A0A087XWG2_POEFO Loading...

NOP14 nucleolar protein homolog (yeast)

Involved in nucleolar processing of pre-18S ribosomal RNA. Has a role in the nuclear export of 40S pre-ribosomal subunit to the cytoplasm.

AlphaFold DB , UniProt , Accession A0A087XWG2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 876 aa.

						>A0A087XWG2_POEFO|A0A087XWG2
MGKAPKKKNLADKVRKAKAATEIKNNPFEVKINRKKFDVLGRKSKHDVGLPGVSRSKAIIKRKETLLKEYKQKNKSNKFIDRRLGEYDAKMAPEDKILQRFAIERQRAHGKRDVYNLNEEEELTHYGQSLAEIEKFNDTVGSDDESEEKGLLSAELTASHFGGGGGLLRKKTSGGYQEDEQGGQKIKSRQELIEELIQKSKQEKRERQVQKEEAQELTEKLDQDWKSIQALMVKKTPKAENVDKPEEKAKPEEYDMMVRELGFEMKAQPSEKMKSPEELAKEEKEKLQKLEADRLRRMMGDEGGDGVQSQVHMSADDLNDGFVLDKHDKKTLAYQDGKWNIEEETEDDKEEEGESEKEEGSEAEGENEEDDDDDDEDDVEEEGEEGSGEDEDGHSDLESEQESENEENDEEEEASSSRQQQQQQTLNREELKARQEAAKAELPYTFAAPESYEDLKDLLHGHTPDNQRLIVARTQKCNHPSLAAGNKLKLQKLVGFLMEYMGELATRSPPELGTIDKLIPELYALCQMFPEAAGKSMQSILGDAAHSMEEAVEVKGHAAFPTLDMLVYLKVTALLFPTSDFRHPVTTPALLFISLTLTKCLVRSLQDLTSGLVLCCLAVEYVSLSKRFLPELINFLSGTLHLAVQDKASAGCMVVPPFRLSGKYSDLLVLSNSESCSSWRKENLPLSATQQLELKSDLNKDHYRLNCLSTCLDLVKRCCLLYKDLTSFTHIFQPIRTLLSKHLSSHMLPSPLQELHSEILEAISSASVTHTRLVFEKKKPIPLKLFTPKIVEVLDYGKKRGSTREEREKERLKHKYKKEFKGALREIRKDSRFLAREKLSEVMNRDAERKRKVKELLGSLATQEGEWKALKRKKRK
					

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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	38.7	Very low	43.9	Very low	244 Å²	244	151.9 Å²	151.9	100%	1.202	82%	0.817	S	S	*	*				0	112.6	0	-84.6	-67.2	-146.6	0	0	110
2	G	41.1	Very low	44.4	Very low	79 Å²	79	146.8 Å²	146.8	81%	0.814	79%	0.79	S	S	*	*			trans	58.6	146.1	156.4	0	0	0	0	0	120.5
3	K	36.3	Very low	45	Very low	205 Å²	205	148.9 Å²	148.9	89%	0.891	79%	0.787	S	S	*	*			cis	-144.8	146.6	-6.5	-70.4	176.5	178.8	170	0	108.1
4	A	38	Very low	45.5	Very low	93 Å²	93	145.7 Å²	145.7	77%	0.769	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-75.2	141.8	178.5	0	0	0	0	0	112.7	K6	A4-K6 PolarHBondContact O-N 3.42Å
5	P	45.7	Very low	45.7	Very low	124 Å²	124	149.3 Å²	149.3	81%	0.805	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-71.9	126	171.3	29.3	-33	0	0	0	110.6	K7	P5-K7 PolarHBondContact O-N 2.89Å
6	K	43.4	Very low	45.8	Very low	200 Å²	200	151.3 Å²	151.3	87%	0.87	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-65	120.1	179.5	-69.9	-175.9	176.3	-176.4	0	110.9	A4 K8	A4-K6 PolarHBondContact O-N 3.42Å; K6-K8 PolarHBondContact O-N 2.87Å
7	K	48.1	Very low	45.7	Very low	201 Å²	201	147.5 Å²	147.5	87%	0.874	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-57.6	116.7	165.6	-68.1	-179.1	179.2	177.8	0	108.8	P5	P5-K7 PolarHBondContact O-N 2.89Å
8	K	46.9	Very low	45.9	Very low	202 Å²	202	149.9 Å²	149.9	88%	0.878	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-83.5	142.7	166	-77	-173.7	174.8	-179.2	0	109.3	K6 L10	K6-K8 PolarHBondContact O-N 2.87Å; K8-L10 PolarHBondContact O-N 3.15Å
9	N	45.3	Very low	45.7	Very low	122 Å²	122	146.6 Å²	146.6	65%	0.652	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-63.6	127.6	-164.5	-63.8	-23.8	0	0	0	113.3	A11	N9-A11 PolarHBondContact O-N 3.1Å
10	L	49.8	Very low	45.7	Very low	141 Å²	141	143.8 Å²	143.8	74%	0.738	77%	0.77	S	S	*	*	S	Bend	trans	-67.6	-26.4	174.3	-163.6	67.9	0	0	0	112	K8 D12 K13	K8-L10 PolarHBondContact O-N 3.15Å; L10-D12 PolarHBondContact O-N 2.97Å; L10-K13 PolarHBondContact O-N 3.33Å
11	A	49.8	Very low	46.1	Very low	60 Å²	60	142.8 Å²	142.8	50%	0.496	77%	0.77	S	S	.	*	H	α-helix	trans	-59.8	-39	-175	0	0	0	0	0	114.1	N9 K13 V14 R15	N9-A11 PolarHBondContact O-N 3.1Å; A11-K13 VanDerWaalsContact C-N 3.29Å; A11-K13 PolarHBondContact O-N 3.26Å; A11-V14 PolarHBondContact O-N 3.27Å; A11-R15 PolarHBondContact O-N 3.43Å
12	D	50.3	Low	46.7	Very low	91 Å²	91	140 Å²	140	49%	0.487	75%	0.754	S	S	.	*	H	α-helix	trans	-69.7	-28.6	-178	-66.7	-50.3	0	0	0	112.6	L10 V14 R15 K16	L10-D12 PolarHBondContact O-N 2.97Å; D12-V14 VanDerWaalsContact C-N 3.34Å; D12-R15 PolarHBondContact O-N 3.47Å; D12-K16 PolarHBondContact O-N 2.87Å; D12-K16 VanDerWaalsContact O-N 3.17Å
