C233 HydrophobicContact CB-CB 4.34Å; P184-I247 HydrophobicContact CB-CB 4.48Å; P184-I247 HydrophobicContact CB-CD1 4.2Å; P184-I247 PolarHBondContact O-N 2.62Å
185	F	67.9	Low	63.4	Low	33 Å²	33	91 Å²	91	15%	0.145	40%	0.398	C	S	.	.	B	Isolated β-bridge	trans	-99.1	142.9	-176.6	-161.3	-93.5	0	0	0	111.9	M183 Y234 A236 H245 F246 M927	M183-F185 PolarHBondContact O-N 3.41Å; F185-Y234 VanDerWaalsContact CB-O 3.29Å; F185-Y234 WeakPolarHBondContact CB-O 3.28Å; F185-Y234 PolarHBondContact N-O 3.45Å; F185-A236 HydrophobicContact CB-CB 4.29Å; F185-A236 HydrophobicContact CD2-CB 3.69Å; F185-A236 HydrophobicContact CE2-CB 4.34Å; F185-A236 HydrophobicContact CG-CB 4.26Å; F185-H245 HydrophobicContact CD2-CB 4.03Å; F185-H245 HydrophobicContact CE1-CB 4.16Å; F185-H245 HydrophobicContact CE2-CB 3.39Å; F185-H245 HydrophobicContact CZ-CB 3.48Å; F185-H245 VanDerWaalsContact CZ-CB 3.48Å; F185-H245 AromaticContact CZ-CG 3.75Å; F185-F246 HydrophobicContact CD2-CD1 4.47Å; F185-F246 HydrophobicContact CD2-CE1 4.08Å; F185-F246 HydrophobicContact CD2-CZ 4.18Å; F185-M927 HydrophobicContact CD1-CE 4.44Å; F185-M927 HydrophobicContact CD1-SD 4.03Å; F185-M927 HydrophobicContact CE1-CE 4.29Å; F185-M927 HydrophobicContact CE1-SD 3.6Å
186	R	61.3	Low	61.4	Low	140 Å²	140	97.9 Å²	97.9	53%	0.528	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-73.9	127.4	-179.5	-78.2	176.5	158.5	174.6	-5.4	111	H244 H245 I247	R186-H244 PolarHBondContact NH1-O 2.73Å; R186-H245 VanDerWaalsContact CB-O 3.25Å; R186-H245 WeakPolarHBondContact CB-O 3.49Å; R186-H245 WeakPolarHBondContact CG-O 3.46Å; R186-H245 PolarHBondContact N-O 3.29Å; R186-I247 HydrophobicContact CG-CG1 3.57Å
187	R	60.4	Low	59.5	Low	79 Å²	79	105.6 Å²	105.6	30%	0.298	46%	0.459	S	S	.	.			trans	-104	134.5	-176.2	170.7	175.3	168.6	-153.8	-6.9	112.4	I189 Y190	R187-I189 HydrophobicContact CG-CG1 4.26Å; R187-I189 PolarHBondContact O-N 2.78Å; R187-Y190 PolarHBondContact NH2-O 2.75Å
188	K	47.1	Very low	57.3	Low	113 Å²	113	108.8 Å²	108.8	49%	0.491	47%	0.472	S	S	.	.			trans	-71.6	115.2	153.4	-70.9	171.5	179.3	162.7	0	108.2	Y190 E930	K188-Y190 HydrophobicContact CB-CD2 4.46Å; K188-Y190 HydrophobicContact CB-CE2 3.96Å; K188-Y190 PolarHBondContact O-N 3.3Å; K188-E930 IonicContact NZ-OE1 3.3Å; K188-E930 PolarHBondContact NZ-OE1 3.12Å; K188-E930 IonicContact NZ-OE2 2.74Å; K188-E930 PolarHBondContact NZ-OE2 3.26Å
189	I	45.5	Very low	55.3	Low	131 Å²	131	109.5 Å²	109.5	67%	0.672	48%	0.477	S	S	*	.			trans	-80.7	83	-174	-54.1	179.4	0	0	0	110.8	R187	R187-I189 HydrophobicContact CG-CG1 4.26Å; R187-I189 PolarHBondContact O-N 2.78Å
190	Y	41.4	Very low	54	Low	141 Å²	141	110.6 Å²	110.6	55%	0.553	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-68.5	135.9	157.8	-60	-70	0	0	0	109.7	R187 K188	R187-Y190 PolarHBondContact NH2-O 2.75Å; K188-Y190 HydrophobicContact CB-CD2 4.46Å; K188-Y190 HydrophobicContact CB-CE2 3.96Å; K188-Y190 PolarHBondContact O-N 3.3Å
191	Y	40.6	Very low	52.6	Low	215 Å²	215	115.5 Å²	115.5	84%	0.843	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-50.9	139.5	-166.8	-66	-91.6	0	0	0	114.4
192	L	43.7	Very low	51.3	Low	94 Å²	94	119 Å²	119	49%	0.492	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-65.7	131.4	169.8	-90.1	78.8	0	0	0	110.6
193	P	36.2	Very low	49.8	Very low	81 Å²	81	120.8 Å²	120.8	53%	0.526	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-58.8	139.2	178.7	-27.5	35.8	0	0	0	113.9	R195 Y196	P193-R195 PolarHBondContact O-N 3.27Å; P193-Y196 PolarHBondContact O-N 3.27Å; P193-Y196 VanDerWaalsContact O-N 3.09Å
194	R	37.3	Very low	48.5	Very low	233 Å²	233	126.7 Å²	126.7	88%	0.879	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.9	-20.8	-179	-165.2	170.9	179.7	169.3	-2.8	114.4	Y196 K197 F198	R194-Y196 PolarHBondContact O-N 2.86Å; R194-K197 PolarHBondContact O-N 3.28Å; R194-F198 PolarHBondContact O-N 2.9Å
195	R	41	Very low	47.4	Very low	211 Å²	211	130 Å²	130	80%	0.796	57%	0.569	S	S	*	*	H	α-helix	trans	-55.5	-38.9	173.3	-96.1	-176.5	172.6	169.5	-1	113.9	P193 K197 F198 M199	P193-R195 PolarHBondContact O-N 3.27Å; R195-K197 VanDerWaalsContact C-N 3.35Å; R195-K197 PolarHBondContact O-N 3.23Å; R195-F198 WeakPolarHBondContact O-CA 3.29Å; R195-F198 WeakPolarHBondContact O-CB 3.23Å; R195-F198 PolarHBondContact O-N 3.28Å; R195-M199 PolarHBondContact O-N 2.83Å
196	Y	46.3	Very low	46.5	Very low	168 Å²	168	132.2 Å²	132.2	66%	0.659	58%	0.581	S	S	*	*	H	α-helix	trans	-61.8	-43	-178.7	-171.7	-89.6	0	0	0	111.6	P193 R194 F198 M199 S200	P193-Y196 PolarHBondContact O-N 3.27Å; P193-Y196 VanDerWaalsContact O-N 3.09Å; R194-Y196 PolarHBondContact O-N 2.86Å; Y196-F198 PolarHBondContact O-N 2.99Å; Y196-M199 PolarHBondContact O-N 3.17Å; Y196-S200 VanDerWaalsContact O-CB 3.27Å; Y196-S200 WeakPolarHBondContact O-CB 3.32Å; Y196-S200 PolarHBondContact O-N 3.16Å
197	K	45.4	Very low	45.8	Very low	162 Å²	162	128.5 Å²	128.5	70%	0.704	58%	0.577	S	S	*	*	H	α-helix	trans	-66.5	-17.9	173.2	-76.5	-176.1	174.9	178.4	0	113.6	R194 R195 R201	R194-K197 PolarHBondContact O-N 3.28Å; R195-K197 VanDerWaalsContact C-N 3.35Å; R195-K197 PolarHBondContact O-N 3.23Å; K197-R201 WeakPolarHBondContact O-CG 3.43Å
198	F	41.1	Very low	45.2	Very low	129 Å²	129	131.7 Å²	131.7	57%	0.566	59%	0.589	S	S	*	*	H	α-helix	trans	-86.9	-45.7	175.2	-160.7	-102.1	0	0	0	111.9	R194 R195 Y196 S200 R201 I202	R194-F198 PolarHBondContact O-N 2.9Å; R195-F198 WeakPolarHBondContact O-CA 3.29Å; R195-F198 WeakPolarHBondContact O-CB 3.23Å; R195-F198 PolarHBondContact O-N 3.28Å; Y196-F198 PolarHBondContact O-N 2.99Å; F198-S200 VanDerWaalsContact C-N 3.29Å; F198-S200 PolarHBondContact O-N 3.21Å; F198-R201 WeakPolarHBondContact O-CB 3.36Å; F198-R201 PolarHBondContact O-N 3.02Å; F198-I202 HydrophobicContact CD1-CD1 3.86Å; F198-I202 HydrophobicContact CE1-CD1 3.76Å; F198-I202 HydrophobicContact CE1-CG1 4.47Å; F198-I202 PolarHBondContact O-N 3.26Å; F198-I202 VanDerWaalsContact O-N 3.09Å
199	M	40.8	Very low	45.1	Very low	140 Å²	140	135.4 Å²	135.4	69%	0.69	61%	0.605	S	S	*	*	H	α-helix	trans	-59.2	-40.7	170.2	-81.7	-177.5	65.7	0	0	111.6	R195 Y196 R201 I202 D203	R195-M199 PolarHBondContact O-N 2.83Å; Y196-M199 PolarHBondContact O-N 3.17Å; M199-R201 PolarHBondContact O-N 3.27Å; M199-I202 PolarHBondContact O-N 2.68Å; M199-I202 VanDerWaalsContact O-N 3.14Å; M199-D203 WeakPolarHBondContact O-CB 3.47Å; M199-D203 PolarHBondContact O-N 3.07Å
200	S	49.8	Very low	45	Very low	51 Å²	51	136 Å²	136	36%	0.357	60%	0.599	S	S	.	*	H	α-helix	trans	-56.9	-33.9	173.3	-178.8	0	0	0	0	113.4	Y196 F198 K204	Y196-S200 VanDerWaalsContact O-CB 3.27Å; Y196-S200 WeakPolarHBondContact O-CB 3.32Å; Y196-S200 PolarHBondContact O-N 3.16Å; F198-S200 VanDerWaalsContact C-N 3.29Å; F198-S200 PolarHBondContact O-N 3.21Å; S200-K204 VanDerWaalsContact O-CB 3.3Å; S200-K204 WeakPolarHBondContact O-CB 3.48Å; S200-K204 VanDerWaalsContact O-CG 3.28Å; S200-K204 WeakPolarHBondContact O-CG 3.49Å; S200-K204 PolarHBondContact O-N 3.33Å
201	R	48.2	Very low	44.9	Very low	171 Å²	171	139 Å²	139	65%	0.645	61%	0.61	S	S	*	*	H	α-helix	trans	-72.5	-44	174.5	-72.1	169.4	-175	-160.5	-1.6	112	K197 F198 M199 D203 K204 Q205	K197-R201 WeakPolarHBondContact O-CG 3.43Å; F198-R201 WeakPolarHBondContact O-CB 3.36Å; F198-R201 PolarHBondContact O-N 3.02Å; M199-R201 PolarHBondContact O-N 3.27Å; R201-D203 VanDerWaalsContact C-N 3.35Å; R201-K204 CarbonylContact O-C 3.56Å; R201-K204 WeakPolarHBondContact O-CA 3.32Å; R201-K204 PolarHBondContact O-N 3.45Å; R201-Q205 WeakPolarHBondContact O-CB 3.47Å; R201-Q205 PolarHBondContact O-N 2.89Å
202	I	53.5	Low	44.9	Very low	76 Å²	76	141 Å²	141	39%	0.39	62%	0.616	S	S	.	*	H	α-helix	trans	-62.6	-42.9	176.7	-65.9	171.8	0	0	0	110.3	F198 M199 K204 Q205 I206	F198-I202 HydrophobicContact CD1-CD1 3.86Å; F198-I202 HydrophobicContact CE1-CD1 3.76Å; F198-I202 HydrophobicContact CE1-CG1 4.47Å; F198-I202 PolarHBondContact O-N 3.26Å; F198-I202 VanDerWaalsContact O-N 3.09Å; M199-I202 PolarHBondContact O-N 2.68Å; M199-I202 VanDerWaalsContact O-N 3.14Å; I202-K204 VanDerWaalsContact C-N 3.33Å; I202-K204 PolarHBondContact O-N 3.36Å; I202-Q205 CarbonylContact O-C 3.59Å; I202-Q205 WeakPolarHBondContact O-CA 3.44Å; I202-Q205 WeakPolarHBondContact O-CB 3.24Å; I202-Q205 PolarHBondContact O-N 3.34Å; I202-I206 HydrophobicContact CG2-CD1 3.8Å; I202-I206 HydrophobicContact CG2-CG1 4.34Å; I202-I206 WeakPolarHBondContact O-CG1 3.23Å; I202-I206 PolarHBondContact O-N 3.04Å
203	D	45.4	Very low	44.8	Very low	99 Å²	99	141.9 Å²	141.9	53%	0.529	62%	0.62	S	S	.	*	H	α-helix	trans	-68.9	-31.8	176.8	-154.5	24.4	0	0	0	111.5	M199 R201 Q205 S207	M199-D203 WeakPolarHBondContact O-CB 3.47Å; M199-D203 PolarHBondContact O-N 3.07Å; R201-D203 VanDerWaalsContact C-N 3.35Å; D203-Q205 PolarHBondContact O-N 2.74Å; D203-S207 WeakPolarHBondContact O-CB 3.32Å; D203-S207 PolarHBondContact O-N 3Å; D203-S207 PolarHBondContact O-OG 3.38Å; D203-S207 VanDerWaalsContact O-OG 3.05Å
204	K	51.1	Low	44.7	Very low	141 Å²	141	143 Å²	143	61%	0.613	63%	0.628	S	S	*	*	H	α-helix	trans	-72	-2.3	165.7	-76.1	-177.5	177.2	-171.5	0	115	S200 R201 I202 S207 R208	S200-K204 VanDerWaalsContact O-CB 3.3Å; S200-K204 WeakPolarHBondContact O-CB 3.48Å; S200-K204 VanDerWaalsContact O-CG 3.28Å; S200-K204 WeakPolarHBondContact O-CG 3.49Å; S200-K204 PolarHBondContact O-N 3.33Å; R201-K204 CarbonylContact O-C 3.56Å; R201-K204 WeakPolarHBondContact O-CA 3.32Å; R201-K204 PolarHBondContact O-N 3.45Å; I202-K204 VanDerWaalsContact C-N 3.33Å; I202-K204 PolarHBondContact O-N 3.36Å; K204-S207 WeakPolarHBondContact CA-OG 3.17Å; K204-R208 PolarHBondContact O-NE 2.85Å; K204-R208 PolarHBondContact O-NH2 3.24Å
205	Q	51.2	Low	44.7	Very low	122 Å²	122	141.5 Å²	141.5	57%	0.57	63%	0.628	S	S	*	*	H	α-helix	trans	-107.5	-42	175.9	-158.1	157.2	-8.2	0	0	109.7	R201 I202 D203 S207 R208 F209	R201-Q205 WeakPolarHBondContact O-CB 3.47Å; R201-Q205 PolarHBondContact O-N 2.89Å; I202-Q205 CarbonylContact O-C 3.59Å; I202-Q205 WeakPolarHBondContact O-CA 3.44Å; I202-Q205 WeakPolarHBondContact O-CB 3.24Å; I202-Q205 PolarHBondContact O-N 3.34Å; D203-Q205 PolarHBondContact O-N 2.74Å; Q205-S207 VanDerWaalsContact C-N 3.35Å; Q205-R208 WeakPolarHBondContact O-CB 3.49Å; Q205-R208 PolarHBondContact O-N 2.85Å; Q205-F209 PolarHBondContact O-N 2.87Å
206	I	48.4	Very low	44.4	Very low	79 Å²	79	138.8 Å²	138.8	41%	0.405	62%	0.622	S	S	.	*	H	α-helix	trans	-62.8	-38	167.3	-65.7	171.7	0	0	0	111.2	I202 R208 F209 R210	I202-I206 HydrophobicContact CG2-CD1 3.8Å; I202-I206 HydrophobicContact CG2-CG1 4.34Å; I202-I206 WeakPolarHBondContact O-CG1 3.23Å; I202-I206 PolarHBondContact O-N 3.04Å; I206-R208 VanDerWaalsContact C-N 3.3Å; I206-R208 PolarHBondContact O-N 3.39Å; I206-F209 PolarHBondContact O-N 2.94Å; I206-R210 WeakPolarHBondContact O-CB 3.36Å; I206-R210 PolarHBondContact O-N 2.71Å
207	S	47.3	Very low	43.8	Very low	62 Å²	62	134.8 Å²	134.8	43%	0.434	62%	0.616	S	S	.	*	H	α-helix	trans	-71	-21.8	176.4	72.1	0	0	0	0	114	D203 K204 Q205 R211	D203-S207 WeakPolarHBondContact O-CB 3.32Å; D203-S207 PolarHBondContact O-N 3Å; D203-S207 PolarHBondContact O-OG 3.38Å; D203-S207 VanDerWaalsContact O-OG 3.05Å; K204-S207 WeakPolarHBondContact CA-OG 3.17Å; Q205-S207 VanDerWaalsContact C-N 3.35Å; S207-R211 PolarHBondContact O-N 2.75Å
208	R	48.4	Very low	43.4	Very low	147 Å²	147	130.1 Å²	130.1	56%	0.555	60%	0.597	S	S	*	*	H	α-helix	trans	-71	-42.3	167.2	-87.8	179	-76.3	162.9	-1.7	111.2	K204 Q205 I206 R211	K204-R208 PolarHBondContact O-NE 2.85Å; K204-R208 PolarHBondContact O-NH2 3.24Å; Q205-R208 WeakPolarHBondContact O-CB 3.49Å; Q205-R208 PolarHBondContact O-N 2.85Å; I206-R208 VanDerWaalsContact C-N 3.3Å; I206-R208 PolarHBondContact O-N 3.39Å; R208-R211 WeakPolarHBondContact O-CB 3.38Å; R208-R211 PolarHBondContact O-N 2.94Å; R208-R211 VanDerWaalsContact O-N 3.16Å
209	F	45.1	Very low	43.2	Very low	190 Å²	190	134.7 Å²	134.7	83%	0.833	61%	0.611	S	S	*	*	H	α-helix	trans	-67	-37.9	175	-144.8	-92.1	0	0	0	112	Q205 I206 R211	Q205-F209 PolarHBondContact O-N 2.87Å; I206-F209 PolarHBondContact O-N 2.94Å; F209-R211 PolarHBondContact O-N 3.18Å
210	R	43.4	Very low	43.2	Very low	145 Å²	145	132.3 Å²	132.3	55%	0.547	60%	0.601	S	S	.	*	G	3₁₀ helix	trans	-71	-0	171.3	-82.8	-177.6	170.8	145.5	-1.1	114.8	I206 W212 L213	I206-R210 WeakPolarHBondContact O-CB 3.36Å; I206-R210 PolarHBondContact O-N 2.71Å; R210-W212 PolarHBondContact O-N 3.26Å; R210-L213 HydrophobicContact CG-CD1 4.44Å; R210-L213 WeakPolarHBondContact O-CB 3.33Å; R210-L213 PolarHBondContact O-N 3.5Å
211	R	38.8	Very low	42.7	Very low	204 Å²	204	134.7 Å²	134.7	77%	0.77	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-66.6	-17	-179.8	-171.9	177.2	-75.8	-172.9	-7	113.3	S207 R208 F209 L213	S207-R211 PolarHBondContact O-N 2.75Å; R208-R211 WeakPolarHBondContact O-CB 3.38Å; R208-R211 PolarHBondContact O-N 2.94Å; R208-R211 VanDerWaalsContact O-N 3.16Å; F209-R211 PolarHBondContact O-N 3.18Å; R211-L213 VanDerWaalsContact C-N 3.35Å; R211-L213 CarbonylContact C-O 3.52Å
212	W	41.8	Very low	42.4	Very low	255 Å²	255	133.6 Å²	133.6	97%	0.966	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-82.9	-11.2	172.4	-157.1	67.1	0	0	0	113.5	R210	R210-W212 PolarHBondContact O-N 3.26Å
213	L	39.8	Very low	41.8	Very low	113 Å²	113	138.8 Å²	138.8	59%	0.592	63%	0.632	S	S	*	*	S	Bend	trans	-93.4	150.1	160.7	-76.2	150.3	0	0	0	108.2	R210 R211 K215	R210-L213 HydrophobicContact CG-CD1 4.44Å; R210-L213 WeakPolarHBondContact O-CB 3.33Å; R210-L213 PolarHBondContact O-N 3.5Å; R211-L213 VanDerWaalsContact C-N 3.35Å; R211-L213 CarbonylContact C-O 3.52Å; L213-K215 PolarHBondContact O-N 2.78Å
214	P	34.3	Very low	41.7	Very low	105 Å²	105	138.7 Å²	138.7	68%	0.682	64%	0.635	S	S	*	*			trans	-57	137.6	-179.8	21.5	-32.4	0	0	0	111.5	K216	P214-K216 PolarHBondContact O-N 3.26Å
215	K	38.8	Very low	41.5	Very low	202 Å²	202	133.6 Å²	133.6	88%	0.878	61%	0.614	S	S	*	*			trans	-45.6	118.1	165.1	-72.7	178	180	174.5	0	106.8	L213 P217	L213-K215 PolarHBondContact O-N 2.78Å; K215-P217 WeakPolarHBondContact O-CD 3.43Å
216	K	33.4	Very low	41.1	Very low	154 Å²	154	132.4 Å²	132.4	67%	0.67	62%	0.617	S	S	*	*			trans	-45.6	103	-175.9	-72.5	-170.8	173.6	-166.9	0	110.4	P214 M218	P214-K216 PolarHBondContact O-N 3.26Å; K216-M218 PolarHBondContact O-N 3.37Å
217	P	34.2	Very low	40.8	Very low	83 Å²	83	135.1 Å²	135.1	54%	0.539	63%	0.633	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.4	37.5	-169	35.7	-38	0	0	0	111.3	K215	K215-P217 WeakPolarHBondContact O-CD 3.43Å
218	M	37	Very low	40.6	Very low	64 Å²	64	133.8 Å²	133.8	32%	0.315	62%	0.62	S	S	.	*	T	Hydrogen-bonded Turn	trans	-161.7	-9.8	-136.5	-121.7	-172.4	-95.5	0	0	113.7	K216 Y331 Y333	K216-M218 PolarHBondContact O-N 3.37Å; M218-Y331 WeakPolarHBondContact CE-O 3.3Å; M218-Y333 HydrophobicContact CB-CD2 3.6Å; M218-Y333 HydrophobicContact CB-CE2 3.9Å; M218-Y333 HydrophobicContact CG-CD2 3.46Å; M218-Y333 VanDerWaalsContact CG-CD2 3.46Å; M218-Y333 HydrophobicContact CG-CE2 3.9Å; M218-Y333 HydrophobicContact CG-CG 4.38Å; M218-Y333 VanDerWaalsContact O-CD2 3.28Å; M218-Y333 WeakPolarHBondContact O-CD2 3.21Å; M218-Y333 HydrophobicContact SD-CD2 3.47Å; M218-Y333 WeakPolarHBondContact SD-CD2 3.34Å; M218-Y333 HydrophobicContact SD-CE2 3.36Å; M218-Y333 WeakPolarHBondContact SD-CE2 3.22Å; M218-Y333 HydrophobicContact SD-CG 4.34Å
219	R	36.8	Very low	40.1	Very low	225 Å²	225	133.8 Å²	133.8	85%	0.849	63%	0.627	S	S	*	*	S	Bend	trans	-81.5	128.7	158	-119.9	-176.3	178.9	173.5	-2	106.7	D221	R219-D221 PolarHBondContact O-N 3.17Å
220	L	41.2	Very low	40	Very low	91 Å²	91	130.4 Å²	130.4	48%	0.476	61%	0.613	S	S	.	*			trans	-60	128.9	167.8	-171.1	70.6	0	0	0	107.6	K222 L225 P335	L220-K222 PolarHBondContact O-N 3.27Å; L220-L225 HydrophobicContact CD2-CD1 4.03Å; L220-P335 HydrophobicContact CD2-CB 4.43Å
221	D	39.1	Very low	40.1	Very low	101 Å²	101	128.4 Å²	128.4	54%	0.54	61%	0.614	S	S	.	*			trans	-79.7	110.8	-171	-147.7	-20.7	0	0	0	110	R219 E223 T224	R219-D221 PolarHBondContact O-N 3.17Å; D221-E223 PolarHBondContact O-N 3.45Å; D221-E223 VanDerWaalsContact O-N 3.12Å; D221-T224 HydrophobicContact CB-CG2 4.34Å; D221-T224 PolarHBondContact O-N 3.44Å; D221-T224 PolarHBondContact O-OG1 3.47Å
222	K	42.5	Very low	40.6	Very low	148 Å²	148	125.2 Å²	125.2	64%	0.643	61%	0.612	S	S	*	*	G	3₁₀ helix	trans	-61.3	-26.6	-170.4	-78.6	-154	168	-148.1	0	112.5	L220 T224 L225	L220-K222 PolarHBondContact O-N 3.27Å; K222-T224 PolarHBondContact O-N 3.15Å; K222-T224 VanDerWaalsContact O-N 3.17Å; K222-L225 PolarHBondContact O-N 3.36Å
223	E	40	Very low	41.2	Very low	184 Å²	184	115.4 Å²	115.4	86%	0.86	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-65.6	-14.7	178.3	-61.4	179.3	-167.3	0	0	113	D221	D221-E223 PolarHBondContact O-N 3.45Å; D221-E223 VanDerWaalsContact O-N 3.12Å
224	T	42.8	Very low	42.4	Very low	97 Å²	97	112.1 Å²	112.1	60%	0.595	56%	0.562	S	S	*	*	G	3₁₀ helix	trans	-88.2	-8.2	177.5	62.4	0	0	0	0	115.4	D221 K222	D221-T224 HydrophobicContact CB-CG2 4.34Å; D221-T224 PolarHBondContact O-N 3.44Å; D221-T224 PolarHBondContact O-OG1 3.47Å; K222-T224 PolarHBondContact O-N 3.15Å; K222-T224 VanDerWaalsContact O-N 3.17Å
225	L	46.8	Very low	44.1	Very low	35 Å²	35	108.1 Å²	108.1	18%	0.183	54%	0.535	C	S	.	.			trans	-140.7	80.4	-175.8	-77.9	162.4	0	0	0	111.1	L220 K222 D227 L228 L319	L220-L225 HydrophobicContact CD2-CD1 4.03Å; K222-L225 PolarHBondContact O-N 3.36Å; L225-D227 VanDerWaalsContact C-N 3.27Å; L225-D227 PolarHBondContact O-N 3.26Å; L225-L228 HydrophobicContact CB-CB 4.27Å; L225-L228 HydrophobicContact CB-CD1 4.13Å; L225-L228 HydrophobicContact CD1-CD1 3.96Å; L225-L228 HydrophobicContact CG-CD1 4.48Å; L225-L228 WeakPolarHBondContact O-CB 3.33Å; L225-L228 PolarHBondContact O-N 3Å; L225-L319 HydrophobicContact CD1-CD2 4.27Å; L225-L319 HydrophobicContact CD2-CD2 3.83Å
226	P	42.5	Very low	45.7	Very low	97 Å²	97	99.5 Å²	99.5	63%	0.63	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-62	-30	-178.2	23.6	-33.5	0	0	0	113.8	L228 E229	P226-L228 PolarHBondContact O-N 3.34Å; P226-E229 PolarHBondContact O-N 3.48Å
227	D	44	Very low	47.8	Very low	136 Å²	136	95 Å²	95	73%	0.727	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-68.7	5.3	173.9	-66.7	-32.1	0	0	0	114.4	L225 R341	L225-D227 VanDerWaalsContact C-N 3.27Å; L225-D227 PolarHBondContact O-N 3.26Å; D227-R341 PolarHBondContact O-NH1 3.37Å
228	L	41.2	Very low	49.9	Very low	33 Å²	33	91.2 Å²	91.2	17%	0.173	46%	0.463	C	S	.	.	G	3₁₀ helix	trans	-121.1	19.1	173.1	-85.1	157.3	0	0	0	112.5	L225 P226 E230	L225-L228 HydrophobicContact CB-CB 4.27Å; L225-L228 HydrophobicContact CB-CD1 4.13Å; L225-L228 HydrophobicContact CD1-CD1 3.96Å; L225-L228 HydrophobicContact CG-CD1 4.48Å; L225-L228 WeakPolarHBondContact O-CB 3.33Å; L225-L228 PolarHBondContact O-N 3Å; P226-L228 PolarHBondContact O-N 3.34Å; L228-E230 PolarHBondContact O-N 3.26Å
229	E	38.1	Very low	51.8	Low	148 Å²	148	88.9 Å²	88.9	69%	0.692	45%	0.453	S	S	*	.			trans	-70	65.4	157.3	-78.6	-142.7	132.7	0	0	111.7	P226 N231	P226-E229 PolarHBondContact O-N 3.48Å; E229-N231 PolarHBondContact O-N 2.77Å; E229-N231 PolarHBondContact O-ND2 2.87Å
230	E	44.8	Very low	53.6	Low	119 Å²	119	82.6 Å²	82.6	56%	0.556	43%	0.433	S	S	*	.			trans	-61.6	84.2	150.3	-71.5	177.9	171	0	0	108.1	L228	L228-E230 PolarHBondContact O-N 3.26Å
231	N	44.3	Very low	55	Low	103 Å²	103	86.1 Å²	86.1	55%	0.551	45%	0.448	S	S	*	.			trans	-55	147.4	156.2	-79.5	-96.1	0	0	0	108.3	E229 C233	E229-N231 PolarHBondContact O-N 2.77Å; E229-N231 PolarHBondContact O-ND2 2.87Å; N231-C233 PolarHBondContact O-N 3.43Å
232	D	49.8	Very low	56.6	Low	137 Å²	137	88.1 Å²	88.1	73%	0.733	45%	0.447	S	S	*	.	S	Bend	trans	-64.5	77.1	-179.3	-61.9	-46.3	0	0	0	111.7
233	C	55.1	Low	58.1	Low	49 Å²	49	83.6 Å²	83.6	33%	0.331	43%	0.43	S	S	.	.			trans	-108.8	115.8	-174.4	-72.3	0	0	0	0	109.6	P184 N231 I247	P184-C233 HydrophobicContact CB-CB 4.34Å; N231-C233 PolarHBondContact O-N 3.43Å; C233-I247 HydrophobicContact CB-CD1 4.47Å
234	Y	64.3	Low	59.5	Low	44 Å²	44	80.3 Å²	80.3	17%	0.173	41%	0.414	C	S	.	.			trans	-57.4	138.8	172.4	-62.5	-70.1	0	0	0	110.7	F185 E920 L923	F185-Y234 VanDerWaalsContact CB-O 3.29Å; F185-Y234 WeakPolarHBondContact CB-O 3.28Å; F185-Y234 PolarHBondContact N-O 3.45Å; Y234-E920 HydrophobicContact CD1-CB 4.11Å; Y234-E920 HydrophobicContact CD1-CG 3.72Å; Y234-E920 HydrophobicContact CE1-CB 3.84Å; Y234-E920 HydrophobicContact CE1-CG 4Å; Y234-L923 HydrophobicContact CD2-CD1 4.34Å; Y234-L923 HydrophobicContact CE2-CD1 3.5Å; Y234-L923 VanDerWaalsContact CE2-CD1 3.5Å
235	T	70.4	Confident	60.7	Low	20 Å²	20	78.7 Å²	78.7	12%	0.123	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	151	176	71.2	0	0	0	0	110.6	M183 D457	M183-T235 VanDerWaalsContact O-CA 3.32Å; M183-T235 WeakPolarHBondContact O-CA 3.38Å; T235-D457 WeakPolarHBondContact CB-OD1 3.23Å; T235-D457 WeakPolarHBondContact CG2-OD1 3.38Å; T235-D457 PolarHBondContact OG1-OD1 2.81Å
236	A	71.9	Confident	62.2	Low	21 Å²	21	77.2 Å²	77.2	17%	0.174	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	149.3	176.1	0	0	0	0	0	109.6	R182 M183 F185 F238 F246	R182-A236 CarbonylContact C-O 3.57Å; R182-A236 VanDerWaalsContact CA-O 3.31Å; R182-A236 WeakPolarHBondContact CA-O 3.39Å; M183-A236 PolarHBondContact N-O 3.28Å; M183-A236 PolarHBondContact O-N 2.95Å; F185-A236 HydrophobicContact CB-CB 4.29Å; F185-A236 HydrophobicContact CD2-CB 3.69Å; F185-A236 HydrophobicContact CE2-CB 4.34Å; F185-A236 HydrophobicContact CG-CB 4.26Å; A236-F238 PolarHBondContact O-N 3.35Å; A236-F246 HydrophobicContact CB-CE1 4.16Å; A236-F246 HydrophobicContact CB-CZ 4.3Å; A236-F246 WeakPolarHBondContact O-CE1 3.49Å
237	P	76.4	Confident	63.5	Low	60 Å²	60	74.8 Å²	74.8	39%	0.39	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	125.9	175.2	24.4	-33.8	0	0	0	110	N180 S239 F246	N180-P237 HydrophobicContact CB-CB 4.43Å; P237-S239 PolarHBondContact O-N 3.02Å; P237-F246 WeakPolarHBondContact O-CZ 3.48Å
238	F	79.4	Confident	64.9	Low	3 Å²	3	70.3 Å²	70.3	1%	0.013	35%	0.349	C	S	.	.			trans	-60.8	131.2	-177.9	-180	-93.7	0	0	0	110.8	W169 A176 E177 V181 M183 A236 I243 F246 F254 F255	W169-F238 HydrophobicContact CZ2-CZ 4.31Å; A176-F238 HydrophobicContact CB-CD1 3.99Å; E177-F238 WeakPolarHBondContact CA-O 3.2Å; E177-F238 WeakPolarHBondContact CB-O 3.38Å; V181-F238 WeakPolarHBondContact O-CB 3.49Å; V181-F238 PolarHBondContact O-N 3.32Å; M183-F238 HydrophobicContact CG-CB 4.19Å; M183-F238 HydrophobicContact CG-CD2 4.39Å; A236-F238 PolarHBondContact O-N 3.35Å; F238-I243 HydrophobicContact CE2-CG1 4.16Å; F238-I243 HydrophobicContact CZ-CD1 4.14Å; F238-I243 HydrophobicContact CZ-CG1 3.88Å; F238-F246 HydrophobicContact CD2-CD2 4.28Å; F238-F246 HydrophobicContact CD2-CE2 4.41Å; F238-F246 HydrophobicContact CD2-CG 4.35Å; F238-F254 AromaticContact CD2-CE1 3.78Å; F238-F254 HydrophobicContact CD2-CE1 3.78Å; F238-F254 AromaticContact CD2-CZ 3.88Å; F238-F254 HydrophobicContact CD2-CZ 3.88Å; F238-F254 AromaticContact CE2-CE1 3.69Å; F238-F254 HydrophobicContact CE2-CE1 3.69Å; F238-F254 AromaticContact CE2-CZ 3.97Å; F238-F254 HydrophobicContact CE2-CZ 3.97Å; F238-F255 HydrophobicContact CE1-CZ 4.43Å; F238-F255 HydrophobicContact CZ-CZ 4.49Å
239	S	77.2	Confident	66.3	Low	15 Å²	15	77.1 Å²	77.1	11%	0.105	38%	0.379	C	S	.	.			trans	-133.9	128.5	174.8	171	0	0	0	0	110.4	E177 P237 Q241 R242 I243	E177-S239 VanDerWaalsContact CD-CA 3.46Å; E177-S239 VanDerWaalsContact OE1-CA 3.29Å; E177-S239 WeakPolarHBondContact OE1-CA 3.05Å; E177-S239 WeakPolarHBondContact OE1-CB 3.33Å; E177-S239 PolarHBondContact OE1-OG 3.25Å; P237-S239 PolarHBondContact O-N 3.02Å; S239-Q241 PolarHBondContact O-N 2.98Å; S239-Q241 PolarHBondContact OG-N 3Å; S239-R242 CarbonylContact O-C 3.45Å; S239-R242 PolarHBondContact O-N 3.49Å; S239-I243 PolarHBondContact O-N 3.01Å
240	Q	74.6	Confident	68.1	Low	93 Å²	93	73.7 Å²	73.7	44%	0.435	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-61.9	-30.5	-179.7	-169.6	168.7	-1.9	0	0	111.4	E177 R242 I243	E177-Q240 VanDerWaalsContact OE2-CB 3.29Å; E177-Q240 WeakPolarHBondContact OE2-CB 3.42Å; E177-Q240 PolarHBondContact OE2-N 3.47Å; Q240-R242 VanDerWaalsContact C-N 3.31Å; Q240-R242 PolarHBondContact O-N 3.01Å; Q240-I243 HydrophobicContact CB-CD1 4.46Å; Q240-I243 HydrophobicContact CG-CD1 3.93Å; Q240-I243 WeakPolarHBondContact O-CD1 3.43Å; Q240-I243 WeakPolarHBondContact O-CG1 3.22Å
241	Q	70.4	Confident	69.7	Low	166 Å²	166	73.7 Å²	73.7	78%	0.776	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-70.2	-25.9	174.9	-57.2	-175.2	7.8	0	0	113.1	S239	S239-Q241 PolarHBondContact O-N 2.98Å; S239-Q241 PolarHBondContact OG-N 3Å
242	R	72.3	Confident	71.1	Confident	142 Å²	142	74.1 Å²	74.1	54%	0.536	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-107.8	13.5	-174	-57.9	-174.5	-175.2	-171.5	2.5	113.7	S239 Q240 H244 H245 F246	S239-R242 CarbonylContact O-C 3.45Å; S239-R242 PolarHBondContact O-N 3.49Å; Q240-R242 VanDerWaalsContact C-N 3.31Å; Q240-R242 PolarHBondContact O-N 3.01Å; R242-H244 PolarHBondContact O-N 3.38Å; R242-H245 WeakPolarHBondContact O-CB 3.34Å; R242-H245 PolarHBondContact O-N 3.23Å; R242-F246 HydrophobicContact CB-CE2 4.21Å; R242-F246 WeakPolarHBondContact O-CD2 3.31Å
243	I	74.4	Confident	72.4	Confident	54 Å²	54	72 Å²	72	28%	0.277	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-44.3	-38.5	-176.9	-84.4	172.5	0	0	0	114.5	F238 S239 Q240 H245 F246 I248	F238-I243 HydrophobicContact CE2-CG1 4.16Å; F238-I243 HydrophobicContact CZ-CD1 4.14Å; F238-I243 HydrophobicContact CZ-CG1 3.88Å; S239-I243 PolarHBondContact O-N 3.01Å; Q240-I243 HydrophobicContact CB-CD1 4.46Å; Q240-I243 HydrophobicContact CG-CD1 3.93Å; Q240-I243 WeakPolarHBondContact O-CD1 3.43Å; Q240-I243 WeakPolarHBondContact O-CG1 3.22Å; I243-H245 PolarHBondContact O-N 2.92Å; I243-F246 PolarHBondContact O-N 3.01Å; I243-I248 HydrophobicContact CG2-CD1 3.99Å
244	H	68.8	Low	73.7	Confident	115 Å²	115	70.8 Å²	70.8	53%	0.532	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-62.5	-23	-178.8	55.7	-88.2	0	0	0	114.3	R186 R242	R186-H244 PolarHBondContact NH1-O 2.73Å; R242-H244 PolarHBondContact O-N 3.38Å
245	H	69.4	Low	74.7	Confident	62 Å²	62	68.7 Å²	68.7	29%	0.287	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-84.8	-9.3	174.4	-64.1	130.1	0	0	0	114.1	F185 R186 R242 I243	F185-H245 HydrophobicContact CD2-CB 4.03Å; F185-H245 HydrophobicContact CE1-CB 4.16Å; F185-H245 HydrophobicContact CE2-CB 3.39Å; F185-H245 HydrophobicContact CZ-CB 3.48Å; F185-H245 VanDerWaalsContact CZ-CB 3.48Å; F185-H245 AromaticContact CZ-CG 3.75Å; R186-H245 VanDerWaalsContact CB-O 3.25Å; R186-H245 WeakPolarHBondContact CB-O 3.49Å; R186-H245 WeakPolarHBondContact CG-O 3.46Å; R186-H245 PolarHBondContact N-O 3.29Å; R242-H245 WeakPolarHBondContact O-CB 3.34Å; R242-H245 PolarHBondContact O-N 3.23Å; I243-H245 PolarHBondContact O-N 2.92Å
246	F	76.7	Confident	75.4	Confident	4 Å²	4	70.2 Å²	70.2	2%	0.018	35%	0.347	C	S	.	.	B	Isolated β-bridge	trans	-91.3	150.4	178.4	-68.2	-82.4	0	0	0	111.9	M183 F185 A236 P237 F238 R242 I243 I248 F254	M183-F246 HydrophobicContact CB-CD1 3.82Å; M183-F246 HydrophobicContact CB-CE1 4Å; F185-F246 HydrophobicContact CD2-CD1 4.47Å; F185-F246 HydrophobicContact CD2-CE1 4.08Å; F185-F246 HydrophobicContact CD2-CZ 4.18Å; A236-F246 HydrophobicContact CB-CE1 4.16Å; A236-F246 HydrophobicContact CB-CZ 4.3Å; A236-F246 WeakPolarHBondContact O-CE1 3.49Å; P237-F246 WeakPolarHBondContact O-CZ 3.48Å; F238-F246 HydrophobicContact CD2-CD2 4.28Å; F238-F246 HydrophobicContact CD2-CE2 4.41Å; F238-F246 HydrophobicContact CD2-CG 4.35Å; R242-F246 HydrophobicContact CB-CE2 4.21Å; R242-F246 WeakPolarHBondContact O-CD2 3.31Å; I243-F246 PolarHBondContact O-N 3.01Å; F246-I248 HydrophobicContact CB-CG1 4.24Å; F246-I248 PolarHBondContact O-N 3.11Å; F246-I248 VanDerWaalsContact O-N 3.08Å; F246-F254 HydrophobicContact CB-CE2 4.41Å; F246-F254 HydrophobicContact CB-CZ 4.31Å
247	I	70.6	Confident	76.2	Confident	46 Å²	46	70.4 Å²	70.4	24%	0.236	35%	0.345	C	S	.	.			trans	-82.1	85.3	177.8	-54.8	175	0	0	0	109.1	P184 R186 C233 H249	P184-I247 HydrophobicContact CB-CB 4.48Å; P184-I247 HydrophobicContact CB-CD1 4.2Å; P184-I247 PolarHBondContact O-N 2.62Å; R186-I247 HydrophobicContact CG-CG1 3.57Å; C233-I247 HydrophobicContact CB-CD1 4.47Å; I247-H249 VanDerWaalsContact CG2-NE2 3.32Å; I247-H249 WeakPolarHBondContact CG2-NE2 3.47Å
248	I	74.1	Confident	76.7	Confident	42 Å²	42	68 Å²	68	22%	0.215	33%	0.33	C	S	.	.			trans	-102.8	105	176.2	-50.6	-179.7	0	0	0	109.4	W169 I243 F246 K251 F254	W169-I248 HydrophobicContact CH2-CD1 4.19Å; W169-I248 HydrophobicContact CZ2-CD1 4.26Å; I243-I248 HydrophobicContact CG2-CD1 3.99Å; F246-I248 HydrophobicContact CB-CG1 4.24Å; F246-I248 PolarHBondContact O-N 3.11Å; F246-I248 VanDerWaalsContact O-N 3.08Å; I248-K251 HydrophobicContact CG2-CG 4.36Å; I248-F254 HydrophobicContact CB-CD2 4.45Å; I248-F254 HydrophobicContact CG1-CD2 3.89Å; I248-F254 HydrophobicContact CG1-CE2 3.79Å; I248-F254 HydrophobicContact CG1-CG 4.44Å; I248-F254 HydrophobicContact CG1-CZ 4.26Å
249	H	70.1	Confident	77.1	Confident	177 Å²	177	69.2 Å²	69.2	82%	0.819	34%	0.338	S	S	*	.	S	Bend	trans	-86.6	-44.4	170.3	-68.8	-85.7	0	0	0	111.8	I247	I247-H249 VanDerWaalsContact CG2-NE2 3.32Å; I247-H249 WeakPolarHBondContact CG2-NE2 3.47Å
250	N	76.3	Confident	77.8	Confident	76 Å²	76	69 Å²	69	41%	0.406	33%	0.334	S	S	.	.			trans	-142	138.5	173.4	-179.8	-3.2	0	0	0	108.5	D252 F254	N250-D252 PolarHBondContact OD1-N 2.96Å; N250-D252 VanDerWaalsContact OD1-N 3.07Å; N250-F254 WeakPolarHBondContact O-CB 3.23Å; N250-F254 PolarHBondContact O-N 3.48Å
251	K	77.6	Confident	78.7	Confident	119 Å²	119	65 Å²	65	52%	0.517	32%	0.316	S	S	.	.	H	α-helix	trans	-66.8	-34.9	179.3	-68.5	-178	-178.4	178	0	112.5	W169 I248 T253	W169-K251 HydrophobicContact CD2-CB 4.2Å; W169-K251 HydrophobicContact CD2-CD 4.2Å; W169-K251 HydrophobicContact CD2-CG 4.29Å; W169-K251 HydrophobicContact CE3-CB 3.71Å; W169-K251 HydrophobicContact CE3-CG 4.18Å; W169-K251 HydrophobicContact CG-CD 4.43Å; W169-K251 HydrophobicContact CH2-CG 4.41Å; W169-K251 HydrophobicContact CZ3-CB 3.89Å; W169-K251 HydrophobicContact CZ3-CG 4.24Å; W169-K251 VanDerWaalsContact CZ3-O 3.27Å; W169-K251 WeakPolarHBondContact CZ3-O 3.24Å; I248-K251 HydrophobicContact CG2-CG 4.36Å; K251-T253 PolarHBondContact O-N 2.78Å
252	D	73.4	Confident	79.6	Confident	112 Å²	112	58.9 Å²	58.9	60%	0.599	29%	0.286	S	S	*	.	H	α-helix	trans	-75.4	-27	-172.7	-61.8	-35.4	0	0	0	113	N250	N250-D252 PolarHBondContact OD1-N 2.96Å; N250-D252 VanDerWaalsContact OD1-N 3.07Å
253	T	77.3	Confident	80.5	Confident	93 Å²	93	52.1 Å²	52.1	57%	0.571	26%	0.261	S	S	*	.	H	α-helix	trans	-100.9	-13.2	178.9	58.9	0	0	0	0	114.1	K251 F255	K251-T253 PolarHBondContact O-N 2.78Å; T253-F255 PolarHBondContact O-N 3.2Å
254	F	82.9	Confident	81.4	Confident	23 Å²	23	49.5 Å²	49.5	10%	0.101	25%	0.248	C	C	.	.	H	α-helix	trans	-60.5	-42.1	179.9	177.4	-99.6	0	0	0	112.9	W169 M183 F238 F246 I248 N250	W169-F254 HydrophobicContact CH2-CB 4.46Å; W169-F254 AromaticContact CH2-CD1 3.62Å; W169-F254 HydrophobicContact CH2-CD1 3.62Å; W169-F254 HydrophobicContact CH2-CE1 4.15Å; W169-F254 HydrophobicContact CH2-CG 4.23Å; W169-F254 HydrophobicContact CZ3-CB 4.21Å; W169-F254 AromaticContact CZ3-CD1 3.88Å; W169-F254 HydrophobicContact CZ3-CD1 3.88Å; W169-F254 HydrophobicContact CZ3-CG 4.4Å; M183-F254 HydrophobicContact CB-CE1 4.49Å; M183-F254 HydrophobicContact CB-CE2 4.38Å; M183-F254 HydrophobicContact CB-CZ 3.74Å; M183-F254 HydrophobicContact CE-CD1 4.19Å; M183-F254 HydrophobicContact CE-CE1 3.91Å; M183-F254 HydrophobicContact CE-CZ 4.41Å; M183-F254 HydrophobicContact CG-CE1 3.89Å; M183-F254 HydrophobicContact CG-CE2 4.48Å; M183-F254 HydrophobicContact CG-CZ 3.63Å; M183-F254 HydrophobicContact SD-CE1 4.12Å; M183-F254 HydrophobicContact SD-CE2 4.45Å; M183-F254 HydrophobicContact SD-CZ 4.01Å; F238-F254 AromaticContact CD2-CE1 3.78Å; F238-F254 HydrophobicContact CD2-CE1 3.78Å; F238-F254 AromaticContact CD2-CZ 3.88Å; F238-F254 HydrophobicContact CD2-CZ 3.88Å; F238-F254 AromaticContact CE2-CE1 3.69Å; F238-F254 HydrophobicContact CE2-CE1 3.69Å; F238-F254 AromaticContact CE2-CZ 3.97Å; F238-F254 HydrophobicContact CE2-CZ 3.97Å; F246-F254 HydrophobicContact CB-CE2 4.41Å; F246-F254 HydrophobicContact CB-CZ 4.31Å; I248-F254 HydrophobicContact CB-CD2 4.45Å; I248-F254 HydrophobicContact CG1-CD2 3.89Å; I248-F254 HydrophobicContact CG1-CE2 3.79Å; I248-F254 HydrophobicContact CG1-CG 4.44Å; I248-F254 HydrophobicContact CG1-CZ 4.26Å; N250-F254 WeakPolarHBondContact O-CB 3.23Å; N250-F254 PolarHBondContact O-N 3.48Å
255	F	85.4	Confident	82.4	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.227	C	C	.	.	S	Bend	trans	-88.4	107.6	170.8	-70.3	-71.5	0	0	0	110.1	W169 L172 A176 M183 F238 T253 T259 R260	W169-F255 AromaticContact CE3-CD2 4Å; W169-F255 HydrophobicContact CE3-CD2 4Å; W169-F255 AromaticContact CE3-CE2 3.86Å; W169-F255 HydrophobicContact CE3-CE2 3.86Å; W169-F255 HydrophobicContact CH2-CD2 4.31Å; W169-F255 AromaticContact CH2-CE2 3.77Å; W169-F255 HydrophobicContact CH2-CE2 3.77Å; W169-F255 HydrophobicContact CZ2-CE2 4.45Å; W169-F255 AromaticContact CZ3-CD2 3.58Å; W169-F255 HydrophobicContact CZ3-CD2 3.58Å; W169-F255 AromaticContact CZ3-CE2 3.43Å; W169-F255 HydrophobicContact CZ3-CE2 3.43Å; W169-F255 VanDerWaalsContact CZ3-CE2 3.43Å; L172-F255 HydrophobicContact CB-CD2 4.08Å; L172-F255 HydrophobicContact CB-CE2 3.93Å; L172-F255 HydrophobicContact CB-CZ 4.44Å; L172-F255 HydrophobicContact CD1-CD2 4.21Å; A176-F255 HydrophobicContact CB-CE1 3.57Å; A176-F255 HydrophobicContact CB-CZ 3.77Å; M183-F255 HydrophobicContact CE-CD1 3.29Å; M183-F255 HydrophobicContact CE-CE1 3.51Å; M183-F255 HydrophobicContact CE-CG 4.21Å; F238-F255 HydrophobicContact CE1-CZ 4.43Å; F238-F255 HydrophobicContact CZ-CZ 4.49Å; T253-F255 PolarHBondContact O-N 3.2Å; F255-T259 HydrophobicContact CD1-CG2 4.46Å; F255-R260 HydrophobicContact CB-CG 3.64Å; F255-R260 WeakPolarHBondContact O-CD 3.08Å; F255-R260 WeakPolarHBondContact O-CG 3.3Å
256	N	85.3	Confident	83.2	Confident	52 Å²	52	43.2 Å²	43.2	28%	0.278	22%	0.218	S	C	.	.			trans	-52.8	146.8	173.1	-83.4	-45.7	0	0	0	111.5	A258 T259 R260 R341	N256-A258 VanDerWaalsContact C-N 3.29Å; N256-A258 PolarHBondContact O-N 3.05Å; N256-T259 WeakPolarHBondContact O-CA 3.29Å; N256-T259 VanDerWaalsContact O-CB 3.24Å; N256-T259 WeakPolarHBondContact O-CB 3.42Å; N256-T259 PolarHBondContact O-N 3.5Å; N256-R260 PolarHBondContact O-N 3.05Å; N256-R341 PolarHBondContact OD1-NE 2.91Å; N256-R341 PolarHBondContact OD1-NH2 3.01Å
257	N	87.3	Confident	83.9	Confident	25 Å²	25	43.1 Å²	43.1	13%	0.134	22%	0.218	C	C	.	.	H	α-helix	trans	-58.3	-40.9	-171.9	-50.5	-26.3	0	0	0	112.3	R118 T259 R260 S261 E299	R118-N257 PolarHBondContact NH1-OD1 2.72Å; R118-N257 PolarHBondContact NH2-ND2 3.44Å; R118-N257 PolarHBondContact NH2-OD1 3.48Å; N257-T259 VanDerWaalsContact C-N 3.35Å; N257-T259 PolarHBondContact O-N 3.11Å; N257-R260 PolarHBondContact O-N 3.43Å; N257-S261 PolarHBondContact O-N 2.93Å; N257-S261 PolarHBondContact O-OG 3.08Å; N257-E299 WeakPolarHBondContact CB-OE1 3.26Å; N257-E299 PolarHBondContact ND2-OE1 3.14Å; N257-E299 PolarHBondContact ND2-OE2 2.83Å; N257-E299 VanDerWaalsContact ND2-OE2 3.15Å
258	A	87.8	Confident	84.8	Confident	9 Å²	9	41 Å²	41	7%	0.074	21%	0.207	C	C	.	.	H	α-helix	trans	-56.1	-45.3	171.1	0	0	0	0	0	112.6	N256 R262 A761	N256-A258 VanDerWaalsContact C-N 3.29Å; N256-A258 PolarHBondContact O-N 3.05Å; A258-R262 WeakPolarHBondContact O-CB 3.39Å; A258-R262 PolarHBondContact O-N 2.77Å; A258-A761 HydrophobicContact CB-CB 3.66Å
259	T	88.2	Confident	85.3	Confident	28 Å²	28	41.2 Å²	41.2	17%	0.172	21%	0.207	C	C	.	.	H	α-helix	trans	-65.9	-42.1	178	-41.2	0	0	0	0	111.9	V181 F255 N256 N257 R262 I263	V181-T259 HydrophobicContact CG1-CG2 3.92Å; F255-T259 HydrophobicContact CD1-CG2 4.46Å; N256-T259 WeakPolarHBondContact O-CA 3.29Å; N256-T259 VanDerWaalsContact O-CB 3.24Å; N256-T259 WeakPolarHBondContact O-CB 3.42Å; N256-T259 PolarHBondContact O-N 3.5Å; N257-T259 VanDerWaalsContact C-N 3.35Å; N257-T259 PolarHBondContact O-N 3.11Å; T259-R262 PolarHBondContact O-N 2.81Å; T259-I263 HydrophobicContact CG2-CD1 4.28Å; T259-I263 WeakPolarHBondContact O-CG1 3.28Å; T259-I263 PolarHBondContact O-N 2.89Å
260	R	91.7	Very high	85.8	Confident	11 Å²	11	37.5 Å²	37.5	4%	0.042	19%	0.186	C	C	.	.	H	α-helix	trans	-60.2	-51.8	175.8	-65.4	177.6	60.1	95.4	19.4	111.1	D120 H166 A167 L172 F255 N256 N257 R262 I263 V264	D120-R260 IonicContact OD1-CZ 2.84Å; D120-R260 IonicContact OD1-NE 2.9Å; D120-R260 PolarHBondContact OD1-NE 3.4Å; D120-R260 IonicContact OD1-NH2 2.79Å; D120-R260 PolarHBondContact OD1-NH2 3.04Å; D120-R260 IonicContact OD2-CZ 3.32Å; D120-R260 IonicContact OD2-NE 3.16Å; D120-R260 IonicContact OD2-NH2 2.71Å; D120-R260 PolarHBondContact OD2-NH2 2.97Å; H166-R260 PolarHBondContact CE1-NH2 2.93Å; H166-R260 VanDerWaalsContact CE1-NH2 3.26Å; H166-R260 PolarHBondContact ND1-NH2 3.14Å; A167-R260 PolarHBondContact O-NH2 2.8Å; L172-R260 HydrophobicContact CD1-CG 4.25Å; L172-R260 VanDerWaalsContact CD1-CZ 3.48Å; L172-R260 VanDerWaalsContact CD1-NH1 3.28Å; L172-R260 HydrophobicContact CD2-CB 4.45Å; L172-R260 HydrophobicContact CD2-CG 4.36Å; F255-R260 HydrophobicContact CB-CG 3.64Å; F255-R260 WeakPolarHBondContact O-CD 3.08Å; F255-R260 WeakPolarHBondContact O-CG 3.3Å; N256-R260 PolarHBondContact O-N 3.05Å; N257-R260 PolarHBondContact O-N 3.43Å; R260-R262 VanDerWaalsContact C-N 3.3Å; R260-R262 PolarHBondContact O-N 3.12Å; R260-I263 PolarHBondContact O-N 3.3Å; R260-V264 PolarHBondContact O-N 3.5Å
261	S	92.6	Very high	86.3	Confident	8 Å²	8	34.1 Å²	34.1	6%	0.056	17%	0.168	C	C	.	.	H	α-helix	trans	-59.3	-38.4	176.6	-63	0	0	0	0	113	D120 N257 V264 H265 P296	D120-S261 PolarHBondContact O-OG 3.47Å; N257-S261 PolarHBondContact O-N 2.93Å; N257-S261 PolarHBondContact O-OG 3.08Å; S261-V264 PolarHBondContact O-N 3.37Å; S261-H265 WeakPolarHBondContact O-CB 3.45Å; S261-H265 PolarHBondContact O-N 3.21Å; S261-P296 WeakPolarHBondContact OG-CB 3.47Å
262	R	89.9	Confident	86.6	Confident	38 Å²	38	33.9 Å²	33.9	14%	0.143	17%	0.167	C	C	.	.	H	α-helix	trans	-64.2	-43.5	176.5	-169.5	-179	71.2	117.6	3.4	112.3	A258 T259 R260 H265 H266 A761	A258-R262 WeakPolarHBondContact O-CB 3.39Å; A258-R262 PolarHBondContact O-N 2.77Å; T259-R262 PolarHBondContact O-N 2.81Å; R260-R262 VanDerWaalsContact C-N 3.3Å; R260-R262 PolarHBondContact O-N 3.12Å; R262-H265 PolarHBondContact O-N 2.85Å; R262-H266 PolarHBondContact O-N 3.23Å; R262-A761 WeakPolarHBondContact CD-O 3.26Å; R262-A761 WeakPolarHBondContact CG-O 3.45Å
263	I	90.9	Very high	86.9	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-63.1	-45.6	175.7	-69.3	163.7	0	0	0	110.6	L172 Y175 A176 M179 T259 R260 H265 H266 I267	L172-I263 HydrophobicContact CD2-CB 4.14Å; L172-I263 HydrophobicContact CD2-CD1 3.9Å; L172-I263 HydrophobicContact CD2-CG2 3.99Å; Y175-I263 HydrophobicContact CG-CG2 4.41Å; A176-I263 HydrophobicContact CB-CD1 4.23Å; M179-I263 HydrophobicContact SD-CG1 3.96Å; T259-I263 HydrophobicContact CG2-CD1 4.28Å; T259-I263 WeakPolarHBondContact O-CG1 3.28Å; T259-I263 PolarHBondContact O-N 2.89Å; R260-I263 PolarHBondContact O-N 3.3Å; I263-H265 VanDerWaalsContact C-N 3.33Å; I263-H265 PolarHBondContact O-N 3.37Å; I263-H266 PolarHBondContact O-N 3.08Å; I263-I267 HydrophobicContact CG2-CD1 4.07Å; I263-I267 WeakPolarHBondContact O-CG1 3.29Å; I263-I267 PolarHBondContact O-N 2.97Å; I263-I267 VanDerWaalsContact O-N 3.11Å
264	V	93.1	Very high	87	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-62.3	-40.2	177.4	177.2	0	0	0	0	111.7	D120 Y121 L147 L165 A167 R260 S261 I267 L268	D120-V264 HydrophobicContact CB-CG2 3.99Å; Y121-V264 HydrophobicContact CG-CG1 4.06Å; L147-V264 HydrophobicContact CD1-CG1 4.36Å; L147-V264 HydrophobicContact CD2-CG2 4.31Å; L165-V264 HydrophobicContact CB-CG1 4.41Å; L165-V264 HydrophobicContact CD1-CG1 4.3Å; A167-V264 HydrophobicContact CB-CG2 3.7Å; R260-V264 PolarHBondContact O-N 3.5Å; S261-V264 PolarHBondContact O-N 3.37Å; V264-I267 PolarHBondContact O-N 3.12Å; V264-L268 HydrophobicContact CG1-CD1 3.88Å; V264-L268 HydrophobicContact CG1-CG 4.41Å; V264-L268 VanDerWaalsContact O-CG 3.28Å; V264-L268 WeakPolarHBondContact O-CG 3.43Å; V264-L268 PolarHBondContact O-N 3.04Å
265	H	90.6	Very high	86.3	Confident	23 Å²	23	35.2 Å²	35.2	11%	0.106	16%	0.163	C	C	.	.	H	α-helix	trans	-65.3	-41.7	176.6	-170.4	82.3	0	0	0	112.8	Y121 S261 R262 I263 I267 L268 Q269 L760	Y121-H265 HydrophobicContact CE2-CB 4.12Å; Y121-H265 AromaticContact CE2-ND1 3.9Å; Y121-H265 AromaticContact CZ-ND1 3.5Å; Y121-H265 PolarHBondContact OH-ND1 3.15Å; S261-H265 WeakPolarHBondContact O-CB 3.45Å; S261-H265 PolarHBondContact O-N 3.21Å; R262-H265 PolarHBondContact O-N 2.85Å; I263-H265 VanDerWaalsContact C-N 3.33Å; I263-H265 PolarHBondContact O-N 3.37Å; H265-I267 VanDerWaalsContact C-N 3.33Å; H265-I267 PolarHBondContact O-N 3.48Å; H265-L268 PolarHBondContact O-N 2.84Å; H265-Q269 PolarHBondContact CD2-NE2 2.95Å; H265-Q269 VanDerWaalsContact CD2-NE2 3.3Å; H265-Q269 PolarHBondContact NE2-NE2 2.8Å; H265-Q269 WeakPolarHBondContact O-CG 3.5Å; H265-Q269 PolarHBondContact O-N 3.13Å; H265-L760 HydrophobicContact CB-CD1 3.76Å; H265-L760 HydrophobicContact CB-CD2 3.84Å; H265-L760 HydrophobicContact CB-CG 4.47Å; H265-L760 WeakPolarHBondContact CD2-CD2 3.47Å; H265-L760 VanDerWaalsContact CG-CD2 3.47Å
266	H	86.6	Confident	85.2	Confident	21 Å²	21	37.1 Å²	37.1	10%	0.097	18%	0.183	C	C	.	.	H	α-helix	trans	-56.4	-45.3	173.9	169.1	95	0	0	0	111.9	M179 R262 I263 L268 Q269 R270 E467	M179-H266 HydrophobicContact CE-CB 3.7Å; M179-H266 HydrophobicContact SD-CB 3.88Å; R262-H266 PolarHBondContact O-N 3.23Å; I263-H266 PolarHBondContact O-N 3.08Å; H266-L268 PolarHBondContact O-N 3.18Å; H266-Q269 PolarHBondContact O-N 2.96Å; H266-R270 PolarHBondContact CE1-NE 3.01Å; H266-R270 PolarHBondContact O-N 3.04Å; H266-E467 IonicContact CE1-OE1 3.61Å; H266-E467 IonicContact CE1-OE2 2.92Å; H266-E467 PolarHBondContact CE1-OE2 3.03Å; H266-E467 IonicContact CG-OE1 2.85Å; H266-E467 IonicContact ND1-OE1 3.95Å; H266-E467 PolarHBondContact ND1-OE1 2.99Å; H266-E467 IonicContact ND1-OE2 3.9Å; H266-E467 PolarHBondContact ND1-OE2 2.81Å
267	I	89.9	Confident	83.9	Confident	3 Å²	3	42.2 Å²	42.2	2%	0.015	20%	0.202	C	C	.	.	H	α-helix	trans	-59.3	-49.1	175.1	-62.5	164.1	0	0	0	110.4	E145 L147 V171 Y175 I263 V264 H265 Q269 R270 I271	E145-I267 HydrophobicContact CB-CG2 4.34Å; L147-I267 HydrophobicContact CD1-CB 4.32Å; L147-I267 HydrophobicContact CD1-CD1 4.36Å; L147-I267 HydrophobicContact CD1-CG2 3.76Å; L147-I267 HydrophobicContact CD2-CD1 4.14Å; L147-I267 HydrophobicContact CG-CD1 4.44Å; L147-I267 HydrophobicContact CG-CG2 4.48Å; V171-I267 HydrophobicContact CG1-CD1 3.85Å; Y175-I267 HydrophobicContact CD1-CG1 4.01Å; Y175-I267 HydrophobicContact CD2-CD1 3.49Å; Y175-I267 VanDerWaalsContact CD2-CD1 3.49Å; Y175-I267 HydrophobicContact CD2-CG1 3.82Å; Y175-I267 HydrophobicContact CE1-CG1 3.91Å; Y175-I267 HydrophobicContact CE2-CD1 3.58Å; Y175-I267 HydrophobicContact CE2-CG1 3.71Å; Y175-I267 HydrophobicContact CG-CD1 4.02Å; Y175-I267 HydrophobicContact CG-CG1 3.97Å; I263-I267 HydrophobicContact CG2-CD1 4.07Å; I263-I267 WeakPolarHBondContact O-CG1 3.29Å; I263-I267 PolarHBondContact O-N 2.97Å; I263-I267 VanDerWaalsContact O-N 3.11Å; V264-I267 PolarHBondContact O-N 3.12Å; H265-I267 VanDerWaalsContact C-N 3.33Å; H265-I267 PolarHBondContact O-N 3.48Å; I267-Q269 VanDerWaalsContact C-N 3.3Å; I267-Q269 PolarHBondContact O-N 3.48Å; I267-R270 PolarHBondContact O-N 2.87Å; I267-I271 HydrophobicContact CG2-CD1 3.68Å; I267-I271 HydrophobicContact CG2-CG1 4.21Å; I267-I271 WeakPolarHBondContact O-CG1 3.35Å; I267-I271 PolarHBondContact O-N 3.31Å; I267-I271 VanDerWaalsContact O-N 3.08Å
268	L	89.9	Confident	82.8	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64.6	-27.6	-179.7	-68.4	166.5	0	0	0	114.1	Y121 L123 F138 I142 L165 V264 H265 H266 R270 L282	Y121-L268 HydrophobicContact CD1-CD1 3.49Å; Y121-L268 VanDerWaalsContact CD1-CD1 3.49Å; Y121-L268 HydrophobicContact CE1-CD1 3.7Å; Y121-L268 HydrophobicContact CG-CD1 4.23Å; L123-L268 HydrophobicContact CD1-CD2 4.3Å; L123-L268 HydrophobicContact CD2-CD1 4.31Å; F138-L268 HydrophobicContact CE1-CD2 4.06Å; F138-L268 HydrophobicContact CZ-CD2 4.09Å; I142-L268 HydrophobicContact CD1-CD2 3.62Å; I142-L268 HydrophobicContact CG1-CD2 3.93Å; L165-L268 HydrophobicContact CD1-CD1 3.75Å; L165-L268 HydrophobicContact CD1-CD2 3.97Å; L165-L268 HydrophobicContact CD1-CG 4.37Å; V264-L268 HydrophobicContact CG1-CD1 3.88Å; V264-L268 HydrophobicContact CG1-CG 4.41Å; V264-L268 VanDerWaalsContact O-CG 3.28Å; V264-L268 WeakPolarHBondContact O-CG 3.43Å; V264-L268 PolarHBondContact O-N 3.04Å; H265-L268 PolarHBondContact O-N 2.84Å; H266-L268 PolarHBondContact O-N 3.18Å; L268-R270 VanDerWaalsContact C-N 3.32Å; L268-L282 HydrophobicContact CB-CB 4.28Å; L268-L282 HydrophobicContact CB-CD2 3.99Å; L268-L282 HydrophobicContact CD1-CD2 4.27Å; L268-L282 WeakPolarHBondContact O-CB 3.47Å; L268-L282 PolarHBondContact O-N 2.87Å
269	Q	84.9	Confident	82	Confident	47 Å²	47	46.9 Å²	46.9	22%	0.22	22%	0.223	C	C	.	.	H	α-helix	trans	-71	-25.7	172.8	-75	-169	-1.5	0	0	113.1	H265 H266 I267 I280 G281	H265-Q269 PolarHBondContact CD2-NE2 2.95Å; H265-Q269 VanDerWaalsContact CD2-NE2 3.3Å; H265-Q269 PolarHBondContact NE2-NE2 2.8Å; H265-Q269 WeakPolarHBondContact O-CG 3.5Å; H265-Q269 PolarHBondContact O-N 3.13Å; H266-Q269 PolarHBondContact O-N 2.96Å; I267-Q269 VanDerWaalsContact C-N 3.3Å; I267-Q269 PolarHBondContact O-N 3.48Å; Q269-I280 WeakPolarHBondContact O-CG2 3.33Å; Q269-G281 WeakPolarHBondContact O-CA 3.45Å
270	R	81.3	Confident	81.3	Confident	100 Å²	100	47.3 Å²	47.3	38%	0.377	22%	0.224	S	C	.	.	H	α-helix	trans	-103.9	-16.6	-172.7	-66	-175.7	171.1	-75.8	-4.4	114.4	H266 I267 L268 E467 E473	H266-R270 PolarHBondContact CE1-NE 3.01Å; H266-R270 PolarHBondContact O-N 3.04Å; I267-R270 PolarHBondContact O-N 2.87Å; L268-R270 VanDerWaalsContact C-N 3.32Å; R270-E467 IonicContact CZ-OE2 3.51Å; R270-E467 VanDerWaalsContact CZ-OE2 3.22Å; R270-E467 IonicContact NE-OE2 2.62Å; R270-E467 PolarHBondContact NE-OE2 2.99Å; R270-E467 IonicContact NH2-OE2 3.57Å; R270-E467 PolarHBondContact NH2-OE2 3.26Å; R270-E473 IonicContact NH1-OE1 2.75Å
271	I	86.4	Confident	80.5	Confident	5 Å²	5	47 Å²	47	3%	0.026	22%	0.223	C	C	.	.			trans	-62.9	138.2	173.8	-72.5	168	0	0	0	111.4	F138 N141 I142 E145 I267 G281	F138-I271 HydrophobicContact CD2-CB 4.28Å; F138-I271 HydrophobicContact CD2-CG2 3.51Å; F138-I271 HydrophobicContact CE2-CB 3.76Å; F138-I271 HydrophobicContact CE2-CG2 3.53Å; F138-I271 HydrophobicContact CG-CG2 4.36Å; F138-I271 HydrophobicContact CZ-CB 4.43Å; F138-I271 HydrophobicContact CZ-CG2 4.39Å; N141-I271 HydrophobicContact CB-CG2 3.62Å; I142-I271 HydrophobicContact CB-CD1 4.34Å; I142-I271 HydrophobicContact CG1-CD1 3.66Å; E145-I271 HydrophobicContact CG-CD1 4.09Å; E145-I271 HydrophobicContact CG-CG1 3.98Å; I267-I271 HydrophobicContact CG2-CD1 3.68Å; I267-I271 HydrophobicContact CG2-CG1 4.21Å; I267-I271 WeakPolarHBondContact O-CG1 3.35Å; I267-I271 PolarHBondContact O-N 3.31Å; I267-I271 VanDerWaalsContact O-N 3.08Å; I271-G281 PolarHBondContact O-N 2.88Å
272	K	83	Confident	80.1	Confident	113 Å²	113	46.6 Å²	46.6	49%	0.491	22%	0.221	S	C	.	.	B	Isolated β-bridge	trans	-82.3	139.6	173.1	-69.5	162	-174.1	162.6	0	110.7	N141 I280	N141-K272 PolarHBondContact ND2-O 3.33Å; K272-I280 HydrophobicContact CG-CG1 3.78Å
273	Y	80.8	Confident	79.7	Confident	8 Å²	8	48.3 Å²	48.3	3%	0.031	23%	0.233	C	C	.	.	S	Bend	trans	-103.1	-8.5	176.6	64.1	-102.1	0	0	0	113.5	K134 V137 K279 R284 L285	K134-Y273 HydrophobicContact CB-CD2 4.44Å; V137-Y273 WeakPolarHBondContact CB-O 3.38Å; V137-Y273 VanDerWaalsContact CG1-O 3.32Å; V137-Y273 WeakPolarHBondContact CG1-O 3.36Å; Y273-K279 WeakPolarHBondContact CD1-O 3.36Å; Y273-K279 HydrophobicContact CE1-CB 4.21Å; Y273-K279 HydrophobicContact CE2-CB 3.95Å; Y273-K279 HydrophobicContact CE2-CD 4.47Å; Y273-K279 HydrophobicContact CE2-CG 4.42Å; Y273-K279 PolarHBondContact N-O 3.47Å; Y273-R284 HydrophobicContact CE1-CB 4.43Å; Y273-R284 WeakPolarHBondContact OH-CD 3.36Å; Y273-L285 HydrophobicContact CD1-CD2 4.02Å; Y273-L285 HydrophobicContact CD1-CG 4.14Å; Y273-L285 HydrophobicContact CD2-CD2 4.05Å; Y273-L285 HydrophobicContact CG-CD1 4.44Å; Y273-L285 HydrophobicContact CG-CD2 3.74Å; Y273-L285 HydrophobicContact CG-CG 4.24Å
274	E	78.3	Confident	79.2	Confident	63 Å²	63	54 Å²	54	29%	0.294	25%	0.254	S	S	.	.	S	Bend	trans	-163	155.8	-177.8	-164.4	-177.6	154.2	0	0	108.7	K134 G276 K279	K134-E274 VanDerWaalsContact CE-OE2 3.3Å; K134-E274 WeakPolarHBondContact CE-OE2 3.24Å; E274-G276 PolarHBondContact O-N 3.33Å; E274-K279 HydrophobicContact CB-CB 4.17Å; E274-K279 HydrophobicContact CB-CD 3.7Å; E274-K279 HydrophobicContact CG-CD 3.86Å; E274-K279 IonicContact OE1-NZ 2.72Å; E274-K279 PolarHBondContact OE1-NZ 3.23Å; E274-K279 WeakPolarHBondContact OE2-CD 3.36Å; E274-K279 IonicContact OE2-NZ 2.75Å
275	E	67.8	Low	78.8	Confident	185 Å²	185	54 Å²	54	86%	0.864	25%	0.254	S	S	*	.	S	Bend	trans	-71.9	123.1	-178.8	-65.5	-172.3	177.2	0	0	111.9
276	G	62.8	Low	78.5	Confident	40 Å²	40	55.5 Å²	55.5	41%	0.412	26%	0.263	S	S	.	.	S	Bend	trans	148	148.7	177.4	0	0	0	0	0	113.1	E274 N278 K279	E274-G276 PolarHBondContact O-N 3.33Å; G276-N278 PolarHBondContact O-N 3.23Å; G276-N278 VanDerWaalsContact O-N 3.09Å; G276-K279 PolarHBondContact O-N 2.86Å
277	K	59.2	Low	78.3	Confident	160 Å²	160	60.3 Å²	60.3	70%	0.696	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-24.6	-177	-71.8	-165.9	172.5	-164.8	0	114.5
278	N	62.4	Low	78	Confident	64 Å²	64	63.3 Å²	63.3	34%	0.342	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.3	20	-169.9	-64.9	6	0	0	0	113.9	G276 R284 A474 S477	G276-N278 PolarHBondContact O-N 3.23Å; G276-N278 VanDerWaalsContact O-N 3.09Å; N278-R284 PolarHBondContact O-NH1 2.81Å; N278-A474 HydrophobicContact CB-CB 4.08Å; N278-A474 PolarHBondContact ND2-O 2.76Å; N278-A474 PolarHBondContact OD1-O 3.32Å; N278-S477 PolarHBondContact OD1-OG 3.01Å
279	K	71.3	Confident	77.6	Confident	67 Å²	67	65 Å²	65	29%	0.291	33%	0.327	S	S	.	.			trans	-123.2	58.1	-172.8	-61.6	-171.3	-175.8	171.3	0	112.2	Y273 E274 G276	Y273-K279 WeakPolarHBondContact CD1-O 3.36Å; Y273-K279 HydrophobicContact CE1-CB 4.21Å; Y273-K279 HydrophobicContact CE2-CB 3.95Å; Y273-K279 HydrophobicContact CE2-CD 4.47Å; Y273-K279 HydrophobicContact CE2-CG 4.42Å; Y273-K279 PolarHBondContact N-O 3.47Å; E274-K279 HydrophobicContact CB-CB 4.17Å; E274-K279 HydrophobicContact CB-CD 3.7Å; E274-K279 HydrophobicContact CG-CD 3.86Å; E274-K279 IonicContact OE1-NZ 2.72Å; E274-K279 PolarHBondContact OE1-NZ 3.23Å; E274-K279 WeakPolarHBondContact OE2-CD 3.36Å; E274-K279 IonicContact OE2-NZ 2.75Å; G276-K279 PolarHBondContact O-N 2.86Å
280	I	74.3	Confident	77.7	Confident	38 Å²	38	62.8 Å²	62.8	20%	0.195	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-113.1	144	-173.6	-63.8	163.5	0	0	0	110.4	Q269 K272	Q269-I280 WeakPolarHBondContact O-CG2 3.33Å; K272-I280 HydrophobicContact CG-CG1 3.78Å
281	G	74.6	Confident	78.1	Confident	3 Å²	3	58 Å²	58	3%	0.031	30%	0.299	C	S	.	.			trans	94.9	136.9	152.5	0	0	0	0	0	117.8	Q269 I271 N283 R284	Q269-G281 WeakPolarHBondContact O-CA 3.45Å; I271-G281 PolarHBondContact O-N 2.88Å; G281-N283 VanDerWaalsContact C-N 3.3Å; G281-N283 PolarHBondContact O-N 2.78Å; G281-R284 PolarHBondContact O-N 2.85Å
282	L	84.4	Confident	78.2	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-50.2	-42.2	178.5	175.8	60.6	0	0	0	114.1	Y121 L123 F138 L268 R284 L285 L286 Y291 A294	Y121-L282 HydrophobicContact CE1-CD2 4.41Å; L123-L282 HydrophobicContact CD2-CD1 3.82Å; L123-L282 HydrophobicContact CD2-CD2 3.84Å; F138-L282 HydrophobicContact CE1-CD1 4.3Å; F138-L282 HydrophobicContact CZ-CB 4.11Å; F138-L282 HydrophobicContact CZ-CD1 4.43Å; L268-L282 HydrophobicContact CB-CB 4.28Å; L268-L282 HydrophobicContact CB-CD2 3.99Å; L268-L282 HydrophobicContact CD1-CD2 4.27Å; L268-L282 WeakPolarHBondContact O-CB 3.47Å; L268-L282 PolarHBondContact O-N 2.87Å; L282-R284 PolarHBondContact O-N 3.14Å; L282-R284 VanDerWaalsContact O-N 3.11Å; L282-L285 WeakPolarHBondContact O-CA 3.29Å; L282-L285 WeakPolarHBondContact O-CB 3.34Å; L282-L285 PolarHBondContact O-N 2.86Å; L282-L286 HydrophobicContact CD1-CG 4.3Å; L282-L286 HydrophobicContact CG-CD1 4.12Å; L282-L286 HydrophobicContact CG-CG 4.39Å; L282-L286 PolarHBondContact O-N 2.95Å; L282-Y291 HydrophobicContact CD1-CD2 4.12Å; L282-A294 HydrophobicContact CD1-CB 4.48Å; L282-A294 HydrophobicContact CD2-CB 3.82Å; L282-A294 HydrophobicContact CG-CB 4.46Å
283	N	82.3	Confident	78.5	Confident	74 Å²	74	56.7 Å²	56.7	40%	0.396	30%	0.296	S	S	.	.	H	α-helix	trans	-57.1	-34.4	-174.4	-64.5	5.5	0	0	0	112.2	G281 L286 T287	G281-N283 VanDerWaalsContact C-N 3.3Å; G281-N283 PolarHBondContact O-N 2.78Å; N283-L286 PolarHBondContact O-N 2.97Å; N283-T287 PolarHBondContact O-N 3.45Å; N283-T287 PolarHBondContact O-OG1 3.01Å; N283-T287 VanDerWaalsContact O-OG1 3.04Å
284	R	80.3	Confident	79.1	Confident	120 Å²	120	57.4 Å²	57.4	45%	0.453	30%	0.304	S	S	.	.	H	α-helix	trans	-75.6	-28.7	177.9	-163.8	171	-173.9	-178.2	4.8	112.9	Y273 N278 G281 L282 L286 N288	Y273-R284 HydrophobicContact CE1-CB 4.43Å; Y273-R284 WeakPolarHBondContact OH-CD 3.36Å; N278-R284 PolarHBondContact O-NH1 2.81Å; G281-R284 PolarHBondContact O-N 2.85Å; L282-R284 PolarHBondContact O-N 3.14Å; L282-R284 VanDerWaalsContact O-N 3.11Å; R284-L286 VanDerWaalsContact C-N 3.34Å; R284-N288 VanDerWaalsContact O-CB 3.26Å; R284-N288 WeakPolarHBondContact O-CB 3.18Å; R284-N288 PolarHBondContact O-N 3Å; R284-N288 PolarHBondContact O-ND2 2.79Å; R284-N288 PolarHBondContact O-OD1 2.97Å
285	L	83.3	Confident	79.8	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-72.3	-28.7	171.6	-62.3	177.2	0	0	0	112.1	F138 Y273 L282 G289 S290 Y291	F138-L285 HydrophobicContact CB-CD1 4.08Å; F138-L285 HydrophobicContact CD1-CD1 3.76Å; F138-L285 HydrophobicContact CD2-CD1 3.73Å; F138-L285 HydrophobicContact CE1-CD1 4.04Å; F138-L285 HydrophobicContact CE2-CD1 4.03Å; F138-L285 HydrophobicContact CG-CD1 3.59Å; F138-L285 HydrophobicContact CZ-CD1 4.18Å; Y273-L285 HydrophobicContact CD1-CD2 4.02Å; Y273-L285 HydrophobicContact CD1-CG 4.14Å; Y273-L285 HydrophobicContact CD2-CD2 4.05Å; Y273-L285 HydrophobicContact CG-CD1 4.44Å; Y273-L285 HydrophobicContact CG-CD2 3.74Å; Y273-L285 HydrophobicContact CG-CG 4.24Å; L282-L285 WeakPolarHBondContact O-CA 3.29Å; L282-L285 WeakPolarHBondContact O-CB 3.34Å; L282-L285 PolarHBondContact O-N 2.86Å; L285-G289 CarbonylContact O-C 3.59Å; L285-G289 PolarHBondContact O-N 3.45Å; L285-S290 PolarHBondContact O-N 2.91Å; L285-S290 PolarHBondContact O-OG 3.35Å; L285-Y291 HydrophobicContact CB-CD2 3.93Å; L285-Y291 HydrophobicContact CD1-CD2 4.05Å; L285-Y291 HydrophobicContact CD1-CE2 3.89Å; L285-Y291 PolarHBondContact O-N 2.95Å
286	L	85.6	Confident	81	Confident	55 Å²	55	46.2 Å²	46.2	29%	0.288	25%	0.251	S	S	.	.	H	α-helix	trans	-70.4	-48.7	169.8	-64.6	167.9	0	0	0	110.8	L282 N283 R284 N288 G289 A294	L282-L286 HydrophobicContact CD1-CG 4.3Å; L282-L286 HydrophobicContact CG-CD1 4.12Å; L282-L286 HydrophobicContact CG-CG 4.39Å; L282-L286 PolarHBondContact O-N 2.95Å; N283-L286 PolarHBondContact O-N 2.97Å; R284-L286 VanDerWaalsContact C-N 3.34Å; L286-N288 VanDerWaalsContact C-N 3.3Å; L286-N288 PolarHBondContact O-N 3.38Å; L286-G289 PolarHBondContact O-N 3.4Å; L286-A294 HydrophobicContact CD1-CB 4.03Å; L286-A294 HydrophobicContact CD2-CB 4.1Å
287	T	82.3	Confident	82.4	Confident	121 Å²	121	44.8 Å²	44.8	74%	0.742	23%	0.234	S	C	*	.	H	α-helix	trans	-62.3	-34.8	177	-47.1	0	0	0	0	113	N283 G289	N283-T287 PolarHBondContact O-N 3.45Å; N283-T287 PolarHBondContact O-OG1 3.01Å; N283-T287 VanDerWaalsContact O-OG1 3.04Å; T287-G289 PolarHBondContact O-N 3.05Å
288	N	82.3	Confident	83.9	Confident	67 Å²	67	37.2 Å²	37.2	36%	0.358	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-2.6	174.2	-66.4	-12.1	0	0	0	113.4	Q131 R284 L286 S290	Q131-N288 PolarHBondContact NE2-O 3.36Å; R284-N288 VanDerWaalsContact O-CB 3.26Å; R284-N288 WeakPolarHBondContact O-CB 3.18Å; R284-N288 PolarHBondContact O-N 3Å; R284-N288 PolarHBondContact O-ND2 2.79Å; R284-N288 PolarHBondContact O-OD1 2.97Å; L286-N288 VanDerWaalsContact C-N 3.3Å; L286-N288 PolarHBondContact O-N 3.38Å; N288-S290 PolarHBondContact O-N 3.46Å
289	G	82.4	Confident	84.9	Confident	35 Å²	35	34.7 Å²	34.7	36%	0.361	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.5	5	-176.9	0	0	0	0	0	115.9	N129 L285 L286 T287 Y291	N129-G289 PolarHBondContact ND2-O 3.24Å; L285-G289 CarbonylContact O-C 3.59Å; L285-G289 PolarHBondContact O-N 3.45Å; L286-G289 PolarHBondContact O-N 3.4Å; T287-G289 PolarHBondContact O-N 3.05Å; G289-Y291 CarbonylContact C-O 3.56Å; G289-Y291 PolarHBondContact O-N 3.36Å
290	S	87	Confident	85.4	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.177	C	C	.	.	S	Bend	trans	-61.1	-33.4	179.8	-26.2	0	0	0	0	112.1	Q131 R135 L285 N288	Q131-S290 PolarHBondContact OE1-OG 3.3Å; R135-S290 PolarHBondContact NH1-O 3.08Å; L285-S290 PolarHBondContact O-N 2.91Å; L285-S290 PolarHBondContact O-OG 3.35Å; N288-S290 PolarHBondContact O-N 3.46Å
291	Y	90	Very high	85.8	Confident	1 Å²	1	33 Å²	33	0%	0.004	19%	0.188	C	C	.	.	S	Bend	trans	-115.7	144.9	160.9	-73.3	-78.5	0	0	0	109	L123 V124 Y125 F138 L282 L285 G289	L123-Y291 HydrophobicContact CB-CD1 3.73Å; L123-Y291 HydrophobicContact CB-CE1 3.64Å; L123-Y291 HydrophobicContact CD1-CD1 4.48Å; L123-Y291 HydrophobicContact CD1-CE1 3.88Å; L123-Y291 HydrophobicContact CD1-CE2 4.29Å; L123-Y291 HydrophobicContact CG-CE1 4.38Å; V124-Y291 CarbonylContact O-C 3.48Å; Y125-Y291 HydrophobicContact CD1-CD1 4.22Å; Y125-Y291 AromaticContact CD1-CE1 3.81Å; Y125-Y291 HydrophobicContact CD1-CE1 3.81Å; Y125-Y291 HydrophobicContact CG-CD1 4.48Å; Y125-Y291 HydrophobicContact CG-CE1 4.42Å; F138-Y291 AromaticContact CD1-CE2 3.76Å; F138-Y291 HydrophobicContact CD1-CE2 3.76Å; F138-Y291 HydrophobicContact CE1-CE2 4.07Å; L282-Y291 HydrophobicContact CD1-CD2 4.12Å; L285-Y291 HydrophobicContact CB-CD2 3.93Å; L285-Y291 HydrophobicContact CD1-CD2 4.05Å; L285-Y291 HydrophobicContact CD1-CE2 3.89Å; L285-Y291 PolarHBondContact O-N 2.95Å; G289-Y291 CarbonylContact C-O 3.56Å; G289-Y291 PolarHBondContact O-N 3.36Å
292	E	87.7	Confident	86.1	Confident	80 Å²	80	35.6 Å²	35.6	37%	0.374	20%	0.198	S	C	.	.	S	Bend	trans	-93.1	-32.2	-177.6	-170.1	165.7	163.9	0	0	111.6	V124 R126 Y699	V124-E292 PolarHBondContact O-N 2.79Å; R126-E292 IonicContact CZ-OE1 3.68Å; R126-E292 IonicContact CZ-OE2 2.82Å; R126-E292 IonicContact NE-OE2 3.55Å; R126-E292 PolarHBondContact NE-OE2 2.99Å; R126-E292 VanDerWaalsContact NH2-CD 3.26Å; R126-E292 IonicContact NH2-OE1 2.63Å; R126-E292 PolarHBondContact NH2-OE1 2.81Å; R126-E292 IonicContact NH2-OE2 3.06Å; R126-E292 PolarHBondContact NH2-OE2 3.01Å; R126-E292 VanDerWaalsContact NH2-OE2 3.07Å; E292-Y699 PolarHBondContact OE1-OH 3.49Å
293	A	89.9	Confident	85.9	Confident	9 Å²	9	42 Å²	42	7%	0.074	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	158.4	173.7	0	0	0	0	0	112.5	V124 F295 Y699	V124-A293 HydrophobicContact CB-CB 4.16Å; V124-A293 HydrophobicContact CG2-CB 4.1Å; V124-A293 PolarHBondContact N-O 3.29Å; V124-A293 PolarHBondContact O-N 3.38Å; A293-F295 HydrophobicContact CB-CD1 4.08Å; A293-F295 HydrophobicContact CB-CE1 3.99Å; A293-Y699 HydrophobicContact CB-CD2 4.42Å; A293-Y699 HydrophobicContact CB-CE2 3.95Å
294	A	92.4	Very high	85.5	Confident	24 Å²	24	40.5 Å²	40.5	20%	0.198	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	123.4	174	0	0	0	0	0	110.2	Y121 I122 L123 L282 L286	Y121-A294 HydrophobicContact CE1-CB 4.02Å; I122-A294 WeakPolarHBondContact O-CA 3.46Å; L123-A294 HydrophobicContact CD2-CB 3.69Å; L282-A294 HydrophobicContact CD1-CB 4.48Å; L282-A294 HydrophobicContact CD2-CB 3.82Å; L282-A294 HydrophobicContact CG-CB 4.46Å; L286-A294 HydrophobicContact CD1-CB 4.03Å; L286-A294 HydrophobicContact CD2-CB 4.1Å
295	F	93.2	Very high	84.8	Confident	7 Å²	7	44.6 Å²	44.6	3%	0.031	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	154.7	-174.3	54.2	-84.4	0	0	0	113.6	I122 V124 A293 L297 D698 Y699	I122-F295 HydrophobicContact CG2-CZ 4.4Å; I122-F295 PolarHBondContact N-O 2.97Å; I122-F295 PolarHBondContact O-N 3.41Å; V124-F295 HydrophobicContact CG2-CE1 3.72Å; V124-F295 HydrophobicContact CG2-CZ 4.24Å; A293-F295 HydrophobicContact CB-CD1 4.08Å; A293-F295 HydrophobicContact CB-CE1 3.99Å; F295-L297 HydrophobicContact CE2-CD2 4.37Å; F295-D698 HydrophobicContact CE2-CB 4Å; F295-Y699 AromaticContact CE1-CD2 3.95Å; F295-Y699 HydrophobicContact CE1-CD2 3.95Å; F295-Y699 HydrophobicContact CZ-CD2 4.14Å
296	P	93.6	Very high	84	Confident	5 Å²	5	48.4 Å²	48.4	3%	0.032	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-80.7	155.5	166.9	34.6	-33.6	0	0	0	111.8	Y121 S261 R758	Y121-P296 HydrophobicContact CD2-CB 4.19Å; Y121-P296 HydrophobicContact CE2-CB 4.4Å; S261-P296 WeakPolarHBondContact OG-CB 3.47Å; P296-R758 WeakPolarHBondContact CD-O 3.35Å; P296-R758 HydrophobicContact CG-CB 4.23Å; P296-R758 HydrophobicContact CG-CG 4.27Å; P296-R758 WeakPolarHBondContact CG-O 3.42Å
297	L	91.3	Very high	83	Confident	10 Å²	10	48.4 Å²	48.4	5%	0.052	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-82.8	148	179.1	-74.8	-173.2	0	0	0	113.9	L110 I119 I122 F295 W695 D698 R758	L110-L297 HydrophobicContact CD2-CD1 4.47Å; I119-L297 HydrophobicContact CB-CD1 3.86Å; I119-L297 HydrophobicContact CD1-CD1 4Å; I119-L297 HydrophobicContact CG2-CD1 3.71Å; I119-L297 HydrophobicContact CG2-CG 4.23Å; I122-L297 HydrophobicContact CD1-CD1 4.09Å; I122-L297 HydrophobicContact CD1-CD2 3.63Å; I122-L297 HydrophobicContact CD1-CG 3.87Å; I122-L297 HydrophobicContact CG1-CD2 4.46Å; I122-L297 HydrophobicContact CG1-CG 4.36Å; F295-L297 HydrophobicContact CE2-CD2 4.37Å; L297-W695 HydrophobicContact CD2-CB 3.97Å; L297-D698 HydrophobicContact CD2-CB 4.38Å; L297-R758 WeakPolarHBondContact O-CD 3.38Å; L297-R758 PolarHBondContact O-NH1 3.11Å
298	H	91	Very high	82.2	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.005	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-73.4	156.3	157.2	-71	-68.5	0	0	0	111.5	L110 G300 R317 Y342 Q694 D698 W756 R758	L110-H298 WeakPolarHBondContact CD2-O 3.47Å; H298-G300 PolarHBondContact O-N 3.15Å; H298-R317 VanDerWaalsContact CB-NH1 3.27Å; H298-R317 VanDerWaalsContact CD2-CZ 3.44Å; H298-R317 PolarHBondContact CD2-NH1 3.02Å; H298-R317 PolarHBondContact CD2-NH2 3.26Å; H298-R317 VanDerWaalsContact CD2-NH2 3.32Å; H298-R317 VanDerWaalsContact CG-CZ 3.48Å; H298-R317 PolarHBondContact NE2-NH2 2.59Å; H298-Y342 AromaticContact ND1-CE1 3.88Å; H298-Y342 AromaticContact ND1-CZ 3.84Å; H298-Y342 PolarHBondContact ND1-OH 3.42Å; H298-Q694 WeakPolarHBondContact O-CG 3.45Å; H298-D698 WeakPolarHBondContact CB-OD2 3.48Å; H298-D698 IonicContact CD2-OD1 2.96Å; H298-D698 PolarHBondContact CD2-OD1 3.05Å; H298-D698 IonicContact CD2-OD2 3.51Å; H298-D698 IonicContact CG-OD2 2.78Å; H298-D698 PolarHBondContact N-OD2 2.71Å; H298-W756 PolarHBondContact NE2-O 3.38Å; H298-W756 VanDerWaalsContact NE2-O 3.12Å; H298-R758 PolarHBondContact NE2-N 3.11Å; H298-R758 VanDerWaalsContact NE2-N 3.11Å