13	K	51.7	Low	47.6	Very low	174 Å²	174	142.4 Å²	142.4	76%	0.757	75%	0.746	S	S	*	*	H	α-helix	trans	-70.2	-32.9	177.2	-144.6	175.6	-173.6	-177.4	0	111.6	L10 A11	L10-K13 PolarHBondContact O-N 3.33Å; A11-K13 VanDerWaalsContact C-N 3.29Å; A11-K13 PolarHBondContact O-N 3.26Å
14	V	51.9	Low	48.5	Very low	104 Å²	104	141.5 Å²	141.5	63%	0.63	74%	0.743	S	S	*	*	H	α-helix	trans	-70.8	-38.5	173	-177.6	0	0	0	0	111.2	A11 D12 A17	A11-V14 PolarHBondContact O-N 3.27Å; D12-V14 VanDerWaalsContact C-N 3.34Å; V14-A17 PolarHBondContact O-N 3.15Å
15	R	48.7	Very low	49.5	Very low	199 Å²	199	144.9 Å²	144.9	75%	0.751	75%	0.748	S	S	*	*	H	α-helix	trans	-66.6	-39.1	179.7	-73	-179.9	171.8	-175.8	-3.7	113.1	A11 D12 A17 K18	A11-R15 PolarHBondContact O-N 3.43Å; D12-R15 PolarHBondContact O-N 3.47Å; R15-A17 VanDerWaalsContact C-N 3.32Å; R15-A17 PolarHBondContact O-N 2.88Å; R15-K18 PolarHBondContact O-N 2.65Å
16	K	46.8	Very low	51.1	Low	182 Å²	182	141.8 Å²	141.8	79%	0.791	73%	0.725	S	S	*	*	H	α-helix	trans	-72.9	-16.3	178.5	-75.3	-166.6	173.1	-173.3	0	115.1	D12 K18 A19	D12-K16 PolarHBondContact O-N 2.87Å; D12-K16 VanDerWaalsContact O-N 3.17Å; K16-K18 PolarHBondContact O-N 2.7Å; K16-A19 PolarHBondContact O-N 3.45Å
17	A	44.6	Very low	52.9	Low	86 Å²	86	136.7 Å²	136.7	71%	0.711	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	-6.2	176.3	0	0	0	0	0	114.3	V14 R15	V14-A17 PolarHBondContact O-N 3.15Å; R15-A17 VanDerWaalsContact C-N 3.32Å; R15-A17 PolarHBondContact O-N 2.88Å
18	K	48.8	Very low	54.5	Low	192 Å²	192	136.2 Å²	136.2	84%	0.835	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.9	28.9	173.4	-73.5	-173.7	176.1	177.9	0	113.5	R15 K16 A20	R15-K18 PolarHBondContact O-N 2.65Å; K16-K18 PolarHBondContact O-N 2.7Å; K18-A20 VanDerWaalsContact C-N 3.26Å; K18-A20 PolarHBondContact O-N 2.83Å
19	A	42.8	Very low	56.3	Low	87 Å²	87	131.1 Å²	131.1	72%	0.719	69%	0.689	S	S	*	*			trans	-64.2	91.8	158	0	0	0	0	0	108.6	K16 T21	K16-A19 PolarHBondContact O-N 3.45Å; A19-T21 PolarHBondContact O-N 3.5Å
20	A	46.1	Very low	58.1	Low	89 Å²	89	127.8 Å²	127.8	74%	0.736	67%	0.673	S	S	*	*			trans	-60.8	124.2	171	0	0	0	0	0	108.1	K18 E22	K18-A20 VanDerWaalsContact C-N 3.26Å; K18-A20 PolarHBondContact O-N 2.83Å; A20-E22 PolarHBondContact O-N 3.34Å; A20-E22 VanDerWaalsContact O-N 3.13Å
21	T	53.6	Low	59.9	Low	123 Å²	123	126.9 Å²	126.9	76%	0.755	66%	0.663	S	S	*	*			trans	-53.4	120.9	171.7	49.5	0	0	0	0	108.5	A19 I23	A19-T21 PolarHBondContact O-N 3.5Å; T21-I23 PolarHBondContact O-N 3.4Å
22	E	51.9	Low	61.6	Low	186 Å²	186	130 Å²	130	87%	0.869	67%	0.671	S	S	*	*			trans	-55.8	111.7	178.5	-66.5	-176.8	143.9	0	0	109	A20 K24	A20-E22 PolarHBondContact O-N 3.34Å; A20-E22 VanDerWaalsContact O-N 3.13Å; E22-K24 VanDerWaalsContact C-N 3.31Å; E22-K24 PolarHBondContact O-N 2.82Å
23	I	58.2	Low	63.2	Low	129 Å²	129	129.2 Å²	129.2	66%	0.662	67%	0.666	S	S	*	*			trans	-70.7	97	176.3	-58.7	175.6	0	0	0	105.3	T21 N25	T21-I23 PolarHBondContact O-N 3.4Å; I23-N25 PolarHBondContact O-N 3.03Å; I23-N25 VanDerWaalsContact O-N 3.16Å
24	K	55.8	Low	64.6	Low	187 Å²	187	132.6 Å²	132.6	81%	0.813	67%	0.674	S	S	*	*			trans	-46.9	125.9	173.6	-72.4	-173.1	174.2	-174.9	0	108	E22 N26	E22-K24 VanDerWaalsContact C-N 3.31Å; E22-K24 PolarHBondContact O-N 2.82Å; K24-N26 PolarHBondContact O-N 3.48Å
25	N	59.9	Low	66	Low	164 Å²	164	132.4 Å²	132.4	88%	0.877	67%	0.665	S	S	*	*			trans	-64.1	76.9	-166.4	-72.5	-32.1	0	0	0	112.8	I23 P27	I23-N25 PolarHBondContact O-N 3.03Å; I23-N25 VanDerWaalsContact O-N 3.16Å; N25-P27 VanDerWaalsContact O-CD 3.27Å; N25-P27 WeakPolarHBondContact O-CD 3.34Å
26	N	78.8	Confident	67.5	Low	59 Å²	59	132.3 Å²	132.3	32%	0.316	67%	0.67	S	S	.	*			trans	-92.8	102.5	178.3	-177.4	3	0	0	0	109.4	K24 F28 E29	K24-N26 PolarHBondContact O-N 3.48Å; N26-F28 PolarHBondContact O-N 3.11Å; N26-F28 VanDerWaalsContact O-N 3.1Å; N26-F28 PolarHBondContact OD1-N 3.35Å; N26-E29 HydrophobicContact CB-CG 4.46Å; N26-E29 PolarHBondContact ND2-OE1 2.87Å; N26-E29 PolarHBondContact O-N 3Å
27	P	80.6	Confident	69.1	Low	92 Å²	92	131.9 Å²	131.9	60%	0.597	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-63.5	-19.7	-176.6	27	-35.2	0	0	0	112.9	N25 V30	N25-P27 VanDerWaalsContact O-CD 3.27Å; N25-P27 WeakPolarHBondContact O-CD 3.34Å; P27-V30 PolarHBondContact O-N 3.45Å
28	F	82.7	Confident	70.8	Confident	192 Å²	192	133.5 Å²	133.5	84%	0.842	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-78.2	-15.7	179.9	-60.7	-73.6	0	0	0	114.2	N26 V30	N26-F28 PolarHBondContact O-N 3.11Å; N26-F28 VanDerWaalsContact O-N 3.1Å; N26-F28 PolarHBondContact OD1-N 3.35Å; F28-V30 VanDerWaalsContact C-N 3.33Å
29	E	83.4	Confident	72.4	Confident	94 Å²	94	127.4 Å²	127.4	44%	0.439	64%	0.644	S	S	.	*	G	3₁₀ helix	trans	-83.2	-14.3	173	-75.6	178.7	-127.9	0	0	113.1	N26 P51	N26-E29 HydrophobicContact CB-CG 4.46Å; N26-E29 PolarHBondContact ND2-OE1 2.87Å; N26-E29 PolarHBondContact O-N 3Å; E29-P51 WeakPolarHBondContact O-CD 3.46Å
30	V	85.1	Confident	74.1	Confident	53 Å²	53	131.1 Å²	131.1	32%	0.321	65%	0.651	S	S	.	*			trans	-110.8	125.5	-172.8	-174.4	0	0	0	0	109.5	P27 F28 I32 V48 L50	P27-V30 PolarHBondContact O-N 3.45Å; F28-V30 VanDerWaalsContact C-N 3.33Å; V30-I32 HydrophobicContact CG1-CG1 4.09Å; V30-V48 HydrophobicContact CG1-CG1 3.39Å; V30-L50 HydrophobicContact CG2-CD2 4.02Å
31	K	86.3	Confident	75.6	Confident	122 Å²	122	130.6 Å²	130.6	53%	0.53	65%	0.654	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.9	108.7	166.5	-178	173.3	177.7	178.5	0	109.7	N33 G49 P51	K31-N33 WeakPolarHBondContact CE-OD1 3.43Å; K31-G49 PolarHBondContact N-O 3.48Å; K31-G49 PolarHBondContact O-N 3.36Å; K31-P51 HydrophobicContact CB-CG 3.79Å
32	I	85.3	Confident	76.6	Confident	126 Å²	126	132.8 Å²	132.8	65%	0.646	65%	0.648	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-84.8	137.2	168.3	-52.7	176.9	0	0	0	108.6	V30 D47	V30-I32 HydrophobicContact CG1-CG1 4.09Å; I32-D47 WeakPolarHBondContact CA-O 3.49Å
33	N	83.7	Confident	77.6	Confident	74 Å²	74	133.5 Å²	133.5	40%	0.396	65%	0.649	S	S	.	*	P	Polyproline II helix	trans	-100.4	126.3	170.7	-67.7	-47.5	0	0	0	109.2	K31 K35 H46 D47	K31-N33 WeakPolarHBondContact CE-OD1 3.43Å; N33-K35 PolarHBondContact O-N 2.91Å; N33-H46 PolarHBondContact ND2-O 3.19Å; N33-D47 PolarHBondContact N-O 2.87Å
34	R	82.4	Confident	78.2	Confident	244 Å²	244	129.8 Å²	129.8	92%	0.921	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-65.3	120.9	177.8	178.8	170.5	177.4	170	0.2	110.2
35	K	80.3	Confident	78.9	Confident	100 Å²	100	129.1 Å²	129.1	44%	0.435	63%	0.631	S	S	.	*	P	Polyproline II helix	trans	-58.7	137.9	167.2	-68.2	-178.1	172.6	-177.7	0	109.7	N33 D38	N33-K35 PolarHBondContact O-N 2.91Å; K35-D38 WeakPolarHBondContact CD-OD1 3.03Å; K35-D38 IonicContact NZ-OD1 2.76Å; K35-D38 PolarHBondContact NZ-OD1 3.42Å
36	K	80.8	Confident	79.5	Confident	197 Å²	197	128.4 Å²	128.4	86%	0.857	62%	0.622	S	S	*	*	S	Bend	trans	-87.8	-39.5	176	-75.3	-165.7	171.3	-164.2	0	112.9
37	F	80.1	Confident	79.3	Confident	173 Å²	173	127.5 Å²	127.5	76%	0.759	62%	0.618	S	S	*	*	S	Bend	trans	-125.8	140.4	172.7	-53.5	-76.8	0	0	0	105.9
38	D	80.6	Confident	79.4	Confident	120 Å²	120	127.3 Å²	127.3	64%	0.642	62%	0.615	S	S	*	*			trans	-89.2	136.3	168.3	-154.5	20.1	0	0	0	109.6	K35	K35-D38 WeakPolarHBondContact CD-OD1 3.03Å; K35-D38 IonicContact NZ-OD1 2.76Å; K35-D38 PolarHBondContact NZ-OD1 3.42Å
39	V	81.2	Confident	79.5	Confident	65 Å²	65	119.7 Å²	119.7	39%	0.394	59%	0.59	S	S	.	*			trans	-132.9	108.2	-176	-179.6	0	0	0	0	106.2	R42	V39-R42 HydrophobicContact CB-CB 4.16Å; V39-R42 HydrophobicContact CG1-CB 3.87Å; V39-R42 PolarHBondContact O-N 2.99Å
40	L	80.5	Confident	79.7	Confident	165 Å²	165	119.4 Å²	119.4	86%	0.864	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.5	146	-177.2	-66.6	168.6	0	0	0	110.9	R42	L40-R42 PolarHBondContact O-N 3.48Å
41	G	76.3	Confident	79.9	Confident	78 Å²	78	119 Å²	119	80%	0.804	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	69.4	-24.6	-174.6	0	0	0	0	0	116.4	K43	G41-K43 PolarHBondContact O-N 3.34Å; G41-K43 VanDerWaalsContact O-N 3.16Å