299	E	82.9	Confident	81.3	Confident	12 Å²	12	50.6 Å²	50.6	6%	0.056	26%	0.261	C	S	.	.			trans	-83.8	34.6	-177.2	-68.4	162.1	-142.3	0	0	112.6	N257 N315 H316 Y342 R758	N257-E299 WeakPolarHBondContact CB-OE1 3.26Å; N257-E299 PolarHBondContact ND2-OE1 3.14Å; N257-E299 PolarHBondContact ND2-OE2 2.83Å; N257-E299 VanDerWaalsContact ND2-OE2 3.15Å; E299-N315 WeakPolarHBondContact O-CB 3.41Å; E299-N315 PolarHBondContact O-ND2 3.28Å; E299-N315 PolarHBondContact O-OD1 3.25Å; E299-H316 IonicContact OE2-CE1 3.68Å; E299-H316 IonicContact OE2-CG 3.77Å; E299-H316 IonicContact OE2-ND1 2.71Å; E299-H316 PolarHBondContact OE2-ND1 2.89Å; E299-Y342 HydrophobicContact CB-CE2 4.31Å; E299-Y342 HydrophobicContact CG-CE2 4.16Å; E299-Y342 PolarHBondContact N-OH 3.12Å; E299-Y342 WeakPolarHBondContact OE1-CE2 3.44Å; E299-R758 IonicContact OE1-CZ 2.75Å; E299-R758 IonicContact OE1-NH1 2.82Å; E299-R758 PolarHBondContact OE1-NH1 2.94Å; E299-R758 IonicContact OE1-NH2 3.86Å; E299-R758 PolarHBondContact OE1-NH2 3.22Å; E299-R758 VanDerWaalsContact OE1-NH2 3.08Å
300	G	83.2	Confident	80.3	Confident	6 Å²	6	53.6 Å²	53.6	6%	0.062	27%	0.272	C	S	.	.	S	Bend	trans	105.4	-153.5	178.9	0	0	0	0	0	115.1	H298 R317	H298-G300 PolarHBondContact O-N 3.15Å; G300-R317 WeakPolarHBondContact O-CD 3.38Å; G300-R317 PolarHBondContact O-NH1 2.7Å; G300-R317 VanDerWaalsContact O-NH1 3.07Å
301	S	82.9	Confident	79	Confident	63 Å²	63	60.3 Å²	60.3	44%	0.441	30%	0.303	S	S	.	.			trans	-67.5	149.1	179	-176.2	0	0	0	0	112.9	R303	S301-R303 PolarHBondContact OG-N 2.89Å; S301-R303 PolarHBondContact OG-O 3.49Å
302	Y	80.8	Confident	77.8	Confident	57 Å²	57	62 Å²	62	22%	0.224	32%	0.32	C	S	.	.	S	Bend	trans	-91.5	-27.5	170.6	72	-86.5	0	0	0	113.1	H318 Y321 T754	Y302-H318 PolarHBondContact O-CD2 2.83Å; Y302-Y321 HydrophobicContact CD2-CD1 4.15Å; Y302-Y321 AromaticContact CD2-CD2 3.61Å; Y302-Y321 HydrophobicContact CD2-CD2 3.61Å; Y302-Y321 HydrophobicContact CD2-CE1 4.2Å; Y302-Y321 AromaticContact CD2-CE2 3.65Å; Y302-Y321 HydrophobicContact CD2-CE2 3.65Å; Y302-Y321 AromaticContact CD2-CG 3.87Å; Y302-Y321 HydrophobicContact CD2-CG 3.87Å; Y302-Y321 AromaticContact CD2-CZ 3.95Å; Y302-Y321 HydrophobicContact CE2-CD2 4.29Å; Y302-Y321 HydrophobicContact CE2-CE1 4.42Å; Y302-Y321 AromaticContact CE2-CE2 3.85Å; Y302-Y321 HydrophobicContact CE2-CE2 3.85Å; Y302-Y321 AromaticContact CE2-CZ 3.92Å; Y302-Y321 HydrophobicContact CG-CD2 4.48Å; Y302-T754 HydrophobicContact CD1-CG2 4.29Å; Y302-T754 HydrophobicContact CD2-CG2 3.66Å; Y302-T754 HydrophobicContact CE1-CG2 4.41Å; Y302-T754 HydrophobicContact CE2-CG2 3.77Å; Y302-T754 HydrophobicContact CG-CG2 3.94Å
303	R	79.3	Confident	76.8	Confident	134 Å²	134	60.3 Å²	60.3	51%	0.506	32%	0.32	S	S	.	.			trans	-91.7	142	169.9	-63.7	-165.5	-176.8	-152.4	-1.2	111	S301	S301-R303 PolarHBondContact OG-N 2.89Å; S301-R303 PolarHBondContact OG-O 3.49Å
304	S	74.1	Confident	76	Confident	44 Å²	44	63.9 Å²	63.9	31%	0.308	34%	0.341	S	S	.	.			trans	-113.7	161.4	168.3	173	0	0	0	0	109.3	N306 H318	S304-N306 VanDerWaalsContact C-N 3.31Å; S304-N306 WeakPolarHBondContact CB-O 3.27Å; S304-N306 PolarHBondContact OG-N 3.19Å; S304-N306 PolarHBondContact OG-O 3.43Å; S304-H318 WeakPolarHBondContact CB-CE1 3.29Å; S304-H318 WeakPolarHBondContact CB-NE2 3.46Å
305	K	65.6	Low	75.4	Confident	206 Å²	206	64.6 Å²	64.6	90%	0.896	34%	0.341	S	S	*	.	S	Bend	trans	-77.6	-19.8	167.6	-69.4	-169	176.2	-172.3	0	113
306	N	66.6	Low	74.9	Confident	80 Å²	80	67.2 Å²	67.2	43%	0.428	35%	0.354	S	S	.	.	S	Bend	trans	-125.5	135	-170.8	-51.2	-24.3	0	0	0	108.9	S304 H311	S304-N306 VanDerWaalsContact C-N 3.31Å; S304-N306 WeakPolarHBondContact CB-O 3.27Å; S304-N306 PolarHBondContact OG-N 3.19Å; S304-N306 PolarHBondContact OG-O 3.43Å; N306-H311 PolarHBondContact ND2-CD2 3.04Å
307	S	64.6	Low	74.6	Confident	54 Å²	54	67.4 Å²	67.4	38%	0.378	35%	0.354	S	S	.	.			trans	-70.3	150.6	177.9	178.9	0	0	0	0	111.9	K309 T310 H311 E322	S307-K309 PolarHBondContact O-N 3.32Å; S307-K309 VanDerWaalsContact O-N 3.13Å; S307-T310 PolarHBondContact O-N 3.39Å; S307-T310 VanDerWaalsContact O-N 3.14Å; S307-T310 PolarHBondContact O-OG1 3.08Å; S307-H311 PolarHBondContact O-N 3.32Å; S307-E322 PolarHBondContact OG-OE2 2.79Å
308	I	65.9	Low	74.4	Confident	34 Å²	34	67 Å²	67	17%	0.174	35%	0.352	C	S	.	.	H	α-helix	trans	-56.3	-30.8	178.3	-63.6	177.3	0	0	0	112.2	T310 G312 A313 H318 L319 E322	I308-T310 VanDerWaalsContact C-N 3.29Å; I308-T310 PolarHBondContact O-N 2.92Å; I308-G312 VanDerWaalsContact O-CA 3.29Å; I308-G312 WeakPolarHBondContact O-CA 3.44Å; I308-G312 PolarHBondContact O-N 3.35Å; I308-A313 HydrophobicContact CD1-CB 4.25Å; I308-A313 HydrophobicContact CG1-CB 4.37Å; I308-H318 VanDerWaalsContact CG1-CE1 3.48Å; I308-H318 WeakPolarHBondContact CG1-CE1 3.15Å; I308-L319 HydrophobicContact CD1-CB 4.42Å; I308-L319 HydrophobicContact CD1-CD1 3.84Å; I308-E322 HydrophobicContact CD1-CB 3.72Å; I308-E322 HydrophobicContact CD1-CG 4.29Å; I308-E322 HydrophobicContact CG1-CB 4.49Å; I308-E322 WeakPolarHBondContact CG1-OE2 3.4Å; I308-E322 PolarHBondContact N-OE2 3.45Å
309	K	62.6	Low	74.2	Confident	201 Å²	201	67.5 Å²	67.5	87%	0.874	35%	0.354	S	S	*	.	H	α-helix	trans	-61.7	-28.9	178.9	-75.4	-172	176.3	-176.4	0	114.6	S307	S307-K309 PolarHBondContact O-N 3.32Å; S307-K309 VanDerWaalsContact O-N 3.13Å
310	T	60.8	Low	74.5	Confident	97 Å²	97	66.9 Å²	66.9	60%	0.595	35%	0.351	S	S	*	.	H	α-helix	trans	-101.3	-33.5	-174.2	57.9	0	0	0	0	113.3	S307 I308	S307-T310 PolarHBondContact O-N 3.39Å; S307-T310 VanDerWaalsContact O-N 3.14Å; S307-T310 PolarHBondContact O-OG1 3.08Å; I308-T310 VanDerWaalsContact C-N 3.29Å; I308-T310 PolarHBondContact O-N 2.92Å
311	H	59.9	Low	74.8	Confident	142 Å²	142	68.4 Å²	68.4	66%	0.657	36%	0.356	S	S	*	.	H	α-helix	trans	-135	12.5	-172.8	-63.1	-30.3	0	0	0	114.5	N306 S307	N306-H311 PolarHBondContact ND2-CD2 3.04Å; S307-H311 PolarHBondContact O-N 3.32Å
312	G	66.3	Low	74.9	Confident	35 Å²	35	68.3 Å²	68.3	36%	0.361	35%	0.348	S	S	.	.			trans	73.7	-179.8	-178.6	0	0	0	0	0	113.9	I308	I308-G312 VanDerWaalsContact O-CA 3.29Å; I308-G312 WeakPolarHBondContact O-CA 3.44Å; I308-G312 PolarHBondContact O-N 3.35Å
313	A	65.9	Low	75	Confident	45 Å²	45	67.2 Å²	67.2	37%	0.372	35%	0.349	S	S	.	.			trans	-81.9	131	177.2	0	0	0	0	0	111.3	I308 L319	I308-A313 HydrophobicContact CD1-CB 4.25Å; I308-A313 HydrophobicContact CG1-CB 4.37Å; A313-L319 HydrophobicContact CB-CB 3.89Å; A313-L319 HydrophobicContact CB-CD1 4.14Å; A313-L319 HydrophobicContact CB-CG 4.41Å
314	V	72.3	Confident	75.5	Confident	85 Å²	85	60.9 Å²	60.9	52%	0.515	32%	0.324	S	S	.	.	S	Bend	trans	-79.1	-38.2	178.8	-175.7	0	0	0	0	111.5	H318	V314-H318 PolarHBondContact N-ND1 2.83Å
315	N	81.4	Confident	76.2	Confident	38 Å²	38	58.8 Å²	58.8	20%	0.203	31%	0.31	C	S	.	.	S	Bend	trans	-146.1	155.3	179.6	-59.4	-55.2	0	0	0	110	E299 R317 H318 L319	E299-N315 WeakPolarHBondContact O-CB 3.41Å; E299-N315 PolarHBondContact O-ND2 3.28Å; E299-N315 PolarHBondContact O-OD1 3.25Å; N315-R317 PolarHBondContact O-N 3.42Å; N315-H318 WeakPolarHBondContact O-CB 3.4Å; N315-H318 PolarHBondContact O-N 3.39Å; N315-L319 PolarHBondContact O-N 2.85Å
316	H	82.3	Confident	77.2	Confident	62 Å²	62	50.7 Å²	50.7	29%	0.287	28%	0.279	S	S	.	.	H	α-helix	trans	-57.8	-32.8	175.1	-60.8	103.7	0	0	0	113.4	E299 H318 L319 L320 Y342	E299-H316 IonicContact OE2-CE1 3.68Å; E299-H316 IonicContact OE2-CG 3.77Å; E299-H316 IonicContact OE2-ND1 2.71Å; E299-H316 PolarHBondContact OE2-ND1 2.89Å; H316-H318 VanDerWaalsContact C-N 3.34Å; H316-H318 PolarHBondContact O-N 3.49Å; H316-L319 PolarHBondContact O-N 3.21Å; H316-L320 WeakPolarHBondContact O-CB 3.02Å; H316-L320 WeakPolarHBondContact O-CG 3.47Å; H316-L320 PolarHBondContact O-N 3.3Å; H316-Y342 HydrophobicContact CB-CD2 3.86Å; H316-Y342 HydrophobicContact CB-CE2 4.14Å
317	R	88	Confident	78.1	Confident	10 Å²	10	52.1 Å²	52.1	4%	0.038	28%	0.279	C	S	.	.	H	α-helix	trans	-62	-39.9	175.2	-164.2	-173.2	-170.1	160.3	9.3	112.4	H298 G300 N315 Y321 Y342 D698 V753	H298-R317 VanDerWaalsContact CB-NH1 3.27Å; H298-R317 VanDerWaalsContact CD2-CZ 3.44Å; H298-R317 PolarHBondContact CD2-NH1 3.02Å; H298-R317 PolarHBondContact CD2-NH2 3.26Å; H298-R317 VanDerWaalsContact CD2-NH2 3.32Å; H298-R317 VanDerWaalsContact CG-CZ 3.48Å; H298-R317 PolarHBondContact NE2-NH2 2.59Å; G300-R317 WeakPolarHBondContact O-CD 3.38Å; G300-R317 PolarHBondContact O-NH1 2.7Å; G300-R317 VanDerWaalsContact O-NH1 3.07Å; N315-R317 PolarHBondContact O-N 3.42Å; R317-Y321 PolarHBondContact O-N 3.48Å; R317-Y321 VanDerWaalsContact O-N 3.1Å; R317-Y342 WeakPolarHBondContact CB-OH 3.28Å; R317-D698 IonicContact NH1-OD1 3.11Å; R317-V753 HydrophobicContact CG-CG1 4.15Å; R317-V753 VanDerWaalsContact CZ-O 3.31Å; R317-V753 PolarHBondContact NE-O 3.08Å; R317-V753 PolarHBondContact NH2-O 3.22Å
318	H	86.4	Confident	78.9	Confident	2 Å²	2	52 Å²	52	1%	0.009	29%	0.287	C	S	.	.	H	α-helix	trans	-73	-40.3	178.9	167	-132.6	0	0	0	111.1	Y302 S304 I308 V314 N315 H316 Y321 E322	Y302-H318 PolarHBondContact O-CD2 2.83Å; S304-H318 WeakPolarHBondContact CB-CE1 3.29Å; S304-H318 WeakPolarHBondContact CB-NE2 3.46Å; I308-H318 VanDerWaalsContact CG1-CE1 3.48Å; I308-H318 WeakPolarHBondContact CG1-CE1 3.15Å; V314-H318 PolarHBondContact N-ND1 2.83Å; N315-H318 WeakPolarHBondContact O-CB 3.4Å; N315-H318 PolarHBondContact O-N 3.39Å; H316-H318 VanDerWaalsContact C-N 3.34Å; H316-H318 PolarHBondContact O-N 3.49Å; H318-Y321 PolarHBondContact O-N 2.83Å; H318-E322 IonicContact CD2-OE1 2.72Å; H318-E322 IonicContact CE1-OE1 2.67Å; H318-E322 IonicContact NE2-OE1 2.8Å; H318-E322 PolarHBondContact NE2-OE1 3.13Å; H318-E322 PolarHBondContact O-N 3.31Å
319	L	86.4	Confident	79.8	Confident	10 Å²	10	51.1 Å²	51.1	5%	0.052	28%	0.282	C	S	.	.	H	α-helix	trans	-58.4	-48.2	171.3	-177.2	62.2	0	0	0	112.4	L225 I308 A313 N315 H316 Y321 C323 L338	L225-L319 HydrophobicContact CD1-CD2 4.27Å; L225-L319 HydrophobicContact CD2-CD2 3.83Å; I308-L319 HydrophobicContact CD1-CB 4.42Å; I308-L319 HydrophobicContact CD1-CD1 3.84Å; A313-L319 HydrophobicContact CB-CB 3.89Å; A313-L319 HydrophobicContact CB-CD1 4.14Å; A313-L319 HydrophobicContact CB-CG 4.41Å; N315-L319 PolarHBondContact O-N 2.85Å; H316-L319 PolarHBondContact O-N 3.21Å; L319-Y321 VanDerWaalsContact C-N 3.27Å; L319-Y321 PolarHBondContact O-N 3.14Å; L319-C323 VanDerWaalsContact O-CB 3.26Å; L319-C323 WeakPolarHBondContact O-CB 3.38Å; L319-C323 PolarHBondContact O-N 2.98Å; L319-L338 HydrophobicContact CD2-CD1 4.15Å; L319-L338 HydrophobicContact CD2-CD2 3.63Å; L319-L338 HydrophobicContact CG-CD2 3.74Å
320	L	88.6	Confident	80.7	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61.3	-34.6	175.4	-79.6	164.8	0	0	0	112.5	H316 W324 A325 L338 V339 Y342 F343 V753	H316-L320 WeakPolarHBondContact O-CB 3.02Å; H316-L320 WeakPolarHBondContact O-CG 3.47Å; H316-L320 PolarHBondContact O-N 3.3Å; L320-W324 HydrophobicContact CD2-CE3 3.87Å; L320-W324 HydrophobicContact CD2-CZ3 4.32Å; L320-W324 WeakPolarHBondContact O-CB 3.45Å; L320-W324 PolarHBondContact O-N 3.07Å; L320-W324 VanDerWaalsContact O-N 3.15Å; L320-A325 PolarHBondContact O-N 3.05Å; L320-A325 VanDerWaalsContact O-N 3.1Å; L320-L338 HydrophobicContact CD2-CB 4.37Å; L320-L338 HydrophobicContact CD2-CD2 3.75Å; L320-L338 HydrophobicContact CD2-CG 3.79Å; L320-L338 HydrophobicContact CG-CD2 3.86Å; L320-L338 HydrophobicContact CG-CG 3.99Å; L320-V339 HydrophobicContact CD2-CG2 3.9Å; L320-Y342 HydrophobicContact CD1-CD1 3.66Å; L320-Y342 HydrophobicContact CD1-CD2 4.31Å; L320-Y342 HydrophobicContact CD1-CE1 4.35Å; L320-Y342 HydrophobicContact CD1-CG 3.61Å; L320-F343 HydrophobicContact CD1-CE2 4.2Å; L320-V753 HydrophobicContact CB-CG2 4.27Å
321	Y	89.4	Confident	81.7	Confident	38 Å²	38	49.4 Å²	49.4	15%	0.149	26%	0.26	C	S	.	.	I	π-helix	trans	-67.4	-56.9	177.4	-170.9	-100.4	0	0	0	112.3	Y302 R317 H318 L319 C323 A325 S326 Y750 V753 T754	Y302-Y321 HydrophobicContact CD2-CD1 4.15Å; Y302-Y321 AromaticContact CD2-CD2 3.61Å; Y302-Y321 HydrophobicContact CD2-CD2 3.61Å; Y302-Y321 HydrophobicContact CD2-CE1 4.2Å; Y302-Y321 AromaticContact CD2-CE2 3.65Å; Y302-Y321 HydrophobicContact CD2-CE2 3.65Å; Y302-Y321 AromaticContact CD2-CG 3.87Å; Y302-Y321 HydrophobicContact CD2-CG 3.87Å; Y302-Y321 AromaticContact CD2-CZ 3.95Å; Y302-Y321 HydrophobicContact CE2-CD2 4.29Å; Y302-Y321 HydrophobicContact CE2-CE1 4.42Å; Y302-Y321 AromaticContact CE2-CE2 3.85Å; Y302-Y321 HydrophobicContact CE2-CE2 3.85Å; Y302-Y321 AromaticContact CE2-CZ 3.92Å; Y302-Y321 HydrophobicContact CG-CD2 4.48Å; R317-Y321 PolarHBondContact O-N 3.48Å; R317-Y321 VanDerWaalsContact O-N 3.1Å; H318-Y321 PolarHBondContact O-N 2.83Å; L319-Y321 VanDerWaalsContact C-N 3.27Å; L319-Y321 PolarHBondContact O-N 3.14Å; Y321-C323 PolarHBondContact O-N 3.42Å; Y321-A325 HydrophobicContact CD2-CB 4.15Å; Y321-A325 PolarHBondContact O-N 3.21Å; Y321-S326 PolarHBondContact O-N 3.21Å; Y321-S326 VanDerWaalsContact O-N 3.07Å; Y321-Y750 AromaticContact CE2-CD2 3.93Å; Y321-Y750 HydrophobicContact CE2-CD2 3.93Å; Y321-Y750 AromaticContact CE2-CE2 3.96Å; Y321-Y750 HydrophobicContact CE2-CE2 3.96Å; Y321-V753 HydrophobicContact CD2-CG1 4.07Å; Y321-T754 HydrophobicContact CD2-CG2 3.82Å; Y321-T754 HydrophobicContact CE2-CG2 3.68Å
322	E	85.3	Confident	82.6	Confident	60 Å²	60	46.6 Å²	46.6	28%	0.28	25%	0.246	S	C	.	.	I	π-helix	trans	-68	-32.2	-178.6	-83.3	-173.3	-143.1	0	0	113.3	S307 I308 H318	S307-E322 PolarHBondContact OG-OE2 2.79Å; I308-E322 HydrophobicContact CD1-CB 3.72Å; I308-E322 HydrophobicContact CD1-CG 4.29Å; I308-E322 HydrophobicContact CG1-CB 4.49Å; I308-E322 WeakPolarHBondContact CG1-OE2 3.4Å; I308-E322 PolarHBondContact N-OE2 3.45Å; H318-E322 IonicContact CD2-OE1 2.72Å; H318-E322 IonicContact CE1-OE1 2.67Å; H318-E322 IonicContact NE2-OE1 2.8Å; H318-E322 PolarHBondContact NE2-OE1 3.13Å; H318-E322 PolarHBondContact O-N 3.31Å
323	C	84.1	Confident	83.1	Confident	35 Å²	35	52.6 Å²	52.6	24%	0.236	26%	0.259	C	S	.	.	I	π-helix	trans	-89.6	-19	-176.6	-65.9	0	0	0	0	115.3	L319 Y321 V329	L319-C323 VanDerWaalsContact O-CB 3.26Å; L319-C323 WeakPolarHBondContact O-CB 3.38Å; L319-C323 PolarHBondContact O-N 2.98Å; Y321-C323 PolarHBondContact O-N 3.42Å; C323-V329 WeakPolarHBondContact O-CG1 3.5Å
324	W	88.8	Confident	84	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.248	C	C	.	.	I	π-helix	trans	-142.1	-48.8	-169	172.5	60.9	0	0	0	114.7	L320 S326 P335 V339 F343 F351 R746 A749 V753	L320-W324 HydrophobicContact CD2-CE3 3.87Å; L320-W324 HydrophobicContact CD2-CZ3 4.32Å; L320-W324 WeakPolarHBondContact O-CB 3.45Å; L320-W324 PolarHBondContact O-N 3.07Å; L320-W324 VanDerWaalsContact O-N 3.15Å; W324-S326 VanDerWaalsContact C-N 3.32Å; W324-S326 PolarHBondContact O-N 3.18Å; W324-P335 HydrophobicContact CB-CG 3.85Å; W324-P335 HydrophobicContact CG-CG 4.22Å; W324-V339 HydrophobicContact CD2-CG2 4.09Å; W324-V339 HydrophobicContact CE3-CG2 4.05Å; W324-V339 HydrophobicContact CH2-CG1 4.21Å; W324-V339 HydrophobicContact CH2-CG2 3.94Å; W324-V339 HydrophobicContact CZ2-CG2 3.96Å; W324-V339 HydrophobicContact CZ3-CG2 3.98Å; W324-F343 HydrophobicContact CZ3-CE2 4.19Å; W324-F351 AromaticContact CH2-CD2 3.95Å; W324-F351 HydrophobicContact CH2-CD2 3.95Å; W324-F351 HydrophobicContact CH2-CE1 4.25Å; W324-F351 AromaticContact CH2-CE2 3.6Å; W324-F351 HydrophobicContact CH2-CE2 3.6Å; W324-F351 HydrophobicContact CH2-CG 4.43Å; W324-F351 AromaticContact CH2-CZ 3.76Å; W324-F351 HydrophobicContact CH2-CZ 3.76Å; W324-F351 AromaticContact CZ2-CD1 3.69Å; W324-F351 HydrophobicContact CZ2-CD1 3.69Å; W324-F351 AromaticContact CZ2-CD2 3.71Å; W324-F351 HydrophobicContact CZ2-CD2 3.71Å; W324-F351 AromaticContact CZ2-CE1 3.65Å; W324-F351 HydrophobicContact CZ2-CE1 3.65Å; W324-F351 AromaticContact CZ2-CE2 3.68Å; W324-F351 HydrophobicContact CZ2-CE2 3.68Å; W324-F351 AromaticContact CZ2-CG 3.73Å; W324-F351 HydrophobicContact CZ2-CG 3.73Å; W324-F351 AromaticContact CZ2-CZ 3.64Å; W324-F351 HydrophobicContact CZ2-CZ 3.64Å; W324-R746 WeakPolarHBondContact O-CD 3.37Å; W324-R746 PolarHBondContact O-NH1 3.38Å; W324-A749 HydrophobicContact CD2-CB 3.67Å; W324-A749 HydrophobicContact CE3-CB 3.83Å; W324-A749 HydrophobicContact CG-CB 4.36Å; W324-A749 HydrophobicContact CH2-CB 3.75Å; W324-A749 HydrophobicContact CZ2-CB 3.58Å; W324-A749 HydrophobicContact CZ3-CB 3.87Å; W324-V753 HydrophobicContact CE3-CG2 4.25Å; W324-V753 HydrophobicContact CZ3-CG2 3.89Å
325	A	89.8	Confident	84.8	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.228	C	C	.	.	I	π-helix	trans	-83.2	-0.3	-177.2	0	0	0	0	0	115.1	L320 Y321 A749 V753	L320-A325 PolarHBondContact O-N 3.05Å; L320-A325 VanDerWaalsContact O-N 3.1Å; Y321-A325 HydrophobicContact CD2-CB 4.15Å; Y321-A325 PolarHBondContact O-N 3.21Å; A325-A749 HydrophobicContact CB-CB 3.84Å; A325-A749 WeakPolarHBondContact CB-O 3.04Å; A325-V753 HydrophobicContact CB-CB 4.23Å; A325-V753 HydrophobicContact CB-CG2 4.16Å
326	S	86.7	Confident	85.1	Confident	36 Å²	36	48 Å²	48	25%	0.252	23%	0.225	S	C	.	.			trans	-82.2	128	175.2	176.3	0	0	0	0	112	Y321 W324 G328 V329	Y321-S326 PolarHBondContact O-N 3.21Å; Y321-S326 VanDerWaalsContact O-N 3.07Å; W324-S326 VanDerWaalsContact C-N 3.32Å; W324-S326 PolarHBondContact O-N 3.18Å; S326-G328 VanDerWaalsContact C-N 3.28Å; S326-G328 PolarHBondContact O-N 3.45Å; S326-V329 WeakPolarHBondContact O-CB 2.98Å; S326-V329 PolarHBondContact O-N 2.84Å
327	W	84.6	Confident	85.2	Confident	110 Å²	110	48.9 Å²	48.9	42%	0.417	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-53.8	-40.7	177.2	-65.1	108.3	0	0	0	113.2	V329 W330 I743 R746 L747	W327-V329 PolarHBondContact O-N 3.16Å; W327-W330 PolarHBondContact O-N 3.15Å; W327-I743 HydrophobicContact CH2-CG2 4.27Å; W327-I743 HydrophobicContact CZ3-CG2 4.04Å; W327-R746 HydrophobicContact CE3-CB 3.84Å; W327-R746 HydrophobicContact CZ3-CB 3.87Å; W327-L747 HydrophobicContact CH2-CB 3.81Å; W327-L747 HydrophobicContact CH2-CG 4.05Å
328	G	81.5	Confident	85.1	Confident	53 Å²	53	48.8 Å²	48.8	55%	0.546	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-66.8	-0.3	177.5	0	0	0	0	0	115.1	S326 Y331	S326-G328 VanDerWaalsContact C-N 3.28Å; S326-G328 PolarHBondContact O-N 3.45Å; G328-Y331 WeakPolarHBondContact O-CE1 3.4Å
329	V	84.3	Confident	85.3	Confident	14 Å²	14	48.7 Å²	48.7	9%	0.085	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-113.7	12.7	-175.9	-170.1	0	0	0	0	111.8	C323 S326 W327 Y331 K332 R746	C323-V329 WeakPolarHBondContact O-CG1 3.5Å; S326-V329 WeakPolarHBondContact O-CB 2.98Å; S326-V329 PolarHBondContact O-N 2.84Å; W327-V329 PolarHBondContact O-N 3.16Å; V329-Y331 PolarHBondContact O-N 3.37Å; V329-K332 HydrophobicContact CG1-CB 3.99Å; V329-K332 HydrophobicContact CG1-CD 3.57Å; V329-K332 HydrophobicContact CG1-CG 3.84Å; V329-K332 PolarHBondContact O-N 2.94Å; V329-R746 PolarHBondContact O-NH1 2.98Å; V329-R746 PolarHBondContact O-NH2 2.8Å
330	W	82.4	Confident	85.5	Confident	153 Å²	153	50.1 Å²	50.1	58%	0.58	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.6	-33.6	-177.4	69.2	-93.8	0	0	0	115	W327 K332 I742 R746	W327-W330 PolarHBondContact O-N 3.15Å; W330-K332 PolarHBondContact O-N 3.48Å; W330-I742 HydrophobicContact CE3-CG2 4Å; W330-R746 VanDerWaalsContact C-NH2 3.35Å; W330-R746 HydrophobicContact CB-CG 4.5Å; W330-R746 PolarHBondContact O-NH2 3.26Å
331	Y	80.8	Confident	85.4	Confident	109 Å²	109	53.6 Å²	53.6	43%	0.427	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-7.2	-177.4	65	-93.4	0	0	0	115.6	M218 G328 V329	M218-Y331 WeakPolarHBondContact CE-O 3.3Å; G328-Y331 WeakPolarHBondContact O-CE1 3.4Å; V329-Y331 PolarHBondContact O-N 3.37Å
332	K	79.4	Confident	85.4	Confident	83 Å²	83	52 Å²	52	36%	0.361	24%	0.243	S	C	.	.	S	Bend	trans	-93.4	145.2	179.9	-58.7	-171.2	-162	159.7	0	112.1	V329 W330 R746	V329-K332 HydrophobicContact CG1-CB 3.99Å; V329-K332 HydrophobicContact CG1-CD 3.57Å; V329-K332 HydrophobicContact CG1-CG 3.84Å; V329-K332 PolarHBondContact O-N 2.94Å; W330-K332 PolarHBondContact O-N 3.48Å; K332-R746 PolarHBondContact O-NH2 3.04Å
333	Y	77.7	Confident	85.7	Confident	161 Å²	161	49.1 Å²	49.1	63%	0.631	23%	0.23	S	C	*	.	P	Polyproline II helix	trans	-58.3	151.2	170.2	-78.2	-77.2	0	0	0	111.5	M218	M218-Y333 HydrophobicContact CB-CD2 3.6Å; M218-Y333 HydrophobicContact CB-CE2 3.9Å; M218-Y333 HydrophobicContact CG-CD2 3.46Å; M218-Y333 VanDerWaalsContact CG-CD2 3.46Å; M218-Y333 HydrophobicContact CG-CE2 3.9Å; M218-Y333 HydrophobicContact CG-CG 4.38Å; M218-Y333 VanDerWaalsContact O-CD2 3.28Å; M218-Y333 WeakPolarHBondContact O-CD2 3.21Å; M218-Y333 HydrophobicContact SD-CD2 3.47Å; M218-Y333 WeakPolarHBondContact SD-CD2 3.34Å; M218-Y333 HydrophobicContact SD-CE2 3.36Å; M218-Y333 WeakPolarHBondContact SD-CE2 3.22Å; M218-Y333 HydrophobicContact SD-CG 4.34Å
334	Q	84.6	Confident	86	Confident	30 Å²	30	47.6 Å²	47.6	14%	0.14	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-74.7	135.1	-179.5	-52.3	-171.8	52.4	0	0	111.2	L336 F351 I745	Q334-L336 HydrophobicContact CB-CD2 4.03Å; Q334-L336 HydrophobicContact CB-CG 4.39Å; Q334-L336 PolarHBondContact O-N 3.02Å; Q334-F351 PolarHBondContact NE2-O 3.2Å; Q334-I745 HydrophobicContact CG-CG2 4.11Å
335	P	88.9	Confident	86	Confident	16 Å²	16	48.8 Å²	48.8	10%	0.104	23%	0.226	C	C	.	.			trans	-82	67.2	177.9	35.2	-35.2	0	0	0	110.8	L220 W324 D337 L338 V339	L220-P335 HydrophobicContact CD2-CB 4.43Å; W324-P335 HydrophobicContact CB-CG 3.85Å; W324-P335 HydrophobicContact CG-CG 4.22Å; P335-D337 PolarHBondContact O-N 3.46Å; P335-D337 VanDerWaalsContact O-N 3.12Å; P335-L338 HydrophobicContact CB-CB 4.28Å; P335-L338 WeakPolarHBondContact O-CB 3.22Å; P335-L338 PolarHBondContact O-N 3.17Å; P335-V339 PolarHBondContact O-N 3.32Å; P335-V339 VanDerWaalsContact O-N 3.12Å
336	L	86.9	Confident	86	Confident	25 Å²	25	50.9 Å²	50.9	13%	0.131	24%	0.235	C	C	.	.	H	α-helix	trans	-52.6	-37.8	-169.5	-63.4	174.7	0	0	0	113.9	Q334 V339 R340 F351 A352 W456	Q334-L336 HydrophobicContact CB-CD2 4.03Å; Q334-L336 HydrophobicContact CB-CG 4.39Å; Q334-L336 PolarHBondContact O-N 3.02Å; L336-V339 WeakPolarHBondContact O-CB 3.43Å; L336-V339 PolarHBondContact O-N 3.34Å; L336-R340 PolarHBondContact O-N 3.31Å; L336-F351 HydrophobicContact CD2-CB 4.1Å; L336-A352 HydrophobicContact CD1-CB 3.8Å; L336-A352 HydrophobicContact CD2-CB 4.05Å; L336-W456 HydrophobicContact CB-CZ2 4.18Å
337	D	85.3	Confident	86.3	Confident	82 Å²	82	49.4 Å²	49.4	44%	0.439	22%	0.224	S	C	.	.	H	α-helix	trans	-72.9	-30.6	-176.6	-46.8	-58.7	0	0	0	112	P335 R341 W456	P335-D337 PolarHBondContact O-N 3.46Å; P335-D337 VanDerWaalsContact O-N 3.12Å; D337-R341 WeakPolarHBondContact O-CB 3.48Å; D337-R341 PolarHBondContact O-N 3.07Å; D337-W456 PolarHBondContact OD1-NE1 3.27Å
338	L	86.1	Confident	86.7	Confident	8 Å²	8	44.1 Å²	44.1	4%	0.042	20%	0.204	C	C	.	.	H	α-helix	trans	-72.2	-36.8	170.6	-175.3	66.9	0	0	0	111.4	L319 L320 P335 R341 Y342	L319-L338 HydrophobicContact CD2-CD1 4.15Å; L319-L338 HydrophobicContact CD2-CD2 3.63Å; L319-L338 HydrophobicContact CG-CD2 3.74Å; L320-L338 HydrophobicContact CD2-CB 4.37Å; L320-L338 HydrophobicContact CD2-CD2 3.75Å; L320-L338 HydrophobicContact CD2-CG 3.79Å; L320-L338 HydrophobicContact CG-CD2 3.86Å; L320-L338 HydrophobicContact CG-CG 3.99Å; P335-L338 HydrophobicContact CB-CB 4.28Å; P335-L338 WeakPolarHBondContact O-CB 3.22Å; P335-L338 PolarHBondContact O-N 3.17Å; L338-R341 PolarHBondContact O-N 3.03Å; L338-Y342 PolarHBondContact O-N 3.49Å; L338-Y342 VanDerWaalsContact O-N 3.13Å
339	V	90.6	Very high	87.2	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-62.6	-47.4	172.7	177.3	0	0	0	0	110.1	L320 W324 P335 L336 R341 Y342 F343 I347 F351	L320-V339 HydrophobicContact CD2-CG2 3.9Å; W324-V339 HydrophobicContact CD2-CG2 4.09Å; W324-V339 HydrophobicContact CE3-CG2 4.05Å; W324-V339 HydrophobicContact CH2-CG1 4.21Å; W324-V339 HydrophobicContact CH2-CG2 3.94Å; W324-V339 HydrophobicContact CZ2-CG2 3.96Å; W324-V339 HydrophobicContact CZ3-CG2 3.98Å; P335-V339 PolarHBondContact O-N 3.32Å; P335-V339 VanDerWaalsContact O-N 3.12Å; L336-V339 WeakPolarHBondContact O-CB 3.43Å; L336-V339 PolarHBondContact O-N 3.34Å; V339-R341 PolarHBondContact O-N 3.13Å; V339-Y342 PolarHBondContact O-N 2.71Å; V339-F343 HydrophobicContact CG1-CD2 4.19Å; V339-F343 PolarHBondContact O-N 3.37Å; V339-I347 HydrophobicContact CG1-CG2 4.42Å; V339-F351 HydrophobicContact CG1-CD2 4.01Å
340	R	89	Confident	87.7	Confident	39 Å²	39	41.2 Å²	41.2	15%	0.147	18%	0.175	C	C	.	.	H	α-helix	trans	-53.8	-52.3	170.9	172.5	-173	175.5	-154.4	8.7	111.2	L336 Y342 G344 E345 W456 D457	L336-R340 PolarHBondContact O-N 3.31Å; R340-Y342 PolarHBondContact O-N 3.32Å; R340-G344 VanDerWaalsContact O-CA 3.24Å; R340-G344 WeakPolarHBondContact O-CA 3.36Å; R340-G344 PolarHBondContact O-N 2.85Å; R340-E345 HydrophobicContact CG-CG 4.03Å; R340-E345 IonicContact CZ-OE1 2.65Å; R340-E345 IonicContact NE-OE1 2.8Å; R340-E345 PolarHBondContact NE-OE1 3.26Å; R340-E345 IonicContact NH2-OE1 2.73Å; R340-W456 HydrophobicContact CB-CZ2 4.44Å; R340-W456 PolarHBondContact NH2-O 2.88Å; R340-D457 IonicContact CZ-OD2 2.74Å; R340-D457 IonicContact NH1-OD2 3.88Å; R340-D457 IonicContact NH2-OD2 3.93Å; R340-D457 PolarHBondContact NH2-OD2 3.19Å
341	R	86.8	Confident	88.2	Confident	73 Å²	73	33.9 Å²	33.9	28%	0.275	15%	0.147	S	C	.	.	H	α-helix	trans	-60.4	-29.2	-175.8	-167.5	174.2	-175.7	177.8	1.2	113.3	D227 N256 D337 L338 V339	D227-R341 PolarHBondContact O-NH1 3.37Å; N256-R341 PolarHBondContact OD1-NE 2.91Å; N256-R341 PolarHBondContact OD1-NH2 3.01Å; D337-R341 WeakPolarHBondContact O-CB 3.48Å; D337-R341 PolarHBondContact O-N 3.07Å; L338-R341 PolarHBondContact O-N 3.03Å; V339-R341 PolarHBondContact O-N 3.13Å
342	Y	90.6	Very high	88.8	Confident	4 Å²	4	29 Å²	29	2%	0.016	13%	0.13	C	C	.	.	H	α-helix	trans	-97.5	-39.9	-177.6	-167.2	-101.2	0	0	0	114.6	H298 E299 H316 R317 L320 L338 V339 R340 R758	H298-Y342 AromaticContact ND1-CE1 3.88Å; H298-Y342 AromaticContact ND1-CZ 3.84Å; H298-Y342 PolarHBondContact ND1-OH 3.42Å; E299-Y342 HydrophobicContact CB-CE2 4.31Å; E299-Y342 HydrophobicContact CG-CE2 4.16Å; E299-Y342 PolarHBondContact N-OH 3.12Å; E299-Y342 WeakPolarHBondContact OE1-CE2 3.44Å; H316-Y342 HydrophobicContact CB-CD2 3.86Å; H316-Y342 HydrophobicContact CB-CE2 4.14Å; R317-Y342 WeakPolarHBondContact CB-OH 3.28Å; L320-Y342 HydrophobicContact CD1-CD1 3.66Å; L320-Y342 HydrophobicContact CD1-CD2 4.31Å; L320-Y342 HydrophobicContact CD1-CE1 4.35Å; L320-Y342 HydrophobicContact CD1-CG 3.61Å; L338-Y342 PolarHBondContact O-N 3.49Å; L338-Y342 VanDerWaalsContact O-N 3.13Å; V339-Y342 PolarHBondContact O-N 2.71Å; R340-Y342 PolarHBondContact O-N 3.32Å; Y342-R758 VanDerWaalsContact CD2-NH2 3.32Å; Y342-R758 PolarHBondContact O-NE 3.1Å; Y342-R758 PolarHBondContact O-NH2 2.82Å
343	F	91.8	Very high	89.5	Confident	1 Å²	1	25.1 Å²	25.1	0%	0.004	11%	0.113	C	C	.	.	H	α-helix	trans	-111.5	-10.3	-173.7	-67.7	-68.7	0	0	0	114.7	L320 W324 V339 I347 F752 V753 P759 A761	L320-F343 HydrophobicContact CD1-CE2 4.2Å; W324-F343 HydrophobicContact CZ3-CE2 4.19Å; V339-F343 HydrophobicContact CG1-CD2 4.19Å; V339-F343 PolarHBondContact O-N 3.37Å; F343-I347 HydrophobicContact CB-CB 4Å; F343-I347 HydrophobicContact CB-CD1 4.01Å; F343-I347 HydrophobicContact CB-CG2 3.9Å; F343-I347 HydrophobicContact CG-CG2 4.38Å; F343-F752 HydrophobicContact CE1-CB 4.4Å; F343-F752 HydrophobicContact CE2-CB 4.47Å; F343-F752 HydrophobicContact CZ-CB 4.01Å; F343-F752 WeakPolarHBondContact CZ-O 3.38Å; F343-V753 HydrophobicContact CE2-CG2 4.2Å; F343-V753 HydrophobicContact CZ-CG2 4.13Å; F343-P759 HydrophobicContact CD1-CG 3.89Å; F343-P759 HydrophobicContact CE1-CG 4.41Å; F343-A761 WeakPolarHBondContact O-CA 3.35Å
344	G	90.3	Very high	90.3	Very high	2 Å²	2	17.4 Å²	17.4	2%	0.021	8%	0.083	C	C	.	.			trans	92	165.1	-177.2	0	0	0	0	0	114.4	R340 K346 I347 G348	R340-G344 VanDerWaalsContact O-CA 3.24Å; R340-G344 WeakPolarHBondContact O-CA 3.36Å; R340-G344 PolarHBondContact O-N 2.85Å; G344-K346 PolarHBondContact O-N 2.91Å; G344-I347 PolarHBondContact O-N 3.33Å; G344-G348 PolarHBondContact O-N 3.29Å; G344-G348 VanDerWaalsContact O-N 3.11Å
345	E	88.9	Confident	90.6	Very high	26 Å²	26	17.3 Å²	17.3	12%	0.121	9%	0.089	C	C	.	.	H	α-helix	trans	-62	-38.8	-173.2	-68.5	73.5	-163.8	0	0	113.1	R340 I347 G348 L349 W456 L458 S762	R340-E345 HydrophobicContact CG-CG 4.03Å; R340-E345 IonicContact CZ-OE1 2.65Å; R340-E345 IonicContact NE-OE1 2.8Å; R340-E345 PolarHBondContact NE-OE1 3.26Å; R340-E345 IonicContact NH2-OE1 2.73Å; E345-I347 VanDerWaalsContact C-N 3.34Å; E345-I347 PolarHBondContact O-N 3.29Å; E345-G348 PolarHBondContact O-N 3.11Å; E345-L349 WeakPolarHBondContact O-CB 3.43Å; E345-L349 PolarHBondContact O-N 2.94Å; E345-W456 HydrophobicContact CB-CE3 4.24Å; E345-W456 HydrophobicContact CG-CB 4.48Å; E345-W456 HydrophobicContact CG-CE3 4.2Å; E345-L458 HydrophobicContact CB-CD1 4.19Å; E345-L458 HydrophobicContact CB-CD2 4.47Å; E345-L458 HydrophobicContact CG-CD1 4.1Å; E345-L458 HydrophobicContact CG-CD2 4.25Å; E345-L458 HydrophobicContact CG-CG 4.44Å; E345-S762 PolarHBondContact N-O 2.93Å
346	K	89.6	Confident	90.7	Very high	43 Å²	43	19.7 Å²	19.7	19%	0.187	10%	0.096	C	C	.	.	H	α-helix	trans	-59.8	-40.9	-177.8	-172.7	174.8	-175.1	170.4	0	113	G344 Y350 E589 L709 S762 A764	G344-K346 PolarHBondContact O-N 2.91Å; K346-Y350 PolarHBondContact O-N 3.26Å; K346-E589 IonicContact NZ-OE1 2.62Å; K346-E589 PolarHBondContact NZ-OE1 2.83Å; K346-E589 IonicContact NZ-OE2 2.92Å; K346-E589 PolarHBondContact NZ-OE2 3.48Å; K346-L709 HydrophobicContact CG-CD1 4.05Å; K346-S762 WeakPolarHBondContact CB-O 3.35Å; K346-S762 PolarHBondContact N-O 3.38Å; K346-A764 HydrophobicContact CB-CB 3.98Å; K346-A764 HydrophobicContact CG-CB 3.98Å
347	I	92.6	Very high	91.1	Very high	5 Å²	5	18.5 Å²	18.5	3%	0.026	9%	0.09	C	C	.	.	H	α-helix	trans	-77.9	-40.8	177.5	-66.9	170.6	0	0	0	110.3	V339 F343 G344 E345 L349 Y350 F351 L709 F752 P759	V339-I347 HydrophobicContact CG1-CG2 4.42Å; F343-I347 HydrophobicContact CB-CB 4Å; F343-I347 HydrophobicContact CB-CD1 4.01Å; F343-I347 HydrophobicContact CB-CG2 3.9Å; F343-I347 HydrophobicContact CG-CG2 4.38Å; G344-I347 PolarHBondContact O-N 3.33Å; E345-I347 VanDerWaalsContact C-N 3.34Å; E345-I347 PolarHBondContact O-N 3.29Å; I347-L349 PolarHBondContact O-N 3.24Å; I347-Y350 PolarHBondContact O-N 3.28Å; I347-F351 HydrophobicContact CG2-CD2 3.91Å; I347-F351 HydrophobicContact CG2-CE2 3.72Å; I347-F351 VanDerWaalsContact O-CD2 3.28Å; I347-F351 WeakPolarHBondContact O-CD2 3.36Å; I347-F351 PolarHBondContact O-N 3.29Å; I347-L709 HydrophobicContact CG1-CD1 3.99Å; I347-L709 HydrophobicContact CG1-CD2 4.26Å; I347-L709 HydrophobicContact CG1-CG 4.47Å; I347-F752 HydrophobicContact CD1-CD1 4.45Å; I347-F752 HydrophobicContact CD1-CE1 3.94Å; I347-F752 HydrophobicContact CG1-CE1 4.4Å; I347-F752 HydrophobicContact CG2-CE1 4.31Å; I347-P759 HydrophobicContact CD1-CB 3.91Å; I347-P759 HydrophobicContact CD1-CG 3.32Å
348	G	92.6	Very high	91.5	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-55.7	-38.8	172.2	0	0	0	0	0	112.8	G344 E345 F351 A352 W456	G344-G348 PolarHBondContact O-N 3.29Å; G344-G348 VanDerWaalsContact O-N 3.11Å; E345-G348 PolarHBondContact O-N 3.11Å; G348-F351 PolarHBondContact O-N 2.9Å; G348-A352 WeakPolarHBondContact O-CB 3.39Å; G348-A352 PolarHBondContact O-N 2.72Å; G348-W456 VanDerWaalsContact C-CH2 3.46Å
349	L	91.9	Very high	91.7	Very high	3 Å²	3	16.6 Å²	16.6	2%	0.016	9%	0.09	C	C	.	.	H	α-helix	trans	-71.1	-37	-178.9	-170.5	64.2	0	0	0	112.8	E345 I347 A352 W353 W445 I452 W456 D766 I767	E345-L349 WeakPolarHBondContact O-CB 3.43Å; E345-L349 PolarHBondContact O-N 2.94Å; I347-L349 PolarHBondContact O-N 3.24Å; L349-A352 PolarHBondContact O-N 3.45Å; L349-W353 WeakPolarHBondContact O-CB 3.44Å; L349-W353 PolarHBondContact O-N 2.9Å; L349-W445 HydrophobicContact CD1-CH2 3.99Å; L349-W445 HydrophobicContact CD1-CZ2 4.08Å; L349-I452 HydrophobicContact CD1-CG2 4.09Å; L349-W456 HydrophobicContact CB-CZ3 4.11Å; L349-W456 HydrophobicContact CD1-CZ3 4.46Å; L349-D766 VanDerWaalsContact CD2-O 3.29Å; L349-D766 WeakPolarHBondContact CD2-O 3.47Å; L349-I767 HydrophobicContact CD2-CG2 4.06Å; L349-I767 HydrophobicContact CG-CG2 4.14Å
350	Y	94.3	Very high	91.7	Very high	2 Å²	2	18 Å²	18	1%	0.008	10%	0.097	C	C	.	.	H	α-helix	trans	-57.2	-52.4	171.5	167.2	-104.1	0	0	0	110.8	K346 I347 A352 W353 L354 E712 Y713 D748	K346-Y350 PolarHBondContact O-N 3.26Å; I347-Y350 PolarHBondContact O-N 3.28Å; Y350-A352 VanDerWaalsContact C-N 3.29Å; Y350-A352 PolarHBondContact O-N 3.25Å; Y350-W353 PolarHBondContact O-N 2.78Å; Y350-W353 VanDerWaalsContact O-N 3.12Å; Y350-L354 HydrophobicContact CE1-CD2 4.2Å; Y350-L354 WeakPolarHBondContact O-CB 3.26Å; Y350-L354 PolarHBondContact O-N 2.85Å; Y350-E712 HydrophobicContact CD2-CB 4.46Å; Y350-E712 HydrophobicContact CE1-CB 4.37Å; Y350-E712 HydrophobicContact CE2-CB 3.73Å; Y350-Y713 VanDerWaalsContact CA-OH 3.3Å; Y350-Y713 WeakPolarHBondContact CA-OH 2.99Å; Y350-Y713 AromaticContact CD2-CD1 3.99Å; Y350-Y713 HydrophobicContact CD2-CD1 3.99Å; Y350-Y713 HydrophobicContact CD2-CD2 4.07Å; Y350-Y713 AromaticContact CD2-CE1 3.81Å; Y350-Y713 HydrophobicContact CD2-CE1 3.81Å; Y350-Y713 AromaticContact CD2-CE2 3.89Å; Y350-Y713 HydrophobicContact CD2-CE2 3.89Å; Y350-Y713 HydrophobicContact CD2-CG 4.13Å; Y350-Y713 AromaticContact CD2-CZ 3.77Å; Y350-Y713 HydrophobicContact CE2-CD1 4.47Å; Y350-Y713 HydrophobicContact CG-CE2 4.41Å; Y350-Y713 PolarHBondContact N-OH 2.9Å; Y350-D748 WeakPolarHBondContact CE1-OD2 3.48Å; Y350-D748 VanDerWaalsContact CZ-OD2 3.3Å; Y350-D748 PolarHBondContact OH-OD2 2.84Å
351	F	94.2	Very high	92	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-64.2	-32.2	177.4	-75.4	-63.8	0	0	0	113.7	W324 Q334 L336 V339 I347 G348 G355 D748 F752	W324-F351 AromaticContact CH2-CD2 3.95Å; W324-F351 HydrophobicContact CH2-CD2 3.95Å; W324-F351 HydrophobicContact CH2-CE1 4.25Å; W324-F351 AromaticContact CH2-CE2 3.6Å; W324-F351 HydrophobicContact CH2-CE2 3.6Å; W324-F351 HydrophobicContact CH2-CG 4.43Å; W324-F351 AromaticContact CH2-CZ 3.76Å; W324-F351 HydrophobicContact CH2-CZ 3.76Å; W324-F351 AromaticContact CZ2-CD1 3.69Å; W324-F351 HydrophobicContact CZ2-CD1 3.69Å; W324-F351 AromaticContact CZ2-CD2 3.71Å; W324-F351 HydrophobicContact CZ2-CD2 3.71Å; W324-F351 AromaticContact CZ2-CE1 3.65Å; W324-F351 HydrophobicContact CZ2-CE1 3.65Å; W324-F351 AromaticContact CZ2-CE2 3.68Å; W324-F351 HydrophobicContact CZ2-CE2 3.68Å; W324-F351 AromaticContact CZ2-CG 3.73Å; W324-F351 HydrophobicContact CZ2-CG 3.73Å; W324-F351 AromaticContact CZ2-CZ 3.64Å; W324-F351 HydrophobicContact CZ2-CZ 3.64Å; Q334-F351 PolarHBondContact NE2-O 3.2Å; L336-F351 HydrophobicContact CD2-CB 4.1Å; V339-F351 HydrophobicContact CG1-CD2 4.01Å; I347-F351 HydrophobicContact CG2-CD2 3.91Å; I347-F351 HydrophobicContact CG2-CE2 3.72Å; I347-F351 VanDerWaalsContact O-CD2 3.28Å; I347-F351 WeakPolarHBondContact O-CD2 3.36Å; I347-F351 PolarHBondContact O-N 3.29Å; G348-F351 PolarHBondContact O-N 2.9Å; F351-G355 PolarHBondContact O-N 2.68Å; F351-D748 HydrophobicContact CE1-CB 3.62Å; F351-D748 HydrophobicContact CZ-CB 3.78Å; F351-F752 HydrophobicContact CE2-CD2 4.05Å; F351-F752 HydrophobicContact CE2-CE2 4.22Å; F351-F752 AromaticContact CZ-CD2 3.77Å; F351-F752 HydrophobicContact CZ-CD2 3.77Å; F351-F752 HydrophobicContact CZ-CE2 4.01Å
352	A	92.6	Very high	92.3	Very high	7 Å²	7	18.1 Å²	18.1	6%	0.058	10%	0.101	C	C	.	.	H	α-helix	trans	-68.9	-36.9	173.2	0	0	0	0	0	112.8	L336 G348 L349 Y350 W356 W445 I452 W456	L336-A352 HydrophobicContact CD1-CB 3.8Å; L336-A352 HydrophobicContact CD2-CB 4.05Å; G348-A352 WeakPolarHBondContact O-CB 3.39Å; G348-A352 PolarHBondContact O-N 2.72Å; L349-A352 PolarHBondContact O-N 3.45Å; Y350-A352 VanDerWaalsContact C-N 3.29Å; Y350-A352 PolarHBondContact O-N 3.25Å; A352-W356 VanDerWaalsContact O-CB 3.3Å; A352-W356 WeakPolarHBondContact O-CB 3.39Å; A352-W356 PolarHBondContact O-N 3.23Å; A352-W356 VanDerWaalsContact O-N 3.1Å; A352-W445 HydrophobicContact CB-CH2 4.44Å; A352-I452 HydrophobicContact CB-CD1 3.81Å; A352-W456 HydrophobicContact CB-CH2 4.5Å
353	W	94.8	Very high	92.5	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-71.3	-49.4	174.4	175.6	76.2	0	0	0	111.4	L349 Y350 G355 W356 Y357 F441 W445 Y713 M716 I717 I767 L774	L349-W353 WeakPolarHBondContact O-CB 3.44Å; L349-W353 PolarHBondContact O-N 2.9Å; Y350-W353 PolarHBondContact O-N 2.78Å; Y350-W353 VanDerWaalsContact O-N 3.12Å; W353-G355 VanDerWaalsContact C-N 3.35Å; W353-G355 PolarHBondContact O-N 3.39Å; W353-W356 CarbonylContact O-C 3.59Å; W353-W356 WeakPolarHBondContact O-CA 3.46Å; W353-W356 WeakPolarHBondContact O-CB 3.35Å; W353-W356 PolarHBondContact O-N 3.19Å; W353-Y357 HydrophobicContact CH2-CD1 4.15Å; W353-Y357 HydrophobicContact CZ2-CD1 4.48Å; W353-Y357 WeakPolarHBondContact O-CB 3.48Å; W353-Y357 PolarHBondContact O-N 3.26Å; W353-F441 HydrophobicContact CZ2-CZ 4.45Å; W353-F441 AromaticContact NE1-CZ 3.82Å; W353-W445 HydrophobicContact CB-CH2 3.66Å; W353-W445 HydrophobicContact CB-CZ2 3.66Å; W353-W445 HydrophobicContact CB-CZ3 4.26Å; W353-W445 AromaticContact CD1-CD2 3.8Å; W353-W445 AromaticContact CD1-CE2 3.51Å; W353-W445 AromaticContact CD1-CZ2 3.83Å; W353-W445 AromaticContact CD1-NE1 3.63Å; W353-W445 HydrophobicContact CG-CH2 4.45Å; W353-W445 HydrophobicContact CG-CZ2 4.14Å; W353-Y713 HydrophobicContact CD2-CE1 4.3Å; W353-Y713 HydrophobicContact CE3-CD1 4.07Å; W353-Y713 AromaticContact CE3-CE1 3.98Å; W353-Y713 HydrophobicContact CE3-CE1 3.98Å; W353-Y713 HydrophobicContact CZ3-CD1 4.19Å; W353-M716 HydrophobicContact CH2-CB 3.56Å; W353-M716 HydrophobicContact CZ3-CB 3.47Å; W353-M716 VanDerWaalsContact CZ3-CB 3.47Å; W353-M716 HydrophobicContact CZ3-CG 4.1Å; W353-I717 HydrophobicContact CH2-CG1 3.9Å; W353-I717 HydrophobicContact CZ2-CG1 4.22Å; W353-I767 HydrophobicContact CB-CG2 4.39Å; W353-L774 HydrophobicContact CZ2-CD1 3.86Å; W353-L774 HydrophobicContact CZ2-CD2 4.46Å
354	L	93.4	Very high	92.6	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-58.3	-47.1	177.4	179	57.3	0	0	0	110.7	Y350 W356 Y357 T358 M716 I745	Y350-L354 HydrophobicContact CE1-CD2 4.2Å; Y350-L354 WeakPolarHBondContact O-CB 3.26Å; Y350-L354 PolarHBondContact O-N 2.85Å; L354-W356 VanDerWaalsContact C-N 3.28Å; L354-W356 PolarHBondContact O-N 3.45Å; L354-Y357 HydrophobicContact CD1-CD1 4.46Å; L354-Y357 PolarHBondContact O-N 3.38Å; L354-T358 PolarHBondContact O-N 3.15Å; L354-T358 PolarHBondContact O-OG1 3.04Å; L354-M716 HydrophobicContact CD1-CG 3.98Å; L354-M716 HydrophobicContact CD1-SD 3.44Å; L354-M716 WeakPolarHBondContact CD1-SD 3.47Å; L354-I745 HydrophobicContact CD1-CG1 4.46Å; L354-I745 HydrophobicContact CD2-CG1 3.54Å; L354-I745 HydrophobicContact CG-CD1 4.15Å; L354-I745 HydrophobicContact CG-CG1 3.59Å
355	G	91.7	Very high	92.9	Very high	27 Å²	27	20.8 Å²	20.8	28%	0.278	12%	0.119	S	C	.	.	H	α-helix	trans	-61.7	-31.7	173.7	0	0	0	0	0	114.2	F351 W353 G359	F351-G355 PolarHBondContact O-N 2.68Å; W353-G355 VanDerWaalsContact C-N 3.35Å; W353-G355 PolarHBondContact O-N 3.39Å; G355-G359 PolarHBondContact O-N 3.45Å; G355-G359 VanDerWaalsContact O-N 3.07Å
356	W	91.1	Very high	93.2	Very high	66 Å²	66	26.6 Å²	26.6	25%	0.25	14%	0.144	C	C	.	.	H	α-helix	trans	-72.9	-44.6	174.5	-178.9	-100.6	0	0	0	112.2	A352 W353 L354 G359 M360 F441 F444 W445 R448	A352-W356 VanDerWaalsContact O-CB 3.3Å; A352-W356 WeakPolarHBondContact O-CB 3.39Å; A352-W356 PolarHBondContact O-N 3.23Å; A352-W356 VanDerWaalsContact O-N 3.1Å; W353-W356 CarbonylContact O-C 3.59Å; W353-W356 WeakPolarHBondContact O-CA 3.46Å; W353-W356 WeakPolarHBondContact O-CB 3.35Å; W353-W356 PolarHBondContact O-N 3.19Å; L354-W356 VanDerWaalsContact C-N 3.28Å; L354-W356 PolarHBondContact O-N 3.45Å; W356-G359 PolarHBondContact O-N 3Å; W356-M360 HydrophobicContact CD2-CG 4.42Å; W356-M360 HydrophobicContact CH2-SD 4.38Å; W356-M360 HydrophobicContact CZ2-CG 3.81Å; W356-M360 HydrophobicContact CZ2-SD 3.83Å; W356-M360 WeakPolarHBondContact O-CB 3.36Å; W356-M360 WeakPolarHBondContact O-CG 3.45Å; W356-M360 PolarHBondContact O-N 2.89Å; W356-F441 AromaticContact CD1-CD2 3.9Å; W356-F441 AromaticContact CD1-CE2 3.68Å; W356-F441 AromaticContact NE1-CD2 3.84Å; W356-F444 HydrophobicContact CH2-CB 4.23Å; W356-F444 HydrophobicContact CZ2-CB 3.49Å; W356-F444 VanDerWaalsContact CZ2-CB 3.49Å; W356-F444 HydrophobicContact CZ2-CG 4.43Å; W356-W445 HydrophobicContact CB-CE3 3.87Å; W356-W445 HydrophobicContact CB-CZ3 3.92Å; W356-W445 AromaticContact CD1-CE3 3.62Å; W356-W445 HydrophobicContact CD2-CE3 4.47Å; W356-W445 AromaticContact CG-CE3 3.69Å; W356-W445 HydrophobicContact CG-CE3 3.69Å; W356-W445 HydrophobicContact CG-CZ3 4.21Å; W356-R448 HydrophobicContact CD2-CB 4.5Å; W356-R448 HydrophobicContact CD2-CG 4.37Å; W356-R448 HydrophobicContact CE3-CB 4.47Å; W356-R448 HydrophobicContact CE3-CG 4.06Å
357	Y	94.6	Very high	93.5	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-58.5	-50.6	175	174.2	-144.5	0	0	0	111.2	W353 L354 G359 M360 L361 W437 F441 M716 Q719 F720 N741	W353-Y357 HydrophobicContact CH2-CD1 4.15Å; W353-Y357 HydrophobicContact CZ2-CD1 4.48Å; W353-Y357 WeakPolarHBondContact O-CB 3.48Å; W353-Y357 PolarHBondContact O-N 3.26Å; L354-Y357 HydrophobicContact CD1-CD1 4.46Å; L354-Y357 PolarHBondContact O-N 3.38Å; Y357-G359 VanDerWaalsContact C-N 3.34Å; Y357-G359 PolarHBondContact O-N 3.33Å; Y357-M360 CarbonylContact O-C 3.55Å; Y357-M360 PolarHBondContact O-N 3.45Å; Y357-M360 VanDerWaalsContact O-N 3.13Å; Y357-L361 HydrophobicContact CD2-CD1 4.04Å; Y357-L361 HydrophobicContact CD2-CG 3.97Å; Y357-L361 HydrophobicContact CE1-CD1 4.33Å; Y357-L361 HydrophobicContact CE2-CD1 3.66Å; Y357-L361 HydrophobicContact CE2-CD2 3.91Å; Y357-L361 HydrophobicContact CE2-CG 3.71Å; Y357-L361 WeakPolarHBondContact O-CG 3.49Å; Y357-L361 PolarHBondContact O-N 3.5Å; Y357-W437 HydrophobicContact CE2-CH2 4.25Å; Y357-F441 HydrophobicContact CD2-CE2 4.19Å; Y357-F441 HydrophobicContact CD2-CZ 4.14Å; Y357-F441 HydrophobicContact CG-CE2 4.46Å; Y357-F441 HydrophobicContact CG-CZ 4.38Å; Y357-M716 HydrophobicContact CE1-SD 4.4Å; Y357-Q719 PolarHBondContact OH-NE2 3.45Å; Y357-Q719 VanDerWaalsContact OH-NE2 3.09Å; Y357-F720 HydrophobicContact CD2-CD2 4.49Å; Y357-F720 AromaticContact CE2-CD2 3.89Å; Y357-F720 HydrophobicContact CE2-CD2 3.89Å; Y357-F720 PolarHBondContact OH-N 3.33Å; Y357-N741 WeakPolarHBondContact CD1-ND2 3.17Å; Y357-N741 WeakPolarHBondContact CE1-ND2 3.34Å
358	T	93.1	Very high	93.6	Very high	9 Å²	9	26.3 Å²	26.3	6%	0.055	14%	0.144	C	C	.	.	H	α-helix	trans	-59	-43.4	174.4	-47.1	0	0	0	0	112.1	L354 M360 L361 F362 L738 N741 I742 I745	L354-T358 PolarHBondContact O-N 3.15Å; L354-T358 PolarHBondContact O-OG1 3.04Å; T358-M360 VanDerWaalsContact C-N 3.3Å; T358-M360 PolarHBondContact O-N 2.93Å; T358-L361 PolarHBondContact O-N 2.89Å; T358-F362 VanDerWaalsContact O-CD2 3.25Å; T358-F362 WeakPolarHBondContact O-CD2 3.3Å; T358-L738 HydrophobicContact CG2-CD1 3.84Å; T358-N741 HydrophobicContact CG2-CB 3.76Å; T358-N741 VanDerWaalsContact OG1-CB 3.28Å; T358-N741 WeakPolarHBondContact OG1-CB 3.38Å; T358-N741 PolarHBondContact OG1-ND2 2.84Å; T358-I742 HydrophobicContact CG2-CG1 4.14Å; T358-I745 HydrophobicContact CG2-CD1 4.21Å; T358-I745 WeakPolarHBondContact OG1-CD1 3.21Å
359	G	90.9	Very high	93.7	Very high	42 Å²	42	29.4 Å²	29.4	43%	0.433	16%	0.161	S	C	.	.	H	α-helix	trans	-61.3	-36	175.9	0	0	0	0	0	113.6	G355 W356 Y357	G355-G359 PolarHBondContact O-N 3.45Å; G355-G359 VanDerWaalsContact O-N 3.07Å; W356-G359 PolarHBondContact O-N 3Å; Y357-G359 VanDerWaalsContact C-N 3.34Å; Y357-G359 PolarHBondContact O-N 3.33Å
360	M	91.4	Very high	93.8	Very high	30 Å²	30	35.7 Å²	35.7	15%	0.148	19%	0.188	C	C	.	.	H	α-helix	trans	-82.1	-22.5	177.2	-73	-64.4	-65.4	0	0	113.4	W356 Y357 T358 F362 P363 W437 V440 F441	W356-M360 HydrophobicContact CD2-CG 4.42Å; W356-M360 HydrophobicContact CH2-SD 4.38Å; W356-M360 HydrophobicContact CZ2-CG 3.81Å; W356-M360 HydrophobicContact CZ2-SD 3.83Å; W356-M360 WeakPolarHBondContact O-CB 3.36Å; W356-M360 WeakPolarHBondContact O-CG 3.45Å; W356-M360 PolarHBondContact O-N 2.89Å; Y357-M360 CarbonylContact O-C 3.55Å; Y357-M360 PolarHBondContact O-N 3.45Å; Y357-M360 VanDerWaalsContact O-N 3.13Å; T358-M360 VanDerWaalsContact C-N 3.3Å; T358-M360 PolarHBondContact O-N 2.93Å; M360-F362 VanDerWaalsContact C-N 3.33Å; M360-F362 PolarHBondContact O-N 3.01Å; M360-P363 VanDerWaalsContact O-CD 3.22Å; M360-P363 WeakPolarHBondContact O-CD 3.49Å; M360-P363 VanDerWaalsContact O-CG 3.27Å; M360-P363 WeakPolarHBondContact O-CG 3.44Å; M360-W437 HydrophobicContact CB-CZ2 4.19Å; M360-W437 PolarHBondContact O-NE1 3.1Å; M360-V440 HydrophobicContact CE-CG1 4.03Å; M360-F441 HydrophobicContact CB-CD2 4.01Å; M360-F441 HydrophobicContact CE-CB 4.43Å; M360-F441 HydrophobicContact CG-CD2 4.1Å
361	L	94.2	Very high	93.8	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-67.2	-29	175.6	-82.1	172	0	0	0	113.1	Y357 T358 A364 A365 W437 P734 A737 L738	Y357-L361 HydrophobicContact CD2-CD1 4.04Å; Y357-L361 HydrophobicContact CD2-CG 3.97Å; Y357-L361 HydrophobicContact CE1-CD1 4.33Å; Y357-L361 HydrophobicContact CE2-CD1 3.66Å; Y357-L361 HydrophobicContact CE2-CD2 3.91Å; Y357-L361 HydrophobicContact CE2-CG 3.71Å; Y357-L361 WeakPolarHBondContact O-CG 3.49Å; Y357-L361 PolarHBondContact O-N 3.5Å; T358-L361 PolarHBondContact O-N 2.89Å; L361-A364 WeakPolarHBondContact O-CB 3.5Å; L361-A364 PolarHBondContact O-N 2.7Å; L361-A365 WeakPolarHBondContact O-CB 3.39Å; L361-A365 PolarHBondContact O-N 3.32Å; L361-W437 HydrophobicContact CD2-CH2 3.93Å; L361-W437 HydrophobicContact CD2-CZ2 3.99Å; L361-W437 HydrophobicContact CG-CZ2 4.34Å; L361-P734 HydrophobicContact CD2-CB 4.09Å; L361-A737 HydrophobicContact CD1-CB 4.15Å; L361-L738 HydrophobicContact CB-CB 4.19Å; L361-L738 HydrophobicContact CB-CD1 4.06Å
362	F	93.5	Very high	93.8	Very high	113 Å²	113	37.8 Å²	37.8	50%	0.496	20%	0.197	S	C	.	.	H	α-helix	trans	-48.5	-55.2	178.8	-81.4	-82.3	0	0	0	115	T358 M360 A364 A365 F366 L738 I742	T358-F362 VanDerWaalsContact O-CD2 3.25Å; T358-F362 WeakPolarHBondContact O-CD2 3.3Å; M360-F362 VanDerWaalsContact C-N 3.33Å; M360-F362 PolarHBondContact O-N 3.01Å; F362-A364 VanDerWaalsContact C-N 3.31Å; F362-A364 PolarHBondContact O-N 2.88Å; F362-A365 PolarHBondContact O-N 3.23Å; F362-F366 WeakPolarHBondContact O-CB 3.42Å; F362-F366 PolarHBondContact O-N 3.38Å; F362-L738 HydrophobicContact CD1-CD1 4.4Å; F362-L738 HydrophobicContact CD1-CD2 3.78Å; F362-L738 HydrophobicContact CD2-CD1 3.9Å; F362-L738 HydrophobicContact CE1-CD1 4.28Å; F362-L738 HydrophobicContact CE1-CD2 3.97Å; F362-L738 HydrophobicContact CE2-CD1 3.76Å; F362-L738 HydrophobicContact CG-CD1 4.22Å; F362-L738 HydrophobicContact CG-CD2 4.13Å; F362-L738 HydrophobicContact CZ-CD1 3.96Å; F362-L738 HydrophobicContact CZ-CD2 4.47Å; F362-I742 HydrophobicContact CZ-CD1 4.45Å
363	P	94.3	Very high	93.8	Very high	59 Å²	59	41.7 Å²	41.7	38%	0.383	22%	0.217	S	C	.	.	H	α-helix	trans	-64.4	-31.7	176.7	23.6	-35	0	0	0	113.7	M360 I367	M360-P363 VanDerWaalsContact O-CD 3.22Å; M360-P363 WeakPolarHBondContact O-CD 3.49Å; M360-P363 VanDerWaalsContact O-CG 3.27Å; M360-P363 WeakPolarHBondContact O-CG 3.44Å; P363-I367 WeakPolarHBondContact O-CG1 3.05Å; P363-I367 PolarHBondContact O-N 2.61Å; P363-I367 VanDerWaalsContact O-N 3.13Å
364	A	95.3	Very high	93.7	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-69.6	-45.2	176.4	0	0	0	0	0	111.9	L361 F362 F366 I367 G368 F433 M434 W437 P734	L361-A364 WeakPolarHBondContact O-CB 3.5Å; L361-A364 PolarHBondContact O-N 2.7Å; F362-A364 VanDerWaalsContact C-N 3.31Å; F362-A364 PolarHBondContact O-N 2.88Å; A364-F366 VanDerWaalsContact C-N 3.34Å; A364-F366 PolarHBondContact O-N 2.93Å; A364-I367 PolarHBondContact O-N 2.68Å; A364-G368 PolarHBondContact O-N 3.33Å; A364-F433 HydrophobicContact CB-CE1 4.32Å; A364-M434 HydrophobicContact CB-CE 4.2Å; A364-M434 HydrophobicContact CB-SD 3.7Å; A364-W437 HydrophobicContact CB-CD2 4.24Å; A364-W437 HydrophobicContact CB-CG 4.41Å; A364-W437 HydrophobicContact CB-CZ2 4.41Å; A364-P734 HydrophobicContact CB-CB 3.84Å; A364-P734 HydrophobicContact CB-CG 4.29Å
365	A	95.9	Very high	93.6	Very high	5 Å²	5	46.8 Å²	46.8	4%	0.041	24%	0.237	C	C	.	.	H	α-helix	trans	-61.4	-40.6	174.1	0	0	0	0	0	112	L361 F362 L369 L735 L738	L361-A365 WeakPolarHBondContact O-CB 3.39Å; L361-A365 PolarHBondContact O-N 3.32Å; F362-A365 PolarHBondContact O-N 3.23Å; A365-L369 VanDerWaalsContact O-CB 3.25Å; A365-L369 WeakPolarHBondContact O-CB 3.48Å; A365-L369 PolarHBondContact O-N 3.3Å; A365-L735 HydrophobicContact CB-CB 4.09Å; A365-L735 HydrophobicContact CB-CD1 4.12Å; A365-L738 HydrophobicContact CB-CB 4.37Å; A365-L738 HydrophobicContact CB-CD2 3.71Å
366	F	95.6	Very high	93.6	Very high	147 Å²	147	48.9 Å²	48.9	65%	0.645	24%	0.244	S	C	*	.	H	α-helix	trans	-63.1	-47.8	177.5	179.5	-99.5	0	0	0	112.5	F362 A364 F370	F362-F366 WeakPolarHBondContact O-CB 3.42Å; F362-F366 PolarHBondContact O-N 3.38Å; A364-F366 VanDerWaalsContact C-N 3.34Å; A364-F366 PolarHBondContact O-N 2.93Å; F366-F370 PolarHBondContact O-N 2.79Å
367	I	95.6	Very high	93.6	Very high	42 Å²	42	50.5 Å²	50.5	22%	0.215	26%	0.261	C	S	.	.	H	α-helix	trans	-71.8	-38	179.4	-62.3	178.4	0	0	0	110.8	P363 A364 L369 F370 V371 F429 F430 F433	P363-I367 WeakPolarHBondContact O-CG1 3.05Å; P363-I367 PolarHBondContact O-N 2.61Å; P363-I367 VanDerWaalsContact O-N 3.13Å; A364-I367 PolarHBondContact O-N 2.68Å; I367-L369 VanDerWaalsContact C-N 3.34Å; I367-L369 PolarHBondContact O-N 2.99Å; I367-F370 PolarHBondContact O-N 3Å; I367-V371 HydrophobicContact CG2-CG2 4.3Å; I367-V371 WeakPolarHBondContact O-CB 3.28Å; I367-V371 VanDerWaalsContact O-CG2 3.25Å; I367-V371 WeakPolarHBondContact O-CG2 3.23Å; I367-V371 PolarHBondContact O-N 3.39Å; I367-F429 HydrophobicContact CG2-CE1 4.42Å; I367-F430 HydrophobicContact CB-CD2 4.39Å; I367-F430 HydrophobicContact CB-CE2 4.07Å; I367-F430 HydrophobicContact CG2-CD2 3.74Å; I367-F430 HydrophobicContact CG2-CE2 3.94Å; I367-F433 HydrophobicContact CD1-CD1 4.47Å; I367-F433 HydrophobicContact CD1-CD2 3.99Å; I367-F433 HydrophobicContact CD1-CE1 4.18Å; I367-F433 HydrophobicContact CD1-CE2 3.64Å; I367-F433 HydrophobicContact CD1-CG 4.4Å; I367-F433 HydrophobicContact CD1-CZ 3.75Å; I367-F433 HydrophobicContact CG2-CD1 4.48Å
368	G	94.8	Very high	93.4	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-60.9	-41.2	174.4	0	0	0	0	0	112.8	A364 V371 F372 F430 P731	A364-G368 PolarHBondContact O-N 3.33Å; G368-V371 PolarHBondContact O-N 2.97Å; G368-F372 WeakPolarHBondContact O-CB 3.42Å; G368-F372 PolarHBondContact O-N 3.48Å; G368-F430 VanDerWaalsContact N-CE2 3.32Å; G368-P731 WeakPolarHBondContact CA-O 2.96Å
369	L	94.9	Very high	93.1	Very high	66 Å²	66	52.6 Å²	52.6	35%	0.346	27%	0.273	S	S	.	.	H	α-helix	trans	-65.4	-41.5	172.8	-179.7	60.8	0	0	0	112.2	A365 I367 V371 F372 L373 L732 L735	A365-L369 VanDerWaalsContact O-CB 3.25Å; A365-L369 WeakPolarHBondContact O-CB 3.48Å; A365-L369 PolarHBondContact O-N 3.3Å; I367-L369 VanDerWaalsContact C-N 3.34Å; I367-L369 PolarHBondContact O-N 2.99Å; L369-V371 PolarHBondContact O-N 3.31Å; L369-F372 PolarHBondContact O-N 2.91Å; L369-L373 HydrophobicContact CD1-CD1 4.29Å; L369-L373 HydrophobicContact CD1-CG 4.25Å; L369-L373 HydrophobicContact CG-CD1 4.06Å; L369-L373 HydrophobicContact CG-CG 4.47Å; L369-L373 WeakPolarHBondContact O-CB 3.47Å; L369-L373 VanDerWaalsContact O-CG 3.28Å; L369-L373 WeakPolarHBondContact O-CG 3.27Å; L369-L373 PolarHBondContact O-N 3.01Å; L369-L732 HydrophobicContact CD1-CD2 4.29Å; L369-L735 HydrophobicContact CD1-CD2 4.36Å
370	F	94.6	Very high	92.7	Very high	134 Å²	134	55.6 Å²	55.6	59%	0.588	28%	0.279	S	S	*	.	H	α-helix	trans	-61.7	-43.1	175.1	178.6	-95.3	0	0	0	112.1	F366 I367 F372 L373 Y374	F366-F370 PolarHBondContact O-N 2.79Å; I367-F370 PolarHBondContact O-N 3Å; F370-F372 VanDerWaalsContact C-N 3.35Å; F370-L373 PolarHBondContact O-N 3.13Å; F370-Y374 WeakPolarHBondContact O-CB 3.45Å; F370-Y374 PolarHBondContact O-N 2.85Å
371	V	94.2	Very high	92.4	Very high	2 Å²	2	59.7 Å²	59.7	1%	0.012	30%	0.297	C	S	.	.	H	α-helix	trans	-64.4	-38.3	176.7	168.2	0	0	0	0	111.7	I367 G368 L369 G375 A426 T427 F430 P731	I367-V371 HydrophobicContact CG2-CG2 4.3Å; I367-V371 WeakPolarHBondContact O-CB 3.28Å; I367-V371 VanDerWaalsContact O-CG2 3.25Å; I367-V371 WeakPolarHBondContact O-CG2 3.23Å; I367-V371 PolarHBondContact O-N 3.39Å; G368-V371 PolarHBondContact O-N 2.97Å; L369-V371 PolarHBondContact O-N 3.31Å; V371-G375 PolarHBondContact O-N 3.33Å; V371-G375 VanDerWaalsContact O-N 3.11Å; V371-A426 HydrophobicContact CG1-CB 4.15Å; V371-A426 HydrophobicContact CG2-CB 4.25Å; V371-T427 HydrophobicContact CG1-CG2 3.71Å; V371-F430 HydrophobicContact CG1-CB 4.37Å; V371-F430 HydrophobicContact CG2-CB 4.15Å; V371-F430 HydrophobicContact CG2-CD2 4.37Å; V371-F430 HydrophobicContact CG2-CG 4.39Å; V371-P731 HydrophobicContact CG1-CB 4.13Å; V371-P731 HydrophobicContact CG1-CG 4.12Å
372	F	92.6	Very high	92	Very high	44 Å²	44	60.2 Å²	60.2	19%	0.193	30%	0.301	C	S	.	.	H	α-helix	trans	-65.7	-47.1	172.4	178	-98.6	0	0	0	112.2	G368 L369 F370 Y374 G375 V376 L421 F422 L732	G368-F372 WeakPolarHBondContact O-CB 3.42Å; G368-F372 PolarHBondContact O-N 3.48Å; L369-F372 PolarHBondContact O-N 2.91Å; F370-F372 VanDerWaalsContact C-N 3.35Å; F372-Y374 VanDerWaalsContact C-N 3.29Å; F372-Y374 PolarHBondContact O-N 3Å; F372-G375 CarbonylContact O-C 3.59Å; F372-G375 WeakPolarHBondContact O-CA 3.47Å; F372-G375 PolarHBondContact O-N 3.07Å; F372-V376 HydrophobicContact CD1-CG2 4.33Å; F372-V376 HydrophobicContact CE1-CG2 4Å; F372-V376 HydrophobicContact CZ-CG2 4.35Å; F372-V376 PolarHBondContact O-N 3.5Å; F372-L421 HydrophobicContact CD2-CD1 3.93Å; F372-L421 HydrophobicContact CD2-CD2 4.45Å; F372-L421 HydrophobicContact CD2-CG 4.06Å; F372-L421 HydrophobicContact CE2-CD1 3.74Å; F372-L421 HydrophobicContact CE2-CD2 3.55Å; F372-L421 HydrophobicContact CE2-CG 3.64Å; F372-L421 HydrophobicContact CZ-CD1 4.19Å; F372-L421 HydrophobicContact CZ-CD2 3.92Å; F372-L421 HydrophobicContact CZ-CG 4.35Å; F372-F422 HydrophobicContact CD2-CD1 4.37Å; F372-F422 AromaticContact CD2-CE1 3.75Å; F372-F422 HydrophobicContact CD2-CE1 3.75Å; F372-F422 AromaticContact CE2-CE1 3.66Å; F372-F422 HydrophobicContact CE2-CE1 3.66Å; F372-F422 AromaticContact CE2-CZ 3.99Å; F372-F422 HydrophobicContact CE2-CZ 3.99Å; F372-L732 HydrophobicContact CB-CD2 3.74Å; F372-L732 HydrophobicContact CB-CG 4.12Å; F372-L732 HydrophobicContact CD1-CD1 4.22Å; F372-L732 HydrophobicContact CD1-CD2 4.17Å; F372-L732 HydrophobicContact CD2-CD1 3.64Å; F372-L732 HydrophobicContact CD2-CD2 4.28Å; F372-L732 HydrophobicContact CD2-CG 3.86Å; F372-L732 HydrophobicContact CE1-CD1 4.26Å; F372-L732 HydrophobicContact CE2-CD1 3.68Å; F372-L732 HydrophobicContact CE2-CG 4.4Å; F372-L732 HydrophobicContact CG-CD1 3.92Å; F372-L732 HydrophobicContact CG-CD2 3.81Å; F372-L732 HydrophobicContact CG-CG 3.93Å; F372-L732 HydrophobicContact CZ-CD1 4Å
373	L	93.1	Very high	91.7	Very high	89 Å²	89	57 Å²	57	47%	0.466	29%	0.287	S	S	.	.	H	α-helix	trans	-61.9	-35.8	177.3	-71.6	170.1	0	0	0	112.3	L369 F370 G375 V376 T377	L369-L373 HydrophobicContact CD1-CD1 4.29Å; L369-L373 HydrophobicContact CD1-CG 4.25Å; L369-L373 HydrophobicContact CG-CD1 4.06Å; L369-L373 HydrophobicContact CG-CG 4.47Å; L369-L373 WeakPolarHBondContact O-CB 3.47Å; L369-L373 VanDerWaalsContact O-CG 3.28Å; L369-L373 WeakPolarHBondContact O-CG 3.27Å; L369-L373 PolarHBondContact O-N 3.01Å; F370-L373 PolarHBondContact O-N 3.13Å; L373-G375 VanDerWaalsContact C-N 3.35Å; L373-V376 WeakPolarHBondContact O-CB 3.3Å; L373-V376 PolarHBondContact O-N 3.19Å; L373-T377 PolarHBondContact O-N 2.84Å; L373-T377 PolarHBondContact O-OG1 3.49Å
374	Y	93	Very high	91.3	Very high	108 Å²	108	55.6 Å²	55.6	42%	0.424	28%	0.278	S	S	.	.	H	α-helix	trans	-62.7	-39.6	170	175.8	-97.3	0	0	0	112.3	F370 F372 V376 T377 T378 A426	F370-Y374 WeakPolarHBondContact O-CB 3.45Å; F370-Y374 PolarHBondContact O-N 2.85Å; F372-Y374 VanDerWaalsContact C-N 3.29Å; F372-Y374 PolarHBondContact O-N 3Å; Y374-V376 VanDerWaalsContact C-N 3.32Å; Y374-V376 PolarHBondContact O-N 3.35Å; Y374-T377 PolarHBondContact O-N 3.36Å; Y374-T377 PolarHBondContact O-OG1 2.8Å; Y374-T378 HydrophobicContact CD2-CG2 4.16Å; Y374-T378 HydrophobicContact CE1-CG2 4.22Å; Y374-T378 HydrophobicContact CE2-CG2 3.72Å; Y374-T378 WeakPolarHBondContact O-CB 3.46Å; Y374-T378 WeakPolarHBondContact O-CG2 3.3Å; Y374-T378 PolarHBondContact O-N 2.93Å; Y374-T378 VanDerWaalsContact O-N 3.08Å; Y374-T378 PolarHBondContact O-OG1 3.3Å; Y374-A426 HydrophobicContact CD1-CB 3.83Å; Y374-A426 HydrophobicContact CE1-CB 4.12Å
375	G	91.1	Very high	91	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-61.4	-37.6	171.6	0	0	0	0	0	113	V371 F372 L373 L379	V371-G375 PolarHBondContact O-N 3.33Å; V371-G375 VanDerWaalsContact O-N 3.11Å; F372-G375 CarbonylContact O-C 3.59Å; F372-G375 WeakPolarHBondContact O-CA 3.47Å; F372-G375 PolarHBondContact O-N 3.07Å; L373-G375 VanDerWaalsContact C-N 3.35Å; G375-L379 PolarHBondContact O-N 2.94Å
376	V	91.8	Very high	90.8	Very high	70 Å²	70	59.3 Å²	59.3	42%	0.424	29%	0.293	S	S	.	.	H	α-helix	trans	-66.6	-52.1	174.1	-179.8	0	0	0	0	111.1	F372 L373 Y374 T378 L379 L421	F372-V376 HydrophobicContact CD1-CG2 4.33Å; F372-V376 HydrophobicContact CE1-CG2 4Å; F372-V376 HydrophobicContact CZ-CG2 4.35Å; F372-V376 PolarHBondContact O-N 3.5Å; L373-V376 WeakPolarHBondContact O-CB 3.3Å; L373-V376 PolarHBondContact O-N 3.19Å; Y374-V376 VanDerWaalsContact C-N 3.32Å; Y374-V376 PolarHBondContact O-N 3.35Å; V376-T378 VanDerWaalsContact C-N 3.26Å; V376-T378 PolarHBondContact O-N 3.45Å; V376-L379 VanDerWaalsContact O-CB 3.24Å; V376-L379 WeakPolarHBondContact O-CB 3.27Å; V376-L379 PolarHBondContact O-N 3.31Å; V376-L421 HydrophobicContact CB-CD1 4.36Å; V376-L421 HydrophobicContact CG2-CD1 3.52Å
377	T	91.4	Very high	90.5	Very high	100 Å²	100	53.6 Å²	53.6	61%	0.613	27%	0.269	S	S	*	.	H	α-helix	trans	-68.3	-23.8	-175.2	56.1	0	0	0	0	113.7	L373 Y374	L373-T377 PolarHBondContact O-N 2.84Å; L373-T377 PolarHBondContact O-OG1 3.49Å; Y374-T377 PolarHBondContact O-N 3.36Å; Y374-T377 PolarHBondContact O-OG1 2.8Å
378	T	89.3	Confident	90.2	Very high	22 Å²	22	52.3 Å²	52.3	14%	0.135	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-3.3	177	57.2	0	0	0	0	114.4	Y374 V376 D380 H381 C382	Y374-T378 HydrophobicContact CD2-CG2 4.16Å; Y374-T378 HydrophobicContact CE1-CG2 4.22Å; Y374-T378 HydrophobicContact CE2-CG2 3.72Å; Y374-T378 WeakPolarHBondContact O-CB 3.46Å; Y374-T378 WeakPolarHBondContact O-CG2 3.3Å; Y374-T378 PolarHBondContact O-N 2.93Å; Y374-T378 VanDerWaalsContact O-N 3.08Å; Y374-T378 PolarHBondContact O-OG1 3.3Å; V376-T378 VanDerWaalsContact C-N 3.26Å; V376-T378 PolarHBondContact O-N 3.45Å; T378-D380 PolarHBondContact O-N 3.15Å; T378-H381 PolarHBondContact O-N 3.41Å; T378-C382 PolarHBondContact O-N 3.44Å; T378-C382 VanDerWaalsContact O-N 3.11Å
379	L	87.1	Confident	90	Very high	32 Å²	32	54 Å²	54	17%	0.168	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-46.5	-173.2	-170.7	149.6	0	0	0	113.3	G375 V376 H381 K417	G375-L379 PolarHBondContact O-N 2.94Å; V376-L379 VanDerWaalsContact O-CB 3.24Å; V376-L379 WeakPolarHBondContact O-CB 3.27Å; V376-L379 PolarHBondContact O-N 3.31Å; L379-H381 VanDerWaalsContact C-N 3.28Å; L379-H381 PolarHBondContact O-N 3.47Å; L379-K417 HydrophobicContact CD1-CB 4.41Å; L379-K417 HydrophobicContact CD2-CB 4.24Å; L379-K417 HydrophobicContact CD2-CD 3.87Å; L379-K417 HydrophobicContact CD2-CG 3.95Å; L379-K417 HydrophobicContact CG-CB 4.5Å
380	D	84	Confident	89.8	Confident	104 Å²	104	57.7 Å²	57.7	56%	0.556	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	1.2	177.5	-65.7	-44.9	0	0	0	113.4	T378 K386 K417	T378-D380 PolarHBondContact O-N 3.15Å; D380-K386 WeakPolarHBondContact O-CE 3.48Å; D380-K386 PolarHBondContact O-NZ 2.74Å; D380-K417 IonicContact OD1-NZ 2.71Å; D380-K417 PolarHBondContact OD1-NZ 3.1Å
381	H	83.8	Confident	89.4	Confident	116 Å²	116	51.6 Å²	51.6	54%	0.537	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-29	169.4	-72.6	-77.6	0	0	0	112.6	T378 L379 Q383 K386 Q816	T378-H381 PolarHBondContact O-N 3.41Å; L379-H381 VanDerWaalsContact C-N 3.28Å; L379-H381 PolarHBondContact O-N 3.47Å; H381-Q383 PolarHBondContact O-N 3.19Å; H381-K386 PolarHBondContact O-NZ 2.87Å; H381-Q816 PolarHBondContact O-NE2 3.34Å
382	C	85.5	Confident	89	Confident	11 Å²	11	56 Å²	56	7%	0.074	29%	0.291	C	S	.	.			trans	-54.7	128.5	-178.4	-177.1	0	0	0	0	113.7	T378 S385 K386 H420	T378-C382 PolarHBondContact O-N 3.44Å; T378-C382 VanDerWaalsContact O-N 3.11Å; C382-S385 WeakPolarHBondContact CB-OG 3.43Å; C382-S385 PolarHBondContact O-OG 2.85Å; C382-K386 WeakPolarHBondContact O-CD 3.39Å; C382-K386 VanDerWaalsContact O-CG 3.32Å; C382-K386 WeakPolarHBondContact O-CG 3.44Å; C382-H420 PolarHBondContact SG-CD2 3.23Å
383	Q	87.4	Confident	88.7	Confident	46 Å²	46	60 Å²	60	22%	0.215	32%	0.315	C	S	.	.	H	α-helix	trans	-74.8	-38.1	178.7	-178.7	58.7	24.2	0	0	112.3	H381 K386 E387 M819 V820	H381-Q383 PolarHBondContact O-N 3.19Å; Q383-K386 WeakPolarHBondContact O-CB 3.43Å; Q383-K386 PolarHBondContact O-N 3.02Å; Q383-E387 WeakPolarHBondContact CG-OE1 3.35Å; Q383-E387 PolarHBondContact NE2-OE1 3Å; Q383-E387 PolarHBondContact O-N 3.09Å; Q383-M819 HydrophobicContact CB-CB 4.19Å; Q383-M819 HydrophobicContact CG-CB 4.31Å; Q383-V820 HydrophobicContact CG-CG2 4.06Å
384	V	87.1	Confident	88.5	Confident	29 Å²	29	56.7 Å²	56.7	18%	0.176	30%	0.297	C	S	.	.	H	α-helix	trans	-68.9	-39.9	-175.7	-179.4	0	0	0	0	111.7	E387 V388 M819 Y822 V823	V384-E387 PolarHBondContact O-N 2.86Å; V384-V388 WeakPolarHBondContact O-CG2 3.3Å; V384-V388 PolarHBondContact O-N 3.35Å; V384-V388 VanDerWaalsContact O-N 3.08Å; V384-M819 HydrophobicContact CG2-CE 4.16Å; V384-Y822 HydrophobicContact CB-CD1 4.48Å; V384-Y822 HydrophobicContact CG1-CD1 3.88Å; V384-Y822 HydrophobicContact CG1-CE1 4.13Å; V384-Y822 HydrophobicContact CG2-CD1 3.74Å; V384-Y822 HydrophobicContact CG2-CE1 4.41Å; V384-Y822 HydrophobicContact CG2-CG 4.33Å; V384-V823 HydrophobicContact CG1-CG2 3.96Å
385	S	89.1	Confident	88.3	Confident	5 Å²	5	52.5 Å²	52.5	4%	0.035	28%	0.282	C	S	.	.	H	α-helix	trans	-66.8	-37.2	174.9	59.3	0	0	0	0	111.8	C382 V388 C389	C382-S385 WeakPolarHBondContact CB-OG 3.43Å; C382-S385 PolarHBondContact O-OG 2.85Å; S385-V388 PolarHBondContact O-N 2.73Å; S385-C389 WeakPolarHBondContact O-CB 3.44Å; S385-C389 PolarHBondContact O-N 2.91Å; S385-C389 PolarHBondContact O-SG 3.22Å
386	K	89.9	Confident	88.2	Confident	78 Å²	78	53.1 Å²	53.1	34%	0.339	29%	0.285	S	S	.	.	H	α-helix	trans	-61.3	-48.3	173.2	-72.3	167.9	-174.6	165.3	0	111.9	D380 H381 C382 Q383 V388 C389 Q390	D380-K386 WeakPolarHBondContact O-CE 3.48Å; D380-K386 PolarHBondContact O-NZ 2.74Å; H381-K386 PolarHBondContact O-NZ 2.87Å; C382-K386 WeakPolarHBondContact O-CD 3.39Å; C382-K386 VanDerWaalsContact O-CG 3.32Å; C382-K386 WeakPolarHBondContact O-CG 3.44Å; Q383-K386 WeakPolarHBondContact O-CB 3.43Å; Q383-K386 PolarHBondContact O-N 3.02Å; K386-V388 PolarHBondContact O-N 2.92Å; K386-C389 CarbonylContact O-C 3.5Å; K386-C389 PolarHBondContact O-N 2.84Å; K386-Q390 WeakPolarHBondContact O-CB 3.34Å; K386-Q390 VanDerWaalsContact O-CG 3.29Å; K386-Q390 WeakPolarHBondContact O-CG 3.17Å; K386-Q390 PolarHBondContact O-N 3.19Å