42	R	74.6	Confident	80	Confident	168 Å²	168	115 Å²	115	63%	0.634	58%	0.583	S	S	*	*			trans	-86.5	91.2	-168.9	-163	179.5	-170	-141.2	7.8	113.8	V39 L40 S44	V39-R42 HydrophobicContact CB-CB 4.16Å; V39-R42 HydrophobicContact CG1-CB 3.87Å; V39-R42 PolarHBondContact O-N 2.99Å; L40-R42 PolarHBondContact O-N 3.48Å; R42-S44 PolarHBondContact O-N 2.78Å
43	K	73.1	Confident	80.1	Confident	201 Å²	201	112 Å²	112	87%	0.874	57%	0.571	S	S	*	*			trans	-75	115.9	171.2	-63.9	180	-179	175.7	0	110.9	G41	G41-K43 PolarHBondContact O-N 3.34Å; G41-K43 VanDerWaalsContact O-N 3.16Å
44	S	70.9	Confident	80.4	Confident	51 Å²	51	112.3 Å²	112.3	36%	0.357	58%	0.578	S	S	.	*			trans	-91.7	131.3	-178.6	138.6	0	0	0	0	112	R42 H46 D47	R42-S44 PolarHBondContact O-N 2.78Å; S44-H46 PolarHBondContact O-N 3.24Å; S44-H46 PolarHBondContact OG-N 2.97Å; S44-D47 VanDerWaalsContact CB-CG 3.45Å; S44-D47 WeakPolarHBondContact CB-OD1 3.22Å; S44-D47 WeakPolarHBondContact CB-OD2 3.33Å; S44-D47 PolarHBondContact N-OD2 2.8Å; S44-D47 PolarHBondContact O-N 3.46Å; S44-D47 VanDerWaalsContact OG-CG 3.27Å; S44-D47 PolarHBondContact OG-N 3.04Å; S44-D47 PolarHBondContact OG-OD1 3.29Å
45	K	70.8	Confident	80.8	Confident	174 Å²	174	109.4 Å²	109.4	76%	0.757	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-4.7	-179.4	-63.8	-176.9	180	178.4	0	114.3
46	H	73.1	Confident	81.3	Confident	148 Å²	148	107.3 Å²	107.3	69%	0.685	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.9	9.8	-176.3	-54.8	106.4	0	0	0	113.1	N33 S44 V48	N33-H46 PolarHBondContact ND2-O 3.19Å; S44-H46 PolarHBondContact O-N 3.24Å; S44-H46 PolarHBondContact OG-N 2.97Å; H46-V48 PolarHBondContact O-N 2.74Å
47	D	74.1	Confident	81.9	Confident	41 Å²	41	104.7 Å²	104.7	22%	0.219	55%	0.554	C	S	.	*	S	Bend	trans	-65.2	-29.2	178.5	-66.6	-14.4	0	0	0	111.8	I32 N33 S44	I32-D47 WeakPolarHBondContact CA-O 3.49Å; N33-D47 PolarHBondContact N-O 2.87Å; S44-D47 VanDerWaalsContact CB-CG 3.45Å; S44-D47 WeakPolarHBondContact CB-OD1 3.22Å; S44-D47 WeakPolarHBondContact CB-OD2 3.33Å; S44-D47 PolarHBondContact N-OD2 2.8Å; S44-D47 PolarHBondContact O-N 3.46Å; S44-D47 VanDerWaalsContact OG-CG 3.27Å; S44-D47 PolarHBondContact OG-N 3.04Å; S44-D47 PolarHBondContact OG-OD1 3.29Å
48	V	83.2	Confident	82.5	Confident	88 Å²	88	97.7 Å²	97.7	53%	0.533	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	135.2	-178.1	-175.3	0	0	0	0	110.6	V30 H46	V30-V48 HydrophobicContact CG1-CG1 3.39Å; H46-V48 PolarHBondContact O-N 2.74Å
49	G	84.4	Confident	83	Confident	31 Å²	31	95.6 Å²	95.6	32%	0.32	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	161.7	171.4	0	0	0	0	0	112.4	K31 P51	K31-G49 PolarHBondContact N-O 3.48Å; K31-G49 PolarHBondContact O-N 3.36Å; G49-P51 WeakPolarHBondContact O-CD 3.3Å
50	L	88.1	Confident	83.7	Confident	88 Å²	88	96.6 Å²	96.6	46%	0.461	52%	0.518	S	S	.	.			trans	-119.5	84.6	-177.4	-66	171.6	0	0	0	111.3	V30 G52 V53 S54	V30-L50 HydrophobicContact CG2-CD2 4.02Å; L50-G52 VanDerWaalsContact C-N 3.32Å; L50-G52 PolarHBondContact O-N 2.88Å; L50-V53 HydrophobicContact CB-CB 4.26Å; L50-V53 HydrophobicContact CB-CG2 4.37Å; L50-S54 WeakPolarHBondContact O-CB 3.44Å; L50-S54 PolarHBondContact O-N 2.93Å
51	P	89.1	Confident	84.3	Confident	46 Å²	46	95.5 Å²	95.5	30%	0.299	51%	0.506	S	S	.	.	H	α-helix	trans	-62.2	-34	-175.9	-24.1	35	0	0	0	113.9	E29 K31 G49 R55	E29-P51 WeakPolarHBondContact O-CD 3.46Å; K31-P51 HydrophobicContact CB-CG 3.79Å; G49-P51 WeakPolarHBondContact O-CD 3.3Å; P51-R55 WeakPolarHBondContact O-CB 3.44Å; P51-R55 WeakPolarHBondContact O-CD 3.43Å; P51-R55 WeakPolarHBondContact O-CG 3.47Å; P51-R55 PolarHBondContact O-N 3.48Å
52	G	88.2	Confident	85.2	Confident	38 Å²	38	92.8 Å²	92.8	39%	0.392	47%	0.472	S	S	.	.	H	α-helix	trans	-61.9	-57.1	178.2	0	0	0	0	0	111.9	L50 S54 R55 S56	L50-G52 VanDerWaalsContact C-N 3.32Å; L50-G52 PolarHBondContact O-N 2.88Å; G52-S54 VanDerWaalsContact C-N 3.3Å; G52-S54 PolarHBondContact O-N 2.96Å; G52-R55 PolarHBondContact O-N 2.81Å; G52-R55 VanDerWaalsContact O-N 3.16Å; G52-S56 PolarHBondContact O-N 2.96Å; G52-S56 PolarHBondContact O-OG 3.24Å