387	E	89.8	Confident	88	Confident	27 Å²	27	50.3 Å²	50.3	13%	0.126	27%	0.269	C	S	.	.	H	α-helix	trans	-58.8	-45.5	177.7	-76.9	175	-161.8	0	0	111.8	Q383 V384 C389 Q390 A391 V820 G821 Y822 V823	Q383-E387 WeakPolarHBondContact CG-OE1 3.35Å; Q383-E387 PolarHBondContact NE2-OE1 3Å; Q383-E387 PolarHBondContact O-N 3.09Å; V384-E387 PolarHBondContact O-N 2.86Å; E387-C389 PolarHBondContact O-N 3.26Å; E387-Q390 PolarHBondContact O-N 3.33Å; E387-A391 VanDerWaalsContact O-CB 3.25Å; E387-A391 WeakPolarHBondContact O-CB 3.47Å; E387-A391 PolarHBondContact O-N 3.01Å; E387-V820 VanDerWaalsContact OE1-CA 3.31Å; E387-V820 WeakPolarHBondContact OE1-CA 3.04Å; E387-G821 PolarHBondContact OE1-N 3.45Å; E387-G821 PolarHBondContact OE2-N 3.36Å; E387-Y822 PolarHBondContact OE2-N 3.35Å; E387-V823 HydrophobicContact CB-CB 4.01Å; E387-V823 HydrophobicContact CB-CG2 3.53Å; E387-V823 WeakPolarHBondContact OE2-CG2 3.27Å; E387-V823 PolarHBondContact OE2-N 2.99Å; E387-V823 VanDerWaalsContact OE2-N 3.16Å
388	V	89.8	Confident	87.7	Confident	15 Å²	15	45.6 Å²	45.6	9%	0.091	24%	0.24	C	C	.	.	H	α-helix	trans	-60.8	-45.2	174.5	172.2	0	0	0	0	111.8	V384 S385 K386 Q390 L409 S410 A416 V823	V384-V388 WeakPolarHBondContact O-CG2 3.3Å; V384-V388 PolarHBondContact O-N 3.35Å; V384-V388 VanDerWaalsContact O-N 3.08Å; S385-V388 PolarHBondContact O-N 2.73Å; K386-V388 PolarHBondContact O-N 2.92Å; V388-Q390 VanDerWaalsContact C-N 3.29Å; V388-Q390 PolarHBondContact O-N 3.37Å; V388-L409 HydrophobicContact CG1-CD1 4.29Å; V388-L409 HydrophobicContact CG1-CG 4.18Å; V388-S410 WeakPolarHBondContact O-CA 2.99Å; V388-A416 HydrophobicContact CB-CB 4.06Å; V388-A416 HydrophobicContact CG1-CB 3.74Å; V388-A416 HydrophobicContact CG2-CB 4.28Å; V388-V823 HydrophobicContact CG2-CG1 4.4Å; V388-V823 HydrophobicContact CG2-CG2 4.02Å
389	C	90.3	Very high	87.1	Confident	37 Å²	37	46.1 Å²	46.1	25%	0.25	24%	0.243	C	C	.	.	H	α-helix	trans	-71.7	-18.4	-179.8	-64	0	0	0	0	114.2	S385 K386 E387 C413	S385-C389 WeakPolarHBondContact O-CB 3.44Å; S385-C389 PolarHBondContact O-N 2.91Å; S385-C389 PolarHBondContact O-SG 3.22Å; K386-C389 CarbonylContact O-C 3.5Å; K386-C389 PolarHBondContact O-N 2.84Å; E387-C389 PolarHBondContact O-N 3.26Å; C389-C413 HydrophobicContact CB-CB 3.85Å; C389-C413 WeakPolarHBondContact CB-SG 3.07Å; C389-C413 VanDerWaalsContact SG-CA 3.59Å; C389-C413 WeakPolarHBondContact SG-CB 3.46Å; C389-C413 CovalentContact SG-SG 2.04Å; C389-C413 PolarHBondContact SG-SG 2.99Å
390	Q	91.1	Very high	86.6	Confident	142 Å²	142	45.6 Å²	45.6	66%	0.664	24%	0.242	S	C	*	.	H	α-helix	trans	-97.9	-17.9	178.9	-72.1	177	-26.1	0	0	113.4	K386 E387 V388 T392	K386-Q390 WeakPolarHBondContact O-CB 3.34Å; K386-Q390 VanDerWaalsContact O-CG 3.29Å; K386-Q390 WeakPolarHBondContact O-CG 3.17Å; K386-Q390 PolarHBondContact O-N 3.19Å; E387-Q390 PolarHBondContact O-N 3.33Å; V388-Q390 VanDerWaalsContact C-N 3.29Å; V388-Q390 PolarHBondContact O-N 3.37Å; Q390-T392 VanDerWaalsContact C-N 3.32Å; Q390-T392 PolarHBondContact O-N 2.89Å
391	A	85.9	Confident	86.4	Confident	7 Å²	7	42.3 Å²	42.3	6%	0.058	22%	0.224	C	C	.	.			trans	-75.5	74	-177.9	0	0	0	0	0	113.2	E387 I394 L409 S410	E387-A391 VanDerWaalsContact O-CB 3.25Å; E387-A391 WeakPolarHBondContact O-CB 3.47Å; E387-A391 PolarHBondContact O-N 3.01Å; A391-I394 HydrophobicContact CB-CB 4.08Å; A391-I394 HydrophobicContact CB-CD1 3.86Å; A391-I394 HydrophobicContact CB-CG1 3.97Å; A391-L409 HydrophobicContact CB-CB 4.19Å; A391-L409 HydrophobicContact CB-CD2 4.02Å; A391-L409 HydrophobicContact CB-CG 4.35Å; A391-S410 PolarHBondContact O-N 3.4Å
392	T	85.4	Confident	85.9	Confident	93 Å²	93	41 Å²	41	57%	0.571	22%	0.217	S	C	*	.	S	Bend	trans	-82.3	-16.4	174.4	54.9	0	0	0	0	113.5	Q390	Q390-T392 VanDerWaalsContact C-N 3.32Å; Q390-T392 PolarHBondContact O-N 2.89Å
393	D	86.8	Confident	85.3	Confident	128 Å²	128	45.9 Å²	45.9	68%	0.684	23%	0.234	S	C	*	.	S	Bend	trans	-87.8	-23	176.6	66.2	-45	0	0	0	113.3	I395	D393-I395 PolarHBondContact O-N 3.44Å
394	I	88.3	Confident	84.7	Confident	20 Å²	20	44.6 Å²	44.6	10%	0.103	23%	0.23	C	C	.	.			trans	-82.4	108.6	-179.2	-58.6	-174.5	0	0	0	110.6	A391 M396 L409 L827 R857	A391-I394 HydrophobicContact CB-CB 4.08Å; A391-I394 HydrophobicContact CB-CD1 3.86Å; A391-I394 HydrophobicContact CB-CG1 3.97Å; I394-M396 HydrophobicContact CG2-SD 4.42Å; I394-L409 HydrophobicContact CB-CB 4.06Å; I394-L409 HydrophobicContact CB-CD2 4.25Å; I394-L409 HydrophobicContact CD1-CD2 4.22Å; I394-L409 HydrophobicContact CG2-CB 4.05Å; I394-L409 HydrophobicContact CG2-CD2 3.95Å; I394-L409 PolarHBondContact O-N 2.81Å; I394-L827 HydrophobicContact CD1-CD1 4.45Å; I394-L827 HydrophobicContact CG2-CD1 3.94Å; I394-R857 HydrophobicContact CG2-CB 4.19Å; I394-R857 HydrophobicContact CG2-CG 3.91Å
395	I	90.1	Very high	84.3	Confident	21 Å²	21	46.7 Å²	46.7	11%	0.108	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	126.8	175.4	-56.9	171.9	0	0	0	110.1	D393 F406 F848 L853 R857	D393-I395 PolarHBondContact O-N 3.44Å; I395-F406 HydrophobicContact CG2-CB 3.78Å; I395-F406 HydrophobicContact CG2-CD1 4.26Å; I395-F406 HydrophobicContact CG2-CG 4.33Å; I395-F848 HydrophobicContact CD1-CB 3.79Å; I395-F848 HydrophobicContact CD1-CG 4.3Å; I395-L853 HydrophobicContact CD1-CD1 4.03Å; I395-L853 HydrophobicContact CD1-CD2 3.67Å; I395-L853 HydrophobicContact CG2-CD1 3.93Å; I395-R857 PolarHBondContact O-N 3.04Å
396	M	88.7	Confident	84.1	Confident	12 Å²	12	46.7 Å²	46.7	6%	0.059	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	144.5	-179.5	-64	-63.8	-66.1	0	0	111.7	I394 M407 L409 P639 L827 R857	I394-M396 HydrophobicContact CG2-SD 4.42Å; M396-M407 PolarHBondContact N-O 3.18Å; M396-L409 HydrophobicContact CG-CD1 4.47Å; M396-L409 HydrophobicContact SD-CD1 4.45Å; M396-P639 HydrophobicContact CE-CB 4.3Å; M396-P639 HydrophobicContact CE-CG 4.41Å; M396-L827 HydrophobicContact CE-CD2 3.83Å; M396-L827 HydrophobicContact SD-CD1 4.27Å; M396-L827 HydrophobicContact SD-CD2 3.92Å; M396-R857 CarbonylContact C-O 3.57Å; M396-R857 WeakPolarHBondContact CA-O 3.33Å; M396-R857 HydrophobicContact SD-CB 3.91Å
397	C	88	Confident	83.8	Confident	12 Å²	12	45.4 Å²	45.4	8%	0.081	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-64.6	151.9	173.6	-54.6	0	0	0	0	111.7	C856 R857	C397-C856 VanDerWaalsContact CA-SG 3.54Å; C397-C856 HydrophobicContact CB-CB 3.98Å; C397-C856 WeakPolarHBondContact CB-SG 3.41Å; C397-C856 VanDerWaalsContact SG-C 3.51Å; C397-C856 WeakPolarHBondContact SG-CB 3.46Å; C397-C856 CovalentContact SG-SG 2.04Å; C397-C856 PolarHBondContact SG-SG 3.47Å; C397-R857 PolarHBondContact N-O 3.11Å; C397-R857 PolarHBondContact SG-O 3.25Å; C397-R857 VanDerWaalsContact SG-O 3.33Å
398	P	84.2	Confident	83.7	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.006	25%	0.25	C	S	.	.	P	Polyproline II helix	trans	-68.9	136.8	-176.2	27	-35.2	0	0	0	113.4	C404 R633 F835 P841	P398-C404 HydrophobicContact CB-CB 3.83Å; P398-R633 PolarHBondContact O-NH1 2.98Å; P398-R633 PolarHBondContact O-NH2 3.1Å; P398-F835 HydrophobicContact CG-CZ 4.47Å; P398-P841 HydrophobicContact CG-CB 4.47Å
399	V	77.6	Confident	83.7	Confident	33 Å²	33	48.2 Å²	48.2	20%	0.2	25%	0.248	C	C	.	.	S	Bend	trans	-78.3	-18.3	-173.8	-178.5	0	0	0	0	113.1	M407 R633 E636	V399-M407 HydrophobicContact CG2-CE 3.64Å; V399-R633 PolarHBondContact O-NH2 3.3Å; V399-E636 HydrophobicContact CG1-CB 4.12Å
400	C	76.7	Confident	83.6	Confident	21 Å²	21	47.5 Å²	47.5	14%	0.142	24%	0.244	C	C	.	.	S	Bend	trans	-123.3	-179.9	167.8	76.2	0	0	0	0	110.8	C404 R633	C400-C404 HydrophobicContact CB-CB 4.1Å; C400-C404 WeakPolarHBondContact CB-SG 3.38Å; C400-C404 PolarHBondContact N-SG 2.98Å; C400-C404 WeakPolarHBondContact SG-CB 3.45Å; C400-C404 CovalentContact SG-SG 2.03Å; C400-C404 PolarHBondContact SG-SG 2.99Å; C400-R633 PolarHBondContact O-NH1 3.5Å
401	D	79.1	Confident	83.4	Confident	35 Å²	35	45.6 Å²	45.6	19%	0.187	24%	0.238	C	C	.	.	S	Bend	trans	-73.4	-155.6	174.4	-66.2	-13.6	0	0	0	110	Y403 C404 R627 R633 S839	D401-Y403 VanDerWaalsContact C-N 3.28Å; D401-Y403 PolarHBondContact O-N 2.84Å; D401-C404 PolarHBondContact O-N 3.39Å; D401-C404 VanDerWaalsContact O-N 3.11Å; D401-R627 IonicContact OD2-CZ 2.88Å; D401-R627 IonicContact OD2-NH1 2.69Å; D401-R627 PolarHBondContact OD2-NH1 2.88Å; D401-R633 WeakPolarHBondContact OD1-CD 3.46Å; D401-R633 IonicContact OD1-NH1 2.61Å; D401-R633 PolarHBondContact OD1-NH1 3.36Å; D401-S839 VanDerWaalsContact OD1-CB 3.32Å; D401-S839 WeakPolarHBondContact OD1-CB 3.41Å; D401-S839 PolarHBondContact OD1-OG 3.2Å; D401-S839 PolarHBondContact OD2-OG 3.45Å
402	K	73.5	Confident	83.4	Confident	87 Å²	87	45.6 Å²	45.6	38%	0.378	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-20.7	-46.8	-170	-62	-151.7	166.8	-146.4	0	120.3	E842	K402-E842 HydrophobicContact CB-CG 4.22Å; K402-E842 PolarHBondContact O-N 3.09Å
403	Y	72.4	Confident	83.6	Confident	115 Å²	115	42.7 Å²	42.7	45%	0.451	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	2.3	-169.1	-55.2	-56.7	0	0	0	115.4	D401 A536 E842	D401-Y403 VanDerWaalsContact C-N 3.28Å; D401-Y403 PolarHBondContact O-N 2.84Å; Y403-A536 HydrophobicContact CD2-CB 3.93Å; Y403-A536 HydrophobicContact CE2-CB 3.91Å; Y403-A536 HydrophobicContact CG-CB 4.45Å; Y403-E842 VanDerWaalsContact CE1-CD 3.49Å; Y403-E842 VanDerWaalsContact CE1-OE1 3.29Å; Y403-E842 WeakPolarHBondContact CE1-OE1 3.43Å; Y403-E842 VanDerWaalsContact CE1-OE2 3.28Å; Y403-E842 WeakPolarHBondContact CE1-OE2 3.32Å
404	C	75.6	Confident	83.6	Confident	18 Å²	18	41.6 Å²	41.6	12%	0.122	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-91.9	128	174	-79.9	0	0	0	0	111.9	P398 C400 D401	P398-C404 HydrophobicContact CB-CB 3.83Å; C400-C404 HydrophobicContact CB-CB 4.1Å; C400-C404 WeakPolarHBondContact CB-SG 3.38Å; C400-C404 PolarHBondContact N-SG 2.98Å; C400-C404 WeakPolarHBondContact SG-CB 3.45Å; C400-C404 CovalentContact SG-SG 2.03Å; C400-C404 PolarHBondContact SG-SG 2.99Å; D401-C404 PolarHBondContact O-N 3.39Å; D401-C404 VanDerWaalsContact O-N 3.11Å
405	P	78.8	Confident	83.5	Confident	74 Å²	74	45.1 Å²	45.1	48%	0.481	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-71.9	163	170	32.6	-35.5	0	0	0	111.4
406	F	83.8	Confident	83.4	Confident	4 Å²	4	44.7 Å²	44.7	2%	0.018	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-64.3	154.8	161.1	-63.3	-85.3	0	0	0	110.3	I395 I832 P841 S843 F848 L853 C856	I395-F406 HydrophobicContact CG2-CB 3.78Å; I395-F406 HydrophobicContact CG2-CD1 4.26Å; I395-F406 HydrophobicContact CG2-CG 4.33Å; F406-I832 HydrophobicContact CE1-CD1 3.86Å; F406-I832 HydrophobicContact CE1-CG1 4.42Å; F406-I832 HydrophobicContact CZ-CD1 3.75Å; F406-I832 HydrophobicContact CZ-CG1 4.36Å; F406-P841 HydrophobicContact CE2-CG 3.95Å; F406-P841 HydrophobicContact CZ-CG 3.96Å; F406-S843 WeakPolarHBondContact CE2-O 3.28Å; F406-F848 HydrophobicContact CB-CD2 4.3Å; F406-F848 HydrophobicContact CB-CE2 3.84Å; F406-F848 VanDerWaalsContact O-CZ 3.24Å; F406-F848 WeakPolarHBondContact O-CZ 3.34Å; F406-L853 HydrophobicContact CB-CD1 4.4Å; F406-L853 HydrophobicContact CD1-CD1 4.2Å; F406-L853 HydrophobicContact CD2-CD1 3.95Å; F406-L853 HydrophobicContact CE1-CD1 4.49Å; F406-L853 HydrophobicContact CE2-CD1 4.24Å; F406-L853 HydrophobicContact CG-CD1 3.94Å; F406-C856 HydrophobicContact CD1-CB 4.22Å; F406-C856 HydrophobicContact CE1-CB 3.98Å
407	M	84.2	Confident	83.4	Confident	52 Å²	52	47.4 Å²	47.4	26%	0.256	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	147.8	-178.3	-58	-175.8	-58.2	0	0	110.5	M396 V399	M396-M407 PolarHBondContact N-O 3.18Å; V399-M407 HydrophobicContact CG2-CE 3.64Å
408	R	88.3	Confident	83.4	Confident	93 Å²	93	49.2 Å²	49.2	35%	0.351	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	147	172	-65.4	177.9	170.2	142	2	110.3	S410 D411 F848	R408-S410 VanDerWaalsContact C-N 3.25Å; R408-S410 VanDerWaalsContact CB-OG 3.28Å; R408-S410 WeakPolarHBondContact CB-OG 3.35Å; R408-S410 PolarHBondContact O-N 3.24Å; R408-D411 WeakPolarHBondContact CB-OD2 3.36Å; R408-D411 PolarHBondContact N-OD2 3.49Å; R408-D411 WeakPolarHBondContact O-CB 3.28Å; R408-D411 PolarHBondContact O-N 3.04Å; R408-F848 HydrophobicContact CG-CD1 4.05Å; R408-F848 HydrophobicContact CG-CE1 4.02Å
409	L	88.4	Confident	83.6	Confident	7 Å²	7	49.9 Å²	49.9	4%	0.037	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-65.8	-31	177.2	-172.2	57.7	0	0	0	112.3	V388 A391 I394 M396 D411 S412 P639 V823 L827	V388-L409 HydrophobicContact CG1-CD1 4.29Å; V388-L409 HydrophobicContact CG1-CG 4.18Å; A391-L409 HydrophobicContact CB-CB 4.19Å; A391-L409 HydrophobicContact CB-CD2 4.02Å; A391-L409 HydrophobicContact CB-CG 4.35Å; I394-L409 HydrophobicContact CB-CB 4.06Å; I394-L409 HydrophobicContact CB-CD2 4.25Å; I394-L409 HydrophobicContact CD1-CD2 4.22Å; I394-L409 HydrophobicContact CG2-CB 4.05Å; I394-L409 HydrophobicContact CG2-CD2 3.95Å; I394-L409 PolarHBondContact O-N 2.81Å; M396-L409 HydrophobicContact CG-CD1 4.47Å; M396-L409 HydrophobicContact SD-CD1 4.45Å; L409-D411 PolarHBondContact O-N 3.06Å; L409-D411 VanDerWaalsContact O-N 3.15Å; L409-S412 WeakPolarHBondContact O-CB 3.27Å; L409-S412 PolarHBondContact O-N 3.34Å; L409-S412 VanDerWaalsContact O-N 3.11Å; L409-P639 HydrophobicContact CD1-CB 4.21Å; L409-V823 HydrophobicContact CD2-CG1 3.52Å; L409-L827 HydrophobicContact CD2-CD1 3.8Å
410	S	88.8	Confident	84.1	Confident	23 Å²	23	49.4 Å²	49.4	16%	0.161	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-49.7	-35.2	171	53.6	0	0	0	0	114	V388 A391 R408 S412 C413	V388-S410 WeakPolarHBondContact O-CA 2.99Å; A391-S410 PolarHBondContact O-N 3.4Å; R408-S410 VanDerWaalsContact C-N 3.25Å; R408-S410 VanDerWaalsContact CB-OG 3.28Å; R408-S410 WeakPolarHBondContact CB-OG 3.35Å; R408-S410 PolarHBondContact O-N 3.24Å; S410-S412 PolarHBondContact O-N 2.71Å; S410-C413 WeakPolarHBondContact O-CB 3.46Å; S410-C413 PolarHBondContact O-N 3.02Å
411	D	86.4	Confident	84.6	Confident	102 Å²	102	49.5 Å²	49.5	55%	0.545	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-72.6	-22.4	-171.9	-47.8	-18.6	0	0	0	110.4	R408 L409 C413	R408-D411 WeakPolarHBondContact CB-OD2 3.36Å; R408-D411 PolarHBondContact N-OD2 3.49Å; R408-D411 WeakPolarHBondContact O-CB 3.28Å; R408-D411 PolarHBondContact O-N 3.04Å; L409-D411 PolarHBondContact O-N 3.06Å; L409-D411 VanDerWaalsContact O-N 3.15Å; D411-C413 VanDerWaalsContact C-N 3.28Å; D411-C413 PolarHBondContact O-N 3.31Å
412	S	86	Confident	85	Confident	7 Å²	7	48.9 Å²	48.9	5%	0.049	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-79.6	0.6	172	-63.3	0	0	0	0	114.3	L409 S410 V414 Y415 A416 H638	L409-S412 WeakPolarHBondContact O-CB 3.27Å; L409-S412 PolarHBondContact O-N 3.34Å; L409-S412 VanDerWaalsContact O-N 3.11Å; S410-S412 PolarHBondContact O-N 2.71Å; S412-V414 VanDerWaalsContact C-N 3.33Å; S412-V414 PolarHBondContact O-N 3Å; S412-Y415 PolarHBondContact O-N 3.42Å; S412-Y415 VanDerWaalsContact O-N 3.12Å; S412-A416 PolarHBondContact O-N 3.23Å; S412-H638 PolarHBondContact OG-CE1 3.05Å; S412-H638 VanDerWaalsContact OG-CE1 3.27Å
413	C	89.1	Confident	85.7	Confident	31 Å²	31	45 Å²	45	21%	0.209	23%	0.231	C	C	.	.	H	α-helix	trans	-53	-42.9	-174.4	172.2	0	0	0	0	114.1	C389 S410 D411 A416 K417	C389-C413 HydrophobicContact CB-CB 3.85Å; C389-C413 WeakPolarHBondContact CB-SG 3.07Å; C389-C413 VanDerWaalsContact SG-CA 3.59Å; C389-C413 WeakPolarHBondContact SG-CB 3.46Å; C389-C413 CovalentContact SG-SG 2.04Å; C389-C413 PolarHBondContact SG-SG 2.99Å; S410-C413 WeakPolarHBondContact O-CB 3.46Å; S410-C413 PolarHBondContact O-N 3.02Å; D411-C413 VanDerWaalsContact C-N 3.28Å; D411-C413 PolarHBondContact O-N 3.31Å; C413-A416 PolarHBondContact O-N 3.26Å; C413-K417 PolarHBondContact O-N 3.48Å
414	V	88.1	Confident	86.4	Confident	105 Å²	105	39.8 Å²	39.8	64%	0.636	21%	0.21	S	C	*	.	H	α-helix	trans	-63.8	-48.8	178.3	179.7	0	0	0	0	110.6	S412 A416 K417 V418	S412-V414 VanDerWaalsContact C-N 3.33Å; S412-V414 PolarHBondContact O-N 3Å; V414-A416 VanDerWaalsContact C-N 3.35Å; V414-A416 PolarHBondContact O-N 3.07Å; V414-K417 PolarHBondContact O-N 3.34Å; V414-V418 WeakPolarHBondContact O-CG2 3.47Å; V414-V418 PolarHBondContact O-N 3.1Å
415	Y	85.4	Confident	86.9	Confident	94 Å²	94	41.1 Å²	41.1	37%	0.369	23%	0.227	S	C	.	.	H	α-helix	trans	-60.7	-42.2	177.5	-67.6	-87.2	0	0	0	111.7	S412 K417 V418 T419 H638 S640 I644 M648	S412-Y415 PolarHBondContact O-N 3.42Å; S412-Y415 VanDerWaalsContact O-N 3.12Å; Y415-K417 PolarHBondContact O-N 2.81Å; Y415-V418 PolarHBondContact O-N 3.07Å; Y415-T419 PolarHBondContact O-N 3.42Å; Y415-T419 PolarHBondContact O-OG1 2.74Å; Y415-T419 VanDerWaalsContact O-OG1 3.12Å; Y415-H638 AromaticContact CD2-CE1 3.48Å; Y415-H638 VanDerWaalsContact CD2-CE1 3.48Å; Y415-H638 WeakPolarHBondContact CD2-CE1 3.46Å; Y415-H638 AromaticContact CD2-NE2 3.97Å; Y415-H638 AromaticContact CG-CE1 3.6Å; Y415-H638 AromaticContact CG-ND1 3.89Å; Y415-S640 WeakPolarHBondContact CB-OG 3.32Å; Y415-I644 HydrophobicContact CD1-CG1 4.44Å; Y415-M648 HydrophobicContact CE1-CE 4.37Å
416	A	87.7	Confident	87.5	Confident	13 Å²	13	38.6 Å²	38.6	11%	0.107	21%	0.213	C	C	.	.	H	α-helix	trans	-64.4	-36.3	176.6	0	0	0	0	0	113.5	V388 S412 C413 V414 H420	V388-A416 HydrophobicContact CB-CB 4.06Å; V388-A416 HydrophobicContact CG1-CB 3.74Å; V388-A416 HydrophobicContact CG2-CB 4.28Å; S412-A416 PolarHBondContact O-N 3.23Å; C413-A416 PolarHBondContact O-N 3.26Å; V414-A416 VanDerWaalsContact C-N 3.35Å; V414-A416 PolarHBondContact O-N 3.07Å; A416-H420 PolarHBondContact O-N 3.05Å; A416-H420 VanDerWaalsContact O-N 3.1Å
417	K	89.3	Confident	87.9	Confident	69 Å²	69	38.6 Å²	38.6	30%	0.3	21%	0.213	S	C	.	.	H	α-helix	trans	-64.3	-42.1	171.8	-79.3	-176.1	168.1	-132.2	0	111.8	L379 D380 C413 V414 Y415 H420 L421	L379-K417 HydrophobicContact CD1-CB 4.41Å; L379-K417 HydrophobicContact CD2-CB 4.24Å; L379-K417 HydrophobicContact CD2-CD 3.87Å; L379-K417 HydrophobicContact CD2-CG 3.95Å; L379-K417 HydrophobicContact CG-CB 4.5Å; D380-K417 IonicContact OD1-NZ 2.71Å; D380-K417 PolarHBondContact OD1-NZ 3.1Å; C413-K417 PolarHBondContact O-N 3.48Å; V414-K417 PolarHBondContact O-N 3.34Å; Y415-K417 PolarHBondContact O-N 2.81Å; K417-H420 PolarHBondContact O-N 2.83Å; K417-L421 PolarHBondContact O-N 3.43Å
418	V	87.4	Confident	88.3	Confident	49 Å²	49	37 Å²	37	30%	0.297	21%	0.206	S	C	.	.	H	α-helix	trans	-73.3	-35.4	177.6	-176.1	0	0	0	0	112	V414 Y415 H420 L421 F422 I644	V414-V418 WeakPolarHBondContact O-CG2 3.47Å; V414-V418 PolarHBondContact O-N 3.1Å; Y415-V418 PolarHBondContact O-N 3.07Å; V418-H420 VanDerWaalsContact C-N 3.32Å; V418-H420 PolarHBondContact O-N 3.13Å; V418-L421 WeakPolarHBondContact O-CB 3.38Å; V418-L421 PolarHBondContact O-N 2.97Å; V418-F422 HydrophobicContact CG1-CD2 4.18Å; V418-F422 HydrophobicContact CG1-CE2 3.78Å; V418-F422 WeakPolarHBondContact O-CD2 3.41Å; V418-I644 HydrophobicContact CB-CD1 4.3Å; V418-I644 HydrophobicContact CG1-CD1 3.59Å
419	T	88.4	Confident	88.5	Confident	16 Å²	16	38.7 Å²	38.7	10%	0.098	22%	0.216	C	C	.	.	H	α-helix	trans	-58.6	-44.9	170.5	-61.3	0	0	0	0	110.2	Y415 L421 F422 D423 S640	Y415-T419 PolarHBondContact O-N 3.42Å; Y415-T419 PolarHBondContact O-OG1 2.74Å; Y415-T419 VanDerWaalsContact O-OG1 3.12Å; T419-L421 VanDerWaalsContact C-N 3.3Å; T419-L421 PolarHBondContact O-N 3.44Å; T419-F422 PolarHBondContact O-N 2.83Å; T419-D423 HydrophobicContact CG2-CB 4.03Å; T419-D423 VanDerWaalsContact O-CB 3.26Å; T419-D423 WeakPolarHBondContact O-CB 3.35Å; T419-D423 PolarHBondContact O-N 3.39Å; T419-S640 PolarHBondContact OG1-O 3.12Å
420	H	88.3	Confident	88.8	Confident	23 Å²	23	38.3 Å²	38.3	11%	0.106	21%	0.214	C	C	.	.	H	α-helix	trans	-62.5	-33.6	178.8	-176.9	-97.6	0	0	0	113.9	C382 A416 K417 V418 F422	C382-H420 PolarHBondContact SG-CD2 3.23Å; A416-H420 PolarHBondContact O-N 3.05Å; A416-H420 VanDerWaalsContact O-N 3.1Å; K417-H420 PolarHBondContact O-N 2.83Å; V418-H420 VanDerWaalsContact C-N 3.32Å; V418-H420 PolarHBondContact O-N 3.13Å; H420-F422 PolarHBondContact O-N 3.47Å
421	L	88.2	Confident	89.1	Confident	23 Å²	23	37.3 Å²	37.3	12%	0.12	21%	0.207	C	C	.	.	H	α-helix	trans	-57.6	-35.7	177	180	56	0	0	0	111.9	F372 V376 K417 V418 T419 N424	F372-L421 HydrophobicContact CD2-CD1 3.93Å; F372-L421 HydrophobicContact CD2-CD2 4.45Å; F372-L421 HydrophobicContact CD2-CG 4.06Å; F372-L421 HydrophobicContact CE2-CD1 3.74Å; F372-L421 HydrophobicContact CE2-CD2 3.55Å; F372-L421 HydrophobicContact CE2-CG 3.64Å; F372-L421 HydrophobicContact CZ-CD1 4.19Å; F372-L421 HydrophobicContact CZ-CD2 3.92Å; F372-L421 HydrophobicContact CZ-CG 4.35Å; V376-L421 HydrophobicContact CB-CD1 4.36Å; V376-L421 HydrophobicContact CG2-CD1 3.52Å; K417-L421 PolarHBondContact O-N 3.43Å; V418-L421 WeakPolarHBondContact O-CB 3.38Å; V418-L421 PolarHBondContact O-N 2.97Å; T419-L421 VanDerWaalsContact C-N 3.3Å; T419-L421 PolarHBondContact O-N 3.44Å; L421-N424 PolarHBondContact O-ND2 2.86Å; L421-N424 VanDerWaalsContact O-ND2 3.12Å
422	F	86.3	Confident	89.4	Confident	22 Å²	22	34.2 Å²	34.2	10%	0.096	19%	0.192	C	C	.	.	H	α-helix	trans	-105	-21.4	-179.6	-55.5	-62.9	0	0	0	114.6	F372 V418 T419 H420 T427 F730	F372-F422 HydrophobicContact CD2-CD1 4.37Å; F372-F422 AromaticContact CD2-CE1 3.75Å; F372-F422 HydrophobicContact CD2-CE1 3.75Å; F372-F422 AromaticContact CE2-CE1 3.66Å; F372-F422 HydrophobicContact CE2-CE1 3.66Å; F372-F422 AromaticContact CE2-CZ 3.99Å; F372-F422 HydrophobicContact CE2-CZ 3.99Å; V418-F422 HydrophobicContact CG1-CD2 4.18Å; V418-F422 HydrophobicContact CG1-CE2 3.78Å; V418-F422 WeakPolarHBondContact O-CD2 3.41Å; T419-F422 PolarHBondContact O-N 2.83Å; H420-F422 PolarHBondContact O-N 3.47Å; F422-T427 WeakPolarHBondContact O-CG2 3.47Å; F422-T427 PolarHBondContact O-OG1 3.27Å; F422-F730 HydrophobicContact CD1-CD2 4.35Å; F422-F730 AromaticContact CE1-CD2 3.92Å; F422-F730 HydrophobicContact CE1-CD2 3.92Å; F422-F730 HydrophobicContact CE1-CE2 4.03Å; F422-F730 HydrophobicContact CZ-CD2 4.34Å; F422-F730 HydrophobicContact CZ-CE2 4.23Å
423	D	88.1	Confident	89.8	Confident	6 Å²	6	36 Å²	36	3%	0.032	20%	0.199	C	C	.	.	S	Bend	trans	-106.7	56.7	-179.2	-164.9	14.6	0	0	0	112.3	T419 L643 S793 D794 R798	T419-D423 HydrophobicContact CG2-CB 4.03Å; T419-D423 VanDerWaalsContact O-CB 3.26Å; T419-D423 WeakPolarHBondContact O-CB 3.35Å; T419-D423 PolarHBondContact O-N 3.39Å; D423-L643 HydrophobicContact CB-CD2 3.68Å; D423-S793 VanDerWaalsContact CG-OG 3.32Å; D423-S793 WeakPolarHBondContact OD1-CB 3.48Å; D423-S793 PolarHBondContact OD1-OG 2.94Å; D423-S793 PolarHBondContact OD2-OG 2.82Å; D423-D794 PolarHBondContact OD2-N 3.5Å; D423-R798 PolarHBondContact O-NH1 3.27Å; D423-R798 PolarHBondContact O-NH2 3.4Å; D423-R798 IonicContact OD1-NH2 2.7Å; D423-R798 PolarHBondContact OD1-NH2 3.27Å; D423-R798 IonicContact OD2-CZ 2.81Å; D423-R798 IonicContact OD2-NH2 3.22Å; D423-R798 PolarHBondContact OD2-NH2 3.3Å
424	N	87.6	Confident	90.1	Very high	4 Å²	4	34.6 Å²	34.6	2%	0.021	19%	0.189	C	C	.	.	S	Bend	trans	-112.8	158.5	-179.8	74.9	68.8	0	0	0	111.8	L421 A426 T427	L421-N424 PolarHBondContact O-ND2 2.86Å; L421-N424 VanDerWaalsContact O-ND2 3.12Å; N424-A426 PolarHBondContact O-N 3.44Å; N424-A426 WeakPolarHBondContact OD1-CA 3.21Å; N424-A426 VanDerWaalsContact OD1-CB 3.3Å; N424-A426 WeakPolarHBondContact OD1-CB 3.43Å; N424-A426 PolarHBondContact OD1-N 3.39Å; N424-T427 PolarHBondContact O-N 3.08Å; N424-T427 PolarHBondContact O-OG1 2.9Å
425	G	87.1	Confident	90.3	Very high	46 Å²	46	29.9 Å²	29.9	47%	0.474	16%	0.162	S	C	.	.	H	α-helix	trans	-59.8	-19.8	-175	0	0	0	0	0	115.5
426	A	91.9	Very high	90.7	Very high	22 Å²	22	27.3 Å²	27.3	18%	0.182	16%	0.155	C	C	.	.	H	α-helix	trans	-80.2	-16.7	176.5	0	0	0	0	0	113.2	V371 Y374 N424 F429 F430	V371-A426 HydrophobicContact CG1-CB 4.15Å; V371-A426 HydrophobicContact CG2-CB 4.25Å; Y374-A426 HydrophobicContact CD1-CB 3.83Å; Y374-A426 HydrophobicContact CE1-CB 4.12Å; N424-A426 PolarHBondContact O-N 3.44Å; N424-A426 WeakPolarHBondContact OD1-CA 3.21Å; N424-A426 VanDerWaalsContact OD1-CB 3.3Å; N424-A426 WeakPolarHBondContact OD1-CB 3.43Å; N424-A426 PolarHBondContact OD1-N 3.39Å; A426-F429 PolarHBondContact O-N 3.31Å; A426-F430 WeakPolarHBondContact O-CB 3.33Å; A426-F430 PolarHBondContact O-N 3.32Å
427	T	91.7	Very high	91.1	Very high	3 Å²	3	27 Å²	27	2%	0.018	15%	0.152	C	C	.	.	H	α-helix	trans	-74.3	-29.1	173.9	69	0	0	0	0	112.4	V371 F422 N424 F430 A431 P731	V371-T427 HydrophobicContact CG1-CG2 3.71Å; F422-T427 WeakPolarHBondContact O-CG2 3.47Å; F422-T427 PolarHBondContact O-OG1 3.27Å; N424-T427 PolarHBondContact O-N 3.08Å; N424-T427 PolarHBondContact O-OG1 2.9Å; T427-F430 WeakPolarHBondContact O-CB 3.5Å; T427-F430 PolarHBondContact O-N 3.36Å; T427-A431 PolarHBondContact O-N 3.12Å; T427-P731 HydrophobicContact CG2-CG 3.52Å
428	V	91.9	Very high	91.3	Very high	20 Å²	20	23.9 Å²	23.9	12%	0.121	14%	0.138	C	C	.	.	H	α-helix	trans	-63.3	-44.4	169.9	-177.2	0	0	0	0	110.7	F430 A431 V432 I789 F795 F887	V428-F430 VanDerWaalsContact C-N 3.34Å; V428-A431 PolarHBondContact O-N 3.11Å; V428-V432 PolarHBondContact O-N 3.11Å; V428-I789 HydrophobicContact CG1-CD1 4.39Å; V428-I789 HydrophobicContact CG2-CD1 4.48Å; V428-I789 HydrophobicContact CG2-CG2 3.92Å; V428-F795 HydrophobicContact CG2-CD1 3.98Å; V428-F795 HydrophobicContact CG2-CD2 4.09Å; V428-F795 HydrophobicContact CG2-CE1 4.1Å; V428-F795 HydrophobicContact CG2-CE2 4.2Å; V428-F795 HydrophobicContact CG2-CG 3.98Å; V428-F795 HydrophobicContact CG2-CZ 4.22Å; V428-F887 HydrophobicContact CG1-CZ 4.23Å
429	F	93.2	Very high	91.5	Very high	127 Å²	127	21.9 Å²	21.9	56%	0.557	13%	0.126	S	C	*	.	H	α-helix	trans	-61.2	-42.1	170.7	167.6	-97.9	0	0	0	111.7	I367 A426 A431 V432 F433	I367-F429 HydrophobicContact CG2-CE1 4.42Å; A426-F429 PolarHBondContact O-N 3.31Å; F429-A431 PolarHBondContact O-N 3.36Å; F429-V432 PolarHBondContact O-N 2.94Å; F429-F433 PolarHBondContact O-N 3.21Å
430	F	94.9	Very high	91.7	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-63	-38.6	178.7	-167.8	-124.3	0	0	0	112.9	I367 G368 V371 A426 T427 V428 V432 F433 M434 V727 P731 P734	I367-F430 HydrophobicContact CB-CD2 4.39Å; I367-F430 HydrophobicContact CB-CE2 4.07Å; I367-F430 HydrophobicContact CG2-CD2 3.74Å; I367-F430 HydrophobicContact CG2-CE2 3.94Å; G368-F430 VanDerWaalsContact N-CE2 3.32Å; V371-F430 HydrophobicContact CG1-CB 4.37Å; V371-F430 HydrophobicContact CG2-CB 4.15Å; V371-F430 HydrophobicContact CG2-CD2 4.37Å; V371-F430 HydrophobicContact CG2-CG 4.39Å; A426-F430 WeakPolarHBondContact O-CB 3.33Å; A426-F430 PolarHBondContact O-N 3.32Å; T427-F430 WeakPolarHBondContact O-CB 3.5Å; T427-F430 PolarHBondContact O-N 3.36Å; V428-F430 VanDerWaalsContact C-N 3.34Å; F430-V432 PolarHBondContact O-N 2.8Å; F430-F433 AromaticContact CD2-CD1 3.91Å; F430-F433 HydrophobicContact CD2-CD1 3.91Å; F430-F433 AromaticContact CE2-CD1 3.8Å; F430-F433 HydrophobicContact CE2-CD1 3.8Å; F430-F433 HydrophobicContact CE2-CE1 4.18Å; F430-F433 PolarHBondContact O-N 3.41Å; F430-M434 HydrophobicContact CD1-CG 4.12Å; F430-M434 HydrophobicContact CD2-CG 4.21Å; F430-M434 HydrophobicContact CE1-CG 3.8Å; F430-M434 HydrophobicContact CE1-SD 4.32Å; F430-M434 HydrophobicContact CE2-CG 3.89Å; F430-M434 HydrophobicContact CE2-SD 3.97Å; F430-M434 HydrophobicContact CG-CG 4.33Å; F430-M434 HydrophobicContact CZ-CG 3.69Å; F430-M434 HydrophobicContact CZ-SD 3.7Å; F430-M434 WeakPolarHBondContact O-CB 3.41Å; F430-M434 VanDerWaalsContact O-CG 3.3Å; F430-M434 WeakPolarHBondContact O-CG 3.32Å; F430-M434 PolarHBondContact O-N 2.92Å; F430-V727 HydrophobicContact CD1-CG2 4.09Å; F430-V727 HydrophobicContact CE1-CG2 3.6Å; F430-P731 HydrophobicContact CD1-CB 3.81Å; F430-P731 HydrophobicContact CD1-CG 4.38Å; F430-P731 HydrophobicContact CE1-CB 3.93Å; F430-P731 WeakPolarHBondContact CE1-O 3.19Å; F430-P734 HydrophobicContact CE1-CG 4.5Å; F430-P734 HydrophobicContact CZ-CG 4.15Å
431	A	93.7	Very high	92	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.008	13%	0.126	C	C	.	.	H	α-helix	trans	-62.2	-42.5	175.7	0	0	0	0	0	112.3	T427 V428 F429 M434 A435 A728 N785 I789 F891	T427-A431 PolarHBondContact O-N 3.12Å; V428-A431 PolarHBondContact O-N 3.11Å; F429-A431 PolarHBondContact O-N 3.36Å; A431-M434 PolarHBondContact O-N 2.73Å; A431-A435 PolarHBondContact O-N 2.88Å; A431-A435 VanDerWaalsContact O-N 3.07Å; A431-A728 HydrophobicContact CB-CB 4.13Å; A431-N785 HydrophobicContact CB-CB 4.31Å; A431-I789 HydrophobicContact CB-CD1 3.78Å; A431-F891 HydrophobicContact CB-CZ 4.2Å
432	V	93.4	Very high	92.1	Very high	38 Å²	38	20.7 Å²	20.7	23%	0.23	12%	0.121	C	C	.	.	H	α-helix	trans	-63.5	-46	173.3	177.9	0	0	0	0	110.8	V428 F429 F430 M434 A435 V436 F891 V895	V428-V432 PolarHBondContact O-N 3.11Å; F429-V432 PolarHBondContact O-N 2.94Å; F430-V432 PolarHBondContact O-N 2.8Å; V432-M434 VanDerWaalsContact C-N 3.31Å; V432-M434 PolarHBondContact O-N 2.77Å; V432-A435 PolarHBondContact O-N 2.93Å; V432-V436 WeakPolarHBondContact O-CG2 3.43Å; V432-V436 PolarHBondContact O-N 3.29Å; V432-V436 VanDerWaalsContact O-N 3.1Å; V432-F891 HydrophobicContact CG2-CD2 4.26Å; V432-F891 HydrophobicContact CG2-CE2 3.52Å; V432-F891 HydrophobicContact CG2-CZ 3.98Å; V432-V895 HydrophobicContact CG1-CG2 4.38Å; V432-V895 HydrophobicContact CG2-CG2 4.28Å
433	F	94.9	Very high	92.4	Very high	45 Å²	45	20 Å²	20	20%	0.197	12%	0.119	C	C	.	.	H	α-helix	trans	-57.7	-42.5	175	167	-92.4	0	0	0	112	A364 I367 F429 F430 V436 W437	A364-F433 HydrophobicContact CB-CE1 4.32Å; I367-F433 HydrophobicContact CD1-CD1 4.47Å; I367-F433 HydrophobicContact CD1-CD2 3.99Å; I367-F433 HydrophobicContact CD1-CE1 4.18Å; I367-F433 HydrophobicContact CD1-CE2 3.64Å; I367-F433 HydrophobicContact CD1-CG 4.4Å; I367-F433 HydrophobicContact CD1-CZ 3.75Å; I367-F433 HydrophobicContact CG2-CD1 4.48Å; F429-F433 PolarHBondContact O-N 3.21Å; F430-F433 AromaticContact CD2-CD1 3.91Å; F430-F433 HydrophobicContact CD2-CD1 3.91Å; F430-F433 AromaticContact CE2-CD1 3.8Å; F430-F433 HydrophobicContact CE2-CD1 3.8Å; F430-F433 HydrophobicContact CE2-CE1 4.18Å; F430-F433 PolarHBondContact O-N 3.41Å; F433-V436 WeakPolarHBondContact O-CB 3.47Å; F433-V436 PolarHBondContact O-N 2.81Å; F433-W437 HydrophobicContact CE1-CB 4.04Å; F433-W437 HydrophobicContact CE1-CG 4.38Å; F433-W437 HydrophobicContact CZ-CB 4.02Å; F433-W437 HydrophobicContact CZ-CG 4.33Å; F433-W437 VanDerWaalsContact O-CB 3.27Å; F433-W437 WeakPolarHBondContact O-CB 3.49Å; F433-W437 PolarHBondContact O-N 2.77Å
434	M	95.2	Very high	92.5	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-70.4	-35.2	-177.6	-75.6	-60.5	-63.1	0	0	112.9	A364 F430 A431 V432 W437 A438 T723 V727 P734	A364-M434 HydrophobicContact CB-CE 4.2Å; A364-M434 HydrophobicContact CB-SD 3.7Å; F430-M434 HydrophobicContact CD1-CG 4.12Å; F430-M434 HydrophobicContact CD2-CG 4.21Å; F430-M434 HydrophobicContact CE1-CG 3.8Å; F430-M434 HydrophobicContact CE1-SD 4.32Å; F430-M434 HydrophobicContact CE2-CG 3.89Å; F430-M434 HydrophobicContact CE2-SD 3.97Å; F430-M434 HydrophobicContact CG-CG 4.33Å; F430-M434 HydrophobicContact CZ-CG 3.69Å; F430-M434 HydrophobicContact CZ-SD 3.7Å; F430-M434 WeakPolarHBondContact O-CB 3.41Å; F430-M434 VanDerWaalsContact O-CG 3.3Å; F430-M434 WeakPolarHBondContact O-CG 3.32Å; F430-M434 PolarHBondContact O-N 2.92Å; A431-M434 PolarHBondContact O-N 2.73Å; V432-M434 VanDerWaalsContact C-N 3.31Å; V432-M434 PolarHBondContact O-N 2.77Å; M434-W437 HydrophobicContact CE-CD2 4.25Å; M434-W437 HydrophobicContact CE-CE3 3.64Å; M434-W437 HydrophobicContact CE-CZ3 3.95Å; M434-W437 PolarHBondContact O-N 3.39Å; M434-W437 HydrophobicContact SD-CD2 4.49Å; M434-W437 HydrophobicContact SD-CE3 4.38Å; M434-A438 WeakPolarHBondContact O-CB 3.36Å; M434-A438 PolarHBondContact O-N 3.4Å; M434-T723 WeakPolarHBondContact CE-O 3.28Å; M434-V727 HydrophobicContact CB-CG1 3.77Å; M434-V727 HydrophobicContact CE-CG2 4.4Å; M434-V727 HydrophobicContact CG-CG1 4.01Å; M434-V727 HydrophobicContact CG-CG2 3.95Å; M434-P734 HydrophobicContact CE-CG 3.76Å; M434-P734 HydrophobicContact SD-CG 4.18Å
435	A	92.8	Very high	92.7	Very high	7 Å²	7	23.2 Å²	23.2	6%	0.058	13%	0.132	C	C	.	.	H	α-helix	trans	-66.4	-39.5	172	0	0	0	0	0	112.4	A431 V432 T439 V782 V895	A431-A435 PolarHBondContact O-N 2.88Å; A431-A435 VanDerWaalsContact O-N 3.07Å; V432-A435 PolarHBondContact O-N 2.93Å; A435-T439 PolarHBondContact O-N 3.07Å; A435-T439 PolarHBondContact O-OG1 3.4Å; A435-V782 HydrophobicContact CB-CG2 4.05Å; A435-V895 HydrophobicContact CB-CG1 3.46Å; A435-V895 VanDerWaalsContact CB-CG1 3.46Å
436	V	92.6	Very high	92.9	Very high	39 Å²	39	22.5 Å²	22.5	24%	0.236	12%	0.116	C	C	.	.	H	α-helix	trans	-62.8	-48.2	171	166.4	0	0	0	0	110.6	V432 F433 A438 T439 V440 I898 I902	V432-V436 WeakPolarHBondContact O-CG2 3.43Å; V432-V436 PolarHBondContact O-N 3.29Å; V432-V436 VanDerWaalsContact O-N 3.1Å; F433-V436 WeakPolarHBondContact O-CB 3.47Å; F433-V436 PolarHBondContact O-N 2.81Å; V436-A438 PolarHBondContact O-N 2.95Å; V436-T439 WeakPolarHBondContact O-CB 3.42Å; V436-T439 PolarHBondContact O-N 2.93Å; V436-V440 HydrophobicContact CG1-CG2 4.28Å; V436-V440 WeakPolarHBondContact O-CB 3.41Å; V436-V440 VanDerWaalsContact O-CG2 3.27Å; V436-V440 WeakPolarHBondContact O-CG2 3.42Å; V436-V440 PolarHBondContact O-N 3.27Å; V436-I898 HydrophobicContact CG2-CG2 3.69Å; V436-I902 HydrophobicContact CB-CD1 4.49Å; V436-I902 HydrophobicContact CG1-CD1 3.8Å; V436-I902 HydrophobicContact CG2-CD1 4.37Å
437	W	95.3	Very high	92.7	Very high	8 Å²	8	24.5 Å²	24.5	3%	0.03	12%	0.119	C	C	.	.	H	α-helix	trans	-59.3	-43.8	178.8	172.2	90.9	0	0	0	112.2	Y357 M360 L361 A364 F433 M434 T439 V440 F441 F720 T724	Y357-W437 HydrophobicContact CE2-CH2 4.25Å; M360-W437 HydrophobicContact CB-CZ2 4.19Å; M360-W437 PolarHBondContact O-NE1 3.1Å; L361-W437 HydrophobicContact CD2-CH2 3.93Å; L361-W437 HydrophobicContact CD2-CZ2 3.99Å; L361-W437 HydrophobicContact CG-CZ2 4.34Å; A364-W437 HydrophobicContact CB-CD2 4.24Å; A364-W437 HydrophobicContact CB-CG 4.41Å; A364-W437 HydrophobicContact CB-CZ2 4.41Å; F433-W437 HydrophobicContact CE1-CB 4.04Å; F433-W437 HydrophobicContact CE1-CG 4.38Å; F433-W437 HydrophobicContact CZ-CB 4.02Å; F433-W437 HydrophobicContact CZ-CG 4.33Å; F433-W437 VanDerWaalsContact O-CB 3.27Å; F433-W437 WeakPolarHBondContact O-CB 3.49Å; F433-W437 PolarHBondContact O-N 2.77Å; M434-W437 HydrophobicContact CE-CD2 4.25Å; M434-W437 HydrophobicContact CE-CE3 3.64Å; M434-W437 HydrophobicContact CE-CZ3 3.95Å; M434-W437 PolarHBondContact O-N 3.39Å; M434-W437 HydrophobicContact SD-CD2 4.49Å; M434-W437 HydrophobicContact SD-CE3 4.38Å; W437-T439 VanDerWaalsContact C-N 3.34Å; W437-T439 PolarHBondContact O-N 3.33Å; W437-V440 PolarHBondContact O-N 3.34Å; W437-F441 VanDerWaalsContact O-CB 3.3Å; W437-F441 WeakPolarHBondContact O-CB 3.13Å; W437-F441 PolarHBondContact O-N 2.8Å; W437-F720 HydrophobicContact CH2-CD2 4.47Å; W437-F720 HydrophobicContact CH2-CE2 4.1Å; W437-F720 HydrophobicContact CZ3-CD2 4.44Å; W437-F720 AromaticContact CZ3-CE2 3.81Å; W437-F720 HydrophobicContact CZ3-CE2 3.81Å; W437-T724 HydrophobicContact CZ3-CG2 4.14Å
438	A	94.1	Very high	92.6	Very high	2 Å²	2	28.8 Å²	28.8	2%	0.017	13%	0.134	C	C	.	.	H	α-helix	trans	-62.6	-40.9	178.1	0	0	0	0	0	111.7	M434 V436 L442 F720 T724	M434-A438 WeakPolarHBondContact O-CB 3.36Å; M434-A438 PolarHBondContact O-N 3.4Å; V436-A438 PolarHBondContact O-N 2.95Å; A438-L442 WeakPolarHBondContact O-CG 3.45Å; A438-L442 PolarHBondContact O-N 3.02Å; A438-F720 HydrophobicContact CB-CZ 4.15Å; A438-T724 HydrophobicContact CB-CG2 4.35Å
439	T	92.4	Very high	92.4	Very high	7 Å²	7	30.5 Å²	30.5	4%	0.043	14%	0.139	C	C	.	.	H	α-helix	trans	-63	-49.7	173.4	-56.1	0	0	0	0	111.1	A435 V436 W437 F441 L442 E443 K899 I902	A435-T439 PolarHBondContact O-N 3.07Å; A435-T439 PolarHBondContact O-OG1 3.4Å; V436-T439 WeakPolarHBondContact O-CB 3.42Å; V436-T439 PolarHBondContact O-N 2.93Å; W437-T439 VanDerWaalsContact C-N 3.34Å; W437-T439 PolarHBondContact O-N 3.33Å; T439-F441 VanDerWaalsContact C-N 3.32Å; T439-F441 PolarHBondContact O-N 2.86Å; T439-L442 PolarHBondContact O-N 2.81Å; T439-E443 HydrophobicContact CG2-CG 4.4Å; T439-E443 WeakPolarHBondContact O-CG 3.44Å; T439-E443 PolarHBondContact O-N 2.91Å; T439-K899 HydrophobicContact CG2-CB 4.41Å; T439-K899 HydrophobicContact CG2-CG 3.79Å; T439-K899 WeakPolarHBondContact OG1-CG 3.22Å; T439-I902 HydrophobicContact CG2-CB 4.17Å; T439-I902 HydrophobicContact CG2-CG2 3.85Å
440	V	92.1	Very high	92.2	Very high	34 Å²	34	25.3 Å²	25.3	21%	0.206	12%	0.119	C	C	.	.	H	α-helix	trans	-60.2	-40.8	179	168.5	0	0	0	0	111.4	M360 V436 W437 F444 I902	M360-V440 HydrophobicContact CE-CG1 4.03Å; V436-V440 HydrophobicContact CG1-CG2 4.28Å; V436-V440 WeakPolarHBondContact O-CB 3.41Å; V436-V440 VanDerWaalsContact O-CG2 3.27Å; V436-V440 WeakPolarHBondContact O-CG2 3.42Å; V436-V440 PolarHBondContact O-N 3.27Å; W437-V440 PolarHBondContact O-N 3.34Å; V440-F444 HydrophobicContact CG1-CD2 3.67Å; V440-F444 HydrophobicContact CG1-CE2 3.89Å; V440-F444 WeakPolarHBondContact O-CB 3.48Å; V440-F444 WeakPolarHBondContact O-CD2 3.25Å; V440-F444 PolarHBondContact O-N 3.12Å; V440-I902 HydrophobicContact CG2-CD1 4.28Å; V440-I902 HydrophobicContact CG2-CG2 3.96Å
441	F	93.6	Very high	91.8	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-58	-47.7	174.9	161.4	-109.6	0	0	0	112.1	W353 W356 Y357 M360 W437 T439 W445 F720	W353-F441 HydrophobicContact CZ2-CZ 4.45Å; W353-F441 AromaticContact NE1-CZ 3.82Å; W356-F441 AromaticContact CD1-CD2 3.9Å; W356-F441 AromaticContact CD1-CE2 3.68Å; W356-F441 AromaticContact NE1-CD2 3.84Å; Y357-F441 HydrophobicContact CD2-CE2 4.19Å; Y357-F441 HydrophobicContact CD2-CZ 4.14Å; Y357-F441 HydrophobicContact CG-CE2 4.46Å; Y357-F441 HydrophobicContact CG-CZ 4.38Å; M360-F441 HydrophobicContact CB-CD2 4.01Å; M360-F441 HydrophobicContact CE-CB 4.43Å; M360-F441 HydrophobicContact CG-CD2 4.1Å; W437-F441 VanDerWaalsContact O-CB 3.3Å; W437-F441 WeakPolarHBondContact O-CB 3.13Å; W437-F441 PolarHBondContact O-N 2.8Å; T439-F441 VanDerWaalsContact C-N 3.32Å; T439-F441 PolarHBondContact O-N 2.86Å; F441-W445 VanDerWaalsContact O-CB 3.27Å; F441-W445 WeakPolarHBondContact O-CB 3.27Å; F441-W445 PolarHBondContact O-N 2.75Å; F441-F720 HydrophobicContact CD1-CD2 4.46Å; F441-F720 AromaticContact CD1-CE2 3.57Å; F441-F720 HydrophobicContact CD1-CE2 3.57Å; F441-F720 HydrophobicContact CD1-CZ 4.03Å; F441-F720 HydrophobicContact CE1-CD2 4.05Å; F441-F720 AromaticContact CE1-CE2 3.55Å; F441-F720 HydrophobicContact CE1-CE2 3.55Å; F441-F720 HydrophobicContact CE1-CZ 4.12Å
442	L	92.2	Very high	91.5	Very high	4 Å²	4	26.5 Å²	26.5	2%	0.021	13%	0.126	C	C	.	.	H	α-helix	trans	-68.4	-45	179.7	-67.6	174.5	0	0	0	112.5	A438 T439 W445 K446 Y771 L774 E775	A438-L442 WeakPolarHBondContact O-CG 3.45Å; A438-L442 PolarHBondContact O-N 3.02Å; T439-L442 PolarHBondContact O-N 2.81Å; L442-W445 PolarHBondContact O-N 2.89Å; L442-W445 VanDerWaalsContact O-N 3.14Å; L442-K446 WeakPolarHBondContact O-CG 3.4Å; L442-K446 PolarHBondContact O-N 3.02Å; L442-Y771 HydrophobicContact CB-CE2 4.28Å; L442-Y771 HydrophobicContact CD2-CD2 4.45Å; L442-Y771 HydrophobicContact CD2-CE2 4.02Å; L442-L774 HydrophobicContact CD2-CB 3.85Å; L442-L774 HydrophobicContact CD2-CD1 4.38Å; L442-E775 HydrophobicContact CD1-CB 4.29Å
443	E	90.6	Very high	91.2	Very high	8 Å²	8	25.1 Å²	25.1	4%	0.037	12%	0.119	C	C	.	.	H	α-helix	trans	-67.7	-36.2	179.8	-66.8	-56.8	148.2	0	0	112.8	T439 K446 R447 I906	T439-E443 HydrophobicContact CG2-CG 4.4Å; T439-E443 WeakPolarHBondContact O-CG 3.44Å; T439-E443 PolarHBondContact O-N 2.91Å; E443-K446 IonicContact OE1-NZ 3.49Å; E443-K446 PolarHBondContact OE1-NZ 2.99Å; E443-K446 WeakPolarHBondContact OE2-CD 3.24Å; E443-K446 IonicContact OE2-NZ 2.7Å; E443-K446 PolarHBondContact OE2-NZ 3.46Å; E443-R447 WeakPolarHBondContact O-CG 3.4Å; E443-R447 PolarHBondContact O-N 2.9Å; E443-I906 HydrophobicContact CB-CB 4.23Å; E443-I906 HydrophobicContact CB-CD1 4.26Å; E443-I906 HydrophobicContact CB-CG2 3.85Å
444	F	90.8	Very high	90.6	Very high	76 Å²	76	24.9 Å²	24.9	33%	0.333	12%	0.117	S	C	.	.	H	α-helix	trans	-75.3	-28.2	169.5	-79.9	-77.5	0	0	0	113.1	W356 V440 R447 R448 I906	W356-F444 HydrophobicContact CH2-CB 4.23Å; W356-F444 HydrophobicContact CZ2-CB 3.49Å; W356-F444 VanDerWaalsContact CZ2-CB 3.49Å; W356-F444 HydrophobicContact CZ2-CG 4.43Å; V440-F444 HydrophobicContact CG1-CD2 3.67Å; V440-F444 HydrophobicContact CG1-CE2 3.89Å; V440-F444 WeakPolarHBondContact O-CB 3.48Å; V440-F444 WeakPolarHBondContact O-CD2 3.25Å; V440-F444 PolarHBondContact O-N 3.12Å; F444-R447 PolarHBondContact O-N 3.43Å; F444-R448 WeakPolarHBondContact O-CB 3.47Å; F444-R448 PolarHBondContact O-N 2.84Å; F444-I906 HydrophobicContact CD2-CD1 4.39Å; F444-I906 HydrophobicContact CE2-CD1 3.96Å
445	W	92.4	Very high	90	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-66.2	-44.5	171.4	177.7	-120	0	0	0	111.8	L349 A352 W353 W356 F441 L442 R447 R448 R449 I452 I767	L349-W445 HydrophobicContact CD1-CH2 3.99Å; L349-W445 HydrophobicContact CD1-CZ2 4.08Å; A352-W445 HydrophobicContact CB-CH2 4.44Å; W353-W445 HydrophobicContact CB-CH2 3.66Å; W353-W445 HydrophobicContact CB-CZ2 3.66Å; W353-W445 HydrophobicContact CB-CZ3 4.26Å; W353-W445 AromaticContact CD1-CD2 3.8Å; W353-W445 AromaticContact CD1-CE2 3.51Å; W353-W445 AromaticContact CD1-CZ2 3.83Å; W353-W445 AromaticContact CD1-NE1 3.63Å; W353-W445 HydrophobicContact CG-CH2 4.45Å; W353-W445 HydrophobicContact CG-CZ2 4.14Å; W356-W445 HydrophobicContact CB-CE3 3.87Å; W356-W445 HydrophobicContact CB-CZ3 3.92Å; W356-W445 AromaticContact CD1-CE3 3.62Å; W356-W445 HydrophobicContact CD2-CE3 4.47Å; W356-W445 AromaticContact CG-CE3 3.69Å; W356-W445 HydrophobicContact CG-CE3 3.69Å; W356-W445 HydrophobicContact CG-CZ3 4.21Å; F441-W445 VanDerWaalsContact O-CB 3.27Å; F441-W445 WeakPolarHBondContact O-CB 3.27Å; F441-W445 PolarHBondContact O-N 2.75Å; L442-W445 PolarHBondContact O-N 2.89Å; L442-W445 VanDerWaalsContact O-N 3.14Å; W445-R447 PolarHBondContact O-N 2.94Å; W445-R448 HydrophobicContact CE3-CB 3.98Å; W445-R448 HydrophobicContact CE3-CG 4.11Å; W445-R448 HydrophobicContact CZ3-CB 4.28Å; W445-R448 HydrophobicContact CZ3-CG 3.94Å; W445-R448 CarbonylContact O-C 3.58Å; W445-R448 PolarHBondContact O-N 3.47Å; W445-R449 HydrophobicContact CH2-CB 4.47Å; W445-R449 HydrophobicContact CZ2-CB 4Å; W445-R449 WeakPolarHBondContact O-CG 3.28Å; W445-R449 PolarHBondContact O-N 3.32Å; W445-I452 HydrophobicContact CH2-CD1 4.4Å; W445-I452 HydrophobicContact CZ3-CD1 4.41Å; W445-I767 HydrophobicContact CZ2-CG2 3.98Å
446	K	90.2	Very high	89.6	Confident	32 Å²	32	28.3 Å²	28.3	14%	0.139	13%	0.134	C	C	.	.	H	α-helix	trans	-49.1	-46.4	170.7	-74.5	159.2	128	-160	0	111.6	L442 E443 R449 A450 Y771 D908	L442-K446 WeakPolarHBondContact O-CG 3.4Å; L442-K446 PolarHBondContact O-N 3.02Å; E443-K446 IonicContact OE1-NZ 3.49Å; E443-K446 PolarHBondContact OE1-NZ 2.99Å; E443-K446 WeakPolarHBondContact OE2-CD 3.24Å; E443-K446 IonicContact OE2-NZ 2.7Å; E443-K446 PolarHBondContact OE2-NZ 3.46Å; K446-R449 WeakPolarHBondContact O-CG 3.48Å; K446-A450 WeakPolarHBondContact O-CB 3.44Å; K446-A450 PolarHBondContact O-N 3.25Å; K446-A450 VanDerWaalsContact O-N 3.15Å; K446-Y771 HydrophobicContact CD-CE2 4.3Å; K446-Y771 WeakPolarHBondContact CD-OH 3.24Å; K446-Y771 VanDerWaalsContact CE-OH 3.27Å; K446-Y771 WeakPolarHBondContact CE-OH 3.19Å; K446-Y771 HydrophobicContact CG-CE2 3.78Å; K446-D908 WeakPolarHBondContact CD-OD1 3.45Å; K446-D908 WeakPolarHBondContact CE-OD1 3.32Å; K446-D908 IonicContact NZ-OD1 3.63Å; K446-D908 PolarHBondContact NZ-OD1 3.46Å
447	R	89.3	Confident	89	Confident	64 Å²	64	28.5 Å²	28.5	24%	0.242	13%	0.134	C	C	.	.	H	α-helix	trans	-69.3	-35.3	177.4	-67.5	170.9	68.6	-171.1	2.7	113.3	E443 F444 W445 V451 I906 P907 D908	E443-R447 WeakPolarHBondContact O-CG 3.4Å; E443-R447 PolarHBondContact O-N 2.9Å; F444-R447 PolarHBondContact O-N 3.43Å; W445-R447 PolarHBondContact O-N 2.94Å; R447-V451 WeakPolarHBondContact O-CG2 3.2Å; R447-V451 PolarHBondContact O-N 3.05Å; R447-I906 VanDerWaalsContact CD-CG2 3.41Å; R447-P907 WeakPolarHBondContact CD-O 2.93Å; R447-P907 VanDerWaalsContact CG-O 3.3Å; R447-P907 WeakPolarHBondContact CG-O 3.44Å; R447-P907 PolarHBondContact NE-O 3.48Å; R447-D908 WeakPolarHBondContact CA-O 3.26Å; R447-D908 WeakPolarHBondContact CG-O 3.45Å
448	R	88.3	Confident	88.3	Confident	92 Å²	92	28.3 Å²	28.3	35%	0.347	13%	0.133	S	C	.	.	H	α-helix	trans	-74.3	-44.7	178.7	-176.5	56.8	179	148.4	5.1	111.7	W356 F444 W445 A450 V451 I452	W356-R448 HydrophobicContact CD2-CB 4.5Å; W356-R448 HydrophobicContact CD2-CG 4.37Å; W356-R448 HydrophobicContact CE3-CB 4.47Å; W356-R448 HydrophobicContact CE3-CG 4.06Å; F444-R448 WeakPolarHBondContact O-CB 3.47Å; F444-R448 PolarHBondContact O-N 2.84Å; W445-R448 HydrophobicContact CE3-CB 3.98Å; W445-R448 HydrophobicContact CE3-CG 4.11Å; W445-R448 HydrophobicContact CZ3-CB 4.28Å; W445-R448 HydrophobicContact CZ3-CG 3.94Å; W445-R448 CarbonylContact O-C 3.58Å; W445-R448 PolarHBondContact O-N 3.47Å; R448-A450 VanDerWaalsContact C-N 3.31Å; R448-A450 PolarHBondContact O-N 3.05Å; R448-V451 PolarHBondContact O-N 3.21Å; R448-I452 HydrophobicContact CG-CD1 3.93Å; R448-I452 WeakPolarHBondContact O-CG1 3.25Å; R448-I452 PolarHBondContact O-N 3.09Å
449	R	88.9	Confident	87.1	Confident	56 Å²	56	31.3 Å²	31.3	21%	0.211	15%	0.148	C	C	.	.	H	α-helix	trans	-60.9	-38.3	174.2	73.7	176	-176.6	-170.7	-1.9	111.5	W445 K446 V451 I452 A453	W445-R449 HydrophobicContact CH2-CB 4.47Å; W445-R449 HydrophobicContact CZ2-CB 4Å; W445-R449 WeakPolarHBondContact O-CG 3.28Å; W445-R449 PolarHBondContact O-N 3.32Å; K446-R449 WeakPolarHBondContact O-CG 3.48Å; R449-V451 PolarHBondContact O-N 3.41Å; R449-I452 PolarHBondContact O-N 3.27Å; R449-A453 VanDerWaalsContact O-CB 3.28Å; R449-A453 WeakPolarHBondContact O-CB 3.24Å; R449-A453 PolarHBondContact O-N 2.93Å
450	A	87.9	Confident	85.6	Confident	18 Å²	18	35.4 Å²	35.4	15%	0.149	17%	0.17	C	C	.	.	H	α-helix	trans	-65.4	-36.8	177.9	0	0	0	0	0	113	K446 R448 Y454 L909 L913	K446-A450 WeakPolarHBondContact O-CB 3.44Å; K446-A450 PolarHBondContact O-N 3.25Å; K446-A450 VanDerWaalsContact O-N 3.15Å; R448-A450 VanDerWaalsContact C-N 3.31Å; R448-A450 PolarHBondContact O-N 3.05Å; A450-Y454 PolarHBondContact O-N 3.04Å; A450-L909 HydrophobicContact CB-CD2 3.87Å; A450-L913 HydrophobicContact CB-CD2 4.15Å; A450-L913 WeakPolarHBondContact O-CD2 3.24Å
451	V	86.6	Confident	84	Confident	22 Å²	22	36 Å²	36	13%	0.133	17%	0.168	C	C	.	.	H	α-helix	trans	-67.9	-45	172.5	171.4	0	0	0	0	111	R447 R448 R449 A453 Y454 D455 P910 L913	R447-V451 WeakPolarHBondContact O-CG2 3.2Å; R447-V451 PolarHBondContact O-N 3.05Å; R448-V451 PolarHBondContact O-N 3.21Å; R449-V451 PolarHBondContact O-N 3.41Å; V451-A453 PolarHBondContact O-N 3.44Å; V451-Y454 PolarHBondContact O-N 2.65Å; V451-D455 WeakPolarHBondContact CG1-OD2 3.37Å; V451-D455 WeakPolarHBondContact O-CB 3.27Å; V451-D455 PolarHBondContact O-N 3.11Å; V451-P910 HydrophobicContact CG2-CG 3.57Å; V451-L913 HydrophobicContact CG2-CD2 4.14Å
452	I	87	Confident	82	Confident	5 Å²	5	42.1 Å²	42.1	3%	0.026	20%	0.197	C	C	.	.	H	α-helix	trans	-62	-42.8	177.3	-68.4	167.3	0	0	0	111.2	L349 A352 W445 R448 R449 Y454 D455 W456	L349-I452 HydrophobicContact CD1-CG2 4.09Å; A352-I452 HydrophobicContact CB-CD1 3.81Å; W445-I452 HydrophobicContact CH2-CD1 4.4Å; W445-I452 HydrophobicContact CZ3-CD1 4.41Å; R448-I452 HydrophobicContact CG-CD1 3.93Å; R448-I452 WeakPolarHBondContact O-CG1 3.25Å; R448-I452 PolarHBondContact O-N 3.09Å; R449-I452 PolarHBondContact O-N 3.27Å; I452-Y454 VanDerWaalsContact C-N 3.27Å; I452-Y454 PolarHBondContact O-N 2.83Å; I452-D455 PolarHBondContact O-N 3.04Å; I452-W456 HydrophobicContact CG2-CD2 3.52Å; I452-W456 HydrophobicContact CG2-CE3 3.35Å; I452-W456 HydrophobicContact CG2-CG 4.25Å; I452-W456 HydrophobicContact CG2-CH2 3.72Å; I452-W456 HydrophobicContact CG2-CZ2 3.91Å; I452-W456 HydrophobicContact CG2-CZ3 3.46Å; I452-W456 VanDerWaalsContact CG2-CZ3 3.46Å; I452-W456 VanDerWaalsContact O-CB 3.23Å; I452-W456 WeakPolarHBondContact O-CB 3.34Å; I452-W456 PolarHBondContact O-N 2.92Å
453	A	87.1	Confident	80	Confident	9 Å²	9	47.7 Å²	47.7	7%	0.074	22%	0.223	C	C	.	.	H	α-helix	trans	-65.5	-28.2	177.9	0	0	0	0	0	113	R449 V451 D457 L458 I459	R449-A453 VanDerWaalsContact O-CB 3.28Å; R449-A453 WeakPolarHBondContact O-CB 3.24Å; R449-A453 PolarHBondContact O-N 2.93Å; V451-A453 PolarHBondContact O-N 3.44Å; A453-D457 PolarHBondContact O-N 3.46Å; A453-L458 HydrophobicContact CB-CB 4.16Å; A453-L458 PolarHBondContact O-N 3.42Å; A453-I459 HydrophobicContact CB-CG1 3.95Å; A453-I459 PolarHBondContact O-N 2.91Å
454	Y	83.8	Confident	78	Confident	39 Å²	39	51.9 Å²	51.9	15%	0.153	24%	0.242	C	C	.	.	H	α-helix	trans	-75.7	-54.8	170.1	-178.1	-96.7	0	0	0	111.7	A450 V451 I452 W456 D457 I459 L913 R916 M917 E920	A450-Y454 PolarHBondContact O-N 3.04Å; V451-Y454 PolarHBondContact O-N 2.65Å; I452-Y454 VanDerWaalsContact C-N 3.27Å; I452-Y454 PolarHBondContact O-N 2.83Å; Y454-W456 PolarHBondContact O-N 3.49Å; Y454-D457 PolarHBondContact O-N 3.4Å; Y454-I459 HydrophobicContact CD2-CD1 4.15Å; Y454-I459 HydrophobicContact CG-CD1 4.43Å; Y454-L913 HydrophobicContact CD1-CD1 3.67Å; Y454-L913 HydrophobicContact CD2-CD1 3.61Å; Y454-L913 HydrophobicContact CE1-CD1 4.4Å; Y454-L913 HydrophobicContact CE2-CD1 4.35Å; Y454-L913 HydrophobicContact CG-CD1 3.22Å; Y454-R916 VanDerWaalsContact CD1-NH1 3.33Å; Y454-R916 HydrophobicContact CE1-CB 4.25Å; Y454-M917 HydrophobicContact CD2-CG 3.6Å; Y454-M917 HydrophobicContact CD2-SD 4.48Å; Y454-M917 HydrophobicContact CE2-CG 3.64Å; Y454-E920 WeakPolarHBondContact CE2-OE2 3.41Å; Y454-E920 PolarHBondContact OH-OE2 3.25Å
455	D	82.1	Confident	76.3	Confident	72 Å²	72	52 Å²	52	39%	0.385	24%	0.244	S	C	.	.	H	α-helix	trans	-62.1	-15.1	-178	-59.6	-18.5	0	0	0	111.5	V451 I452 R916	V451-D455 WeakPolarHBondContact CG1-OD2 3.37Å; V451-D455 WeakPolarHBondContact O-CB 3.27Å; V451-D455 PolarHBondContact O-N 3.11Å; I452-D455 PolarHBondContact O-N 3.04Å; D455-R916 IonicContact OD1-CZ 2.75Å; D455-R916 IonicContact OD1-NH1 2.93Å; D455-R916 PolarHBondContact OD1-NH1 2.95Å
456	W	83.8	Confident	75	Confident	7 Å²	7	53.4 Å²	53.4	3%	0.027	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.7	15.9	174.9	-61.8	-8.9	0	0	0	115.8	L336 D337 R340 E345 G348 L349 A352 I452 Y454 L458	L336-W456 HydrophobicContact CB-CZ2 4.18Å; D337-W456 PolarHBondContact OD1-NE1 3.27Å; R340-W456 HydrophobicContact CB-CZ2 4.44Å; R340-W456 PolarHBondContact NH2-O 2.88Å; E345-W456 HydrophobicContact CB-CE3 4.24Å; E345-W456 HydrophobicContact CG-CB 4.48Å; E345-W456 HydrophobicContact CG-CE3 4.2Å; G348-W456 VanDerWaalsContact C-CH2 3.46Å; L349-W456 HydrophobicContact CB-CZ3 4.11Å; L349-W456 HydrophobicContact CD1-CZ3 4.46Å; A352-W456 HydrophobicContact CB-CH2 4.5Å; I452-W456 HydrophobicContact CG2-CD2 3.52Å; I452-W456 HydrophobicContact CG2-CE3 3.35Å; I452-W456 HydrophobicContact CG2-CG 4.25Å; I452-W456 HydrophobicContact CG2-CH2 3.72Å; I452-W456 HydrophobicContact CG2-CZ2 3.91Å; I452-W456 HydrophobicContact CG2-CZ3 3.46Å; I452-W456 VanDerWaalsContact CG2-CZ3 3.46Å; I452-W456 VanDerWaalsContact O-CB 3.23Å; I452-W456 WeakPolarHBondContact O-CB 3.34Å; I452-W456 PolarHBondContact O-N 2.92Å; Y454-W456 PolarHBondContact O-N 3.49Å; W456-L458 VanDerWaalsContact C-N 3.32Å; W456-L458 HydrophobicContact CB-CD1 3.97Å; W456-L458 HydrophobicContact CB-CG 4.36Å; W456-L458 HydrophobicContact CE3-CD1 4.23Å; W456-L458 PolarHBondContact O-N 3.21Å
457	D	80.7	Confident	74	Confident	44 Å²	44	55.2 Å²	55.2	24%	0.235	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.5	24.9	171.3	-40.5	-84.5	0	0	0	116	R182 T235 R340 A453 Y454	R182-D457 HydrophobicContact CB-CB 4.42Å; T235-D457 WeakPolarHBondContact CB-OD1 3.23Å; T235-D457 WeakPolarHBondContact CG2-OD1 3.38Å; T235-D457 PolarHBondContact OG1-OD1 2.81Å; R340-D457 IonicContact CZ-OD2 2.74Å; R340-D457 IonicContact NH1-OD2 3.88Å; R340-D457 IonicContact NH2-OD2 3.93Å; R340-D457 PolarHBondContact NH2-OD2 3.19Å; A453-D457 PolarHBondContact O-N 3.46Å; Y454-D457 PolarHBondContact O-N 3.4Å
458	L	79.8	Confident	73.5	Confident	4 Å²	4	53.2 Å²	53.2	2%	0.021	25%	0.254	C	S	.	.			trans	-97	-8.2	-172.8	-67.8	161.8	0	0	0	114.7	E345 A453 W456 W461 R763 A764 K765	E345-L458 HydrophobicContact CB-CD1 4.19Å; E345-L458 HydrophobicContact CB-CD2 4.47Å; E345-L458 HydrophobicContact CG-CD1 4.1Å; E345-L458 HydrophobicContact CG-CD2 4.25Å; E345-L458 HydrophobicContact CG-CG 4.44Å; A453-L458 HydrophobicContact CB-CB 4.16Å; A453-L458 PolarHBondContact O-N 3.42Å; W456-L458 VanDerWaalsContact C-N 3.32Å; W456-L458 HydrophobicContact CB-CD1 3.97Å; W456-L458 HydrophobicContact CB-CG 4.36Å; W456-L458 HydrophobicContact CE3-CD1 4.23Å; W456-L458 PolarHBondContact O-N 3.21Å; L458-W461 WeakPolarHBondContact O-CB 3.47Å; L458-W461 PolarHBondContact O-N 2.82Å; L458-R763 HydrophobicContact CD2-CB 4.09Å; L458-R763 HydrophobicContact CD2-CG 4.18Å; L458-A764 WeakPolarHBondContact CD1-O 3.27Å; L458-K765 HydrophobicContact CB-CB 4.48Å
459	I	70.4	Confident	73.2	Confident	65 Å²	65	49.8 Å²	49.8	33%	0.333	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-37.9	-170.4	-81.1	178.7	0	0	0	114	A453 Y454 W461 M917	A453-I459 HydrophobicContact CB-CG1 3.95Å; A453-I459 PolarHBondContact O-N 2.91Å; Y454-I459 HydrophobicContact CD2-CD1 4.15Å; Y454-I459 HydrophobicContact CG-CD1 4.43Å; I459-W461 PolarHBondContact O-N 3.29Å; I459-M917 HydrophobicContact CD1-CE 4.15Å; I459-M917 HydrophobicContact CD1-SD 4.01Å; I459-M917 HydrophobicContact CG2-CE 3.8Å
460	D	60.6	Low	72.5	Confident	92 Å²	92	49 Å²	49	49%	0.492	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	18.9	179.2	-55.6	-38.2	0	0	0	111.9	R182 E462	R182-D460 IonicContact CZ-OD2 3.59Å; R182-D460 IonicContact NH1-OD2 3.36Å; R182-D460 PolarHBondContact NH1-OD2 2.81Å; R182-D460 IonicContact NH2-OD2 3.7Å; R182-D460 PolarHBondContact NH2-OD2 3.05Å; D460-E462 PolarHBondContact O-N 3.05Å
461	W	57.1	Low	72	Confident	46 Å²	46	54.2 Å²	54.2	17%	0.174	26%	0.264	C	S	.	.			trans	-89.9	97.8	174.9	-175.1	63.6	0	0	0	109.2	L458 I459 E466 K765	L458-W461 WeakPolarHBondContact O-CB 3.47Å; L458-W461 PolarHBondContact O-N 2.82Å; I459-W461 PolarHBondContact O-N 3.29Å; W461-E466 HydrophobicContact CH2-CG 3.51Å; W461-E466 WeakPolarHBondContact CH2-OE1 3.3Å; W461-E466 HydrophobicContact CZ2-CG 3.57Å; W461-E466 HydrophobicContact CZ3-CG 4.49Å; W461-K765 HydrophobicContact CE3-CB 4.25Å; W461-K765 HydrophobicContact CE3-CD 4.27Å; W461-K765 HydrophobicContact CE3-CG 4.39Å; W461-K765 HydrophobicContact CZ3-CD 4.45Å; W461-K765 HydrophobicContact CZ3-CG 4.44Å
462	E	53.4	Low	71.8	Confident	129 Å²	129	53.7 Å²	53.7	60%	0.603	26%	0.26	S	S	*	.			trans	-76.1	147.3	-178.2	-62.3	-177.5	158.1	0	0	111.1	D460 E464 E465	D460-E462 PolarHBondContact O-N 3.05Å; E462-E464 PolarHBondContact O-N 3.45Å; E462-E464 VanDerWaalsContact O-N 3.08Å; E462-E465 WeakPolarHBondContact O-CB 3.49Å; E462-E465 PolarHBondContact O-N 2.9Å
463	E	49.8	Very low	71.3	Confident	122 Å²	122	55.7 Å²	55.7	57%	0.57	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-63.8	-13.3	175	-69.2	173.6	-176.5	0	0	112.5	E466 K765	E463-E466 WeakPolarHBondContact O-CB 3.37Å; E463-E466 PolarHBondContact O-N 3.04Å; E463-K765 IonicContact OE1-NZ 2.79Å; E463-K765 PolarHBondContact OE1-NZ 3.31Å
464	E	47.3	Very low	70.7	Confident	95 Å²	95	56.4 Å²	56.4	44%	0.444	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-83.6	-10.7	172.9	-58.3	-165.7	-165.2	0	0	113.4	E462 E466 I485	E462-E464 PolarHBondContact O-N 3.45Å; E462-E464 VanDerWaalsContact O-N 3.08Å; E464-E466 VanDerWaalsContact C-N 3.35Å; E464-I485 VanDerWaalsContact OE1-CD1 3.23Å; E464-I485 WeakPolarHBondContact OE1-CD1 3.41Å; E464-I485 WeakPolarHBondContact OE2-CD1 3.45Å
465	E	55.1	Low	70.5	Confident	78 Å²	78	58.6 Å²	58.6	36%	0.364	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-84.8	-4.2	164.6	-65.9	-158.2	136.8	0	0	113	N180 E462 E467	N180-E465 PolarHBondContact ND2-OE1 3.27Å; E462-E465 WeakPolarHBondContact O-CB 3.49Å; E462-E465 PolarHBondContact O-N 2.9Å; E465-E467 PolarHBondContact O-N 2.7Å
466	E	65.3	Low	70.5	Confident	30 Å²	30	55.7 Å²	55.7	14%	0.14	27%	0.269	C	S	.	.	S	Bend	trans	-67.4	130.3	175.3	-78.7	-164.8	-175.6	0	0	112	W461 E463 E464 I468 T584 S586	W461-E466 HydrophobicContact CH2-CG 3.51Å; W461-E466 WeakPolarHBondContact CH2-OE1 3.3Å; W461-E466 HydrophobicContact CZ2-CG 3.57Å; W461-E466 HydrophobicContact CZ3-CG 4.49Å; E463-E466 WeakPolarHBondContact O-CB 3.37Å; E463-E466 PolarHBondContact O-N 3.04Å; E464-E466 VanDerWaalsContact C-N 3.35Å; E466-I468 PolarHBondContact O-N 3.08Å; E466-T584 HydrophobicContact CB-CG2 3.77Å; E466-T584 WeakPolarHBondContact OE2-CB 3.4Å; E466-T584 PolarHBondContact OE2-OG1 2.77Å; E466-S586 WeakPolarHBondContact OE1-CB 3.36Å; E466-S586 PolarHBondContact OE1-OG 3.39Å; E466-S586 WeakPolarHBondContact OE2-CB 3.37Å
467	E	70.5	Confident	70.1	Confident	71 Å²	71	56.5 Å²	56.5	33%	0.332	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-69.4	127.2	-178.1	-60.2	-163.6	-123.2	0	0	111.9	H266 R270 E465 R469	H266-E467 IonicContact CE1-OE1 3.61Å; H266-E467 IonicContact CE1-OE2 2.92Å; H266-E467 PolarHBondContact CE1-OE2 3.03Å; H266-E467 IonicContact CG-OE1 2.85Å; H266-E467 IonicContact ND1-OE1 3.95Å; H266-E467 PolarHBondContact ND1-OE1 2.99Å; H266-E467 IonicContact ND1-OE2 3.9Å; H266-E467 PolarHBondContact ND1-OE2 2.81Å; R270-E467 IonicContact CZ-OE2 3.51Å; R270-E467 VanDerWaalsContact CZ-OE2 3.22Å; R270-E467 IonicContact NE-OE2 2.62Å; R270-E467 PolarHBondContact NE-OE2 2.99Å; R270-E467 IonicContact NH2-OE2 3.57Å; R270-E467 PolarHBondContact NH2-OE2 3.26Å; E465-E467 PolarHBondContact O-N 2.7Å; E467-R469 PolarHBondContact O-N 2.62Å
468	I	77.5	Confident	69.8	Low	22 Å²	22	63.9 Å²	63.9	11%	0.113	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-64.1	134.1	175.6	-53.1	179.5	0	0	0	109.3	E466 F472 E473 P491 R583	E466-I468 PolarHBondContact O-N 3.08Å; I468-F472 HydrophobicContact CG2-CB 4.27Å; I468-F472 HydrophobicContact CG2-CD1 3.69Å; I468-F472 HydrophobicContact CG2-CE1 4.5Å; I468-F472 HydrophobicContact CG2-CG 4.34Å; I468-E473 HydrophobicContact CB-CG 4.14Å; I468-E473 HydrophobicContact CG2-CG 3.7Å; I468-P491 HydrophobicContact CD1-CG 4.13Å; I468-P491 HydrophobicContact CG2-CG 4.4Å; I468-R583 WeakPolarHBondContact CA-O 3.17Å; I468-R583 HydrophobicContact CG1-CG 4.27Å; I468-R583 HydrophobicContact CG2-CG 4.15Å; I468-R583 WeakPolarHBondContact CG2-O 3.13Å
469	R	81.8	Confident	69.9	Low	20 Å²	20	70 Å²	70	8%	0.075	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-63.6	131.4	-180	-58.1	-179.1	90.4	-162	18	110.3	E467 Q471 F472 E473 R583 T584 E585 W588	E467-R469 PolarHBondContact O-N 2.62Å; R469-Q471 PolarHBondContact O-N 3.08Å; R469-F472 HydrophobicContact CB-CB 4.33Å; R469-F472 WeakPolarHBondContact O-CA 3.43Å; R469-F472 WeakPolarHBondContact O-CB 3.49Å; R469-F472 PolarHBondContact O-N 2.94Å; R469-E473 PolarHBondContact O-N 3.41Å; R469-E473 VanDerWaalsContact O-N 3.09Å; R469-R583 PolarHBondContact N-O 3.18Å; R469-T584 WeakPolarHBondContact CD-O 3.45Å; R469-E585 IonicContact CZ-OE1 3.07Å; R469-E585 IonicContact CZ-OE2 3.33Å; R469-E585 IonicContact NE-OE1 2.98Å; R469-E585 IonicContact NE-OE2 2.76Å; R469-E585 PolarHBondContact NE-OE2 3.1Å; R469-E585 IonicContact NH2-OE1 3.45Å; R469-E585 PolarHBondContact NH2-OE1 3.44Å; R469-E585 IonicContact NH2-OE2 3.23Å; R469-E585 PolarHBondContact NH2-OE2 3.36Å; R469-W588 VanDerWaalsContact CZ-CG 3.49Å; R469-W588 VanDerWaalsContact NH2-CG 3.33Å
470	P	75.9	Confident	70.4	Confident	39 Å²	39	72.4 Å²	72.4	25%	0.253	34%	0.342	S	S	.	.	H	α-helix	trans	-56.5	-25.4	177.1	-28.8	35.7	0	0	0	114.6	A474	P470-A474 WeakPolarHBondContact O-CB 3.33Å; P470-A474 PolarHBondContact O-N 2.62Å
471	Q	76.4	Confident	71.5	Confident	128 Å²	128	74.7 Å²	74.7	60%	0.598	34%	0.344	S	S	*	.	H	α-helix	trans	-68.2	-37.8	173.5	-59	-177.1	11.6	0	0	112.7	R469 K475	R469-Q471 PolarHBondContact O-N 3.08Å; Q471-K475 PolarHBondContact O-N 2.96Å
472	F	82.4	Confident	72.8	Confident	10 Å²	10	78.7 Å²	78.7	4%	0.044	37%	0.366	C	S	.	.	H	α-helix	trans	-72.8	-48.2	177.7	-175.2	-86.5	0	0	0	110.2	I468 R469 A474 K475 Y476 P491 Q493 Q581 R583	I468-F472 HydrophobicContact CG2-CB 4.27Å; I468-F472 HydrophobicContact CG2-CD1 3.69Å; I468-F472 HydrophobicContact CG2-CE1 4.5Å; I468-F472 HydrophobicContact CG2-CG 4.34Å; R469-F472 HydrophobicContact CB-CB 4.33Å; R469-F472 WeakPolarHBondContact O-CA 3.43Å; R469-F472 WeakPolarHBondContact O-CB 3.49Å; R469-F472 PolarHBondContact O-N 2.94Å; F472-A474 VanDerWaalsContact C-N 3.32Å; F472-A474 PolarHBondContact O-N 3.33Å; F472-K475 PolarHBondContact O-N 2.74Å; F472-Y476 HydrophobicContact CD1-CD2 4.1Å; F472-Y476 AromaticContact CD2-CD2 3.76Å; F472-Y476 HydrophobicContact CD2-CD2 3.76Å; F472-Y476 AromaticContact CD2-CE2 3.76Å; F472-Y476 HydrophobicContact CD2-CE2 3.76Å; F472-Y476 AromaticContact CE1-CD2 3.99Å; F472-Y476 HydrophobicContact CE1-CD2 3.99Å; F472-Y476 AromaticContact CE2-CD2 3.66Å; F472-Y476 HydrophobicContact CE2-CD2 3.66Å; F472-Y476 AromaticContact CE2-CE2 3.6Å; F472-Y476 HydrophobicContact CE2-CE2 3.6Å; F472-Y476 AromaticContact CG-CD2 3.99Å; F472-Y476 HydrophobicContact CG-CD2 3.99Å; F472-Y476 HydrophobicContact CG-CE2 4.41Å; F472-Y476 AromaticContact CZ-CD2 3.77Å; F472-Y476 HydrophobicContact CZ-CD2 3.77Å; F472-Y476 HydrophobicContact CZ-CE2 4.12Å; F472-Y476 HydrophobicContact CZ-CG 4.42Å; F472-Y476 WeakPolarHBondContact O-CD2 3.47Å; F472-Y476 PolarHBondContact O-N 3.02Å; F472-P491 HydrophobicContact CD1-CB 4.37Å; F472-P491 HydrophobicContact CD1-CG 4.19Å; F472-P491 HydrophobicContact CE1-CB 4.12Å; F472-P491 HydrophobicContact CE1-CG 4.17Å; F472-Q493 HydrophobicContact CE2-CB 4.03Å; F472-Q493 HydrophobicContact CZ-CB 3.91Å; F472-Q581 WeakPolarHBondContact CD2-O 3.37Å; F472-Q581 WeakPolarHBondContact CE2-O 3.1Å; F472-R583 HydrophobicContact CD1-CG 4.45Å; F472-R583 HydrophobicContact CD2-CB 4.5Å; F472-R583 HydrophobicContact CE1-CB 4.44Å; F472-R583 HydrophobicContact CE1-CG 4.23Å; F472-R583 HydrophobicContact CE2-CB 4.31Å; F472-R583 HydrophobicContact CZ-CB 4.28Å; F472-R583 HydrophobicContact CZ-CG 4.49Å
473	E	77	Confident	74	Confident	48 Å²	48	73.5 Å²	73.5	22%	0.224	34%	0.342	C	S	.	.	H	α-helix	trans	-51.1	-51.5	172.4	-64	-174.9	159.6	0	0	110.7	R270 I468 R469 K475 Y476 S477 P491	R270-E473 IonicContact NH1-OE1 2.75Å; I468-E473 HydrophobicContact CB-CG 4.14Å; I468-E473 HydrophobicContact CG2-CG 3.7Å; R469-E473 PolarHBondContact O-N 3.41Å; R469-E473 VanDerWaalsContact O-N 3.09Å; E473-K475 VanDerWaalsContact C-N 3.31Å; E473-K475 PolarHBondContact O-N 3.46Å; E473-Y476 PolarHBondContact O-N 3.29Å; E473-S477 WeakPolarHBondContact O-CA 3.49Å; E473-S477 VanDerWaalsContact O-CB 3.22Å; E473-S477 WeakPolarHBondContact O-CB 3.42Å; E473-S477 PolarHBondContact O-N 2.83Å; E473-P491 HydrophobicContact CG-CG 4.45Å
474	A	75	Confident	75.6	Confident	23 Å²	23	73.3 Å²	73.3	19%	0.19	35%	0.352	C	S	.	.	H	α-helix	trans	-63.8	-27.2	-177.4	0	0	0	0	0	114.7	N278 P470 F472 S477	N278-A474 HydrophobicContact CB-CB 4.08Å; N278-A474 PolarHBondContact ND2-O 2.76Å; N278-A474 PolarHBondContact OD1-O 3.32Å; P470-A474 WeakPolarHBondContact O-CB 3.33Å; P470-A474 PolarHBondContact O-N 2.62Å; F472-A474 VanDerWaalsContact C-N 3.32Å; F472-A474 PolarHBondContact O-N 3.33Å; A474-S477 PolarHBondContact O-OG 3.28Å
475	K	79.2	Confident	77	Confident	86 Å²	86	74.5 Å²	74.5	37%	0.374	36%	0.36	S	S	.	.	H	α-helix	trans	-84	-43.4	174.8	-176.5	-177	164.2	-168.5	0	112.1	Q471 F472 E473 D497	Q471-K475 PolarHBondContact O-N 2.96Å; F472-K475 PolarHBondContact O-N 2.74Å; E473-K475 VanDerWaalsContact C-N 3.31Å; E473-K475 PolarHBondContact O-N 3.46Å; K475-D497 IonicContact NZ-OD2 2.88Å