53	V	87.8	Confident	86.1	Confident	63 Å²	63	90 Å²	90	38%	0.382	47%	0.465	S	S	.	.	H	α-helix	trans	-62	-36.5	178.3	-176.2	0	0	0	0	112.1	L50 S56 K57	L50-V53 HydrophobicContact CB-CB 4.26Å; L50-V53 HydrophobicContact CB-CG2 4.37Å; V53-S56 PolarHBondContact O-OG 3.01Å; V53-K57 HydrophobicContact CG1-CD 4.17Å; V53-K57 WeakPolarHBondContact O-CB 3.4Å; V53-K57 WeakPolarHBondContact O-CG 3.41Å; V53-K57 PolarHBondContact O-N 3.44Å; V53-K57 VanDerWaalsContact O-N 3.11Å
54	S	88.8	Confident	87.1	Confident	80 Å²	80	85.4 Å²	85.4	56%	0.559	45%	0.446	S	S	*	.	H	α-helix	trans	-64.4	-45.4	174.2	179.6	0	0	0	0	111.8	L50 G52 A58	L50-S54 WeakPolarHBondContact O-CB 3.44Å; L50-S54 PolarHBondContact O-N 2.93Å; G52-S54 VanDerWaalsContact C-N 3.3Å; G52-S54 PolarHBondContact O-N 2.96Å; S54-A58 WeakPolarHBondContact O-CB 3.32Å; S54-A58 PolarHBondContact O-N 2.92Å
55	R	90.4	Very high	88.2	Confident	182 Å²	182	85.4 Å²	85.4	69%	0.687	44%	0.444	S	S	*	.	H	α-helix	trans	-65.1	-43.8	177.1	-74.3	169.4	-178.2	-172.3	2.3	112.1	P51 G52 A58 I59	P51-R55 WeakPolarHBondContact O-CB 3.44Å; P51-R55 WeakPolarHBondContact O-CD 3.43Å; P51-R55 WeakPolarHBondContact O-CG 3.47Å; P51-R55 PolarHBondContact O-N 3.48Å; G52-R55 PolarHBondContact O-N 2.81Å; G52-R55 VanDerWaalsContact O-N 3.16Å; R55-A58 CarbonylContact O-C 3.57Å; R55-A58 PolarHBondContact O-N 2.85Å; R55-I59 VanDerWaalsContact O-CG1 3.31Å; R55-I59 WeakPolarHBondContact O-CG1 3.47Å; R55-I59 PolarHBondContact O-N 3.37Å
56	S	91.3	Very high	89.3	Confident	56 Å²	56	78.7 Å²	78.7	39%	0.392	42%	0.416	S	S	.	.	H	α-helix	trans	-65.3	-48.4	-179.3	63.3	0	0	0	0	111.7	G52 V53 A58 I59 I60	G52-S56 PolarHBondContact O-N 2.96Å; G52-S56 PolarHBondContact O-OG 3.24Å; V53-S56 PolarHBondContact O-OG 3.01Å; S56-A58 VanDerWaalsContact C-N 3.28Å; S56-A58 PolarHBondContact O-N 2.89Å; S56-I59 PolarHBondContact O-N 3.35Å; S56-I60 WeakPolarHBondContact O-CG1 3.43Å; S56-I60 PolarHBondContact O-N 3.45Å
57	K	93	Very high	90.2	Very high	143 Å²	143	72.5 Å²	72.5	62%	0.622	39%	0.388	S	S	*	.	H	α-helix	trans	-56.7	-41.1	172.9	-72.4	-178.2	177.3	-173.7	0	112.2	V53 I59 I60 K61	V53-K57 HydrophobicContact CG1-CD 4.17Å; V53-K57 WeakPolarHBondContact O-CB 3.4Å; V53-K57 WeakPolarHBondContact O-CG 3.41Å; V53-K57 PolarHBondContact O-N 3.44Å; V53-K57 VanDerWaalsContact O-N 3.11Å; K57-I59 VanDerWaalsContact C-N 3.31Å; K57-I59 PolarHBondContact O-N 2.87Å; K57-I60 PolarHBondContact O-N 2.9Å; K57-K61 PolarHBondContact O-N 2.96Å
58	A	92.1	Very high	91	Very high	26 Å²	26	75.8 Å²	75.8	22%	0.215	40%	0.401	C	S	.	.	H	α-helix	trans	-73	-19.1	178.2	0	0	0	0	0	113.9	S54 R55 S56 R62	S54-A58 WeakPolarHBondContact O-CB 3.32Å; S54-A58 PolarHBondContact O-N 2.92Å; R55-A58 CarbonylContact O-C 3.57Å; R55-A58 PolarHBondContact O-N 2.85Å; S56-A58 VanDerWaalsContact C-N 3.28Å; S56-A58 PolarHBondContact O-N 2.89Å; A58-R62 WeakPolarHBondContact O-CD 3.48Å; A58-R62 VanDerWaalsContact O-CG 3.25Å; A58-R62 WeakPolarHBondContact O-CG 3.48Å; A58-R62 PolarHBondContact O-NH1 3.25Å
59	I	92.4	Very high	91.4	Very high	76 Å²	76	76.4 Å²	76.4	39%	0.39	40%	0.398	S	S	.	.	H	α-helix	trans	-83.2	-39.9	169.7	-70.7	163.5	0	0	0	110.4	R55 S56 K57 R62 K63	R55-I59 VanDerWaalsContact O-CG1 3.31Å; R55-I59 WeakPolarHBondContact O-CG1 3.47Å; R55-I59 PolarHBondContact O-N 3.37Å; S56-I59 PolarHBondContact O-N 3.35Å; K57-I59 VanDerWaalsContact C-N 3.31Å; K57-I59 PolarHBondContact O-N 2.87Å; I59-R62 PolarHBondContact O-N 3.38Å; I59-K63 PolarHBondContact O-N 3.06Å
60	I	94.8	Very high	91.7	Very high	86 Å²	86	78.2 Å²	78.2	44%	0.441	40%	0.395	S	S	.	.	H	α-helix	trans	-57.6	-50.7	174.2	-68.7	163.6	0	0	0	109.8	S56 K57 R62 K63 E64	S56-I60 WeakPolarHBondContact O-CG1 3.43Å; S56-I60 PolarHBondContact O-N 3.45Å; K57-I60 PolarHBondContact O-N 2.9Å; I60-R62 VanDerWaalsContact C-N 3.27Å; I60-R62 PolarHBondContact O-N 3.5Å; I60-K63 CarbonylContact O-C 3.55Å; I60-K63 WeakPolarHBondContact O-CA 3.41Å; I60-K63 WeakPolarHBondContact O-CB 3.32Å; I60-K63 PolarHBondContact O-N 2.9Å; I60-E64 HydrophobicContact CG2-CG 4.41Å; I60-E64 VanDerWaalsContact CG2-OE1 3.29Å; I60-E64 WeakPolarHBondContact CG2-OE1 3.29Å; I60-E64 WeakPolarHBondContact O-CG 3.31Å; I60-E64 PolarHBondContact O-N 2.89Å