476	Y	81.1	Confident	78	Confident	10 Å²	10	73 Å²	73	4%	0.039	36%	0.358	C	S	.	.	H	α-helix	trans	-95.5	7.9	-172.7	-61.3	-77.8	0	0	0	113.8	F472 E473 K478 K479 Q493 D497	F472-Y476 HydrophobicContact CD1-CD2 4.1Å; F472-Y476 AromaticContact CD2-CD2 3.76Å; F472-Y476 HydrophobicContact CD2-CD2 3.76Å; F472-Y476 AromaticContact CD2-CE2 3.76Å; F472-Y476 HydrophobicContact CD2-CE2 3.76Å; F472-Y476 AromaticContact CE1-CD2 3.99Å; F472-Y476 HydrophobicContact CE1-CD2 3.99Å; F472-Y476 AromaticContact CE2-CD2 3.66Å; F472-Y476 HydrophobicContact CE2-CD2 3.66Å; F472-Y476 AromaticContact CE2-CE2 3.6Å; F472-Y476 HydrophobicContact CE2-CE2 3.6Å; F472-Y476 AromaticContact CG-CD2 3.99Å; F472-Y476 HydrophobicContact CG-CD2 3.99Å; F472-Y476 HydrophobicContact CG-CE2 4.41Å; F472-Y476 AromaticContact CZ-CD2 3.77Å; F472-Y476 HydrophobicContact CZ-CD2 3.77Å; F472-Y476 HydrophobicContact CZ-CE2 4.12Å; F472-Y476 HydrophobicContact CZ-CG 4.42Å; F472-Y476 WeakPolarHBondContact O-CD2 3.47Å; F472-Y476 PolarHBondContact O-N 3.02Å; E473-Y476 PolarHBondContact O-N 3.29Å; Y476-K478 PolarHBondContact O-N 3.23Å; Y476-K479 CarbonylContact O-C 3.53Å; Y476-K479 PolarHBondContact O-N 2.71Å; Y476-Q493 HydrophobicContact CE1-CB 4.13Å; Y476-Q493 HydrophobicContact CE1-CG 4.1Å; Y476-Q493 HydrophobicContact CE2-CB 4.35Å; Y476-Q493 HydrophobicContact CE2-CG 4.47Å; Y476-Q493 PolarHBondContact OH-NE2 3.34Å; Y476-Q493 VanDerWaalsContact OH-NE2 3.08Å; Y476-D497 PolarHBondContact OH-OD2 2.94Å
477	S	74.9	Confident	78.6	Confident	24 Å²	24	73.7 Å²	73.7	17%	0.168	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	4.8	173.5	61.5	0	0	0	0	116.9	N278 E473 A474	N278-S477 PolarHBondContact OD1-OG 3.01Å; E473-S477 WeakPolarHBondContact O-CA 3.49Å; E473-S477 VanDerWaalsContact O-CB 3.22Å; E473-S477 WeakPolarHBondContact O-CB 3.42Å; E473-S477 PolarHBondContact O-N 2.83Å; A474-S477 PolarHBondContact O-OG 3.28Å
478	K	76.3	Confident	79.1	Confident	199 Å²	199	76.8 Å²	76.8	87%	0.865	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.5	0.9	170.5	-65.6	-173.2	177.6	-174.5	0	113.3	Y476	Y476-K478 PolarHBondContact O-N 3.23Å
479	K	79.9	Confident	79.3	Confident	133 Å²	133	79.6 Å²	79.6	58%	0.578	41%	0.405	S	S	*	.			trans	-136.8	73.6	-175.5	-70.4	-171.4	175.7	-174.8	0	109.1	Y476 Y492	Y476-K479 CarbonylContact O-C 3.53Å; Y476-K479 PolarHBondContact O-N 2.71Å; K479-Y492 PolarHBondContact O-N 3.12Å
480	E	81.8	Confident	79.2	Confident	115 Å²	115	80.3 Å²	80.3	54%	0.537	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	146.5	177	-68.3	165.9	-161.8	0	0	110.6	P489 E490	E480-P489 HydrophobicContact CB-CB 4.33Å; E480-E490 CarbonylContact C-O 3.4Å; E480-E490 VanDerWaalsContact CA-O 3.3Å; E480-E490 WeakPolarHBondContact CA-O 3.48Å
481	R	84.1	Confident	79.6	Confident	140 Å²	140	79.6 Å²	79.6	53%	0.528	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	140.5	172.6	-179.9	-179.2	172.2	175.3	-1.1	108.6	N483 E490 Y492	R481-N483 PolarHBondContact O-N 2.92Å; R481-E490 PolarHBondContact N-O 3.02Å; R481-E490 PolarHBondContact O-N 3.43Å; R481-Y492 HydrophobicContact CB-CG 4.15Å
482	M	83.6	Confident	80	Confident	130 Å²	130	78.2 Å²	78.2	64%	0.64	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.6	118.6	169.8	-155.8	83.5	157.3	0	0	109.5	G487	M482-G487 VanDerWaalsContact CE-O 3.24Å; M482-G487 WeakPolarHBondContact CE-O 3.42Å
483	N	80	Confident	80.1	Confident	20 Å²	20	78.5 Å²	78.5	11%	0.107	40%	0.396	C	S	.	.			trans	-71.3	125.4	170.9	175	-15.8	0	0	0	108.6	R481 I485 S486 G487 K488 E490	R481-N483 PolarHBondContact O-N 2.92Å; N483-I485 PolarHBondContact O-N 2.89Å; N483-I485 PolarHBondContact OD1-N 3.45Å; N483-S486 VanDerWaalsContact CB-OG 3.32Å; N483-S486 WeakPolarHBondContact CB-OG 3.2Å; N483-S486 PolarHBondContact ND2-OG 3.2Å; N483-S486 PolarHBondContact OD1-N 3.46Å; N483-G487 WeakPolarHBondContact O-CA 3.36Å; N483-G487 PolarHBondContact O-N 3.3Å; N483-K488 PolarHBondContact N-O 3.26Å; N483-E490 HydrophobicContact CB-CG 4.37Å; N483-E490 VanDerWaalsContact CB-OE1 3.23Å; N483-E490 WeakPolarHBondContact CB-OE1 3.3Å; N483-E490 PolarHBondContact ND2-OE1 3.01Å
484	P	82.4	Confident	80.6	Confident	119 Å²	119	77.8 Å²	77.8	77%	0.773	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-16.8	-177.3	29.4	-36.6	0	0	0	114.4
485	I	77.1	Confident	81.2	Confident	120 Å²	120	84 Å²	84	62%	0.615	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-53.2	-179.4	-63	163.6	0	0	0	110	E464 N483 G487	E464-I485 VanDerWaalsContact OE1-CD1 3.23Å; E464-I485 WeakPolarHBondContact OE1-CD1 3.41Å; E464-I485 WeakPolarHBondContact OE2-CD1 3.45Å; N483-I485 PolarHBondContact O-N 2.89Å; N483-I485 PolarHBondContact OD1-N 3.45Å; I485-G487 VanDerWaalsContact C-N 3.34Å; I485-G487 PolarHBondContact O-N 2.89Å
486	S	75.3	Confident	81.6	Confident	46 Å²	46	85.1 Å²	85.1	32%	0.322	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-19	-177.5	87	0	0	0	0	114	N483 K488 E490	N483-S486 VanDerWaalsContact CB-OG 3.32Å; N483-S486 WeakPolarHBondContact CB-OG 3.2Å; N483-S486 PolarHBondContact ND2-OG 3.2Å; N483-S486 PolarHBondContact OD1-N 3.46Å; S486-K488 PolarHBondContact O-N 3.48Å; S486-K488 PolarHBondContact OG-N 2.92Å; S486-E490 PolarHBondContact OG-OE1 3Å
487	G	79.3	Confident	81.9	Confident	44 Å²	44	86.5 Å²	86.5	45%	0.454	44%	0.444	S	S	.	.			trans	68.5	5.4	-175.6	0	0	0	0	0	114.7	M482 N483 I485	M482-G487 VanDerWaalsContact CE-O 3.24Å; M482-G487 WeakPolarHBondContact CE-O 3.42Å; N483-G487 WeakPolarHBondContact O-CA 3.36Å; N483-G487 PolarHBondContact O-N 3.3Å; I485-G487 VanDerWaalsContact C-N 3.34Å; I485-G487 PolarHBondContact O-N 2.89Å
488	K	80.6	Confident	82.6	Confident	136 Å²	136	89.8 Å²	89.8	59%	0.591	46%	0.455	S	S	*	.	S	Bend	trans	-98.5	152.8	-176.5	-63.7	166.6	-171	169.8	0	111.4	N483 S486	N483-K488 PolarHBondContact N-O 3.26Å; S486-K488 PolarHBondContact O-N 3.48Å; S486-K488 PolarHBondContact OG-N 2.92Å
489	P	81.4	Confident	83.2	Confident	82 Å²	82	82.6 Å²	82.6	53%	0.532	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	124.9	164.7	30.1	-32.5	0	0	0	109.7	E480	E480-P489 HydrophobicContact CB-CB 4.33Å
490	E	79.9	Confident	83.8	Confident	34 Å²	34	79.1 Å²	79.1	16%	0.159	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	146.8	-179.6	-70.5	179	-141.7	0	0	111.1	E480 R481 N483 S486 Y492 R583	E480-E490 CarbonylContact C-O 3.4Å; E480-E490 VanDerWaalsContact CA-O 3.3Å; E480-E490 WeakPolarHBondContact CA-O 3.48Å; R481-E490 PolarHBondContact N-O 3.02Å; R481-E490 PolarHBondContact O-N 3.43Å; N483-E490 HydrophobicContact CB-CG 4.37Å; N483-E490 VanDerWaalsContact CB-OE1 3.23Å; N483-E490 WeakPolarHBondContact CB-OE1 3.3Å; N483-E490 PolarHBondContact ND2-OE1 3.01Å; S486-E490 PolarHBondContact OG-OE1 3Å; E490-Y492 PolarHBondContact O-N 2.95Å; E490-R583 IonicContact OE2-CZ 3.14Å; E490-R583 IonicContact OE2-NH2 3.37Å; E490-R583 PolarHBondContact OE2-NH2 2.86Å
491	P	83.8	Confident	84.3	Confident	24 Å²	24	76.4 Å²	76.4	16%	0.156	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	133.8	178.6	25.4	-33.4	0	0	0	111.8	I468 F472 E473	I468-P491 HydrophobicContact CD1-CG 4.13Å; I468-P491 HydrophobicContact CG2-CG 4.4Å; F472-P491 HydrophobicContact CD1-CB 4.37Å; F472-P491 HydrophobicContact CD1-CG 4.19Å; F472-P491 HydrophobicContact CE1-CB 4.12Å; F472-P491 HydrophobicContact CE1-CG 4.17Å; E473-P491 HydrophobicContact CG-CG 4.45Å
492	Y	84.5	Confident	84.6	Confident	99 Å²	99	74.5 Å²	74.5	39%	0.388	41%	0.406	S	S	.	.			trans	-125.4	125.4	-172.4	177.5	-107.1	0	0	0	113.1	K479 R481 E490	K479-Y492 PolarHBondContact O-N 3.12Å; R481-Y492 HydrophobicContact CB-CG 4.15Å; E490-Y492 PolarHBondContact O-N 2.95Å
493	Q	85.3	Confident	85	Confident	17 Å²	17	73.5 Å²	73.5	8%	0.079	40%	0.402	C	S	.	.			trans	-87.5	128.4	170.3	-176.7	179.9	49.1	0	0	109.9	F472 Y476 K498 E580	F472-Q493 HydrophobicContact CE2-CB 4.03Å; F472-Q493 HydrophobicContact CZ-CB 3.91Å; Y476-Q493 HydrophobicContact CE1-CB 4.13Å; Y476-Q493 HydrophobicContact CE1-CG 4.1Å; Y476-Q493 HydrophobicContact CE2-CB 4.35Å; Y476-Q493 HydrophobicContact CE2-CG 4.47Å; Y476-Q493 PolarHBondContact OH-NE2 3.34Å; Y476-Q493 VanDerWaalsContact OH-NE2 3.08Å; Q493-K498 HydrophobicContact CG-CB 4.18Å; Q493-E580 PolarHBondContact NE2-O 2.92Å
494	A	86.8	Confident	85.6	Confident	32 Å²	32	76.1 Å²	76.1	26%	0.264	42%	0.419	S	S	.	.			trans	-70.1	139.9	177.7	0	0	0	0	0	111.3	T496 D497 K498	A494-T496 VanDerWaalsContact C-N 3.26Å; A494-T496 PolarHBondContact O-N 2.8Å; A494-D497 WeakPolarHBondContact O-CB 3.44Å; A494-D497 PolarHBondContact O-N 2.87Å; A494-K498 PolarHBondContact O-N 3.49Å
495	F	86.9	Confident	86.1	Confident	155 Å²	155	70.5 Å²	70.5	68%	0.68	38%	0.382	S	S	*	.	H	α-helix	trans	-56	-36.8	-176.6	-177.8	-100.7	0	0	0	113.8	K498 C499	F495-K498 PolarHBondContact O-N 2.84Å; F495-C499 HydrophobicContact CE1-CB 4.49Å; F495-C499 WeakPolarHBondContact O-CB 3.39Å; F495-C499 PolarHBondContact O-N 3.08Å
496	T	87.8	Confident	86.8	Confident	109 Å²	109	67.2 Å²	67.2	67%	0.669	37%	0.373	S	S	*	.	H	α-helix	trans	-67.4	-34.8	176.6	48	0	0	0	0	113.2	A494 S500	A494-T496 VanDerWaalsContact C-N 3.26Å; A494-T496 PolarHBondContact O-N 2.8Å; T496-S500 WeakPolarHBondContact O-CB 3.16Å; T496-S500 PolarHBondContact O-N 2.85Å; T496-S500 VanDerWaalsContact O-N 3.08Å; T496-S500 PolarHBondContact O-OG 2.9Å
497	D	88	Confident	87.6	Confident	39 Å²	39	68.4 Å²	68.4	21%	0.209	38%	0.381	C	S	.	.	H	α-helix	trans	-73.2	-39.6	173.7	-174.4	47.9	0	0	0	110.8	K475 Y476 A494 S500 R501	K475-D497 IonicContact NZ-OD2 2.88Å; Y476-D497 PolarHBondContact OH-OD2 2.94Å; A494-D497 WeakPolarHBondContact O-CB 3.44Å; A494-D497 PolarHBondContact O-N 2.87Å; D497-S500 PolarHBondContact O-OG 2.89Å; D497-R501 VanDerWaalsContact CG-NE 3.29Å; D497-R501 WeakPolarHBondContact O-CB 3.35Å; D497-R501 WeakPolarHBondContact O-CD 3.38Å; D497-R501 WeakPolarHBondContact O-CG 3.22Å; D497-R501 PolarHBondContact O-N 3.41Å; D497-R501 IonicContact OD1-CZ 3.82Å; D497-R501 VanDerWaalsContact OD1-CZ 3.23Å; D497-R501 IonicContact OD1-NE 3.85Å; D497-R501 PolarHBondContact OD1-NE 3.49Å; D497-R501 IonicContact OD1-NH2 3.74Å; D497-R501 PolarHBondContact OD1-NH2 2.93Å; D497-R501 IonicContact OD2-NE 3.83Å; D497-R501 PolarHBondContact OD2-NE 3.04Å; D497-R501 IonicContact OD2-NH2 2.77Å
498	K	88.9	Confident	88.2	Confident	92 Å²	92	67.1 Å²	67.1	40%	0.4	37%	0.368	S	S	.	.	H	α-helix	trans	-64.6	-46.3	173.8	-165.1	167.7	-172.1	167.3	0	111.4	Q493 A494 F495 L502 E587	Q493-K498 HydrophobicContact CG-CB 4.18Å; A494-K498 PolarHBondContact O-N 3.49Å; F495-K498 PolarHBondContact O-N 2.84Å; K498-L502 WeakPolarHBondContact O-CB 3.29Å; K498-L502 PolarHBondContact O-N 2.68Å; K498-E587 IonicContact NZ-OE1 3.87Å; K498-E587 PolarHBondContact NZ-OE1 3Å; K498-E587 IonicContact NZ-OE2 3.87Å
499	C	90.8	Very high	88.7	Confident	49 Å²	49	61.8 Å²	61.8	33%	0.331	35%	0.346	S	S	.	.	H	α-helix	trans	-66.8	-46.7	-177.5	-173.6	0	0	0	0	112.8	F495 R501 L502 I503	F495-C499 HydrophobicContact CE1-CB 4.49Å; F495-C499 WeakPolarHBondContact O-CB 3.39Å; F495-C499 PolarHBondContact O-N 3.08Å; C499-R501 VanDerWaalsContact C-N 3.34Å; C499-R501 PolarHBondContact O-N 2.9Å; C499-L502 PolarHBondContact O-N 2.89Å; C499-I503 WeakPolarHBondContact O-CG1 3.14Å; C499-I503 PolarHBondContact O-N 3.06Å
500	S	91.9	Very high	89.3	Confident	60 Å²	60	64.6 Å²	64.6	42%	0.42	35%	0.35	S	S	.	.	H	α-helix	trans	-62.7	-38.7	177.8	52.3	0	0	0	0	112.7	T496 D497 I503 V504	T496-S500 WeakPolarHBondContact O-CB 3.16Å; T496-S500 PolarHBondContact O-N 2.85Å; T496-S500 VanDerWaalsContact O-N 3.08Å; T496-S500 PolarHBondContact O-OG 2.9Å; D497-S500 PolarHBondContact O-OG 2.89Å; S500-I503 PolarHBondContact O-N 3.19Å; S500-V504 WeakPolarHBondContact O-CG2 3.44Å; S500-V504 PolarHBondContact O-N 3.17Å; S500-V504 VanDerWaalsContact O-N 3.09Å
501	R	91.7	Very high	89.9	Confident	58 Å²	58	69.3 Å²	69.3	22%	0.219	37%	0.37	C	S	.	.	H	α-helix	trans	-63.2	-44.8	172.4	-70.6	168.1	-170.3	-60.5	-26	112.7	D497 C499 I503 V504 S505 L579	D497-R501 VanDerWaalsContact CG-NE 3.29Å; D497-R501 WeakPolarHBondContact O-CB 3.35Å; D497-R501 WeakPolarHBondContact O-CD 3.38Å; D497-R501 WeakPolarHBondContact O-CG 3.22Å; D497-R501 PolarHBondContact O-N 3.41Å; D497-R501 IonicContact OD1-CZ 3.82Å; D497-R501 VanDerWaalsContact OD1-CZ 3.23Å; D497-R501 IonicContact OD1-NE 3.85Å; D497-R501 PolarHBondContact OD1-NE 3.49Å; D497-R501 IonicContact OD1-NH2 3.74Å; D497-R501 PolarHBondContact OD1-NH2 2.93Å; D497-R501 IonicContact OD2-NE 3.83Å; D497-R501 PolarHBondContact OD2-NE 3.04Å; D497-R501 IonicContact OD2-NH2 2.77Å; C499-R501 VanDerWaalsContact C-N 3.34Å; C499-R501 PolarHBondContact O-N 2.9Å; R501-I503 VanDerWaalsContact C-N 3.32Å; R501-I503 PolarHBondContact O-N 3.21Å; R501-V504 PolarHBondContact O-N 3.22Å; R501-S505 PolarHBondContact O-N 3.1Å; R501-L579 HydrophobicContact CB-CD2 4.17Å; R501-L579 WeakPolarHBondContact CD-O 3.22Å; R501-L579 HydrophobicContact CG-CD2 4.21Å; R501-L579 PolarHBondContact NH1-O 3.01Å
502	L	90.6	Very high	90.2	Very high	99 Å²	99	68.8 Å²	68.8	52%	0.518	37%	0.366	S	S	.	.	H	α-helix	trans	-62.7	-39.1	178.4	-175.1	64.3	0	0	0	111.6	K498 C499 S505 A506	K498-L502 WeakPolarHBondContact O-CB 3.29Å; K498-L502 PolarHBondContact O-N 2.68Å; C499-L502 PolarHBondContact O-N 2.89Å; L502-S505 PolarHBondContact O-N 3.43Å; L502-A506 WeakPolarHBondContact O-CB 3.4Å; L502-A506 PolarHBondContact O-N 2.78Å
503	I	92.8	Very high	90.5	Very high	109 Å²	109	65.6 Å²	65.6	56%	0.559	36%	0.355	S	S	*	.	H	α-helix	trans	-63.7	-45.1	174.8	-69	165.2	0	0	0	111.2	C499 S500 R501 S505 A506 S507	C499-I503 WeakPolarHBondContact O-CG1 3.14Å; C499-I503 PolarHBondContact O-N 3.06Å; S500-I503 PolarHBondContact O-N 3.19Å; R501-I503 VanDerWaalsContact C-N 3.32Å; R501-I503 PolarHBondContact O-N 3.21Å; I503-S505 VanDerWaalsContact C-N 3.3Å; I503-S505 PolarHBondContact O-N 3.19Å; I503-A506 PolarHBondContact O-N 2.91Å; I503-S507 PolarHBondContact O-N 3.12Å; I503-S507 PolarHBondContact O-OG 3.35Å
504	V	92.6	Very high	90.8	Very high	76 Å²	76	67.3 Å²	67.3	46%	0.461	37%	0.368	S	S	.	.	H	α-helix	trans	-62.5	-37.5	175.1	169.8	0	0	0	0	111.6	S500 R501 S507 G508 L579	S500-V504 WeakPolarHBondContact O-CG2 3.44Å; S500-V504 PolarHBondContact O-N 3.17Å; S500-V504 VanDerWaalsContact O-N 3.09Å; R501-V504 PolarHBondContact O-N 3.22Å; V504-S507 PolarHBondContact O-OG 3.23Å; V504-S507 VanDerWaalsContact O-OG 3.1Å; V504-G508 PolarHBondContact O-N 2.75Å; V504-L579 HydrophobicContact CB-CD2 4.5Å; V504-L579 HydrophobicContact CG1-CD1 4.49Å; V504-L579 HydrophobicContact CG1-CD2 4.17Å
505	S	92.6	Very high	91.1	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-70.2	-38.2	173.8	-171.3	0	0	0	0	112.7	R501 L502 I503 G508 I509 E580 K595	R501-S505 PolarHBondContact O-N 3.1Å; L502-S505 PolarHBondContact O-N 3.43Å; I503-S505 VanDerWaalsContact C-N 3.3Å; I503-S505 PolarHBondContact O-N 3.19Å; S505-G508 PolarHBondContact O-N 3.09Å; S505-I509 VanDerWaalsContact O-CG1 3.3Å; S505-I509 WeakPolarHBondContact O-CG1 3.45Å; S505-I509 PolarHBondContact O-N 2.6Å; S505-I509 VanDerWaalsContact O-N 3.08Å; S505-E580 VanDerWaalsContact CB-OE1 3.25Å; S505-E580 WeakPolarHBondContact CB-OE1 3.4Å; S505-E580 PolarHBondContact OG-OE1 3.37Å; S505-K595 WeakPolarHBondContact OG-CE 3.32Å
506	A	91.5	Very high	91.2	Very high	51 Å²	51	60.9 Å²	60.9	42%	0.421	34%	0.338	S	S	.	.	H	α-helix	trans	-66.6	-41.9	-179.7	0	0	0	0	0	111.9	L502 I503 G508 I509 F510	L502-A506 WeakPolarHBondContact O-CB 3.4Å; L502-A506 PolarHBondContact O-N 2.78Å; I503-A506 PolarHBondContact O-N 2.91Å; A506-G508 VanDerWaalsContact C-N 3.33Å; A506-G508 PolarHBondContact O-N 3.19Å; A506-I509 PolarHBondContact O-N 2.72Å; A506-F510 PolarHBondContact O-N 2.67Å
507	S	92.9	Very high	91.2	Very high	71 Å²	71	60.2 Å²	60.2	50%	0.497	33%	0.33	S	S	.	.	H	α-helix	trans	-65.9	-35.7	174.5	62.3	0	0	0	0	112.2	I503 V504 F510 F511	I503-S507 PolarHBondContact O-N 3.12Å; I503-S507 PolarHBondContact O-OG 3.35Å; V504-S507 PolarHBondContact O-OG 3.23Å; V504-S507 VanDerWaalsContact O-OG 3.1Å; S507-F510 PolarHBondContact O-N 2.78Å; S507-F511 WeakPolarHBondContact O-CB 3.31Å; S507-F511 PolarHBondContact O-N 2.9Å
508	G	91.1	Very high	91.3	Very high	17 Å²	17	61.3 Å²	61.3	18%	0.175	34%	0.344	C	S	.	.	H	α-helix	trans	-61.5	-40.8	172	0	0	0	0	0	113.8	V504 S505 A506 M512	V504-G508 PolarHBondContact O-N 2.75Å; S505-G508 PolarHBondContact O-N 3.09Å; A506-G508 VanDerWaalsContact C-N 3.33Å; A506-G508 PolarHBondContact O-N 3.19Å; G508-M512 WeakPolarHBondContact O-CG 3.03Å; G508-M512 PolarHBondContact O-N 3.13Å
509	I	92	Very high	91.3	Very high	24 Å²	24	58.2 Å²	58.2	12%	0.123	34%	0.336	C	S	.	.	H	α-helix	trans	-64.6	-48.6	173.8	-59.4	158.2	0	0	0	110.2	S505 A506 F511 M512 I513 K595	S505-I509 VanDerWaalsContact O-CG1 3.3Å; S505-I509 WeakPolarHBondContact O-CG1 3.45Å; S505-I509 PolarHBondContact O-N 2.6Å; S505-I509 VanDerWaalsContact O-N 3.08Å; A506-I509 PolarHBondContact O-N 2.72Å; I509-F511 PolarHBondContact O-N 2.8Å; I509-M512 PolarHBondContact O-N 3.32Å; I509-I513 HydrophobicContact CG2-CD1 3.89Å; I509-I513 WeakPolarHBondContact O-CG1 3.25Å; I509-I513 PolarHBondContact O-N 3.29Å; I509-K595 HydrophobicContact CD1-CG 3.69Å; I509-K595 HydrophobicContact CG1-CG 4.06Å
510	F	92.1	Very high	91	Very high	142 Å²	142	56.8 Å²	56.8	62%	0.623	33%	0.325	S	S	*	.	H	α-helix	trans	-61	-42.8	-178.4	-175.1	-98.3	0	0	0	112.2	A506 S507 M512 I513 C514	A506-F510 PolarHBondContact O-N 2.67Å; S507-F510 PolarHBondContact O-N 2.78Å; F510-M512 PolarHBondContact O-N 3.43Å; F510-I513 WeakPolarHBondContact O-CB 3.49Å; F510-I513 PolarHBondContact O-N 3.34Å; F510-C514 VanDerWaalsContact CE1-SG 3.59Å; F510-C514 PolarHBondContact O-N 2.87Å; F510-C514 PolarHBondContact O-SG 2.79Å; F510-C514 VanDerWaalsContact O-SG 3.4Å
511	F	93.1	Very high	90.6	Very high	133 Å²	133	58.9 Å²	58.9	58%	0.583	33%	0.327	S	S	*	.	H	α-helix	trans	-56.1	-47.7	174.2	174.3	-99.9	0	0	0	112.2	S507 I509 I513 C514 V515	S507-F511 WeakPolarHBondContact O-CB 3.31Å; S507-F511 PolarHBondContact O-N 2.9Å; I509-F511 PolarHBondContact O-N 2.8Å; F511-I513 VanDerWaalsContact C-N 3.34Å; F511-I513 PolarHBondContact O-N 3.5Å; F511-C514 WeakPolarHBondContact O-CB 3.39Å; F511-C514 PolarHBondContact O-N 3.26Å; F511-V515 HydrophobicContact CD1-CG2 4.45Å; F511-V515 HydrophobicContact CE1-CG2 4.03Å; F511-V515 HydrophobicContact CZ-CG2 4.05Å; F511-V515 WeakPolarHBondContact O-CG2 3.46Å; F511-V515 PolarHBondContact O-N 3.18Å
512	M	90.3	Very high	90.3	Very high	13 Å²	13	57.9 Å²	57.9	6%	0.064	33%	0.334	C	S	.	.	H	α-helix	trans	-68	-32.2	178.9	-67.6	-59.7	-63.7	0	0	112.9	G508 I509 F510 V515 V516 L568 Y569 V572 F599	G508-M512 WeakPolarHBondContact O-CG 3.03Å; G508-M512 PolarHBondContact O-N 3.13Å; I509-M512 PolarHBondContact O-N 3.32Å; F510-M512 PolarHBondContact O-N 3.43Å; M512-V515 PolarHBondContact O-N 2.56Å; M512-V516 WeakPolarHBondContact O-CG2 3.43Å; M512-V516 PolarHBondContact O-N 2.91Å; M512-L568 HydrophobicContact CE-CD2 4.34Å; M512-Y569 HydrophobicContact CB-CD2 3.69Å; M512-Y569 HydrophobicContact CB-CE2 3.62Å; M512-Y569 HydrophobicContact CE-CD2 3.97Å; M512-Y569 HydrophobicContact CG-CD2 3.71Å; M512-Y569 HydrophobicContact CG-CE2 3.78Å; M512-V572 HydrophobicContact CG-CG1 4.47Å; M512-F599 HydrophobicContact CB-CD2 4.18Å; M512-F599 HydrophobicContact CB-CE2 4.3Å; M512-F599 HydrophobicContact CE-CE2 4.36Å
513	I	91.1	Very high	90	Very high	32 Å²	32	54 Å²	54	16%	0.164	31%	0.314	C	S	.	.	H	α-helix	trans	-63.8	-42	170.7	-74	172	0	0	0	110.8	I509 F510 F511 V515 V516 I517 V602	I509-I513 HydrophobicContact CG2-CD1 3.89Å; I509-I513 WeakPolarHBondContact O-CG1 3.25Å; I509-I513 PolarHBondContact O-N 3.29Å; F510-I513 WeakPolarHBondContact O-CB 3.49Å; F510-I513 PolarHBondContact O-N 3.34Å; F511-I513 VanDerWaalsContact C-N 3.34Å; F511-I513 PolarHBondContact O-N 3.5Å; I513-V515 PolarHBondContact O-N 3.44Å; I513-V516 PolarHBondContact O-N 3.42Å; I513-I517 HydrophobicContact CG2-CD1 3.91Å; I513-I517 WeakPolarHBondContact O-CG1 3.24Å; I513-I517 PolarHBondContact O-N 2.9Å; I513-V602 HydrophobicContact CG1-CG2 4.43Å; I513-V602 HydrophobicContact CG2-CG1 4.39Å
514	C	91.9	Very high	89.4	Confident	53 Å²	53	49.5 Å²	49.5	36%	0.358	29%	0.292	S	S	.	.	H	α-helix	trans	-63.2	-38.3	173.8	-67.1	0	0	0	0	112.7	F510 F511 I517 A518	F510-C514 VanDerWaalsContact CE1-SG 3.59Å; F510-C514 PolarHBondContact O-N 2.87Å; F510-C514 PolarHBondContact O-SG 2.79Å; F510-C514 VanDerWaalsContact O-SG 3.4Å; F511-C514 WeakPolarHBondContact O-CB 3.39Å; F511-C514 PolarHBondContact O-N 3.26Å; C514-I517 PolarHBondContact O-N 3.39Å; C514-A518 WeakPolarHBondContact O-CB 3.37Å; C514-A518 PolarHBondContact O-N 3.19Å
515	V	91.6	Very high	88.9	Confident	50 Å²	50	48.5 Å²	48.5	30%	0.303	28%	0.283	S	S	.	.	H	α-helix	trans	-61.4	-43	174.3	171.1	0	0	0	0	111.4	F511 M512 I513 A518 A519 L565	F511-V515 HydrophobicContact CD1-CG2 4.45Å; F511-V515 HydrophobicContact CE1-CG2 4.03Å; F511-V515 HydrophobicContact CZ-CG2 4.05Å; F511-V515 WeakPolarHBondContact O-CG2 3.46Å; F511-V515 PolarHBondContact O-N 3.18Å; M512-V515 PolarHBondContact O-N 2.56Å; I513-V515 PolarHBondContact O-N 3.44Å; V515-A518 PolarHBondContact O-N 2.96Å; V515-A519 PolarHBondContact O-N 3.4Å; V515-L565 HydrophobicContact CG1-CD2 4.39Å
516	V	89.4	Confident	88.6	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.006	30%	0.296	C	S	.	.	H	α-helix	trans	-62.2	-47	175.2	168.4	0	0	0	0	111.5	M512 I513 A518 A519 V520 L565 F599 V602 N603	M512-V516 WeakPolarHBondContact O-CG2 3.43Å; M512-V516 PolarHBondContact O-N 2.91Å; I513-V516 PolarHBondContact O-N 3.42Å; V516-A518 VanDerWaalsContact C-N 3.29Å; V516-A518 PolarHBondContact O-N 3.28Å; V516-A519 WeakPolarHBondContact O-CB 3.22Å; V516-A519 PolarHBondContact O-N 3.35Å; V516-A519 VanDerWaalsContact O-N 3.12Å; V516-V520 WeakPolarHBondContact O-CG2 3.32Å; V516-V520 PolarHBondContact O-N 2.75Å; V516-L565 HydrophobicContact CG2-CD1 4.36Å; V516-F599 HydrophobicContact CG2-CD2 4.15Å; V516-F599 HydrophobicContact CG2-CE2 3.42Å; V516-F599 VanDerWaalsContact CG2-CE2 3.42Å; V516-F599 HydrophobicContact CG2-CZ 3.93Å; V516-V602 HydrophobicContact CG1-CG1 3.87Å; V516-N603 HydrophobicContact CG1-CB 4.23Å; V516-N603 HydrophobicContact CG2-CB 4.28Å
517	I	89.3	Confident	88	Confident	96 Å²	96	51 Å²	51	49%	0.492	28%	0.282	S	S	.	.	H	α-helix	trans	-61.2	-40	178.4	-67	165	0	0	0	110.9	I513 C514 V520 F521 V602	I513-I517 HydrophobicContact CG2-CD1 3.91Å; I513-I517 WeakPolarHBondContact O-CG1 3.24Å; I513-I517 PolarHBondContact O-N 2.9Å; C514-I517 PolarHBondContact O-N 3.39Å; I517-V520 PolarHBondContact O-N 2.97Å; I517-F521 WeakPolarHBondContact O-CB 3.39Å; I517-F521 PolarHBondContact O-N 3.14Å; I517-V602 HydrophobicContact CG1-CG1 4.48Å
518	A	90.1	Very high	87.2	Confident	62 Å²	62	48.9 Å²	48.9	51%	0.512	27%	0.267	S	S	.	.	H	α-helix	trans	-65.1	-37.6	174.6	0	0	0	0	0	112.7	C514 V515 V516 F521 G522	C514-A518 WeakPolarHBondContact O-CB 3.37Å; C514-A518 PolarHBondContact O-N 3.19Å; V515-A518 PolarHBondContact O-N 2.96Å; V516-A518 VanDerWaalsContact C-N 3.29Å; V516-A518 PolarHBondContact O-N 3.28Å; A518-F521 PolarHBondContact O-N 3.48Å; A518-G522 PolarHBondContact O-N 3.22Å
519	A	87.8	Confident	86.6	Confident	27 Å²	27	50 Å²	50	22%	0.223	27%	0.27	C	S	.	.	H	α-helix	trans	-65.6	-43.2	175.7	0	0	0	0	0	112.1	V515 V516 F521 G522 I523 I561 L565	V515-A519 PolarHBondContact O-N 3.4Å; V516-A519 WeakPolarHBondContact O-CB 3.22Å; V516-A519 PolarHBondContact O-N 3.35Å; V516-A519 VanDerWaalsContact O-N 3.12Å; A519-F521 PolarHBondContact O-N 3.37Å; A519-G522 WeakPolarHBondContact O-CA 3.49Å; A519-G522 PolarHBondContact O-N 3.35Å; A519-G522 VanDerWaalsContact O-N 3.15Å; A519-I523 WeakPolarHBondContact O-CG1 3.3Å; A519-I523 PolarHBondContact O-N 3.36Å; A519-I561 HydrophobicContact CB-CG2 4.11Å; A519-L565 HydrophobicContact CB-CD1 4.25Å
520	V	84.4	Confident	86	Confident	18 Å²	18	49.6 Å²	49.6	11%	0.109	27%	0.268	C	S	.	.	H	α-helix	trans	-60.8	-45	174.4	175.2	0	0	0	0	111.1	V516 I517 G522 I523 V524 S606	V516-V520 WeakPolarHBondContact O-CG2 3.32Å; V516-V520 PolarHBondContact O-N 2.75Å; I517-V520 PolarHBondContact O-N 2.97Å; V520-G522 VanDerWaalsContact C-N 3.29Å; V520-G522 PolarHBondContact O-N 3.44Å; V520-I523 WeakPolarHBondContact O-CB 3.43Å; V520-I523 PolarHBondContact O-N 3.49Å; V520-I523 VanDerWaalsContact O-N 3.09Å; V520-V524 WeakPolarHBondContact O-CG2 3.49Å; V520-V524 PolarHBondContact O-N 3.46Å; V520-S606 VanDerWaalsContact CG2-OG 3.27Å; V520-S606 WeakPolarHBondContact CG2-OG 3.29Å
521	F	84.1	Confident	85.2	Confident	105 Å²	105	44 Å²	44	46%	0.461	25%	0.246	S	C	.	.	H	α-helix	trans	-62.3	-36.4	174.9	-174.4	-110.9	0	0	0	112.2	I517 A518 A519 I523 V524 I525 L628	I517-F521 WeakPolarHBondContact O-CB 3.39Å; I517-F521 PolarHBondContact O-N 3.14Å; A518-F521 PolarHBondContact O-N 3.48Å; A519-F521 PolarHBondContact O-N 3.37Å; F521-I523 PolarHBondContact O-N 2.91Å; F521-V524 PolarHBondContact O-N 2.77Å; F521-I525 HydrophobicContact CD1-CD1 3.88Å; F521-I525 HydrophobicContact CE1-CD1 3.66Å; F521-I525 HydrophobicContact CZ-CD1 4.24Å; F521-I525 WeakPolarHBondContact O-CG1 3.5Å; F521-I525 PolarHBondContact O-N 3.32Å; F521-L628 HydrophobicContact CE2-CD1 4.35Å; F521-L628 HydrophobicContact CE2-CD2 4.28Å; F521-L628 HydrophobicContact CZ-CD1 4Å; F521-L628 HydrophobicContact CZ-CD2 3.82Å; F521-L628 HydrophobicContact CZ-CG 4.44Å
522	G	85.9	Confident	84.1	Confident	36 Å²	36	39.5 Å²	39.5	37%	0.371	23%	0.231	S	C	.	.	H	α-helix	trans	-61.5	-37.9	170.3	0	0	0	0	0	113.6	A518 A519 V520 I525 Y526	A518-G522 PolarHBondContact O-N 3.22Å; A519-G522 WeakPolarHBondContact O-CA 3.49Å; A519-G522 PolarHBondContact O-N 3.35Å; A519-G522 VanDerWaalsContact O-N 3.15Å; V520-G522 VanDerWaalsContact C-N 3.29Å; V520-G522 PolarHBondContact O-N 3.44Å; G522-I525 PolarHBondContact O-N 2.8Å; G522-Y526 WeakPolarHBondContact O-CB 3.3Å; G522-Y526 PolarHBondContact O-N 3.01Å
523	I	84.1	Confident	83.4	Confident	17 Å²	17	42.1 Å²	42.1	9%	0.087	25%	0.248	C	C	.	.	H	α-helix	trans	-69.5	-36.4	175.8	-66.1	158.3	0	0	0	111.4	A519 V520 F521 Y526 R527 N558 I561	A519-I523 WeakPolarHBondContact O-CG1 3.3Å; A519-I523 PolarHBondContact O-N 3.36Å; V520-I523 WeakPolarHBondContact O-CB 3.43Å; V520-I523 PolarHBondContact O-N 3.49Å; V520-I523 VanDerWaalsContact O-N 3.09Å; F521-I523 PolarHBondContact O-N 2.91Å; I523-Y526 WeakPolarHBondContact O-CB 3.35Å; I523-Y526 PolarHBondContact O-N 2.84Å; I523-R527 PolarHBondContact O-N 2.7Å; I523-N558 HydrophobicContact CD1-CB 3.89Å; I523-N558 VanDerWaalsContact CD1-OD1 3.26Å; I523-N558 WeakPolarHBondContact CD1-OD1 3.39Å; I523-I561 HydrophobicContact CD1-CD1 3.98Å; I523-I561 HydrophobicContact CG1-CD1 4.03Å
524	V	80	Confident	82.7	Confident	15 Å²	15	42.6 Å²	42.6	9%	0.091	25%	0.249	C	C	.	.	H	α-helix	trans	-62.7	-45.5	171.8	173.8	0	0	0	0	110.8	V520 F521 Y526 R527 V528 Y610	V520-V524 WeakPolarHBondContact O-CG2 3.49Å; V520-V524 PolarHBondContact O-N 3.46Å; F521-V524 PolarHBondContact O-N 2.77Å; V524-Y526 VanDerWaalsContact C-N 3.34Å; V524-Y526 PolarHBondContact O-N 3.36Å; V524-R527 PolarHBondContact O-N 3.47Å; V524-V528 WeakPolarHBondContact O-CG2 3.41Å; V524-V528 PolarHBondContact O-N 2.94Å; V524-Y610 HydrophobicContact CG1-CE1 4.29Å; V524-Y610 HydrophobicContact CG1-CE2 4.37Å; V524-Y610 WeakPolarHBondContact CG1-OH 3.13Å; V524-Y610 HydrophobicContact CG2-CD1 3.82Å; V524-Y610 HydrophobicContact CG2-CD2 4.2Å; V524-Y610 HydrophobicContact CG2-CE1 3.49Å; V524-Y610 VanDerWaalsContact CG2-CE1 3.49Å; V524-Y610 HydrophobicContact CG2-CE2 3.9Å; V524-Y610 HydrophobicContact CG2-CG 4.18Å
525	I	82.6	Confident	81.5	Confident	56 Å²	56	40.4 Å²	40.4	29%	0.287	24%	0.235	S	C	.	.	H	α-helix	trans	-61.1	-43.4	174.2	-68	167.3	0	0	0	110.8	F521 G522 R527 V528 V529 L628	F521-I525 HydrophobicContact CD1-CD1 3.88Å; F521-I525 HydrophobicContact CE1-CD1 3.66Å; F521-I525 HydrophobicContact CZ-CD1 4.24Å; F521-I525 WeakPolarHBondContact O-CG1 3.5Å; F521-I525 PolarHBondContact O-N 3.32Å; G522-I525 PolarHBondContact O-N 2.8Å; I525-R527 PolarHBondContact O-N 2.66Å; I525-V528 PolarHBondContact O-N 2.93Å; I525-V529 HydrophobicContact CG2-CG2 4.33Å; I525-V529 WeakPolarHBondContact O-CG2 3.44Å; I525-V529 PolarHBondContact O-N 2.93Å; I525-L628 HydrophobicContact CD1-CD2 4.1Å; I525-L628 HydrophobicContact CG1-CD2 3.81Å
526	Y	85.5	Confident	80.5	Confident	66 Å²	66	40.7 Å²	40.7	26%	0.259	24%	0.242	S	C	.	.	H	α-helix	trans	-57.6	-44.7	175.5	169.1	-89.4	0	0	0	112.1	G522 I523 V524 T530 T553 A554 I557	G522-Y526 WeakPolarHBondContact O-CB 3.3Å; G522-Y526 PolarHBondContact O-N 3.01Å; I523-Y526 WeakPolarHBondContact O-CB 3.35Å; I523-Y526 PolarHBondContact O-N 2.84Å; V524-Y526 VanDerWaalsContact C-N 3.34Å; V524-Y526 PolarHBondContact O-N 3.36Å; Y526-T530 HydrophobicContact CD2-CG2 4Å; Y526-T530 HydrophobicContact CE1-CG2 4.16Å; Y526-T530 HydrophobicContact CE2-CG2 3.53Å; Y526-T530 HydrophobicContact CG-CG2 4.49Å; Y526-T530 WeakPolarHBondContact O-CB 3.48Å; Y526-T530 WeakPolarHBondContact O-CG2 3.5Å; Y526-T530 PolarHBondContact O-N 2.98Å; Y526-T530 PolarHBondContact O-OG1 3.43Å; Y526-T553 WeakPolarHBondContact OH-CB 3.39Å; Y526-T553 PolarHBondContact OH-OG1 2.74Å; Y526-A554 HydrophobicContact CD1-CB 4.06Å; Y526-A554 HydrophobicContact CE1-CB 3.96Å; Y526-I557 HydrophobicContact CD1-CD1 4.45Å; Y526-I557 HydrophobicContact CD2-CD1 4.31Å; Y526-I557 HydrophobicContact CE1-CD1 3.8Å; Y526-I557 HydrophobicContact CE2-CD1 3.61Å; Y526-I557 WeakPolarHBondContact OH-CD1 3.47Å
527	R	79.3	Confident	79.9	Confident	36 Å²	36	45.4 Å²	45.4	14%	0.136	26%	0.262	C	S	.	.	H	α-helix	trans	-59.4	-55	175.9	-79.4	-177.5	165.8	-141	-0.1	111.5	I523 V524 I525 V529 T530 V531 T550 A554 E635	I523-R527 PolarHBondContact O-N 2.7Å; V524-R527 PolarHBondContact O-N 3.47Å; I525-R527 PolarHBondContact O-N 2.66Å; R527-V529 VanDerWaalsContact C-N 3.3Å; R527-V529 PolarHBondContact O-N 3.39Å; R527-T530 PolarHBondContact O-N 3.35Å; R527-T530 VanDerWaalsContact O-N 3.11Å; R527-T530 PolarHBondContact O-OG1 2.79Å; R527-V531 WeakPolarHBondContact O-CG2 3.14Å; R527-V531 PolarHBondContact O-N 3.17Å; R527-T550 HydrophobicContact CB-CG2 4.18Å; R527-T550 HydrophobicContact CG-CG2 4.12Å; R527-A554 HydrophobicContact CG-CB 3.63Å; R527-E635 WeakPolarHBondContact CD-OE2 3.49Å; R527-E635 IonicContact NH1-OE1 3.43Å; R527-E635 PolarHBondContact NH1-OE1 2.88Å; R527-E635 IonicContact NH1-OE2 2.68Å
528	V	75.6	Confident	79	Confident	28 Å²	28	50.6 Å²	50.6	17%	0.17	28%	0.281	C	S	.	.	H	α-helix	trans	-55.9	-44.4	-178.8	170.2	0	0	0	0	111.6	V524 I525 W632 R633 E635	V524-V528 WeakPolarHBondContact O-CG2 3.41Å; V524-V528 PolarHBondContact O-N 2.94Å; I525-V528 PolarHBondContact O-N 2.93Å; V528-W632 HydrophobicContact CG1-CB 3.81Å; V528-R633 WeakPolarHBondContact CG1-O 3.28Å; V528-E635 HydrophobicContact CG2-CB 4.34Å
529	V	79.6	Confident	78.3	Confident	41 Å²	41	55.1 Å²	55.1	25%	0.248	29%	0.286	C	S	.	.	H	α-helix	trans	-66.2	-47.3	176.3	174.5	0	0	0	0	111.1	I525 R527 S532 T533 W632	I525-V529 HydrophobicContact CG2-CG2 4.33Å; I525-V529 WeakPolarHBondContact O-CG2 3.44Å; I525-V529 PolarHBondContact O-N 2.93Å; R527-V529 VanDerWaalsContact C-N 3.3Å; R527-V529 PolarHBondContact O-N 3.39Å; V529-S532 PolarHBondContact O-N 3.36Å; V529-S532 PolarHBondContact O-OG 3.03Å; V529-T533 HydrophobicContact CG1-CG2 4.46Å; V529-T533 PolarHBondContact O-N 3.42Å; V529-T533 VanDerWaalsContact O-N 3.12Å; V529-W632 HydrophobicContact CG1-CH2 4.4Å; V529-W632 HydrophobicContact CG2-CD2 4.11Å; V529-W632 HydrophobicContact CG2-CE3 4.13Å; V529-W632 HydrophobicContact CG2-CH2 4.01Å; V529-W632 HydrophobicContact CG2-CZ2 3.97Å; V529-W632 HydrophobicContact CG2-CZ3 4.08Å
530	T	78.8	Confident	77.5	Confident	14 Å²	14	56.5 Å²	56.5	9%	0.086	30%	0.297	C	S	.	.	H	α-helix	trans	-74.3	-27.9	-173.9	51.6	0	0	0	0	114.9	Y526 R527 S532 T533 F534 T550	Y526-T530 HydrophobicContact CD2-CG2 4Å; Y526-T530 HydrophobicContact CE1-CG2 4.16Å; Y526-T530 HydrophobicContact CE2-CG2 3.53Å; Y526-T530 HydrophobicContact CG-CG2 4.49Å; Y526-T530 WeakPolarHBondContact O-CB 3.48Å; Y526-T530 WeakPolarHBondContact O-CG2 3.5Å; Y526-T530 PolarHBondContact O-N 2.98Å; Y526-T530 PolarHBondContact O-OG1 3.43Å; R527-T530 PolarHBondContact O-N 3.35Å; R527-T530 VanDerWaalsContact O-N 3.11Å; R527-T530 PolarHBondContact O-OG1 2.79Å; T530-S532 VanDerWaalsContact C-N 3.28Å; T530-S532 PolarHBondContact O-N 3.18Å; T530-T533 WeakPolarHBondContact CA-OG1 3.43Å; T530-T533 PolarHBondContact O-N 2.9Å; T530-T533 PolarHBondContact O-OG1 3.03Å; T530-F534 VanDerWaalsContact O-CB 3.25Å; T530-F534 WeakPolarHBondContact O-CB 3.29Å; T530-F534 VanDerWaalsContact O-CG 3.29Å; T530-F534 WeakPolarHBondContact O-CG 3.27Å; T530-F534 PolarHBondContact O-N 3.46Å; T530-T550 WeakPolarHBondContact OG1-CG2 3.3Å
531	V	74.1	Confident	76.8	Confident	25 Å²	25	60.9 Å²	60.9	15%	0.152	32%	0.319	C	S	.	.	H	α-helix	trans	-57.5	-46.7	167.7	173.3	0	0	0	0	109.6	R527 T533 A535 T550	R527-V531 WeakPolarHBondContact O-CG2 3.14Å; R527-V531 PolarHBondContact O-N 3.17Å; V531-T533 PolarHBondContact O-N 2.85Å; V531-A535 VanDerWaalsContact O-CB 3.28Å; V531-A535 WeakPolarHBondContact O-CB 3.08Å; V531-A535 PolarHBondContact O-N 3.39Å; V531-T550 HydrophobicContact CG2-CG2 3.74Å; V531-T550 PolarHBondContact N-OG1 3.25Å
532	S	70.6	Confident	76.3	Confident	39 Å²	39	57.9 Å²	57.9	27%	0.273	31%	0.307	S	S	.	.	H	α-helix	trans	-65.9	-37.5	-178.8	77	0	0	0	0	113.3	V529 T530 A536	V529-S532 PolarHBondContact O-N 3.36Å; V529-S532 PolarHBondContact O-OG 3.03Å; T530-S532 VanDerWaalsContact C-N 3.28Å; T530-S532 PolarHBondContact O-N 3.18Å; S532-A536 WeakPolarHBondContact O-CB 3.36Å; S532-A536 PolarHBondContact O-N 3.5Å
533	T	75.5	Confident	75.6	Confident	67 Å²	67	63 Å²	63	41%	0.411	32%	0.315	S	S	.	.	H	α-helix	trans	-80.8	-29.9	179.7	61.3	0	0	0	0	113.3	V529 T530 V531 F537	V529-T533 HydrophobicContact CG1-CG2 4.46Å; V529-T533 PolarHBondContact O-N 3.42Å; V529-T533 VanDerWaalsContact O-N 3.12Å; T530-T533 WeakPolarHBondContact CA-OG1 3.43Å; T530-T533 PolarHBondContact O-N 2.9Å; T530-T533 PolarHBondContact O-OG1 3.03Å; V531-T533 PolarHBondContact O-N 2.85Å; T533-F537 PolarHBondContact O-N 3.14Å
534	F	76.8	Confident	74.9	Confident	42 Å²	42	68.6 Å²	68.6	18%	0.184	35%	0.346	C	S	.	.	H	α-helix	trans	-75.1	-34.9	173.3	-70	-7.5	0	0	0	112.1	T530 A536 F537 I542 A549 T550 T553	T530-F534 VanDerWaalsContact O-CB 3.25Å; T530-F534 WeakPolarHBondContact O-CB 3.29Å; T530-F534 VanDerWaalsContact O-CG 3.29Å; T530-F534 WeakPolarHBondContact O-CG 3.27Å; T530-F534 PolarHBondContact O-N 3.46Å; F534-A536 VanDerWaalsContact C-N 3.33Å; F534-F537 VanDerWaalsContact O-CB 3.25Å; F534-F537 WeakPolarHBondContact O-CB 3.45Å; F534-F537 PolarHBondContact O-N 3.12Å; F534-F537 VanDerWaalsContact O-N 3.15Å; F534-I542 HydrophobicContact CB-CG2 3.8Å; F534-I542 HydrophobicContact CD1-CG2 4.14Å; F534-I542 HydrophobicContact CD2-CG2 4.39Å; F534-I542 HydrophobicContact CG-CG2 3.87Å; F534-A549 HydrophobicContact CD2-CB 4.03Å; F534-A549 HydrophobicContact CE2-CB 4.25Å; F534-T550 WeakPolarHBondContact CD2-OG1 3.39Å; F534-T553 HydrophobicContact CE2-CG2 4.47Å
535	A	67.4	Low	74.5	Confident	8 Å²	8	71.8 Å²	71.8	7%	0.066	36%	0.362	C	S	.	.	H	α-helix	trans	-64.1	-37.5	169.9	0	0	0	0	0	112.2	V531 F537 R543	V531-A535 VanDerWaalsContact O-CB 3.28Å; V531-A535 WeakPolarHBondContact O-CB 3.08Å; V531-A535 PolarHBondContact O-N 3.39Å; A535-F537 PolarHBondContact O-N 2.9Å; A535-R543 WeakPolarHBondContact O-CG 3.24Å
536	A	70.7	Confident	73.9	Confident	55 Å²	55	70 Å²	70	46%	0.455	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-0.6	173.2	0	0	0	0	0	114.3	Y403 S532 F534	Y403-A536 HydrophobicContact CD2-CB 3.93Å; Y403-A536 HydrophobicContact CE2-CB 3.91Å; Y403-A536 HydrophobicContact CG-CB 4.45Å; S532-A536 WeakPolarHBondContact O-CB 3.36Å; S532-A536 PolarHBondContact O-N 3.5Å; F534-A536 VanDerWaalsContact C-N 3.33Å
537	F	76.3	Confident	73.1	Confident	100 Å²	100	70.8 Å²	70.8	44%	0.439	36%	0.36	S	S	.	.			trans	-80.4	139.5	-171.7	-156.3	-106.4	0	0	0	112.6	T533 F534 A535 W539 I542	T533-F537 PolarHBondContact O-N 3.14Å; F534-F537 VanDerWaalsContact O-CB 3.25Å; F534-F537 WeakPolarHBondContact O-CB 3.45Å; F534-F537 PolarHBondContact O-N 3.12Å; F534-F537 VanDerWaalsContact O-N 3.15Å; A535-F537 PolarHBondContact O-N 2.9Å; F537-W539 VanDerWaalsContact C-N 3.28Å; F537-W539 HydrophobicContact CD1-CB 3.81Å; F537-W539 HydrophobicContact CE1-CB 3.86Å; F537-W539 PolarHBondContact O-N 3.23Å; F537-I542 HydrophobicContact CB-CG2 4.23Å; F537-I542 HydrophobicContact CD1-CB 4.19Å; F537-I542 HydrophobicContact CD1-CD1 4.09Å; F537-I542 HydrophobicContact CD1-CG2 4.21Å; F537-I542 HydrophobicContact CE1-CD1 4.06Å; F537-I542 HydrophobicContact CG-CG2 4.44Å
538	K	70.4	Confident	72.8	Confident	205 Å²	205	73.8 Å²	73.8	89%	0.891	38%	0.382	S	S	*	.	S	Bend	trans	-68.2	-21.8	-174.1	-67.7	-173.2	177.9	-177.5	0	114.5	A540	K538-A540 PolarHBondContact O-N 2.81Å
539	W	75.3	Confident	72.8	Confident	158 Å²	158	73.9 Å²	73.9	60%	0.598	39%	0.386	S	S	*	.	S	Bend	trans	-85.7	115.3	-176.5	-168.1	24.3	0	0	0	111.2	F537 L541 I542 R543	F537-W539 VanDerWaalsContact C-N 3.28Å; F537-W539 HydrophobicContact CD1-CB 3.81Å; F537-W539 HydrophobicContact CE1-CB 3.86Å; F537-W539 PolarHBondContact O-N 3.23Å; W539-L541 VanDerWaalsContact C-N 3.27Å; W539-L541 HydrophobicContact CZ2-CD1 3.96Å; W539-L541 PolarHBondContact O-N 3.29Å; W539-L541 VanDerWaalsContact O-N 3.13Å; W539-I542 HydrophobicContact CE3-CD1 3.58Å; W539-I542 HydrophobicContact CE3-CG1 3.85Å; W539-I542 HydrophobicContact CZ3-CD1 4.05Å; W539-I542 HydrophobicContact CZ3-CG1 4.37Å; W539-I542 PolarHBondContact O-N 2.84Å; W539-R543 PolarHBondContact O-N 3.45Å; W539-R543 VanDerWaalsContact O-N 3.07Å
540	A	70.1	Confident	72.7	Confident	55 Å²	55	72 Å²	72	46%	0.455	38%	0.375	S	S	.	.	H	α-helix	trans	-55.2	-35	-169.8	0	0	0	0	0	114.8	K538 R543 N544	K538-A540 PolarHBondContact O-N 2.81Å; A540-R543 PolarHBondContact O-N 2.7Å; A540-N544 WeakPolarHBondContact O-CB 3.48Å; A540-N544 PolarHBondContact O-N 2.84Å
541	L	71.3	Confident	72.5	Confident	110 Å²	110	74.3 Å²	74.3	58%	0.576	39%	0.389	S	S	*	.	H	α-helix	trans	-62.8	-46	176.8	-77.1	169.6	0	0	0	112.4	W539 N545	W539-L541 VanDerWaalsContact C-N 3.27Å; W539-L541 HydrophobicContact CZ2-CD1 3.96Å; W539-L541 PolarHBondContact O-N 3.29Å; W539-L541 VanDerWaalsContact O-N 3.13Å; L541-N545 WeakPolarHBondContact O-CB 3.27Å; L541-N545 PolarHBondContact O-N 2.94Å
542	I	73.3	Confident	72.6	Confident	42 Å²	42	74.8 Å²	74.8	22%	0.215	40%	0.399	C	S	.	.	H	α-helix	trans	-69.5	-40.7	178.3	-66.4	-176.7	0	0	0	110.3	F534 F537 W539 N545 S546	F534-I542 HydrophobicContact CB-CG2 3.8Å; F534-I542 HydrophobicContact CD1-CG2 4.14Å; F534-I542 HydrophobicContact CD2-CG2 4.39Å; F534-I542 HydrophobicContact CG-CG2 3.87Å; F537-I542 HydrophobicContact CB-CG2 4.23Å; F537-I542 HydrophobicContact CD1-CB 4.19Å; F537-I542 HydrophobicContact CD1-CD1 4.09Å; F537-I542 HydrophobicContact CD1-CG2 4.21Å; F537-I542 HydrophobicContact CE1-CD1 4.06Å; F537-I542 HydrophobicContact CG-CG2 4.44Å; W539-I542 HydrophobicContact CE3-CD1 3.58Å; W539-I542 HydrophobicContact CE3-CG1 3.85Å; W539-I542 HydrophobicContact CZ3-CD1 4.05Å; W539-I542 HydrophobicContact CZ3-CG1 4.37Å; W539-I542 PolarHBondContact O-N 2.84Å; I542-N545 CarbonylContact O-C 3.58Å; I542-S546 WeakPolarHBondContact O-CA 3.26Å; I542-S546 VanDerWaalsContact O-CB 3.32Å; I542-S546 WeakPolarHBondContact O-CB 3.12Å; I542-S546 PolarHBondContact O-N 3.02Å
543	R	70.2	Confident	73.2	Confident	144 Å²	144	75.3 Å²	75.3	54%	0.543	40%	0.401	S	S	.	.	H	α-helix	trans	-61.1	-52.2	178.4	-176	175.3	72.4	-171.3	4.1	112.2	A535 W539 A540 N545 S546	A535-R543 WeakPolarHBondContact O-CG 3.24Å; W539-R543 PolarHBondContact O-N 3.45Å; W539-R543 VanDerWaalsContact O-N 3.07Å; A540-R543 PolarHBondContact O-N 2.7Å; R543-N545 PolarHBondContact O-N 3.48Å; R543-S546 WeakPolarHBondContact O-CB 3.37Å; R543-S546 PolarHBondContact O-N 3.35Å; R543-S546 PolarHBondContact O-OG 3.22Å
544	N	69.7	Low	73.4	Confident	135 Å²	135	72.2 Å²	72.2	72%	0.722	38%	0.382	S	S	*	.	H	α-helix	trans	-67.9	-34.4	-175.2	-165.1	88.6	0	0	0	112.5	A540	A540-N544 WeakPolarHBondContact O-CB 3.48Å; A540-N544 PolarHBondContact O-N 2.84Å
545	N	71.1	Confident	73.4	Confident	82 Å²	82	72.8 Å²	72.8	44%	0.439	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	26.2	-178.5	-59.1	1.1	0	0	0	111.9	L541 I542 R543 Q547 V548 A549	L541-N545 WeakPolarHBondContact O-CB 3.27Å; L541-N545 PolarHBondContact O-N 2.94Å; I542-N545 CarbonylContact O-C 3.58Å; R543-N545 PolarHBondContact O-N 3.48Å; N545-Q547 PolarHBondContact O-N 3.33Å; N545-V548 WeakPolarHBondContact O-CB 3.39Å; N545-V548 PolarHBondContact O-N 3.26Å; N545-A549 PolarHBondContact O-N 3.37Å
546	S	70.6	Confident	74	Confident	17 Å²	17	76.3 Å²	76.3	12%	0.119	41%	0.412	C	S	.	.	H	α-helix	trans	-56.7	-44.1	-168.3	44.6	0	0	0	0	113.9	I542 R543 V548 A549 T550	I542-S546 WeakPolarHBondContact O-CA 3.26Å; I542-S546 VanDerWaalsContact O-CB 3.32Å; I542-S546 WeakPolarHBondContact O-CB 3.12Å; I542-S546 PolarHBondContact O-N 3.02Å; R543-S546 WeakPolarHBondContact O-CB 3.37Å; R543-S546 PolarHBondContact O-N 3.35Å; R543-S546 PolarHBondContact O-OG 3.22Å; S546-V548 VanDerWaalsContact C-N 3.34Å; S546-V548 PolarHBondContact O-N 3.3Å; S546-A549 PolarHBondContact O-N 3.35Å; S546-T550 PolarHBondContact O-N 3.48Å; S546-T550 PolarHBondContact O-OG1 2.96Å
547	Q	69.1	Low	74.7	Confident	84 Å²	84	76.7 Å²	76.7	39%	0.393	41%	0.406	S	S	.	.	H	α-helix	trans	-60	-41.4	175.2	-67.6	-178.5	-7.4	0	0	112.7	N545 T551	N545-Q547 PolarHBondContact O-N 3.33Å; Q547-T551 VanDerWaalsContact O-CB 3.29Å; Q547-T551 WeakPolarHBondContact O-CB 3.43Å; Q547-T551 PolarHBondContact O-N 2.85Å; Q547-T551 PolarHBondContact O-OG1 2.99Å
548	V	72.5	Confident	75	Confident	98 Å²	98	73 Å²	73	59%	0.594	39%	0.391	S	S	*	.	H	α-helix	trans	-70	-42.2	178.5	-176.7	0	0	0	0	110.4	N545 S546 T551 G552	N545-V548 WeakPolarHBondContact O-CB 3.39Å; N545-V548 PolarHBondContact O-N 3.26Å; S546-V548 VanDerWaalsContact C-N 3.34Å; S546-V548 PolarHBondContact O-N 3.3Å; V548-T551 PolarHBondContact O-N 3.42Å; V548-G552 PolarHBondContact O-N 3.44Å
549	A	75	Confident	75.4	Confident	31 Å²	31	66.7 Å²	66.7	26%	0.256	36%	0.363	S	S	.	.	H	α-helix	trans	-61.3	-49.5	176.9	0	0	0	0	0	111.9	F534 N545 S546 T551 G552 T553	F534-A549 HydrophobicContact CD2-CB 4.03Å; F534-A549 HydrophobicContact CE2-CB 4.25Å; N545-A549 PolarHBondContact O-N 3.37Å; S546-A549 PolarHBondContact O-N 3.35Å; A549-T551 PolarHBondContact O-N 3.17Å; A549-G552 PolarHBondContact O-N 2.96Å; A549-T553 PolarHBondContact O-N 2.85Å; A549-T553 PolarHBondContact O-OG1 3.04Å
550	T	77.1	Confident	75.8	Confident	2 Å²	2	63.1 Å²	63.1	1%	0.012	36%	0.362	C	S	.	.	H	α-helix	trans	-61.9	-41	175.1	-68.3	0	0	0	0	112.2	R527 T530 V531 F534 S546 G552 T553 A554	R527-T550 HydrophobicContact CB-CG2 4.18Å; R527-T550 HydrophobicContact CG-CG2 4.12Å; T530-T550 WeakPolarHBondContact OG1-CG2 3.3Å; V531-T550 HydrophobicContact CG2-CG2 3.74Å; V531-T550 PolarHBondContact N-OG1 3.25Å; F534-T550 WeakPolarHBondContact CD2-OG1 3.39Å; S546-T550 PolarHBondContact O-N 3.48Å; S546-T550 PolarHBondContact O-OG1 2.96Å; T550-G552 VanDerWaalsContact C-N 3.33Å; T550-G552 PolarHBondContact O-N 2.86Å; T550-T553 PolarHBondContact O-N 2.87Å; T550-T553 PolarHBondContact O-OG1 3.19Å; T550-A554 WeakPolarHBondContact O-CB 3.44Å; T550-A554 PolarHBondContact O-N 3.3Å
551	T	74.9	Confident	76.6	Confident	61 Å²	61	62.9 Å²	62.9	37%	0.374	35%	0.352	S	S	.	.	H	α-helix	trans	-60.8	-45.1	177.1	-62.9	0	0	0	0	110.7	Q547 V548 A549 V555	Q547-T551 VanDerWaalsContact O-CB 3.29Å; Q547-T551 WeakPolarHBondContact O-CB 3.43Å; Q547-T551 PolarHBondContact O-N 2.85Å; Q547-T551 PolarHBondContact O-OG1 2.99Å; V548-T551 PolarHBondContact O-N 3.42Å; A549-T551 PolarHBondContact O-N 3.17Å; T551-V555 VanDerWaalsContact O-CG2 3.3Å; T551-V555 WeakPolarHBondContact O-CG2 3.43Å; T551-V555 PolarHBondContact O-N 3.29Å
552	G	76.3	Confident	77.2	Confident	36 Å²	36	58.6 Å²	58.6	37%	0.371	33%	0.329	S	S	.	.	H	α-helix	trans	-61.4	-52.2	176	0	0	0	0	0	113.3	V548 A549 T550 A554 V555 C556	V548-G552 PolarHBondContact O-N 3.44Å; A549-G552 PolarHBondContact O-N 2.96Å; T550-G552 VanDerWaalsContact C-N 3.33Å; T550-G552 PolarHBondContact O-N 2.86Å; G552-A554 VanDerWaalsContact C-N 3.34Å; G552-A554 PolarHBondContact O-N 3.44Å; G552-V555 PolarHBondContact O-N 3.29Å; G552-C556 PolarHBondContact O-N 2.95Å; G552-C556 VanDerWaalsContact O-N 3.11Å; G552-C556 PolarHBondContact O-SG 2.68Å
553	T	82.9	Confident	77.6	Confident	49 Å²	49	60.4 Å²	60.4	30%	0.301	34%	0.338	S	S	.	.	H	α-helix	trans	-64.7	-38	-179.5	60	0	0	0	0	112.2	Y526 F534 A549 T550 C556 I557	Y526-T553 WeakPolarHBondContact OH-CB 3.39Å; Y526-T553 PolarHBondContact OH-OG1 2.74Å; F534-T553 HydrophobicContact CE2-CG2 4.47Å; A549-T553 PolarHBondContact O-N 2.85Å; A549-T553 PolarHBondContact O-OG1 3.04Å; T550-T553 PolarHBondContact O-N 2.87Å; T550-T553 PolarHBondContact O-OG1 3.19Å; T553-C556 PolarHBondContact O-N 2.94Å; T553-I557 WeakPolarHBondContact O-CB 3.42Å; T553-I557 WeakPolarHBondContact O-CG1 3.43Å; T553-I557 PolarHBondContact O-N 2.98Å
554	A	81.1	Confident	78.4	Confident	2 Å²	2	59.6 Å²	59.6	2%	0.017	34%	0.344	C	S	.	.	H	α-helix	trans	-65.3	-37.1	176.2	0	0	0	0	0	112.6	Y526 R527 T550 G552 N558	Y526-A554 HydrophobicContact CD1-CB 4.06Å; Y526-A554 HydrophobicContact CE1-CB 3.96Å; R527-A554 HydrophobicContact CG-CB 3.63Å; T550-A554 WeakPolarHBondContact O-CB 3.44Å; T550-A554 PolarHBondContact O-N 3.3Å; G552-A554 VanDerWaalsContact C-N 3.34Å; G552-A554 PolarHBondContact O-N 3.44Å; A554-N558 WeakPolarHBondContact O-CB 3.47Å; A554-N558 PolarHBondContact O-N 3.43Å
555	V	76.4	Confident	79.3	Confident	54 Å²	54	54.1 Å²	54.1	33%	0.327	31%	0.314	S	S	.	.	H	α-helix	trans	-65.2	-44.8	174.4	167.1	0	0	0	0	111	T551 G552 N558 F559	T551-V555 VanDerWaalsContact O-CG2 3.3Å; T551-V555 WeakPolarHBondContact O-CG2 3.43Å; T551-V555 PolarHBondContact O-N 3.29Å; G552-V555 PolarHBondContact O-N 3.29Å; V555-N558 PolarHBondContact O-N 2.93Å; V555-F559 WeakPolarHBondContact O-CB 3.49Å; V555-F559 PolarHBondContact O-N 3.4Å
556	C	80.2	Confident	80.1	Confident	82 Å²	82	51.5 Å²	51.5	55%	0.554	30%	0.3	S	S	*	.	H	α-helix	trans	-62	-44.5	176.5	-65	0	0	0	0	112.3	G552 T553 F559 C560	G552-C556 PolarHBondContact O-N 2.95Å; G552-C556 VanDerWaalsContact O-N 3.11Å; G552-C556 PolarHBondContact O-SG 2.68Å; T553-C556 PolarHBondContact O-N 2.94Å; C556-F559 PolarHBondContact O-N 3.14Å; C556-C560 PolarHBondContact O-N 2.89Å; C556-C560 PolarHBondContact O-SG 2.68Å; C556-C560 VanDerWaalsContact O-SG 3.36Å
557	I	85.2	Confident	80.9	Confident	63 Å²	63	54.8 Å²	54.8	32%	0.323	32%	0.32	S	S	.	.	H	α-helix	trans	-65.2	-43	177.9	-71.8	164.4	0	0	0	111.1	Y526 T553 F559 C560 I561	Y526-I557 HydrophobicContact CD1-CD1 4.45Å; Y526-I557 HydrophobicContact CD2-CD1 4.31Å; Y526-I557 HydrophobicContact CE1-CD1 3.8Å; Y526-I557 HydrophobicContact CE2-CD1 3.61Å; Y526-I557 WeakPolarHBondContact OH-CD1 3.47Å; T553-I557 WeakPolarHBondContact O-CB 3.42Å; T553-I557 WeakPolarHBondContact O-CG1 3.43Å; T553-I557 PolarHBondContact O-N 2.98Å; I557-F559 VanDerWaalsContact C-N 3.35Å; I557-F559 PolarHBondContact O-N 2.82Å; I557-C560 PolarHBondContact O-N 3.45Å; I557-I561 HydrophobicContact CG2-CD1 3.7Å; I557-I561 HydrophobicContact CG2-CG1 4.46Å; I557-I561 WeakPolarHBondContact O-CB 3.16Å; I557-I561 VanDerWaalsContact O-CG1 3.31Å; I557-I561 WeakPolarHBondContact O-CG1 3.24Å; I557-I561 PolarHBondContact O-N 3.01Å
558	N	81.8	Confident	81.9	Confident	23 Å²	23	55.5 Å²	55.5	12%	0.123	33%	0.326	C	S	.	.	H	α-helix	trans	-58.2	-45.6	174.4	-176.5	45.2	0	0	0	111.6	I523 A554 V555 C560 I561 I562	I523-N558 HydrophobicContact CD1-CB 3.89Å; I523-N558 VanDerWaalsContact CD1-OD1 3.26Å; I523-N558 WeakPolarHBondContact CD1-OD1 3.39Å; A554-N558 WeakPolarHBondContact O-CB 3.47Å; A554-N558 PolarHBondContact O-N 3.43Å; V555-N558 PolarHBondContact O-N 2.93Å; N558-C560 PolarHBondContact O-N 3.21Å; N558-I561 PolarHBondContact O-N 3.13Å; N558-I562 WeakPolarHBondContact O-CB 3.19Å; N558-I562 VanDerWaalsContact O-CG1 3.28Å; N558-I562 WeakPolarHBondContact O-CG1 3.48Å; N558-I562 PolarHBondContact O-N 3.07Å
559	F	79.6	Confident	82.7	Confident	73 Å²	73	50.9 Å²	50.9	32%	0.32	30%	0.297	S	S	.	.	H	α-helix	trans	-60.4	-46.2	177	-177.1	-98.9	0	0	0	112.3	V555 C556 I557 I561 I562 M563	V555-F559 WeakPolarHBondContact O-CB 3.49Å; V555-F559 PolarHBondContact O-N 3.4Å; C556-F559 PolarHBondContact O-N 3.14Å; I557-F559 VanDerWaalsContact C-N 3.35Å; I557-F559 PolarHBondContact O-N 2.82Å; F559-I561 VanDerWaalsContact C-N 3.34Å; F559-I561 PolarHBondContact O-N 3.22Å; F559-I562 PolarHBondContact O-N 3.31Å; F559-M563 HydrophobicContact CD1-CG 4.32Å; F559-M563 HydrophobicContact CE1-CG 3.98Å; F559-M563 HydrophobicContact CE2-CG 4.43Å; F559-M563 HydrophobicContact CZ-CG 4.05Å; F559-M563 HydrophobicContact CZ-SD 4.36Å; F559-M563 WeakPolarHBondContact O-CG 3.49Å; F559-M563 PolarHBondContact O-N 3.27Å
560	C	84.1	Confident	83.4	Confident	83 Å²	83	51.1 Å²	51.1	56%	0.561	29%	0.293	S	S	*	.	H	α-helix	trans	-61	-40.7	175.8	-68.7	0	0	0	0	112.8	C556 I557 N558 L564	C556-C560 PolarHBondContact O-N 2.89Å; C556-C560 PolarHBondContact O-SG 2.68Å; C556-C560 VanDerWaalsContact O-SG 3.36Å; I557-C560 PolarHBondContact O-N 3.45Å; N558-C560 PolarHBondContact O-N 3.21Å; C560-L564 WeakPolarHBondContact O-CB 3.24Å; C560-L564 PolarHBondContact O-N 2.96Å
561	I	86.3	Confident	84.1	Confident	49 Å²	49	56.4 Å²	56.4	25%	0.251	32%	0.316	S	S	.	.	H	α-helix	trans	-65.3	-46.9	176.5	-72	168	0	0	0	110.8	A519 I523 I557 N558 F559 M563 L564 L565	A519-I561 HydrophobicContact CB-CG2 4.11Å; I523-I561 HydrophobicContact CD1-CD1 3.98Å; I523-I561 HydrophobicContact CG1-CD1 4.03Å; I557-I561 HydrophobicContact CG2-CD1 3.7Å; I557-I561 HydrophobicContact CG2-CG1 4.46Å; I557-I561 WeakPolarHBondContact O-CB 3.16Å; I557-I561 VanDerWaalsContact O-CG1 3.31Å; I557-I561 WeakPolarHBondContact O-CG1 3.24Å; I557-I561 PolarHBondContact O-N 3.01Å; N558-I561 PolarHBondContact O-N 3.13Å; F559-I561 VanDerWaalsContact C-N 3.34Å; F559-I561 PolarHBondContact O-N 3.22Å; I561-M563 VanDerWaalsContact C-N 3.34Å; I561-M563 PolarHBondContact O-N 3.46Å; I561-L564 PolarHBondContact O-N 3.09Å; I561-L565 HydrophobicContact CG2-CD1 3.69Å; I561-L565 HydrophobicContact CG2-CG 4.24Å; I561-L565 WeakPolarHBondContact O-CB 3.45Å; I561-L565 VanDerWaalsContact O-CG 3.31Å; I561-L565 WeakPolarHBondContact O-CG 3.48Å; I561-L565 PolarHBondContact O-N 3.22Å
562	I	84.3	Confident	84.9	Confident	20 Å²	20	55.4 Å²	55.4	10%	0.103	31%	0.31	C	S	.	.	H	α-helix	trans	-57.3	-47.7	177.2	-73.5	166.7	0	0	0	110.4	N558 F559 N566 N603	N558-I562 WeakPolarHBondContact O-CB 3.19Å; N558-I562 VanDerWaalsContact O-CG1 3.28Å; N558-I562 WeakPolarHBondContact O-CG1 3.48Å; N558-I562 PolarHBondContact O-N 3.07Å; F559-I562 PolarHBondContact O-N 3.31Å; I562-N566 VanDerWaalsContact O-CB 3.32Å; I562-N566 WeakPolarHBondContact O-CB 3.49Å; I562-N566 PolarHBondContact O-N 3.05Å; I562-N566 PolarHBondContact O-OD1 2.9Å; I562-N603 PolarHBondContact O-ND2 3.41Å
563	M	82.2	Confident	85.6	Confident	80 Å²	80	53.7 Å²	53.7	39%	0.394	29%	0.292	S	S	.	.	H	α-helix	trans	-62.1	-45.3	178.5	-73	-60.1	-63.1	0	0	112.7	F559 I561 N566 V567	F559-M563 HydrophobicContact CD1-CG 4.32Å; F559-M563 HydrophobicContact CE1-CG 3.98Å; F559-M563 HydrophobicContact CE2-CG 4.43Å; F559-M563 HydrophobicContact CZ-CG 4.05Å; F559-M563 HydrophobicContact CZ-SD 4.36Å; F559-M563 WeakPolarHBondContact O-CG 3.49Å; F559-M563 PolarHBondContact O-N 3.27Å; I561-M563 VanDerWaalsContact C-N 3.34Å; I561-M563 PolarHBondContact O-N 3.46Å; M563-N566 PolarHBondContact O-N 3.16Å; M563-V567 PolarHBondContact O-N 3.33Å
564	L	87	Confident	86	Confident	127 Å²	127	52.7 Å²	52.7	67%	0.665	29%	0.285	S	S	*	.	H	α-helix	trans	-64.3	-46.6	178.5	179	62.4	0	0	0	112	C560 I561 N566 V567 L568	C560-L564 WeakPolarHBondContact O-CB 3.24Å; C560-L564 PolarHBondContact O-N 2.96Å; I561-L564 PolarHBondContact O-N 3.09Å; L564-N566 VanDerWaalsContact C-N 3.3Å; L564-N566 PolarHBondContact O-N 3.31Å; L564-V567 PolarHBondContact O-N 3.5Å; L564-L568 PolarHBondContact O-N 3.45Å; L564-L568 VanDerWaalsContact O-N 3.15Å
565	L	88.4	Confident	86.4	Confident	20 Å²	20	58.4 Å²	58.4	11%	0.105	32%	0.315	C	S	.	.	H	α-helix	trans	-66.3	-32.4	179.7	-69.7	178.5	0	0	0	112	V515 V516 A519 I561 Y569 F599	V515-L565 HydrophobicContact CG1-CD2 4.39Å; V516-L565 HydrophobicContact CG2-CD1 4.36Å; A519-L565 HydrophobicContact CB-CD1 4.25Å; I561-L565 HydrophobicContact CG2-CD1 3.69Å; I561-L565 HydrophobicContact CG2-CG 4.24Å; I561-L565 WeakPolarHBondContact O-CB 3.45Å; I561-L565 VanDerWaalsContact O-CG 3.31Å; I561-L565 WeakPolarHBondContact O-CG 3.48Å; I561-L565 PolarHBondContact O-N 3.22Å; L565-Y569 VanDerWaalsContact O-CB 3.31Å; L565-Y569 WeakPolarHBondContact O-CB 3.32Å; L565-Y569 PolarHBondContact O-N 3.44Å; L565-F599 HydrophobicContact CB-CZ 4.1Å
566	N	87.1	Confident	87.2	Confident	27 Å²	27	56.8 Å²	56.8	14%	0.144	30%	0.304	C	S	.	.	H	α-helix	trans	-62.3	-48.4	174.3	-80.4	-2.5	0	0	0	112.5	I562 M563 L564 L568 Y569 E570 F599 Q600 N603	I562-N566 VanDerWaalsContact O-CB 3.32Å; I562-N566 WeakPolarHBondContact O-CB 3.49Å; I562-N566 PolarHBondContact O-N 3.05Å; I562-N566 PolarHBondContact O-OD1 2.9Å; M563-N566 PolarHBondContact O-N 3.16Å; L564-N566 VanDerWaalsContact C-N 3.3Å; L564-N566 PolarHBondContact O-N 3.31Å; N566-L568 VanDerWaalsContact C-N 3.34Å; N566-L568 PolarHBondContact O-N 3.08Å; N566-Y569 PolarHBondContact O-N 3.31Å; N566-E570 PolarHBondContact O-N 3.03Å; N566-F599 WeakPolarHBondContact OD1-CE1 3.13Å; N566-Q600 PolarHBondContact ND2-NE2 2.84Å; N566-Q600 PolarHBondContact ND2-OE1 3.37Å; N566-Q600 VanDerWaalsContact ND2-OE1 3.09Å; N566-Q600 PolarHBondContact OD1-NE2 3.33Å; N566-Q600 PolarHBondContact OD1-OE1 2.84Å; N566-N603 PolarHBondContact OD1-ND2 2.87Å
567	V	87.1	Confident	87.7	Confident	87 Å²	87	52.9 Å²	52.9	53%	0.527	28%	0.277	S	S	.	.	H	α-helix	trans	-64.9	-39.6	178.8	178.7	0	0	0	0	111.3	M563 L564	M563-V567 PolarHBondContact O-N 3.33Å; L564-V567 PolarHBondContact O-N 3.5Å
568	L	89.9	Confident	87.9	Confident	98 Å²	98	53.1 Å²	53.1	51%	0.513	28%	0.279	S	S	.	.	H	α-helix	trans	-63.3	-48.2	175.2	-178.1	66	0	0	0	111.5	M512 L564 N566 E570 K571 V572	M512-L568 HydrophobicContact CE-CD2 4.34Å; L564-L568 PolarHBondContact O-N 3.45Å; L564-L568 VanDerWaalsContact O-N 3.15Å; N566-L568 VanDerWaalsContact C-N 3.34Å; N566-L568 PolarHBondContact O-N 3.08Å; L568-E570 PolarHBondContact O-N 2.96Å; L568-K571 PolarHBondContact O-N 3.38Å; L568-V572 PolarHBondContact O-N 3.29Å
569	Y	91.1	Very high	88.3	Confident	1 Å²	1	55 Å²	55	0%	0.004	29%	0.289	C	S	.	.	H	α-helix	trans	-68	-34.3	-176	-172.7	-93.1	0	0	0	113	M512 L565 N566 K571 V572 A573 K595 M596 F599	M512-Y569 HydrophobicContact CB-CD2 3.69Å; M512-Y569 HydrophobicContact CB-CE2 3.62Å; M512-Y569 HydrophobicContact CE-CD2 3.97Å; M512-Y569 HydrophobicContact CG-CD2 3.71Å; M512-Y569 HydrophobicContact CG-CE2 3.78Å; L565-Y569 VanDerWaalsContact O-CB 3.31Å; L565-Y569 WeakPolarHBondContact O-CB 3.32Å; L565-Y569 PolarHBondContact O-N 3.44Å; N566-Y569 PolarHBondContact O-N 3.31Å; Y569-K571 VanDerWaalsContact C-N 3.26Å; Y569-K571 PolarHBondContact O-N 3.11Å; Y569-V572 CarbonylContact O-C 3.59Å; Y569-V572 PolarHBondContact O-N 3.44Å; Y569-V572 VanDerWaalsContact O-N 3.1Å; Y569-A573 HydrophobicContact CD1-CB 4.18Å; Y569-A573 HydrophobicContact CE1-CB 3.76Å; Y569-A573 WeakPolarHBondContact O-CB 3.41Å; Y569-A573 PolarHBondContact O-N 2.93Å; Y569-K595 PolarHBondContact OH-O 2.96Å; Y569-M596 HydrophobicContact CD1-SD 3.63Å; Y569-M596 HydrophobicContact CE1-SD 3.81Å; Y569-F599 VanDerWaalsContact CB-CE1 3.4Å; Y569-F599 VanDerWaalsContact CB-CZ 3.48Å; Y569-F599 HydrophobicContact CD1-CB 3.6Å; Y569-F599 AromaticContact CD1-CD1 3.4Å; Y569-F599 HydrophobicContact CD1-CD1 3.4Å; Y569-F599 HydrophobicContact CD1-CD2 4.04Å; Y569-F599 HydrophobicContact CD1-CE1 4.07Å; Y569-F599 AromaticContact CD1-CG 3.38Å; Y569-F599 HydrophobicContact CD1-CG 3.38Å; Y569-F599 HydrophobicContact CD2-CB 4.16Å; Y569-F599 HydrophobicContact CD2-CD1 4.16Å; Y569-F599 AromaticContact CD2-CD2 3.34Å; Y569-F599 HydrophobicContact CD2-CD2 3.34Å; Y569-F599 HydrophobicContact CD2-CE1 4.45Å; Y569-F599 AromaticContact CD2-CE2 3.67Å; Y569-F599 HydrophobicContact CD2-CE2 3.67Å; Y569-F599 AromaticContact CD2-CG 3.61Å; Y569-F599 HydrophobicContact CD2-CG 3.61Å; Y569-F599 HydrophobicContact CD2-CZ 4.22Å; Y569-F599 HydrophobicContact CE1-CB 3.33Å; Y569-F599 HydrophobicContact CE1-CD1 4.09Å; Y569-F599 HydrophobicContact CE1-CD2 4.35Å; Y569-F599 AromaticContact CE1-CG 3.67Å; Y569-F599 HydrophobicContact CE1-CG 3.67Å; Y569-F599 HydrophobicContact CE2-CB 3.93Å; Y569-F599 AromaticContact CE2-CD2 3.7Å; Y569-F599 HydrophobicContact CE2-CD2 3.7Å; Y569-F599 HydrophobicContact CE2-CE2 4.43Å; Y569-F599 AromaticContact CE2-CG 3.88Å; Y569-F599 HydrophobicContact CE2-CG 3.88Å; Y569-F599 HydrophobicContact CG-CB 4.01Å; Y569-F599 AromaticContact CG-CD1 3.45Å; Y569-F599 HydrophobicContact CG-CD1 3.45Å; Y569-F599 VanDerWaalsContact CG-CD1 3.45Å; Y569-F599 AromaticContact CG-CD2 3.53Å; Y569-F599 HydrophobicContact CG-CD2 3.53Å; Y569-F599 AromaticContact CG-CE1 3.71Å; Y569-F599 HydrophobicContact CG-CE1 3.71Å; Y569-F599 AromaticContact CG-CE2 3.77Å; Y569-F599 HydrophobicContact CG-CE2 3.77Å; Y569-F599 AromaticContact CG-CG 3.35Å; Y569-F599 HydrophobicContact CG-CG 3.35Å; Y569-F599 AromaticContact CG-CZ 3.87Å; Y569-F599 HydrophobicContact CG-CZ 3.87Å; Y569-F599 AromaticContact CZ-CG 3.91Å
570	E	89.6	Confident	88.8	Confident	37 Å²	37	52.4 Å²	52.4	17%	0.173	28%	0.278	C	S	.	.	H	α-helix	trans	-52.4	-47.3	173.7	-171	-135.4	134.8	0	0	110.9	N566 L568 V572 A573 L574 M596 Y707	N566-E570 PolarHBondContact O-N 3.03Å; L568-E570 PolarHBondContact O-N 2.96Å; E570-V572 PolarHBondContact O-N 3.24Å; E570-A573 PolarHBondContact O-N 3.42Å; E570-L574 VanDerWaalsContact O-CG 3.26Å; E570-L574 WeakPolarHBondContact O-CG 3.32Å; E570-L574 PolarHBondContact O-N 3.34Å; E570-L574 VanDerWaalsContact O-N 3.12Å; E570-M596 HydrophobicContact CB-CE 4.04Å; E570-M596 HydrophobicContact CG-CE 4.08Å; E570-Y707 HydrophobicContact CG-CE2 4.2Å; E570-Y707 WeakPolarHBondContact OE1-CE2 3.45Å; E570-Y707 PolarHBondContact OE1-OH 3.03Å
571	K	90.3	Very high	88.9	Confident	112 Å²	112	51.1 Å²	51.1	49%	0.487	26%	0.264	S	S	.	.	H	α-helix	trans	-69	-34.2	-179.5	-51.6	-41.5	-175.1	-152.8	0	112.3	L568 Y569 L574 L575	L568-K571 PolarHBondContact O-N 3.38Å; Y569-K571 VanDerWaalsContact C-N 3.26Å; Y569-K571 PolarHBondContact O-N 3.11Å; K571-L574 HydrophobicContact CD-CD1 4.25Å; K571-L575 PolarHBondContact O-N 3Å
572	V	92.1	Very high	89	Confident	40 Å²	40	49.2 Å²	49.2	24%	0.242	26%	0.255	C	S	.	.	H	α-helix	trans	-66.3	-46.2	172.9	175.5	0	0	0	0	111.2	M512 L568 Y569 E570 L574 L575 L576	M512-V572 HydrophobicContact CG-CG1 4.47Å; L568-V572 PolarHBondContact O-N 3.29Å; Y569-V572 CarbonylContact O-C 3.59Å; Y569-V572 PolarHBondContact O-N 3.44Å; Y569-V572 VanDerWaalsContact O-N 3.1Å; E570-V572 PolarHBondContact O-N 3.24Å; V572-L574 VanDerWaalsContact C-N 3.32Å; V572-L574 PolarHBondContact O-N 2.94Å; V572-L575 PolarHBondContact O-N 2.74Å; V572-L576 HydrophobicContact CG1-CD1 3.9Å; V572-L576 HydrophobicContact CG1-CG 4.17Å; V572-L576 WeakPolarHBondContact O-CG 3.17Å; V572-L576 PolarHBondContact O-N 3.18Å
573	A	92.2	Very high	89	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-61.4	-38.8	-179.6	0	0	0	0	0	112.3	Y569 E570 T577 F592 M596	Y569-A573 HydrophobicContact CD1-CB 4.18Å; Y569-A573 HydrophobicContact CE1-CB 3.76Å; Y569-A573 WeakPolarHBondContact O-CB 3.41Å; Y569-A573 PolarHBondContact O-N 2.93Å; E570-A573 PolarHBondContact O-N 3.42Å; A573-T577 WeakPolarHBondContact O-CB 3.47Å; A573-T577 PolarHBondContact O-N 2.96Å; A573-T577 PolarHBondContact O-OG1 2.97Å; A573-F592 HydrophobicContact CB-CD2 4.17Å; A573-F592 HydrophobicContact CB-CE2 3.92Å; A573-M596 HydrophobicContact CB-CG 4.02Å; A573-M596 HydrophobicContact CB-SD 3.54Å; A573-M596 VanDerWaalsContact CB-SD 3.54Å
574	L	89.8	Confident	89.2	Confident	28 Å²	28	48.2 Å²	48.2	15%	0.147	25%	0.246	C	C	.	.	H	α-helix	trans	-63.6	-47.6	173.1	-64.5	164.7	0	0	0	111.8	E570 K571 V572 L576 T577 N578 W588 F592 Y707	E570-L574 VanDerWaalsContact O-CG 3.26Å; E570-L574 WeakPolarHBondContact O-CG 3.32Å; E570-L574 PolarHBondContact O-N 3.34Å; E570-L574 VanDerWaalsContact O-N 3.12Å; K571-L574 HydrophobicContact CD-CD1 4.25Å; V572-L574 VanDerWaalsContact C-N 3.32Å; V572-L574 PolarHBondContact O-N 2.94Å; L574-L576 VanDerWaalsContact C-N 3.34Å; L574-L576 PolarHBondContact O-N 3.03Å; L574-T577 PolarHBondContact O-N 2.98Å; L574-N578 VanDerWaalsContact O-CB 3.26Å; L574-N578 WeakPolarHBondContact O-CB 3.27Å; L574-N578 PolarHBondContact O-N 3.42Å; L574-N578 PolarHBondContact O-ND2 3.09Å; L574-N578 VanDerWaalsContact O-ND2 3.14Å; L574-W588 HydrophobicContact CD2-CH2 4.15Å; L574-W588 HydrophobicContact CD2-CZ2 4.03Å; L574-F592 HydrophobicContact CD2-CD2 4.07Å; L574-F592 HydrophobicContact CD2-CE2 3.55Å; L574-F592 HydrophobicContact CD2-CZ 4.12Å; L574-F592 HydrophobicContact CG-CE2 3.91Å; L574-Y707 HydrophobicContact CD1-CE1 4.41Å; L574-Y707 WeakPolarHBondContact CD1-OH 3.49Å; L574-Y707 HydrophobicContact CD2-CD1 4.23Å; L574-Y707 HydrophobicContact CD2-CE1 3.47Å; L574-Y707 VanDerWaalsContact CD2-CE1 3.47Å
575	L	90.8	Very high	89	Confident	123 Å²	123	46.1 Å²	46.1	64%	0.644	23%	0.233	S	C	*	.	H	α-helix	trans	-59.7	-45.1	178.6	179.9	61.8	0	0	0	111.3	K571 V572 L579	K571-L575 PolarHBondContact O-N 3Å; V572-L575 PolarHBondContact O-N 2.74Å; L575-L579 WeakPolarHBondContact O-CB 3.48Å; L575-L579 PolarHBondContact O-N 3.01Å
576	L	92.3	Very high	88.7	Confident	19 Å²	19	47 Å²	47	10%	0.099	24%	0.241	C	C	.	.	H	α-helix	trans	-65.5	-47.3	177.8	-67.5	-178.6	0	0	0	112.3	V572 L574 N578 L579 E580	V572-L576 HydrophobicContact CG1-CD1 3.9Å; V572-L576 HydrophobicContact CG1-CG 4.17Å; V572-L576 WeakPolarHBondContact O-CG 3.17Å; V572-L576 PolarHBondContact O-N 3.18Å; L574-L576 VanDerWaalsContact C-N 3.34Å; L574-L576 PolarHBondContact O-N 3.03Å; L576-N578 VanDerWaalsContact C-N 3.31Å; L576-N578 PolarHBondContact O-N 3.1Å; L576-L579 WeakPolarHBondContact O-CB 3.2Å; L576-L579 PolarHBondContact O-N 3.05Å; L576-E580 PolarHBondContact O-N 3.01Å; L576-E580 VanDerWaalsContact O-N 3.13Å
577	T	92	Very high	88.7	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-67	-33.4	-179.6	-44.5	0	0	0	0	111.9	A573 L574 L579 W588 F592 K595	A573-T577 WeakPolarHBondContact O-CB 3.47Å; A573-T577 PolarHBondContact O-N 2.96Å; A573-T577 PolarHBondContact O-OG1 2.97Å; L574-T577 PolarHBondContact O-N 2.98Å; T577-L579 VanDerWaalsContact C-N 3.32Å; T577-W588 HydrophobicContact CG2-CG 4.16Å; T577-F592 HydrophobicContact CG2-CB 4.16Å; T577-K595 WeakPolarHBondContact OG1-CD 3.49Å
578	N	89.1	Confident	88.7	Confident	68 Å²	68	45.9 Å²	45.9	36%	0.364	23%	0.228	S	C	.	.	H	α-helix	trans	-74.7	-20.1	173.5	-68.3	-26.7	0	0	0	113.2	L574 L576 Q581 W588	L574-N578 VanDerWaalsContact O-CB 3.26Å; L574-N578 WeakPolarHBondContact O-CB 3.27Å; L574-N578 PolarHBondContact O-N 3.42Å; L574-N578 PolarHBondContact O-ND2 3.09Å; L574-N578 VanDerWaalsContact O-ND2 3.14Å; L576-N578 VanDerWaalsContact C-N 3.31Å; L576-N578 PolarHBondContact O-N 3.1Å; N578-Q581 WeakPolarHBondContact O-CG 3.25Å; N578-W588 PolarHBondContact OD1-NE1 3.14Å
579	L	89.6	Confident	88.7	Confident	63 Å²	63	43.9 Å²	43.9	33%	0.33	22%	0.216	S	C	.	.	H	α-helix	trans	-78.1	-32.4	172.9	179.9	151	0	0	0	112.6	R501 V504 L575 L576 T577	R501-L579 HydrophobicContact CB-CD2 4.17Å; R501-L579 WeakPolarHBondContact CD-O 3.22Å; R501-L579 HydrophobicContact CG-CD2 4.21Å; R501-L579 PolarHBondContact NH1-O 3.01Å; V504-L579 HydrophobicContact CB-CD2 4.5Å; V504-L579 HydrophobicContact CG1-CD1 4.49Å; V504-L579 HydrophobicContact CG1-CD2 4.17Å; L575-L579 WeakPolarHBondContact O-CB 3.48Å; L575-L579 PolarHBondContact O-N 3.01Å; L576-L579 WeakPolarHBondContact O-CB 3.2Å; L576-L579 PolarHBondContact O-N 3.05Å; T577-L579 VanDerWaalsContact C-N 3.32Å
580	E	89.6	Confident	88.6	Confident	19 Å²	19	46 Å²	46	9%	0.089	23%	0.228	C	C	.	.	H	α-helix	trans	-63.9	-40.8	174.1	-70.9	176.6	156.7	0	0	113	Q493 S505 L576 S591 K595	Q493-E580 PolarHBondContact NE2-O 2.92Å; S505-E580 VanDerWaalsContact CB-OE1 3.25Å; S505-E580 WeakPolarHBondContact CB-OE1 3.4Å; S505-E580 PolarHBondContact OG-OE1 3.37Å; L576-E580 PolarHBondContact O-N 3.01Å; L576-E580 VanDerWaalsContact O-N 3.13Å; E580-S591 PolarHBondContact OE2-OG 3.38Å; E580-K595 WeakPolarHBondContact OE1-CE 3.47Å; E580-K595 IonicContact OE1-NZ 2.79Å; E580-K595 PolarHBondContact OE1-NZ 3.33Å; E580-K595 IonicContact OE2-NZ 2.96Å; E580-K595 PolarHBondContact OE2-NZ 3.49Å
581	Q	87.3	Confident	88.7	Confident	55 Å²	55	45.5 Å²	45.5	26%	0.257	23%	0.228	S	C	.	.			trans	59.9	66.7	-179.1	-59	-176.7	-42.7	0	0	114.1	F472 N578	F472-Q581 WeakPolarHBondContact CD2-O 3.37Å; F472-Q581 WeakPolarHBondContact CE2-O 3.1Å; N578-Q581 WeakPolarHBondContact O-CG 3.25Å
582	P	88.2	Confident	88.8	Confident	10 Å²	10	40.2 Å²	40.2	7%	0.065	21%	0.205	C	C	.	.			trans	-59.4	153.2	170.6	24.8	-35.1	0	0	0	113.6	E587 W588	P582-E587 HydrophobicContact CB-CB 3.49Å; P582-E587 VanDerWaalsContact CB-CB 3.49Å; P582-W588 HydrophobicContact CB-CB 4.34Å; P582-W588 HydrophobicContact CG-CB 3.53Å; P582-W588 HydrophobicContact CG-CG 3.99Å
583	R	84.6	Confident	88.8	Confident	71 Å²	71	38.8 Å²	38.8	27%	0.268	20%	0.196	S	C	.	.	S	Bend	trans	-74.4	-44.1	-176.8	-179.4	-176.6	176.6	-135.6	8	112.1	I468 R469 F472 E490 E587	I468-R583 WeakPolarHBondContact CA-O 3.17Å; I468-R583 HydrophobicContact CG1-CG 4.27Å; I468-R583 HydrophobicContact CG2-CG 4.15Å; I468-R583 WeakPolarHBondContact CG2-O 3.13Å; R469-R583 PolarHBondContact N-O 3.18Å; F472-R583 HydrophobicContact CD1-CG 4.45Å; F472-R583 HydrophobicContact CD2-CB 4.5Å; F472-R583 HydrophobicContact CE1-CB 4.44Å; F472-R583 HydrophobicContact CE1-CG 4.23Å; F472-R583 HydrophobicContact CE2-CB 4.31Å; F472-R583 HydrophobicContact CZ-CB 4.28Å; F472-R583 HydrophobicContact CZ-CG 4.49Å; E490-R583 IonicContact OE2-CZ 3.14Å; E490-R583 IonicContact OE2-NH2 3.37Å; E490-R583 PolarHBondContact OE2-NH2 2.86Å; R583-E587 WeakPolarHBondContact CB-OE2 3.49Å; R583-E587 PolarHBondContact N-OE2 3.37Å
584	T	85.1	Confident	88.8	Confident	8 Å²	8	42.3 Å²	42.3	5%	0.049	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	-117.6	163	-176.3	75.3	0	0	0	0	111.5	E466 R469 S586 E587 W588	E466-T584 HydrophobicContact CB-CG2 3.77Å; E466-T584 WeakPolarHBondContact OE2-CB 3.4Å; E466-T584 PolarHBondContact OE2-OG1 2.77Å; R469-T584 WeakPolarHBondContact CD-O 3.45Å; T584-S586 VanDerWaalsContact C-N 3.25Å; T584-S586 PolarHBondContact O-N 2.83Å; T584-S586 PolarHBondContact OG1-N 3.34Å; T584-E587 PolarHBondContact O-N 3.1Å; T584-E587 PolarHBondContact OG1-N 3.35Å; T584-E587 VanDerWaalsContact OG1-N 3.15Å; T584-W588 PolarHBondContact O-N 2.73Å
585	E	82.4	Confident	88.9	Confident	83 Å²	83	41.4 Å²	41.4	39%	0.388	21%	0.21	S	C	.	.	H	α-helix	trans	-65.8	-31	176.3	-153.2	65.4	-140.8	0	0	111.6	R469 W588 E589	R469-E585 IonicContact CZ-OE1 3.07Å; R469-E585 IonicContact CZ-OE2 3.33Å; R469-E585 IonicContact NE-OE1 2.98Å; R469-E585 IonicContact NE-OE2 2.76Å; R469-E585 PolarHBondContact NE-OE2 3.1Å; R469-E585 IonicContact NH2-OE1 3.45Å; R469-E585 PolarHBondContact NH2-OE1 3.44Å; R469-E585 IonicContact NH2-OE2 3.23Å; R469-E585 PolarHBondContact NH2-OE2 3.36Å; E585-W588 WeakPolarHBondContact O-CB 3.33Å; E585-W588 PolarHBondContact O-N 3.43Å; E585-E589 WeakPolarHBondContact O-CG 3.2Å; E585-E589 PolarHBondContact O-N 2.9Å
586	S	83.2	Confident	88.9	Confident	39 Å²	39	36 Å²	36	27%	0.273	18%	0.181	S	C	.	.	H	α-helix	trans	-66.7	-45	174.7	-163.6	0	0	0	0	111.9	E466 T584 W588 E589 N590	E466-S586 WeakPolarHBondContact OE1-CB 3.36Å; E466-S586 PolarHBondContact OE1-OG 3.39Å; E466-S586 WeakPolarHBondContact OE2-CB 3.37Å; T584-S586 VanDerWaalsContact C-N 3.25Å; T584-S586 PolarHBondContact O-N 2.83Å; T584-S586 PolarHBondContact OG1-N 3.34Å; S586-W588 PolarHBondContact O-N 2.73Å; S586-E589 PolarHBondContact O-N 3.47Å; S586-N590 VanDerWaalsContact O-CB 3.27Å; S586-N590 WeakPolarHBondContact O-CB 3.31Å; S586-N590 VanDerWaalsContact O-CG 3.29Å; S586-N590 PolarHBondContact O-N 3.46Å; S586-N590 PolarHBondContact O-ND2 2.97Å; S586-N590 PolarHBondContact OG-ND2 2.95Å
587	E	86.1	Confident	89	Confident	71 Å²	71	35.8 Å²	35.8	33%	0.332	18%	0.18	S	C	.	.	H	α-helix	trans	-57.3	-37.8	171.3	-85.8	-162.5	135.6	0	0	111.1	K498 P582 R583 T584 S591	K498-E587 IonicContact NZ-OE1 3.87Å; K498-E587 PolarHBondContact NZ-OE1 3Å; K498-E587 IonicContact NZ-OE2 3.87Å; P582-E587 HydrophobicContact CB-CB 3.49Å; P582-E587 VanDerWaalsContact CB-CB 3.49Å; R583-E587 WeakPolarHBondContact CB-OE2 3.49Å; R583-E587 PolarHBondContact N-OE2 3.37Å; T584-E587 PolarHBondContact O-N 3.1Å; T584-E587 PolarHBondContact OG1-N 3.35Å; T584-E587 VanDerWaalsContact OG1-N 3.15Å; E587-S591 WeakPolarHBondContact O-CB 3.26Å; E587-S591 PolarHBondContact O-N 3.39Å
588	W	88.6	Confident	89	Confident	19 Å²	19	39 Å²	39	7%	0.072	20%	0.196	C	C	.	.	H	α-helix	trans	-69	-51.7	178.5	-172.5	86.6	0	0	0	112.9	R469 L574 T577 N578 P582 T584 E585 S586 N590 S591 F592 Y707	R469-W588 VanDerWaalsContact CZ-CG 3.49Å; R469-W588 VanDerWaalsContact NH2-CG 3.33Å; L574-W588 HydrophobicContact CD2-CH2 4.15Å; L574-W588 HydrophobicContact CD2-CZ2 4.03Å; T577-W588 HydrophobicContact CG2-CG 4.16Å; N578-W588 PolarHBondContact OD1-NE1 3.14Å; P582-W588 HydrophobicContact CB-CB 4.34Å; P582-W588 HydrophobicContact CG-CB 3.53Å; P582-W588 HydrophobicContact CG-CG 3.99Å; T584-W588 PolarHBondContact O-N 2.73Å; E585-W588 WeakPolarHBondContact O-CB 3.33Å; E585-W588 PolarHBondContact O-N 3.43Å; S586-W588 PolarHBondContact O-N 2.73Å; W588-N590 PolarHBondContact O-N 3.24Å; W588-S591 PolarHBondContact O-N 3.2Å; W588-F592 WeakPolarHBondContact O-CB 3.03Å; W588-F592 PolarHBondContact O-N 2.93Å; W588-Y707 AromaticContact CH2-CD1 3.93Å; W588-Y707 HydrophobicContact CH2-CD1 3.93Å; W588-Y707 HydrophobicContact CH2-CE1 4.37Å; W588-Y707 HydrophobicContact CZ3-CD1 4.46Å
589	E	88	Confident	89.1	Confident	56 Å²	56	35.8 Å²	35.8	26%	0.262	18%	0.179	S	C	.	.	H	α-helix	trans	-59.8	-45	177.7	-74.6	-174.7	174.2	0	0	111.3	K346 E585 S586 S591 T593	K346-E589 IonicContact NZ-OE1 2.62Å; K346-E589 PolarHBondContact NZ-OE1 2.83Å; K346-E589 IonicContact NZ-OE2 2.92Å; K346-E589 PolarHBondContact NZ-OE2 3.48Å; E585-E589 WeakPolarHBondContact O-CG 3.2Å; E585-E589 PolarHBondContact O-N 2.9Å; S586-E589 PolarHBondContact O-N 3.47Å; E589-S591 PolarHBondContact O-N 3.33Å; E589-T593 WeakPolarHBondContact O-CB 3.32Å; E589-T593 PolarHBondContact O-N 3.33Å; E589-T593 PolarHBondContact O-OG1 3.37Å
590	N	90.1	Very high	89.1	Confident	46 Å²	46	33.9 Å²	33.9	25%	0.246	17%	0.169	C	C	.	.	H	α-helix	trans	-63.9	-41.2	178.5	-73.5	-55.2	0	0	0	111.9	S586 W588 L594 I769	S586-N590 VanDerWaalsContact O-CB 3.27Å; S586-N590 WeakPolarHBondContact O-CB 3.31Å; S586-N590 VanDerWaalsContact O-CG 3.29Å; S586-N590 PolarHBondContact O-N 3.46Å; S586-N590 PolarHBondContact O-ND2 2.97Å; S586-N590 PolarHBondContact OG-ND2 2.95Å; W588-N590 PolarHBondContact O-N 3.24Å; N590-L594 PolarHBondContact O-N 2.92Å; N590-I769 HydrophobicContact CB-CB 4.17Å; N590-I769 HydrophobicContact CB-CG2 4.18Å; N590-I769 VanDerWaalsContact OD1-CB 3.28Å; N590-I769 WeakPolarHBondContact OD1-CB 3.25Å; N590-I769 WeakPolarHBondContact OD1-CG2 3.39Å; N590-I769 PolarHBondContact OD1-N 2.95Å
591	S	91.3	Very high	89.2	Confident	25 Å²	25	34.2 Å²	34.2	18%	0.175	17%	0.17	C	C	.	.	H	α-helix	trans	-68.6	-43.7	178.8	-171.4	0	0	0	0	112.5	E580 E587 W588 E589 K595	E580-S591 PolarHBondContact OE2-OG 3.38Å; E587-S591 WeakPolarHBondContact O-CB 3.26Å; E587-S591 PolarHBondContact O-N 3.39Å; W588-S591 PolarHBondContact O-N 3.2Å; E589-S591 PolarHBondContact O-N 3.33Å; S591-K595 WeakPolarHBondContact O-CD 3.26Å; S591-K595 VanDerWaalsContact O-CG 3.31Å; S591-K595 WeakPolarHBondContact O-CG 3.39Å; S591-K595 PolarHBondContact O-N 2.83Å; S591-K595 PolarHBondContact OG-NZ 3Å
592	F	92.1	Very high	89.3	Confident	2 Å²	2	33.2 Å²	33.2	1%	0.009	17%	0.167	C	C	.	.	H	α-helix	trans	-62	-45.5	173.4	176.2	-104.2	0	0	0	111.4	A573 L574 T577 W588 L594 K595 M596 Y707 F710	A573-F592 HydrophobicContact CB-CD2 4.17Å; A573-F592 HydrophobicContact CB-CE2 3.92Å; L574-F592 HydrophobicContact CD2-CD2 4.07Å; L574-F592 HydrophobicContact CD2-CE2 3.55Å; L574-F592 HydrophobicContact CD2-CZ 4.12Å; L574-F592 HydrophobicContact CG-CE2 3.91Å; T577-F592 HydrophobicContact CG2-CB 4.16Å; W588-F592 WeakPolarHBondContact O-CB 3.03Å; W588-F592 PolarHBondContact O-N 2.93Å; F592-L594 PolarHBondContact O-N 3.43Å; F592-K595 WeakPolarHBondContact O-CB 3.41Å; F592-K595 PolarHBondContact O-N 2.93Å; F592-M596 HydrophobicContact CD1-CG 4.28Å; F592-M596 HydrophobicContact CD2-CG 4.11Å; F592-M596 HydrophobicContact CE1-CG 3.87Å; F592-M596 HydrophobicContact CE2-CG 3.68Å; F592-M596 HydrophobicContact CE2-SD 4.16Å; F592-M596 HydrophobicContact CG-CG 4.4Å; F592-M596 HydrophobicContact CZ-CE 4.35Å; F592-M596 HydrophobicContact CZ-CG 3.56Å; F592-M596 HydrophobicContact CZ-SD 4.14Å; F592-M596 WeakPolarHBondContact O-CG 3.41Å; F592-M596 PolarHBondContact O-N 2.74Å; F592-Y707 HydrophobicContact CE1-CD1 4.25Å; F592-Y707 AromaticContact CE1-CD2 3.95Å; F592-Y707 HydrophobicContact CE1-CD2 3.95Å; F592-Y707 AromaticContact CE1-CG 3.76Å; F592-Y707 HydrophobicContact CE1-CG 3.76Å; F592-Y707 HydrophobicContact CZ-CD1 4.31Å; F592-Y707 AromaticContact CZ-CD2 3.92Å; F592-Y707 HydrophobicContact CZ-CD2 3.92Å; F592-Y707 HydrophobicContact CZ-CE2 4.14Å; F592-Y707 HydrophobicContact CZ-CG 4.03Å; F592-F710 HydrophobicContact CD1-CD2 4.36Å; F592-F710 HydrophobicContact CD1-CG 4.4Å; F592-F710 AromaticContact CE1-CD1 3.92Å; F592-F710 HydrophobicContact CE1-CD1 3.92Å; F592-F710 HydrophobicContact CE1-CD2 4.3Å; F592-F710 HydrophobicContact CE1-CE1 4.25Å; F592-F710 AromaticContact CE1-CG 3.98Å; F592-F710 HydrophobicContact CE1-CG 3.98Å
593	T	92.4	Very high	89.3	Confident	9 Å²	9	33 Å²	33	6%	0.055	17%	0.166	C	C	.	.	H	α-helix	trans	-58.5	-47.4	179.9	-66.6	0	0	0	0	111.6	E589 K595 M596 F597 F710 I769 W770 I773	E589-T593 WeakPolarHBondContact O-CB 3.32Å; E589-T593 PolarHBondContact O-N 3.33Å; E589-T593 PolarHBondContact O-OG1 3.37Å; T593-K595 PolarHBondContact O-N 2.79Å; T593-M596 PolarHBondContact O-N 2.79Å; T593-F597 WeakPolarHBondContact O-CB 3.46Å; T593-F597 PolarHBondContact O-N 2.93Å; T593-F710 HydrophobicContact CG2-CD2 4.23Å; T593-F710 HydrophobicContact CG2-CE2 4.08Å; T593-I769 HydrophobicContact CG2-CG2 3.41Å; T593-I769 VanDerWaalsContact CG2-CG2 3.41Å; T593-W770 HydrophobicContact CG2-CD2 3.66Å; T593-W770 VanDerWaalsContact CG2-CE2 3.44Å; T593-W770 HydrophobicContact CG2-CE3 3.74Å; T593-W770 HydrophobicContact CG2-CH2 3.57Å; T593-W770 HydrophobicContact CG2-CZ2 3.44Å; T593-W770 VanDerWaalsContact CG2-CZ2 3.44Å; T593-W770 HydrophobicContact CG2-CZ3 3.7Å; T593-I773 HydrophobicContact CG2-CD1 4.1Å
594	L	91.9	Very high	89.3	Confident	75 Å²	75	30.3 Å²	30.3	39%	0.393	16%	0.156	S	C	.	.	H	α-helix	trans	-63.1	-40.6	179.3	-177.2	61.8	0	0	0	112.2	N590 F592 L598	N590-L594 PolarHBondContact O-N 2.92Å; F592-L594 PolarHBondContact O-N 3.43Å; L594-L598 HydrophobicContact CD1-CD1 4.11Å; L594-L598 HydrophobicContact CD1-CG 4.21Å; L594-L598 HydrophobicContact CG-CD1 4.06Å; L594-L598 WeakPolarHBondContact O-CB 3.34Å; L594-L598 VanDerWaalsContact O-CG 3.25Å; L594-L598 WeakPolarHBondContact O-CG 3.28Å; L594-L598 PolarHBondContact O-N 3.18Å
595	K	92.4	Very high	89.4	Confident	9 Å²	9	30 Å²	30	4%	0.039	16%	0.155	C	C	.	.	H	α-helix	trans	-61	-55.4	176.2	-71.9	160.6	172.5	62	0	111.5	S505 I509 Y569 T577 E580 S591 F592 T593 F597 L598 F599	S505-K595 WeakPolarHBondContact OG-CE 3.32Å; I509-K595 HydrophobicContact CD1-CG 3.69Å; I509-K595 HydrophobicContact CG1-CG 4.06Å; Y569-K595 PolarHBondContact OH-O 2.96Å; T577-K595 WeakPolarHBondContact OG1-CD 3.49Å; E580-K595 WeakPolarHBondContact OE1-CE 3.47Å; E580-K595 IonicContact OE1-NZ 2.79Å; E580-K595 PolarHBondContact OE1-NZ 3.33Å; E580-K595 IonicContact OE2-NZ 2.96Å; E580-K595 PolarHBondContact OE2-NZ 3.49Å; S591-K595 WeakPolarHBondContact O-CD 3.26Å; S591-K595 VanDerWaalsContact O-CG 3.31Å; S591-K595 WeakPolarHBondContact O-CG 3.39Å; S591-K595 PolarHBondContact O-N 2.83Å; S591-K595 PolarHBondContact OG-NZ 3Å; F592-K595 WeakPolarHBondContact O-CB 3.41Å; F592-K595 PolarHBondContact O-N 2.93Å; T593-K595 PolarHBondContact O-N 2.79Å; K595-F597 PolarHBondContact O-N 2.84Å; K595-L598 PolarHBondContact O-N 2.81Å; K595-F599 PolarHBondContact O-N 3.07Å; K595-F599 VanDerWaalsContact O-N 3.12Å
596	M	91.6	Very high	89.7	Confident	9 Å²	9	27 Å²	27	4%	0.044	14%	0.142	C	C	.	.	H	α-helix	trans	-62.4	-42.4	-179.3	-70.3	-67.5	-74.8	0	0	111.6	Y569 E570 A573 F592 T593 Q600 F710	Y569-M596 HydrophobicContact CD1-SD 3.63Å; Y569-M596 HydrophobicContact CE1-SD 3.81Å; E570-M596 HydrophobicContact CB-CE 4.04Å; E570-M596 HydrophobicContact CG-CE 4.08Å; A573-M596 HydrophobicContact CB-CG 4.02Å; A573-M596 HydrophobicContact CB-SD 3.54Å; A573-M596 VanDerWaalsContact CB-SD 3.54Å; F592-M596 HydrophobicContact CD1-CG 4.28Å; F592-M596 HydrophobicContact CD2-CG 4.11Å; F592-M596 HydrophobicContact CE1-CG 3.87Å; F592-M596 HydrophobicContact CE2-CG 3.68Å; F592-M596 HydrophobicContact CE2-SD 4.16Å; F592-M596 HydrophobicContact CG-CG 4.4Å; F592-M596 HydrophobicContact CZ-CE 4.35Å; F592-M596 HydrophobicContact CZ-CG 3.56Å; F592-M596 HydrophobicContact CZ-SD 4.14Å; F592-M596 WeakPolarHBondContact O-CG 3.41Å; F592-M596 PolarHBondContact O-N 2.74Å; T593-M596 PolarHBondContact O-N 2.79Å; M596-Q600 VanDerWaalsContact O-CB 3.23Å; M596-Q600 WeakPolarHBondContact O-CB 3.25Å; M596-Q600 WeakPolarHBondContact O-CG 3.41Å; M596-Q600 PolarHBondContact O-N 2.98Å; M596-F710 HydrophobicContact CB-CE1 4.02Å; M596-F710 HydrophobicContact CB-CE2 3.89Å; M596-F710 HydrophobicContact CB-CZ 3.29Å; M596-F710 HydrophobicContact CE-CE1 4.2Å; M596-F710 HydrophobicContact CG-CE1 4.3Å; M596-F710 HydrophobicContact CG-CZ 4Å
597	F	93	Very high	89.8	Confident	15 Å²	15	25.7 Å²	25.7	7%	0.066	13%	0.133	C	C	.	.	H	α-helix	trans	-60	-51.1	175.1	172.4	-99	0	0	0	112	T593 K595 F599 Q600 F601 L714 I717 L718 W770 I773 I777	T593-F597 WeakPolarHBondContact O-CB 3.46Å; T593-F597 PolarHBondContact O-N 2.93Å; K595-F597 PolarHBondContact O-N 2.84Å; F597-F599 VanDerWaalsContact C-N 3.31Å; F597-F599 PolarHBondContact O-N 2.96Å; F597-Q600 PolarHBondContact O-N 2.75Å; F597-F601 HydrophobicContact CE1-CB 4.23Å; F597-F601 HydrophobicContact CE1-CG 4.43Å; F597-F601 HydrophobicContact CE2-CB 4.16Å; F597-F601 HydrophobicContact CE2-CD2 4.16Å; F597-F601 HydrophobicContact CZ-CB 3.93Å; F597-F601 AromaticContact CZ-CD2 3.73Å; F597-F601 HydrophobicContact CZ-CD2 3.73Å; F597-F601 AromaticContact CZ-CG 3.98Å; F597-F601 HydrophobicContact CZ-CG 3.98Å; F597-F601 WeakPolarHBondContact O-CB 3.25Å; F597-F601 PolarHBondContact O-N 2.97Å; F597-L714 HydrophobicContact CD2-CD1 4.4Å; F597-I717 HydrophobicContact CE2-CG2 4.21Å; F597-L718 HydrophobicContact CE2-CD2 4.42Å; F597-W770 HydrophobicContact CB-CZ3 4.21Å; F597-W770 HydrophobicContact CD2-CZ3 4.26Å; F597-W770 HydrophobicContact CG-CZ3 4.48Å; F597-I773 HydrophobicContact CB-CD1 4Å; F597-I773 HydrophobicContact CD1-CD1 4.07Å; F597-I773 HydrophobicContact CD1-CG1 4.04Å; F597-I773 HydrophobicContact CD1-CG2 3.79Å; F597-I773 HydrophobicContact CD2-CG2 3.73Å; F597-I773 HydrophobicContact CE1-CG1 4.45Å; F597-I773 HydrophobicContact CE1-CG2 3.63Å; F597-I773 HydrophobicContact CE2-CG2 3.56Å; F597-I773 HydrophobicContact CG-CD1 3.95Å; F597-I773 HydrophobicContact CG-CG1 4.35Å; F597-I773 HydrophobicContact CG-CG2 3.85Å; F597-I773 HydrophobicContact CZ-CG2 3.52Å; F597-I777 HydrophobicContact CE2-CD1 4.03Å; F597-I777 HydrophobicContact CZ-CD1 3.88Å; F597-I777 HydrophobicContact CZ-CG1 4.1Å
598	L	92.3	Very high	89.8	Confident	67 Å²	67	22.3 Å²	22.3	35%	0.351	12%	0.118	S	C	.	.	H	α-helix	trans	-59.1	-42.8	-178.3	-75.5	170.2	0	0	0	111.9	L594 K595 V602	L594-L598 HydrophobicContact CD1-CD1 4.11Å; L594-L598 HydrophobicContact CD1-CG 4.21Å; L594-L598 HydrophobicContact CG-CD1 4.06Å; L594-L598 WeakPolarHBondContact O-CB 3.34Å; L594-L598 VanDerWaalsContact O-CG 3.25Å; L594-L598 WeakPolarHBondContact O-CG 3.28Å; L594-L598 PolarHBondContact O-N 3.18Å; K595-L598 PolarHBondContact O-N 2.81Å; L598-V602 WeakPolarHBondContact O-CG2 3.45Å; L598-V602 PolarHBondContact O-N 3.17Å
599	F	91.6	Very high	89.9	Confident	1 Å²	1	23.5 Å²	23.5	0%	0.004	12%	0.124	C	C	.	.	H	α-helix	trans	-66.3	-52.1	176.3	174.4	-93.1	0	0	0	112.4	M512 V516 L565 N566 Y569 K595 F597 F601 V602 N603	M512-F599 HydrophobicContact CB-CD2 4.18Å; M512-F599 HydrophobicContact CB-CE2 4.3Å; M512-F599 HydrophobicContact CE-CE2 4.36Å; V516-F599 HydrophobicContact CG2-CD2 4.15Å; V516-F599 HydrophobicContact CG2-CE2 3.42Å; V516-F599 VanDerWaalsContact CG2-CE2 3.42Å; V516-F599 HydrophobicContact CG2-CZ 3.93Å; L565-F599 HydrophobicContact CB-CZ 4.1Å; N566-F599 WeakPolarHBondContact OD1-CE1 3.13Å; Y569-F599 VanDerWaalsContact CB-CE1 3.4Å; Y569-F599 VanDerWaalsContact CB-CZ 3.48Å; Y569-F599 HydrophobicContact CD1-CB 3.6Å; Y569-F599 AromaticContact CD1-CD1 3.4Å; Y569-F599 HydrophobicContact CD1-CD1 3.4Å; Y569-F599 HydrophobicContact CD1-CD2 4.04Å; Y569-F599 HydrophobicContact CD1-CE1 4.07Å; Y569-F599 AromaticContact CD1-CG 3.38Å; Y569-F599 HydrophobicContact CD1-CG 3.38Å; Y569-F599 HydrophobicContact CD2-CB 4.16Å; Y569-F599 HydrophobicContact CD2-CD1 4.16Å; Y569-F599 AromaticContact CD2-CD2 3.34Å; Y569-F599 HydrophobicContact CD2-CD2 3.34Å; Y569-F599 HydrophobicContact CD2-CE1 4.45Å; Y569-F599 AromaticContact CD2-CE2 3.67Å; Y569-F599 HydrophobicContact CD2-CE2 3.67Å; Y569-F599 AromaticContact CD2-CG 3.61Å; Y569-F599 HydrophobicContact CD2-CG 3.61Å; Y569-F599 HydrophobicContact CD2-CZ 4.22Å; Y569-F599 HydrophobicContact CE1-CB 3.33Å; Y569-F599 HydrophobicContact CE1-CD1 4.09Å; Y569-F599 HydrophobicContact CE1-CD2 4.35Å; Y569-F599 AromaticContact CE1-CG 3.67Å; Y569-F599 HydrophobicContact CE1-CG 3.67Å; Y569-F599 HydrophobicContact CE2-CB 3.93Å; Y569-F599 AromaticContact CE2-CD2 3.7Å; Y569-F599 HydrophobicContact CE2-CD2 3.7Å; Y569-F599 HydrophobicContact CE2-CE2 4.43Å; Y569-F599 AromaticContact CE2-CG 3.88Å; Y569-F599 HydrophobicContact CE2-CG 3.88Å; Y569-F599 HydrophobicContact CG-CB 4.01Å; Y569-F599 AromaticContact CG-CD1 3.45Å; Y569-F599 HydrophobicContact CG-CD1 3.45Å; Y569-F599 VanDerWaalsContact CG-CD1 3.45Å; Y569-F599 AromaticContact CG-CD2 3.53Å; Y569-F599 HydrophobicContact CG-CD2 3.53Å; Y569-F599 AromaticContact CG-CE1 3.71Å; Y569-F599 HydrophobicContact CG-CE1 3.71Å; Y569-F599 AromaticContact CG-CE2 3.77Å; Y569-F599 HydrophobicContact CG-CE2 3.77Å; Y569-F599 AromaticContact CG-CG 3.35Å; Y569-F599 HydrophobicContact CG-CG 3.35Å; Y569-F599 AromaticContact CG-CZ 3.87Å; Y569-F599 HydrophobicContact CG-CZ 3.87Å; Y569-F599 AromaticContact CZ-CG 3.91Å; K595-F599 PolarHBondContact O-N 3.07Å; K595-F599 VanDerWaalsContact O-N 3.12Å; F597-F599 VanDerWaalsContact C-N 3.31Å; F597-F599 PolarHBondContact O-N 2.96Å; F599-F601 VanDerWaalsContact C-N 3.29Å; F599-F601 PolarHBondContact O-N 3.31Å; F599-V602 PolarHBondContact O-N 3.42Å; F599-N603 HydrophobicContact CE1-CB 4.25Å; F599-N603 HydrophobicContact CZ-CB 4.42Å; F599-N603 WeakPolarHBondContact O-CB 3.46Å; F599-N603 PolarHBondContact O-N 3.11Å
600	Q	89.8	Confident	90	Very high	23 Å²	23	22.9 Å²	22.9	11%	0.107	12%	0.119	C	C	.	.	H	α-helix	trans	-60.7	-39.3	-179.8	-72.6	-77.5	1.1	0	0	111.6	N566 M596 F597 V602 N603 L604 L714 L718	N566-Q600 PolarHBondContact ND2-NE2 2.84Å; N566-Q600 PolarHBondContact ND2-OE1 3.37Å; N566-Q600 VanDerWaalsContact ND2-OE1 3.09Å; N566-Q600 PolarHBondContact OD1-NE2 3.33Å; N566-Q600 PolarHBondContact OD1-OE1 2.84Å; M596-Q600 VanDerWaalsContact O-CB 3.23Å; M596-Q600 WeakPolarHBondContact O-CB 3.25Å; M596-Q600 WeakPolarHBondContact O-CG 3.41Å; M596-Q600 PolarHBondContact O-N 2.98Å; F597-Q600 PolarHBondContact O-N 2.75Å; Q600-V602 PolarHBondContact O-N 3.12Å; Q600-N603 PolarHBondContact O-N 3.37Å; Q600-L604 WeakPolarHBondContact O-CB 3.35Å; Q600-L604 PolarHBondContact O-N 3.48Å; Q600-L714 HydrophobicContact CB-CD1 4.28Å; Q600-L714 HydrophobicContact CG-CD1 4.47Å; Q600-L714 HydrophobicContact CG-CD2 4.04Å; Q600-L718 HydrophobicContact CB-CD1 4.47Å
601	F	90.8	Very high	89.8	Confident	26 Å²	26	21.2 Å²	21.2	11%	0.114	11%	0.11	C	C	.	.	H	α-helix	trans	-59.5	-46.7	176.4	-178.9	-93.2	0	0	0	111.8	F597 F599 N605 F609 I725 L780	F597-F601 HydrophobicContact CE1-CB 4.23Å; F597-F601 HydrophobicContact CE1-CG 4.43Å; F597-F601 HydrophobicContact CE2-CB 4.16Å; F597-F601 HydrophobicContact CE2-CD2 4.16Å; F597-F601 HydrophobicContact CZ-CB 3.93Å; F597-F601 AromaticContact CZ-CD2 3.73Å; F597-F601 HydrophobicContact CZ-CD2 3.73Å; F597-F601 AromaticContact CZ-CG 3.98Å; F597-F601 HydrophobicContact CZ-CG 3.98Å; F597-F601 WeakPolarHBondContact O-CB 3.25Å; F597-F601 PolarHBondContact O-N 2.97Å; F599-F601 VanDerWaalsContact C-N 3.29Å; F599-F601 PolarHBondContact O-N 3.31Å; F601-N605 WeakPolarHBondContact CD2-ND2 3.4Å; F601-N605 WeakPolarHBondContact CE2-ND2 3.45Å; F601-N605 HydrophobicContact CZ-CB 4.5Å; F601-N605 VanDerWaalsContact O-CB 3.31Å; F601-N605 WeakPolarHBondContact O-CB 3.14Å; F601-N605 PolarHBondContact O-N 3.06Å; F601-N605 PolarHBondContact O-ND2 2.9Å; F601-F609 HydrophobicContact CE1-CE2 4.12Å; F601-F609 HydrophobicContact CZ-CE2 4.09Å; F601-F609 HydrophobicContact CZ-CZ 4.33Å; F601-I725 HydrophobicContact CE2-CD1 3.51Å; F601-I725 HydrophobicContact CZ-CD1 3.77Å; F601-L780 HydrophobicContact CE1-CD2 3.88Å; F601-L780 HydrophobicContact CE2-CD2 4.45Å; F601-L780 HydrophobicContact CZ-CD2 3.48Å; F601-L780 VanDerWaalsContact CZ-CD2 3.48Å
602	V	90.6	Very high	89.7	Confident	34 Å²	34	20.3 Å²	20.3	21%	0.206	10%	0.104	C	C	.	.	H	α-helix	trans	-70.8	-46.4	176.7	-179.7	0	0	0	0	110.8	I513 V516 I517 L598 F599 Q600 L604 N605 S606	I513-V602 HydrophobicContact CG1-CG2 4.43Å; I513-V602 HydrophobicContact CG2-CG1 4.39Å; V516-V602 HydrophobicContact CG1-CG1 3.87Å; I517-V602 HydrophobicContact CG1-CG1 4.48Å; L598-V602 WeakPolarHBondContact O-CG2 3.45Å; L598-V602 PolarHBondContact O-N 3.17Å; F599-V602 PolarHBondContact O-N 3.42Å; Q600-V602 PolarHBondContact O-N 3.12Å; V602-L604 VanDerWaalsContact C-N 3.25Å; V602-L604 PolarHBondContact O-N 3.27Å; V602-N605 PolarHBondContact O-N 3.02Å; V602-S606 WeakPolarHBondContact O-CB 3.45Å; V602-S606 PolarHBondContact O-N 3.36Å; V602-S606 PolarHBondContact O-OG 2.91Å
603	N	86.9	Confident	89.6	Confident	5 Å²	5	22.1 Å²	22.1	3%	0.027	11%	0.112	C	C	.	.	H	α-helix	trans	-57.2	-39.5	-179.1	-159.9	25.9	0	0	0	112	V516 I562 N566 F599 Q600	V516-N603 HydrophobicContact CG1-CB 4.23Å; V516-N603 HydrophobicContact CG2-CB 4.28Å; I562-N603 PolarHBondContact O-ND2 3.41Å; N566-N603 PolarHBondContact OD1-ND2 2.87Å; F599-N603 HydrophobicContact CE1-CB 4.25Å; F599-N603 HydrophobicContact CZ-CB 4.42Å; F599-N603 WeakPolarHBondContact O-CB 3.46Å; F599-N603 PolarHBondContact O-N 3.11Å; Q600-N603 PolarHBondContact O-N 3.37Å
604	L	85.3	Confident	89.4	Confident	14 Å²	14	27 Å²	27	7%	0.073	13%	0.133	C	C	.	.	H	α-helix	trans	-82.3	-45	-178.8	-169.9	57.8	0	0	0	113.6	Q600 V602 I653 K657 L718 F722	Q600-L604 WeakPolarHBondContact O-CB 3.35Å; Q600-L604 PolarHBondContact O-N 3.48Å; V602-L604 VanDerWaalsContact C-N 3.25Å; V602-L604 PolarHBondContact O-N 3.27Å; L604-I653 HydrophobicContact CD1-CG2 4.05Å; L604-K657 HydrophobicContact CD2-CD 4.39Å; L604-L718 HydrophobicContact CD2-CB 4.3Å; L604-L718 HydrophobicContact CD2-CD1 4.01Å; L604-L718 HydrophobicContact CD2-CD2 4.18Å; L604-L718 HydrophobicContact CD2-CG 4.4Å; L604-F722 HydrophobicContact CD1-CZ 4.04Å; L604-F722 HydrophobicContact CD2-CE1 4.38Å; L604-F722 HydrophobicContact CD2-CE2 3.86Å; L604-F722 HydrophobicContact CD2-CZ 3.45Å; L604-F722 VanDerWaalsContact CD2-CZ 3.45Å; L604-F722 HydrophobicContact CG-CE1 4.27Å; L604-F722 HydrophobicContact CG-CE2 4.45Å; L604-F722 HydrophobicContact CG-CZ 3.58Å
605	N	87.8	Confident	89	Confident	3 Å²	3	24 Å²	24	2%	0.016	12%	0.117	C	C	.	.	H	α-helix	trans	-93	-17.2	-171.9	-62.8	-80.4	0	0	0	114.7	F601 V602 S607 T608 F609	F601-N605 WeakPolarHBondContact CD2-ND2 3.4Å; F601-N605 WeakPolarHBondContact CE2-ND2 3.45Å; F601-N605 HydrophobicContact CZ-CB 4.5Å; F601-N605 VanDerWaalsContact O-CB 3.31Å; F601-N605 WeakPolarHBondContact O-CB 3.14Å; F601-N605 PolarHBondContact O-N 3.06Å; F601-N605 PolarHBondContact O-ND2 2.9Å; V602-N605 PolarHBondContact O-N 3.02Å; N605-S607 VanDerWaalsContact C-N 3.33Å; N605-S607 PolarHBondContact O-N 3.45Å; N605-T608 CarbonylContact O-C 3.51Å; N605-T608 WeakPolarHBondContact O-CA 3.09Å; N605-T608 WeakPolarHBondContact O-CB 3.3Å; N605-T608 PolarHBondContact O-N 3.25Å; N605-F609 HydrophobicContact CB-CD2 3.84Å; N605-F609 HydrophobicContact CB-CE2 3.64Å; N605-F609 WeakPolarHBondContact O-CD2 3.46Å; N605-F609 PolarHBondContact O-N 2.87Å
606	S	88.3	Confident	88.4	Confident	18 Å²	18	24.8 Å²	24.8	13%	0.126	13%	0.127	C	C	.	.	H	α-helix	trans	-56.9	-42.8	-177.7	49.7	0	0	0	0	113.4	V520 V602 T608 F609 Y610	V520-S606 VanDerWaalsContact CG2-OG 3.27Å; V520-S606 WeakPolarHBondContact CG2-OG 3.29Å; V602-S606 WeakPolarHBondContact O-CB 3.45Å; V602-S606 PolarHBondContact O-N 3.36Å; V602-S606 PolarHBondContact O-OG 2.91Å; S606-T608 VanDerWaalsContact C-N 3.28Å; S606-T608 PolarHBondContact O-N 2.79Å; S606-F609 PolarHBondContact O-N 3.34Å; S606-Y610 PolarHBondContact O-N 2.9Å
607	S	84.3	Confident	88	Confident	12 Å²	12	29 Å²	29	8%	0.084	14%	0.143	C	C	.	.	H	α-helix	trans	-62.7	-34.9	174.7	67.1	0	0	0	0	112.4	N605 I611 Q649	N605-S607 VanDerWaalsContact C-N 3.33Å; N605-S607 PolarHBondContact O-N 3.45Å; S607-I611 PolarHBondContact O-N 2.78Å; S607-Q649 PolarHBondContact O-NE2 3.21Å; S607-Q649 PolarHBondContact OG-NE2 2.77Å; S607-Q649 VanDerWaalsContact OG-NE2 3.08Å
608	T	87.2	Confident	87.5	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.006	16%	0.164	C	C	.	.	H	α-helix	trans	-72.4	-42.1	176.5	-44.2	0	0	0	0	111.7	N605 S606 Y610 I611 A612 L646 M650 F726	N605-T608 CarbonylContact O-C 3.51Å; N605-T608 WeakPolarHBondContact O-CA 3.09Å; N605-T608 WeakPolarHBondContact O-CB 3.3Å; N605-T608 PolarHBondContact O-N 3.25Å; S606-T608 VanDerWaalsContact C-N 3.28Å; S606-T608 PolarHBondContact O-N 2.79Å; T608-Y610 VanDerWaalsContact C-N 3.31Å; T608-Y610 PolarHBondContact O-N 3.35Å; T608-I611 PolarHBondContact O-N 2.93Å; T608-A612 WeakPolarHBondContact O-CB 3.38Å; T608-A612 PolarHBondContact O-N 3.16Å; T608-L646 HydrophobicContact CG2-CD1 3.38Å; T608-M650 HydrophobicContact CG2-CG 4.11Å; T608-F726 HydrophobicContact CG2-CD1 4.27Å; T608-F726 HydrophobicContact CG2-CD2 3.99Å; T608-F726 HydrophobicContact CG2-CE1 3.97Å; T608-F726 HydrophobicContact CG2-CE2 3.67Å; T608-F726 HydrophobicContact CG2-CG 4.28Å; T608-F726 HydrophobicContact CG2-CZ 3.66Å
609	F	91	Very high	86.8	Confident	44 Å²	44	31.4 Å²	31.4	19%	0.193	15%	0.152	C	C	.	.	H	α-helix	trans	-63.4	-35	173.5	-76.9	-62.3	0	0	0	112.5	F601 N605 S606 F613 I725 F726 T784	F601-F609 HydrophobicContact CE1-CE2 4.12Å; F601-F609 HydrophobicContact CZ-CE2 4.09Å; F601-F609 HydrophobicContact CZ-CZ 4.33Å; N605-F609 HydrophobicContact CB-CD2 3.84Å; N605-F609 HydrophobicContact CB-CE2 3.64Å; N605-F609 WeakPolarHBondContact O-CD2 3.46Å; N605-F609 PolarHBondContact O-N 2.87Å; S606-F609 PolarHBondContact O-N 3.34Å; F609-F613 HydrophobicContact CD1-CD2 4.1Å; F609-F613 AromaticContact CD1-CE2 3.75Å; F609-F613 HydrophobicContact CD1-CE2 3.75Å; F609-F613 HydrophobicContact CE1-CE2 4.19Å; F609-F613 PolarHBondContact O-N 3.36Å; F609-F613 VanDerWaalsContact O-N 3.11Å; F609-I725 HydrophobicContact CE1-CG2 4.39Å; F609-I725 HydrophobicContact CZ-CG2 4.12Å; F609-F726 AromaticContact CD1-CE1 3.84Å; F609-F726 HydrophobicContact CD1-CE1 3.84Å; F609-F726 AromaticContact CD1-CZ 3.67Å; F609-F726 HydrophobicContact CD1-CZ 3.67Å; F609-F726 HydrophobicContact CD2-CZ 4.22Å; F609-F726 AromaticContact CE1-CE1 3.88Å; F609-F726 HydrophobicContact CE1-CE1 3.88Å; F609-F726 AromaticContact CE1-CZ 3.59Å; F609-F726 HydrophobicContact CE1-CZ 3.59Å; F609-F726 HydrophobicContact CE2-CZ 4.14Å; F609-F726 HydrophobicContact CG-CE1 4.48Å; F609-F726 AromaticContact CG-CZ 3.99Å; F609-F726 HydrophobicContact CG-CZ 3.99Å; F609-F726 AromaticContact CZ-CZ 3.83Å; F609-F726 HydrophobicContact CZ-CZ 3.83Å; F609-T784 HydrophobicContact CE1-CG2 3.79Å
610	Y	88.5	Confident	86.5	Confident	42 Å²	42	32.5 Å²	32.5	17%	0.165	16%	0.164	C	C	.	.	H	α-helix	trans	-61.2	-51.6	173.6	176.5	-97.6	0	0	0	111.8	V524 S606 T608 A612 F613 F614 L615	V524-Y610 HydrophobicContact CG1-CE1 4.29Å; V524-Y610 HydrophobicContact CG1-CE2 4.37Å; V524-Y610 WeakPolarHBondContact CG1-OH 3.13Å; V524-Y610 HydrophobicContact CG2-CD1 3.82Å; V524-Y610 HydrophobicContact CG2-CD2 4.2Å; V524-Y610 HydrophobicContact CG2-CE1 3.49Å; V524-Y610 VanDerWaalsContact CG2-CE1 3.49Å; V524-Y610 HydrophobicContact CG2-CE2 3.9Å; V524-Y610 HydrophobicContact CG2-CG 4.18Å; S606-Y610 PolarHBondContact O-N 2.9Å; T608-Y610 VanDerWaalsContact C-N 3.31Å; T608-Y610 PolarHBondContact O-N 3.35Å; Y610-A612 VanDerWaalsContact C-N 3.34Å; Y610-A612 PolarHBondContact O-N 2.93Å; Y610-F613 PolarHBondContact O-N 3.11Å; Y610-F614 HydrophobicContact CD2-CB 3.71Å; Y610-F614 HydrophobicContact CD2-CG 4.41Å; Y610-F614 HydrophobicContact CE2-CB 3.79Å; Y610-F614 PolarHBondContact O-N 3.48Å; Y610-L615 HydrophobicContact CE1-CB 4.29Å; Y610-L615 HydrophobicContact CE1-CD1 4.11Å; Y610-L615 PolarHBondContact O-N 2.64Å
611	I	85.9	Confident	86.3	Confident	12 Å²	12	33.1 Å²	33.1	6%	0.062	17%	0.167	C	C	.	.	H	α-helix	trans	-65.8	-35.9	179	-65.7	-162.1	0	0	0	111.8	S607 T608 L615 D645 L646	S607-I611 PolarHBondContact O-N 2.78Å; T608-I611 PolarHBondContact O-N 2.93Å; I611-L615 HydrophobicContact CB-CD2 4.39Å; I611-L615 HydrophobicContact CG1-CD2 4.27Å; I611-L615 HydrophobicContact CG2-CD2 3.96Å; I611-D645 HydrophobicContact CG2-CB 3.88Å; I611-L646 HydrophobicContact CG2-CB 4.16Å
612	A	89.4	Confident	86.1	Confident	5 Å²	5	32.1 Å²	32.1	4%	0.041	16%	0.163	C	C	.	.	H	α-helix	trans	-66.5	-42	178.3	0	0	0	0	0	113.9	T608 Y610 L646 F726 T792	T608-A612 WeakPolarHBondContact O-CB 3.38Å; T608-A612 PolarHBondContact O-N 3.16Å; Y610-A612 VanDerWaalsContact C-N 3.34Å; Y610-A612 PolarHBondContact O-N 2.93Å; A612-L646 HydrophobicContact CB-CD1 4.2Å; A612-L646 HydrophobicContact CB-CD2 3.96Å; A612-F726 HydrophobicContact CB-CE1 4.3Å; A612-T792 WeakPolarHBondContact O-CG2 3.47Å; A612-T792 PolarHBondContact O-OG1 3.22Å
613	F	90.4	Very high	85.8	Confident	41 Å²	41	31.6 Å²	31.6	18%	0.18	17%	0.165	C	C	.	.	H	α-helix	trans	-124.8	-18.1	-163.2	-58.3	-37.3	0	0	0	116.5	F609 Y610 T784 F787 V788	F609-F613 HydrophobicContact CD1-CD2 4.1Å; F609-F613 AromaticContact CD1-CE2 3.75Å; F609-F613 HydrophobicContact CD1-CE2 3.75Å; F609-F613 HydrophobicContact CE1-CE2 4.19Å; F609-F613 PolarHBondContact O-N 3.36Å; F609-F613 VanDerWaalsContact O-N 3.11Å; Y610-F613 PolarHBondContact O-N 3.11Å; F613-T784 HydrophobicContact CE2-CG2 4.18Å; F613-T784 HydrophobicContact CZ-CG2 3.88Å; F613-F787 HydrophobicContact CD1-CB 4.37Å; F613-F787 HydrophobicContact CE1-CB 3.53Å; F613-F787 HydrophobicContact CE2-CB 4.43Å; F613-F787 HydrophobicContact CZ-CB 3.56Å; F613-V788 HydrophobicContact CE1-CG2 3.78Å; F613-V788 HydrophobicContact CZ-CG2 3.9Å
614	F	88.2	Confident	85.7	Confident	112 Å²	112	34 Å²	34	49%	0.491	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.9	-34.4	-173.7	-65	-91.9	0	0	0	113.4	Y610 R617 F618	Y610-F614 HydrophobicContact CD2-CB 3.71Å; Y610-F614 HydrophobicContact CD2-CG 4.41Å; Y610-F614 HydrophobicContact CE2-CB 3.79Å; Y610-F614 PolarHBondContact O-N 3.48Å; F614-R617 PolarHBondContact O-N 3.12Å; F614-F618 AromaticContact CD1-CE2 3.97Å; F614-F618 HydrophobicContact CD1-CE2 3.97Å
615	L	84.4	Confident	85.6	Confident	10 Å²	10	34.3 Å²	34.3	5%	0.052	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	135.9	177	-175.1	67.3	0	0	0	111.5	Y610 I611 R617 E635	Y610-L615 HydrophobicContact CE1-CB 4.29Å; Y610-L615 HydrophobicContact CE1-CD1 4.11Å; Y610-L615 PolarHBondContact O-N 2.64Å; I611-L615 HydrophobicContact CB-CD2 4.39Å; I611-L615 HydrophobicContact CG1-CD2 4.27Å; I611-L615 HydrophobicContact CG2-CD2 3.96Å; L615-R617 PolarHBondContact O-N 3.12Å; L615-E635 HydrophobicContact CD1-CB 3.68Å; L615-E635 HydrophobicContact CD1-CG 3.69Å
616	G	78.8	Confident	85.3	Confident	26 Å²	26	39.1 Å²	39.1	27%	0.268	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.9	-3.5	178.3	0	0	0	0	0	117.4	T619 E635	G616-T619 PolarHBondContact O-OG1 3.34Å; G616-E635 WeakPolarHBondContact CA-O 3.44Å; G616-E635 PolarHBondContact N-O 3.35Å; G616-E635 VanDerWaalsContact N-O 3.09Å
617	R	83.9	Confident	84.8	Confident	97 Å²	97	39.9 Å²	39.9	37%	0.366	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-26.9	-171.4	-168.2	66	-165	97.5	-9.1	114.3	F614 L615	F614-R617 PolarHBondContact O-N 3.12Å; L615-R617 PolarHBondContact O-N 3.12Å
618	F	82.9	Confident	84.3	Confident	115 Å²	115	41.7 Å²	41.7	50%	0.504	22%	0.219	S	C	.	.	S	Bend	trans	-117.6	30.6	-171.8	-61.7	-79.8	0	0	0	113.2	F614 L626	F614-F618 AromaticContact CD1-CE2 3.97Å; F614-F618 HydrophobicContact CD1-CE2 3.97Å; F618-L626 WeakPolarHBondContact O-CB 3.13Å; F618-L626 WeakPolarHBondContact O-CD1 3.13Å
619	T	77.3	Confident	83.7	Confident	18 Å²	18	48.7 Å²	48.7	11%	0.11	26%	0.255	C	S	.	.			trans	-89.5	-28.9	-169.5	49.7	0	0	0	0	113.8	G616 Y625 L626 L634 E636	G616-T619 PolarHBondContact O-OG1 3.34Å; T619-Y625 WeakPolarHBondContact O-CA 3.37Å; T619-L626 PolarHBondContact O-N 3.37Å; T619-L634 HydrophobicContact CG2-CB 4.07Å; T619-E636 HydrophobicContact CG2-CG 3.53Å
620	G	84.3	Confident	82.9	Confident	24 Å²	24	53 Å²	53	25%	0.247	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	107.9	-133.3	176	0	0	0	0	0	112.7
621	H	87.1	Confident	82.1	Confident	37 Å²	37	59.5 Å²	59.5	17%	0.171	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	164.8	168.4	67.4	103.5	0	0	0	109.6	G623 A624 Y625 Y858 Y871	H621-G623 PolarHBondContact O-N 2.78Å; H621-A624 PolarHBondContact N-O 3.33Å; H621-A624 CarbonylContact O-C 3.58Å; H621-A624 PolarHBondContact O-N 3.45Å; H621-Y625 PolarHBondContact O-N 2.83Å; H621-Y858 HydrophobicContact CB-CE2 4.02Å; H621-Y871 AromaticContact ND1-CG 3.94Å
622	P	85.9	Confident	81.6	Confident	4 Å²	4	62.8 Å²	62.8	3%	0.026	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-22.2	-165.4	-27.8	36.5	0	0	0	117.5	Y625 F830 F835 Y858	P622-Y625 VanDerWaalsContact CA-CZ 3.49Å; P622-Y625 WeakPolarHBondContact CA-OH 3.44Å; P622-Y625 WeakPolarHBondContact O-CE2 3.1Å; P622-F830 HydrophobicContact CB-CD1 3.74Å; P622-F830 HydrophobicContact CB-CD2 3.84Å; P622-F830 HydrophobicContact CB-CE1 3.72Å; P622-F830 HydrophobicContact CB-CE2 3.84Å; P622-F830 HydrophobicContact CB-CG 3.8Å; P622-F830 HydrophobicContact CB-CZ 3.76Å; P622-F830 HydrophobicContact CG-CB 4.45Å; P622-F830 HydrophobicContact CG-CD1 4.42Å; P622-F830 HydrophobicContact CG-CD2 4.18Å; P622-F830 HydrophobicContact CG-CG 4.09Å; P622-F835 HydrophobicContact CB-CD1 4.39Å; P622-F835 HydrophobicContact CB-CE1 3.72Å; P622-F835 HydrophobicContact CB-CZ 4.35Å; P622-F835 VanDerWaalsContact O-CD1 3.25Å; P622-F835 WeakPolarHBondContact O-CD1 3.37Å; P622-Y858 HydrophobicContact CG-CD1 3.92Å; P622-Y858 HydrophobicContact CG-CD2 4.04Å; P622-Y858 HydrophobicContact CG-CE1 4.29Å; P622-Y858 HydrophobicContact CG-CE2 4.38Å; P622-Y858 HydrophobicContact CG-CG 3.78Å
623	G	83.2	Confident	81	Confident	24 Å²	24	63.4 Å²	63.4	25%	0.247	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-12.4	173.1	0	0	0	0	0	114.9	H621 D834	H621-G623 PolarHBondContact O-N 2.78Å; G623-D834 WeakPolarHBondContact CA-O 3.31Å
624	A	85.3	Confident	80.4	Confident	55 Å²	55	63.5 Å²	63.5	46%	0.455	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	85.9	178.2	0	0	0	0	0	110.8	H621	H621-A624 PolarHBondContact N-O 3.33Å; H621-A624 CarbonylContact O-C 3.58Å; H621-A624 PolarHBondContact O-N 3.45Å
625	Y	83.6	Confident	79.6	Confident	20 Å²	20	60.2 Å²	60.2	8%	0.078	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	141	173.5	-65.6	-68	0	0	0	111.7	T619 H621 P622 R627 R633 E636	T619-Y625 WeakPolarHBondContact O-CA 3.37Å; H621-Y625 PolarHBondContact O-N 2.83Å; P622-Y625 VanDerWaalsContact CA-CZ 3.49Å; P622-Y625 WeakPolarHBondContact CA-OH 3.44Å; P622-Y625 WeakPolarHBondContact O-CE2 3.1Å; Y625-R627 PolarHBondContact O-N 3.3Å; Y625-R633 HydrophobicContact CD1-CG 4.34Å; Y625-R633 VanDerWaalsContact CE1-CZ 3.44Å; Y625-R633 VanDerWaalsContact CE1-NE 3.31Å; Y625-R633 HydrophobicContact CG-CG 4.23Å; Y625-R633 VanDerWaalsContact OH-CZ 3.32Å; Y625-R633 PolarHBondContact OH-NH1 3.23Å; Y625-R633 PolarHBondContact OH-NH2 3.32Å; Y625-R633 VanDerWaalsContact OH-NH2 3.11Å; Y625-E636 VanDerWaalsContact CE1-OE1 3.25Å; Y625-E636 WeakPolarHBondContact CE1-OE1 3.49Å
626	L	81.3	Confident	79.3	Confident	104 Å²	104	62.1 Å²	62.1	55%	0.545	31%	0.314	S	S	.	.			trans	-71.2	111.8	166.6	-86.7	152.8	0	0	0	109	F618 T619 L634	F618-L626 WeakPolarHBondContact O-CB 3.13Å; F618-L626 WeakPolarHBondContact O-CD1 3.13Å; T619-L626 PolarHBondContact O-N 3.37Å; L626-L634 WeakPolarHBondContact O-CD1 3.44Å
627	R	77.3	Confident	79.3	Confident	35 Å²	35	62 Å²	62	13%	0.132	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	122.9	-179	-63.1	-176.1	-174.5	-81.2	-3.4	111.2	D401 Y625 I629 N630 W632 E836 S839	D401-R627 IonicContact OD2-CZ 2.88Å; D401-R627 IonicContact OD2-NH1 2.69Å; D401-R627 PolarHBondContact OD2-NH1 2.88Å; Y625-R627 PolarHBondContact O-N 3.3Å; R627-I629 PolarHBondContact O-N 3.08Å; R627-N630 PolarHBondContact O-N 3.46Å; R627-W632 CarbonylContact C-O 3.46Å; R627-W632 WeakPolarHBondContact CA-O 3.37Å; R627-E836 IonicContact CZ-OE2 3.13Å; R627-E836 IonicContact NE-OE2 3.91Å; R627-E836 PolarHBondContact NE-OE2 2.89Å; R627-E836 VanDerWaalsContact NE-OE2 3.13Å; R627-E836 IonicContact NH2-OE2 3.36Å; R627-E836 PolarHBondContact NH2-OE2 3.39Å; R627-S839 PolarHBondContact NH2-OG 2.04Å
628	L	74.4	Confident	78.9	Confident	50 Å²	50	59.3 Å²	59.3	26%	0.262	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	125.9	172.7	-159.1	74	0	0	0	110.2	F521 I525 N630 R631 W632 L634	F521-L628 HydrophobicContact CE2-CD1 4.35Å; F521-L628 HydrophobicContact CE2-CD2 4.28Å; F521-L628 HydrophobicContact CZ-CD1 4Å; F521-L628 HydrophobicContact CZ-CD2 3.82Å; F521-L628 HydrophobicContact CZ-CG 4.44Å; I525-L628 HydrophobicContact CD1-CD2 4.1Å; I525-L628 HydrophobicContact CG1-CD2 3.81Å; L628-N630 PolarHBondContact O-N 2.9Å; L628-N630 VanDerWaalsContact O-N 3.14Å; L628-R631 PolarHBondContact O-N 3.04Å; L628-W632 PolarHBondContact N-O 3.36Å; L628-W632 PolarHBondContact O-N 3.17Å; L628-W632 VanDerWaalsContact O-N 3.15Å; L628-L634 HydrophobicContact CB-CD1 3.96Å; L628-L634 HydrophobicContact CD1-CD1 4.49Å
629	I	74.5	Confident	78.5	Confident	148 Å²	148	54.8 Å²	54.8	76%	0.759	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.3	37.9	-175	-41.6	176.3	0	0	0	111.1	R627 R631	R627-I629 PolarHBondContact O-N 3.08Å; I629-R631 PolarHBondContact O-N 3.01Å
630	N	74.4	Confident	78.2	Confident	134 Å²	134	54.7 Å²	54.7	72%	0.717	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	13.3	-176.7	-64.7	-11.4	0	0	0	116	R627 L628	R627-N630 PolarHBondContact O-N 3.46Å; L628-N630 PolarHBondContact O-N 2.9Å; L628-N630 VanDerWaalsContact O-N 3.14Å
631	R	72.3	Confident	78	Confident	178 Å²	178	53.9 Å²	53.9	67%	0.672	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.8	-38.3	-170.3	-172	172.2	-178.9	161.2	2.6	114.2	L628 I629	L628-R631 PolarHBondContact O-N 3.04Å; I629-R631 PolarHBondContact O-N 3.01Å
632	W	74.1	Confident	77.8	Confident	82 Å²	82	53.3 Å²	53.3	31%	0.311	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	126.2	-170.7	-51.4	106.6	0	0	0	111.6	V528 V529 R627 L628	V528-W632 HydrophobicContact CG1-CB 3.81Å; V529-W632 HydrophobicContact CG1-CH2 4.4Å; V529-W632 HydrophobicContact CG2-CD2 4.11Å; V529-W632 HydrophobicContact CG2-CE3 4.13Å; V529-W632 HydrophobicContact CG2-CH2 4.01Å; V529-W632 HydrophobicContact CG2-CZ2 3.97Å; V529-W632 HydrophobicContact CG2-CZ3 4.08Å; R627-W632 CarbonylContact C-O 3.46Å; R627-W632 WeakPolarHBondContact CA-O 3.37Å; L628-W632 PolarHBondContact N-O 3.36Å; L628-W632 PolarHBondContact O-N 3.17Å; L628-W632 VanDerWaalsContact O-N 3.15Å
633	R	78	Confident	77.8	Confident	17 Å²	17	53.4 Å²	53.4	6%	0.064	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	139.7	174.5	175.1	172	165.5	-163.5	-4.9	110.3	P398 V399 C400 D401 V528 Y625 E636	P398-R633 PolarHBondContact O-NH1 2.98Å; P398-R633 PolarHBondContact O-NH2 3.1Å; V399-R633 PolarHBondContact O-NH2 3.3Å; C400-R633 PolarHBondContact O-NH1 3.5Å; D401-R633 WeakPolarHBondContact OD1-CD 3.46Å; D401-R633 IonicContact OD1-NH1 2.61Å; D401-R633 PolarHBondContact OD1-NH1 3.36Å; V528-R633 WeakPolarHBondContact CG1-O 3.28Å; Y625-R633 HydrophobicContact CD1-CG 4.34Å; Y625-R633 VanDerWaalsContact CE1-CZ 3.44Å; Y625-R633 VanDerWaalsContact CE1-NE 3.31Å; Y625-R633 HydrophobicContact CG-CG 4.23Å; Y625-R633 VanDerWaalsContact OH-CZ 3.32Å; Y625-R633 PolarHBondContact OH-NH1 3.23Å; Y625-R633 PolarHBondContact OH-NH2 3.32Å; Y625-R633 VanDerWaalsContact OH-NH2 3.11Å; R633-E636 IonicContact CZ-OE1 2.91Å; R633-E636 VanDerWaalsContact CZ-OE1 3.26Å; R633-E636 IonicContact NE-OE1 3.85Å; R633-E636 PolarHBondContact NE-OE1 3.48Å; R633-E636 IonicContact NH2-OE1 3.4Å; R633-E636 PolarHBondContact NH2-OE1 2.82Å; R633-E636 IonicContact NH2-OE2 2.8Å; R633-E636 PolarHBondContact NH2-OE2 3.02Å
634	L	76.4	Confident	77.8	Confident	44 Å²	44	52.5 Å²	52.5	23%	0.23	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-71.2	152.7	176.5	-87.5	73.3	0	0	0	111.7	T619 L626 L628	T619-L634 HydrophobicContact CG2-CB 4.07Å; L626-L634 WeakPolarHBondContact O-CD1 3.44Å; L628-L634 HydrophobicContact CB-CD1 3.96Å; L628-L634 HydrophobicContact CD1-CD1 4.49Å
635	E	73.4	Confident	77.7	Confident	43 Å²	43	52.1 Å²	52.1	20%	0.201	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-67.8	127.5	-179.4	-163.3	177.9	179.1	0	0	111.3	R527 V528 L615 G616	R527-E635 WeakPolarHBondContact CD-OE2 3.49Å; R527-E635 IonicContact NH1-OE1 3.43Å; R527-E635 PolarHBondContact NH1-OE1 2.88Å; R527-E635 IonicContact NH1-OE2 2.68Å; V528-E635 HydrophobicContact CG2-CB 4.34Å; L615-E635 HydrophobicContact CD1-CB 3.68Å; L615-E635 HydrophobicContact CD1-CG 3.69Å; G616-E635 WeakPolarHBondContact CA-O 3.44Å; G616-E635 PolarHBondContact N-O 3.35Å; G616-E635 VanDerWaalsContact N-O 3.09Å
636	E	77.4	Confident	77.8	Confident	50 Å²	50	51.2 Å²	51.2	23%	0.234	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-98.6	145.5	176.3	-77.5	164.5	-143.7	0	0	110.6	V399 T619 Y625 R633	V399-E636 HydrophobicContact CG1-CB 4.12Å; T619-E636 HydrophobicContact CG2-CG 3.53Å; Y625-E636 VanDerWaalsContact CE1-OE1 3.25Å; Y625-E636 WeakPolarHBondContact CE1-OE1 3.49Å; R633-E636 IonicContact CZ-OE1 2.91Å; R633-E636 VanDerWaalsContact CZ-OE1 3.26Å; R633-E636 IonicContact NE-OE1 3.85Å; R633-E636 PolarHBondContact NE-OE1 3.48Å; R633-E636 IonicContact NH2-OE1 3.4Å; R633-E636 PolarHBondContact NH2-OE1 2.82Å; R633-E636 IonicContact NH2-OE2 2.8Å; R633-E636 PolarHBondContact NH2-OE2 3.02Å
637	C	78.9	Confident	78	Confident	24 Å²	24	46.6 Å²	46.6	16%	0.162	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-72.6	156.6	176.8	-54.9	0	0	0	0	111.9	C642	C637-C642 HydrophobicContact CB-CB 3.85Å; C637-C642 WeakPolarHBondContact CB-SG 3.26Å; C637-C642 WeakPolarHBondContact SG-CB 3.38Å; C637-C642 CovalentContact SG-SG 2.03Å; C637-C642 PolarHBondContact SG-SG 3.26Å
638	H	75.3	Confident	78.2	Confident	40 Å²	40	49.3 Å²	49.3	19%	0.185	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-55.3	147.6	171.7	-165	-104.9	0	0	0	111.5	S412 Y415 S640 G641	S412-H638 PolarHBondContact OG-CE1 3.05Å; S412-H638 VanDerWaalsContact OG-CE1 3.27Å; Y415-H638 AromaticContact CD2-CE1 3.48Å; Y415-H638 VanDerWaalsContact CD2-CE1 3.48Å; Y415-H638 WeakPolarHBondContact CD2-CE1 3.46Å; Y415-H638 AromaticContact CD2-NE2 3.97Å; Y415-H638 AromaticContact CG-CE1 3.6Å; Y415-H638 AromaticContact CG-ND1 3.89Å; H638-S640 PolarHBondContact ND1-OG 3.1Å; H638-S640 PolarHBondContact O-N 3.33Å; H638-G641 PolarHBondContact O-N 3.26Å
639	P	73.5	Confident	78.6	Confident	20 Å²	20	48.3 Å²	48.3	13%	0.13	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-25.7	-177.7	-31.1	37.6	0	0	0	115.6	M396 L409 G641	M396-P639 HydrophobicContact CE-CB 4.3Å; M396-P639 HydrophobicContact CE-CG 4.41Å; L409-P639 HydrophobicContact CD1-CB 4.21Å; P639-G641 VanDerWaalsContact C-N 3.27Å; P639-G641 PolarHBondContact O-N 3.29Å
640	S	71.6	Confident	79.1	Confident	15 Å²	15	41.6 Å²	41.6	11%	0.105	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	3.3	174.7	60.5	0	0	0	0	115.5	Y415 T419 H638	Y415-S640 WeakPolarHBondContact CB-OG 3.32Å; T419-S640 PolarHBondContact OG1-O 3.12Å; H638-S640 PolarHBondContact ND1-OG 3.1Å; H638-S640 PolarHBondContact O-N 3.33Å
641	G	79.5	Confident	79.4	Confident	8 Å²	8	36 Å²	36	8%	0.082	18%	0.176	C	C	.	.			trans	91.1	153.7	179	0	0	0	0	0	114.8	H638 P639 L643	H638-G641 PolarHBondContact O-N 3.26Å; P639-G641 VanDerWaalsContact C-N 3.27Å; P639-G641 PolarHBondContact O-N 3.29Å; G641-L643 VanDerWaalsContact C-N 3.26Å; G641-L643 PolarHBondContact O-N 3.08Å
642	C	83.1	Confident	79.8	Confident	25 Å²	25	31.6 Å²	31.6	17%	0.169	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-13.9	-172.7	-34.6	0	0	0	0	114.8	C637 I644 D645 L646 T792	C637-C642 HydrophobicContact CB-CB 3.85Å; C637-C642 WeakPolarHBondContact CB-SG 3.26Å; C637-C642 WeakPolarHBondContact SG-CB 3.38Å; C637-C642 CovalentContact SG-SG 2.03Å; C637-C642 PolarHBondContact SG-SG 3.26Å; C642-I644 PolarHBondContact O-N 3.47Å; C642-D645 PolarHBondContact O-N 2.96Å; C642-L646 PolarHBondContact O-N 3.21Å; C642-T792 HydrophobicContact CB-CG2 4.27Å
643	L	86.3	Confident	80.1	Confident	6 Å²	6	29 Å²	29	3%	0.031	16%	0.157	C	C	.	.	H	α-helix	trans	-63.4	-29.3	-174.4	-162.1	80.8	0	0	0	112.3	D423 G641 L646 C647 A729 V788 T792	D423-L643 HydrophobicContact CB-CD2 3.68Å; G641-L643 VanDerWaalsContact C-N 3.26Å; G641-L643 PolarHBondContact O-N 3.08Å; L643-L646 HydrophobicContact CD1-CD2 4.34Å; L643-C647 WeakPolarHBondContact O-CB 3.37Å; L643-C647 PolarHBondContact O-N 3.3Å; L643-A729 HydrophobicContact CD1-CB 3.93Å; L643-A729 HydrophobicContact CG-CB 4.35Å; L643-V788 HydrophobicContact CD1-CG1 3.94Å; L643-T792 HydrophobicContact CB-CG2 4.47Å; L643-T792 HydrophobicContact CD1-CG2 3.89Å
644	I	83.8	Confident	80.2	Confident	4 Å²	4	29 Å²	29	2%	0.021	16%	0.158	C	C	.	.	H	α-helix	trans	-69.5	-38.5	177.2	-169.6	56.5	0	0	0	111.9	Y415 V418 C642 C647 M648	Y415-I644 HydrophobicContact CD1-CG1 4.44Å; V418-I644 HydrophobicContact CB-CD1 4.3Å; V418-I644 HydrophobicContact CG1-CD1 3.59Å; C642-I644 PolarHBondContact O-N 3.47Å; I644-C647 PolarHBondContact O-N 3.1Å; I644-M648 HydrophobicContact CD1-CE 4.1Å; I644-M648 HydrophobicContact CD1-CG 4.41Å; I644-M648 HydrophobicContact CG1-CE 3.93Å; I644-M648 HydrophobicContact CG1-CG 4.48Å; I644-M648 HydrophobicContact CG1-SD 4.47Å; I644-M648 WeakPolarHBondContact O-CB 3.46Å; I644-M648 WeakPolarHBondContact O-CG 3.5Å; I644-M648 PolarHBondContact O-N 2.7Å
645	D	81.9	Confident	80.5	Confident	48 Å²	48	30.5 Å²	30.5	26%	0.257	17%	0.168	S	C	.	.	H	α-helix	trans	-65.4	-42.7	178.3	-52.3	-51.2	0	0	0	110.4	I611 C642 M648 Q649	I611-D645 HydrophobicContact CG2-CB 3.88Å; C642-D645 PolarHBondContact O-N 2.96Å; D645-M648 PolarHBondContact O-N 3.48Å; D645-Q649 VanDerWaalsContact O-CB 3.29Å; D645-Q649 WeakPolarHBondContact O-CB 3.28Å; D645-Q649 PolarHBondContact O-N 2.98Å
646	L	85.8	Confident	80.8	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-59.7	-48.4	171.8	175.7	60.2	0	0	0	111.8	T608 I611 A612 C642 L643 Q649 M650 F726 A729 V788 T792	T608-L646 HydrophobicContact CG2-CD1 3.38Å; I611-L646 HydrophobicContact CG2-CB 4.16Å; A612-L646 HydrophobicContact CB-CD1 4.2Å; A612-L646 HydrophobicContact CB-CD2 3.96Å; C642-L646 PolarHBondContact O-N 3.21Å; L643-L646 HydrophobicContact CD1-CD2 4.34Å; L646-Q649 PolarHBondContact O-N 3.35Å; L646-M650 HydrophobicContact CD1-CG 4.29Å; L646-M650 HydrophobicContact CD1-SD 4.16Å; L646-M650 HydrophobicContact CG-SD 4.22Å; L646-M650 WeakPolarHBondContact O-CB 3.38Å; L646-M650 VanDerWaalsContact O-CG 3.3Å; L646-M650 WeakPolarHBondContact O-CG 3.3Å; L646-M650 PolarHBondContact O-N 3.24Å; L646-F726 HydrophobicContact CD1-CD1 4.29Å; L646-A729 HydrophobicContact CD2-CB 3.69Å; L646-A729 HydrophobicContact CG-CB 4.04Å; L646-V788 HydrophobicContact CD2-CG1 4.42Å; L646-V788 HydrophobicContact CD2-CG2 4.48Å; L646-T792 HydrophobicContact CD2-CG2 4.27Å
647	C	87.1	Confident	80.7	Confident	8 Å²	8	32 Å²	32	5%	0.054	18%	0.177	C	C	.	.	H	α-helix	trans	-62.4	-42.9	178.7	-177.8	0	0	0	0	112.2	L643 I644 G651 F730	L643-C647 WeakPolarHBondContact O-CB 3.37Å; L643-C647 PolarHBondContact O-N 3.3Å; I644-C647 PolarHBondContact O-N 3.1Å; C647-G651 PolarHBondContact O-N 3.44Å; C647-F730 WeakPolarHBondContact SG-CD2 3.49Å
648	M	81.6	Confident	80.8	Confident	91 Å²	91	31.6 Å²	31.6	45%	0.448	17%	0.173	S	C	.	.	H	α-helix	trans	-65.9	-45.3	176.8	-74.1	-174.3	177.2	0	0	111.4	Y415 I644 D645 M650 G651 I652	Y415-M648 HydrophobicContact CE1-CE 4.37Å; I644-M648 HydrophobicContact CD1-CE 4.1Å; I644-M648 HydrophobicContact CD1-CG 4.41Å; I644-M648 HydrophobicContact CG1-CE 3.93Å; I644-M648 HydrophobicContact CG1-CG 4.48Å; I644-M648 HydrophobicContact CG1-SD 4.47Å; I644-M648 WeakPolarHBondContact O-CB 3.46Å; I644-M648 WeakPolarHBondContact O-CG 3.5Å; I644-M648 PolarHBondContact O-N 2.7Å; D645-M648 PolarHBondContact O-N 3.48Å; M648-M650 PolarHBondContact O-N 3.29Å; M648-G651 PolarHBondContact O-N 3.29Å; M648-I652 WeakPolarHBondContact O-CB 3.27Å; M648-I652 VanDerWaalsContact O-CG1 3.24Å; M648-I652 WeakPolarHBondContact O-CG1 3.44Å; M648-I652 PolarHBondContact O-N 3.45Å
649	Q	82.4	Confident	81	Confident	29 Å²	29	33.9 Å²	33.9	14%	0.136	19%	0.19	C	C	.	.	H	α-helix	trans	-59.1	-47.2	176.2	-178	-177.7	20.6	0	0	111.7	S607 D645 L646 I652 I653	S607-Q649 PolarHBondContact O-NE2 3.21Å; S607-Q649 PolarHBondContact OG-NE2 2.77Å; S607-Q649 VanDerWaalsContact OG-NE2 3.08Å; D645-Q649 VanDerWaalsContact O-CB 3.29Å; D645-Q649 WeakPolarHBondContact O-CB 3.28Å; D645-Q649 PolarHBondContact O-N 2.98Å; L646-Q649 PolarHBondContact O-N 3.35Å; Q649-I652 PolarHBondContact O-N 2.83Å; Q649-I653 HydrophobicContact CG-CD1 3.76Å; Q649-I653 HydrophobicContact CG-CG1 4.49Å; Q649-I653 WeakPolarHBondContact O-CB 3.49Å; Q649-I653 VanDerWaalsContact O-CG1 3.25Å; Q649-I653 WeakPolarHBondContact O-CG1 3.32Å; Q649-I653 PolarHBondContact O-N 2.99Å
650	M	84.1	Confident	81.4	Confident	7 Å²	7	37.8 Å²	37.8	3%	0.034	20%	0.202	C	C	.	.	H	α-helix	trans	-60.9	-46.8	175.9	-74.1	174.6	62	0	0	112.4	T608 L646 M648 I653 M654 F726 A729 F730	T608-M650 HydrophobicContact CG2-CG 4.11Å; L646-M650 HydrophobicContact CD1-CG 4.29Å; L646-M650 HydrophobicContact CD1-SD 4.16Å; L646-M650 HydrophobicContact CG-SD 4.22Å; L646-M650 WeakPolarHBondContact O-CB 3.38Å; L646-M650 VanDerWaalsContact O-CG 3.3Å; L646-M650 WeakPolarHBondContact O-CG 3.3Å; L646-M650 PolarHBondContact O-N 3.24Å; M648-M650 PolarHBondContact O-N 3.29Å; M650-I653 PolarHBondContact O-N 2.84Å; M650-M654 VanDerWaalsContact O-CB 3.25Å; M650-M654 WeakPolarHBondContact O-CB 3.32Å; M650-M654 PolarHBondContact O-N 3.43Å; M650-F726 HydrophobicContact CE-CB 3.54Å; M650-F726 HydrophobicContact SD-CB 3.35Å; M650-F726 WeakPolarHBondContact SD-CB 3.33Å; M650-F726 HydrophobicContact SD-CG 4.14Å; M650-A729 HydrophobicContact SD-CB 4.29Å; M650-F730 HydrophobicContact CE-CB 3.86Å; M650-F730 HydrophobicContact SD-CB 4.43Å
651	G	81.8	Confident	81.9	Confident	16 Å²	16	39 Å²	39	17%	0.165	21%	0.207	C	C	.	.	H	α-helix	trans	-61.4	-45.7	179.2	0	0	0	0	0	112.1	C647 M648 V655	C647-G651 PolarHBondContact O-N 3.44Å; M648-G651 PolarHBondContact O-N 3.29Å; G651-V655 WeakPolarHBondContact O-CB 3.41Å; G651-V655 WeakPolarHBondContact O-CG2 3.37Å; G651-V655 PolarHBondContact O-N 3.46Å
652	I	81	Confident	82.2	Confident	86 Å²	86	39.4 Å²	39.4	44%	0.441	21%	0.208	S	C	.	.	H	α-helix	trans	-63.2	-50.1	176.5	-68.6	165.5	0	0	0	110.6	M648 Q649 M654 V655 L656	M648-I652 WeakPolarHBondContact O-CB 3.27Å; M648-I652 VanDerWaalsContact O-CG1 3.24Å; M648-I652 WeakPolarHBondContact O-CG1 3.44Å; M648-I652 PolarHBondContact O-N 3.45Å; Q649-I652 PolarHBondContact O-N 2.83Å; I652-M654 PolarHBondContact O-N 3.28Å; I652-V655 PolarHBondContact O-N 2.89Å; I652-L656 WeakPolarHBondContact O-CB 3.44Å; I652-L656 PolarHBondContact O-N 3.16Å
653	I	79.9	Confident	82.3	Confident	29 Å²	29	44.1 Å²	44.1	15%	0.149	23%	0.225	C	C	.	.	H	α-helix	trans	-60.8	-47.6	-179.7	-70	171.3	0	0	0	110.7	L604 Q649 M650 K657 F722	L604-I653 HydrophobicContact CD1-CG2 4.05Å; Q649-I653 HydrophobicContact CG-CD1 3.76Å; Q649-I653 HydrophobicContact CG-CG1 4.49Å; Q649-I653 WeakPolarHBondContact O-CB 3.49Å; Q649-I653 VanDerWaalsContact O-CG1 3.25Å; Q649-I653 WeakPolarHBondContact O-CG1 3.32Å; Q649-I653 PolarHBondContact O-N 2.99Å; M650-I653 PolarHBondContact O-N 2.84Å; I653-K657 WeakPolarHBondContact O-CB 3.3Å; I653-K657 PolarHBondContact O-N 3.19Å; I653-F722 HydrophobicContact CG2-CE1 4.18Å; I653-F722 HydrophobicContact CG2-CE2 4Å; I653-F722 HydrophobicContact CG2-CZ 3.46Å; I653-F722 VanDerWaalsContact CG2-CZ 3.46Å
654	M	80.1	Confident	82.2	Confident	16 Å²	16	47.2 Å²	47.2	8%	0.079	24%	0.241	C	C	.	.	H	α-helix	trans	-71.7	-30.6	-175.7	-168.4	-178.3	60.2	0	0	113.1	M650 I652 Q658 F730 A733 L736	M650-M654 VanDerWaalsContact O-CB 3.25Å; M650-M654 WeakPolarHBondContact O-CB 3.32Å; M650-M654 PolarHBondContact O-N 3.43Å; I652-M654 PolarHBondContact O-N 3.28Å; M654-Q658 WeakPolarHBondContact O-CB 3.1Å; M654-F730 HydrophobicContact CE-CD1 4.38Å; M654-F730 HydrophobicContact CE-CE1 3.8Å; M654-A733 HydrophobicContact CE-CB 4.42Å; M654-A733 HydrophobicContact SD-CB 4.36Å; M654-L736 HydrophobicContact CE-CB 3.62Å; M654-L736 HydrophobicContact CE-CD1 3.59Å; M654-L736 HydrophobicContact CE-CG 4.17Å
655	V	82.4	Confident	82	Confident	75 Å²	75	49 Å²	49	46%	0.455	25%	0.249	S	C	.	.	H	α-helix	trans	-81.8	-45.6	174.5	174.4	0	0	0	0	111.5	G651 I652 T659 L736	G651-V655 WeakPolarHBondContact O-CB 3.41Å; G651-V655 WeakPolarHBondContact O-CG2 3.37Å; G651-V655 PolarHBondContact O-N 3.46Å; I652-V655 PolarHBondContact O-N 2.89Å; V655-T659 WeakPolarHBondContact O-CB 3.4Å; V655-T659 WeakPolarHBondContact O-CG2 3.3Å; V655-T659 PolarHBondContact O-N 2.03Å; V655-T659 PolarHBondContact O-OG1 2.82Å; V655-L736 HydrophobicContact CG2-CD1 4.27Å
656	L	78.4	Confident	82.1	Confident	88 Å²	88	48.6 Å²	48.6	46%	0.461	25%	0.247	S	C	.	.	H	α-helix	trans	-74.2	-46.2	-174.8	-174.2	65.7	0	0	0	112	I652 Q658 T659 W660	I652-L656 WeakPolarHBondContact O-CB 3.44Å; I652-L656 PolarHBondContact O-N 3.16Å; L656-Q658 VanDerWaalsContact C-N 3.28Å; L656-Q658 PolarHBondContact O-N 3.11Å; L656-T659 PolarHBondContact O-OG1 3.33Å; L656-W660 WeakPolarHBondContact O-CB 3.48Å; L656-W660 PolarHBondContact O-N 3.47Å
657	K	76.4	Confident	82	Confident	36 Å²	36	49.1 Å²	49.1	16%	0.157	25%	0.252	C	S	.	.	H	α-helix	trans	-59.2	-44.9	176.4	-174.5	-165.5	168.7	-95	0	109.9	L604 I653 W660 N661 E715	L604-K657 HydrophobicContact CD2-CD 4.39Å; I653-K657 WeakPolarHBondContact O-CB 3.3Å; I653-K657 PolarHBondContact O-N 3.19Å; K657-W660 PolarHBondContact O-N 3.11Å; K657-N661 VanDerWaalsContact CE-ND2 3.33Å; K657-N661 WeakPolarHBondContact CE-ND2 3.44Å; K657-N661 PolarHBondContact NZ-ND2 3.22Å; K657-N661 VanDerWaalsContact O-CB 3.24Å; K657-N661 WeakPolarHBondContact O-CB 3.28Å; K657-N661 PolarHBondContact O-N 3.41Å; K657-N661 PolarHBondContact O-OD1 2.96Å; K657-E715 IonicContact NZ-OE1 3.39Å; K657-E715 PolarHBondContact NZ-OE1 2.99Å; K657-E715 IonicContact NZ-OE2 3.81Å; K657-E715 PolarHBondContact NZ-OE2 3.29Å
658	Q	80.2	Confident	81.8	Confident	17 Å²	17	55.8 Å²	55.8	8%	0.079	28%	0.277	C	S	.	.	H	α-helix	trans	-68.4	-51.8	-176	-156	65.2	59.3	0	0	111.7	M654 L656 W660 N661 N662 E715 N740 E744	M654-Q658 WeakPolarHBondContact O-CB 3.1Å; L656-Q658 VanDerWaalsContact C-N 3.28Å; L656-Q658 PolarHBondContact O-N 3.11Å; Q658-W660 PolarHBondContact O-N 3.26Å; Q658-N661 PolarHBondContact O-N 3.24Å; Q658-N661 VanDerWaalsContact O-N 3.09Å; Q658-N662 PolarHBondContact NE2-OD1 2.74Å; Q658-N662 PolarHBondContact O-N 3.06Å; Q658-N662 PolarHBondContact O-OD1 3.12Å; Q658-E715 PolarHBondContact NE2-OE1 3.23Å; Q658-E715 PolarHBondContact OE1-OE1 3.22Å; Q658-N740 HydrophobicContact CG-CB 4.03Å; Q658-N740 WeakPolarHBondContact CG-ND2 3.22Å; Q658-N740 WeakPolarHBondContact CG-OD1 3.42Å; Q658-N740 PolarHBondContact NE2-ND2 3.5Å; Q658-N740 VanDerWaalsContact NE2-ND2 3.18Å; Q658-E744 PolarHBondContact NE2-OE1 3.46Å
659	T	81.1	Confident	82	Confident	87 Å²	87	51.8 Å²	51.8	53%	0.534	26%	0.258	S	S	.	.	H	α-helix	trans	-60.7	-33.5	177.4	51.4	0	0	0	0	112.7	V655 L656 F663	V655-T659 WeakPolarHBondContact O-CB 3.4Å; V655-T659 WeakPolarHBondContact O-CG2 3.3Å; V655-T659 PolarHBondContact O-N 2.03Å; V655-T659 PolarHBondContact O-OG1 2.82Å; L656-T659 PolarHBondContact O-OG1 3.33Å; T659-F663 WeakPolarHBondContact O-CB 3.48Å; T659-F663 PolarHBondContact O-N 3.43Å; T659-F663 VanDerWaalsContact O-N 3.15Å
660	W	81.8	Confident	82.1	Confident	102 Å²	102	53.2 Å²	53.2	39%	0.386	27%	0.266	S	S	.	.	H	α-helix	trans	-68.1	-43.6	172	-178.2	-100.3	0	0	0	113.5	L656 K657 Q658 F663 M664	L656-W660 WeakPolarHBondContact O-CB 3.48Å; L656-W660 PolarHBondContact O-N 3.47Å; K657-W660 PolarHBondContact O-N 3.11Å; Q658-W660 PolarHBondContact O-N 3.26Å; W660-F663 PolarHBondContact O-N 3.28Å; W660-M664 HydrophobicContact CD2-CG 4.35Å; W660-M664 HydrophobicContact CH2-CE 3.32Å; W660-M664 HydrophobicContact CZ2-CE 3.38Å; W660-M664 HydrophobicContact CZ2-CG 4.17Å; W660-M664 HydrophobicContact CZ2-SD 4.5Å; W660-M664 HydrophobicContact CZ3-CE 3.92Å; W660-M664 WeakPolarHBondContact O-CB 3.34Å; W660-M664 WeakPolarHBondContact O-CG 3.27Å; W660-M664 PolarHBondContact O-N 3.47Å
661	N	82.1	Confident	82.3	Confident	40 Å²	40	57.2 Å²	57.2	21%	0.214	29%	0.287	C	S	.	.	H	α-helix	trans	-64.7	-56.5	179.5	-78.9	2.1	0	0	0	110.8	K657 Q658 F663 M664 E665 E715	K657-N661 VanDerWaalsContact CE-ND2 3.33Å; K657-N661 WeakPolarHBondContact CE-ND2 3.44Å; K657-N661 PolarHBondContact NZ-ND2 3.22Å; K657-N661 VanDerWaalsContact O-CB 3.24Å; K657-N661 WeakPolarHBondContact O-CB 3.28Å; K657-N661 PolarHBondContact O-N 3.41Å; K657-N661 PolarHBondContact O-OD1 2.96Å; Q658-N661 PolarHBondContact O-N 3.24Å; Q658-N661 VanDerWaalsContact O-N 3.09Å; N661-F663 PolarHBondContact O-N 3.18Å; N661-M664 PolarHBondContact O-N 2.98Å; N661-E665 WeakPolarHBondContact O-CB 3.11Å; N661-E665 PolarHBondContact O-N 2.89Å; N661-E715 PolarHBondContact ND2-OE1 3.1Å; N661-E715 PolarHBondContact ND2-OE2 2.88Å
662	N	85.1	Confident	82.3	Confident	18 Å²	18	59.3 Å²	59.3	10%	0.096	29%	0.292	C	S	.	.	H	α-helix	trans	-56.7	-35.2	177.7	-59.3	47.7	0	0	0	111.2	Q658 L666 N740 E744 L747	Q658-N662 PolarHBondContact NE2-OD1 2.74Å; Q658-N662 PolarHBondContact O-N 3.06Å; Q658-N662 PolarHBondContact O-OD1 3.12Å; N662-L666 WeakPolarHBondContact O-CB 3.28Å; N662-L666 PolarHBondContact O-N 2.89Å; N662-N740 PolarHBondContact ND2-OD1 3.37Å; N662-E744 PolarHBondContact ND2-OE2 2.91Å; N662-L747 HydrophobicContact CB-CD1 3.65Å
663	F	85.3	Confident	82.4	Confident	123 Å²	123	55.2 Å²	55.2	54%	0.539	27%	0.271	S	S	.	.	H	α-helix	trans	-67.9	-46.2	173.8	177	-96.5	0	0	0	113.2	T659 W660 N661 G667	T659-F663 WeakPolarHBondContact O-CB 3.48Å; T659-F663 PolarHBondContact O-N 3.43Å; T659-F663 VanDerWaalsContact O-N 3.15Å; W660-F663 PolarHBondContact O-N 3.28Å; N661-F663 PolarHBondContact O-N 3.18Å; F663-G667 VanDerWaalsContact O-CA 3.22Å; F663-G667 WeakPolarHBondContact O-CA 3.45Å; F663-G667 PolarHBondContact O-N 2.92Å
664	M	82.9	Confident	82.6	Confident	72 Å²	72	59 Å²	59	36%	0.355	28%	0.284	S	S	.	.	H	α-helix	trans	-71.3	-40.2	179.8	-77.7	-63.8	164.5	0	0	112.2	W660 N661 Y668	W660-M664 HydrophobicContact CD2-CG 4.35Å; W660-M664 HydrophobicContact CH2-CE 3.32Å; W660-M664 HydrophobicContact CZ2-CE 3.38Å; W660-M664 HydrophobicContact CZ2-CG 4.17Å; W660-M664 HydrophobicContact CZ2-SD 4.5Å; W660-M664 HydrophobicContact CZ3-CE 3.92Å; W660-M664 WeakPolarHBondContact O-CB 3.34Å; W660-M664 WeakPolarHBondContact O-CG 3.27Å; W660-M664 PolarHBondContact O-N 3.47Å; N661-M664 PolarHBondContact O-N 2.98Å; M664-Y668 WeakPolarHBondContact O-CB 3.44Å; M664-Y668 PolarHBondContact O-N 2.99Å
665	E	81.3	Confident	82.8	Confident	41 Å²	41	66.3 Å²	66.3	19%	0.192	31%	0.311	C	S	.	.	H	α-helix	trans	-61.7	-42	179	-173.1	-136.3	153.5	0	0	112.4	N661 P669 L747 K751	N661-E665 WeakPolarHBondContact O-CB 3.11Å; N661-E665 PolarHBondContact O-N 2.89Å; E665-P669 WeakPolarHBondContact O-CD 3.23Å; E665-P669 WeakPolarHBondContact O-CG 3.15Å; E665-L747 VanDerWaalsContact CD-CD2 3.46Å; E665-L747 HydrophobicContact CG-CD2 4.46Å; E665-L747 VanDerWaalsContact OE1-CD2 3.29Å; E665-L747 WeakPolarHBondContact OE1-CD2 3.49Å; E665-L747 WeakPolarHBondContact OE2-CD2 3.5Å; E665-K751 HydrophobicContact CG-CD 4.02Å; E665-K751 VanDerWaalsContact OE1-CD 3.27Å; E665-K751 WeakPolarHBondContact OE1-CD 3.31Å; E665-K751 VanDerWaalsContact OE1-CE 3.29Å; E665-K751 WeakPolarHBondContact OE1-CE 3.42Å; E665-K751 IonicContact OE1-NZ 3.49Å; E665-K751 PolarHBondContact OE1-NZ 2.87Å
666	L	82.6	Confident	82.7	Confident	40 Å²	40	64.7 Å²	64.7	21%	0.209	30%	0.301	C	S	.	.	H	α-helix	trans	-81.3	-45.2	173.4	-174.7	55.2	0	0	0	112.2	N662 P669 L670 L747 Y750	N662-L666 WeakPolarHBondContact O-CB 3.28Å; N662-L666 PolarHBondContact O-N 2.89Å; L666-P669 WeakPolarHBondContact O-CD 3.48Å; L666-L670 HydrophobicContact CD1-CD1 3.79Å; L666-L670 HydrophobicContact CD1-CG 4.29Å; L666-L670 HydrophobicContact CG-CD1 3.77Å; L666-L670 WeakPolarHBondContact O-CB 3.47Å; L666-L670 VanDerWaalsContact O-CG 3.25Å; L666-L670 WeakPolarHBondContact O-CG 3.17Å; L666-L670 PolarHBondContact O-N 3.22Å; L666-L747 HydrophobicContact CB-CD1 4.44Å; L666-L747 HydrophobicContact CB-CD2 3.84Å; L666-L747 HydrophobicContact CB-CG 4.32Å; L666-L747 HydrophobicContact CD1-CD2 4.21Å; L666-L747 HydrophobicContact CD2-CG 4.43Å; L666-L747 HydrophobicContact CG-CD2 4.43Å; L666-Y750 HydrophobicContact CD1-CD1 3.79Å; L666-Y750 HydrophobicContact CD1-CE1 3.91Å
667	G	84	Confident	82.7	Confident	11 Å²	11	66.8 Å²	66.8	11%	0.113	30%	0.303	C	S	.	.	H	α-helix	trans	-71.3	-45.8	-170.4	0	0	0	0	0	113.6	F663 L670 I671	F663-G667 VanDerWaalsContact O-CA 3.22Å; F663-G667 WeakPolarHBondContact O-CA 3.45Å; F663-G667 PolarHBondContact O-N 2.92Å; G667-L670 PolarHBondContact O-N 3.4Å; G667-I671 WeakPolarHBondContact O-CB 3.42Å; G667-I671 WeakPolarHBondContact O-CD1 3.4Å; G667-I671 WeakPolarHBondContact O-CG1 3.36Å; G667-I671 PolarHBondContact O-N 3.37Å
668	Y	84.1	Confident	83	Confident	148 Å²	148	70.5 Å²	70.5	58%	0.58	32%	0.316	S	S	*	.	H	α-helix	trans	-55.6	-55.6	179.9	178.4	-99.1	0	0	0	112.7	M664 L670 I671 Q672	M664-Y668 WeakPolarHBondContact O-CB 3.44Å; M664-Y668 PolarHBondContact O-N 2.99Å; Y668-L670 PolarHBondContact O-N 3.46Å; Y668-I671 PolarHBondContact O-N 2.83Å; Y668-Q672 VanDerWaalsContact O-CB 3.25Å; Y668-Q672 WeakPolarHBondContact O-CB 3.42Å; Y668-Q672 PolarHBondContact O-N 3.09Å