61	K	94.8	Very high	91.8	Very high	141 Å²	141	79.9 Å²	79.9	61%	0.613	40%	0.399	S	S	*	.	H	α-helix	trans	-55.8	-39.9	176.1	-169.6	177.9	-178.6	-177	0	112.7	K57 E64 T65	K57-K61 PolarHBondContact O-N 2.96Å; K61-E64 CarbonylContact O-C 3.58Å; K61-E64 PolarHBondContact O-N 2.68Å; K61-E64 VanDerWaalsContact O-N 3.15Å; K61-T65 HydrophobicContact CG-CG2 4.46Å; K61-T65 PolarHBondContact O-N 3.22Å; K61-T65 PolarHBondContact O-OG1 2.89Å
62	R	94.4	Very high	91.7	Very high	21 Å²	21	83.1 Å²	83.1	8%	0.079	41%	0.41	C	S	.	.	H	α-helix	trans	-68.1	-34	176.6	-71.5	170.8	170.5	83.7	13.3	113.1	A58 I59 I60 E64 L66 L67 E826 D830 F833	A58-R62 WeakPolarHBondContact O-CD 3.48Å; A58-R62 VanDerWaalsContact O-CG 3.25Å; A58-R62 WeakPolarHBondContact O-CG 3.48Å; A58-R62 PolarHBondContact O-NH1 3.25Å; I59-R62 PolarHBondContact O-N 3.38Å; I60-R62 VanDerWaalsContact C-N 3.27Å; I60-R62 PolarHBondContact O-N 3.5Å; R62-E64 VanDerWaalsContact C-N 3.28Å; R62-L66 HydrophobicContact CB-CD1 4.4Å; R62-L66 HydrophobicContact CG-CD1 4.02Å; R62-L66 PolarHBondContact O-N 3.47Å; R62-L66 VanDerWaalsContact O-N 3.14Å; R62-L67 PolarHBondContact O-N 2.88Å; R62-E826 IonicContact CZ-OE2 2.65Å; R62-E826 IonicContact NH1-OE2 3.67Å; R62-E826 IonicContact NH2-OE2 3.64Å; R62-E826 PolarHBondContact NH2-OE2 3.3Å; R62-D830 IonicContact CZ-OD1 2.96Å; R62-D830 IonicContact NE-OD1 2.72Å; R62-D830 PolarHBondContact NE-OD1 2.87Å; R62-D830 IonicContact NH2-OD1 3.23Å; R62-D830 PolarHBondContact NH2-OD1 3.44Å; R62-F833 HydrophobicContact CB-CD1 3.78Å; R62-F833 HydrophobicContact CB-CD2 4.18Å; R62-F833 HydrophobicContact CB-CE1 3.76Å; R62-F833 HydrophobicContact CB-CE2 4.18Å; R62-F833 HydrophobicContact CB-CG 4Å; R62-F833 HydrophobicContact CB-CZ 3.98Å; R62-F833 HydrophobicContact CG-CD1 4.45Å; R62-F833 HydrophobicContact CG-CG 4.48Å; R62-F833 WeakPolarHBondContact O-CE1 3.39Å
63	K	93.8	Very high	91.6	Very high	111 Å²	111	89 Å²	89	48%	0.483	43%	0.425	S	S	.	.	H	α-helix	trans	-69.6	-27.8	170.5	-71.6	-174	171.4	-166.4	0	112.3	I59 I60 L67 F833	I59-K63 PolarHBondContact O-N 3.06Å; I60-K63 CarbonylContact O-C 3.55Å; I60-K63 WeakPolarHBondContact O-CA 3.41Å; I60-K63 WeakPolarHBondContact O-CB 3.32Å; I60-K63 PolarHBondContact O-N 2.9Å; K63-L67 HydrophobicContact CB-CD2 4.32Å; K63-L67 HydrophobicContact CG-CD2 4.05Å; K63-F833 HydrophobicContact CG-CE2 4.03Å; K63-F833 HydrophobicContact CG-CZ 3.77Å
64	E	93.9	Very high	91.6	Very high	103 Å²	103	93.2 Å²	93.2	48%	0.481	45%	0.445	S	S	.	.	H	α-helix	trans	-85.2	-25.9	178.8	-71.3	166.7	170.3	0	0	114.3	I60 K61 R62 K68	I60-E64 HydrophobicContact CG2-CG 4.41Å; I60-E64 VanDerWaalsContact CG2-OE1 3.29Å; I60-E64 WeakPolarHBondContact CG2-OE1 3.29Å; I60-E64 WeakPolarHBondContact O-CG 3.31Å; I60-E64 PolarHBondContact O-N 2.89Å; K61-E64 CarbonylContact O-C 3.58Å; K61-E64 PolarHBondContact O-N 2.68Å; K61-E64 VanDerWaalsContact O-N 3.15Å; R62-E64 VanDerWaalsContact C-N 3.28Å; E64-K68 WeakPolarHBondContact O-CD 3.23Å; E64-K68 WeakPolarHBondContact O-CE 3.48Å; E64-K68 WeakPolarHBondContact O-CG 3.19Å; E64-K68 PolarHBondContact O-NZ 3.3Å
65	T	93.2	Very high	91.5	Very high	52 Å²	52	96.6 Å²	96.6	32%	0.319	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-83.9	176.8	70.2	0	0	0	0	110.9	K61 L67 K68 E69	K61-T65 HydrophobicContact CG-CG2 4.46Å; K61-T65 PolarHBondContact O-N 3.22Å; K61-T65 PolarHBondContact O-OG1 2.89Å; T65-L67 VanDerWaalsContact C-N 3.28Å; T65-L67 PolarHBondContact O-N 3.35Å; T65-L67 VanDerWaalsContact O-N 3.07Å; T65-K68 WeakPolarHBondContact O-CA 3.43Å; T65-K68 WeakPolarHBondContact O-CB 3.27Å; T65-K68 PolarHBondContact O-N 2.86Å; T65-E69 WeakPolarHBondContact CA-OE1 3.33Å; T65-E69 VanDerWaalsContact CB-OE1 3.23Å; T65-E69 WeakPolarHBondContact CB-OE1 3.29Å; T65-E69 PolarHBondContact O-N 3.32Å