669	P	84.9	Confident	82.9	Confident	7 Å²	7	74.9 Å²	74.9	5%	0.045	34%	0.335	C	S	.	.	H	α-helix	trans	-70.4	-29.7	179.5	30.2	-36.5	0	0	0	112.6	E665 L666 N673 Q702 Q755	E665-P669 WeakPolarHBondContact O-CD 3.23Å; E665-P669 WeakPolarHBondContact O-CG 3.15Å; L666-P669 WeakPolarHBondContact O-CD 3.48Å; P669-N673 WeakPolarHBondContact O-CB 3.33Å; P669-N673 PolarHBondContact O-N 2.89Å; P669-N673 PolarHBondContact O-ND2 3.43Å; P669-Q702 HydrophobicContact CB-CG 4.32Å; P669-Q755 HydrophobicContact CB-CB 4.13Å; P669-Q755 HydrophobicContact CG-CB 4.43Å
670	L	85.4	Confident	82.5	Confident	58 Å²	58	71.7 Å²	71.7	30%	0.304	32%	0.315	S	S	.	.	H	α-helix	trans	-63.3	-51.1	172.7	-81.9	175.7	0	0	0	111.7	L666 G667 Y668 N673 W674 Q755	L666-L670 HydrophobicContact CD1-CD1 3.79Å; L666-L670 HydrophobicContact CD1-CG 4.29Å; L666-L670 HydrophobicContact CG-CD1 3.77Å; L666-L670 WeakPolarHBondContact O-CB 3.47Å; L666-L670 VanDerWaalsContact O-CG 3.25Å; L666-L670 WeakPolarHBondContact O-CG 3.17Å; L666-L670 PolarHBondContact O-N 3.22Å; G667-L670 PolarHBondContact O-N 3.4Å; Y668-L670 PolarHBondContact O-N 3.46Å; L670-N673 PolarHBondContact O-N 3.18Å; L670-W674 WeakPolarHBondContact O-CB 3.35Å; L670-W674 PolarHBondContact O-N 2.79Å; L670-Q755 HydrophobicContact CD2-CG 4.42Å
671	I	87.3	Confident	82.1	Confident	92 Å²	92	74.6 Å²	74.6	47%	0.472	33%	0.326	S	S	.	.	H	α-helix	trans	-62.6	-45.4	179.4	-68.2	165	0	0	0	110.1	G667 Y668 W674 W675	G667-I671 WeakPolarHBondContact O-CB 3.42Å; G667-I671 WeakPolarHBondContact O-CD1 3.4Å; G667-I671 WeakPolarHBondContact O-CG1 3.36Å; G667-I671 PolarHBondContact O-N 3.37Å; Y668-I671 PolarHBondContact O-N 2.83Å; I671-W674 WeakPolarHBondContact O-CB 3.48Å; I671-W674 PolarHBondContact O-N 2.87Å; I671-W675 WeakPolarHBondContact O-CB 3.26Å; I671-W675 PolarHBondContact O-N 2.9Å
672	Q	82.5	Confident	81.6	Confident	60 Å²	60	79.6 Å²	79.6	28%	0.28	35%	0.348	S	S	.	.	H	α-helix	trans	-67.7	-41.4	-179.9	-163.9	-178.4	12.2	0	0	112.2	Y668 W674 W675 T676	Y668-Q672 VanDerWaalsContact O-CB 3.25Å; Y668-Q672 WeakPolarHBondContact O-CB 3.42Å; Y668-Q672 PolarHBondContact O-N 3.09Å; Q672-W674 VanDerWaalsContact C-N 3.34Å; Q672-W675 PolarHBondContact O-N 3.02Å; Q672-T676 WeakPolarHBondContact O-CB 3.3Å; Q672-T676 PolarHBondContact O-N 3.28Å; Q672-T676 PolarHBondContact O-OG1 3.05Å
673	N	83.5	Confident	80.8	Confident	0 Å²	0	83.9 Å²	83.9	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-68.3	-33	174.2	-68.8	-19.1	0	0	0	111.5	P669 L670 R677 Q702 Q755	P669-N673 WeakPolarHBondContact O-CB 3.33Å; P669-N673 PolarHBondContact O-N 2.89Å; P669-N673 PolarHBondContact O-ND2 3.43Å; L670-N673 PolarHBondContact O-N 3.18Å; N673-R677 WeakPolarHBondContact O-CB 3.49Å; N673-R677 VanDerWaalsContact O-CG 3.27Å; N673-R677 WeakPolarHBondContact O-CG 3.49Å; N673-R677 VanDerWaalsContact O-CZ 3.29Å; N673-R677 PolarHBondContact O-N 3.02Å; N673-R677 VanDerWaalsContact O-N 3.11Å; N673-R677 PolarHBondContact O-NE 2.88Å; N673-R677 VanDerWaalsContact O-NE 3.1Å; N673-Q702 PolarHBondContact OD1-NE2 3.43Å; N673-Q702 VanDerWaalsContact OD1-NE2 3.1Å; N673-Q755 PolarHBondContact ND2-O 3.15Å; N673-Q755 PolarHBondContact ND2-OE1 2.96Å
674	W	84	Confident	79.5	Confident	107 Å²	107	81.8 Å²	81.8	41%	0.405	36%	0.359	S	S	.	.	H	α-helix	trans	-66.2	-45.4	171.6	175.8	99.8	0	0	0	111.6	L670 I671 Q672 R677 R678	L670-W674 WeakPolarHBondContact O-CB 3.35Å; L670-W674 PolarHBondContact O-N 2.79Å; I671-W674 WeakPolarHBondContact O-CB 3.48Å; I671-W674 PolarHBondContact O-N 2.87Å; Q672-W674 VanDerWaalsContact C-N 3.34Å; W674-R677 CarbonylContact O-C 3.58Å; W674-R677 WeakPolarHBondContact O-CB 3.38Å; W674-R677 PolarHBondContact O-N 3Å; W674-R678 WeakPolarHBondContact O-CB 3.24Å; W674-R678 PolarHBondContact O-N 3Å
675	W	84.3	Confident	78.2	Confident	171 Å²	171	80.2 Å²	80.2	65%	0.648	36%	0.361	S	S	*	.	H	α-helix	trans	-62.6	-45.9	178.3	-166.6	-70.2	0	0	0	111.4	I671 Q672 R677 R678 K679	I671-W675 WeakPolarHBondContact O-CB 3.26Å; I671-W675 PolarHBondContact O-N 2.9Å; Q672-W675 PolarHBondContact O-N 3.02Å; W675-R677 VanDerWaalsContact C-N 3.33Å; W675-R677 PolarHBondContact O-N 3.38Å; W675-R678 PolarHBondContact O-N 2.57Å; W675-R678 VanDerWaalsContact O-N 3.16Å; W675-K679 PolarHBondContact O-N 2.95Å
676	T	79.3	Confident	76.8	Confident	41 Å²	41	83.6 Å²	83.6	25%	0.252	39%	0.385	S	S	.	.	H	α-helix	trans	-57.3	-44.8	173.3	-61.5	0	0	0	0	111.3	Q672 V680 N700	Q672-T676 WeakPolarHBondContact O-CB 3.3Å; Q672-T676 PolarHBondContact O-N 3.28Å; Q672-T676 PolarHBondContact O-OG1 3.05Å; T676-V680 WeakPolarHBondContact O-CG2 3.36Å; T676-V680 PolarHBondContact O-N 2.89Å; T676-N700 HydrophobicContact CG2-CB 4.1Å
677	R	78.9	Confident	74.9	Confident	132 Å²	132	90.8 Å²	90.8	50%	0.498	42%	0.417	S	S	.	.	H	α-helix	trans	-64.2	-38.7	175.1	-75.3	179.7	-72.6	-109.3	4	112.9	N673 W674 W675 R681	N673-R677 WeakPolarHBondContact O-CB 3.49Å; N673-R677 VanDerWaalsContact O-CG 3.27Å; N673-R677 WeakPolarHBondContact O-CG 3.49Å; N673-R677 VanDerWaalsContact O-CZ 3.29Å; N673-R677 PolarHBondContact O-N 3.02Å; N673-R677 VanDerWaalsContact O-N 3.11Å; N673-R677 PolarHBondContact O-NE 2.88Å; N673-R677 VanDerWaalsContact O-NE 3.1Å; W674-R677 CarbonylContact O-C 3.58Å; W674-R677 WeakPolarHBondContact O-CB 3.38Å; W674-R677 PolarHBondContact O-N 3Å; W675-R677 VanDerWaalsContact C-N 3.33Å; W675-R677 PolarHBondContact O-N 3.38Å; R677-R681 WeakPolarHBondContact O-CB 3.4Å; R677-R681 PolarHBondContact O-N 3.25Å; R677-R681 VanDerWaalsContact O-N 3.11Å
678	R	82	Confident	73.2	Confident	113 Å²	113	99.6 Å²	99.6	43%	0.426	45%	0.447	S	S	.	.	H	α-helix	trans	-66.7	-45.1	177.5	-172.9	171	176.7	137.5	-6.2	111.3	W674 W675 R681 Q682	W674-R678 WeakPolarHBondContact O-CB 3.24Å; W674-R678 PolarHBondContact O-N 3Å; W675-R678 PolarHBondContact O-N 2.57Å; W675-R678 VanDerWaalsContact O-N 3.16Å; R678-R681 PolarHBondContact O-N 3.24Å; R678-Q682 WeakPolarHBondContact O-CG 3.37Å; R678-Q682 PolarHBondContact O-N 3.22Å
679	K	79.5	Confident	71.5	Confident	110 Å²	110	102.4 Å²	102.4	48%	0.478	46%	0.462	S	S	.	.	H	α-helix	trans	-60.5	-50.4	176	179.9	169.3	176	170.7	0	112.2	W675 R681 Q682 E683	W675-K679 PolarHBondContact O-N 2.95Å; K679-R681 PolarHBondContact O-N 3.18Å; K679-Q682 PolarHBondContact O-N 3.27Å; K679-Q682 VanDerWaalsContact O-N 3.08Å; K679-E683 WeakPolarHBondContact CE-OE1 3.44Å; K679-E683 IonicContact NZ-OE1 2.89Å; K679-E683 WeakPolarHBondContact O-CG 3.43Å; K679-E683 PolarHBondContact O-N 3.44Å
680	V	71.9	Confident	70.1	Confident	20 Å²	20	104.8 Å²	104.8	12%	0.121	47%	0.474	C	S	.	.	H	α-helix	trans	-57.9	-37.6	176.5	171.2	0	0	0	0	111.5	I156 T676 H684 F692	I156-V680 HydrophobicContact CD1-CG1 3.95Å; I156-V680 HydrophobicContact CD1-CG2 4.23Å; I156-V680 HydrophobicContact CG1-CG1 4.31Å; I156-V680 HydrophobicContact CG2-CG1 4.29Å; I156-V680 HydrophobicContact CG2-CG2 4.24Å; T676-V680 WeakPolarHBondContact O-CG2 3.36Å; T676-V680 PolarHBondContact O-N 2.89Å; V680-H684 WeakPolarHBondContact O-CB 3.22Å; V680-H684 PolarHBondContact O-N 2.92Å; V680-F692 HydrophobicContact CG1-CZ 4.06Å
681	R	72.9	Confident	69.2	Low	163 Å²	163	109.2 Å²	109.2	62%	0.615	50%	0.498	S	S	*	.	H	α-helix	trans	-70.7	-35.1	176.3	-172.7	176.9	177.6	-172.7	-2.2	113.3	R677 R678 K679 G685	R677-R681 WeakPolarHBondContact O-CB 3.4Å; R677-R681 PolarHBondContact O-N 3.25Å; R677-R681 VanDerWaalsContact O-N 3.11Å; R678-R681 PolarHBondContact O-N 3.24Å; K679-R681 PolarHBondContact O-N 3.18Å; R681-G685 PolarHBondContact O-N 3.01Å
682	Q	72.8	Confident	68.5	Low	145 Å²	145	107.4 Å²	107.4	68%	0.678	49%	0.487	S	S	*	.	H	α-helix	trans	-66.7	-42.1	173.3	-75.6	171.9	-52.9	0	0	111.5	R678 K679 H684	R678-Q682 WeakPolarHBondContact O-CG 3.37Å; R678-Q682 PolarHBondContact O-N 3.22Å; K679-Q682 PolarHBondContact O-N 3.27Å; K679-Q682 VanDerWaalsContact O-N 3.08Å; Q682-H684 VanDerWaalsContact C-N 3.34Å; Q682-H684 PolarHBondContact O-N 3.39Å
683	E	66.7	Low	68.6	Low	108 Å²	108	105.6 Å²	105.6	51%	0.505	48%	0.481	S	S	.	.	H	α-helix	trans	-69.2	-26.6	-179.6	-70.3	171.9	174.2	0	0	113.7	K679	K679-E683 WeakPolarHBondContact CE-OE1 3.44Å; K679-E683 IonicContact NZ-OE1 2.89Å; K679-E683 WeakPolarHBondContact O-CG 3.43Å; K679-E683 PolarHBondContact O-N 3.44Å
684	H	59.8	Low	68.8	Low	79 Å²	79	106 Å²	106	37%	0.366	48%	0.483	S	S	.	.	H	α-helix	trans	-116.5	-6.6	-172	-75.4	67	0	0	0	115.9	I156 V680 Q682	I156-H684 PolarHBondContact O-CE1 3.48Å; I156-H684 VanDerWaalsContact O-CE1 3.23Å; V680-H684 WeakPolarHBondContact O-CB 3.22Å; V680-H684 PolarHBondContact O-N 2.92Å; Q682-H684 VanDerWaalsContact C-N 3.34Å; Q682-H684 PolarHBondContact O-N 3.39Å
685	G	54.2	Low	68.9	Low	39 Å²	39	102 Å²	102	40%	0.402	47%	0.467	S	S	.	.			trans	74.5	169	177.4	0	0	0	0	0	115.3	R681	R681-G685 PolarHBondContact O-N 3.01Å
686	T	51.9	Low	69.1	Low	111 Å²	111	93.9 Å²	93.9	68%	0.681	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-21.7	-171.6	-57.9	0	0	0	0	114.1	R688	T686-R688 VanDerWaalsContact C-N 3.32Å; T686-R688 PolarHBondContact O-N 2.95Å
687	E	43.9	Very low	69.4	Low	191 Å²	191	96.5 Å²	96.5	89%	0.893	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-29.1	-171.1	-73	-82.2	101.4	0	0	114.7
688	R	46.6	Very low	69.9	Low	196 Å²	196	90.3 Å²	90.3	74%	0.74	42%	0.421	S	S	*	.			trans	-110.6	97.8	-167.5	-77.9	-170.6	177.3	178	0.5	113.4	T686 I690	T686-R688 VanDerWaalsContact C-N 3.32Å; T686-R688 PolarHBondContact O-N 2.95Å; R688-I690 HydrophobicContact CB-CD1 3.98Å; R688-I690 HydrophobicContact CB-CG1 4.07Å; R688-I690 PolarHBondContact O-N 3.22Å
689	K	48.8	Very low	70.2	Confident	208 Å²	208	86.5 Å²	86.5	90%	0.904	41%	0.407	S	S	*	.			trans	-69.3	61.1	158	-71.2	-179	178.8	171.8	0	111.3	N691	K689-N691 PolarHBondContact O-N 2.99Å
690	I	56	Low	70.5	Confident	57 Å²	57	83.2 Å²	83.2	29%	0.292	40%	0.395	S	S	.	.			trans	-63.3	119.2	169.7	-74.1	156.3	0	0	0	108	L155 R688 F692	L155-I690 HydrophobicContact CD1-CG2 3.98Å; R688-I690 HydrophobicContact CB-CD1 3.98Å; R688-I690 HydrophobicContact CB-CG1 4.07Å; R688-I690 PolarHBondContact O-N 3.22Å; I690-F692 VanDerWaalsContact C-N 3.25Å; I690-F692 HydrophobicContact CG2-CD1 3.89Å; I690-F692 HydrophobicContact CG2-CE1 4Å; I690-F692 HydrophobicContact CG2-CG 4.3Å; I690-F692 PolarHBondContact O-N 3.45Å
691	N	65.9	Low	71.3	Confident	151 Å²	151	83 Å²	83	81%	0.807	39%	0.393	S	S	*	.			trans	-72	85.4	166.8	-85.4	-33.4	0	0	0	108.6	K689	K689-N691 PolarHBondContact O-N 2.99Å
692	F	73.9	Confident	71.9	Confident	54 Å²	54	76.8 Å²	76.8	24%	0.237	37%	0.371	C	S	.	.			trans	-51.3	135.5	175.6	-64.7	-70.1	0	0	0	110.6	I156 V680 I690 E696 K697	I156-F692 HydrophobicContact CD1-CD1 4.29Å; I156-F692 HydrophobicContact CD1-CE1 3.87Å; I156-F692 HydrophobicContact CD1-CZ 4.38Å; I156-F692 HydrophobicContact CG1-CD1 4.3Å; I156-F692 HydrophobicContact CG1-CE1 3.63Å; I156-F692 HydrophobicContact CG1-CZ 4.33Å; V680-F692 HydrophobicContact CG1-CZ 4.06Å; I690-F692 VanDerWaalsContact C-N 3.25Å; I690-F692 HydrophobicContact CG2-CD1 3.89Å; I690-F692 HydrophobicContact CG2-CE1 4Å; I690-F692 HydrophobicContact CG2-CG 4.3Å; I690-F692 PolarHBondContact O-N 3.45Å; F692-E696 HydrophobicContact CB-CB 4.42Å; F692-K697 HydrophobicContact CB-CG 4.11Å; F692-K697 WeakPolarHBondContact O-CD 3.33Å; F692-K697 WeakPolarHBondContact O-CE 3.22Å; F692-K697 PolarHBondContact O-NZ 3.45Å
693	P	83.7	Confident	72.5	Confident	22 Å²	22	73 Å²	73	14%	0.143	36%	0.359	C	S	.	.			trans	-65.2	163.3	176	29.9	-36.7	0	0	0	111.3	W695 E696 K697	P693-W695 HydrophobicContact CB-CD2 3.75Å; P693-W695 VanDerWaalsContact CB-CE2 3.43Å; P693-W695 HydrophobicContact CB-CE3 3.97Å; P693-W695 HydrophobicContact CB-CG 4.47Å; P693-W695 HydrophobicContact CB-CH2 3.56Å; P693-W695 HydrophobicContact CB-CZ2 3.32Å; P693-W695 HydrophobicContact CB-CZ3 3.9Å; P693-W695 HydrophobicContact CG-CD2 3.99Å; P693-W695 HydrophobicContact CG-CG 4.38Å; P693-W695 HydrophobicContact CG-CH2 4.24Å; P693-W695 HydrophobicContact CG-CZ2 3.47Å; P693-W695 VanDerWaalsContact CG-CZ2 3.47Å; P693-W695 PolarHBondContact O-N 2.96Å; P693-E696 VanDerWaalsContact CD-OE2 3.3Å; P693-E696 WeakPolarHBondContact CD-OE2 3.21Å; P693-E696 HydrophobicContact CG-CB 4.24Å; P693-E696 HydrophobicContact CG-CG 3.95Å; P693-E696 PolarHBondContact O-N 2.95Å; P693-K697 PolarHBondContact O-N 2.97Å; P693-K697 VanDerWaalsContact O-N 3.17Å
694	Q	86.8	Confident	73.4	Confident	9 Å²	9	70.2 Å²	70.2	4%	0.042	35%	0.347	C	S	.	.	H	α-helix	trans	-60.9	-33.3	-173	-171.3	57.1	32.9	0	0	113	L110 H298 K697 D698	L110-Q694 HydrophobicContact CD2-CB 4.14Å; L110-Q694 HydrophobicContact CD2-CG 3.92Å; H298-Q694 WeakPolarHBondContact O-CG 3.45Å; Q694-K697 PolarHBondContact O-N 3.45Å; Q694-D698 PolarHBondContact NE2-OD1 3.43Å; Q694-D698 PolarHBondContact NE2-OD2 2.94Å; Q694-D698 VanDerWaalsContact NE2-OD2 3.11Å; Q694-D698 WeakPolarHBondContact O-CB 3.47Å; Q694-D698 PolarHBondContact O-N 3.48Å
695	W	87.3	Confident	74.3	Confident	21 Å²	21	70.2 Å²	70.2	8%	0.08	35%	0.349	C	S	.	.	H	α-helix	trans	-68.8	-33.8	178.6	56.4	85.4	0	0	0	114.5	G109 I119 I122 E152 F162 K164 L297 P693 Y699	G109-W695 VanDerWaalsContact O-CE3 3.27Å; G109-W695 WeakPolarHBondContact O-CZ3 3.47Å; I119-W695 HydrophobicContact CD1-CE3 3.6Å; I119-W695 HydrophobicContact CD1-CZ3 3.66Å; I122-W695 HydrophobicContact CD1-CB 3.21Å; I122-W695 HydrophobicContact CD1-CG 4.13Å; E152-W695 WeakPolarHBondContact OE2-CZ2 3.25Å; F162-W695 AromaticContact CD2-CD1 3.69Å; F162-W695 AromaticContact CG-CD1 3.66Å; K164-W695 VanDerWaalsContact CE-CH2 3.49Å; L297-W695 HydrophobicContact CD2-CB 3.97Å; P693-W695 HydrophobicContact CB-CD2 3.75Å; P693-W695 VanDerWaalsContact CB-CE2 3.43Å; P693-W695 HydrophobicContact CB-CE3 3.97Å; P693-W695 HydrophobicContact CB-CG 4.47Å; P693-W695 HydrophobicContact CB-CH2 3.56Å; P693-W695 HydrophobicContact CB-CZ2 3.32Å; P693-W695 HydrophobicContact CB-CZ3 3.9Å; P693-W695 HydrophobicContact CG-CD2 3.99Å; P693-W695 HydrophobicContact CG-CG 4.38Å; P693-W695 HydrophobicContact CG-CH2 4.24Å; P693-W695 HydrophobicContact CG-CZ2 3.47Å; P693-W695 VanDerWaalsContact CG-CZ2 3.47Å; P693-W695 PolarHBondContact O-N 2.96Å; W695-Y699 VanDerWaalsContact O-CB 3.27Å; W695-Y699 WeakPolarHBondContact O-CB 3.48Å; W695-Y699 PolarHBondContact O-N 3Å
696	E	87.4	Confident	75	Confident	2 Å²	2	72.7 Å²	72.7	1%	0.009	37%	0.366	C	S	.	.	H	α-helix	trans	-75.6	-36.3	174	-69.3	-169	139.7	0	0	111.8	S154 L155 F162 F692 P693 Y699 N700	S154-E696 WeakPolarHBondContact CA-OE1 3.36Å; S154-E696 VanDerWaalsContact CB-OE1 3.26Å; S154-E696 WeakPolarHBondContact CB-OE1 3.47Å; S154-E696 PolarHBondContact OG-OE1 2.63Å; L155-E696 PolarHBondContact N-OE1 3.21Å; F162-E696 HydrophobicContact CD2-CG 4.38Å; F162-E696 HydrophobicContact CE2-CG 3.57Å; F162-E696 HydrophobicContact CZ-CG 3.86Å; F692-E696 HydrophobicContact CB-CB 4.42Å; P693-E696 VanDerWaalsContact CD-OE2 3.3Å; P693-E696 WeakPolarHBondContact CD-OE2 3.21Å; P693-E696 HydrophobicContact CG-CB 4.24Å; P693-E696 HydrophobicContact CG-CG 3.95Å; P693-E696 PolarHBondContact O-N 2.95Å; E696-Y699 PolarHBondContact O-N 3.07Å; E696-N700 VanDerWaalsContact O-CG 3.31Å; E696-N700 PolarHBondContact O-N 3.27Å; E696-N700 VanDerWaalsContact O-N 3.1Å; E696-N700 PolarHBondContact O-ND2 3.09Å
697	K	85.5	Confident	76	Confident	96 Å²	96	69.5 Å²	69.5	42%	0.417	34%	0.341	S	S	.	.	H	α-helix	trans	-60	-48.4	172.3	-73.1	167.1	171.5	148.6	0	111.2	F692 P693 Q694 N700	F692-K697 HydrophobicContact CB-CG 4.11Å; F692-K697 WeakPolarHBondContact O-CD 3.33Å; F692-K697 WeakPolarHBondContact O-CE 3.22Å; F692-K697 PolarHBondContact O-NZ 3.45Å; P693-K697 PolarHBondContact O-N 2.97Å; P693-K697 VanDerWaalsContact O-N 3.17Å; Q694-K697 PolarHBondContact O-N 3.45Å; K697-N700 PolarHBondContact O-N 3.34Å
698	D	89.4	Confident	77.8	Confident	2 Å²	2	61 Å²	61	1%	0.011	31%	0.305	C	S	.	.	H	α-helix	trans	-71.8	-34	179.5	-68	-15.3	0	0	0	111.6	F295 L297 H298 R317 Q694 N700 L701 R757	F295-D698 HydrophobicContact CE2-CB 4Å; L297-D698 HydrophobicContact CD2-CB 4.38Å; H298-D698 WeakPolarHBondContact CB-OD2 3.48Å; H298-D698 IonicContact CD2-OD1 2.96Å; H298-D698 PolarHBondContact CD2-OD1 3.05Å; H298-D698 IonicContact CD2-OD2 3.51Å; H298-D698 IonicContact CG-OD2 2.78Å; H298-D698 PolarHBondContact N-OD2 2.71Å; R317-D698 IonicContact NH1-OD1 3.11Å; Q694-D698 PolarHBondContact NE2-OD1 3.43Å; Q694-D698 PolarHBondContact NE2-OD2 2.94Å; Q694-D698 VanDerWaalsContact NE2-OD2 3.11Å; Q694-D698 WeakPolarHBondContact O-CB 3.47Å; Q694-D698 PolarHBondContact O-N 3.48Å; D698-N700 VanDerWaalsContact C-N 3.26Å; D698-N700 PolarHBondContact O-N 3.49Å; D698-L701 WeakPolarHBondContact O-CB 3.27Å; D698-L701 PolarHBondContact O-N 2.71Å; D698-L701 VanDerWaalsContact O-N 3.13Å; D698-R757 VanDerWaalsContact O-CG 3.24Å; D698-R757 WeakPolarHBondContact O-CG 3.43Å; D698-R757 PolarHBondContact O-NE 2.8Å
699	Y	88.7	Confident	79.7	Confident	32 Å²	32	52 Å²	52	13%	0.125	27%	0.271	C	S	.	.	H	α-helix	trans	-58.6	-37.8	171.6	-173.5	-112.8	0	0	0	112.6	V124 I160 F162 E292 A293 F295 W695 E696 L701 R757	V124-Y699 HydrophobicContact CB-CD2 4.47Å; V124-Y699 HydrophobicContact CB-CE2 4.07Å; V124-Y699 HydrophobicContact CG1-CD2 4.25Å; V124-Y699 HydrophobicContact CG1-CE2 3.73Å; V124-Y699 HydrophobicContact CG2-CD2 3.89Å; V124-Y699 HydrophobicContact CG2-CE2 3.98Å; I160-Y699 HydrophobicContact CD1-CE1 4.19Å; F162-Y699 HydrophobicContact CE1-CD1 4.42Å; F162-Y699 HydrophobicContact CE1-CD2 4.15Å; F162-Y699 AromaticContact CE1-CG 3.9Å; F162-Y699 HydrophobicContact CE1-CG 3.9Å; F162-Y699 HydrophobicContact CZ-CD1 4.15Å; F162-Y699 HydrophobicContact CZ-CG 4.05Å; E292-Y699 PolarHBondContact OE1-OH 3.49Å; A293-Y699 HydrophobicContact CB-CD2 4.42Å; A293-Y699 HydrophobicContact CB-CE2 3.95Å; F295-Y699 AromaticContact CE1-CD2 3.95Å; F295-Y699 HydrophobicContact CE1-CD2 3.95Å; F295-Y699 HydrophobicContact CZ-CD2 4.14Å; W695-Y699 VanDerWaalsContact O-CB 3.27Å; W695-Y699 WeakPolarHBondContact O-CB 3.48Å; W695-Y699 PolarHBondContact O-N 3Å; E696-Y699 PolarHBondContact O-N 3.07Å; Y699-L701 PolarHBondContact O-N 3.02Å; Y699-R757 PolarHBondContact O-NE 3.35Å; Y699-R757 PolarHBondContact O-NH2 2.85Å
700	N	86.7	Confident	81.7	Confident	41 Å²	41	42.4 Å²	42.4	22%	0.219	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	3.9	179.7	-67.4	-25.5	0	0	0	114.3	T676 E696 K697 D698	T676-N700 HydrophobicContact CG2-CB 4.1Å; E696-N700 VanDerWaalsContact O-CG 3.31Å; E696-N700 PolarHBondContact O-N 3.27Å; E696-N700 VanDerWaalsContact O-N 3.1Å; E696-N700 PolarHBondContact O-ND2 3.09Å; K697-N700 PolarHBondContact O-N 3.34Å; D698-N700 VanDerWaalsContact C-N 3.26Å; D698-N700 PolarHBondContact O-N 3.49Å
701	L	87.9	Confident	83.2	Confident	16 Å²	16	42.2 Å²	42.2	8%	0.084	23%	0.229	C	C	.	.	S	Bend	trans	-91.1	159.4	167.1	-62.1	177.2	0	0	0	111	D698 Y699 W756 R757	D698-L701 WeakPolarHBondContact O-CB 3.27Å; D698-L701 PolarHBondContact O-N 2.71Å; D698-L701 VanDerWaalsContact O-N 3.13Å; Y699-L701 PolarHBondContact O-N 3.02Å; L701-W756 WeakPolarHBondContact CD1-O 3.5Å; L701-R757 HydrophobicContact CB-CG 3.99Å; L701-R757 PolarHBondContact O-NE 3.26Å; L701-R757 PolarHBondContact O-NH2 2.92Å
702	Q	85.6	Confident	84.3	Confident	32 Å²	32	35.9 Å²	35.9	15%	0.15	20%	0.195	C	C	.	.	B	Isolated β-bridge	trans	-70.8	140.8	176.2	-63.1	-42.9	-52	0	0	112.2	P669 N673 Q755 W756 R757	P669-Q702 HydrophobicContact CB-CG 4.32Å; N673-Q702 PolarHBondContact OD1-NE2 3.43Å; N673-Q702 VanDerWaalsContact OD1-NE2 3.1Å; Q702-Q755 PolarHBondContact N-O 3.43Å; Q702-W756 CarbonylContact O-C 3.59Å; Q702-W756 WeakPolarHBondContact O-CA 3.42Å; Q702-R757 WeakPolarHBondContact O-CG 3.15Å; Q702-R757 PolarHBondContact O-N 3.5Å
703	P	86.8	Confident	85.2	Confident	67 Å²	67	34 Å²	34	44%	0.435	19%	0.186	S	C	.	.	P	Polyproline II helix	trans	-64.8	151.8	164.3	31.4	-34.3	0	0	0	110.3
704	M	84.6	Confident	85.6	Confident	49 Å²	49	33.6 Å²	33.6	24%	0.241	18%	0.183	C	C	.	.	P	Polyproline II helix	trans	-64.4	151.1	165.7	-174.5	164.9	85.2	0	0	109.9	F752 W756 P759	M704-F752 HydrophobicContact SD-CE1 3.85Å; M704-F752 HydrophobicContact SD-CZ 4.42Å; M704-W756 HydrophobicContact CB-CE3 4.08Å; M704-W756 HydrophobicContact CB-CZ3 4.24Å; M704-W756 HydrophobicContact CG-CE3 3.83Å; M704-W756 HydrophobicContact CG-CH2 3.99Å; M704-W756 HydrophobicContact CG-CZ3 3.49Å; M704-W756 VanDerWaalsContact CG-CZ3 3.49Å; M704-W756 HydrophobicContact SD-CE3 4.06Å; M704-W756 HydrophobicContact SD-CZ3 3.71Å; M704-P759 HydrophobicContact CE-CB 3.55Å; M704-P759 HydrophobicContact SD-CB 3.73Å; M704-P759 HydrophobicContact SD-CG 4.22Å
705	N	78.1	Confident	85.7	Confident	78 Å²	78	34.4 Å²	34.4	42%	0.417	19%	0.187	S	C	.	.	P	Polyproline II helix	trans	-52.5	147.5	179.3	-72.4	-1.4	0	0	0	112	Y707 G708 D711	N705-Y707 PolarHBondContact O-N 2.83Å; N705-G708 PolarHBondContact O-N 2.64Å; N705-D711 PolarHBondContact ND2-OD2 3.39Å
706	A	69	Low	85.9	Confident	91 Å²	91	33.4 Å²	33.4	75%	0.752	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-18.3	-177.9	0	0	0	0	0	113.8
707	Y	74.4	Confident	86.2	Confident	44 Å²	44	33.3 Å²	33.3	17%	0.173	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	9.7	178.9	-35.8	-43.4	0	0	0	111.9	E570 L574 W588 F592 N705 L709 F710	E570-Y707 HydrophobicContact CG-CE2 4.2Å; E570-Y707 WeakPolarHBondContact OE1-CE2 3.45Å; E570-Y707 PolarHBondContact OE1-OH 3.03Å; L574-Y707 HydrophobicContact CD1-CE1 4.41Å; L574-Y707 WeakPolarHBondContact CD1-OH 3.49Å; L574-Y707 HydrophobicContact CD2-CD1 4.23Å; L574-Y707 HydrophobicContact CD2-CE1 3.47Å; L574-Y707 VanDerWaalsContact CD2-CE1 3.47Å; W588-Y707 AromaticContact CH2-CD1 3.93Å; W588-Y707 HydrophobicContact CH2-CD1 3.93Å; W588-Y707 HydrophobicContact CH2-CE1 4.37Å; W588-Y707 HydrophobicContact CZ3-CD1 4.46Å; F592-Y707 HydrophobicContact CE1-CD1 4.25Å; F592-Y707 AromaticContact CE1-CD2 3.95Å; F592-Y707 HydrophobicContact CE1-CD2 3.95Å; F592-Y707 AromaticContact CE1-CG 3.76Å; F592-Y707 HydrophobicContact CE1-CG 3.76Å; F592-Y707 HydrophobicContact CZ-CD1 4.31Å; F592-Y707 AromaticContact CZ-CD2 3.92Å; F592-Y707 HydrophobicContact CZ-CD2 3.92Å; F592-Y707 HydrophobicContact CZ-CE2 4.14Å; F592-Y707 HydrophobicContact CZ-CG 4.03Å; N705-Y707 PolarHBondContact O-N 2.83Å; Y707-L709 PolarHBondContact O-N 3.49Å; Y707-L709 VanDerWaalsContact O-N 3.12Å; Y707-F710 WeakPolarHBondContact O-CB 3.34Å; Y707-F710 PolarHBondContact O-N 3.24Å
708	G	80.5	Confident	86.4	Confident	12 Å²	12	29 Å²	29	12%	0.124	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.6	-105.6	174.4	0	0	0	0	0	113.8	N705	N705-G708 PolarHBondContact O-N 2.64Å
709	L	87.8	Confident	86.5	Confident	7 Å²	7	29.2 Å²	29.2	4%	0.037	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99	6.9	-177.7	-61.3	177.5	0	0	0	113.1	K346 I347 Y707 D711 E712 Y713 F752	K346-L709 HydrophobicContact CG-CD1 4.05Å; I347-L709 HydrophobicContact CG1-CD1 3.99Å; I347-L709 HydrophobicContact CG1-CD2 4.26Å; I347-L709 HydrophobicContact CG1-CG 4.47Å; Y707-L709 PolarHBondContact O-N 3.49Å; Y707-L709 VanDerWaalsContact O-N 3.12Å; L709-D711 PolarHBondContact O-N 3.21Å; L709-E712 HydrophobicContact CD2-CG 4.24Å; L709-E712 PolarHBondContact O-N 3.28Å; L709-Y713 HydrophobicContact CB-CD2 3.94Å; L709-Y713 HydrophobicContact CB-CE2 4.03Å; L709-Y713 HydrophobicContact CD1-CE2 4.22Å; L709-Y713 WeakPolarHBondContact O-CD2 3.47Å; L709-Y713 PolarHBondContact O-N 3.48Å; L709-Y713 VanDerWaalsContact O-N 3.14Å; L709-F752 HydrophobicContact CD2-CE1 4.22Å; L709-F752 HydrophobicContact CD2-CE2 4.49Å; L709-F752 HydrophobicContact CD2-CZ 3.53Å
710	F	88.9	Confident	86.7	Confident	8 Å²	8	27.7 Å²	27.7	4%	0.035	16%	0.159	C	C	.	.	H	α-helix	trans	-55.5	-48.9	-175.2	168.8	-98.8	0	0	0	112.2	F592 T593 M596 Y707 E712 Y713 L714 W770	F592-F710 HydrophobicContact CD1-CD2 4.36Å; F592-F710 HydrophobicContact CD1-CG 4.4Å; F592-F710 AromaticContact CE1-CD1 3.92Å; F592-F710 HydrophobicContact CE1-CD1 3.92Å; F592-F710 HydrophobicContact CE1-CD2 4.3Å; F592-F710 HydrophobicContact CE1-CE1 4.25Å; F592-F710 AromaticContact CE1-CG 3.98Å; F592-F710 HydrophobicContact CE1-CG 3.98Å; T593-F710 HydrophobicContact CG2-CD2 4.23Å; T593-F710 HydrophobicContact CG2-CE2 4.08Å; M596-F710 HydrophobicContact CB-CE1 4.02Å; M596-F710 HydrophobicContact CB-CE2 3.89Å; M596-F710 HydrophobicContact CB-CZ 3.29Å; M596-F710 HydrophobicContact CE-CE1 4.2Å; M596-F710 HydrophobicContact CG-CE1 4.3Å; M596-F710 HydrophobicContact CG-CZ 4Å; Y707-F710 WeakPolarHBondContact O-CB 3.34Å; Y707-F710 PolarHBondContact O-N 3.24Å; F710-E712 PolarHBondContact O-N 3.36Å; F710-Y713 PolarHBondContact O-N 3.04Å; F710-L714 HydrophobicContact CE1-CB 4.37Å; F710-L714 HydrophobicContact CE1-CD2 3.86Å; F710-L714 HydrophobicContact CE2-CB 4.49Å; F710-L714 HydrophobicContact CZ-CB 4.1Å; F710-L714 HydrophobicContact CZ-CD1 4.18Å; F710-L714 HydrophobicContact CZ-CD2 3.8Å; F710-L714 HydrophobicContact CZ-CG 4.23Å; F710-L714 WeakPolarHBondContact O-CB 3.48Å; F710-L714 PolarHBondContact O-N 3.39Å; F710-W770 HydrophobicContact CD2-CH2 4.02Å; F710-W770 AromaticContact CD2-CZ2 3.57Å; F710-W770 HydrophobicContact CD2-CZ2 3.57Å; F710-W770 AromaticContact CE2-CH2 3.55Å; F710-W770 HydrophobicContact CE2-CH2 3.55Å; F710-W770 AromaticContact CE2-CZ2 3.62Å; F710-W770 HydrophobicContact CE2-CZ2 3.62Å; F710-W770 HydrophobicContact CZ-CH2 4.33Å; F710-W770 WeakPolarHBondContact O-CZ2 3.13Å
711	D	87.6	Confident	87	Confident	52 Å²	52	25.8 Å²	25.8	28%	0.278	15%	0.15	S	C	.	.	H	α-helix	trans	-65.3	-41	-176.1	-53.2	-61.4	0	0	0	111.4	N705 L709 Y713 L714 E715	N705-D711 PolarHBondContact ND2-OD2 3.39Å; L709-D711 PolarHBondContact O-N 3.21Å; D711-Y713 PolarHBondContact O-N 2.96Å; D711-L714 WeakPolarHBondContact O-CB 2.97Å; D711-L714 PolarHBondContact O-N 3.17Å; D711-E715 WeakPolarHBondContact O-CB 3.43Å; D711-E715 PolarHBondContact O-N 2.8Å
712	E	90.4	Very high	87	Confident	19 Å²	19	25.5 Å²	25.5	9%	0.089	15%	0.147	C	C	.	.	H	α-helix	trans	-62.4	-43.7	179.7	-39.9	-60.6	177	0	0	112.3	Y350 L709 F710 K751 W756	Y350-E712 HydrophobicContact CD2-CB 4.46Å; Y350-E712 HydrophobicContact CE1-CB 4.37Å; Y350-E712 HydrophobicContact CE2-CB 3.73Å; L709-E712 HydrophobicContact CD2-CG 4.24Å; L709-E712 PolarHBondContact O-N 3.28Å; F710-E712 PolarHBondContact O-N 3.36Å; E712-K751 WeakPolarHBondContact OE1-CE 2.92Å; E712-K751 IonicContact OE1-NZ 3.59Å; E712-K751 PolarHBondContact OE1-NZ 3.27Å; E712-K751 IonicContact OE2-NZ 3.08Å; E712-K751 PolarHBondContact OE2-NZ 3.09Å; E712-W756 WeakPolarHBondContact OE1-CH2 3.35Å
713	Y	92.9	Very high	87.3	Confident	13 Å²	13	24 Å²	24	5%	0.051	14%	0.14	C	C	.	.	H	α-helix	trans	-71.6	-39.6	173.8	-81.4	-73.5	0	0	0	111.7	Y350 W353 L709 F710 D711 E715 M716 I717 I767 W770	Y350-Y713 VanDerWaalsContact CA-OH 3.3Å; Y350-Y713 WeakPolarHBondContact CA-OH 2.99Å; Y350-Y713 AromaticContact CD2-CD1 3.99Å; Y350-Y713 HydrophobicContact CD2-CD1 3.99Å; Y350-Y713 HydrophobicContact CD2-CD2 4.07Å; Y350-Y713 AromaticContact CD2-CE1 3.81Å; Y350-Y713 HydrophobicContact CD2-CE1 3.81Å; Y350-Y713 AromaticContact CD2-CE2 3.89Å; Y350-Y713 HydrophobicContact CD2-CE2 3.89Å; Y350-Y713 HydrophobicContact CD2-CG 4.13Å; Y350-Y713 AromaticContact CD2-CZ 3.77Å; Y350-Y713 HydrophobicContact CE2-CD1 4.47Å; Y350-Y713 HydrophobicContact CG-CE2 4.41Å; Y350-Y713 PolarHBondContact N-OH 2.9Å; W353-Y713 HydrophobicContact CD2-CE1 4.3Å; W353-Y713 HydrophobicContact CE3-CD1 4.07Å; W353-Y713 AromaticContact CE3-CE1 3.98Å; W353-Y713 HydrophobicContact CE3-CE1 3.98Å; W353-Y713 HydrophobicContact CZ3-CD1 4.19Å; L709-Y713 HydrophobicContact CB-CD2 3.94Å; L709-Y713 HydrophobicContact CB-CE2 4.03Å; L709-Y713 HydrophobicContact CD1-CE2 4.22Å; L709-Y713 WeakPolarHBondContact O-CD2 3.47Å; L709-Y713 PolarHBondContact O-N 3.48Å; L709-Y713 VanDerWaalsContact O-N 3.14Å; F710-Y713 PolarHBondContact O-N 3.04Å; D711-Y713 PolarHBondContact O-N 2.96Å; Y713-E715 VanDerWaalsContact C-N 3.32Å; Y713-E715 PolarHBondContact O-N 2.88Å; Y713-M716 PolarHBondContact O-N 3.28Å; Y713-I717 HydrophobicContact CD1-CD1 4.42Å; Y713-I717 VanDerWaalsContact O-CB 3.24Å; Y713-I717 WeakPolarHBondContact O-CB 3.25Å; Y713-I717 WeakPolarHBondContact O-CD1 3.24Å; Y713-I717 WeakPolarHBondContact O-CG1 3.16Å; Y713-I717 PolarHBondContact O-N 3.19Å; Y713-I767 HydrophobicContact CE1-CB 4.1Å; Y713-I767 HydrophobicContact CE1-CG2 4Å; Y713-I767 WeakPolarHBondContact OH-CG2 3.16Å; Y713-W770 AromaticContact CD1-CD1 3.93Å; Y713-W770 HydrophobicContact CD1-CG 4.4Å; Y713-W770 AromaticContact CD2-CD1 3.88Å; Y713-W770 AromaticContact CD2-NE1 3.66Å; Y713-W770 AromaticContact CG-CD1 3.61Å; Y713-W770 HydrophobicContact CG-CG 4.32Å; Y713-W770 AromaticContact CG-NE1 3.5Å
714	L	90.9	Very high	87.6	Confident	14 Å²	14	20.8 Å²	20.8	7%	0.073	12%	0.12	C	C	.	.	H	α-helix	trans	-58.1	-46	178.3	179	70.5	0	0	0	111	F597 Q600 F710 D711 I717 L718 W770	F597-L714 HydrophobicContact CD2-CD1 4.4Å; Q600-L714 HydrophobicContact CB-CD1 4.28Å; Q600-L714 HydrophobicContact CG-CD1 4.47Å; Q600-L714 HydrophobicContact CG-CD2 4.04Å; F710-L714 HydrophobicContact CE1-CB 4.37Å; F710-L714 HydrophobicContact CE1-CD2 3.86Å; F710-L714 HydrophobicContact CE2-CB 4.49Å; F710-L714 HydrophobicContact CZ-CB 4.1Å; F710-L714 HydrophobicContact CZ-CD1 4.18Å; F710-L714 HydrophobicContact CZ-CD2 3.8Å; F710-L714 HydrophobicContact CZ-CG 4.23Å; F710-L714 WeakPolarHBondContact O-CB 3.48Å; F710-L714 PolarHBondContact O-N 3.39Å; D711-L714 WeakPolarHBondContact O-CB 2.97Å; D711-L714 PolarHBondContact O-N 3.17Å; L714-I717 PolarHBondContact O-N 3.3Å; L714-L718 HydrophobicContact CD1-CD1 3.93Å; L714-L718 HydrophobicContact CD1-CG 4.14Å; L714-L718 HydrophobicContact CD2-CD1 4.45Å; L714-L718 HydrophobicContact CG-CD1 3.84Å; L714-L718 HydrophobicContact CG-CG 4.39Å; L714-L718 WeakPolarHBondContact O-CB 3.5Å; L714-L718 VanDerWaalsContact O-CG 3.27Å; L714-L718 WeakPolarHBondContact O-CG 3.46Å; L714-L718 PolarHBondContact O-N 3.18Å; L714-W770 HydrophobicContact CB-CH2 3.83Å; L714-W770 HydrophobicContact CB-CZ2 4.37Å; L714-W770 HydrophobicContact CD1-CH2 4.02Å; L714-W770 HydrophobicContact CD1-CZ3 4.45Å
715	E	88.8	Confident	88.1	Confident	26 Å²	26	18.4 Å²	18.4	12%	0.121	11%	0.108	C	C	.	.	H	α-helix	trans	-50.4	-60.8	176.8	-171.4	64.3	-154.9	0	0	111.3	K657 Q658 N661 D711 Y713 I717 L718 Q719	K657-E715 IonicContact NZ-OE1 3.39Å; K657-E715 PolarHBondContact NZ-OE1 2.99Å; K657-E715 IonicContact NZ-OE2 3.81Å; K657-E715 PolarHBondContact NZ-OE2 3.29Å; Q658-E715 PolarHBondContact NE2-OE1 3.23Å; Q658-E715 PolarHBondContact OE1-OE1 3.22Å; N661-E715 PolarHBondContact ND2-OE1 3.1Å; N661-E715 PolarHBondContact ND2-OE2 2.88Å; D711-E715 WeakPolarHBondContact O-CB 3.43Å; D711-E715 PolarHBondContact O-N 2.8Å; Y713-E715 VanDerWaalsContact C-N 3.32Å; Y713-E715 PolarHBondContact O-N 2.88Å; E715-I717 VanDerWaalsContact C-N 3.31Å; E715-I717 PolarHBondContact O-N 3.48Å; E715-L718 PolarHBondContact O-N 3.37Å; E715-Q719 PolarHBondContact O-N 2.95Å
716	M	92	Very high	88.6	Confident	0 Å²	0	14.7 Å²	14.7	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-67.9	-27.8	-176.2	-66.6	-68.5	103.2	0	0	113.5	W353 L354 Y357 Y713 F720 E744	W353-M716 HydrophobicContact CH2-CB 3.56Å; W353-M716 HydrophobicContact CZ3-CB 3.47Å; W353-M716 VanDerWaalsContact CZ3-CB 3.47Å; W353-M716 HydrophobicContact CZ3-CG 4.1Å; L354-M716 HydrophobicContact CD1-CG 3.98Å; L354-M716 HydrophobicContact CD1-SD 3.44Å; L354-M716 WeakPolarHBondContact CD1-SD 3.47Å; Y357-M716 HydrophobicContact CE1-SD 4.4Å; Y713-M716 PolarHBondContact O-N 3.28Å; M716-F720 PolarHBondContact O-N 3.43Å; M716-E744 HydrophobicContact CE-CG 3.79Å; M716-E744 WeakPolarHBondContact CE-OE1 3.32Å; M716-E744 HydrophobicContact SD-CG 4.35Å
717	I	93.8	Very high	89.8	Confident	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-82.7	-32.8	179.9	-68.9	169.3	0	0	0	111.3	W353 F597 Y713 L714 E715 Q719 F720 G721 W770 I773 L774 I777	W353-I717 HydrophobicContact CH2-CG1 3.9Å; W353-I717 HydrophobicContact CZ2-CG1 4.22Å; F597-I717 HydrophobicContact CE2-CG2 4.21Å; Y713-I717 HydrophobicContact CD1-CD1 4.42Å; Y713-I717 VanDerWaalsContact O-CB 3.24Å; Y713-I717 WeakPolarHBondContact O-CB 3.25Å; Y713-I717 WeakPolarHBondContact O-CD1 3.24Å; Y713-I717 WeakPolarHBondContact O-CG1 3.16Å; Y713-I717 PolarHBondContact O-N 3.19Å; L714-I717 PolarHBondContact O-N 3.3Å; E715-I717 VanDerWaalsContact C-N 3.31Å; E715-I717 PolarHBondContact O-N 3.48Å; I717-Q719 VanDerWaalsContact C-N 3.35Å; I717-F720 PolarHBondContact O-N 3.22Å; I717-G721 PolarHBondContact O-N 3.44Å; I717-W770 HydrophobicContact CD1-CB 3.61Å; I717-W770 HydrophobicContact CD1-CD2 3.39Å; I717-W770 HydrophobicContact CD1-CE3 3.23Å; I717-W770 HydrophobicContact CD1-CG 3.6Å; I717-W770 HydrophobicContact CD1-CZ3 3.92Å; I717-W770 HydrophobicContact CG1-CE3 4.45Å; I717-W770 HydrophobicContact CG2-CE3 4.39Å; I717-W770 HydrophobicContact CG2-CZ3 4.44Å; I717-I773 HydrophobicContact CG2-CG2 3.73Å; I717-L774 HydrophobicContact CD1-CG 4.49Å; I717-L774 HydrophobicContact CG1-CD2 4.02Å; I717-L774 HydrophobicContact CG1-CG 4.27Å; I717-L774 HydrophobicContact CG2-CD2 4.16Å; I717-I777 HydrophobicContact CG2-CD1 3.78Å
718	L	89.6	Confident	90.6	Very high	7 Å²	7	8.5 Å²	8.5	4%	0.037	5%	0.046	C	C	.	.	H	α-helix	trans	-66.6	-38.5	166.6	-68.2	171.1	0	0	0	110.9	F597 Q600 L604 L714 E715 G721 F722	F597-L718 HydrophobicContact CE2-CD2 4.42Å; Q600-L718 HydrophobicContact CB-CD1 4.47Å; L604-L718 HydrophobicContact CD2-CB 4.3Å; L604-L718 HydrophobicContact CD2-CD1 4.01Å; L604-L718 HydrophobicContact CD2-CD2 4.18Å; L604-L718 HydrophobicContact CD2-CG 4.4Å; L714-L718 HydrophobicContact CD1-CD1 3.93Å; L714-L718 HydrophobicContact CD1-CG 4.14Å; L714-L718 HydrophobicContact CD2-CD1 4.45Å; L714-L718 HydrophobicContact CG-CD1 3.84Å; L714-L718 HydrophobicContact CG-CG 4.39Å; L714-L718 WeakPolarHBondContact O-CB 3.5Å; L714-L718 VanDerWaalsContact O-CG 3.27Å; L714-L718 WeakPolarHBondContact O-CG 3.46Å; L714-L718 PolarHBondContact O-N 3.18Å; E715-L718 PolarHBondContact O-N 3.37Å; L718-G721 WeakPolarHBondContact O-CA 3.25Å; L718-G721 PolarHBondContact O-N 2.9Å; L718-G721 VanDerWaalsContact O-N 3.17Å; L718-F722 WeakPolarHBondContact O-CD2 3.48Å; L718-F722 PolarHBondContact O-N 3.49Å
719	Q	91.7	Very high	91	Very high	5 Å²	5	7.9 Å²	7.9	2%	0.023	4%	0.04	C	C	.	.	H	α-helix	trans	-61.7	-43.9	171.5	-162.3	-165.4	-98.2	0	0	111.9	Y357 E715 I717 G721 F722 T723 A737 N740 N741	Y357-Q719 PolarHBondContact OH-NE2 3.45Å; Y357-Q719 VanDerWaalsContact OH-NE2 3.09Å; E715-Q719 PolarHBondContact O-N 2.95Å; I717-Q719 VanDerWaalsContact C-N 3.35Å; Q719-G721 VanDerWaalsContact C-N 3.28Å; Q719-G721 PolarHBondContact O-N 3.21Å; Q719-F722 PolarHBondContact O-N 2.99Å; Q719-T723 WeakPolarHBondContact O-CG2 3.35Å; Q719-T723 PolarHBondContact O-N 2.87Å; Q719-T723 PolarHBondContact O-OG1 3.05Å; Q719-A737 HydrophobicContact CG-CB 4.14Å; Q719-N740 PolarHBondContact OE1-ND2 3.06Å; Q719-N741 PolarHBondContact NE2-OD1 3.25Å
720	F	93.4	Very high	91.1	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-57.9	-41.7	171.8	-178.2	-95.2	0	0	0	111.6	Y357 W437 A438 F441 M716 I717 T723 T724 L774 I777	Y357-F720 HydrophobicContact CD2-CD2 4.49Å; Y357-F720 AromaticContact CE2-CD2 3.89Å; Y357-F720 HydrophobicContact CE2-CD2 3.89Å; Y357-F720 PolarHBondContact OH-N 3.33Å; W437-F720 HydrophobicContact CH2-CD2 4.47Å; W437-F720 HydrophobicContact CH2-CE2 4.1Å; W437-F720 HydrophobicContact CZ3-CD2 4.44Å; W437-F720 AromaticContact CZ3-CE2 3.81Å; W437-F720 HydrophobicContact CZ3-CE2 3.81Å; A438-F720 HydrophobicContact CB-CZ 4.15Å; F441-F720 HydrophobicContact CD1-CD2 4.46Å; F441-F720 AromaticContact CD1-CE2 3.57Å; F441-F720 HydrophobicContact CD1-CE2 3.57Å; F441-F720 HydrophobicContact CD1-CZ 4.03Å; F441-F720 HydrophobicContact CE1-CD2 4.05Å; F441-F720 AromaticContact CE1-CE2 3.55Å; F441-F720 HydrophobicContact CE1-CE2 3.55Å; F441-F720 HydrophobicContact CE1-CZ 4.12Å; M716-F720 PolarHBondContact O-N 3.43Å; I717-F720 PolarHBondContact O-N 3.22Å; F720-T723 WeakPolarHBondContact CA-OG1 3.3Å; F720-T723 PolarHBondContact O-N 3.29Å; F720-T723 PolarHBondContact O-OG1 3.14Å; F720-T724 HydrophobicContact CD1-CG2 4.45Å; F720-T724 HydrophobicContact CD2-CG2 4.38Å; F720-T724 HydrophobicContact CE1-CG2 4.14Å; F720-T724 HydrophobicContact CE2-CG2 4.04Å; F720-T724 HydrophobicContact CZ-CG2 3.92Å; F720-T724 WeakPolarHBondContact O-CB 3.06Å; F720-T724 WeakPolarHBondContact O-CG2 3.46Å; F720-T724 PolarHBondContact O-N 3.41Å; F720-T724 PolarHBondContact O-OG1 3.4Å; F720-L774 HydrophobicContact CB-CD2 3.94Å; F720-L774 HydrophobicContact CD1-CD2 3.29Å; F720-L774 HydrophobicContact CD2-CD2 4.22Å; F720-L774 HydrophobicContact CE1-CD2 3.75Å; F720-L774 HydrophobicContact CG-CD2 3.55Å; F720-L774 HydrophobicContact CZ-CD2 4.39Å; F720-I777 HydrophobicContact CD1-CB 4.37Å; F720-I777 HydrophobicContact CD1-CG2 3.72Å; F720-I777 HydrophobicContact CE1-CB 4.33Å; F720-I777 HydrophobicContact CE1-CG2 3.79Å
721	G	92.4	Very high	91.2	Very high	2 Å²	2	8.1 Å²	8.1	2%	0.021	4%	0.041	C	C	.	.	H	α-helix	trans	-52.9	-55	170.4	0	0	0	0	0	112.9	I717 L718 Q719 T723 T724 I725	I717-G721 PolarHBondContact O-N 3.44Å; L718-G721 WeakPolarHBondContact O-CA 3.25Å; L718-G721 PolarHBondContact O-N 2.9Å; L718-G721 VanDerWaalsContact O-N 3.17Å; Q719-G721 VanDerWaalsContact C-N 3.28Å; Q719-G721 PolarHBondContact O-N 3.21Å; G721-T723 PolarHBondContact O-N 3.37Å; G721-T724 PolarHBondContact O-N 2.89Å; G721-T724 PolarHBondContact O-OG1 3.07Å; G721-I725 VanDerWaalsContact O-CB 3.3Å; G721-I725 WeakPolarHBondContact O-CB 3.04Å; G721-I725 WeakPolarHBondContact O-CG1 3.36Å; G721-I725 PolarHBondContact O-N 3.35Å
722	F	88.1	Confident	91.4	Very high	9 Å²	9	7 Å²	7	4%	0.039	3%	0.034	C	C	.	.	H	α-helix	trans	-60.2	-41.2	178.2	-67.7	-46.8	0	0	0	113.4	L604 I653 L718 Q719 T724	L604-F722 HydrophobicContact CD1-CZ 4.04Å; L604-F722 HydrophobicContact CD2-CE1 4.38Å; L604-F722 HydrophobicContact CD2-CE2 3.86Å; L604-F722 HydrophobicContact CD2-CZ 3.45Å; L604-F722 VanDerWaalsContact CD2-CZ 3.45Å; L604-F722 HydrophobicContact CG-CE1 4.27Å; L604-F722 HydrophobicContact CG-CE2 4.45Å; L604-F722 HydrophobicContact CG-CZ 3.58Å; I653-F722 HydrophobicContact CG2-CE1 4.18Å; I653-F722 HydrophobicContact CG2-CE2 4Å; I653-F722 HydrophobicContact CG2-CZ 3.46Å; I653-F722 VanDerWaalsContact CG2-CZ 3.46Å; L718-F722 WeakPolarHBondContact O-CD2 3.48Å; L718-F722 PolarHBondContact O-N 3.49Å; Q719-F722 PolarHBondContact O-N 2.99Å; F722-T724 PolarHBondContact O-N 3.33Å
723	T	91.5	Very high	91.4	Very high	0 Å²	0	6 Å²	6	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-71.1	-10.8	179.5	59.5	0	0	0	0	114.7	M434 Q719 F720 G721 V727 A733 A737	M434-T723 WeakPolarHBondContact CE-O 3.28Å; Q719-T723 WeakPolarHBondContact O-CG2 3.35Å; Q719-T723 PolarHBondContact O-N 2.87Å; Q719-T723 PolarHBondContact O-OG1 3.05Å; F720-T723 WeakPolarHBondContact CA-OG1 3.3Å; F720-T723 PolarHBondContact O-N 3.29Å; F720-T723 PolarHBondContact O-OG1 3.14Å; G721-T723 PolarHBondContact O-N 3.37Å; T723-V727 WeakPolarHBondContact O-CB 3.23Å; T723-V727 WeakPolarHBondContact O-CG2 3.46Å; T723-A733 HydrophobicContact CG2-CB 4.39Å; T723-A737 HydrophobicContact CG2-CB 3.39Å
724	T	94.1	Very high	91.5	Very high	0 Å²	0	5.4 Å²	5.4	0%	0	3%	0.028	C	C	.	.	H	α-helix	trans	-122.5	-40.1	-175.4	56.8	0	0	0	0	114	W437 A438 F720 G721 F722 I777 S781 N785	W437-T724 HydrophobicContact CZ3-CG2 4.14Å; A438-T724 HydrophobicContact CB-CG2 4.35Å; F720-T724 HydrophobicContact CD1-CG2 4.45Å; F720-T724 HydrophobicContact CD2-CG2 4.38Å; F720-T724 HydrophobicContact CE1-CG2 4.14Å; F720-T724 HydrophobicContact CE2-CG2 4.04Å; F720-T724 HydrophobicContact CZ-CG2 3.92Å; F720-T724 WeakPolarHBondContact O-CB 3.06Å; F720-T724 WeakPolarHBondContact O-CG2 3.46Å; F720-T724 PolarHBondContact O-N 3.41Å; F720-T724 PolarHBondContact O-OG1 3.4Å; G721-T724 PolarHBondContact O-N 2.89Å; G721-T724 PolarHBondContact O-OG1 3.07Å; F722-T724 PolarHBondContact O-N 3.33Å; T724-I777 WeakPolarHBondContact OG1-CG2 3.17Å; T724-S781 VanDerWaalsContact C-OG 3.3Å; T724-S781 WeakPolarHBondContact O-CB 3.39Å; T724-S781 PolarHBondContact O-OG 3.48Å; T724-N785 PolarHBondContact O-ND2 2.92Å
725	I	93.8	Very high	91.7	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-71.7	-41.5	-169.9	-67.1	174.8	0	0	0	112.7	F601 F609 G721 I777 L780 T784 N785	F601-I725 HydrophobicContact CE2-CD1 3.51Å; F601-I725 HydrophobicContact CZ-CD1 3.77Å; F609-I725 HydrophobicContact CE1-CG2 4.39Å; F609-I725 HydrophobicContact CZ-CG2 4.12Å; G721-I725 VanDerWaalsContact O-CB 3.3Å; G721-I725 WeakPolarHBondContact O-CB 3.04Å; G721-I725 WeakPolarHBondContact O-CG1 3.36Å; G721-I725 PolarHBondContact O-N 3.35Å; I725-I777 HydrophobicContact CD1-CG2 4.07Å; I725-I777 HydrophobicContact CG1-CG2 4.07Å; I725-L780 HydrophobicContact CD1-CD2 4.41Å; I725-T784 HydrophobicContact CG2-CG2 3.63Å; I725-T784 WeakPolarHBondContact O-CB 3.33Å; I725-T784 VanDerWaalsContact O-CG2 3.32Å; I725-T784 WeakPolarHBondContact O-CG2 3.44Å; I725-N785 PolarHBondContact O-ND2 3.5Å
726	F	90.3	Very high	91.8	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	5%	0.045	C	C	.	.	S	Bend	trans	-116.8	20.4	-175.8	-58.1	-79.8	0	0	0	112.7	T608 F609 A612 L646 M650 A728 A729 T784 V788	T608-F726 HydrophobicContact CG2-CD1 4.27Å; T608-F726 HydrophobicContact CG2-CD2 3.99Å; T608-F726 HydrophobicContact CG2-CE1 3.97Å; T608-F726 HydrophobicContact CG2-CE2 3.67Å; T608-F726 HydrophobicContact CG2-CG 4.28Å; T608-F726 HydrophobicContact CG2-CZ 3.66Å; F609-F726 AromaticContact CD1-CE1 3.84Å; F609-F726 HydrophobicContact CD1-CE1 3.84Å; F609-F726 AromaticContact CD1-CZ 3.67Å; F609-F726 HydrophobicContact CD1-CZ 3.67Å; F609-F726 HydrophobicContact CD2-CZ 4.22Å; F609-F726 AromaticContact CE1-CE1 3.88Å; F609-F726 HydrophobicContact CE1-CE1 3.88Å; F609-F726 AromaticContact CE1-CZ 3.59Å; F609-F726 HydrophobicContact CE1-CZ 3.59Å; F609-F726 HydrophobicContact CE2-CZ 4.14Å; F609-F726 HydrophobicContact CG-CE1 4.48Å; F609-F726 AromaticContact CG-CZ 3.99Å; F609-F726 HydrophobicContact CG-CZ 3.99Å; F609-F726 AromaticContact CZ-CZ 3.83Å; F609-F726 HydrophobicContact CZ-CZ 3.83Å; A612-F726 HydrophobicContact CB-CE1 4.3Å; L646-F726 HydrophobicContact CD1-CD1 4.29Å; M650-F726 HydrophobicContact CE-CB 3.54Å; M650-F726 HydrophobicContact SD-CB 3.35Å; M650-F726 WeakPolarHBondContact SD-CB 3.33Å; M650-F726 HydrophobicContact SD-CG 4.14Å; F726-A728 PolarHBondContact O-N 3.43Å; F726-A728 VanDerWaalsContact O-N 3.14Å; F726-A729 WeakPolarHBondContact O-CB 3.38Å; F726-A729 PolarHBondContact O-N 2.75Å; F726-T784 HydrophobicContact CD1-CG2 3.95Å; F726-T784 HydrophobicContact CE1-CG2 3.84Å; F726-V788 HydrophobicContact CD1-CG2 4.34Å
727	V	92.6	Very high	91.9	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.046	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-23.1	-169.5	73.2	0	0	0	0	114	F430 M434 T723 A729 F730 P734 N785	F430-V727 HydrophobicContact CD1-CG2 4.09Å; F430-V727 HydrophobicContact CE1-CG2 3.6Å; M434-V727 HydrophobicContact CB-CG1 3.77Å; M434-V727 HydrophobicContact CE-CG2 4.4Å; M434-V727 HydrophobicContact CG-CG1 4.01Å; M434-V727 HydrophobicContact CG-CG2 3.95Å; T723-V727 WeakPolarHBondContact O-CB 3.23Å; T723-V727 WeakPolarHBondContact O-CG2 3.46Å; V727-A729 PolarHBondContact O-N 3.48Å; V727-F730 CarbonylContact O-C 3.59Å; V727-F730 PolarHBondContact O-N 3.04Å; V727-P734 HydrophobicContact CG2-CG 4.48Å; V727-N785 PolarHBondContact N-OD1 3.24Å
728	A	91.2	Very high	91.9	Very high	4 Å²	4	9.3 Å²	9.3	3%	0.033	5%	0.049	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-27.1	170.2	0	0	0	0	0	113.8	A431 F726 N785 V788 I789	A431-A728 HydrophobicContact CB-CB 4.13Å; F726-A728 PolarHBondContact O-N 3.43Å; F726-A728 VanDerWaalsContact O-N 3.14Å; A728-N785 HydrophobicContact CB-CB 4.3Å; A728-N785 VanDerWaalsContact CB-OD1 3.28Å; A728-N785 WeakPolarHBondContact CB-OD1 3.41Å; A728-N785 PolarHBondContact N-OD1 3.08Å; A728-V788 HydrophobicContact CB-CG1 4.15Å; A728-I789 HydrophobicContact CB-CD1 3.94Å; A728-I789 HydrophobicContact CB-CG1 3.71Å
729	A	89.6	Confident	92	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-24.7	177.9	0	0	0	0	0	113.4	L643 L646 M650 F726 V727 V788	L643-A729 HydrophobicContact CD1-CB 3.93Å; L643-A729 HydrophobicContact CG-CB 4.35Å; L646-A729 HydrophobicContact CD2-CB 3.69Å; L646-A729 HydrophobicContact CG-CB 4.04Å; M650-A729 HydrophobicContact SD-CB 4.29Å; F726-A729 WeakPolarHBondContact O-CB 3.38Å; F726-A729 PolarHBondContact O-N 2.75Å; V727-A729 PolarHBondContact O-N 3.48Å; A729-V788 HydrophobicContact CB-CG1 4.27Å
730	F	89.1	Confident	92	Very high	17 Å²	17	14 Å²	14	8%	0.075	7%	0.073	C	C	.	.			trans	-144.4	85.4	-176.9	-172.4	-127	0	0	0	113.1	F422 C647 M650 M654 V727 L732 A733 L736	F422-F730 HydrophobicContact CD1-CD2 4.35Å; F422-F730 AromaticContact CE1-CD2 3.92Å; F422-F730 HydrophobicContact CE1-CD2 3.92Å; F422-F730 HydrophobicContact CE1-CE2 4.03Å; F422-F730 HydrophobicContact CZ-CD2 4.34Å; F422-F730 HydrophobicContact CZ-CE2 4.23Å; C647-F730 WeakPolarHBondContact SG-CD2 3.49Å; M650-F730 HydrophobicContact CE-CB 3.86Å; M650-F730 HydrophobicContact SD-CB 4.43Å; M654-F730 HydrophobicContact CE-CD1 4.38Å; M654-F730 HydrophobicContact CE-CE1 3.8Å; V727-F730 CarbonylContact O-C 3.59Å; V727-F730 PolarHBondContact O-N 3.04Å; F730-L732 HydrophobicContact CD2-CB 4.47Å; F730-L732 HydrophobicContact CE1-CB 4.19Å; F730-L732 HydrophobicContact CE2-CB 3.86Å; F730-L732 HydrophobicContact CE2-CD1 4.35Å; F730-L732 HydrophobicContact CZ-CB 3.7Å; F730-L732 PolarHBondContact O-N 2.91Å; F730-L732 VanDerWaalsContact O-N 3.09Å; F730-A733 HydrophobicContact CD1-CB 3.88Å; F730-A733 HydrophobicContact CE1-CB 4.45Å; F730-A733 WeakPolarHBondContact O-CB 3.4Å; F730-A733 PolarHBondContact O-N 3.27Å; F730-A733 VanDerWaalsContact O-N 3.1Å; F730-L736 HydrophobicContact CE1-CD1 4.05Å; F730-L736 HydrophobicContact CZ-CD1 4.08Å
731	P	91.5	Very high	91.9	Very high	2 Å²	2	14 Å²	14	1%	0.013	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-18.5	-177.7	-26.5	35.3	0	0	0	116	G368 V371 T427 F430 A733 P734	G368-P731 WeakPolarHBondContact CA-O 2.96Å; V371-P731 HydrophobicContact CG1-CB 4.13Å; V371-P731 HydrophobicContact CG1-CG 4.12Å; T427-P731 HydrophobicContact CG2-CG 3.52Å; F430-P731 HydrophobicContact CD1-CB 3.81Å; F430-P731 HydrophobicContact CD1-CG 4.38Å; F430-P731 HydrophobicContact CE1-CB 3.93Å; F430-P731 WeakPolarHBondContact CE1-O 3.19Å; P731-A733 VanDerWaalsContact C-N 3.3Å; P731-P734 WeakPolarHBondContact O-CD 3.36Å
732	L	91.1	Very high	91.9	Very high	28 Å²	28	15.9 Å²	15.9	15%	0.147	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-5.3	177.4	-67.3	179.2	0	0	0	113.6	L369 F372 F730 L735 L736	L369-L732 HydrophobicContact CD1-CD2 4.29Å; F372-L732 HydrophobicContact CB-CD2 3.74Å; F372-L732 HydrophobicContact CB-CG 4.12Å; F372-L732 HydrophobicContact CD1-CD1 4.22Å; F372-L732 HydrophobicContact CD1-CD2 4.17Å; F372-L732 HydrophobicContact CD2-CD1 3.64Å; F372-L732 HydrophobicContact CD2-CD2 4.28Å; F372-L732 HydrophobicContact CD2-CG 3.86Å; F372-L732 HydrophobicContact CE1-CD1 4.26Å; F372-L732 HydrophobicContact CE2-CD1 3.68Å; F372-L732 HydrophobicContact CE2-CG 4.4Å; F372-L732 HydrophobicContact CG-CD1 3.92Å; F372-L732 HydrophobicContact CG-CD2 3.81Å; F372-L732 HydrophobicContact CG-CG 3.93Å; F372-L732 HydrophobicContact CZ-CD1 4Å; F730-L732 HydrophobicContact CD2-CB 4.47Å; F730-L732 HydrophobicContact CE1-CB 4.19Å; F730-L732 HydrophobicContact CE2-CB 3.86Å; F730-L732 HydrophobicContact CE2-CD1 4.35Å; F730-L732 HydrophobicContact CZ-CB 3.7Å; F730-L732 PolarHBondContact O-N 2.91Å; F730-L732 VanDerWaalsContact O-N 3.09Å; L732-L735 HydrophobicContact CD2-CD2 4.23Å; L732-L735 WeakPolarHBondContact O-CB 3.33Å; L732-L735 PolarHBondContact O-N 3.03Å; L732-L736 PolarHBondContact O-N 3.38Å
733	A	92.2	Very high	92	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-52.6	-45.9	-179.3	0	0	0	0	0	113.7	M654 T723 F730 P731 L735 L736 A737	M654-A733 HydrophobicContact CE-CB 4.42Å; M654-A733 HydrophobicContact SD-CB 4.36Å; T723-A733 HydrophobicContact CG2-CB 4.39Å; F730-A733 HydrophobicContact CD1-CB 3.88Å; F730-A733 HydrophobicContact CE1-CB 4.45Å; F730-A733 WeakPolarHBondContact O-CB 3.4Å; F730-A733 PolarHBondContact O-N 3.27Å; F730-A733 VanDerWaalsContact O-N 3.1Å; P731-A733 VanDerWaalsContact C-N 3.3Å; A733-L735 VanDerWaalsContact C-N 3.27Å; A733-L735 PolarHBondContact O-N 3.11Å; A733-L736 PolarHBondContact O-N 3.42Å; A733-A737 WeakPolarHBondContact O-CB 3.16Å; A733-A737 PolarHBondContact O-N 2.8Å
734	P	94.4	Very high	91.9	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-67.7	-22.6	179.2	-22.2	37.1	0	0	0	114.2	L361 A364 F430 M434 V727 P731 L738	L361-P734 HydrophobicContact CD2-CB 4.09Å; A364-P734 HydrophobicContact CB-CB 3.84Å; A364-P734 HydrophobicContact CB-CG 4.29Å; F430-P734 HydrophobicContact CE1-CG 4.5Å; F430-P734 HydrophobicContact CZ-CG 4.15Å; M434-P734 HydrophobicContact CE-CG 3.76Å; M434-P734 HydrophobicContact SD-CG 4.18Å; V727-P734 HydrophobicContact CG2-CG 4.48Å; P731-P734 WeakPolarHBondContact O-CD 3.36Å; P734-L738 VanDerWaalsContact O-CB 3.22Å; P734-L738 WeakPolarHBondContact O-CB 3.4Å; P734-L738 PolarHBondContact O-N 3.38Å
735	L	93.9	Very high	91.8	Very high	47 Å²	47	20.3 Å²	20.3	25%	0.246	11%	0.106	C	C	.	.	H	α-helix	trans	-75	-44.9	176	177.9	63.1	0	0	0	111.4	A365 L369 L732 A733 L738 L739	A365-L735 HydrophobicContact CB-CB 4.09Å; A365-L735 HydrophobicContact CB-CD1 4.12Å; L369-L735 HydrophobicContact CD1-CD2 4.36Å; L732-L735 HydrophobicContact CD2-CD2 4.23Å; L732-L735 WeakPolarHBondContact O-CB 3.33Å; L732-L735 PolarHBondContact O-N 3.03Å; A733-L735 VanDerWaalsContact C-N 3.27Å; A733-L735 PolarHBondContact O-N 3.11Å; L735-L738 PolarHBondContact O-N 2.87Å; L735-L739 WeakPolarHBondContact O-CG 3.3Å; L735-L739 PolarHBondContact O-N 3.3Å
736	L	92.1	Very high	91.7	Very high	60 Å²	60	20.7 Å²	20.7	31%	0.314	11%	0.107	S	C	.	.	H	α-helix	trans	-68.2	-38.3	176.7	-63.4	-178.2	0	0	0	111.4	M654 V655 F730 L732 A733 L739 N740	M654-L736 HydrophobicContact CE-CB 3.62Å; M654-L736 HydrophobicContact CE-CD1 3.59Å; M654-L736 HydrophobicContact CE-CG 4.17Å; V655-L736 HydrophobicContact CG2-CD1 4.27Å; F730-L736 HydrophobicContact CE1-CD1 4.05Å; F730-L736 HydrophobicContact CZ-CD1 4.08Å; L732-L736 PolarHBondContact O-N 3.38Å; A733-L736 PolarHBondContact O-N 3.42Å; L736-L739 HydrophobicContact CD2-CD1 4.39Å; L736-L739 PolarHBondContact O-N 2.97Å; L736-N740 PolarHBondContact O-N 3.44Å
737	A	93	Very high	91.7	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.008	11%	0.108	C	C	.	.	H	α-helix	trans	-61.7	-40	170.6	0	0	0	0	0	113.1	L361 Q719 T723 A733 N740 N741	L361-A737 HydrophobicContact CD1-CB 4.15Å; Q719-A737 HydrophobicContact CG-CB 4.14Å; T723-A737 HydrophobicContact CG2-CB 3.39Å; A733-A737 WeakPolarHBondContact O-CB 3.16Å; A733-A737 PolarHBondContact O-N 2.8Å; A737-N740 PolarHBondContact O-N 3.39Å; A737-N741 WeakPolarHBondContact O-CB 3.43Å; A737-N741 PolarHBondContact O-N 3.32Å; A737-N741 PolarHBondContact O-OD1 3.43Å; A737-N741 VanDerWaalsContact O-OD1 3.12Å
738	L	93.6	Very high	91.6	Very high	13 Å²	13	20.9 Å²	20.9	7%	0.068	11%	0.108	C	C	.	.	H	α-helix	trans	-63.6	-43.6	175.1	175.6	62.8	0	0	0	111.8	T358 L361 F362 A365 P734 L735 I742	T358-L738 HydrophobicContact CG2-CD1 3.84Å; L361-L738 HydrophobicContact CB-CB 4.19Å; L361-L738 HydrophobicContact CB-CD1 4.06Å; F362-L738 HydrophobicContact CD1-CD1 4.4Å; F362-L738 HydrophobicContact CD1-CD2 3.78Å; F362-L738 HydrophobicContact CD2-CD1 3.9Å; F362-L738 HydrophobicContact CE1-CD1 4.28Å; F362-L738 HydrophobicContact CE1-CD2 3.97Å; F362-L738 HydrophobicContact CE2-CD1 3.76Å; F362-L738 HydrophobicContact CG-CD1 4.22Å; F362-L738 HydrophobicContact CG-CD2 4.13Å; F362-L738 HydrophobicContact CZ-CD1 3.96Å; F362-L738 HydrophobicContact CZ-CD2 4.47Å; A365-L738 HydrophobicContact CB-CB 4.37Å; A365-L738 HydrophobicContact CB-CD2 3.71Å; P734-L738 VanDerWaalsContact O-CB 3.22Å; P734-L738 WeakPolarHBondContact O-CB 3.4Å; P734-L738 PolarHBondContact O-N 3.38Å; L735-L738 PolarHBondContact O-N 2.87Å; L738-I742 HydrophobicContact CD1-CD1 4.17Å; L738-I742 HydrophobicContact CG-CD1 4.21Å; L738-I742 WeakPolarHBondContact O-CD1 3.36Å; L738-I742 VanDerWaalsContact O-CG1 3.31Å; L738-I742 WeakPolarHBondContact O-CG1 3.34Å; L738-I742 PolarHBondContact O-N 3.1Å
739	L	92	Very high	91.7	Very high	95 Å²	95	20.7 Å²	20.7	50%	0.497	11%	0.107	S	C	.	.	H	α-helix	trans	-63.1	-43.4	176.2	-72.2	175.3	0	0	0	111.6	L735 L736 I742 I743	L735-L739 WeakPolarHBondContact O-CG 3.3Å; L735-L739 PolarHBondContact O-N 3.3Å; L736-L739 HydrophobicContact CD2-CD1 4.39Å; L736-L739 PolarHBondContact O-N 2.97Å; L739-I742 PolarHBondContact O-N 2.77Å; L739-I743 PolarHBondContact O-N 2.87Å
740	N	91.4	Very high	91.8	Very high	15 Å²	15	22.1 Å²	22.1	8%	0.08	11%	0.112	C	C	.	.	H	α-helix	trans	-60	-54.2	174.7	-176	55.7	0	0	0	111.4	Q658 N662 Q719 L736 A737 I742 I743 E744	Q658-N740 HydrophobicContact CG-CB 4.03Å; Q658-N740 WeakPolarHBondContact CG-ND2 3.22Å; Q658-N740 WeakPolarHBondContact CG-OD1 3.42Å; Q658-N740 PolarHBondContact NE2-ND2 3.5Å; Q658-N740 VanDerWaalsContact NE2-ND2 3.18Å; N662-N740 PolarHBondContact ND2-OD1 3.37Å; Q719-N740 PolarHBondContact OE1-ND2 3.06Å; L736-N740 PolarHBondContact O-N 3.44Å; A737-N740 PolarHBondContact O-N 3.39Å; N740-I742 PolarHBondContact O-N 3.49Å; N740-I743 CarbonylContact O-C 3.59Å; N740-I743 WeakPolarHBondContact O-CA 3.19Å; N740-I743 WeakPolarHBondContact O-CB 3.31Å; N740-I743 PolarHBondContact O-N 2.82Å; N740-E744 PolarHBondContact O-N 2.71Å
741	N	92.1	Very high	91.8	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-54.4	-30.6	-178.1	-82.8	34.5	0	0	0	114.4	Y357 T358 Q719 A737 I745	Y357-N741 WeakPolarHBondContact CD1-ND2 3.17Å; Y357-N741 WeakPolarHBondContact CE1-ND2 3.34Å; T358-N741 HydrophobicContact CG2-CB 3.76Å; T358-N741 VanDerWaalsContact OG1-CB 3.28Å; T358-N741 WeakPolarHBondContact OG1-CB 3.38Å; T358-N741 PolarHBondContact OG1-ND2 2.84Å; Q719-N741 PolarHBondContact NE2-OD1 3.25Å; A737-N741 WeakPolarHBondContact O-CB 3.43Å; A737-N741 PolarHBondContact O-N 3.32Å; A737-N741 PolarHBondContact O-OD1 3.43Å; A737-N741 VanDerWaalsContact O-OD1 3.12Å; N741-I745 WeakPolarHBondContact O-CD1 3.32Å; N741-I745 VanDerWaalsContact O-CG1 3.24Å; N741-I745 WeakPolarHBondContact O-CG1 3.44Å; N741-I745 PolarHBondContact O-N 2.97Å; N741-I745 VanDerWaalsContact O-N 3.12Å
742	I	91.6	Very high	91.8	Very high	43 Å²	43	21.3 Å²	21.3	22%	0.221	11%	0.108	C	C	.	.	H	α-helix	trans	-70.3	-35.4	177.3	-70.2	165.4	0	0	0	111.2	W330 T358 F362 L738 L739 N740	W330-I742 HydrophobicContact CE3-CG2 4Å; T358-I742 HydrophobicContact CG2-CG1 4.14Å; F362-I742 HydrophobicContact CZ-CD1 4.45Å; L738-I742 HydrophobicContact CD1-CD1 4.17Å; L738-I742 HydrophobicContact CG-CD1 4.21Å; L738-I742 WeakPolarHBondContact O-CD1 3.36Å; L738-I742 VanDerWaalsContact O-CG1 3.31Å; L738-I742 WeakPolarHBondContact O-CG1 3.34Å; L738-I742 PolarHBondContact O-N 3.1Å; L739-I742 PolarHBondContact O-N 2.77Å; N740-I742 PolarHBondContact O-N 3.49Å
743	I	90.1	Very high	91.8	Very high	82 Å²	82	20 Å²	20	42%	0.421	10%	0.101	S	C	.	.	H	α-helix	trans	-71.2	-51.2	170.7	-62.1	170.2	0	0	0	109	W327 L739 N740 I745 R746 L747	W327-I743 HydrophobicContact CH2-CG2 4.27Å; W327-I743 HydrophobicContact CZ3-CG2 4.04Å; L739-I743 PolarHBondContact O-N 2.87Å; N740-I743 CarbonylContact O-C 3.59Å; N740-I743 WeakPolarHBondContact O-CA 3.19Å; N740-I743 WeakPolarHBondContact O-CB 3.31Å; N740-I743 PolarHBondContact O-N 2.82Å; I743-I745 PolarHBondContact O-N 3.36Å; I743-R746 WeakPolarHBondContact O-CA 3.33Å; I743-R746 PolarHBondContact O-N 3.15Å; I743-L747 PolarHBondContact O-N 2.95Å
744	E	91.3	Very high	91.7	Very high	6 Å²	6	20.3 Å²	20.3	3%	0.028	10%	0.103	C	C	.	.	H	α-helix	trans	-51.8	-53	-175.1	-148.7	82.5	132.8	0	0	112.3	Q658 N662 M716 N740 R746 L747 D748	Q658-E744 PolarHBondContact NE2-OE1 3.46Å; N662-E744 PolarHBondContact ND2-OE2 2.91Å; M716-E744 HydrophobicContact CE-CG 3.79Å; M716-E744 WeakPolarHBondContact CE-OE1 3.32Å; M716-E744 HydrophobicContact SD-CG 4.35Å; N740-E744 PolarHBondContact O-N 2.71Å; E744-R746 PolarHBondContact O-N 3.31Å; E744-L747 PolarHBondContact O-N 3.41Å; E744-L747 VanDerWaalsContact O-N 3.08Å; E744-D748 VanDerWaalsContact O-CB 3.32Å; E744-D748 WeakPolarHBondContact O-CB 3.01Å; E744-D748 PolarHBondContact O-N 2.91Å
745	I	91.2	Very high	91.4	Very high	13 Å²	13	20.7 Å²	20.7	7%	0.067	11%	0.105	C	C	.	.	H	α-helix	trans	-52.5	-28.2	179.2	-73.8	166.3	0	0	0	112.6	Q334 L354 T358 N741 I743 A749	Q334-I745 HydrophobicContact CG-CG2 4.11Å; L354-I745 HydrophobicContact CD1-CG1 4.46Å; L354-I745 HydrophobicContact CD2-CG1 3.54Å; L354-I745 HydrophobicContact CG-CD1 4.15Å; L354-I745 HydrophobicContact CG-CG1 3.59Å; T358-I745 HydrophobicContact CG2-CD1 4.21Å; T358-I745 WeakPolarHBondContact OG1-CD1 3.21Å; N741-I745 WeakPolarHBondContact O-CD1 3.32Å; N741-I745 VanDerWaalsContact O-CG1 3.24Å; N741-I745 WeakPolarHBondContact O-CG1 3.44Å; N741-I745 PolarHBondContact O-N 2.97Å; N741-I745 VanDerWaalsContact O-N 3.12Å; I743-I745 PolarHBondContact O-N 3.36Å; I745-A749 VanDerWaalsContact O-CB 3.24Å; I745-A749 WeakPolarHBondContact O-CB 3.37Å; I745-A749 PolarHBondContact O-N 2.89Å
746	R	91.1	Very high	91.2	Very high	9 Å²	9	19.2 Å²	19.2	3%	0.034	10%	0.096	C	C	.	.	H	α-helix	trans	-96.1	-36.6	-179.2	-53	-56.3	167.4	163.4	3.2	112.3	W324 W327 V329 W330 K332 I743 E744 A749 Y750	W324-R746 WeakPolarHBondContact O-CD 3.37Å; W324-R746 PolarHBondContact O-NH1 3.38Å; W327-R746 HydrophobicContact CE3-CB 3.84Å; W327-R746 HydrophobicContact CZ3-CB 3.87Å; V329-R746 PolarHBondContact O-NH1 2.98Å; V329-R746 PolarHBondContact O-NH2 2.8Å; W330-R746 VanDerWaalsContact C-NH2 3.35Å; W330-R746 HydrophobicContact CB-CG 4.5Å; W330-R746 PolarHBondContact O-NH2 3.26Å; K332-R746 PolarHBondContact O-NH2 3.04Å; I743-R746 WeakPolarHBondContact O-CA 3.33Å; I743-R746 PolarHBondContact O-N 3.15Å; E744-R746 PolarHBondContact O-N 3.31Å; R746-A749 PolarHBondContact O-N 2.88Å; R746-Y750 VanDerWaalsContact O-CB 3.24Å; R746-Y750 WeakPolarHBondContact O-CB 3.46Å; R746-Y750 PolarHBondContact O-N 2.89Å
747	L	90.8	Very high	91.1	Very high	4 Å²	4	18.4 Å²	18.4	2%	0.021	9%	0.089	C	C	.	.	H	α-helix	trans	-61.6	-51	173.7	-155.4	176.7	0	0	0	110.1	W327 N662 E665 L666 I743 E744 A749 Y750 K751	W327-L747 HydrophobicContact CH2-CB 3.81Å; W327-L747 HydrophobicContact CH2-CG 4.05Å; N662-L747 HydrophobicContact CB-CD1 3.65Å; E665-L747 VanDerWaalsContact CD-CD2 3.46Å; E665-L747 HydrophobicContact CG-CD2 4.46Å; E665-L747 VanDerWaalsContact OE1-CD2 3.29Å; E665-L747 WeakPolarHBondContact OE1-CD2 3.49Å; E665-L747 WeakPolarHBondContact OE2-CD2 3.5Å; L666-L747 HydrophobicContact CB-CD1 4.44Å; L666-L747 HydrophobicContact CB-CD2 3.84Å; L666-L747 HydrophobicContact CB-CG 4.32Å; L666-L747 HydrophobicContact CD1-CD2 4.21Å; L666-L747 HydrophobicContact CD2-CG 4.43Å; L666-L747 HydrophobicContact CG-CD2 4.43Å; I743-L747 PolarHBondContact O-N 2.95Å; E744-L747 PolarHBondContact O-N 3.41Å; E744-L747 VanDerWaalsContact O-N 3.08Å; L747-A749 PolarHBondContact O-N 2.94Å; L747-Y750 WeakPolarHBondContact O-CB 3.38Å; L747-Y750 PolarHBondContact O-N 2.94Å; L747-K751 WeakPolarHBondContact O-CB 3.31Å; L747-K751 PolarHBondContact O-N 3.48Å
748	D	91.2	Very high	91.1	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-53.4	-55.2	171	-107.5	-42.2	0	0	0	111.6	Y350 F351 E744 Y750 K751 F752	Y350-D748 WeakPolarHBondContact CE1-OD2 3.48Å; Y350-D748 VanDerWaalsContact CZ-OD2 3.3Å; Y350-D748 PolarHBondContact OH-OD2 2.84Å; F351-D748 HydrophobicContact CE1-CB 3.62Å; F351-D748 HydrophobicContact CZ-CB 3.78Å; E744-D748 VanDerWaalsContact O-CB 3.32Å; E744-D748 WeakPolarHBondContact O-CB 3.01Å; E744-D748 PolarHBondContact O-N 2.91Å; D748-Y750 PolarHBondContact O-N 3.25Å; D748-K751 WeakPolarHBondContact O-CB 3.47Å; D748-K751 PolarHBondContact O-N 2.89Å; D748-K751 WeakPolarHBondContact OD1-CE 3.42Å; D748-K751 IonicContact OD1-NZ 3Å; D748-K751 PolarHBondContact OD1-NZ 3.47Å; D748-F752 VanDerWaalsContact O-CD2 3.3Å; D748-F752 WeakPolarHBondContact O-CD2 3.38Å; D748-F752 PolarHBondContact O-N 3.06Å
749	A	92.3	Very high	91	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-57.8	-37.6	-178	0	0	0	0	0	111.5	W324 A325 I745 R746 L747 V753	W324-A749 HydrophobicContact CD2-CB 3.67Å; W324-A749 HydrophobicContact CE3-CB 3.83Å; W324-A749 HydrophobicContact CG-CB 4.36Å; W324-A749 HydrophobicContact CH2-CB 3.75Å; W324-A749 HydrophobicContact CZ2-CB 3.58Å; W324-A749 HydrophobicContact CZ3-CB 3.87Å; A325-A749 HydrophobicContact CB-CB 3.84Å; A325-A749 WeakPolarHBondContact CB-O 3.04Å; I745-A749 VanDerWaalsContact O-CB 3.24Å; I745-A749 WeakPolarHBondContact O-CB 3.37Å; I745-A749 PolarHBondContact O-N 2.89Å; R746-A749 PolarHBondContact O-N 2.88Å; L747-A749 PolarHBondContact O-N 2.94Å; A749-V753 VanDerWaalsContact O-CB 3.26Å; A749-V753 WeakPolarHBondContact O-CB 3.48Å; A749-V753 WeakPolarHBondContact O-CG2 3.3Å; A749-V753 PolarHBondContact O-N 3.27Å; A749-V753 VanDerWaalsContact O-N 3.08Å
750	Y	91.1	Very high	90.8	Very high	30 Å²	30	16.7 Å²	16.7	12%	0.118	8%	0.08	C	C	.	.	H	α-helix	trans	-67.3	-45.8	174.2	-177.3	-90.9	0	0	0	112.3	Y321 L666 R746 L747 D748 V753 T754 Q755	Y321-Y750 AromaticContact CE2-CD2 3.93Å; Y321-Y750 HydrophobicContact CE2-CD2 3.93Å; Y321-Y750 AromaticContact CE2-CE2 3.96Å; Y321-Y750 HydrophobicContact CE2-CE2 3.96Å; L666-Y750 HydrophobicContact CD1-CD1 3.79Å; L666-Y750 HydrophobicContact CD1-CE1 3.91Å; R746-Y750 VanDerWaalsContact O-CB 3.24Å; R746-Y750 WeakPolarHBondContact O-CB 3.46Å; R746-Y750 PolarHBondContact O-N 2.89Å; L747-Y750 WeakPolarHBondContact O-CB 3.38Å; L747-Y750 PolarHBondContact O-N 2.94Å; D748-Y750 PolarHBondContact O-N 3.25Å; Y750-V753 PolarHBondContact O-N 2.82Å; Y750-T754 WeakPolarHBondContact CD1-OG1 3.32Å; Y750-T754 HydrophobicContact CD2-CG2 4.09Å; Y750-T754 VanDerWaalsContact CE1-OG1 3.25Å; Y750-T754 WeakPolarHBondContact CE1-OG1 3.46Å; Y750-T754 HydrophobicContact CE2-CG2 3.96Å; Y750-T754 WeakPolarHBondContact O-CB 3.34Å; Y750-T754 PolarHBondContact O-N 2.96Å; Y750-T754 PolarHBondContact O-OG1 3.43Å; Y750-Q755 HydrophobicContact CE1-CG 4.11Å; Y750-Q755 PolarHBondContact OH-NE2 3.32Å
751	K	90.5	Very high	90.7	Very high	2 Å²	2	16.3 Å²	16.3	1%	0.009	8%	0.079	C	C	.	.	I	π-helix	trans	-54.5	-55.4	174.9	176.4	-178.8	71.2	-164.8	0	111.2	E665 E712 L747 D748 V753 Q755 W756	E665-K751 HydrophobicContact CG-CD 4.02Å; E665-K751 VanDerWaalsContact OE1-CD 3.27Å; E665-K751 WeakPolarHBondContact OE1-CD 3.31Å; E665-K751 VanDerWaalsContact OE1-CE 3.29Å; E665-K751 WeakPolarHBondContact OE1-CE 3.42Å; E665-K751 IonicContact OE1-NZ 3.49Å; E665-K751 PolarHBondContact OE1-NZ 2.87Å; E712-K751 WeakPolarHBondContact OE1-CE 2.92Å; E712-K751 IonicContact OE1-NZ 3.59Å; E712-K751 PolarHBondContact OE1-NZ 3.27Å; E712-K751 IonicContact OE2-NZ 3.08Å; E712-K751 PolarHBondContact OE2-NZ 3.09Å; L747-K751 WeakPolarHBondContact O-CB 3.31Å; L747-K751 PolarHBondContact O-N 3.48Å; D748-K751 WeakPolarHBondContact O-CB 3.47Å; D748-K751 PolarHBondContact O-N 2.89Å; D748-K751 WeakPolarHBondContact OD1-CE 3.42Å; D748-K751 IonicContact OD1-NZ 3Å; D748-K751 PolarHBondContact OD1-NZ 3.47Å; K751-V753 PolarHBondContact O-N 2.63Å; K751-Q755 PolarHBondContact O-N 2.89Å; K751-W756 HydrophobicContact CD-CD2 4.35Å; K751-W756 HydrophobicContact CD-CH2 3.94Å; K751-W756 HydrophobicContact CD-CZ2 3.54Å; K751-W756 HydrophobicContact CD-CZ3 4.44Å; K751-W756 HydrophobicContact CG-CD2 3.81Å; K751-W756 HydrophobicContact CG-CE3 4.29Å; K751-W756 HydrophobicContact CG-CG 4.24Å; K751-W756 HydrophobicContact CG-CH2 4.43Å; K751-W756 HydrophobicContact CG-CZ2 3.95Å; K751-W756 PolarHBondContact O-N 2.8Å