66	L	93.4	Very high	91	Very high	33 Å²	33	93.3 Å²	93.3	17%	0.173	45%	0.454	C	S	.	.	H	α-helix	trans	-53.2	-37.4	-171.5	-61.1	179.3	0	0	0	114.2	R62 Y70 D830 F833 L834	R62-L66 HydrophobicContact CB-CD1 4.4Å; R62-L66 HydrophobicContact CG-CD1 4.02Å; R62-L66 PolarHBondContact O-N 3.47Å; R62-L66 VanDerWaalsContact O-N 3.14Å; L66-Y70 WeakPolarHBondContact O-CB 3.41Å; L66-Y70 PolarHBondContact O-N 2.94Å; L66-D830 HydrophobicContact CD1-CB 3.7Å; L66-F833 HydrophobicContact CB-CD1 4.4Å; L66-F833 HydrophobicContact CB-CE1 4.32Å; L66-F833 HydrophobicContact CD1-CD1 4.34Å; L66-L834 HydrophobicContact CB-CD2 4.31Å
67	L	93.5	Very high	90.6	Very high	17 Å²	17	98 Å²	98	9%	0.089	48%	0.475	C	S	.	.	H	α-helix	trans	-74.8	-30.6	178.3	-173.3	58.4	0	0	0	112.8	R62 K63 T65 K71 F833 E837	R62-L67 PolarHBondContact O-N 2.88Å; K63-L67 HydrophobicContact CB-CD2 4.32Å; K63-L67 HydrophobicContact CG-CD2 4.05Å; T65-L67 VanDerWaalsContact C-N 3.28Å; T65-L67 PolarHBondContact O-N 3.35Å; T65-L67 VanDerWaalsContact O-N 3.07Å; L67-K71 HydrophobicContact CD1-CD 4.36Å; L67-K71 HydrophobicContact CG-CD 4.35Å; L67-K71 WeakPolarHBondContact O-CB 3.37Å; L67-K71 VanDerWaalsContact O-CG 3.26Å; L67-K71 WeakPolarHBondContact O-CG 3.48Å; L67-K71 PolarHBondContact O-N 3.42Å; L67-K71 VanDerWaalsContact O-N 3.16Å; L67-F833 HydrophobicContact CB-CE1 4.1Å; L67-F833 HydrophobicContact CB-CZ 4.16Å; L67-F833 HydrophobicContact CD2-CZ 4.48Å; L67-E837 HydrophobicContact CD1-CB 4.23Å; L67-E837 HydrophobicContact CD1-CG 3.98Å; L67-E837 WeakPolarHBondContact CD1-OE2 3.43Å
68	K	91.4	Very high	89.9	Confident	111 Å²	111	99.3 Å²	99.3	48%	0.483	48%	0.481	S	S	.	.	H	α-helix	trans	-71.3	-48.5	172.1	-63.3	-170.2	-165.3	136.3	0	109.9	E64 T65 Y70 K71 Q72	E64-K68 WeakPolarHBondContact O-CD 3.23Å; E64-K68 WeakPolarHBondContact O-CE 3.48Å; E64-K68 WeakPolarHBondContact O-CG 3.19Å; E64-K68 PolarHBondContact O-NZ 3.3Å; T65-K68 WeakPolarHBondContact O-CA 3.43Å; T65-K68 WeakPolarHBondContact O-CB 3.27Å; T65-K68 PolarHBondContact O-N 2.86Å; K68-Y70 PolarHBondContact O-N 3.49Å; K68-K71 CarbonylContact O-C 3.59Å; K68-K71 PolarHBondContact O-N 2.94Å; K68-Q72 VanDerWaalsContact O-CB 3.3Å; K68-Q72 WeakPolarHBondContact O-CB 3.4Å; K68-Q72 VanDerWaalsContact O-CG 3.26Å; K68-Q72 WeakPolarHBondContact O-CG 3.29Å; K68-Q72 PolarHBondContact O-N 3.25Å
69	E	90.6	Very high	89.4	Confident	101 Å²	101	106.1 Å²	106.1	47%	0.472	51%	0.506	S	S	.	.	H	α-helix	trans	-54.6	-49	175	-68.3	154.1	-142.9	0	0	111.2	T65 K71 Q72 K73	T65-E69 WeakPolarHBondContact CA-OE1 3.33Å; T65-E69 VanDerWaalsContact CB-OE1 3.23Å; T65-E69 WeakPolarHBondContact CB-OE1 3.29Å; T65-E69 PolarHBondContact O-N 3.32Å; E69-K71 PolarHBondContact O-N 3.26Å; E69-Q72 CarbonylContact O-C 3.6Å; E69-Q72 WeakPolarHBondContact O-CA 3.27Å; E69-Q72 PolarHBondContact O-N 3Å; E69-K73 PolarHBondContact O-N 2.9Å
70	Y	91.2	Very high	88.7	Confident	68 Å²	68	107.5 Å²	107.5	27%	0.267	51%	0.513	S	S	.	.	H	α-helix	trans	-61	-41.4	177.8	-177.8	-115.2	0	0	0	112.7	L66 K68 Q72 K73 L834 K838	L66-Y70 WeakPolarHBondContact O-CB 3.41Å; L66-Y70 PolarHBondContact O-N 2.94Å; K68-Y70 PolarHBondContact O-N 3.49Å; Y70-Q72 VanDerWaalsContact C-N 3.26Å; Y70-Q72 PolarHBondContact O-N 3.48Å; Y70-K73 WeakPolarHBondContact O-CB 3.21Å; Y70-K73 PolarHBondContact O-N 3.17Å; Y70-L834 HydrophobicContact CG-CD2 4.31Å; Y70-K838 HydrophobicContact CE1-CG 4.34Å; Y70-K838 HydrophobicContact CE2-CG 4.46Å
71	K	89.1	Confident	87.7	Confident	124 Å²	124	104.5 Å²	104.5	54%	0.539	50%	0.498	S	S	.	.	H	α-helix	trans	-73.5	-13.7	174.3	-71.7	176.9	179.1	-178	0	114.1	L67 K68 E69	L67-K71 HydrophobicContact CD1-CD 4.36Å; L67-K71 HydrophobicContact CG-CD 4.35Å; L67-K71 WeakPolarHBondContact O-CB 3.37Å; L67-K71 VanDerWaalsContact O-CG 3.26Å; L67-K71 WeakPolarHBondContact O-CG 3.48Å; L67-K71 PolarHBondContact O-N 3.42Å; L67-K71 VanDerWaalsContact O-N 3.16Å; K68-K71 CarbonylContact O-C 3.59Å; K68-K71 PolarHBondContact O-N 2.94Å; E69-K71 PolarHBondContact O-N 3.26Å