752	F	91.2	Very high	90.2	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.097	C	C	.	.	I	π-helix	trans	-63.2	-36	178.7	-82.9	-79.9	0	0	0	114.3	F343 I347 F351 M704 L709 D748 W756 P759	F343-F752 HydrophobicContact CE1-CB 4.4Å; F343-F752 HydrophobicContact CE2-CB 4.47Å; F343-F752 HydrophobicContact CZ-CB 4.01Å; F343-F752 WeakPolarHBondContact CZ-O 3.38Å; I347-F752 HydrophobicContact CD1-CD1 4.45Å; I347-F752 HydrophobicContact CD1-CE1 3.94Å; I347-F752 HydrophobicContact CG1-CE1 4.4Å; I347-F752 HydrophobicContact CG2-CE1 4.31Å; F351-F752 HydrophobicContact CE2-CD2 4.05Å; F351-F752 HydrophobicContact CE2-CE2 4.22Å; F351-F752 AromaticContact CZ-CD2 3.77Å; F351-F752 HydrophobicContact CZ-CD2 3.77Å; F351-F752 HydrophobicContact CZ-CE2 4.01Å; M704-F752 HydrophobicContact SD-CE1 3.85Å; M704-F752 HydrophobicContact SD-CZ 4.42Å; L709-F752 HydrophobicContact CD2-CE1 4.22Å; L709-F752 HydrophobicContact CD2-CE2 4.49Å; L709-F752 HydrophobicContact CD2-CZ 3.53Å; D748-F752 VanDerWaalsContact O-CD2 3.3Å; D748-F752 WeakPolarHBondContact O-CD2 3.38Å; D748-F752 PolarHBondContact O-N 3.06Å; F752-W756 AromaticContact CD1-CE3 3.94Å; F752-W756 HydrophobicContact CD1-CE3 3.94Å; F752-W756 HydrophobicContact CD1-CZ3 4.18Å; F752-W756 AromaticContact CE1-CE3 3.8Å; F752-W756 HydrophobicContact CE1-CE3 3.8Å; F752-W756 AromaticContact CE1-CZ3 3.6Å; F752-W756 HydrophobicContact CE1-CZ3 3.6Å; F752-W756 HydrophobicContact CE2-CZ3 4.04Å; F752-W756 HydrophobicContact CG-CE3 4.39Å; F752-W756 HydrophobicContact CZ-CE3 4.12Å; F752-W756 HydrophobicContact CZ-CH2 4.47Å; F752-W756 AromaticContact CZ-CZ3 3.5Å; F752-W756 HydrophobicContact CZ-CZ3 3.5Å; F752-P759 HydrophobicContact CD1-CG 4.38Å; F752-P759 HydrophobicContact CE1-CG 4.42Å
753	V	91.4	Very high	89.9	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.095	C	C	.	.	I	π-helix	trans	-85.1	-29.8	-177.1	173.7	0	0	0	0	112.4	R317 L320 Y321 W324 A325 F343 A749 Y750 K751	R317-V753 HydrophobicContact CG-CG1 4.15Å; R317-V753 VanDerWaalsContact CZ-O 3.31Å; R317-V753 PolarHBondContact NE-O 3.08Å; R317-V753 PolarHBondContact NH2-O 3.22Å; L320-V753 HydrophobicContact CB-CG2 4.27Å; Y321-V753 HydrophobicContact CD2-CG1 4.07Å; W324-V753 HydrophobicContact CE3-CG2 4.25Å; W324-V753 HydrophobicContact CZ3-CG2 3.89Å; A325-V753 HydrophobicContact CB-CB 4.23Å; A325-V753 HydrophobicContact CB-CG2 4.16Å; F343-V753 HydrophobicContact CE2-CG2 4.2Å; F343-V753 HydrophobicContact CZ-CG2 4.13Å; A749-V753 VanDerWaalsContact O-CB 3.26Å; A749-V753 WeakPolarHBondContact O-CB 3.48Å; A749-V753 WeakPolarHBondContact O-CG2 3.3Å; A749-V753 PolarHBondContact O-N 3.27Å; A749-V753 VanDerWaalsContact O-N 3.08Å; Y750-V753 PolarHBondContact O-N 2.82Å; K751-V753 PolarHBondContact O-N 2.63Å
754	T	88.4	Confident	89.5	Confident	6 Å²	6	16 Å²	16	4%	0.037	8%	0.082	C	C	.	.	I	π-helix	trans	-121.1	-37.5	-167.5	71.9	0	0	0	0	116.4	Y302 Y321 Y750	Y302-T754 HydrophobicContact CD1-CG2 4.29Å; Y302-T754 HydrophobicContact CD2-CG2 3.66Å; Y302-T754 HydrophobicContact CE1-CG2 4.41Å; Y302-T754 HydrophobicContact CE2-CG2 3.77Å; Y302-T754 HydrophobicContact CG-CG2 3.94Å; Y321-T754 HydrophobicContact CD2-CG2 3.82Å; Y321-T754 HydrophobicContact CE2-CG2 3.68Å; Y750-T754 WeakPolarHBondContact CD1-OG1 3.32Å; Y750-T754 HydrophobicContact CD2-CG2 4.09Å; Y750-T754 VanDerWaalsContact CE1-OG1 3.25Å; Y750-T754 WeakPolarHBondContact CE1-OG1 3.46Å; Y750-T754 HydrophobicContact CE2-CG2 3.96Å; Y750-T754 WeakPolarHBondContact O-CB 3.34Å; Y750-T754 PolarHBondContact O-N 2.96Å; Y750-T754 PolarHBondContact O-OG1 3.43Å
755	Q	88.7	Confident	89	Confident	8 Å²	8	18.5 Å²	18.5	4%	0.037	9%	0.092	C	C	.	.	I	π-helix	trans	-102.5	-29	-168.4	-58.1	-49	-43.2	0	0	114.6	P669 L670 N673 Q702 Y750 K751	P669-Q755 HydrophobicContact CB-CB 4.13Å; P669-Q755 HydrophobicContact CG-CB 4.43Å; L670-Q755 HydrophobicContact CD2-CG 4.42Å; N673-Q755 PolarHBondContact ND2-O 3.15Å; N673-Q755 PolarHBondContact ND2-OE1 2.96Å; Q702-Q755 PolarHBondContact N-O 3.43Å; Y750-Q755 HydrophobicContact CE1-CG 4.11Å; Y750-Q755 PolarHBondContact OH-NE2 3.32Å; K751-Q755 PolarHBondContact O-N 2.89Å
756	W	89.5	Confident	88.7	Confident	17 Å²	17	20.1 Å²	20.1	6%	0.064	10%	0.102	C	C	.	.	B	Isolated β-bridge	trans	-94.2	154.4	178.6	-71.1	-4.3	0	0	0	112.5	H298 L701 Q702 M704 E712 K751 F752	H298-W756 PolarHBondContact NE2-O 3.38Å; H298-W756 VanDerWaalsContact NE2-O 3.12Å; L701-W756 WeakPolarHBondContact CD1-O 3.5Å; Q702-W756 CarbonylContact O-C 3.59Å; Q702-W756 WeakPolarHBondContact O-CA 3.42Å; M704-W756 HydrophobicContact CB-CE3 4.08Å; M704-W756 HydrophobicContact CB-CZ3 4.24Å; M704-W756 HydrophobicContact CG-CE3 3.83Å; M704-W756 HydrophobicContact CG-CH2 3.99Å; M704-W756 HydrophobicContact CG-CZ3 3.49Å; M704-W756 VanDerWaalsContact CG-CZ3 3.49Å; M704-W756 HydrophobicContact SD-CE3 4.06Å; M704-W756 HydrophobicContact SD-CZ3 3.71Å; E712-W756 WeakPolarHBondContact OE1-CH2 3.35Å; K751-W756 HydrophobicContact CD-CD2 4.35Å; K751-W756 HydrophobicContact CD-CH2 3.94Å; K751-W756 HydrophobicContact CD-CZ2 3.54Å; K751-W756 HydrophobicContact CD-CZ3 4.44Å; K751-W756 HydrophobicContact CG-CD2 3.81Å; K751-W756 HydrophobicContact CG-CE3 4.29Å; K751-W756 HydrophobicContact CG-CG 4.24Å; K751-W756 HydrophobicContact CG-CH2 4.43Å; K751-W756 HydrophobicContact CG-CZ2 3.95Å; K751-W756 PolarHBondContact O-N 2.8Å; F752-W756 AromaticContact CD1-CE3 3.94Å; F752-W756 HydrophobicContact CD1-CE3 3.94Å; F752-W756 HydrophobicContact CD1-CZ3 4.18Å; F752-W756 AromaticContact CE1-CE3 3.8Å; F752-W756 HydrophobicContact CE1-CE3 3.8Å; F752-W756 AromaticContact CE1-CZ3 3.6Å; F752-W756 HydrophobicContact CE1-CZ3 3.6Å; F752-W756 HydrophobicContact CE2-CZ3 4.04Å; F752-W756 HydrophobicContact CG-CE3 4.39Å; F752-W756 HydrophobicContact CZ-CE3 4.12Å; F752-W756 HydrophobicContact CZ-CH2 4.47Å; F752-W756 AromaticContact CZ-CZ3 3.5Å; F752-W756 HydrophobicContact CZ-CZ3 3.5Å
757	R	91	Very high	88.6	Confident	42 Å²	42	20.1 Å²	20.1	16%	0.158	10%	0.102	C	C	.	.	P	Polyproline II helix	trans	-61.9	149.3	161.4	-68	178	-168.5	166.6	2.9	109.7	D698 Y699 L701 Q702 P759	D698-R757 VanDerWaalsContact O-CG 3.24Å; D698-R757 WeakPolarHBondContact O-CG 3.43Å; D698-R757 PolarHBondContact O-NE 2.8Å; Y699-R757 PolarHBondContact O-NE 3.35Å; Y699-R757 PolarHBondContact O-NH2 2.85Å; L701-R757 HydrophobicContact CB-CG 3.99Å; L701-R757 PolarHBondContact O-NE 3.26Å; L701-R757 PolarHBondContact O-NH2 2.92Å; Q702-R757 WeakPolarHBondContact O-CG 3.15Å; Q702-R757 PolarHBondContact O-N 3.5Å; R757-P759 VanDerWaalsContact O-CD 3.25Å; R757-P759 WeakPolarHBondContact O-CD 3.47Å; R757-P759 VanDerWaalsContact O-N 3.12Å
758	R	92	Very high	88.4	Confident	10 Å²	10	21.2 Å²	21.2	4%	0.038	11%	0.114	C	C	.	.	P	Polyproline II helix	trans	-57.7	117.3	176.3	-168.9	179.5	-170.9	157.9	8	110	P296 L297 H298 E299 Y342	P296-R758 WeakPolarHBondContact CD-O 3.35Å; P296-R758 HydrophobicContact CG-CB 4.23Å; P296-R758 HydrophobicContact CG-CG 4.27Å; P296-R758 WeakPolarHBondContact CG-O 3.42Å; L297-R758 WeakPolarHBondContact O-CD 3.38Å; L297-R758 PolarHBondContact O-NH1 3.11Å; H298-R758 PolarHBondContact NE2-N 3.11Å; H298-R758 VanDerWaalsContact NE2-N 3.11Å; E299-R758 IonicContact OE1-CZ 2.75Å; E299-R758 IonicContact OE1-NH1 2.82Å; E299-R758 PolarHBondContact OE1-NH1 2.94Å; E299-R758 IonicContact OE1-NH2 3.86Å; E299-R758 PolarHBondContact OE1-NH2 3.22Å; E299-R758 VanDerWaalsContact OE1-NH2 3.08Å; Y342-R758 VanDerWaalsContact CD2-NH2 3.32Å; Y342-R758 PolarHBondContact O-NE 3.1Å; Y342-R758 PolarHBondContact O-NH2 2.82Å
759	P	91.1	Very high	88.4	Confident	10 Å²	10	23.9 Å²	23.9	7%	0.065	13%	0.128	C	C	.	.	P	Polyproline II helix	trans	-68.4	157.2	173.3	28.2	-33.9	0	0	0	110.7	F343 I347 M704 F752 R757	F343-P759 HydrophobicContact CD1-CG 3.89Å; F343-P759 HydrophobicContact CE1-CG 4.41Å; I347-P759 HydrophobicContact CD1-CB 3.91Å; I347-P759 HydrophobicContact CD1-CG 3.32Å; M704-P759 HydrophobicContact CE-CB 3.55Å; M704-P759 HydrophobicContact SD-CB 3.73Å; M704-P759 HydrophobicContact SD-CG 4.22Å; F752-P759 HydrophobicContact CD1-CG 4.38Å; F752-P759 HydrophobicContact CE1-CG 4.42Å; R757-P759 VanDerWaalsContact O-CD 3.25Å; R757-P759 WeakPolarHBondContact O-CD 3.47Å; R757-P759 VanDerWaalsContact O-N 3.12Å
760	L	88.5	Confident	88.4	Confident	53 Å²	53	24.5 Å²	24.5	28%	0.277	13%	0.13	S	C	.	.	P	Polyproline II helix	trans	-70.4	131.6	173.9	-170.7	73.5	0	0	0	110	Y121 H265 S762	Y121-L760 HydrophobicContact CE2-CD1 4.23Å; H265-L760 HydrophobicContact CB-CD1 3.76Å; H265-L760 HydrophobicContact CB-CD2 3.84Å; H265-L760 HydrophobicContact CB-CG 4.47Å; H265-L760 WeakPolarHBondContact CD2-CD2 3.47Å; H265-L760 VanDerWaalsContact CG-CD2 3.47Å; L760-S762 PolarHBondContact O-N 3.47Å; L760-S762 VanDerWaalsContact O-N 3.15Å
761	A	88.7	Confident	88.5	Confident	8 Å²	8	24.1 Å²	24.1	7%	0.066	13%	0.128	C	C	.	.			trans	-65.8	113.5	174	0	0	0	0	0	110.8	A258 R262 F343	A258-A761 HydrophobicContact CB-CB 3.66Å; R262-A761 WeakPolarHBondContact CD-O 3.26Å; R262-A761 WeakPolarHBondContact CG-O 3.45Å; F343-A761 WeakPolarHBondContact O-CA 3.35Å
762	S	83.4	Confident	88.7	Confident	55 Å²	55	25.7 Å²	25.7	39%	0.385	15%	0.146	S	C	.	.			trans	-115.2	148.5	176.3	-168.9	0	0	0	0	111.2	E345 K346 L760	E345-S762 PolarHBondContact N-O 2.93Å; K346-S762 WeakPolarHBondContact CB-O 3.35Å; K346-S762 PolarHBondContact N-O 3.38Å; L760-S762 PolarHBondContact O-N 3.47Å; L760-S762 VanDerWaalsContact O-N 3.15Å
763	R	83.4	Confident	88.9	Confident	46 Å²	46	26.1 Å²	26.1	17%	0.174	15%	0.148	C	C	.	.			trans	-86.9	143.3	173.3	-75	-177.8	174.3	167.1	-5.6	109.7	L458	L458-R763 HydrophobicContact CD2-CB 4.09Å; L458-R763 HydrophobicContact CD2-CG 4.18Å
764	A	83	Confident	89.1	Confident	17 Å²	17	26.1 Å²	26.1	14%	0.14	15%	0.148	C	C	.	.			trans	-151	126.8	168.2	0	0	0	0	0	108.3	K346 L458	K346-A764 HydrophobicContact CB-CB 3.98Å; K346-A764 HydrophobicContact CG-CB 3.98Å; L458-A764 WeakPolarHBondContact CD1-O 3.27Å
765	K	80.4	Confident	89.3	Confident	58 Å²	58	29.1 Å²	29.1	25%	0.252	16%	0.161	S	C	.	.	S	Bend	trans	-73.9	-27.2	180	66.9	-175.9	-178.8	-176.9	0	113.3	L458 W461 E463	L458-K765 HydrophobicContact CB-CB 4.48Å; W461-K765 HydrophobicContact CE3-CB 4.25Å; W461-K765 HydrophobicContact CE3-CD 4.27Å; W461-K765 HydrophobicContact CE3-CG 4.39Å; W461-K765 HydrophobicContact CZ3-CD 4.45Å; W461-K765 HydrophobicContact CZ3-CG 4.44Å; E463-K765 IonicContact OE1-NZ 2.79Å; E463-K765 PolarHBondContact OE1-NZ 3.31Å
766	D	85.4	Confident	89.6	Confident	48 Å²	48	30.4 Å²	30.4	26%	0.257	18%	0.177	S	C	.	.	S	Bend	trans	-149.9	-175.9	-178.3	58.2	42.6	0	0	0	110.3	L349 G768	L349-D766 VanDerWaalsContact CD2-O 3.29Å; L349-D766 WeakPolarHBondContact CD2-O 3.47Å; D766-G768 PolarHBondContact O-N 3.06Å; D766-G768 WeakPolarHBondContact OD1-CA 3.37Å; D766-G768 PolarHBondContact OD1-N 2.95Å
767	I	87.6	Confident	89.9	Confident	9 Å²	9	29.9 Å²	29.9	5%	0.046	18%	0.175	C	C	.	.			trans	-83.4	12.4	179.6	65.1	173.4	0	0	0	113	L349 W353 W445 Y713 W770 L774	L349-I767 HydrophobicContact CD2-CG2 4.06Å; L349-I767 HydrophobicContact CG-CG2 4.14Å; W353-I767 HydrophobicContact CB-CG2 4.39Å; W445-I767 HydrophobicContact CZ2-CG2 3.98Å; Y713-I767 HydrophobicContact CE1-CB 4.1Å; Y713-I767 HydrophobicContact CE1-CG2 4Å; Y713-I767 WeakPolarHBondContact OH-CG2 3.16Å; I767-W770 HydrophobicContact CB-CB 4.49Å; I767-W770 HydrophobicContact CD1-CB 4.04Å; I767-W770 HydrophobicContact CG1-CB 4.16Å; I767-W770 WeakPolarHBondContact O-CB 3.07Å; I767-L774 HydrophobicContact CD1-CD1 4.24Å
768	G	86.7	Confident	90	Very high	26 Å²	26	28.1 Å²	28.1	27%	0.268	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.2	-151.1	-175.1	0	0	0	0	0	113.7	D766 W770 Y771	D766-G768 PolarHBondContact O-N 3.06Å; D766-G768 WeakPolarHBondContact OD1-CA 3.37Å; D766-G768 PolarHBondContact OD1-N 2.95Å; G768-W770 PolarHBondContact O-N 3.45Å; G768-Y771 PolarHBondContact O-N 3.33Å
769	I	91.1	Very high	90.1	Very high	56 Å²	56	31.1 Å²	31.1	29%	0.287	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-22.1	-177.1	-169.8	58.6	0	0	0	113.9	N590 T593 Y771 G772 I773	N590-I769 HydrophobicContact CB-CB 4.17Å; N590-I769 HydrophobicContact CB-CG2 4.18Å; N590-I769 VanDerWaalsContact OD1-CB 3.28Å; N590-I769 WeakPolarHBondContact OD1-CB 3.25Å; N590-I769 WeakPolarHBondContact OD1-CG2 3.39Å; N590-I769 PolarHBondContact OD1-N 2.95Å; T593-I769 HydrophobicContact CG2-CG2 3.41Å; T593-I769 VanDerWaalsContact CG2-CG2 3.41Å; I769-Y771 PolarHBondContact O-N 3.39Å; I769-Y771 VanDerWaalsContact O-N 3.13Å; I769-G772 PolarHBondContact O-N 2.96Å; I769-I773 HydrophobicContact CG1-CD1 4.17Å; I769-I773 HydrophobicContact CG1-CG1 4.39Å; I769-I773 HydrophobicContact CG2-CD1 4.18Å; I769-I773 PolarHBondContact O-N 2.91Å
770	W	94.1	Very high	90.2	Very high	13 Å²	13	33.4 Å²	33.4	5%	0.049	20%	0.198	C	C	.	.	H	α-helix	trans	-54.2	-30.8	176.6	-66.8	131	0	0	0	113.8	T593 F597 F710 Y713 L714 I717 I767 G768 I773 L774	T593-W770 HydrophobicContact CG2-CD2 3.66Å; T593-W770 VanDerWaalsContact CG2-CE2 3.44Å; T593-W770 HydrophobicContact CG2-CE3 3.74Å; T593-W770 HydrophobicContact CG2-CH2 3.57Å; T593-W770 HydrophobicContact CG2-CZ2 3.44Å; T593-W770 VanDerWaalsContact CG2-CZ2 3.44Å; T593-W770 HydrophobicContact CG2-CZ3 3.7Å; F597-W770 HydrophobicContact CB-CZ3 4.21Å; F597-W770 HydrophobicContact CD2-CZ3 4.26Å; F597-W770 HydrophobicContact CG-CZ3 4.48Å; F710-W770 HydrophobicContact CD2-CH2 4.02Å; F710-W770 AromaticContact CD2-CZ2 3.57Å; F710-W770 HydrophobicContact CD2-CZ2 3.57Å; F710-W770 AromaticContact CE2-CH2 3.55Å; F710-W770 HydrophobicContact CE2-CH2 3.55Å; F710-W770 AromaticContact CE2-CZ2 3.62Å; F710-W770 HydrophobicContact CE2-CZ2 3.62Å; F710-W770 HydrophobicContact CZ-CH2 4.33Å; F710-W770 WeakPolarHBondContact O-CZ2 3.13Å; Y713-W770 AromaticContact CD1-CD1 3.93Å; Y713-W770 HydrophobicContact CD1-CG 4.4Å; Y713-W770 AromaticContact CD2-CD1 3.88Å; Y713-W770 AromaticContact CD2-NE1 3.66Å; Y713-W770 AromaticContact CG-CD1 3.61Å; Y713-W770 HydrophobicContact CG-CG 4.32Å; Y713-W770 AromaticContact CG-NE1 3.5Å; L714-W770 HydrophobicContact CB-CH2 3.83Å; L714-W770 HydrophobicContact CB-CZ2 4.37Å; L714-W770 HydrophobicContact CD1-CH2 4.02Å; L714-W770 HydrophobicContact CD1-CZ3 4.45Å; I717-W770 HydrophobicContact CD1-CB 3.61Å; I717-W770 HydrophobicContact CD1-CD2 3.39Å; I717-W770 HydrophobicContact CD1-CE3 3.23Å; I717-W770 HydrophobicContact CD1-CG 3.6Å; I717-W770 HydrophobicContact CD1-CZ3 3.92Å; I717-W770 HydrophobicContact CG1-CE3 4.45Å; I717-W770 HydrophobicContact CG2-CE3 4.39Å; I717-W770 HydrophobicContact CG2-CZ3 4.44Å; I767-W770 HydrophobicContact CB-CB 4.49Å; I767-W770 HydrophobicContact CD1-CB 4.04Å; I767-W770 HydrophobicContact CG1-CB 4.16Å; I767-W770 WeakPolarHBondContact O-CB 3.07Å; G768-W770 PolarHBondContact O-N 3.45Å; W770-I773 HydrophobicContact CD2-CD1 4.46Å; W770-I773 HydrophobicContact CE3-CB 4.42Å; W770-I773 HydrophobicContact CE3-CD1 3.55Å; W770-I773 HydrophobicContact CE3-CG2 4.34Å; W770-I773 HydrophobicContact CZ3-CD1 3.91Å; W770-I773 PolarHBondContact O-N 3.36Å; W770-L774 VanDerWaalsContact O-CG 3.3Å; W770-L774 WeakPolarHBondContact O-CG 3.23Å; W770-L774 PolarHBondContact O-N 3.41Å
771	Y	93.1	Very high	90.5	Very high	22 Å²	22	31 Å²	31	9%	0.086	19%	0.185	C	C	.	.	H	α-helix	trans	-62.9	-47.2	173.2	178	-88.2	0	0	0	112	L442 K446 G768 I769 I773 L774 E775	L442-Y771 HydrophobicContact CB-CE2 4.28Å; L442-Y771 HydrophobicContact CD2-CD2 4.45Å; L442-Y771 HydrophobicContact CD2-CE2 4.02Å; K446-Y771 HydrophobicContact CD-CE2 4.3Å; K446-Y771 WeakPolarHBondContact CD-OH 3.24Å; K446-Y771 VanDerWaalsContact CE-OH 3.27Å; K446-Y771 WeakPolarHBondContact CE-OH 3.19Å; K446-Y771 HydrophobicContact CG-CE2 3.78Å; G768-Y771 PolarHBondContact O-N 3.33Å; I769-Y771 PolarHBondContact O-N 3.39Å; I769-Y771 VanDerWaalsContact O-N 3.13Å; Y771-I773 VanDerWaalsContact C-N 3.32Å; Y771-I773 PolarHBondContact O-N 3.3Å; Y771-L774 PolarHBondContact O-N 3.44Å; Y771-E775 HydrophobicContact CE1-CB 4.46Å; Y771-E775 WeakPolarHBondContact CE1-OE2 3.24Å; Y771-E775 PolarHBondContact O-N 3.44Å
772	G	94.1	Very high	90.8	Very high	36 Å²	36	30.7 Å²	30.7	37%	0.371	18%	0.182	S	C	.	.	H	α-helix	trans	-68.1	-32.6	178.8	0	0	0	0	0	112.7	I769 E775 G776	I769-G772 PolarHBondContact O-N 2.96Å; G772-E775 PolarHBondContact O-N 3.32Å; G772-G776 PolarHBondContact O-N 3.47Å
773	I	95.7	Very high	91.3	Very high	9 Å²	9	30.4 Å²	30.4	5%	0.046	18%	0.176	C	C	.	.	H	α-helix	trans	-63.6	-47.6	172.6	-71.9	166.7	0	0	0	110.9	T593 F597 I717 I769 W770 Y771 E775 G776 I777	T593-I773 HydrophobicContact CG2-CD1 4.1Å; F597-I773 HydrophobicContact CB-CD1 4Å; F597-I773 HydrophobicContact CD1-CD1 4.07Å; F597-I773 HydrophobicContact CD1-CG1 4.04Å; F597-I773 HydrophobicContact CD1-CG2 3.79Å; F597-I773 HydrophobicContact CD2-CG2 3.73Å; F597-I773 HydrophobicContact CE1-CG1 4.45Å; F597-I773 HydrophobicContact CE1-CG2 3.63Å; F597-I773 HydrophobicContact CE2-CG2 3.56Å; F597-I773 HydrophobicContact CG-CD1 3.95Å; F597-I773 HydrophobicContact CG-CG1 4.35Å; F597-I773 HydrophobicContact CG-CG2 3.85Å; F597-I773 HydrophobicContact CZ-CG2 3.52Å; I717-I773 HydrophobicContact CG2-CG2 3.73Å; I769-I773 HydrophobicContact CG1-CD1 4.17Å; I769-I773 HydrophobicContact CG1-CG1 4.39Å; I769-I773 HydrophobicContact CG2-CD1 4.18Å; I769-I773 PolarHBondContact O-N 2.91Å; W770-I773 HydrophobicContact CD2-CD1 4.46Å; W770-I773 HydrophobicContact CE3-CB 4.42Å; W770-I773 HydrophobicContact CE3-CD1 3.55Å; W770-I773 HydrophobicContact CE3-CG2 4.34Å; W770-I773 HydrophobicContact CZ3-CD1 3.91Å; W770-I773 PolarHBondContact O-N 3.36Å; Y771-I773 VanDerWaalsContact C-N 3.32Å; Y771-I773 PolarHBondContact O-N 3.3Å; I773-E775 VanDerWaalsContact C-N 3.32Å; I773-E775 PolarHBondContact O-N 3.11Å; I773-G776 PolarHBondContact O-N 3.01Å; I773-I777 HydrophobicContact CG2-CD1 4.03Å; I773-I777 WeakPolarHBondContact O-CG1 2.79Å; I773-I777 PolarHBondContact O-N 3.15Å
774	L	94.9	Very high	91.9	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-62.1	-38	175.8	-72.5	165.6	0	0	0	112.5	W353 L442 I717 F720 I767 W770 Y771 G778	W353-L774 HydrophobicContact CZ2-CD1 3.86Å; W353-L774 HydrophobicContact CZ2-CD2 4.46Å; L442-L774 HydrophobicContact CD2-CB 3.85Å; L442-L774 HydrophobicContact CD2-CD1 4.38Å; I717-L774 HydrophobicContact CD1-CG 4.49Å; I717-L774 HydrophobicContact CG1-CD2 4.02Å; I717-L774 HydrophobicContact CG1-CG 4.27Å; I717-L774 HydrophobicContact CG2-CD2 4.16Å; F720-L774 HydrophobicContact CB-CD2 3.94Å; F720-L774 HydrophobicContact CD1-CD2 3.29Å; F720-L774 HydrophobicContact CD2-CD2 4.22Å; F720-L774 HydrophobicContact CE1-CD2 3.75Å; F720-L774 HydrophobicContact CG-CD2 3.55Å; F720-L774 HydrophobicContact CZ-CD2 4.39Å; I767-L774 HydrophobicContact CD1-CD1 4.24Å; W770-L774 VanDerWaalsContact O-CG 3.3Å; W770-L774 WeakPolarHBondContact O-CG 3.23Å; W770-L774 PolarHBondContact O-N 3.41Å; Y771-L774 PolarHBondContact O-N 3.44Å; L774-G778 PolarHBondContact O-N 3.02Å
775	E	93.4	Very high	92.4	Very high	69 Å²	69	27.7 Å²	27.7	32%	0.322	16%	0.163	S	C	.	.	H	α-helix	trans	-66	-41.1	175.2	179.7	157.9	-135.3	0	0	112.4	L442 Y771 G772 I773 G778 I779	L442-E775 HydrophobicContact CD1-CB 4.29Å; Y771-E775 HydrophobicContact CE1-CB 4.46Å; Y771-E775 WeakPolarHBondContact CE1-OE2 3.24Å; Y771-E775 PolarHBondContact O-N 3.44Å; G772-E775 PolarHBondContact O-N 3.32Å; I773-E775 VanDerWaalsContact C-N 3.32Å; I773-E775 PolarHBondContact O-N 3.11Å; E775-G778 CarbonylContact O-C 3.57Å; E775-G778 WeakPolarHBondContact O-CA 3.35Å; E775-G778 PolarHBondContact O-N 3.31Å; E775-I779 WeakPolarHBondContact O-CG1 3.38Å; E775-I779 PolarHBondContact O-N 3.44Å
776	G	94.4	Very high	93.1	Very high	35 Å²	35	25 Å²	25	36%	0.361	15%	0.151	S	C	.	.	H	α-helix	trans	-63.2	-44.6	173	0	0	0	0	0	113	G772 I773 G778 I779 L780	G772-G776 PolarHBondContact O-N 3.47Å; I773-G776 PolarHBondContact O-N 3.01Å; G776-G778 VanDerWaalsContact C-N 3.28Å; G776-G778 PolarHBondContact O-N 3.14Å; G776-I779 PolarHBondContact O-N 3.3Å; G776-L780 PolarHBondContact O-N 3.34Å
777	I	95.1	Very high	93.5	Very high	6 Å²	6	26.1 Å²	26.1	3%	0.031	15%	0.154	C	C	.	.	H	α-helix	trans	-57	-44	170.5	-70.3	166.9	0	0	0	110.3	F597 I717 F720 T724 I725 I773 I779 L780 S781	F597-I777 HydrophobicContact CE2-CD1 4.03Å; F597-I777 HydrophobicContact CZ-CD1 3.88Å; F597-I777 HydrophobicContact CZ-CG1 4.1Å; I717-I777 HydrophobicContact CG2-CD1 3.78Å; F720-I777 HydrophobicContact CD1-CB 4.37Å; F720-I777 HydrophobicContact CD1-CG2 3.72Å; F720-I777 HydrophobicContact CE1-CB 4.33Å; F720-I777 HydrophobicContact CE1-CG2 3.79Å; T724-I777 WeakPolarHBondContact OG1-CG2 3.17Å; I725-I777 HydrophobicContact CD1-CG2 4.07Å; I725-I777 HydrophobicContact CG1-CG2 4.07Å; I773-I777 HydrophobicContact CG2-CD1 4.03Å; I773-I777 WeakPolarHBondContact O-CG1 2.79Å; I773-I777 PolarHBondContact O-N 3.15Å; I777-I779 PolarHBondContact O-N 3.17Å; I777-L780 PolarHBondContact O-N 3.36Å; I777-S781 VanDerWaalsContact O-CB 3.24Å; I777-S781 WeakPolarHBondContact O-CB 3.29Å; I777-S781 PolarHBondContact O-N 3.12Å
778	G	93.6	Very high	93.8	Very high	5 Å²	5	25.8 Å²	25.8	5%	0.052	15%	0.152	C	C	.	.	H	α-helix	trans	-69.9	-7.3	176.4	0	0	0	0	0	115.5	L774 E775 G776 K899	L774-G778 PolarHBondContact O-N 3.02Å; E775-G778 CarbonylContact O-C 3.57Å; E775-G778 WeakPolarHBondContact O-CA 3.35Å; E775-G778 PolarHBondContact O-N 3.31Å; G776-G778 VanDerWaalsContact C-N 3.28Å; G776-G778 PolarHBondContact O-N 3.14Å; G778-K899 PolarHBondContact O-NZ 2.98Å
779	I	93.3	Very high	94.1	Very high	73 Å²	73	24.7 Å²	24.7	37%	0.374	14%	0.14	S	C	.	.	H	α-helix	trans	-92.8	-50.5	166.4	-69	161.7	0	0	0	109.1	E775 G776 I777 S781 V782 I783 F896	E775-I779 WeakPolarHBondContact O-CG1 3.38Å; E775-I779 PolarHBondContact O-N 3.44Å; G776-I779 PolarHBondContact O-N 3.3Å; I777-I779 PolarHBondContact O-N 3.17Å; I779-S781 PolarHBondContact O-N 3.38Å; I779-V782 PolarHBondContact O-N 3.37Å; I779-V782 VanDerWaalsContact O-N 3.12Å; I779-I783 HydrophobicContact CG2-CD1 4.31Å; I779-F896 HydrophobicContact CG2-CE1 4.18Å; I779-F896 HydrophobicContact CG2-CZ 3.95Å
780	L	94.3	Very high	94.2	Very high	58 Å²	58	22 Å²	22	30%	0.304	13%	0.126	S	C	.	.	H	α-helix	trans	-59.3	-32	179.3	-178.1	59.2	0	0	0	112.7	F601 I725 G776 I777 I783 T784	F601-L780 HydrophobicContact CE1-CD2 3.88Å; F601-L780 HydrophobicContact CE2-CD2 4.45Å; F601-L780 HydrophobicContact CZ-CD2 3.48Å; F601-L780 VanDerWaalsContact CZ-CD2 3.48Å; I725-L780 HydrophobicContact CD1-CD2 4.41Å; G776-L780 PolarHBondContact O-N 3.34Å; I777-L780 PolarHBondContact O-N 3.36Å; L780-I783 PolarHBondContact O-N 2.83Å; L780-T784 VanDerWaalsContact O-CB 3.27Å; L780-T784 WeakPolarHBondContact O-CB 3.25Å; L780-T784 PolarHBondContact O-N 3.02Å; L780-T784 PolarHBondContact O-OG1 2.99Å
781	S	94.5	Very high	94	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.007	14%	0.137	C	C	.	.	H	α-helix	trans	-61.9	-41.8	175	163.6	0	0	0	0	113	T724 I777 I779 T784 N785	T724-S781 VanDerWaalsContact C-OG 3.3Å; T724-S781 WeakPolarHBondContact O-CB 3.39Å; T724-S781 PolarHBondContact O-OG 3.48Å; I777-S781 VanDerWaalsContact O-CB 3.24Å; I777-S781 WeakPolarHBondContact O-CB 3.29Å; I777-S781 PolarHBondContact O-N 3.12Å; I779-S781 PolarHBondContact O-N 3.38Å; S781-T784 PolarHBondContact O-N 2.93Å; S781-N785 WeakPolarHBondContact O-CB 3.47Å; S781-N785 PolarHBondContact O-N 3.3Å; S781-N785 PolarHBondContact O-ND2 2.93Å; S781-N785 PolarHBondContact OG-ND2 2.94Å
782	V	94.6	Very high	93.9	Very high	3 Å²	3	23.3 Å²	23.3	2%	0.018	14%	0.136	C	C	.	.	H	α-helix	trans	-61.8	-49.6	178.9	177.4	0	0	0	0	110	A435 I779 A786 V895 F896	A435-V782 HydrophobicContact CB-CG2 4.05Å; I779-V782 PolarHBondContact O-N 3.37Å; I779-V782 VanDerWaalsContact O-N 3.12Å; V782-A786 WeakPolarHBondContact O-CB 3.46Å; V782-A786 PolarHBondContact O-N 3Å; V782-A786 VanDerWaalsContact O-N 3.14Å; V782-V895 HydrophobicContact CB-CG1 4.31Å; V782-V895 HydrophobicContact CG1-CB 3.87Å; V782-V895 HydrophobicContact CG1-CG1 3.63Å; V782-V895 HydrophobicContact CG2-CG1 3.71Å; V782-F896 HydrophobicContact CB-CE1 3.89Å; V782-F896 HydrophobicContact CB-CZ 3.86Å; V782-F896 HydrophobicContact CG1-CD1 4.41Å; V782-F896 HydrophobicContact CG1-CD2 4.46Å; V782-F896 HydrophobicContact CG1-CE1 4.09Å; V782-F896 HydrophobicContact CG1-CE2 4.17Å; V782-F896 HydrophobicContact CG1-CZ 3.96Å; V782-F896 HydrophobicContact CG2-CD1 4.38Å; V782-F896 HydrophobicContact CG2-CE1 3.88Å; V782-F896 HydrophobicContact CG2-CZ 4.37Å
783	I	95	Very high	93.7	Very high	49 Å²	49	21.9 Å²	21.9	25%	0.251	12%	0.12	S	C	.	.	H	α-helix	trans	-62.2	-49.6	179.6	-59.8	170.6	0	0	0	110.1	I779 L780 N785 A786 F787 F896	I779-I783 HydrophobicContact CG2-CD1 4.31Å; L780-I783 PolarHBondContact O-N 2.83Å; I783-N785 PolarHBondContact O-N 3.29Å; I783-A786 WeakPolarHBondContact O-CB 3.44Å; I783-A786 PolarHBondContact O-N 3.29Å; I783-F787 HydrophobicContact CG2-CD2 3.79Å; I783-F787 HydrophobicContact CG2-CE2 3.71Å; I783-F787 VanDerWaalsContact O-CD2 3.28Å; I783-F787 WeakPolarHBondContact O-CD2 3.44Å; I783-F787 PolarHBondContact O-N 2.96Å; I783-F896 HydrophobicContact CD1-CZ 4.43Å; I783-F896 HydrophobicContact CG1-CE2 4.31Å; I783-F896 HydrophobicContact CG1-CZ 4.13Å
784	T	94.8	Very high	93.4	Very high	4 Å²	4	22.4 Å²	22.4	3%	0.025	12%	0.122	C	C	.	.	H	α-helix	trans	-64.4	-44.4	-176.1	-53.8	0	0	0	0	112	F609 F613 I725 F726 L780 S781 A786 F787 V788	F609-T784 HydrophobicContact CE1-CG2 3.79Å; F613-T784 HydrophobicContact CE2-CG2 4.18Å; F613-T784 HydrophobicContact CZ-CG2 3.88Å; I725-T784 HydrophobicContact CG2-CG2 3.63Å; I725-T784 WeakPolarHBondContact O-CB 3.33Å; I725-T784 VanDerWaalsContact O-CG2 3.32Å; I725-T784 WeakPolarHBondContact O-CG2 3.44Å; F726-T784 HydrophobicContact CD1-CG2 3.95Å; F726-T784 HydrophobicContact CE1-CG2 3.84Å; L780-T784 VanDerWaalsContact O-CB 3.27Å; L780-T784 WeakPolarHBondContact O-CB 3.25Å; L780-T784 PolarHBondContact O-N 3.02Å; L780-T784 PolarHBondContact O-OG1 2.99Å; S781-T784 PolarHBondContact O-N 2.93Å; T784-A786 VanDerWaalsContact C-N 3.34Å; T784-A786 PolarHBondContact O-N 3.02Å; T784-F787 PolarHBondContact O-N 3.47Å; T784-V788 HydrophobicContact CG2-CG2 4.35Å; T784-V788 WeakPolarHBondContact O-CG2 3.32Å; T784-V788 PolarHBondContact O-N 2.92Å
785	N	94.2	Very high	93.2	Very high	2 Å²	2	24.6 Å²	24.6	1%	0.011	13%	0.132	C	C	.	.	H	α-helix	trans	-65.4	-36.2	176.9	-73.1	-71.2	0	0	0	112.2	A431 T724 I725 V727 A728 S781 I783 V788 I789	A431-N785 HydrophobicContact CB-CB 4.31Å; T724-N785 PolarHBondContact O-ND2 2.92Å; I725-N785 PolarHBondContact O-ND2 3.5Å; V727-N785 PolarHBondContact N-OD1 3.24Å; A728-N785 HydrophobicContact CB-CB 4.3Å; A728-N785 VanDerWaalsContact CB-OD1 3.28Å; A728-N785 WeakPolarHBondContact CB-OD1 3.41Å; A728-N785 PolarHBondContact N-OD1 3.08Å; S781-N785 WeakPolarHBondContact O-CB 3.47Å; S781-N785 PolarHBondContact O-N 3.3Å; S781-N785 PolarHBondContact O-ND2 2.93Å; S781-N785 PolarHBondContact OG-ND2 2.94Å; I783-N785 PolarHBondContact O-N 3.29Å; N785-V788 PolarHBondContact O-N 3Å; N785-I789 WeakPolarHBondContact O-CB 3.45Å; N785-I789 WeakPolarHBondContact O-CD1 3.4Å; N785-I789 VanDerWaalsContact O-CG1 3.28Å; N785-I789 WeakPolarHBondContact O-CG1 3.27Å; N785-I789 PolarHBondContact O-N 3.36Å
786	A	94.8	Very high	93.1	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-59.6	-46.3	173.8	0	0	0	0	0	111.4	V782 I783 T784 A790 I888 F891	V782-A786 WeakPolarHBondContact O-CB 3.46Å; V782-A786 PolarHBondContact O-N 3Å; V782-A786 VanDerWaalsContact O-N 3.14Å; I783-A786 WeakPolarHBondContact O-CB 3.44Å; I783-A786 PolarHBondContact O-N 3.29Å; T784-A786 VanDerWaalsContact C-N 3.34Å; T784-A786 PolarHBondContact O-N 3.02Å; A786-A790 VanDerWaalsContact O-CB 3.27Å; A786-A790 WeakPolarHBondContact O-CB 3.36Å; A786-A790 PolarHBondContact O-N 3.31Å; A786-I888 HydrophobicContact CB-CG2 4.34Å; A786-F891 HydrophobicContact CB-CD1 3.61Å; A786-F891 HydrophobicContact CB-CE1 4.1Å; A786-F891 HydrophobicContact CB-CG 4.31Å
787	F	94.3	Very high	93	Very high	73 Å²	73	19.9 Å²	19.9	32%	0.32	10%	0.101	S	C	.	.	H	α-helix	trans	-66.9	-38.3	175.5	-80.3	-70.1	0	0	0	113.2	F613 I783 T784 A790 I791 I888	F613-F787 HydrophobicContact CD1-CB 4.37Å; F613-F787 HydrophobicContact CE1-CB 3.53Å; F613-F787 HydrophobicContact CE2-CB 4.43Å; F613-F787 HydrophobicContact CZ-CB 3.56Å; I783-F787 HydrophobicContact CG2-CD2 3.79Å; I783-F787 HydrophobicContact CG2-CE2 3.71Å; I783-F787 VanDerWaalsContact O-CD2 3.28Å; I783-F787 WeakPolarHBondContact O-CD2 3.44Å; I783-F787 PolarHBondContact O-N 2.96Å; T784-F787 PolarHBondContact O-N 3.47Å; F787-A790 PolarHBondContact O-N 3.02Å; F787-I791 HydrophobicContact CD1-CD1 3.73Å; F787-I791 HydrophobicContact CD1-CG1 4.4Å; F787-I791 HydrophobicContact CE1-CD1 4.37Å; F787-I791 WeakPolarHBondContact O-CB 3.47Å; F787-I791 PolarHBondContact O-N 3.21Å; F787-I888 HydrophobicContact CD1-CD1 3.7Å; F787-I888 HydrophobicContact CD1-CG1 4.48Å; F787-I888 HydrophobicContact CE1-CD1 3.69Å; F787-I888 HydrophobicContact CZ-CG2 4.37Å
788	V	93.6	Very high	92.8	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.006	11%	0.107	C	C	.	.	I	π-helix	trans	-64.1	-45.2	176.8	168.2	0	0	0	0	111.3	F613 L643 L646 F726 A728 A729 T784 N785 A790 T792 S793	F613-V788 HydrophobicContact CE1-CG2 3.78Å; F613-V788 HydrophobicContact CZ-CG2 3.9Å; L643-V788 HydrophobicContact CD1-CG1 3.94Å; L646-V788 HydrophobicContact CD2-CG1 4.42Å; L646-V788 HydrophobicContact CD2-CG2 4.48Å; F726-V788 HydrophobicContact CD1-CG2 4.34Å; A728-V788 HydrophobicContact CB-CG1 4.15Å; A729-V788 HydrophobicContact CB-CG1 4.27Å; T784-V788 HydrophobicContact CG2-CG2 4.35Å; T784-V788 WeakPolarHBondContact O-CG2 3.32Å; T784-V788 PolarHBondContact O-N 2.92Å; N785-V788 PolarHBondContact O-N 3Å; V788-A790 VanDerWaalsContact C-N 3.35Å; V788-T792 WeakPolarHBondContact O-CB 3.36Å; V788-T792 PolarHBondContact O-N 3.13Å; V788-T792 VanDerWaalsContact O-N 3.07Å; V788-S793 PolarHBondContact O-N 3.42Å
789	I	93.1	Very high	92.6	Very high	3 Å²	3	24.4 Å²	24.4	2%	0.015	12%	0.121	C	C	.	.	I	π-helix	trans	-68.5	-34.7	178.8	-64.3	164.2	0	0	0	111.4	V428 A431 A728 N785 F795 F887 F891	V428-I789 HydrophobicContact CG1-CD1 4.39Å; V428-I789 HydrophobicContact CG2-CD1 4.48Å; V428-I789 HydrophobicContact CG2-CG2 3.92Å; A431-I789 HydrophobicContact CB-CD1 3.78Å; A728-I789 HydrophobicContact CB-CD1 3.94Å; A728-I789 HydrophobicContact CB-CG1 3.71Å; N785-I789 WeakPolarHBondContact O-CB 3.45Å; N785-I789 WeakPolarHBondContact O-CD1 3.4Å; N785-I789 VanDerWaalsContact O-CG1 3.28Å; N785-I789 WeakPolarHBondContact O-CG1 3.27Å; N785-I789 PolarHBondContact O-N 3.36Å; I789-F795 HydrophobicContact CG2-CD1 4.14Å; I789-F887 HydrophobicContact CB-CE1 3.91Å; I789-F887 HydrophobicContact CB-CZ 4.33Å; I789-F887 HydrophobicContact CG2-CD1 4.46Å; I789-F887 HydrophobicContact CG2-CE1 3.52Å; I789-F887 HydrophobicContact CG2-CZ 3.57Å; I789-F891 HydrophobicContact CD1-CE2 4.07Å; I789-F891 HydrophobicContact CD1-CZ 4.24Å
790	A	93.2	Very high	92.5	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.109	C	C	.	.	I	π-helix	trans	-78.4	-50.1	179	0	0	0	0	0	113.1	A786 F787 V788 R884 F887 I888	A786-A790 VanDerWaalsContact O-CB 3.27Å; A786-A790 WeakPolarHBondContact O-CB 3.36Å; A786-A790 PolarHBondContact O-N 3.31Å; F787-A790 PolarHBondContact O-N 3.02Å; V788-A790 VanDerWaalsContact C-N 3.35Å; A790-R884 HydrophobicContact CB-CB 4.4Å; A790-R884 WeakPolarHBondContact O-CD 3.17Å; A790-R884 WeakPolarHBondContact O-CG 3.46Å; A790-R884 PolarHBondContact O-NE 3.38Å; A790-F887 HydrophobicContact CB-CD1 4.23Å; A790-I888 HydrophobicContact CB-CD1 3.71Å; A790-I888 HydrophobicContact CB-CG1 3.52Å
791	I	90.8	Very high	92.4	Very high	53 Å²	53	20 Å²	20	27%	0.272	10%	0.098	S	C	.	.	I	π-helix	trans	-93.3	-50.9	-169	-58.7	-174.9	0	0	0	111.7	F787 R884	F787-I791 HydrophobicContact CD1-CD1 3.73Å; F787-I791 HydrophobicContact CD1-CG1 4.4Å; F787-I791 HydrophobicContact CE1-CD1 4.37Å; F787-I791 WeakPolarHBondContact O-CB 3.47Å; F787-I791 PolarHBondContact O-N 3.21Å; I791-R884 PolarHBondContact O-NH2 3.11Å
792	T	90.4	Very high	92.1	Very high	10 Å²	10	20.2 Å²	20.2	6%	0.061	10%	0.099	C	C	.	.	I	π-helix	trans	-85.6	-32.5	-168.5	-33.3	0	0	0	0	113.2	A612 C642 L643 L646 V788	A612-T792 WeakPolarHBondContact O-CG2 3.47Å; A612-T792 PolarHBondContact O-OG1 3.22Å; C642-T792 HydrophobicContact CB-CG2 4.27Å; L643-T792 HydrophobicContact CB-CG2 4.47Å; L643-T792 HydrophobicContact CD1-CG2 3.89Å; L646-T792 HydrophobicContact CD2-CG2 4.27Å; V788-T792 WeakPolarHBondContact O-CB 3.36Å; V788-T792 PolarHBondContact O-N 3.13Å; V788-T792 VanDerWaalsContact O-N 3.07Å
793	S	90.6	Very high	91.8	Very high	5 Å²	5	25.5 Å²	25.5	4%	0.035	12%	0.12	C	C	.	.	S	Bend	trans	-83.5	151.2	176.1	159.6	0	0	0	0	112.5	D423 V788 F795	D423-S793 VanDerWaalsContact CG-OG 3.32Å; D423-S793 WeakPolarHBondContact OD1-CB 3.48Å; D423-S793 PolarHBondContact OD1-OG 2.94Å; D423-S793 PolarHBondContact OD2-OG 2.82Å; V788-S793 PolarHBondContact O-N 3.42Å; S793-F795 VanDerWaalsContact C-N 3.26Å; S793-F795 PolarHBondContact O-N 2.81Å; S793-F795 VanDerWaalsContact OG-CB 3.23Å; S793-F795 WeakPolarHBondContact OG-CB 3.36Å; S793-F795 PolarHBondContact OG-N 2.82Å
794	D	88.4	Confident	91.5	Very high	20 Å²	20	29.4 Å²	29.4	11%	0.107	14%	0.135	C	C	.	.	S	Bend	trans	-85.4	7.9	172.9	-94	19.6	0	0	0	113	D423 P797 R798 Y822 R859	D423-D794 PolarHBondContact OD2-N 3.5Å; D794-P797 WeakPolarHBondContact O-CD 3.47Å; D794-R798 VanDerWaalsContact C-NE 3.3Å; D794-R798 VanDerWaalsContact O-CB 3.28Å; D794-R798 WeakPolarHBondContact O-CB 3.44Å; D794-R798 WeakPolarHBondContact O-CG 3.37Å; D794-R798 PolarHBondContact O-N 3.08Å; D794-R798 VanDerWaalsContact O-N 3.09Å; D794-R798 PolarHBondContact O-NE 3.12Å; D794-Y822 PolarHBondContact OD2-OH 3.02Å; D794-R859 IonicContact OD1-CZ 3.93Å; D794-R859 IonicContact OD1-NH1 3.51Å; D794-R859 IonicContact OD1-NH2 2.72Å; D794-R859 PolarHBondContact OD1-NH2 3.16Å; D794-R859 IonicContact OD2-CZ 2.83Å; D794-R859 IonicContact OD2-NH1 2.96Å; D794-R859 PolarHBondContact OD2-NH1 3.34Å; D794-R859 IonicContact OD2-NH2 2.94Å; D794-R859 PolarHBondContact OD2-NH2 3.43Å
795	F	90.6	Very high	91.2	Very high	46 Å²	46	33 Å²	33	20%	0.202	15%	0.149	C	C	.	.	H	α-helix	trans	-59.2	-52.3	-179.4	-178.2	-105.6	0	0	0	112.6	V428 I789 S793 R798 L799 F887	V428-F795 HydrophobicContact CG2-CD1 3.98Å; V428-F795 HydrophobicContact CG2-CD2 4.09Å; V428-F795 HydrophobicContact CG2-CE1 4.1Å; V428-F795 HydrophobicContact CG2-CE2 4.2Å; V428-F795 HydrophobicContact CG2-CG 3.98Å; V428-F795 HydrophobicContact CG2-CZ 4.22Å; I789-F795 HydrophobicContact CG2-CD1 4.14Å; S793-F795 VanDerWaalsContact C-N 3.26Å; S793-F795 PolarHBondContact O-N 2.81Å; S793-F795 VanDerWaalsContact OG-CB 3.23Å; S793-F795 WeakPolarHBondContact OG-CB 3.36Å; S793-F795 PolarHBondContact OG-N 2.82Å; F795-R798 PolarHBondContact O-N 3.43Å; F795-L799 HydrophobicContact CE1-CD2 4.33Å; F795-L799 WeakPolarHBondContact O-CB 3.44Å; F795-L799 PolarHBondContact O-N 2.96Å; F795-F887 HydrophobicContact CE1-CE2 4.49Å
796	I	92.4	Very high	90.9	Very high	4 Å²	4	33.2 Å²	33.2	2%	0.021	15%	0.151	C	C	.	.	H	α-helix	trans	-66.7	-45.8	-178	-54.6	-61	0	0	0	112.9	R798 L799 V800 A883 R884 F887	I796-R798 PolarHBondContact O-N 2.97Å; I796-L799 PolarHBondContact O-N 3.26Å; I796-V800 HydrophobicContact CG2-CG2 4.33Å; I796-V800 WeakPolarHBondContact O-CG2 3.4Å; I796-V800 PolarHBondContact O-N 3.43Å; I796-A883 HydrophobicContact CG2-CB 3.78Å; I796-R884 HydrophobicContact CB-CG 4.15Å; I796-R884 HydrophobicContact CG2-CG 3.85Å; I796-F887 HydrophobicContact CD1-CB 3.8Å; I796-F887 HydrophobicContact CD1-CD1 4.09Å; I796-F887 HydrophobicContact CD1-CD2 3.59Å; I796-F887 HydrophobicContact CD1-CE2 4.19Å; I796-F887 HydrophobicContact CD1-CG 3.53Å; I796-F887 HydrophobicContact CG1-CB 4.44Å; I796-F887 HydrophobicContact CG1-CG 4.33Å
797	P	91.8	Very high	90.4	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.006	18%	0.177	C	C	.	.	H	α-helix	trans	-60.6	-40.2	174.9	-23.1	33	0	0	0	113.8	D794 Y801 Y861 V880	D794-P797 WeakPolarHBondContact O-CD 3.47Å; P797-Y801 WeakPolarHBondContact O-CB 3.42Å; P797-Y801 PolarHBondContact O-N 3.33Å; P797-Y861 WeakPolarHBondContact CB-OH 3.07Å; P797-V880 HydrophobicContact CB-CG1 4.3Å; P797-V880 HydrophobicContact CG-CG1 3.96Å
798	R	89.9	Confident	89.7	Confident	40 Å²	40	34.6 Å²	34.6	15%	0.151	17%	0.167	C	C	.	.	H	α-helix	trans	-60.8	-43.3	173.5	-74.2	178.1	-70.9	170.8	-1.6	111.6	D423 D794 F795 I796 Y801 A802 M819 Y822	D423-R798 PolarHBondContact O-NH1 3.27Å; D423-R798 PolarHBondContact O-NH2 3.4Å; D423-R798 IonicContact OD1-NH2 2.7Å; D423-R798 PolarHBondContact OD1-NH2 3.27Å; D423-R798 IonicContact OD2-CZ 2.81Å; D423-R798 IonicContact OD2-NH2 3.22Å; D423-R798 PolarHBondContact OD2-NH2 3.3Å; D794-R798 VanDerWaalsContact C-NE 3.3Å; D794-R798 VanDerWaalsContact O-CB 3.28Å; D794-R798 WeakPolarHBondContact O-CB 3.44Å; D794-R798 WeakPolarHBondContact O-CG 3.37Å; D794-R798 PolarHBondContact O-N 3.08Å; D794-R798 VanDerWaalsContact O-N 3.09Å; D794-R798 PolarHBondContact O-NE 3.12Å; F795-R798 PolarHBondContact O-N 3.43Å; I796-R798 PolarHBondContact O-N 2.97Å; R798-Y801 PolarHBondContact O-N 3.44Å; R798-A802 PolarHBondContact O-N 2.91Å; R798-M819 HydrophobicContact CB-CE 3.67Å; R798-M819 HydrophobicContact CB-SD 4.43Å; R798-M819 HydrophobicContact CG-CE 3.69Å; R798-Y822 HydrophobicContact CB-CE2 4.37Å; R798-Y822 HydrophobicContact CG-CD1 4.45Å; R798-Y822 HydrophobicContact CG-CD2 4.39Å; R798-Y822 HydrophobicContact CG-CE1 3.9Å; R798-Y822 HydrophobicContact CG-CE2 3.83Å
799	L	90.1	Very high	89.1	Confident	66 Å²	66	36.7 Å²	36.7	35%	0.346	19%	0.185	S	C	.	.	H	α-helix	trans	-65.4	-45.1	179.7	-163.8	70	0	0	0	112.4	F795 I796 Y801 A802 Y803	F795-L799 HydrophobicContact CE1-CD2 4.33Å; F795-L799 WeakPolarHBondContact O-CB 3.44Å; F795-L799 PolarHBondContact O-N 2.96Å; I796-L799 PolarHBondContact O-N 3.26Å; L799-Y801 VanDerWaalsContact C-N 3.32Å; L799-Y801 PolarHBondContact O-N 3.14Å; L799-A802 PolarHBondContact O-N 3.24Å; L799-Y803 HydrophobicContact CD1-CD2 4.21Å; L799-Y803 HydrophobicContact CD1-CE2 3.71Å; L799-Y803 HydrophobicContact CG-CD2 4.15Å; L799-Y803 HydrophobicContact CG-CE2 4.05Å; L799-Y803 WeakPolarHBondContact O-CD2 3.48Å; L799-Y803 PolarHBondContact O-N 2.85Å
800	V	92.1	Very high	88.1	Confident	20 Å²	20	40.2 Å²	40.2	12%	0.121	22%	0.222	C	C	.	.	H	α-helix	trans	-63.1	-39.4	176	172.1	0	0	0	0	111.1	I796 K804 Y805 H879 V880 A883	I796-V800 HydrophobicContact CG2-CG2 4.33Å; I796-V800 WeakPolarHBondContact O-CG2 3.4Å; I796-V800 PolarHBondContact O-N 3.43Å; V800-K804 WeakPolarHBondContact O-CB 3.43Å; V800-K804 PolarHBondContact O-N 2.87Å; V800-Y805 HydrophobicContact CG1-CD2 4.48Å; V800-Y805 HydrophobicContact CG1-CE2 4.38Å; V800-H879 HydrophobicContact CG1-CB 4.18Å; V800-V880 HydrophobicContact CB-CG2 4.13Å; V800-V880 HydrophobicContact CG1-CG2 3.92Å; V800-V880 HydrophobicContact CG2-CG2 4.48Å; V800-A883 HydrophobicContact CG2-CB 3.42Å; V800-A883 VanDerWaalsContact CG2-CB 3.42Å
801	Y	91.2	Very high	87.1	Confident	20 Å²	20	47 Å²	47	8%	0.078	25%	0.254	C	S	.	.	H	α-helix	trans	-61	-54.8	174.3	-176.5	-100.5	0	0	0	111.3	P797 R798 L799 Y803 K804 Y805 G806 M819 V820 Y822 A825	P797-Y801 WeakPolarHBondContact O-CB 3.42Å; P797-Y801 PolarHBondContact O-N 3.33Å; R798-Y801 PolarHBondContact O-N 3.44Å; L799-Y801 VanDerWaalsContact C-N 3.32Å; L799-Y801 PolarHBondContact O-N 3.14Å; Y801-Y803 VanDerWaalsContact C-N 3.31Å; Y801-Y803 PolarHBondContact O-N 3.4Å; Y801-K804 PolarHBondContact O-N 3.35Å; Y801-Y805 CarbonylContact O-C 3.53Å; Y801-Y805 PolarHBondContact O-N 3.19Å; Y801-G806 VanDerWaalsContact CE1-CA 3.5Å; Y801-G806 PolarHBondContact O-N 2.74Å; Y801-M819 HydrophobicContact CD1-CE 4.3Å; Y801-V820 PolarHBondContact OH-O 2.77Å; Y801-Y822 AromaticContact CD1-CD2 3.85Å; Y801-Y822 HydrophobicContact CD1-CD2 3.85Å; Y801-Y822 HydrophobicContact CD1-CG 4.39Å; Y801-Y822 HydrophobicContact CD2-CD2 4.35Å; Y801-Y822 AromaticContact CG-CD2 3.72Å; Y801-Y822 HydrophobicContact CG-CD2 3.72Å; Y801-A825 HydrophobicContact CD2-CB 4.11Å; Y801-A825 HydrophobicContact CE2-CB 3.45Å; Y801-A825 VanDerWaalsContact CE2-CB 3.45Å
802	A	88.8	Confident	85.9	Confident	5 Å²	5	47.1 Å²	47.1	4%	0.041	27%	0.268	C	S	.	.	H	α-helix	trans	-53.3	-43.6	-176.2	0	0	0	0	0	113.6	R798 L799 M819	R798-A802 PolarHBondContact O-N 2.91Å; L799-A802 PolarHBondContact O-N 3.24Å; A802-M819 HydrophobicContact CB-SD 3.95Å
803	Y	88.3	Confident	84.5	Confident	114 Å²	114	53.4 Å²	53.4	45%	0.447	30%	0.297	S	S	.	.	H	α-helix	trans	-82.7	-26.4	-177.6	-75.5	-66	0	0	0	115.1	L799 Y801 A809 G810 A814	L799-Y803 HydrophobicContact CD1-CD2 4.21Å; L799-Y803 HydrophobicContact CD1-CE2 3.71Å; L799-Y803 HydrophobicContact CG-CD2 4.15Å; L799-Y803 HydrophobicContact CG-CE2 4.05Å; L799-Y803 WeakPolarHBondContact O-CD2 3.48Å; L799-Y803 PolarHBondContact O-N 2.85Å; Y801-Y803 VanDerWaalsContact C-N 3.31Å; Y801-Y803 PolarHBondContact O-N 3.4Å; Y803-A809 WeakPolarHBondContact O-CA 3.49Å; Y803-G810 PolarHBondContact O-N 2.96Å; Y803-A814 HydrophobicContact CE1-CB 4.1Å; Y803-A814 HydrophobicContact CE2-CB 4.12Å
804	K	89.3	Confident	83.1	Confident	130 Å²	130	55.9 Å²	55.9	57%	0.565	32%	0.318	S	S	*	.	H	α-helix	trans	-123	-23.2	-167.3	-172.2	56.8	177.7	177.1	0	116	V800 Y801	V800-K804 WeakPolarHBondContact O-CB 3.43Å; V800-K804 PolarHBondContact O-N 2.87Å; Y801-K804 PolarHBondContact O-N 3.35Å
805	Y	88.5	Confident	82.1	Confident	81 Å²	81	56.6 Å²	56.6	32%	0.318	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.7	-23.9	-170.6	-68.6	-81.6	0	0	0	114.9	V800 Y801 Q876 H879	V800-Y805 HydrophobicContact CG1-CD2 4.48Å; V800-Y805 HydrophobicContact CG1-CE2 4.38Å; Y801-Y805 CarbonylContact O-C 3.53Å; Y801-Y805 PolarHBondContact O-N 3.19Å; Y805-Q876 HydrophobicContact CD2-CG 4.29Å; Y805-Q876 HydrophobicContact CE1-CB 4.35Å; Y805-Q876 HydrophobicContact CE2-CB 4.18Å; Y805-Q876 HydrophobicContact CE2-CG 3.86Å; Y805-Q876 WeakPolarHBondContact OH-CA 3.37Å; Y805-Q876 PolarHBondContact OH-N 3.1Å; Y805-H879 AromaticContact CZ-ND1 3.84Å; Y805-H879 PolarHBondContact OH-ND1 3.34Å
806	G	86.7	Confident	80.9	Confident	6 Å²	6	59.3 Å²	59.3	6%	0.062	34%	0.343	C	S	.	.	S	Bend	trans	-77.6	174.9	177.1	0	0	0	0	0	113.3	Y801 C808 A809	Y801-G806 VanDerWaalsContact CE1-CA 3.5Å; Y801-G806 PolarHBondContact O-N 2.74Å; G806-C808 PolarHBondContact O-N 2.03Å; G806-A809 VanDerWaalsContact O-CB 3.23Å; G806-A809 WeakPolarHBondContact O-CB 3.43Å; G806-A809 PolarHBondContact O-N 2.91Å
807	P	84.6	Confident	80	Confident	84 Å²	84	67.6 Å²	67.6	55%	0.545	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-11.4	-174.6	23.1	-33.6	0	0	0	115.7	V820	P807-V820 HydrophobicContact CG-CB 4.48Å
808	C	80.5	Confident	79.5	Confident	17 Å²	17	67.8 Å²	67.8	12%	0.115	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	10.3	174	-51	0	0	0	0	113.4	G806 G810 Q811 C818	G806-C808 PolarHBondContact O-N 2.03Å; C808-G810 PolarHBondContact O-N 3.39Å; C808-Q811 WeakPolarHBondContact O-CB 3.45Å; C808-Q811 PolarHBondContact O-N 3.5Å; C808-C818 HydrophobicContact CB-CB 3.59Å; C808-C818 WeakPolarHBondContact CB-SG 3.45Å; C808-C818 WeakPolarHBondContact SG-CA 3.24Å; C808-C818 WeakPolarHBondContact SG-CB 3.31Å; C808-C818 CovalentContact SG-SG 2.03Å; C808-C818 PolarHBondContact SG-SG 3.28Å
809	A	79.7	Confident	79.2	Confident	45 Å²	45	67.2 Å²	67.2	37%	0.372	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	128.8	-174.6	0	0	0	0	0	112.1	Y803 G806 Q811	Y803-A809 WeakPolarHBondContact O-CA 3.49Å; G806-A809 VanDerWaalsContact O-CB 3.23Å; G806-A809 WeakPolarHBondContact O-CB 3.43Å; G806-A809 PolarHBondContact O-N 2.91Å; A809-Q811 VanDerWaalsContact C-N 3.28Å; A809-Q811 PolarHBondContact O-N 3.05Å
810	G	72.4	Confident	79.2	Confident	78 Å²	78	67.5 Å²	67.5	80%	0.804	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	78	-5.7	-177.5	0	0	0	0	0	116.4	Y803 C808	Y803-G810 PolarHBondContact O-N 2.96Å; C808-G810 PolarHBondContact O-N 3.39Å
811	Q	73.3	Confident	79	Confident	142 Å²	142	67.8 Å²	67.8	66%	0.664	39%	0.391	S	S	*	.	S	Bend	trans	-83	-13.5	177	-63.4	-179.5	-23.9	0	0	113.6	C808 A809 E813	C808-Q811 WeakPolarHBondContact O-CB 3.45Å; C808-Q811 PolarHBondContact O-N 3.5Å; A809-Q811 VanDerWaalsContact C-N 3.28Å; A809-Q811 PolarHBondContact O-N 3.05Å; Q811-E813 VanDerWaalsContact C-N 3.26Å; Q811-E813 PolarHBondContact O-N 3.32Å
812	G	64.4	Low	79	Confident	55 Å²	55	67 Å²	67	57%	0.567	39%	0.388	S	S	*	.			trans	81.9	-8.6	178.9	0	0	0	0	0	115.3
813	E	61.6	Low	79	Confident	143 Å²	143	67.2 Å²	67.2	67%	0.668	39%	0.389	S	S	*	.			trans	-95.6	129.5	177.3	-62.9	-168.5	170	0	0	112.5	Q811	Q811-E813 VanDerWaalsContact C-N 3.26Å; Q811-E813 PolarHBondContact O-N 3.32Å
814	A	61.2	Low	79.1	Confident	57 Å²	57	66 Å²	66	47%	0.471	39%	0.39	S	S	.	.			trans	-107.5	77.8	174.1	0	0	0	0	0	111.1	Y803	Y803-A814 HydrophobicContact CE1-CB 4.1Å; Y803-A814 HydrophobicContact CE2-CB 4.12Å
815	G	65.9	Low	79.1	Confident	35 Å²	35	61.6 Å²	61.6	36%	0.361	38%	0.378	S	S	.	.			trans	-98.8	165.7	178.9	0	0	0	0	0	114.3	K817 C818	G815-K817 PolarHBondContact O-N 3.43Å; G815-C818 PolarHBondContact N-SG 3.47Å; G815-C818 WeakPolarHBondContact O-CA 3.42Å; G815-C818 WeakPolarHBondContact O-CB 3.36Å; G815-C818 PolarHBondContact O-N 3.46Å
816	Q	66.4	Low	79.2	Confident	102 Å²	102	58.2 Å²	58.2	48%	0.477	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-63.6	-26.9	179.9	-152.6	165.6	41.1	0	0	113	H381 C818 M819	H381-Q816 PolarHBondContact O-NE2 3.34Å; Q816-C818 VanDerWaalsContact C-N 3.28Å; Q816-C818 PolarHBondContact O-N 2.87Å; Q816-M819 PolarHBondContact O-N 3.09Å
817	K	72.9	Confident	79.4	Confident	179 Å²	179	58.6 Å²	58.6	78%	0.778	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-69.6	-20.6	170.9	-63	-179.7	-179.1	177.4	0	113.5	G815 M819 V820	G815-K817 PolarHBondContact O-N 3.43Å; K817-M819 PolarHBondContact O-N 3.35Å; K817-V820 WeakPolarHBondContact O-CG2 3.06Å
818	C	82.4	Confident	79.8	Confident	4 Å²	4	55 Å²	55	3%	0.027	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-79.6	-5.1	179.9	-50.8	0	0	0	0	113.3	C808 G815 Q816	C808-C818 HydrophobicContact CB-CB 3.59Å; C808-C818 WeakPolarHBondContact CB-SG 3.45Å; C808-C818 WeakPolarHBondContact SG-CA 3.24Å; C808-C818 WeakPolarHBondContact SG-CB 3.31Å; C808-C818 CovalentContact SG-SG 2.03Å; C808-C818 PolarHBondContact SG-SG 3.28Å; G815-C818 PolarHBondContact N-SG 3.47Å; G815-C818 WeakPolarHBondContact O-CA 3.42Å; G815-C818 WeakPolarHBondContact O-CB 3.36Å; G815-C818 PolarHBondContact O-N 3.46Å; Q816-C818 VanDerWaalsContact C-N 3.28Å; Q816-C818 PolarHBondContact O-N 2.87Å
819	M	83.9	Confident	80.4	Confident	28 Å²	28	56 Å²	56	14%	0.138	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-94.5	-2	177.8	-64	-54.9	-52.5	0	0	113.7	Q383 V384 R798 Y801 A802 Q816 K817 G821 Y822	Q383-M819 HydrophobicContact CB-CB 4.19Å; Q383-M819 HydrophobicContact CG-CB 4.31Å; V384-M819 HydrophobicContact CG2-CE 4.16Å; R798-M819 HydrophobicContact CB-CE 3.67Å; R798-M819 HydrophobicContact CB-SD 4.43Å; R798-M819 HydrophobicContact CG-CE 3.69Å; Y801-M819 HydrophobicContact CD1-CE 4.3Å; A802-M819 HydrophobicContact CB-SD 3.95Å; Q816-M819 PolarHBondContact O-N 3.09Å; K817-M819 PolarHBondContact O-N 3.35Å; M819-G821 PolarHBondContact O-N 2.88Å; M819-Y822 HydrophobicContact CE-CD1 4.36Å; M819-Y822 HydrophobicContact CE-CD2 3.73Å; M819-Y822 HydrophobicContact CE-CE2 4.4Å; M819-Y822 HydrophobicContact CE-CG 3.71Å; M819-Y822 VanDerWaalsContact O-CB 3.24Å; M819-Y822 WeakPolarHBondContact O-CB 3.3Å; M819-Y822 PolarHBondContact O-N 2.96Å; M819-Y822 VanDerWaalsContact O-N 3.15Å
820	V	88.3	Confident	81	Confident	72 Å²	72	53.9 Å²	53.9	44%	0.436	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	123.9	-178	176.8	0	0	0	0	110.2	Q383 E387 Y801 P807 K817	Q383-V820 HydrophobicContact CG-CG2 4.06Å; E387-V820 VanDerWaalsContact OE1-CA 3.31Å; E387-V820 WeakPolarHBondContact OE1-CA 3.04Å; Y801-V820 PolarHBondContact OH-O 2.77Å; P807-V820 HydrophobicContact CG-CB 4.48Å; K817-V820 WeakPolarHBondContact O-CG2 3.06Å
821	G	88.8	Confident	81.9	Confident	27 Å²	27	53.3 Å²	53.3	28%	0.278	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.9	1.9	-178.6	0	0	0	0	0	114.9	E387 M819 V823 N824 A825	E387-G821 PolarHBondContact OE1-N 3.45Å; E387-G821 PolarHBondContact OE2-N 3.36Å; M819-G821 PolarHBondContact O-N 2.88Å; G821-V823 VanDerWaalsContact C-N 3.28Å; G821-V823 PolarHBondContact O-N 3.09Å; G821-N824 PolarHBondContact O-N 2.99Å; G821-A825 PolarHBondContact O-N 3.38Å; G821-A825 VanDerWaalsContact O-N 3.14Å
822	Y	90.5	Very high	82.6	Confident	3 Å²	3	47.9 Å²	47.9	1%	0.012	28%	0.28	C	S	.	.	H	α-helix	trans	-55.1	-41.9	179.1	171.2	-99.1	0	0	0	112.4	V384 E387 D794 R798 Y801 M819 A825 S826	V384-Y822 HydrophobicContact CB-CD1 4.48Å; V384-Y822 HydrophobicContact CG1-CD1 3.88Å; V384-Y822 HydrophobicContact CG1-CE1 4.13Å; V384-Y822 HydrophobicContact CG2-CD1 3.74Å; V384-Y822 HydrophobicContact CG2-CE1 4.41Å; V384-Y822 HydrophobicContact CG2-CG 4.33Å; E387-Y822 PolarHBondContact OE2-N 3.35Å; D794-Y822 PolarHBondContact OD2-OH 3.02Å; R798-Y822 HydrophobicContact CB-CE2 4.37Å; R798-Y822 HydrophobicContact CG-CD1 4.45Å; R798-Y822 HydrophobicContact CG-CD2 4.39Å; R798-Y822 HydrophobicContact CG-CE1 3.9Å; R798-Y822 HydrophobicContact CG-CE2 3.83Å; Y801-Y822 AromaticContact CD1-CD2 3.85Å; Y801-Y822 HydrophobicContact CD1-CD2 3.85Å; Y801-Y822 HydrophobicContact CD1-CG 4.39Å; Y801-Y822 HydrophobicContact CD2-CD2 4.35Å; Y801-Y822 AromaticContact CG-CD2 3.72Å; Y801-Y822 HydrophobicContact CG-CD2 3.72Å; M819-Y822 HydrophobicContact CE-CD1 4.36Å; M819-Y822 HydrophobicContact CE-CD2 3.73Å; M819-Y822 HydrophobicContact CE-CE2 4.4Å; M819-Y822 HydrophobicContact CE-CG 3.71Å; M819-Y822 VanDerWaalsContact O-CB 3.24Å; M819-Y822 WeakPolarHBondContact O-CB 3.3Å; M819-Y822 PolarHBondContact O-N 2.96Å; M819-Y822 VanDerWaalsContact O-N 3.15Å; Y822-A825 CarbonylContact O-C 3.53Å; Y822-A825 PolarHBondContact O-N 3.44Å; Y822-S826 WeakPolarHBondContact O-CB 3.21Å; Y822-S826 PolarHBondContact O-N 3.49Å; Y822-S826 PolarHBondContact O-OG 3.03Å
823	V	89.8	Confident	83.6	Confident	9 Å²	9	49.7 Å²	49.7	6%	0.055	28%	0.284	C	S	.	.	H	α-helix	trans	-62.6	-48.9	-177	175.4	0	0	0	0	110.7	V384 E387 V388 L409 G821 A825 S826 L827	V384-V823 HydrophobicContact CG1-CG2 3.96Å; E387-V823 HydrophobicContact CB-CB 4.01Å; E387-V823 HydrophobicContact CB-CG2 3.53Å; E387-V823 WeakPolarHBondContact OE2-CG2 3.27Å; E387-V823 PolarHBondContact OE2-N 2.99Å; E387-V823 VanDerWaalsContact OE2-N 3.16Å; V388-V823 HydrophobicContact CG2-CG1 4.4Å; V388-V823 HydrophobicContact CG2-CG2 4.02Å; L409-V823 HydrophobicContact CD2-CG1 3.52Å; G821-V823 VanDerWaalsContact C-N 3.28Å; G821-V823 PolarHBondContact O-N 3.09Å; V823-A825 VanDerWaalsContact C-N 3.3Å; V823-A825 PolarHBondContact O-N 3.15Å; V823-S826 PolarHBondContact O-N 2.94Å; V823-S826 VanDerWaalsContact O-N 3.1Å; V823-S826 PolarHBondContact O-OG 3.15Å; V823-L827 HydrophobicContact CG1-CD1 4.04Å; V823-L827 WeakPolarHBondContact O-CG 3.28Å
824	N	90.1	Very high	84.8	Confident	90 Å²	90	45.3 Å²	45.3	48%	0.481	27%	0.265	S	S	.	.	H	α-helix	trans	-62.9	-35.1	178.2	-171	18.3	0	0	0	112.5	G821 S826 R857	G821-N824 PolarHBondContact O-N 2.99Å; N824-S826 VanDerWaalsContact C-N 3.33Å; N824-R857 PolarHBondContact O-NH1 3.41Å; N824-R857 VanDerWaalsContact OD1-CZ 3.32Å; N824-R857 PolarHBondContact OD1-NH1 3.45Å; N824-R857 PolarHBondContact OD1-NH2 2.96Å
825	A	89	Confident	86	Confident	37 Å²	37	43.5 Å²	43.5	31%	0.306	25%	0.246	S	C	.	.	H	α-helix	trans	-77.5	-12.2	176.4	0	0	0	0	0	114.6	Y801 G821 Y822 V823	Y801-A825 HydrophobicContact CD2-CB 4.11Å; Y801-A825 HydrophobicContact CE2-CB 3.45Å; Y801-A825 VanDerWaalsContact CE2-CB 3.45Å; G821-A825 PolarHBondContact O-N 3.38Å; G821-A825 VanDerWaalsContact O-N 3.14Å; Y822-A825 CarbonylContact O-C 3.53Å; Y822-A825 PolarHBondContact O-N 3.44Å; V823-A825 VanDerWaalsContact C-N 3.3Å; V823-A825 PolarHBondContact O-N 3.15Å
826	S	90.6	Very high	86.9	Confident	9 Å²	9	44.8 Å²	44.8	6%	0.063	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-3	175.1	72	0	0	0	0	114.2	Y822 V823 N824	Y822-S826 WeakPolarHBondContact O-CB 3.21Å; Y822-S826 PolarHBondContact O-N 3.49Å; Y822-S826 PolarHBondContact O-OG 3.03Å; V823-S826 PolarHBondContact O-N 2.94Å; V823-S826 VanDerWaalsContact O-N 3.1Å; V823-S826 PolarHBondContact O-OG 3.15Å; N824-S826 VanDerWaalsContact C-N 3.33Å
827	L	91.6	Very high	87.5	Confident	14 Å²	14	46.4 Å²	46.4	7%	0.073	26%	0.255	C	S	.	.			trans	-120.8	105.1	-170	-71.8	176.4	0	0	0	111.8	I394 M396 L409 V823 R857 Y858 R859	I394-L827 HydrophobicContact CD1-CD1 4.45Å; I394-L827 HydrophobicContact CG2-CD1 3.94Å; M396-L827 HydrophobicContact CE-CD2 3.83Å; M396-L827 HydrophobicContact SD-CD1 4.27Å; M396-L827 HydrophobicContact SD-CD2 3.92Å; L409-L827 HydrophobicContact CD2-CD1 3.8Å; V823-L827 HydrophobicContact CG1-CD1 4.04Å; V823-L827 WeakPolarHBondContact O-CG 3.28Å; L827-R857 HydrophobicContact CB-CB 4.22Å; L827-R857 HydrophobicContact CB-CG 4.38Å; L827-R857 HydrophobicContact CD1-CB 4.48Å; L827-R857 PolarHBondContact O-NH1 3.01Å; L827-Y858 CarbonylContact C-O 3.58Å; L827-Y858 WeakPolarHBondContact CA-O 3.5Å; L827-R859 HydrophobicContact CD2-CB 4.14Å
828	S	92.1	Very high	87.6	Confident	8 Å²	8	45.3 Å²	45.3	6%	0.056	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	148.3	172.6	-71.7	0	0	0	0	112	R857 Y858 D860 R862	S828-R857 WeakPolarHBondContact O-CA 3.29Å; S828-R857 WeakPolarHBondContact O-CD 3.07Å; S828-Y858 VanDerWaalsContact CB-CE1 3.43Å; S828-Y858 PolarHBondContact N-O 3.42Å; S828-Y858 PolarHBondContact O-N 3.41Å; S828-D860 VanDerWaalsContact OG-C 3.28Å; S828-D860 PolarHBondContact OG-O 2.8Å; S828-R862 PolarHBondContact OG-N 3.26Å; S828-R862 PolarHBondContact OG-O 3.45Å
829	V	92.9	Very high	87.3	Confident	39 Å²	39	45.1 Å²	45.1	24%	0.236	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	133.3	174.1	-177	0	0	0	0	109.6	Y855 P865	V829-Y855 HydrophobicContact CG1-CD1 3.9Å; V829-Y855 HydrophobicContact CG1-CG 4.32Å; V829-P865 HydrophobicContact CG1-CG 4.23Å
830	F	92.4	Very high	87.1	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	142.9	169.2	-170.3	-110.1	0	0	0	110.5	P622 D834 F835 Y855 C856 Y858 Y871	P622-F830 HydrophobicContact CB-CD1 3.74Å; P622-F830 HydrophobicContact CB-CD2 3.84Å; P622-F830 HydrophobicContact CB-CE1 3.72Å; P622-F830 HydrophobicContact CB-CE2 3.84Å; P622-F830 HydrophobicContact CB-CG 3.8Å; P622-F830 HydrophobicContact CB-CZ 3.76Å; P622-F830 HydrophobicContact CG-CB 4.45Å; P622-F830 HydrophobicContact CG-CD1 4.42Å; P622-F830 HydrophobicContact CG-CD2 4.18Å; P622-F830 HydrophobicContact CG-CG 4.09Å; F830-D834 HydrophobicContact CE2-CB 4.15Å; F830-D834 HydrophobicContact CZ-CB 3.91Å; F830-D834 WeakPolarHBondContact CZ-O 3.44Å; F830-F835 HydrophobicContact CD1-CE1 4.34Å; F830-F835 HydrophobicContact CD1-CE2 4.22Å; F830-F835 HydrophobicContact CD1-CZ 4.05Å; F830-F835 AromaticContact CE1-CD1 3.74Å; F830-F835 HydrophobicContact CE1-CD1 3.74Å; F830-F835 AromaticContact CE1-CD2 3.86Å; F830-F835 HydrophobicContact CE1-CD2 3.86Å; F830-F835 AromaticContact CE1-CE1 3.74Å; F830-F835 HydrophobicContact CE1-CE1 3.74Å; F830-F835 AromaticContact CE1-CE2 3.84Å; F830-F835 HydrophobicContact CE1-CE2 3.84Å; F830-F835 AromaticContact CE1-CG 3.78Å; F830-F835 HydrophobicContact CE1-CG 3.78Å; F830-F835 AromaticContact CE1-CZ 3.77Å; F830-F835 HydrophobicContact CE1-CZ 3.77Å; F830-F835 HydrophobicContact CZ-CD1 4.19Å; F830-F835 HydrophobicContact CZ-CE1 4.46Å; F830-F835 HydrophobicContact CZ-CG 4.35Å; F830-Y855 WeakPolarHBondContact O-CA 3.46Å; F830-C856 PolarHBondContact N-O 3.08Å; F830-C856 PolarHBondContact O-N 2.94Å; F830-Y858 HydrophobicContact CB-CD1 3.8Å; F830-Y858 HydrophobicContact CB-CE1 3.76Å; F830-Y858 HydrophobicContact CD2-CE1 4.45Å; F830-Y871 HydrophobicContact CD2-CD1 4.22Å; F830-Y871 AromaticContact CD2-CE1 3.51Å; F830-Y871 HydrophobicContact CD2-CE1 3.51Å; F830-Y871 HydrophobicContact CD2-CE2 4.37Å; F830-Y871 AromaticContact CD2-CZ 3.58Å; F830-Y871 HydrophobicContact CE2-CE1 4.04Å; F830-Y871 HydrophobicContact CE2-CE2 4.05Å; F830-Y871 AromaticContact CE2-CZ 3.67Å; F830-Y871 HydrophobicContact CG-CE1 4.49Å
831	R	91.3	Very high	86.6	Confident	67 Å²	67	46.2 Å²	46.2	25%	0.253	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	128	172.3	-170.8	-170	-67.7	133	3.9	109.1	S833 D834 Y855 P865 H866 Y871	R831-S833 VanDerWaalsContact C-N 3.25Å; R831-S833 WeakPolarHBondContact CD-OG 3.26Å; R831-S833 WeakPolarHBondContact CG-OG 3.5Å; R831-S833 PolarHBondContact O-N 3.49Å; R831-D834 IonicContact NH1-OD1 2.7Å; R831-D834 IonicContact NH1-OD2 3.91Å; R831-D834 WeakPolarHBondContact O-CB 3.31Å; R831-D834 PolarHBondContact O-N 2.87Å; R831-Y855 HydrophobicContact CB-CD1 4.1Å; R831-Y855 HydrophobicContact CB-CE1 4.07Å; R831-Y855 HydrophobicContact CG-CD1 4.23Å; R831-Y855 HydrophobicContact CG-CE1 3.95Å; R831-P865 HydrophobicContact CB-CB 4.12Å; R831-P865 HydrophobicContact CB-CG 4.15Å; R831-P865 PolarHBondContact NH2-O 3.36Å; R831-H866 PolarHBondContact NH2-CE1 2.6Å; R831-H866 VanDerWaalsContact NH2-CE1 3.32Å; R831-Y871 PolarHBondContact N-OH 3.23Å
832	I	87.6	Confident	85.8	Confident	28 Å²	28	51 Å²	51	14%	0.144	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-67.4	-24.8	-169.5	-70.1	166.7	0	0	0	112.6	F406 D834 F835 L853 K854 C856	F406-I832 HydrophobicContact CE1-CD1 3.86Å; F406-I832 HydrophobicContact CE1-CG1 4.42Å; F406-I832 HydrophobicContact CZ-CD1 3.75Å; F406-I832 HydrophobicContact CZ-CG1 4.36Å; I832-D834 PolarHBondContact O-N 3.4Å; I832-D834 VanDerWaalsContact O-N 3.14Å; I832-F835 HydrophobicContact CB-CE2 4.43Å; I832-F835 HydrophobicContact CG1-CE2 4.24Å; I832-F835 HydrophobicContact CG2-CD2 4.1Å; I832-F835 HydrophobicContact CG2-CE2 4.15Å; I832-F835 VanDerWaalsContact O-CD2 3.23Å; I832-F835 WeakPolarHBondContact O-CD2 3.4Å; I832-L853 HydrophobicContact CD1-CB 3.51Å; I832-L853 WeakPolarHBondContact CD1-O 3.5Å; I832-K854 PolarHBondContact N-O 3.31Å; I832-K854 VanDerWaalsContact N-O 3.12Å; I832-C856 HydrophobicContact CD1-CB 4.35Å; I832-C856 HydrophobicContact CG1-CB 4.48Å
833	S	85.5	Confident	85	Confident	93 Å²	93	52.7 Å²	52.7	65%	0.65	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-64.1	-12.4	171.9	53.8	0	0	0	0	115.2	R831	R831-S833 VanDerWaalsContact C-N 3.25Å; R831-S833 WeakPolarHBondContact CD-OG 3.26Å; R831-S833 WeakPolarHBondContact CG-OG 3.5Å; R831-S833 PolarHBondContact O-N 3.49Å
834	D	87.3	Confident	84.1	Confident	51 Å²	51	57.6 Å²	57.6	27%	0.273	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-102	11.3	-170	-52.1	6.4	0	0	0	111.5	G623 F830 R831 I832 Y871	G623-D834 WeakPolarHBondContact CA-O 3.31Å; F830-D834 HydrophobicContact CE2-CB 4.15Å; F830-D834 HydrophobicContact CZ-CB 3.91Å; F830-D834 WeakPolarHBondContact CZ-O 3.44Å; R831-D834 IonicContact NH1-OD1 2.7Å; R831-D834 IonicContact NH1-OD2 3.91Å; R831-D834 WeakPolarHBondContact O-CB 3.31Å; R831-D834 PolarHBondContact O-N 2.87Å; I832-D834 PolarHBondContact O-N 3.4Å; I832-D834 VanDerWaalsContact O-N 3.14Å; D834-Y871 HydrophobicContact CB-CE2 4.22Å; D834-Y871 PolarHBondContact OD2-OH 2.88Å
835	F	86.9	Confident	83.2	Confident	18 Å²	18	53.3 Å²	53.3	8%	0.079	28%	0.277	C	S	.	.	S	Bend	trans	-69.5	148.7	173.2	-85.4	-60.9	0	0	0	112.3	P398 P622 F830 I832	P398-F835 HydrophobicContact CG-CZ 4.47Å; P622-F835 HydrophobicContact CB-CD1 4.39Å; P622-F835 HydrophobicContact CB-CE1 3.72Å; P622-F835 HydrophobicContact CB-CZ 4.35Å; P622-F835 VanDerWaalsContact O-CD1 3.25Å; P622-F835 WeakPolarHBondContact O-CD1 3.37Å; F830-F835 HydrophobicContact CD1-CE1 4.34Å; F830-F835 HydrophobicContact CD1-CE2 4.22Å; F830-F835 HydrophobicContact CD1-CZ 4.05Å; F830-F835 AromaticContact CE1-CD1 3.74Å; F830-F835 HydrophobicContact CE1-CD1 3.74Å; F830-F835 AromaticContact CE1-CD2 3.86Å; F830-F835 HydrophobicContact CE1-CD2 3.86Å; F830-F835 AromaticContact CE1-CE1 3.74Å; F830-F835 HydrophobicContact CE1-CE1 3.74Å; F830-F835 AromaticContact CE1-CE2 3.84Å; F830-F835 HydrophobicContact CE1-CE2 3.84Å; F830-F835 AromaticContact CE1-CG 3.78Å; F830-F835 HydrophobicContact CE1-CG 3.78Å; F830-F835 AromaticContact CE1-CZ 3.77Å; F830-F835 HydrophobicContact CE1-CZ 3.77Å; F830-F835 HydrophobicContact CZ-CD1 4.19Å; F830-F835 HydrophobicContact CZ-CE1 4.46Å; F830-F835 HydrophobicContact CZ-CG 4.35Å; I832-F835 HydrophobicContact CB-CE2 4.43Å; I832-F835 HydrophobicContact CG1-CE2 4.24Å; I832-F835 HydrophobicContact CG2-CD2 4.1Å; I832-F835 HydrophobicContact CG2-CE2 4.15Å; I832-F835 VanDerWaalsContact O-CD2 3.23Å; I832-F835 WeakPolarHBondContact O-CD2 3.4Å
836	E	83.9	Confident	82.2	Confident	63 Å²	63	54.1 Å²	54.1	29%	0.294	28%	0.28	S	S	.	.			trans	-68.7	134.2	163	-173.2	-169.5	175.6	0	0	109.4	R627 R838 S839 E840	R627-E836 IonicContact CZ-OE2 3.13Å; R627-E836 IonicContact NE-OE2 3.91Å; R627-E836 PolarHBondContact NE-OE2 2.89Å; R627-E836 VanDerWaalsContact NE-OE2 3.13Å; R627-E836 IonicContact NH2-OE2 3.36Å; R627-E836 PolarHBondContact NH2-OE2 3.39Å; E836-R838 HydrophobicContact CG-CB 4.44Å; E836-R838 PolarHBondContact O-N 3.16Å; E836-R838 WeakPolarHBondContact OE1-CD 3.5Å; E836-R838 IonicContact OE1-NE 3.97Å; E836-S839 PolarHBondContact O-N 3.3Å; E836-E840 PolarHBondContact O-N 3.24Å
837	N	78.8	Confident	81.3	Confident	136 Å²	136	61.2 Å²	61.2	73%	0.727	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-7.7	-178.7	-54.3	43.9	0	0	0	115.8
838	R	75.1	Confident	80.2	Confident	155 Å²	155	62.6 Å²	62.6	59%	0.585	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-25.7	176.1	-63	-177	178.8	178.4	-2	113.4	E836	E836-R838 HydrophobicContact CG-CB 4.44Å; E836-R838 PolarHBondContact O-N 3.16Å; E836-R838 WeakPolarHBondContact OE1-CD 3.5Å; E836-R838 IonicContact OE1-NE 3.97Å
839	S	77.7	Confident	78.8	Confident	1 Å²	1	65.8 Å²	65.8	1%	0.007	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110	-1.3	-177	-68.9	0	0	0	0	113.8	D401 R627 E836	D401-S839 VanDerWaalsContact OD1-CB 3.32Å; D401-S839 WeakPolarHBondContact OD1-CB 3.41Å; D401-S839 PolarHBondContact OD1-OG 3.2Å; D401-S839 PolarHBondContact OD2-OG 3.45Å; R627-S839 PolarHBondContact NH2-OG 2.04Å; E836-S839 PolarHBondContact O-N 3.3Å
840	E	79.1	Confident	77.6	Confident	108 Å²	108	67.2 Å²	67.2	51%	0.505	36%	0.363	S	S	.	.			trans	-57.1	126.7	167.3	-171.8	171.7	-142.5	0	0	110.4	E836	E836-E840 PolarHBondContact O-N 3.24Å
841	P	77.5	Confident	76.6	Confident	14 Å²	14	71.5 Å²	71.5	9%	0.091	39%	0.389	C	S	.	.			trans	-74.8	153.5	-178	30.7	-34.8	0	0	0	112.1	P398 F406 S843	P398-P841 HydrophobicContact CG-CB 4.47Å; F406-P841 HydrophobicContact CE2-CG 3.95Å; F406-P841 HydrophobicContact CZ-CG 3.96Å; P841-S843 PolarHBondContact O-N 3.01Å
842	E	72.6	Confident	75.9	Confident	129 Å²	129	72 Å²	72	60%	0.603	40%	0.401	S	S	*	.	S	Bend	trans	-75.1	3.8	176.1	-69.5	-178.1	173.2	0	0	114.1	K402 Y403	K402-E842 HydrophobicContact CB-CG 4.22Å; K402-E842 PolarHBondContact O-N 3.09Å; Y403-E842 VanDerWaalsContact CE1-CD 3.49Å; Y403-E842 VanDerWaalsContact CE1-OE1 3.29Å; Y403-E842 WeakPolarHBondContact CE1-OE1 3.43Å; Y403-E842 VanDerWaalsContact CE1-OE2 3.28Å; Y403-E842 WeakPolarHBondContact CE1-OE2 3.32Å
843	S	72.9	Confident	75.7	Confident	37 Å²	37	71.9 Å²	71.9	26%	0.259	40%	0.4	S	S	.	.			trans	-129.5	126.4	178.7	168.6	0	0	0	0	110.3	F406 P841 G845	F406-S843 WeakPolarHBondContact CE2-O 3.28Å; P841-S843 PolarHBondContact O-N 3.01Å; S843-G845 PolarHBondContact O-N 3.42Å; S843-G845 VanDerWaalsContact O-N 3.07Å; S843-G845 PolarHBondContact OG-N 3.35Å
844	D	70.3	Confident	75.7	Confident	113 Å²	113	75 Å²	75	60%	0.604	40%	0.402	S	S	*	.			trans	-68.8	0.1	175.7	-59.5	-25.2	0	0	0	113.7	S846 P852 L853	D844-S846 PolarHBondContact O-N 3.49Å; D844-P852 HydrophobicContact CB-CB 3.92Å; D844-L853 PolarHBondContact O-N 2.75Å
845	G	71.9	Confident	75.9	Confident	0 Å²	0	77.5 Å²	77.5	0%	0	41%	0.408	C	S	.	.	S	Bend	trans	68.1	14.4	-173.8	0	0	0	0	0	114.4	S843 E847 F848	S843-G845 PolarHBondContact O-N 3.42Å; S843-G845 VanDerWaalsContact O-N 3.07Å; S843-G845 PolarHBondContact OG-N 3.35Å; G845-E847 PolarHBondContact O-N 3.12Å; G845-E847 VanDerWaalsContact O-N 3.14Å; G845-F848 WeakPolarHBondContact O-CD2 3.45Å; G845-F848 PolarHBondContact O-N 3.43Å
846	S	69.1	Low	76	Confident	53 Å²	53	76.8 Å²	76.8	37%	0.371	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-57.8	-26.4	-178.9	53.8	0	0	0	0	113.6	D844 F848 S849 G850	D844-S846 PolarHBondContact O-N 3.49Å; S846-F848 PolarHBondContact O-N 3.02Å; S846-S849 PolarHBondContact O-N 3.02Å; S846-G850 WeakPolarHBondContact O-CA 3.37Å; S846-G850 PolarHBondContact O-N 2.96Å
847	E	70.4	Confident	76.4	Confident	158 Å²	158	76.5 Å²	76.5	74%	0.738	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-54.4	-29.5	171.8	-60.6	-177.6	164.7	0	0	113.5	G845	G845-E847 PolarHBondContact O-N 3.12Å; G845-E847 VanDerWaalsContact O-N 3.14Å
848	F	69.2	Low	76.9	Confident	44 Å²	44	71 Å²	71	19%	0.193	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-87.3	-17.6	-175	-65.5	-76.1	0	0	0	114.5	I395 F406 R408 G845 S846	I395-F848 HydrophobicContact CD1-CB 3.79Å; I395-F848 HydrophobicContact CD1-CG 4.3Å; F406-F848 HydrophobicContact CB-CD2 4.3Å; F406-F848 HydrophobicContact CB-CE2 3.84Å; F406-F848 VanDerWaalsContact O-CZ 3.24Å; F406-F848 WeakPolarHBondContact O-CZ 3.34Å; R408-F848 HydrophobicContact CG-CD1 4.05Å; R408-F848 HydrophobicContact CG-CE1 4.02Å; G845-F848 WeakPolarHBondContact O-CD2 3.45Å; G845-F848 PolarHBondContact O-N 3.43Å; S846-F848 PolarHBondContact O-N 3.02Å
849	S	63.3	Low	77.5	Confident	74 Å²	74	68.2 Å²	68.2	52%	0.517	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-154.1	8.3	-172	-66	0	0	0	0	115.5	S846 T851	S846-S849 PolarHBondContact O-N 3.02Å; S849-T851 PolarHBondContact O-N 3.27Å
850	G	66.8	Low	78.1	Confident	70 Å²	70	69.5 Å²	69.5	72%	0.722	37%	0.367	S	S	*	.	S	Bend	trans	68.4	-5.9	-178.1	0	0	0	0	0	115.4	S846	S846-G850 WeakPolarHBondContact O-CA 3.37Å; S846-G850 PolarHBondContact O-N 2.96Å
851	T	72.3	Confident	78.6	Confident	89 Å²	89	65.4 Å²	65.4	55%	0.546	35%	0.348	S	S	.	.	S	Bend	trans	-133.8	151.7	178.8	53.5	0	0	0	0	109.2	S849	S849-T851 PolarHBondContact O-N 3.27Å
852	P	76.7	Confident	79.3	Confident	79 Å²	79	66.2 Å²	66.2	51%	0.513	35%	0.349	S	S	.	.			trans	-60.3	137.5	178.4	25.8	-35.6	0	0	0	111.3	D844	D844-P852 HydrophobicContact CB-CB 3.92Å
853	L	83.3	Confident	80.2	Confident	25 Å²	25	62.6 Å²	62.6	13%	0.131	33%	0.333	C	S	.	.			trans	-69.6	139.6	-177.7	-66.1	178.1	0	0	0	111.3	I395 F406 I832 D844	I395-L853 HydrophobicContact CD1-CD1 4.03Å; I395-L853 HydrophobicContact CD1-CD2 3.67Å; I395-L853 HydrophobicContact CG2-CD1 3.93Å; F406-L853 HydrophobicContact CB-CD1 4.4Å; F406-L853 HydrophobicContact CD1-CD1 4.2Å; F406-L853 HydrophobicContact CD2-CD1 3.95Å; F406-L853 HydrophobicContact CE1-CD1 4.49Å; F406-L853 HydrophobicContact CE2-CD1 4.24Å; F406-L853 HydrophobicContact CG-CD1 3.94Å; I832-L853 HydrophobicContact CD1-CB 3.51Å; I832-L853 WeakPolarHBondContact CD1-O 3.5Å; D844-L853 PolarHBondContact O-N 2.75Å
854	K	85.8	Confident	81.2	Confident	159 Å²	159	63.5 Å²	63.5	69%	0.691	34%	0.339	S	S	*	.	S	Bend	trans	-100.1	-28.6	178.1	-63.7	-177	-179.7	179.1	0	113.4	I832	I832-K854 PolarHBondContact N-O 3.31Å; I832-K854 VanDerWaalsContact N-O 3.12Å
855	Y	89.5	Confident	82.1	Confident	102 Å²	102	58.6 Å²	58.6	40%	0.4	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	148.3	-177	-56.1	-76.6	0	0	0	110.5	V829 F830 R831 P865 H866	V829-Y855 HydrophobicContact CG1-CD1 3.9Å; V829-Y855 HydrophobicContact CG1-CG 4.32Å; F830-Y855 WeakPolarHBondContact O-CA 3.46Å; R831-Y855 HydrophobicContact CB-CD1 4.1Å; R831-Y855 HydrophobicContact CB-CE1 4.07Å; R831-Y855 HydrophobicContact CG-CD1 4.23Å; R831-Y855 HydrophobicContact CG-CE1 3.95Å; Y855-P865 HydrophobicContact CE1-CG 4.3Å; Y855-H866 AromaticContact CE1-NE2 3.82Å; Y855-H866 AromaticContact CZ-NE2 3.85Å; Y855-H866 PolarHBondContact OH-NE2 2.86Å
856	C	90.4	Very high	82.9	Confident	3 Å²	3	64.8 Å²	64.8	2%	0.02	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	159.9	166.2	63.4	0	0	0	0	109.9	C397 F406 F830 I832	C397-C856 VanDerWaalsContact CA-SG 3.54Å; C397-C856 HydrophobicContact CB-CB 3.98Å; C397-C856 WeakPolarHBondContact CB-SG 3.41Å; C397-C856 VanDerWaalsContact SG-C 3.51Å; C397-C856 WeakPolarHBondContact SG-CB 3.46Å; C397-C856 CovalentContact SG-SG 2.04Å; C397-C856 PolarHBondContact SG-SG 3.47Å; F406-C856 HydrophobicContact CD1-CB 4.22Å; F406-C856 HydrophobicContact CE1-CB 3.98Å; F830-C856 PolarHBondContact N-O 3.08Å; F830-C856 PolarHBondContact O-N 2.94Å; I832-C856 HydrophobicContact CD1-CB 4.35Å; I832-C856 HydrophobicContact CG1-CB 4.48Å
857	R	91.4	Very high	83.9	Confident	57 Å²	57	63.9 Å²	63.9	22%	0.215	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	147.6	175.5	-67.8	-60.5	-170.3	106.2	16.4	111.7	I394 I395 M396 C397 N824 L827 S828	I394-R857 HydrophobicContact CG2-CB 4.19Å; I394-R857 HydrophobicContact CG2-CG 3.91Å; I395-R857 PolarHBondContact O-N 3.04Å; M396-R857 CarbonylContact C-O 3.57Å; M396-R857 WeakPolarHBondContact CA-O 3.33Å; M396-R857 HydrophobicContact SD-CB 3.91Å; C397-R857 PolarHBondContact N-O 3.11Å; C397-R857 PolarHBondContact SG-O 3.25Å; C397-R857 VanDerWaalsContact SG-O 3.33Å; N824-R857 PolarHBondContact O-NH1 3.41Å; N824-R857 VanDerWaalsContact OD1-CZ 3.32Å; N824-R857 PolarHBondContact OD1-NH1 3.45Å; N824-R857 PolarHBondContact OD1-NH2 2.96Å; L827-R857 HydrophobicContact CB-CB 4.22Å; L827-R857 HydrophobicContact CB-CG 4.38Å; L827-R857 HydrophobicContact CD1-CB 4.48Å; L827-R857 PolarHBondContact O-NH1 3.01Å; S828-R857 WeakPolarHBondContact O-CA 3.29Å; S828-R857 WeakPolarHBondContact O-CD 3.07Å
858	Y	90.2	Very high	84.7	Confident	21 Å²	21	65.3 Å²	65.3	8%	0.082	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	158.1	171.7	69.9	-74.3	0	0	0	110.7	H621 P622 L827 S828 F830 D860 R862	H621-Y858 HydrophobicContact CB-CE2 4.02Å; P622-Y858 HydrophobicContact CG-CD1 3.92Å; P622-Y858 HydrophobicContact CG-CD2 4.04Å; P622-Y858 HydrophobicContact CG-CE1 4.29Å; P622-Y858 HydrophobicContact CG-CE2 4.38Å; P622-Y858 HydrophobicContact CG-CG 3.78Å; L827-Y858 CarbonylContact C-O 3.58Å; L827-Y858 WeakPolarHBondContact CA-O 3.5Å; S828-Y858 VanDerWaalsContact CB-CE1 3.43Å; S828-Y858 PolarHBondContact N-O 3.42Å; S828-Y858 PolarHBondContact O-N 3.41Å; F830-Y858 HydrophobicContact CB-CD1 3.8Å; F830-Y858 HydrophobicContact CB-CE1 3.76Å; F830-Y858 HydrophobicContact CD2-CE1 4.45Å; Y858-D860 HydrophobicContact CD2-CB 4.12Å; Y858-D860 HydrophobicContact CE2-CB 3.85Å; Y858-D860 PolarHBondContact O-N 2.79Å; Y858-R862 VanDerWaalsContact OH-CD 3.24Å; Y858-R862 WeakPolarHBondContact OH-CD 3.42Å
859	R	87.9	Confident	85.6	Confident	96 Å²	96	66.2 Å²	66.2	36%	0.362	36%	0.362	S	S	.	.	S	Bend	trans	-94.5	79.1	-168	-168.6	-175.5	148.1	109.9	19.3	112	D794 L827	D794-R859 IonicContact OD1-CZ 3.93Å; D794-R859 IonicContact OD1-NH1 3.51Å; D794-R859 IonicContact OD1-NH2 2.72Å; D794-R859 PolarHBondContact OD1-NH2 3.16Å; D794-R859 IonicContact OD2-CZ 2.83Å; D794-R859 IonicContact OD2-NH1 2.96Å; D794-R859 PolarHBondContact OD2-NH1 3.34Å; D794-R859 IonicContact OD2-NH2 2.94Å; D794-R859 PolarHBondContact OD2-NH2 3.43Å; L827-R859 HydrophobicContact CD2-CB 4.14Å
860	D	88.6	Confident	86.8	Confident	28 Å²	28	66 Å²	66	15%	0.15	36%	0.36	C	S	.	.	S	Bend	trans	-147.4	173.3	167.9	-159.5	-4.5	0	0	0	109.6	S828 Y858 R862	S828-D860 VanDerWaalsContact OG-C 3.28Å; S828-D860 PolarHBondContact OG-O 2.8Å; Y858-D860 HydrophobicContact CD2-CB 4.12Å; Y858-D860 HydrophobicContact CE2-CB 3.85Å; Y858-D860 PolarHBondContact O-N 2.79Å; D860-R862 HydrophobicContact CB-CG 4.35Å; D860-R862 IonicContact OD2-CZ 3.03Å; D860-R862 IonicContact OD2-NE 2.72Å; D860-R862 PolarHBondContact OD2-NE 3.34Å; D860-R862 IonicContact OD2-NH2 3.26Å; D860-R862 PolarHBondContact OD2-NH2 2.92Å
861	Y	91.1	Very high	87.9	Confident	23 Å²	23	63.8 Å²	63.8	9%	0.09	33%	0.33	C	S	.	.			trans	-105.4	64.5	-180	-65.6	-65.6	0	0	0	111.8	P797 T874 Q876 V880	P797-Y861 WeakPolarHBondContact CB-OH 3.07Å; Y861-T874 WeakPolarHBondContact O-CB 3.47Å; Y861-T874 WeakPolarHBondContact O-CG2 3.35Å; Y861-T874 PolarHBondContact O-N 3Å; Y861-T874 PolarHBondContact O-OG1 3.39Å; Y861-Q876 HydrophobicContact CD1-CB 4.44Å; Y861-Q876 HydrophobicContact CD1-CG 3.88Å; Y861-Q876 HydrophobicContact CE1-CG 4.17Å; Y861-Q876 VanDerWaalsContact CE1-NE2 3.27Å; Y861-Q876 HydrophobicContact CG-CG 4.43Å; Y861-V880 HydrophobicContact CE2-CG1 4.38Å; Y861-V880 HydrophobicContact CE2-CG2 4.3Å
862	R	92.1	Very high	88.7	Confident	30 Å²	30	60.8 Å²	60.8	11%	0.113	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-116.1	153.4	-173.9	-70.2	176.6	-175.6	-101.9	3.2	114	S828 Y858 D860 Y871 G872 Y873	S828-R862 PolarHBondContact OG-N 3.26Å; S828-R862 PolarHBondContact OG-O 3.45Å; Y858-R862 VanDerWaalsContact OH-CD 3.24Å; Y858-R862 WeakPolarHBondContact OH-CD 3.42Å; D860-R862 HydrophobicContact CB-CG 4.35Å; D860-R862 IonicContact OD2-CZ 3.03Å; D860-R862 IonicContact OD2-NE 2.72Å; D860-R862 PolarHBondContact OD2-NE 3.34Å; D860-R862 IonicContact OD2-NH2 3.26Å; D860-R862 PolarHBondContact OD2-NH2 2.92Å; R862-Y871 WeakPolarHBondContact CD-O 3.42Å; R862-Y871 PolarHBondContact NH1-O 3.32Å; R862-G872 CarbonylContact C-O 3.09Å; R862-G872 WeakPolarHBondContact CA-O 3.05Å; R862-G872 VanDerWaalsContact CB-O 3.31Å; R862-G872 WeakPolarHBondContact CB-O 3.45Å; R862-G872 WeakPolarHBondContact CG-O 3.25Å; R862-Y873 HydrophobicContact CG-CD1 4.17Å; R862-Y873 PolarHBondContact NH2-OH 2.88Å; R862-Y873 VanDerWaalsContact NH2-OH 3.15Å
863	D	92.1	Very high	89.4	Confident	53 Å²	53	61.9 Å²	61.9	28%	0.283	31%	0.311	S	S	.	.			trans	-70.8	141.6	-179.6	-77.8	-71.2	0	0	0	112.4	Y871 G872	D863-Y871 PolarHBondContact O-N 3.37Å; D863-G872 PolarHBondContact N-O 2.96Å
864	P	91.9	Very high	89.8	Confident	57 Å²	57	61.9 Å²	61.9	37%	0.37	31%	0.312	S	S	.	.			trans	-69.4	162.5	-173.3	28.9	-36.3	0	0	0	112.9	H866 S867	P864-H866 PolarHBondContact O-N 2.91Å; P864-S867 WeakPolarHBondContact O-CB 3.29Å; P864-S867 PolarHBondContact O-N 3.25Å; P864-S867 PolarHBondContact O-OG 2.96Å
865	P	90.8	Very high	90.1	Very high	10 Å²	10	60.6 Å²	60.6	7%	0.065	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	13	-177.6	29.6	-37.3	0	0	0	115.6	V829 R831 Y855 Y871	V829-P865 HydrophobicContact CG1-CG 4.23Å; R831-P865 HydrophobicContact CB-CB 4.12Å; R831-P865 HydrophobicContact CB-CG 4.15Å; R831-P865 PolarHBondContact NH2-O 3.36Å; Y855-P865 HydrophobicContact CE1-CG 4.3Å; P865-Y871 HydrophobicContact CB-CE1 4.09Å; P865-Y871 WeakPolarHBondContact CB-OH 3.48Å
866	H	88.3	Confident	90.2	Very high	129 Å²	129	57 Å²	57	60%	0.597	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.9	3.7	175.5	-57.3	-89.9	0	0	0	112.2	R831 Y855 P864	R831-H866 PolarHBondContact NH2-CE1 2.6Å; R831-H866 VanDerWaalsContact NH2-CE1 3.32Å; Y855-H866 AromaticContact CE1-NE2 3.82Å; Y855-H866 AromaticContact CZ-NE2 3.85Å; Y855-H866 PolarHBondContact OH-NE2 2.86Å; P864-H866 PolarHBondContact O-N 2.91Å
867	S	89.8	Confident	90.3	Very high	35 Å²	35	57.8 Å²	57.8	25%	0.245	30%	0.302	C	S	.	.	S	Bend	trans	-80.8	168.4	175.9	67.3	0	0	0	0	111.9	P864 A869 P870	P864-S867 WeakPolarHBondContact O-CB 3.29Å; P864-S867 PolarHBondContact O-N 3.25Å; P864-S867 PolarHBondContact O-OG 2.96Å; S867-A869 PolarHBondContact O-N 2.92Å; S867-A869 PolarHBondContact OG-O 3.34Å; S867-P870 WeakPolarHBondContact OG-CA 3.41Å
868	L	87.1	Confident	90.5	Very high	188 Å²	188	61.9 Å²	61.9	98%	0.984	32%	0.318	S	S	*	.	S	Bend	trans	-67.5	-19.2	174.9	-64.1	171.4	0	0	0	113.4
869	A	87.9	Confident	90.7	Very high	62 Å²	62	64.7 Å²	64.7	51%	0.512	33%	0.331	S	S	.	.	S	Bend	trans	-137.6	73.1	-179.4	0	0	0	0	0	109.1	S867 Y871 G872	S867-A869 PolarHBondContact O-N 2.92Å; S867-A869 PolarHBondContact OG-O 3.34Å; A869-Y871 PolarHBondContact O-N 2.92Å; A869-G872 PolarHBondContact O-N 2.72Å; A869-G872 VanDerWaalsContact O-N 3.16Å
870	P	87.9	Confident	90.9	Very high	71 Å²	71	60.3 Å²	60.3	46%	0.461	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	137	-172.2	24.9	-34.9	0	0	0	111.4	S867 G872	S867-P870 WeakPolarHBondContact OG-CA 3.41Å; P870-G872 PolarHBondContact O-N 3.43Å
871	Y	89.8	Confident	91.2	Very high	23 Å²	23	61.5 Å²	61.5	9%	0.09	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.6	10	-179.5	-43	-54.3	0	0	0	115.8	H621 F830 R831 D834 R862 D863 P865 A869	H621-Y871 AromaticContact ND1-CG 3.94Å; F830-Y871 HydrophobicContact CD2-CD1 4.22Å; F830-Y871 AromaticContact CD2-CE1 3.51Å; F830-Y871 HydrophobicContact CD2-CE1 3.51Å; F830-Y871 HydrophobicContact CD2-CE2 4.37Å; F830-Y871 AromaticContact CD2-CZ 3.58Å; F830-Y871 HydrophobicContact CE2-CE1 4.04Å; F830-Y871 HydrophobicContact CE2-CE2 4.05Å; F830-Y871 AromaticContact CE2-CZ 3.67Å; F830-Y871 HydrophobicContact CG-CE1 4.49Å; R831-Y871 PolarHBondContact N-OH 3.23Å; D834-Y871 HydrophobicContact CB-CE2 4.22Å; D834-Y871 PolarHBondContact OD2-OH 2.88Å; R862-Y871 WeakPolarHBondContact CD-O 3.42Å; R862-Y871 PolarHBondContact NH1-O 3.32Å; D863-Y871 PolarHBondContact O-N 3.37Å; P865-Y871 HydrophobicContact CB-CE1 4.09Å; P865-Y871 WeakPolarHBondContact CB-OH 3.48Å; A869-Y871 PolarHBondContact O-N 2.92Å
872	G	89.9	Confident	91.4	Very high	26 Å²	26	63.2 Å²	63.2	27%	0.268	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-64.6	163.8	167.6	0	0	0	0	0	113	R862 D863 A869 P870	R862-G872 CarbonylContact C-O 3.09Å; R862-G872 WeakPolarHBondContact CA-O 3.05Å; R862-G872 VanDerWaalsContact CB-O 3.31Å; R862-G872 WeakPolarHBondContact CB-O 3.45Å; R862-G872 WeakPolarHBondContact CG-O 3.25Å; D863-G872 PolarHBondContact N-O 2.96Å; A869-G872 PolarHBondContact O-N 2.72Å; A869-G872 VanDerWaalsContact O-N 3.16Å; P870-G872 PolarHBondContact O-N 3.43Å
873	Y	91.9	Very high	91.6	Very high	101 Å²	101	63.2 Å²	63.2	40%	0.396	35%	0.347	S	S	.	.	B	Isolated β-bridge	trans	-81.1	122.7	176.9	-70.6	-62.4	0	0	0	111.8	R862 F877	R862-Y873 HydrophobicContact CG-CD1 4.17Å; R862-Y873 PolarHBondContact NH2-OH 2.88Å; R862-Y873 VanDerWaalsContact NH2-OH 3.15Å; Y873-F877 HydrophobicContact CD1-CB 4.31Å; Y873-F877 HydrophobicContact CD1-CD1 4.01Å; Y873-F877 AromaticContact CD1-CD2 3.57Å; Y873-F877 HydrophobicContact CD1-CD2 3.57Å; Y873-F877 HydrophobicContact CD1-CE1 4.19Å; Y873-F877 AromaticContact CD1-CE2 3.76Å; Y873-F877 HydrophobicContact CD1-CE2 3.76Å; Y873-F877 AromaticContact CD1-CG 3.7Å; Y873-F877 HydrophobicContact CD1-CG 3.7Å; Y873-F877 HydrophobicContact CD1-CZ 4.06Å; Y873-F877 HydrophobicContact CD2-CE1 4.49Å; Y873-F877 AromaticContact CE1-CD2 3.81Å; Y873-F877 HydrophobicContact CE1-CD2 3.81Å; Y873-F877 HydrophobicContact CE1-CE1 4.33Å; Y873-F877 AromaticContact CE1-CE2 3.52Å; Y873-F877 HydrophobicContact CE1-CE2 3.52Å; Y873-F877 HydrophobicContact CE1-CG 4.33Å; Y873-F877 AromaticContact CE1-CZ 3.81Å; Y873-F877 HydrophobicContact CE1-CZ 3.81Å; Y873-F877 HydrophobicContact CG-CD1 4.05Å; Y873-F877 HydrophobicContact CG-CD2 4.41Å; Y873-F877 HydrophobicContact CG-CE1 4.27Å; Y873-F877 HydrophobicContact CG-CG 4.12Å
874	T	92.1	Very high	91.7	Very high	26 Å²	26	62.5 Å²	62.5	16%	0.16	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-65.7	163.3	176.8	63	0	0	0	0	112.5	Y861 Q876 F877 W878	Y861-T874 WeakPolarHBondContact O-CB 3.47Å; Y861-T874 WeakPolarHBondContact O-CG2 3.35Å; Y861-T874 PolarHBondContact O-N 3Å; Y861-T874 PolarHBondContact O-OG1 3.39Å; T874-Q876 PolarHBondContact O-N 3.32Å; T874-Q876 PolarHBondContact OG1-N 3.5Å; T874-F877 WeakPolarHBondContact O-CB 3.14Å; T874-F877 PolarHBondContact O-N 2.89Å; T874-F877 VanDerWaalsContact O-N 3.14Å; T874-F877 PolarHBondContact OG1-N 3.16Å; T874-W878 VanDerWaalsContact O-CD1 3.32Å
875	L	91.5	Very high	91.9	Very high	132 Å²	132	64.4 Å²	64.4	69%	0.691	35%	0.347	S	S	*	.	H	α-helix	trans	-58.1	-25.3	167.1	-68.5	172.9	0	0	0	113.2	W878 H879	L875-W878 PolarHBondContact O-N 3.46Å; L875-H879 PolarHBondContact O-N 3.18Å; L875-H879 PolarHBondContact O-ND1 3.37Å; L875-H879 VanDerWaalsContact O-ND1 3.11Å
876	Q	91.5	Very high	92.1	Very high	27 Å²	27	66.4 Å²	66.4	13%	0.126	36%	0.364	C	S	.	.	H	α-helix	trans	-68.4	-36.4	177.2	-172.7	172.5	-16.2	0	0	111.8	Y805 Y861 T874 W878 H879 V880	Y805-Q876 HydrophobicContact CD2-CG 4.29Å; Y805-Q876 HydrophobicContact CE1-CB 4.35Å; Y805-Q876 HydrophobicContact CE2-CB 4.18Å; Y805-Q876 HydrophobicContact CE2-CG 3.86Å; Y805-Q876 WeakPolarHBondContact OH-CA 3.37Å; Y805-Q876 PolarHBondContact OH-N 3.1Å; Y861-Q876 HydrophobicContact CD1-CB 4.44Å; Y861-Q876 HydrophobicContact CD1-CG 3.88Å; Y861-Q876 HydrophobicContact CE1-CG 4.17Å; Y861-Q876 VanDerWaalsContact CE1-NE2 3.27Å; Y861-Q876 HydrophobicContact CG-CG 4.43Å; T874-Q876 PolarHBondContact O-N 3.32Å; T874-Q876 PolarHBondContact OG1-N 3.5Å; Q876-W878 VanDerWaalsContact C-N 3.33Å; Q876-W878 PolarHBondContact O-N 2.87Å; Q876-H879 PolarHBondContact O-N 3.44Å; Q876-V880 WeakPolarHBondContact O-CB 3.48Å; Q876-V880 VanDerWaalsContact O-CG2 3.32Å; Q876-V880 WeakPolarHBondContact O-CG2 3.48Å; Q876-V880 PolarHBondContact O-N 2.86Å
877	F	92.7	Very high	92.5	Very high	18 Å²	18	62.1 Å²	62.1	8%	0.079	34%	0.343	C	S	.	.	H	α-helix	trans	-55	-49.6	171	-179.7	-93.3	0	0	0	111.1	Y873 T874 V880 L881	Y873-F877 HydrophobicContact CD1-CB 4.31Å; Y873-F877 HydrophobicContact CD1-CD1 4.01Å; Y873-F877 AromaticContact CD1-CD2 3.57Å; Y873-F877 HydrophobicContact CD1-CD2 3.57Å; Y873-F877 HydrophobicContact CD1-CE1 4.19Å; Y873-F877 AromaticContact CD1-CE2 3.76Å; Y873-F877 HydrophobicContact CD1-CE2 3.76Å; Y873-F877 AromaticContact CD1-CG 3.7Å; Y873-F877 HydrophobicContact CD1-CG 3.7Å; Y873-F877 HydrophobicContact CD1-CZ 4.06Å; Y873-F877 HydrophobicContact CD2-CE1 4.49Å; Y873-F877 AromaticContact CE1-CD2 3.81Å; Y873-F877 HydrophobicContact CE1-CD2 3.81Å; Y873-F877 HydrophobicContact CE1-CE1 4.33Å; Y873-F877 AromaticContact CE1-CE2 3.52Å; Y873-F877 HydrophobicContact CE1-CE2 3.52Å; Y873-F877 HydrophobicContact CE1-CG 4.33Å; Y873-F877 AromaticContact CE1-CZ 3.81Å; Y873-F877 HydrophobicContact CE1-CZ 3.81Å; Y873-F877 HydrophobicContact CG-CD1 4.05Å; Y873-F877 HydrophobicContact CG-CD2 4.41Å; Y873-F877 HydrophobicContact CG-CE1 4.27Å; Y873-F877 HydrophobicContact CG-CG 4.12Å; T874-F877 WeakPolarHBondContact O-CB 3.14Å; T874-F877 PolarHBondContact O-N 2.89Å; T874-F877 VanDerWaalsContact O-N 3.14Å; T874-F877 PolarHBondContact OG1-N 3.16Å; F877-V880 PolarHBondContact O-N 2.81Å; F877-L881 HydrophobicContact CE1-CD2 4.05Å; F877-L881 WeakPolarHBondContact O-CB 3.24Å; F877-L881 PolarHBondContact O-N 3.47Å
878	W	94.7	Very high	92.8	Very high	143 Å²	143	61 Å²	61	54%	0.542	34%	0.335	S	S	.	.	H	α-helix	trans	-69.2	-39.8	-176.9	-65.5	105.1	0	0	0	112.9	T874 L875 Q876 L881 A882	T874-W878 VanDerWaalsContact O-CD1 3.32Å; L875-W878 PolarHBondContact O-N 3.46Å; Q876-W878 VanDerWaalsContact C-N 3.33Å; Q876-W878 PolarHBondContact O-N 2.87Å; W878-L881 HydrophobicContact CE3-CD2 4.08Å; W878-L881 HydrophobicContact CZ3-CD2 3.99Å; W878-L881 PolarHBondContact O-N 2.91Å; W878-A882 WeakPolarHBondContact O-CB 3.5Å; W878-A882 PolarHBondContact O-N 3.1Å
879	H	94.4	Very high	93.2	Very high	81 Å²	81	56.8 Å²	56.8	38%	0.375	31%	0.312	S	S	.	.	H	α-helix	trans	-62.1	-43.5	172.4	-70	133.4	0	0	0	112.2	V800 Y805 L875 Q876 A883	V800-H879 HydrophobicContact CG1-CB 4.18Å; Y805-H879 AromaticContact CZ-ND1 3.84Å; Y805-H879 PolarHBondContact OH-ND1 3.34Å; L875-H879 PolarHBondContact O-N 3.18Å; L875-H879 PolarHBondContact O-ND1 3.37Å; L875-H879 VanDerWaalsContact O-ND1 3.11Å; Q876-H879 PolarHBondContact O-N 3.44Å; H879-A883 VanDerWaalsContact O-CB 3.3Å; H879-A883 WeakPolarHBondContact O-CB 3.31Å; H879-A883 PolarHBondContact O-N 3.14Å
880	V	93.8	Very high	93.5	Very high	3 Å²	3	58.4 Å²	58.4	2%	0.018	32%	0.315	C	S	.	.	H	α-helix	trans	-66	-41	176.8	171.1	0	0	0	0	111.2	P797 V800 Y861 Q876 F877 A883 R884	P797-V880 HydrophobicContact CB-CG1 4.3Å; P797-V880 HydrophobicContact CG-CG1 3.96Å; V800-V880 HydrophobicContact CB-CG2 4.13Å; V800-V880 HydrophobicContact CG1-CG2 3.92Å; V800-V880 HydrophobicContact CG2-CG2 4.48Å; Y861-V880 HydrophobicContact CE2-CG1 4.38Å; Y861-V880 HydrophobicContact CE2-CG2 4.3Å; Q876-V880 WeakPolarHBondContact O-CB 3.48Å; Q876-V880 VanDerWaalsContact O-CG2 3.32Å; Q876-V880 WeakPolarHBondContact O-CG2 3.48Å; Q876-V880 PolarHBondContact O-N 2.86Å; F877-V880 PolarHBondContact O-N 2.81Å; V880-A883 PolarHBondContact O-N 2.61Å; V880-R884 HydrophobicContact CG1-CG 4.5Å; V880-R884 WeakPolarHBondContact O-CB 3.48Å; V880-R884 WeakPolarHBondContact O-CG 3.46Å; V880-R884 PolarHBondContact O-N 3.15Å
881	L	93.8	Very high	93.8	Very high	54 Å²	54	55.6 Å²	55.6	28%	0.283	30%	0.296	S	S	.	.	H	α-helix	trans	-64.7	-44.8	176.8	-177.7	60	0	0	0	112.2	F877 W878 R884 L885	F877-L881 HydrophobicContact CE1-CD2 4.05Å; F877-L881 WeakPolarHBondContact O-CB 3.24Å; F877-L881 PolarHBondContact O-N 3.47Å; W878-L881 HydrophobicContact CE3-CD2 4.08Å; W878-L881 HydrophobicContact CZ3-CD2 3.99Å; W878-L881 PolarHBondContact O-N 2.91Å; L881-R884 PolarHBondContact O-N 3.19Å; L881-L885 WeakPolarHBondContact O-CG 3.38Å; L881-L885 PolarHBondContact O-N 3.32Å; L881-L885 VanDerWaalsContact O-N 3.11Å
882	A	95.9	Very high	94	Very high	59 Å²	59	57 Å²	57	49%	0.488	30%	0.303	S	S	.	.	H	α-helix	trans	-62.7	-44.5	176.3	0	0	0	0	0	111.8	W878 R884 L885 A886	W878-A882 WeakPolarHBondContact O-CB 3.5Å; W878-A882 PolarHBondContact O-N 3.1Å; A882-R884 VanDerWaalsContact C-N 3.34Å; A882-R884 PolarHBondContact O-N 3.28Å; A882-L885 PolarHBondContact O-N 2.85Å; A882-A886 WeakPolarHBondContact O-CB 3.34Å; A882-A886 PolarHBondContact O-N 3.12Å
883	A	95.8	Very high	94.2	Very high	30 Å²	30	61.6 Å²	61.6	25%	0.248	32%	0.318	C	S	.	.	H	α-helix	trans	-63.1	-37.6	176.6	0	0	0	0	0	112.6	I796 V800 H879 V880 F887	I796-A883 HydrophobicContact CG2-CB 3.78Å; V800-A883 HydrophobicContact CG2-CB 3.42Å; V800-A883 VanDerWaalsContact CG2-CB 3.42Å; H879-A883 VanDerWaalsContact O-CB 3.3Å; H879-A883 WeakPolarHBondContact O-CB 3.31Å; H879-A883 PolarHBondContact O-N 3.14Å; V880-A883 PolarHBondContact O-N 2.61Å; A883-F887 VanDerWaalsContact O-CB 3.3Å; A883-F887 WeakPolarHBondContact O-CB 3.12Å; A883-F887 PolarHBondContact O-N 3.24Å
884	R	95.2	Very high	94.3	Very high	38 Å²	38	61.4 Å²	61.4	14%	0.143	32%	0.323	C	S	.	.	H	α-helix	trans	-61.3	-49.1	174.5	-78.4	172.3	152.7	163.6	-11.7	111.9	A790 I791 I796 V880 L881 A882 F887 I888	A790-R884 HydrophobicContact CB-CB 4.4Å; A790-R884 WeakPolarHBondContact O-CD 3.17Å; A790-R884 WeakPolarHBondContact O-CG 3.46Å; A790-R884 PolarHBondContact O-NE 3.38Å; I791-R884 PolarHBondContact O-NH2 3.11Å; I796-R884 HydrophobicContact CB-CG 4.15Å; I796-R884 HydrophobicContact CG2-CG 3.85Å; V880-R884 HydrophobicContact CG1-CG 4.5Å; V880-R884 WeakPolarHBondContact O-CB 3.48Å; V880-R884 WeakPolarHBondContact O-CG 3.46Å; V880-R884 PolarHBondContact O-N 3.15Å; L881-R884 PolarHBondContact O-N 3.19Å; A882-R884 VanDerWaalsContact C-N 3.34Å; A882-R884 PolarHBondContact O-N 3.28Å; R884-F887 PolarHBondContact O-N 3.32Å; R884-I888 WeakPolarHBondContact O-CD1 3.42Å; R884-I888 WeakPolarHBondContact O-CG1 3.36Å; R884-I888 PolarHBondContact O-N 3.43Å; R884-I888 VanDerWaalsContact O-N 3.11Å
885	L	95.1	Very high	94.4	Very high	97 Å²	97	60.4 Å²	60.4	51%	0.508	32%	0.317	S	S	.	.	H	α-helix	trans	-65.2	-43.6	178.8	-66.5	172.8	0	0	0	111.9	L881 A882 F887 I888 I889	L881-L885 WeakPolarHBondContact O-CG 3.38Å; L881-L885 PolarHBondContact O-N 3.32Å; L881-L885 VanDerWaalsContact O-N 3.11Å; A882-L885 PolarHBondContact O-N 2.85Å; L885-F887 PolarHBondContact O-N 2.96Å; L885-I888 PolarHBondContact O-N 2.97Å; L885-I889 WeakPolarHBondContact O-CG1 3.21Å; L885-I889 PolarHBondContact O-N 3.32Å
886	A	96.2	Very high	94.5	Very high	51 Å²	51	56 Å²	56	42%	0.421	29%	0.292	S	S	.	.	H	α-helix	trans	-61.7	-41.6	176	0	0	0	0	0	112.2	A882 I889 V890	A882-A886 WeakPolarHBondContact O-CB 3.34Å; A882-A886 PolarHBondContact O-N 3.12Å; A886-I889 PolarHBondContact O-N 2.9Å; A886-V890 WeakPolarHBondContact O-CB 3.28Å; A886-V890 WeakPolarHBondContact O-CG2 3.46Å; A886-V890 PolarHBondContact O-N 3.48Å
887	F	95.1	Very high	94.6	Very high	39 Å²	39	58.7 Å²	58.7	17%	0.171	31%	0.313	C	S	.	.	H	α-helix	trans	-62	-45.9	176.6	177.7	-91.3	0	0	0	112.2	V428 I789 A790 F795 I796 A883 R884 L885 I889 V890 F891	V428-F887 HydrophobicContact CG1-CZ 4.23Å; I789-F887 HydrophobicContact CB-CE1 3.91Å; I789-F887 HydrophobicContact CB-CZ 4.33Å; I789-F887 HydrophobicContact CG2-CD1 4.46Å; I789-F887 HydrophobicContact CG2-CE1 3.52Å; I789-F887 HydrophobicContact CG2-CZ 3.57Å; A790-F887 HydrophobicContact CB-CD1 4.23Å; F795-F887 HydrophobicContact CE1-CE2 4.49Å; I796-F887 HydrophobicContact CD1-CB 3.8Å; I796-F887 HydrophobicContact CD1-CD1 4.09Å; I796-F887 HydrophobicContact CD1-CD2 3.59Å; I796-F887 HydrophobicContact CD1-CE2 4.19Å; I796-F887 HydrophobicContact CD1-CG 3.53Å; I796-F887 HydrophobicContact CG1-CB 4.44Å; I796-F887 HydrophobicContact CG1-CG 4.33Å; A883-F887 VanDerWaalsContact O-CB 3.3Å; A883-F887 WeakPolarHBondContact O-CB 3.12Å; A883-F887 PolarHBondContact O-N 3.24Å; R884-F887 PolarHBondContact O-N 3.32Å; L885-F887 PolarHBondContact O-N 2.96Å; F887-I889 PolarHBondContact O-N 3.03Å; F887-V890 PolarHBondContact O-N 3.39Å; F887-F891 HydrophobicContact CD1-CB 4.46Å; F887-F891 HydrophobicContact CE1-CB 4.09Å; F887-F891 HydrophobicContact CE1-CD2 4Å; F887-F891 HydrophobicContact CE1-CG 4.2Å; F887-F891 HydrophobicContact CE2-CD2 4.38Å; F887-F891 HydrophobicContact CZ-CB 4.21Å; F887-F891 AromaticContact CZ-CD2 3.59Å; F887-F891 HydrophobicContact CZ-CD2 3.59Å; F887-F891 HydrophobicContact CZ-CE2 4.32Å; F887-F891 HydrophobicContact CZ-CG 4.21Å; F887-F891 WeakPolarHBondContact O-CB 3.38Å; F887-F891 PolarHBondContact O-N 2.91Å
888	I	95.6	Very high	94.6	Very high	12 Å²	12	60.2 Å²	60.2	6%	0.062	32%	0.321	C	S	.	.	H	α-helix	trans	-56.6	-52.2	178.5	-66.8	159.1	0	0	0	109.9	A786 F787 A790 R884 L885 V890 F891 E892	A786-I888 HydrophobicContact CB-CG2 4.34Å; F787-I888 HydrophobicContact CD1-CD1 3.7Å; F787-I888 HydrophobicContact CD1-CG1 4.48Å; F787-I888 HydrophobicContact CE1-CD1 3.69Å; F787-I888 HydrophobicContact CZ-CG2 4.37Å; A790-I888 HydrophobicContact CB-CD1 3.71Å; A790-I888 HydrophobicContact CB-CG1 3.52Å; R884-I888 WeakPolarHBondContact O-CD1 3.42Å; R884-I888 WeakPolarHBondContact O-CG1 3.36Å; R884-I888 PolarHBondContact O-N 3.43Å; R884-I888 VanDerWaalsContact O-N 3.11Å; L885-I888 PolarHBondContact O-N 2.97Å; I888-V890 PolarHBondContact O-N 2.98Å; I888-F891 PolarHBondContact O-N 3.35Å; I888-E892 WeakPolarHBondContact O-CB 3.5Å; I888-E892 PolarHBondContact O-N 3.34Å
889	I	95.6	Very high	94.3	Very high	99 Å²	99	54.6 Å²	54.6	51%	0.508	30%	0.301	S	S	.	.	H	α-helix	trans	-58.4	-48.6	-179	-65.5	166.9	0	0	0	111	L885 A886 F887 H893	L885-I889 WeakPolarHBondContact O-CG1 3.21Å; L885-I889 PolarHBondContact O-N 3.32Å; A886-I889 PolarHBondContact O-N 2.9Å; F887-I889 PolarHBondContact O-N 3.03Å; I889-H893 WeakPolarHBondContact O-CB 3.34Å; I889-H893 PolarHBondContact O-N 3.48Å; I889-H893 VanDerWaalsContact O-N 3.09Å; I889-H893 PolarHBondContact O-ND1 2.87Å
890	V	95.2	Very high	94.1	Very high	97 Å²	97	56.8 Å²	56.8	59%	0.588	31%	0.311	S	S	*	.	H	α-helix	trans	-66.2	-45.2	-178.5	171.1	0	0	0	0	111.8	A886 F887 I888 L894	A886-V890 WeakPolarHBondContact O-CB 3.28Å; A886-V890 WeakPolarHBondContact O-CG2 3.46Å; A886-V890 PolarHBondContact O-N 3.48Å; F887-V890 PolarHBondContact O-N 3.39Å; I888-V890 PolarHBondContact O-N 2.98Å; V890-L894 WeakPolarHBondContact O-CB 3.47Å; V890-L894 PolarHBondContact O-N 3.32Å
891	F	93.9	Very high	94.1	Very high	12 Å²	12	61.3 Å²	61.3	5%	0.053	33%	0.334	C	S	.	.	H	α-helix	trans	-62.7	-48.2	179.1	-176.7	-80.4	0	0	0	111.2	A431 V432 A786 I789 F887 I888 L894 V895	A431-F891 HydrophobicContact CB-CZ 4.2Å; V432-F891 HydrophobicContact CG2-CD2 4.26Å; V432-F891 HydrophobicContact CG2-CE2 3.52Å; V432-F891 HydrophobicContact CG2-CZ 3.98Å; A786-F891 HydrophobicContact CB-CD1 3.61Å; A786-F891 HydrophobicContact CB-CE1 4.1Å; A786-F891 HydrophobicContact CB-CG 4.31Å; I789-F891 HydrophobicContact CD1-CE2 4.07Å; I789-F891 HydrophobicContact CD1-CZ 4.24Å; F887-F891 HydrophobicContact CD1-CB 4.46Å; F887-F891 HydrophobicContact CE1-CB 4.09Å; F887-F891 HydrophobicContact CE1-CD2 4Å; F887-F891 HydrophobicContact CE1-CG 4.2Å; F887-F891 HydrophobicContact CE2-CD2 4.38Å; F887-F891 HydrophobicContact CZ-CB 4.21Å; F887-F891 AromaticContact CZ-CD2 3.59Å; F887-F891 HydrophobicContact CZ-CD2 3.59Å; F887-F891 HydrophobicContact CZ-CE2 4.32Å; F887-F891 HydrophobicContact CZ-CG 4.21Å; F887-F891 WeakPolarHBondContact O-CB 3.38Å; F887-F891 PolarHBondContact O-N 2.91Å; I888-F891 PolarHBondContact O-N 3.35Å; F891-L894 PolarHBondContact O-N 2.88Å; F891-V895 HydrophobicContact CD1-CG2 4.14Å; F891-V895 HydrophobicContact CE1-CG2 3.98Å; F891-V895 HydrophobicContact CZ-CG2 4.25Å; F891-V895 WeakPolarHBondContact O-CB 3.19Å; F891-V895 VanDerWaalsContact O-CG2 3.27Å; F891-V895 WeakPolarHBondContact O-CG2 3.2Å; F891-V895 PolarHBondContact O-N 3.38Å
892	E	94.6	Very high	94	Very high	51 Å²	51	60 Å²	60	24%	0.238	33%	0.327	C	S	.	.	H	α-helix	trans	-60.3	-51.9	-179.2	-176.4	177.7	-177.1	0	0	111.7	I888 L894 V895 F896	I888-E892 WeakPolarHBondContact O-CB 3.5Å; I888-E892 PolarHBondContact O-N 3.34Å; E892-L894 PolarHBondContact O-N 3.33Å; E892-V895 PolarHBondContact O-N 3.28Å; E892-F896 HydrophobicContact CG-CD2 3.6Å; E892-F896 HydrophobicContact CG-CE2 3.46Å; E892-F896 VanDerWaalsContact CG-CE2 3.46Å; E892-F896 WeakPolarHBondContact O-CB 3.35Å; E892-F896 WeakPolarHBondContact O-CD2 3.34Å; E892-F896 PolarHBondContact O-N 2.89Å
893	H	94.8	Very high	93.7	Very high	124 Å²	124	59.2 Å²	59.2	57%	0.574	32%	0.319	S	S	*	.	H	α-helix	trans	-66.8	-38.3	-179	-72	73.9	0	0	0	112.2	I889 C897	I889-H893 WeakPolarHBondContact O-CB 3.34Å; I889-H893 PolarHBondContact O-N 3.48Å; I889-H893 VanDerWaalsContact O-N 3.09Å; I889-H893 PolarHBondContact O-ND1 2.87Å; H893-C897 WeakPolarHBondContact O-CB 3.33Å; H893-C897 PolarHBondContact O-N 3.06Å
894	L	94.1	Very high	93.4	Very high	97 Å²	97	67.2 Å²	67.2	51%	0.508	34%	0.344	S	S	.	.	H	α-helix	trans	-62.9	-50.1	175.7	177.6	62	0	0	0	111.4	V890 F891 E892 C897 I898	V890-L894 WeakPolarHBondContact O-CB 3.47Å; V890-L894 PolarHBondContact O-N 3.32Å; F891-L894 PolarHBondContact O-N 2.88Å; E892-L894 PolarHBondContact O-N 3.33Å; L894-C897 PolarHBondContact O-N 2.88Å; L894-I898 HydrophobicContact CD1-CD1 3.99Å; L894-I898 HydrophobicContact CD1-CG1 4.48Å; L894-I898 HydrophobicContact CG-CD1 4.02Å; L894-I898 VanDerWaalsContact O-CG1 3.3Å; L894-I898 WeakPolarHBondContact O-CG1 3.43Å; L894-I898 PolarHBondContact O-N 2.8Å
895	V	92.5	Very high	93.3	Very high	4 Å²	4	70.9 Å²	70.9	2%	0.024	37%	0.366	C	S	.	.	H	α-helix	trans	-68.3	-39.5	-177.7	174	0	0	0	0	111.3	V432 A435 V782 F891 E892 I898 K899	V432-V895 HydrophobicContact CG1-CG2 4.38Å; V432-V895 HydrophobicContact CG2-CG2 4.28Å; A435-V895 HydrophobicContact CB-CG1 3.46Å; A435-V895 VanDerWaalsContact CB-CG1 3.46Å; V782-V895 HydrophobicContact CB-CG1 4.31Å; V782-V895 HydrophobicContact CG1-CB 3.87Å; V782-V895 HydrophobicContact CG1-CG1 3.63Å; V782-V895 HydrophobicContact CG2-CG1 3.71Å; F891-V895 HydrophobicContact CD1-CG2 4.14Å; F891-V895 HydrophobicContact CE1-CG2 3.98Å; F891-V895 HydrophobicContact CZ-CG2 4.25Å; F891-V895 WeakPolarHBondContact O-CB 3.19Å; F891-V895 VanDerWaalsContact O-CG2 3.27Å; F891-V895 WeakPolarHBondContact O-CG2 3.2Å; F891-V895 PolarHBondContact O-N 3.38Å; E892-V895 PolarHBondContact O-N 3.28Å; V895-I898 PolarHBondContact O-N 2.91Å; V895-K899 WeakPolarHBondContact O-CB 3.25Å; V895-K899 PolarHBondContact O-N 3.2Å
896	F	93.5	Very high	93	Very high	39 Å²	39	67.4 Å²	67.4	17%	0.171	35%	0.347	C	S	.	.	H	α-helix	trans	-68.1	-34.9	173.3	-74.9	-45.6	0	0	0	113	I779 V782 I783 E892 K899 H900	I779-F896 HydrophobicContact CG2-CE1 4.18Å; I779-F896 HydrophobicContact CG2-CZ 3.95Å; V782-F896 HydrophobicContact CB-CE1 3.89Å; V782-F896 HydrophobicContact CB-CZ 3.86Å; V782-F896 HydrophobicContact CG1-CD1 4.41Å; V782-F896 HydrophobicContact CG1-CD2 4.46Å; V782-F896 HydrophobicContact CG1-CE1 4.09Å; V782-F896 HydrophobicContact CG1-CE2 4.17Å; V782-F896 HydrophobicContact CG1-CZ 3.96Å; V782-F896 HydrophobicContact CG2-CD1 4.38Å; V782-F896 HydrophobicContact CG2-CE1 3.88Å; V782-F896 HydrophobicContact CG2-CZ 4.37Å; I783-F896 HydrophobicContact CD1-CZ 4.43Å; I783-F896 HydrophobicContact CG1-CE2 4.31Å; I783-F896 HydrophobicContact CG1-CZ 4.13Å; E892-F896 HydrophobicContact CG-CD2 3.6Å; E892-F896 HydrophobicContact CG-CE2 3.46Å; E892-F896 VanDerWaalsContact CG-CE2 3.46Å; E892-F896 WeakPolarHBondContact O-CB 3.35Å; E892-F896 WeakPolarHBondContact O-CD2 3.34Å; E892-F896 PolarHBondContact O-N 2.89Å; F896-K899 HydrophobicContact CD1-CD 4.32Å; F896-K899 PolarHBondContact O-N 3.35Å; F896-H900 PolarHBondContact O-N 3.38Å; F896-H900 PolarHBondContact O-ND1 2.89Å
897	C	94.4	Very high	92.7	Very high	84 Å²	84	67.9 Å²	67.9	57%	0.568	35%	0.346	S	S	*	.	H	α-helix	trans	-61.5	-46.7	172.5	-176.3	0	0	0	0	111.2	H893 L894 K899 H900 L901	H893-C897 WeakPolarHBondContact O-CB 3.33Å; H893-C897 PolarHBondContact O-N 3.06Å; L894-C897 PolarHBondContact O-N 2.88Å; C897-K899 VanDerWaalsContact C-N 3.35Å; C897-K899 PolarHBondContact O-N 2.71Å; C897-H900 PolarHBondContact O-N 3.03Å; C897-L901 WeakPolarHBondContact O-CB 3.39Å; C897-L901 PolarHBondContact O-N 3.11Å
898	I	92.1	Very high	92.4	Very high	51 Å²	51	69.8 Å²	69.8	26%	0.262	36%	0.358	S	S	.	.	H	α-helix	trans	-62	-41.5	175.7	-64.3	163.4	0	0	0	111	V436 L894 V895 H900 L901 I902	V436-I898 HydrophobicContact CG2-CG2 3.69Å; L894-I898 HydrophobicContact CD1-CD1 3.99Å; L894-I898 HydrophobicContact CD1-CG1 4.48Å; L894-I898 HydrophobicContact CG-CD1 4.02Å; L894-I898 VanDerWaalsContact O-CG1 3.3Å; L894-I898 WeakPolarHBondContact O-CG1 3.43Å; L894-I898 PolarHBondContact O-N 2.8Å; V895-I898 PolarHBondContact O-N 2.91Å; I898-H900 PolarHBondContact O-N 2.84Å; I898-L901 PolarHBondContact O-N 3.11Å; I898-I902 HydrophobicContact CG2-CD1 3.75Å; I898-I902 HydrophobicContact CG2-CG1 4.39Å; I898-I902 VanDerWaalsContact O-CG1 3.29Å; I898-I902 WeakPolarHBondContact O-CG1 3.44Å; I898-I902 PolarHBondContact O-N 3.44Å
899	K	89.7	Confident	91.9	Very high	24 Å²	24	72.1 Å²	72.1	10%	0.104	37%	0.37	C	S	.	.	H	α-helix	trans	-57.2	-49.4	175.3	175.6	167.8	-172.2	-179.6	0	112.1	T439 G778 V895 F896 C897 I902 S903	T439-K899 HydrophobicContact CG2-CB 4.41Å; T439-K899 HydrophobicContact CG2-CG 3.79Å; T439-K899 WeakPolarHBondContact OG1-CG 3.22Å; G778-K899 PolarHBondContact O-NZ 2.98Å; V895-K899 WeakPolarHBondContact O-CB 3.25Å; V895-K899 PolarHBondContact O-N 3.2Å; F896-K899 HydrophobicContact CD1-CD 4.32Å; F896-K899 PolarHBondContact O-N 3.35Å; C897-K899 VanDerWaalsContact C-N 3.35Å; C897-K899 PolarHBondContact O-N 2.71Å; K899-I902 PolarHBondContact O-N 3.27Å; K899-S903 PolarHBondContact O-N 2.87Å; K899-S903 VanDerWaalsContact O-N 3.08Å; K899-S903 PolarHBondContact O-OG 3.3Å
900	H	90.5	Very high	91.6	Very high	127 Å²	127	68.6 Å²	68.6	59%	0.588	35%	0.354	S	S	*	.	H	α-helix	trans	-67	-36	178.7	-74	81.6	0	0	0	112.6	F896 C897 I898 I902 S903 Y904	F896-H900 PolarHBondContact O-N 3.38Å; F896-H900 PolarHBondContact O-ND1 2.89Å; C897-H900 PolarHBondContact O-N 3.03Å; I898-H900 PolarHBondContact O-N 2.84Å; H900-I902 VanDerWaalsContact C-N 3.35Å; H900-S903 PolarHBondContact O-OG 3.05Å; H900-Y904 VanDerWaalsContact O-CB 3.31Å; H900-Y904 WeakPolarHBondContact O-CB 3.45Å; H900-Y904 PolarHBondContact O-N 3Å
901	L	93.6	Very high	91.1	Very high	98 Å²	98	71.5 Å²	71.5	51%	0.513	36%	0.359	S	S	.	.	H	α-helix	trans	-64.1	-40.5	174.3	-179.2	60.7	0	0	0	111.5	C897 I898 Y904 L905	C897-L901 WeakPolarHBondContact O-CB 3.39Å; C897-L901 PolarHBondContact O-N 3.11Å; I898-L901 PolarHBondContact O-N 3.11Å; L901-Y904 PolarHBondContact O-N 2.86Å; L901-L905 HydrophobicContact CD1-CD1 3.93Å; L901-L905 HydrophobicContact CD1-CG 4.21Å; L901-L905 HydrophobicContact CG-CD1 3.89Å; L901-L905 WeakPolarHBondContact O-CB 3.38Å; L901-L905 WeakPolarHBondContact O-CG 3.39Å; L901-L905 PolarHBondContact O-N 3.03Å
902	I	91.5	Very high	90.5	Very high	26 Å²	26	75.8 Å²	75.8	13%	0.133	38%	0.382	C	S	.	.	H	α-helix	trans	-67.3	-45.9	178.7	-71.2	169.5	0	0	0	111.5	V436 T439 V440 I898 K899 H900 Y904 L905 I906	V436-I902 HydrophobicContact CB-CD1 4.49Å; V436-I902 HydrophobicContact CG1-CD1 3.8Å; V436-I902 HydrophobicContact CG2-CD1 4.37Å; T439-I902 HydrophobicContact CG2-CB 4.17Å; T439-I902 HydrophobicContact CG2-CG2 3.85Å; V440-I902 HydrophobicContact CG2-CD1 4.28Å; V440-I902 HydrophobicContact CG2-CG2 3.96Å; I898-I902 HydrophobicContact CG2-CD1 3.75Å; I898-I902 HydrophobicContact CG2-CG1 4.39Å; I898-I902 VanDerWaalsContact O-CG1 3.29Å; I898-I902 WeakPolarHBondContact O-CG1 3.44Å; I898-I902 PolarHBondContact O-N 3.44Å; K899-I902 PolarHBondContact O-N 3.27Å; H900-I902 VanDerWaalsContact C-N 3.35Å; I902-Y904 VanDerWaalsContact C-N 3.32Å; I902-Y904 PolarHBondContact O-N 2.84Å; I902-L905 PolarHBondContact O-N 3.02Å; I902-I906 HydrophobicContact CG2-CD1 3.71Å; I902-I906 HydrophobicContact CG2-CG1 4.46Å; I902-I906 WeakPolarHBondContact O-CB 3.15Å; I902-I906 WeakPolarHBondContact O-CG1 3.34Å; I902-I906 PolarHBondContact O-N 2.85Å
903	S	88.1	Confident	89.9	Confident	44 Å²	44	73.4 Å²	73.4	31%	0.308	37%	0.371	S	S	.	.	H	α-helix	trans	-67.6	-31.4	177.4	59.3	0	0	0	0	112.7	K899 H900	K899-S903 PolarHBondContact O-N 2.87Å; K899-S903 VanDerWaalsContact O-N 3.08Å; K899-S903 PolarHBondContact O-OG 3.3Å; H900-S903 PolarHBondContact O-OG 3.05Å
904	Y	90.7	Very high	89.5	Confident	197 Å²	197	70.9 Å²	70.9	77%	0.773	36%	0.356	S	S	*	.	H	α-helix	trans	-67.2	-39.2	170.8	-178.4	-98.7	0	0	0	113.1	H900 L901 I902	H900-Y904 VanDerWaalsContact O-CB 3.31Å; H900-Y904 WeakPolarHBondContact O-CB 3.45Å; H900-Y904 PolarHBondContact O-N 3Å; L901-Y904 PolarHBondContact O-N 2.86Å; I902-Y904 VanDerWaalsContact C-N 3.32Å; I902-Y904 PolarHBondContact O-N 2.84Å
905	L	92.1	Very high	89	Confident	116 Å²	116	70.4 Å²	70.4	61%	0.607	36%	0.355	S	S	*	.	H	α-helix	trans	-77.6	-23.1	-179	-72.8	171	0	0	0	114	L901 I902 P907	L901-L905 HydrophobicContact CD1-CD1 3.93Å; L901-L905 HydrophobicContact CD1-CG 4.21Å; L901-L905 HydrophobicContact CG-CD1 3.89Å; L901-L905 WeakPolarHBondContact O-CB 3.38Å; L901-L905 WeakPolarHBondContact O-CG 3.39Å; L901-L905 PolarHBondContact O-N 3.03Å; I902-L905 PolarHBondContact O-N 3.02Å; L905-P907 WeakPolarHBondContact O-CD 3.47Å
906	I	90.2	Very high	88.4	Confident	23 Å²	23	74 Å²	74	12%	0.118	37%	0.367	C	S	.	.	S	Bend	trans	-104.4	101.6	-176.5	-63.7	179.4	0	0	0	110.3	E443 F444 R447 I902	E443-I906 HydrophobicContact CB-CB 4.23Å; E443-I906 HydrophobicContact CB-CD1 4.26Å; E443-I906 HydrophobicContact CB-CG2 3.85Å; F444-I906 HydrophobicContact CD2-CD1 4.39Å; F444-I906 HydrophobicContact CE2-CD1 3.96Å; R447-I906 VanDerWaalsContact CD-CG2 3.41Å; I902-I906 HydrophobicContact CG2-CD1 3.71Å; I902-I906 HydrophobicContact CG2-CG1 4.46Å; I902-I906 WeakPolarHBondContact O-CB 3.15Å; I902-I906 WeakPolarHBondContact O-CG1 3.34Å; I902-I906 PolarHBondContact O-N 2.85Å
907	P	89.8	Confident	87.9	Confident	62 Å²	62	74.9 Å²	74.9	40%	0.403	37%	0.373	S	S	.	.			trans	-74.7	131.4	179.9	29.1	-34.8	0	0	0	112	R447 L905 L909	R447-P907 WeakPolarHBondContact CD-O 2.93Å; R447-P907 VanDerWaalsContact CG-O 3.3Å; R447-P907 WeakPolarHBondContact CG-O 3.44Å; R447-P907 PolarHBondContact NE-O 3.48Å; L905-P907 WeakPolarHBondContact O-CD 3.47Å; P907-L909 PolarHBondContact O-N 3.31Å
908	D	88.2	Confident	87.4	Confident	78 Å²	78	78.6 Å²	78.6	42%	0.417	38%	0.375	S	S	.	.	S	Bend	trans	-52.3	-30.8	-177.9	-58.3	-84.8	0	0	0	114.2	K446 R447	K446-D908 WeakPolarHBondContact CD-OD1 3.45Å; K446-D908 WeakPolarHBondContact CE-OD1 3.32Å; K446-D908 IonicContact NZ-OD1 3.63Å; K446-D908 PolarHBondContact NZ-OD1 3.46Å; R447-D908 WeakPolarHBondContact CA-O 3.26Å; R447-D908 WeakPolarHBondContact CG-O 3.45Å
909	L	86	Confident	86.9	Confident	61 Å²	61	81.1 Å²	81.1	32%	0.319	38%	0.381	S	S	.	.	S	Bend	trans	-106.4	125.7	177.3	-74	166.4	0	0	0	111.2	A450 P907 L913 R914	A450-L909 HydrophobicContact CB-CD2 3.87Å; P907-L909 PolarHBondContact O-N 3.31Å; L909-L913 HydrophobicContact CD2-CD2 3.79Å; L909-L913 HydrophobicContact CD2-CG 4.49Å; L909-R914 HydrophobicContact CB-CG 3.83Å; L909-R914 HydrophobicContact CD1-CG 4.14Å; L909-R914 PolarHBondContact O-NH1 3.34Å
910	P	88.7	Confident	86.2	Confident	26 Å²	26	81 Å²	81	17%	0.169	38%	0.381	C	S	.	.			trans	-67	148.1	169.7	23.1	-26	0	0	0	111.7	V451 D912 L913 R914	V451-P910 HydrophobicContact CG2-CG 3.57Å; P910-D912 PolarHBondContact O-N 2.75Å; P910-L913 HydrophobicContact CG-CB 3.84Å; P910-L913 HydrophobicContact CG-CD2 4.34Å; P910-L913 PolarHBondContact O-N 3.18Å; P910-R914 PolarHBondContact O-N 2.83Å
911	K	84.7	Confident	85.7	Confident	158 Å²	158	81.8 Å²	81.8	69%	0.687	38%	0.383	S	S	*	.	H	α-helix	trans	-57.6	-48.8	-176.1	-69.6	-179.1	178	-179.2	0	112.4	L913 R914 D915	K911-L913 VanDerWaalsContact C-N 3.32Å; K911-L913 PolarHBondContact O-N 3.25Å; K911-R914 PolarHBondContact O-N 3.26Å; K911-D915 PolarHBondContact O-N 3.4Å; K911-D915 VanDerWaalsContact O-N 3.1Å
912	D	80.1	Confident	85.1	Confident	101 Å²	101	84 Å²	84	54%	0.54	39%	0.385	S	S	.	.	H	α-helix	trans	-52.7	-45.4	177.6	176.2	80.8	0	0	0	113	P910 D915 R916	P910-D912 PolarHBondContact O-N 2.75Å; D912-D915 PolarHBondContact O-N 3.15Å; D912-R916 PolarHBondContact O-N 3.03Å; D912-R916 IonicContact OD2-CZ 2.71Å; D912-R916 IonicContact OD2-NE 3.66Å; D912-R916 PolarHBondContact OD2-NE 3.14Å; D912-R916 IonicContact OD2-NH2 3.65Å; D912-R916 PolarHBondContact OD2-NH2 3.2Å
913	L	83.4	Confident	84.3	Confident	1 Å²	1	84.4 Å²	84.4	1%	0.005	39%	0.388	C	S	.	.	H	α-helix	trans	-64.1	-45.9	178.8	172.9	58.2	0	0	0	111.9	A450 V451 Y454 L909 P910 K911 D915 R916 M917	A450-L913 HydrophobicContact CB-CD2 4.15Å; A450-L913 WeakPolarHBondContact O-CD2 3.24Å; V451-L913 HydrophobicContact CG2-CD2 4.14Å; Y454-L913 HydrophobicContact CD1-CD1 3.67Å; Y454-L913 HydrophobicContact CD2-CD1 3.61Å; Y454-L913 HydrophobicContact CE1-CD1 4.4Å; Y454-L913 HydrophobicContact CE2-CD1 4.35Å; Y454-L913 HydrophobicContact CG-CD1 3.22Å; L909-L913 HydrophobicContact CD2-CD2 3.79Å; L909-L913 HydrophobicContact CD2-CG 4.49Å; P910-L913 HydrophobicContact CG-CB 3.84Å; P910-L913 HydrophobicContact CG-CD2 4.34Å; P910-L913 PolarHBondContact O-N 3.18Å; K911-L913 VanDerWaalsContact C-N 3.32Å; K911-L913 PolarHBondContact O-N 3.25Å; L913-D915 PolarHBondContact O-N 3.45Å; L913-R916 WeakPolarHBondContact O-CB 3.45Å; L913-R916 PolarHBondContact O-N 2.03Å; L913-M917 HydrophobicContact CD1-CG 3.91Å; L913-M917 HydrophobicContact CD1-SD 4Å; L913-M917 HydrophobicContact CG-CG 4.39Å; L913-M917 HydrophobicContact CG-SD 3.98Å; L913-M917 WeakPolarHBondContact O-CG 3.45Å; L913-M917 PolarHBondContact O-N 3.34Å
914	R	85.7	Confident	83.5	Confident	71 Å²	71	85.4 Å²	85.4	27%	0.268	39%	0.389	S	S	.	.	H	α-helix	trans	-59.5	-38.1	177.3	-69.8	-164.8	-66.6	-99.7	-5.7	111.8	L909 P910 K911 R918	L909-R914 HydrophobicContact CB-CG 3.83Å; L909-R914 HydrophobicContact CD1-CG 4.14Å; L909-R914 PolarHBondContact O-NH1 3.34Å; P910-R914 PolarHBondContact O-N 2.83Å; K911-R914 PolarHBondContact O-N 3.26Å; R914-R918 WeakPolarHBondContact O-CB 3.35Å; R914-R918 VanDerWaalsContact O-CD 3.3Å; R914-R918 WeakPolarHBondContact O-CD 3.09Å; R914-R918 WeakPolarHBondContact O-CG 3.32Å; R914-R918 PolarHBondContact O-N 2.95Å
915	D	83.4	Confident	82.7	Confident	88 Å²	88	81.7 Å²	81.7	47%	0.471	38%	0.379	S	S	.	.	H	α-helix	trans	-76.2	-29.9	179.9	-63.2	-26	0	0	0	112	K911 D912 L913 R918 R919	K911-D915 PolarHBondContact O-N 3.4Å; K911-D915 VanDerWaalsContact O-N 3.1Å; D912-D915 PolarHBondContact O-N 3.15Å; L913-D915 PolarHBondContact O-N 3.45Å; D915-R918 IonicContact OD1-CZ 2.84Å; D915-R918 IonicContact OD1-NH1 3.93Å; D915-R918 PolarHBondContact OD1-NH1 3.47Å; D915-R919 WeakPolarHBondContact O-CB 3.07Å; D915-R919 PolarHBondContact O-N 3Å; D915-R919 VanDerWaalsContact O-N 3.17Å
916	R	81.1	Confident	82.1	Confident	78 Å²	78	79.9 Å²	79.9	29%	0.294	37%	0.367	S	S	.	.	H	α-helix	trans	-61.8	-55.3	165.5	-79.4	-167.6	-91.8	152.9	-9.8	112	Y454 D455 D912 L913 R918 R919 E920	Y454-R916 VanDerWaalsContact CD1-NH1 3.33Å; Y454-R916 HydrophobicContact CE1-CB 4.25Å; D455-R916 IonicContact OD1-CZ 2.75Å; D455-R916 IonicContact OD1-NH1 2.93Å; D455-R916 PolarHBondContact OD1-NH1 2.95Å; D912-R916 PolarHBondContact O-N 3.03Å; D912-R916 IonicContact OD2-CZ 2.71Å; D912-R916 IonicContact OD2-NE 3.66Å; D912-R916 PolarHBondContact OD2-NE 3.14Å; D912-R916 IonicContact OD2-NH2 3.65Å; D912-R916 PolarHBondContact OD2-NH2 3.2Å; L913-R916 WeakPolarHBondContact O-CB 3.45Å; L913-R916 PolarHBondContact O-N 2.03Å; R916-R918 VanDerWaalsContact C-N 3.35Å; R916-R918 PolarHBondContact O-N 3.34Å; R916-R919 WeakPolarHBondContact O-CB 3.06Å; R916-R919 PolarHBondContact O-N 3.47Å; R916-R919 VanDerWaalsContact O-N 3.1Å; R916-E920 PolarHBondContact O-N 3.39Å
917	M	82.1	Confident	81.1	Confident	58 Å²	58	81.6 Å²	81.6	29%	0.286	38%	0.375	S	S	.	.	H	α-helix	trans	-58	-42.8	180	-68.3	173.4	66.7	0	0	112.8	Y454 I459 L913 E920 K921	Y454-M917 HydrophobicContact CD2-CG 3.6Å; Y454-M917 HydrophobicContact CD2-SD 4.48Å; Y454-M917 HydrophobicContact CE2-CG 3.64Å; I459-M917 HydrophobicContact CD1-CE 4.15Å; I459-M917 HydrophobicContact CD1-SD 4.01Å; I459-M917 HydrophobicContact CG2-CE 3.8Å; L913-M917 HydrophobicContact CD1-CG 3.91Å; L913-M917 HydrophobicContact CD1-SD 4Å; L913-M917 HydrophobicContact CG-CG 4.39Å; L913-M917 HydrophobicContact CG-SD 3.98Å; L913-M917 WeakPolarHBondContact O-CG 3.45Å; L913-M917 PolarHBondContact O-N 3.34Å; M917-E920 PolarHBondContact O-N 3.44Å; M917-K921 PolarHBondContact O-N 3.23Å
918	R	84	Confident	80.1	Confident	162 Å²	162	84.4 Å²	84.4	61%	0.611	38%	0.384	S	S	*	.	H	α-helix	trans	-60.5	-44.4	175	-76.6	163.5	172	173.1	-11.1	112.1	R914 D915 R916 Y922	R914-R918 WeakPolarHBondContact O-CB 3.35Å; R914-R918 VanDerWaalsContact O-CD 3.3Å; R914-R918 WeakPolarHBondContact O-CD 3.09Å; R914-R918 WeakPolarHBondContact O-CG 3.32Å; R914-R918 PolarHBondContact O-N 2.95Å; D915-R918 IonicContact OD1-CZ 2.84Å; D915-R918 IonicContact OD1-NH1 3.93Å; D915-R918 PolarHBondContact OD1-NH1 3.47Å; R916-R918 VanDerWaalsContact C-N 3.35Å; R916-R918 PolarHBondContact O-N 3.34Å; R918-Y922 WeakPolarHBondContact O-CB 3.25Å; R918-Y922 PolarHBondContact O-N 2.04Å
919	R	81.4	Confident	79.6	Confident	105 Å²	105	88.1 Å²	88.1	40%	0.396	39%	0.394	S	S	.	.	H	α-helix	trans	-65.4	-41.1	179.3	-177	-178.2	-177.2	-157.5	-1.7	111.5	D915 R916 Y922 L923	D915-R919 WeakPolarHBondContact O-CB 3.07Å; D915-R919 PolarHBondContact O-N 3Å; D915-R919 VanDerWaalsContact O-N 3.17Å; R916-R919 WeakPolarHBondContact O-CB 3.06Å; R916-R919 PolarHBondContact O-N 3.47Å; R916-R919 VanDerWaalsContact O-N 3.1Å; R919-Y922 PolarHBondContact O-N 2.87Å; R919-L923 HydrophobicContact CG-CD1 4.07Å; R919-L923 VanDerWaalsContact O-CG 3.27Å; R919-L923 WeakPolarHBondContact O-CG 3.04Å; R919-L923 PolarHBondContact O-N 3.39Å
920	E	75.4	Confident	79.2	Confident	22 Å²	22	88.7 Å²	88.7	10%	0.103	40%	0.395	C	S	.	.	H	α-helix	trans	-63.4	-48.9	175.8	179.5	165.5	-162	0	0	112	Y234 Y454 R916 M917 Y922 L923 I924	Y234-E920 HydrophobicContact CD1-CB 4.11Å; Y234-E920 HydrophobicContact CD1-CG 3.72Å; Y234-E920 HydrophobicContact CE1-CB 3.84Å; Y234-E920 HydrophobicContact CE1-CG 4Å; Y454-E920 WeakPolarHBondContact CE2-OE2 3.41Å; Y454-E920 PolarHBondContact OH-OE2 3.25Å; R916-E920 PolarHBondContact O-N 3.39Å; M917-E920 PolarHBondContact O-N 3.44Å; E920-Y922 VanDerWaalsContact C-N 3.27Å; E920-Y922 PolarHBondContact O-N 3.27Å; E920-L923 PolarHBondContact O-N 2.93Å; E920-L923 VanDerWaalsContact O-N 3.11Å; E920-I924 HydrophobicContact CG-CD1 3.85Å; E920-I924 HydrophobicContact CG-CG1 4.5Å; E920-I924 WeakPolarHBondContact O-CG1 3.28Å; E920-I924 PolarHBondContact O-N 3.05Å
921	K	79	Confident	78.5	Confident	143 Å²	143	89.6 Å²	89.6	62%	0.622	41%	0.405	S	S	*	.	H	α-helix	trans	-57.3	-40.5	175.6	-173.6	164.5	-174.6	162.4	0	112.4	M917 Q925	M917-K921 PolarHBondContact O-N 3.23Å; K921-Q925 WeakPolarHBondContact O-CG 3.29Å; K921-Q925 PolarHBondContact O-N 2.7Å; K921-Q925 VanDerWaalsContact O-N 3.11Å
922	Y	81.5	Confident	78.1	Confident	144 Å²	144	87.8 Å²	87.8	57%	0.565	40%	0.399	S	S	*	.	H	α-helix	trans	-62.7	-48.1	173.8	176.7	-93.6	0	0	0	112.4	R918 R919 E920 I924 Q925 E926	R918-Y922 WeakPolarHBondContact O-CB 3.25Å; R918-Y922 PolarHBondContact O-N 2.04Å; R919-Y922 PolarHBondContact O-N 2.87Å; E920-Y922 VanDerWaalsContact C-N 3.27Å; E920-Y922 PolarHBondContact O-N 3.27Å; Y922-I924 VanDerWaalsContact C-N 3.34Å; Y922-I924 PolarHBondContact O-N 3.4Å; Y922-Q925 PolarHBondContact O-N 3.21Å; Y922-E926 PolarHBondContact O-N 2.83Å
923	L	74.2	Confident	78.3	Confident	34 Å²	34	86.8 Å²	86.8	18%	0.178	39%	0.393	C	S	.	.	H	α-helix	trans	-64	-36.6	178.4	-71.4	168.4	0	0	0	112.3	Y234 R919 E920 E926 M927	Y234-L923 HydrophobicContact CD2-CD1 4.34Å; Y234-L923 HydrophobicContact CE2-CD1 3.5Å; Y234-L923 VanDerWaalsContact CE2-CD1 3.5Å; R919-L923 HydrophobicContact CG-CD1 4.07Å; R919-L923 VanDerWaalsContact O-CG 3.27Å; R919-L923 WeakPolarHBondContact O-CG 3.04Å; R919-L923 PolarHBondContact O-N 3.39Å; E920-L923 PolarHBondContact O-N 2.93Å; E920-L923 VanDerWaalsContact O-N 3.11Å; L923-E926 PolarHBondContact O-N 3.31Å; L923-M927 WeakPolarHBondContact O-CB 3.2Å; L923-M927 VanDerWaalsContact O-CG 3.27Å; L923-M927 WeakPolarHBondContact O-CG 3.09Å; L923-M927 PolarHBondContact O-N 3.47Å
924	I	71.3	Confident	78.2	Confident	66 Å²	66	91.2 Å²	91.2	34%	0.338	41%	0.413	S	S	.	.	H	α-helix	trans	-64.2	-42.9	174.8	-69.2	167.8	0	0	0	110.5	E920 Y922 M927 M928	E920-I924 HydrophobicContact CG-CD1 3.85Å; E920-I924 HydrophobicContact CG-CG1 4.5Å; E920-I924 WeakPolarHBondContact O-CG1 3.28Å; E920-I924 PolarHBondContact O-N 3.05Å; Y922-I924 VanDerWaalsContact C-N 3.34Å; Y922-I924 PolarHBondContact O-N 3.4Å; I924-M927 HydrophobicContact CG1-CE 4.23Å; I924-M927 PolarHBondContact O-N 2.61Å; I924-M928 HydrophobicContact CG2-SD 4.16Å; I924-M928 WeakPolarHBondContact O-CB 3.46Å; I924-M928 VanDerWaalsContact O-CG 3.3Å; I924-M928 WeakPolarHBondContact O-CG 3.39Å; I924-M928 PolarHBondContact O-N 3.23Å
925	Q	74	Confident	77.9	Confident	118 Å²	118	95.4 Å²	95.4	55%	0.551	43%	0.429	S	S	*	.	H	α-helix	trans	-63.5	-42.6	175.2	-72.1	175.6	-40.9	0	0	112.1	K921 Y922 M928 Y929	K921-Q925 WeakPolarHBondContact O-CG 3.29Å; K921-Q925 PolarHBondContact O-N 2.7Å; K921-Q925 VanDerWaalsContact O-N 3.11Å; Y922-Q925 PolarHBondContact O-N 3.21Å; Q925-M928 PolarHBondContact O-N 3.12Å; Q925-Y929 PolarHBondContact O-N 3.32Å
926	E	79.5	Confident	77.8	Confident	78 Å²	78	95.3 Å²	95.3	36%	0.364	43%	0.428	S	S	.	.	H	α-helix	trans	-61.1	-46.9	175.1	-173.8	174.3	-150.1	0	0	111.8	Y922 L923 Y929 E930	Y922-E926 PolarHBondContact O-N 2.83Å; L923-E926 PolarHBondContact O-N 3.31Å; E926-Y929 PolarHBondContact O-N 2.6Å; E926-E930 PolarHBondContact O-N 2.92Å
927	M	70.1	Confident	78.1	Confident	59 Å²	59	95.9 Å²	95.9	29%	0.291	43%	0.434	S	S	.	.	H	α-helix	trans	-67.2	-34.9	177.6	-70.6	-175.5	-59.6	0	0	113.2	F185 L923 I924 A931	F185-M927 HydrophobicContact CD1-CE 4.44Å; F185-M927 HydrophobicContact CD1-SD 4.03Å; F185-M927 HydrophobicContact CE1-CE 4.29Å; F185-M927 HydrophobicContact CE1-SD 3.6Å; L923-M927 WeakPolarHBondContact O-CB 3.2Å; L923-M927 VanDerWaalsContact O-CG 3.27Å; L923-M927 WeakPolarHBondContact O-CG 3.09Å; L923-M927 PolarHBondContact O-N 3.47Å; I924-M927 HydrophobicContact CG1-CE 4.23Å; I924-M927 PolarHBondContact O-N 2.61Å; M927-A931 WeakPolarHBondContact O-CB 3.48Å; M927-A931 PolarHBondContact O-N 3.03Å
928	M	67.2	Low	78.1	Confident	121 Å²	121	98.2 Å²	98.2	60%	0.596	44%	0.443	S	S	*	.	H	α-helix	trans	-64.4	-42.1	173	-76.4	179.7	66.4	0	0	111.3	I924 Q925 A931 E932	I924-M928 HydrophobicContact CG2-SD 4.16Å; I924-M928 WeakPolarHBondContact O-CB 3.46Å; I924-M928 VanDerWaalsContact O-CG 3.3Å; I924-M928 WeakPolarHBondContact O-CG 3.39Å; I924-M928 PolarHBondContact O-N 3.23Å; Q925-M928 PolarHBondContact O-N 3.12Å; M928-A931 PolarHBondContact O-N 2.77Å; M928-E932 PolarHBondContact O-N 3.37Å
929	Y	77.7	Confident	78	Confident	157 Å²	157	93 Å²	93	62%	0.616	43%	0.425	S	S	*	.	H	α-helix	trans	-66.2	-43.3	176.5	-175.3	-101.5	0	0	0	112.5	Q925 E926 A931 E932 L933	Q925-Y929 PolarHBondContact O-N 3.32Å; E926-Y929 PolarHBondContact O-N 2.6Å; Y929-A931 VanDerWaalsContact C-N 3.35Å; Y929-A931 PolarHBondContact O-N 2.88Å; Y929-E932 PolarHBondContact O-N 2.69Å; Y929-L933 VanDerWaalsContact O-CB 3.31Å; Y929-L933 WeakPolarHBondContact O-CB 3.42Å; Y929-L933 PolarHBondContact O-N 3.13Å
930	E	78.9	Confident	78	Confident	72 Å²	72	97 Å²	97	34%	0.336	44%	0.441	S	S	.	.	H	α-helix	trans	-58.3	-44.8	172.2	-77.4	-161.2	137.3	0	0	111.9	K188 E926 L933 E934	K188-E930 IonicContact NZ-OE1 3.3Å; K188-E930 PolarHBondContact NZ-OE1 3.12Å; K188-E930 IonicContact NZ-OE2 2.74Å; K188-E930 PolarHBondContact NZ-OE2 3.26Å; E926-E930 PolarHBondContact O-N 2.92Å; E930-L933 PolarHBondContact O-N 2.79Å; E930-E934 PolarHBondContact O-N 3.46Å
931	A	73.1	Confident	78.4	Confident	46 Å²	46	102.5 Å²	102.5	38%	0.38	46%	0.464	S	S	.	.	H	α-helix	trans	-67.6	-37.9	-178.2	0	0	0	0	0	112.9	M927 M928 Y929 R935	M927-A931 WeakPolarHBondContact O-CB 3.48Å; M927-A931 PolarHBondContact O-N 3.03Å; M928-A931 PolarHBondContact O-N 2.77Å; Y929-A931 VanDerWaalsContact C-N 3.35Å; Y929-A931 PolarHBondContact O-N 2.88Å; A931-R935 WeakPolarHBondContact O-CB 3.25Å; A931-R935 PolarHBondContact O-N 3.06Å
932	E	77.4	Confident	78.4	Confident	120 Å²	120	101.2 Å²	101.2	56%	0.561	46%	0.46	S	S	*	.	H	α-helix	trans	-67.4	-42.1	172.9	-176.3	166.8	-151.6	0	0	111.4	M928 Y929 E934 R935 L936	M928-E932 PolarHBondContact O-N 3.37Å; Y929-E932 PolarHBondContact O-N 2.69Å; E932-E934 PolarHBondContact O-N 3.13Å; E932-R935 WeakPolarHBondContact O-CB 3.47Å; E932-R935 PolarHBondContact O-N 3.11Å; E932-L936 HydrophobicContact CG-CD1 4.15Å; E932-L936 WeakPolarHBondContact O-CG 3.32Å; E932-L936 PolarHBondContact O-N 2.98Å
933	L	83.8	Confident	78	Confident	80 Å²	80	103.4 Å²	103.4	42%	0.419	47%	0.468	S	S	.	.	H	α-helix	trans	-61.5	-43	174.9	-169.9	72.8	0	0	0	111.7	Y929 E930 L936 Q937	Y929-L933 VanDerWaalsContact O-CB 3.31Å; Y929-L933 WeakPolarHBondContact O-CB 3.42Å; Y929-L933 PolarHBondContact O-N 3.13Å; E930-L933 PolarHBondContact O-N 2.79Å; L933-L936 PolarHBondContact O-N 2.93Å; L933-Q937 WeakPolarHBondContact O-CB 3.4Å; L933-Q937 VanDerWaalsContact O-CG 3.29Å; L933-Q937 WeakPolarHBondContact O-CG 3.3Å; L933-Q937 PolarHBondContact O-N 3.2Å
934	E	80.6	Confident	78	Confident	93 Å²	93	110.6 Å²	110.6	44%	0.435	50%	0.497	S	S	.	.	H	α-helix	trans	-61.3	-41.7	173.2	-91.2	-155.6	-154.8	0	0	112.6	E930 E932 Q937 K938	E930-E934 PolarHBondContact O-N 3.46Å; E932-E934 PolarHBondContact O-N 3.13Å; E934-Q937 PolarHBondContact O-N 3.35Å; E934-K938 WeakPolarHBondContact O-CG 3.22Å; E934-K938 PolarHBondContact O-N 3.12Å; E934-K938 IonicContact OE2-NZ 2.68Å; E934-K938 PolarHBondContact OE2-NZ 3.07Å
935	R	79.2	Confident	77.9	Confident	160 Å²	160	116.2 Å²	116.2	60%	0.604	52%	0.519	S	S	*	.	H	α-helix	trans	-62	-50.1	176.2	179.4	-176.8	166.5	175.1	-3	110.8	A931 E932 Q937 K938 E939	A931-R935 WeakPolarHBondContact O-CB 3.25Å; A931-R935 PolarHBondContact O-N 3.06Å; E932-R935 WeakPolarHBondContact O-CB 3.47Å; E932-R935 PolarHBondContact O-N 3.11Å; R935-Q937 PolarHBondContact O-N 3.15Å; R935-K938 PolarHBondContact O-N 2.77Å; R935-E939 IonicContact CZ-OE1 3.46Å; R935-E939 VanDerWaalsContact CZ-OE1 3.3Å; R935-E939 IonicContact NE-OE1 3.35Å; R935-E939 PolarHBondContact NE-OE1 3.29Å; R935-E939 IonicContact NH2-OE1 2.73Å; R935-E939 PolarHBondContact NH2-OE1 2.83Å; R935-E939 PolarHBondContact O-N 3.14Å
936	L	82.4	Confident	77.5	Confident	86 Å²	86	116.9 Å²	116.9	45%	0.45	53%	0.527	S	S	.	.	H	α-helix	trans	-61	-32.9	176.8	-69.1	170	0	0	0	112.1	E932 L933 R940	E932-L936 HydrophobicContact CG-CD1 4.15Å; E932-L936 WeakPolarHBondContact O-CG 3.32Å; E932-L936 PolarHBondContact O-N 2.98Å; L933-L936 PolarHBondContact O-N 2.93Å; L936-R940 VanDerWaalsContact O-CB 3.28Å; L936-R940 WeakPolarHBondContact O-CB 3.43Å; L936-R940 VanDerWaalsContact O-CG 3.27Å; L936-R940 WeakPolarHBondContact O-CG 3.37Å; L936-R940 PolarHBondContact O-N 2.73Å
937	Q	86.6	Confident	76.2	Confident	89 Å²	89	115.9 Å²	115.9	42%	0.416	54%	0.537	S	S	.	.	H	α-helix	trans	-70	-38.5	171.6	-75.4	-177	39.9	0	0	113.2	L933 E934 R935 K941	L933-Q937 WeakPolarHBondContact O-CB 3.4Å; L933-Q937 VanDerWaalsContact O-CG 3.29Å; L933-Q937 WeakPolarHBondContact O-CG 3.3Å; L933-Q937 PolarHBondContact O-N 3.2Å; E934-Q937 PolarHBondContact O-N 3.35Å; R935-Q937 PolarHBondContact O-N 3.15Å; Q937-K941 WeakPolarHBondContact O-CB 3.38Å; Q937-K941 VanDerWaalsContact O-CG 3.25Å; Q937-K941 WeakPolarHBondContact O-CG 3.01Å; Q937-K941 PolarHBondContact O-N 3.24Å
938	K	83.1	Confident	75.2	Confident	108 Å²	108	122.5 Å²	122.5	47%	0.47	56%	0.564	S	S	.	*	H	α-helix	trans	-65	-50.2	174.4	-73.8	162.9	-171.7	155.6	0	110.3	E934 R935 R940 K941 E942	E934-K938 WeakPolarHBondContact O-CG 3.22Å; E934-K938 PolarHBondContact O-N 3.12Å; E934-K938 IonicContact OE2-NZ 2.68Å; E934-K938 PolarHBondContact OE2-NZ 3.07Å; R935-K938 PolarHBondContact O-N 2.77Å; K938-R940 VanDerWaalsContact C-N 3.32Å; K938-R940 PolarHBondContact O-N 3Å; K938-K941 CarbonylContact O-C 3.59Å; K938-K941 WeakPolarHBondContact O-CA 3.25Å; K938-K941 WeakPolarHBondContact O-CB 3.44Å; K938-K941 PolarHBondContact O-N 3.49Å; K938-E942 WeakPolarHBondContact O-CG 3.32Å; K938-E942 PolarHBondContact O-N 3.31Å
939	E	82.3	Confident	74.5	Confident	52 Å²	52	120.9 Å²	120.9	24%	0.243	57%	0.57	C	S	.	*	H	α-helix	trans	-59	-39.6	175.2	-68.4	-177.3	-164.2	0	0	112.2	R935 E942 R943	R935-E939 IonicContact CZ-OE1 3.46Å; R935-E939 VanDerWaalsContact CZ-OE1 3.3Å; R935-E939 IonicContact NE-OE1 3.35Å; R935-E939 PolarHBondContact NE-OE1 3.29Å; R935-E939 IonicContact NH2-OE1 2.73Å; R935-E939 PolarHBondContact NH2-OE1 2.83Å; R935-E939 PolarHBondContact O-N 3.14Å; E939-E942 PolarHBondContact O-N 3.17Å; E939-R943 WeakPolarHBondContact O-CB 3.23Å; E939-R943 VanDerWaalsContact O-CG 3.27Å; E939-R943 WeakPolarHBondContact O-CG 3.49Å; E939-R943 PolarHBondContact O-N 3Å
940	R	81.4	Confident	72.8	Confident	190 Å²	190	122.1 Å²	122.1	72%	0.717	58%	0.581	S	S	*	*	H	α-helix	trans	-65.3	-38.1	172.3	-81.4	178	171.4	-170.4	-1.5	113.1	L936 K938 K944	L936-R940 VanDerWaalsContact O-CB 3.28Å; L936-R940 WeakPolarHBondContact O-CB 3.43Å; L936-R940 VanDerWaalsContact O-CG 3.27Å; L936-R940 WeakPolarHBondContact O-CG 3.37Å; L936-R940 PolarHBondContact O-N 2.73Å; K938-R940 VanDerWaalsContact C-N 3.32Å; K938-R940 PolarHBondContact O-N 3Å; R940-K944 WeakPolarHBondContact O-CB 3.34Å; R940-K944 WeakPolarHBondContact O-CG 3.28Å; R940-K944 PolarHBondContact O-N 3.27Å
941	K	82.4	Confident	71.1	Confident	136 Å²	136	127.3 Å²	127.3	59%	0.591	61%	0.605	S	S	*	*	H	α-helix	trans	-68.9	-39.8	176.3	-76.6	167.5	-178.7	171.6	0	111.2	Q937 K938 K944 K945	Q937-K941 WeakPolarHBondContact O-CB 3.38Å; Q937-K941 VanDerWaalsContact O-CG 3.25Å; Q937-K941 WeakPolarHBondContact O-CG 3.01Å; Q937-K941 PolarHBondContact O-N 3.24Å; K938-K941 CarbonylContact O-C 3.59Å; K938-K941 WeakPolarHBondContact O-CA 3.25Å; K938-K941 WeakPolarHBondContact O-CB 3.44Å; K938-K941 PolarHBondContact O-N 3.49Å; K941-K944 PolarHBondContact O-N 3Å; K941-K945 WeakPolarHBondContact O-CB 3.44Å; K941-K945 PolarHBondContact O-N 2.8Å
942	E	79.1	Confident	69.8	Low	117 Å²	117	131.6 Å²	131.6	55%	0.547	62%	0.621	S	S	.	*	H	α-helix	trans	-68.4	-44	175.8	-72.6	171.8	178.4	0	0	111.9	K938 E939 K944 K945 N946	K938-E942 WeakPolarHBondContact O-CG 3.32Å; K938-E942 PolarHBondContact O-N 3.31Å; E939-E942 PolarHBondContact O-N 3.17Å; E942-K944 VanDerWaalsContact C-N 3.28Å; E942-K944 PolarHBondContact O-N 3.27Å; E942-K945 PolarHBondContact O-N 2.99Å; E942-N946 WeakPolarHBondContact O-CB 3.29Å; E942-N946 PolarHBondContact O-N 3.07Å
943	R	74.6	Confident	68.1	Low	190 Å²	190	135.1 Å²	135.1	72%	0.717	64%	0.638	S	S	*	*	H	α-helix	trans	-58.2	-38.7	171	-72	178.6	-165.8	-152.7	7.1	112.2	E939 G947	E939-R943 WeakPolarHBondContact O-CB 3.23Å; E939-R943 VanDerWaalsContact O-CG 3.27Å; E939-R943 WeakPolarHBondContact O-CG 3.49Å; E939-R943 PolarHBondContact O-N 3Å; R943-G947 PolarHBondContact O-N 3.14Å
944	K	73.8	Confident	65.7	Low	184 Å²	184	141.6 Å²	141.6	80%	0.8	66%	0.657	S	S	*	*	H	α-helix	trans	-68.9	-30.7	172.5	-78.8	-171.4	173	-166.3	0	113.6	R940 K941 E942	R940-K944 WeakPolarHBondContact O-CB 3.34Å; R940-K944 WeakPolarHBondContact O-CG 3.28Å; R940-K944 PolarHBondContact O-N 3.27Å; K941-K944 PolarHBondContact O-N 3Å; E942-K944 VanDerWaalsContact C-N 3.28Å; E942-K944 PolarHBondContact O-N 3.27Å
945	K	68.8	Low	64.1	Low	184 Å²	184	145.9 Å²	145.9	80%	0.8	69%	0.693	S	S	*	*	H	α-helix	trans	-82.7	-30.8	-179.2	-162.8	178.2	-177.2	-173.2	0	112.9	K941 E942 G947	K941-K945 WeakPolarHBondContact O-CB 3.44Å; K941-K945 PolarHBondContact O-N 2.8Å; E942-K945 PolarHBondContact O-N 2.99Å; K945-G947 VanDerWaalsContact C-N 3.31Å
946	N	64.7	Low	63.4	Low	133 Å²	133	145.2 Å²	145.2	71%	0.711	70%	0.697	S	S	*	*	S	Bend	trans	-87.3	-3	175.8	-63.7	-2.7	0	0	0	112.4	E942 K948	E942-N946 WeakPolarHBondContact O-CB 3.29Å; E942-N946 PolarHBondContact O-N 3.07Å; N946-K948 VanDerWaalsContact C-N 3.32Å; N946-K948 PolarHBondContact O-N 3.28Å
947	G	53.3	Low	62.4	Low	56 Å²	56	148.3 Å²	148.3	58%	0.577	71%	0.71	S	S	*	*			trans	-73.1	73.1	-178.5	0	0	0	0	0	114.2	R943 K945	R943-G947 PolarHBondContact O-N 3.14Å; K945-G947 VanDerWaalsContact C-N 3.31Å
948	K	49.8	Very low	61	Low	199 Å²	199	151.6 Å²	151.6	87%	0.865	73%	0.727	S	S	*	*			trans	-66	136.5	140.6	-93.5	-171.7	173.4	-175.8	0	107.4	N946 H950	N946-K948 VanDerWaalsContact C-N 3.32Å; N946-K948 PolarHBondContact O-N 3.28Å; K948-H950 PolarHBondContact O-N 3.18Å
949	A	50.5	Low	59.7	Low	86 Å²	86	154.2 Å²	154.2	71%	0.711	74%	0.742	S	S	*	*			trans	-68.6	127.9	-176.1	0	0	0	0	0	111.4
950	H	42.9	Very low	58.3	Low	184 Å²	184	160.6 Å²	160.6	85%	0.852	77%	0.773	S	S	*	*			trans	-113.7	128.6	144.3	-92.6	-82.2	0	0	0	107.2	K948	K948-H950 PolarHBondContact O-N 3.18Å
951	H	43.6	Very low	56.8	Low	180 Å²	180	158.6 Å²	158.6	83%	0.833	78%	0.777	S	S	*	*			trans	-71.6	152.6	171	-88.4	-107.5	0	0	0	110.1
952	N	45.3	Very low	54.9	Low	136 Å²	136	160.2 Å²	160.2	73%	0.727	79%	0.79	S	S	*	*			trans	-70.1	135.8	173.3	-52.1	-32.9	0	0	0	109.9
953	E	41	Very low	53.1	Low	195 Å²	195	163.5 Å²	163.5	91%	0.911	81%	0.809	S	S	*	*			trans	-123.9	137	139.1	-69.5	-167.2	138.4	0	0	107.8
954	W	34.8	Very low	51.3	Low	216 Å²	216	161.3 Å²	161.3	82%	0.818	82%	0.816	S	S	*	*			trans	-90.7	154.2	175.5	-82.6	61.6	0	0	0	108.1
955	P	46.9	Very low	49.2	Very low	183 Å²	183	159.3 Å²	159.3	100%	1.188	82%	0.818	S	S	*	*				-107.8	0	60.3	-7.9	29.2	0	0	0	116

Retrieved 955 of 955 residues in 787.7 ms (Link to these results)

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