72	Q	88.3	Confident	87	Confident	113 Å²	113	108.6 Å²	108.6	53%	0.528	51%	0.509	S	S	.	.	H	α-helix	trans	-101.9	-8.2	175.9	-72.8	172.6	-16.8	0	0	112.8	K68 E69 Y70 N74 K75	K68-Q72 VanDerWaalsContact O-CB 3.3Å; K68-Q72 WeakPolarHBondContact O-CB 3.4Å; K68-Q72 VanDerWaalsContact O-CG 3.26Å; K68-Q72 WeakPolarHBondContact O-CG 3.29Å; K68-Q72 PolarHBondContact O-N 3.25Å; E69-Q72 CarbonylContact O-C 3.6Å; E69-Q72 WeakPolarHBondContact O-CA 3.27Å; E69-Q72 PolarHBondContact O-N 3Å; Y70-Q72 VanDerWaalsContact C-N 3.26Å; Y70-Q72 PolarHBondContact O-N 3.48Å; Q72-N74 PolarHBondContact O-N 3.24Å; Q72-K75 WeakPolarHBondContact O-CB 3.45Å; Q72-K75 PolarHBondContact O-N 3.36Å
73	K	85.9	Confident	86.2	Confident	163 Å²	163	113.3 Å²	113.3	71%	0.709	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.3	-38.4	-175	-167.2	-159.1	171.8	-163.8	0	113.8	E69 Y70	E69-K73 PolarHBondContact O-N 2.9Å; Y70-K73 WeakPolarHBondContact O-CB 3.21Å; Y70-K73 PolarHBondContact O-N 3.17Å
74	N	86.5	Confident	85	Confident	150 Å²	150	112 Å²	112	80%	0.802	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	26.4	-177.8	-60.3	13.8	0	0	0	112.4	Q72	Q72-N74 PolarHBondContact O-N 3.24Å
75	K	86.8	Confident	83.9	Confident	151 Å²	151	108.3 Å²	108.3	66%	0.657	51%	0.514	S	S	*	.			trans	-122.6	117	179.2	-58.6	-169.4	-178.8	-166.3	0	110.7	Q72	Q72-K75 WeakPolarHBondContact O-CB 3.45Å; Q72-K75 PolarHBondContact O-N 3.36Å
76	S	81.6	Confident	82.9	Confident	113 Å²	113	109.2 Å²	109.2	79%	0.79	52%	0.515	S	S	*	.			trans	-79.4	-25	173.8	44.3	0	0	0	0	113.6	K78	S76-K78 PolarHBondContact O-N 3.13Å
77	N	82.9	Confident	81.7	Confident	154 Å²	154	116.1 Å²	116.1	82%	0.824	54%	0.54	S	S	*	.			trans	-70.2	98.3	-172.1	-63.3	12.4	0	0	0	112.2
78	K	76.6	Confident	80.7	Confident	171 Å²	171	118.6 Å²	118.6	74%	0.743	55%	0.553	S	S	*	*			trans	-99	110.1	174.2	-175.5	-178.1	-179.4	-178.1	0	110.6	S76 I80	S76-K78 PolarHBondContact O-N 3.13Å; K78-I80 HydrophobicContact CD-CD1 4.37Å; K78-I80 HydrophobicContact CD-CG1 4.11Å; K78-I80 HydrophobicContact CG-CG1 4.01Å; K78-I80 PolarHBondContact O-N 2.9Å
79	F	81.6	Confident	79.8	Confident	169 Å²	169	118.2 Å²	118.2	74%	0.741	57%	0.571	S	S	*	*			trans	-71.6	115.1	167.2	-175.4	-104.2	0	0	0	109.1	D81	F79-D81 HydrophobicContact CD1-CB 4.18Å; F79-D81 HydrophobicContact CE1-CB 3.72Å
80	I	77.9	Confident	79.2	Confident	105 Å²	105	122.3 Å²	122.3	54%	0.538	59%	0.588	S	S	.	*			trans	-101.5	96.6	177	-57.2	177.7	0	0	0	107.6	K78 R82	K78-I80 HydrophobicContact CD-CD1 4.37Å; K78-I80 HydrophobicContact CD-CG1 4.11Å; K78-I80 HydrophobicContact CG-CG1 4.01Å; K78-I80 PolarHBondContact O-N 2.9Å; I80-R82 HydrophobicContact CG2-CG 4.18Å; I80-R82 PolarHBondContact O-N 3.26Å
81	D	75.6	Confident	78.3	Confident	24 Å²	24	122 Å²	122	13%	0.128	59%	0.589	C	S	.	*			trans	-73.7	107.1	176.7	-162.9	-16	0	0	0	110.3	F79 R83 Y87	F79-D81 HydrophobicContact CD1-CB 4.18Å; F79-D81 HydrophobicContact CE1-CB 3.72Å; D81-R83 VanDerWaalsContact C-N 3.34Å; D81-R83 VanDerWaalsContact OD1-CB 3.23Å; D81-R83 WeakPolarHBondContact OD1-CB 3.39Å; D81-R83 WeakPolarHBondContact OD1-CG 3.38Å; D81-R83 IonicContact OD1-CZ 3.72Å; D81-R83 PolarHBondContact OD1-N 3.16Å; D81-R83 IonicContact OD1-NE 2.73Å; D81-R83 PolarHBondContact OD1-NE 3.1Å; D81-R83 IonicContact OD1-NH2 3.32Å; D81-R83 IonicContact OD2-CZ 2.69Å; D81-R83 VanDerWaalsContact OD2-CZ 3.3Å; D81-R83 IonicContact OD2-NE 2.68Å; D81-R83 PolarHBondContact OD2-NE 3.4Å; D81-R83 VanDerWaalsContact OD2-NE 3.16Å; D81-R83 IonicContact OD2-NH2 2.63Å; D81-R83 PolarHBondContact OD2-NH2 2.92Å; D81-Y87 HydrophobicContact CB-CE2 3.97Å; D81-Y87 WeakPolarHBondContact CB-OH 3.3Å
82	R	79.9	Confident	77.9	Confident	226 Å²	226	118 Å²	118	85%	0.853	58%	0.579	S	S	*	*			trans	-90.8	10.9	178	-66.8	-174.2	174	-172.9	-2.4	113	I80 L84	I80-R82 HydrophobicContact CG2-CG 4.18Å; I80-R82 PolarHBondContact O-N 3.26Å; R82-L84 PolarHBondContact O-N 3.47Å
83	R	77.4	Confident	77.4	Confident	121 Å²	121	117 Å²	117	46%	0.457	58%	0.583	S	S	.	*			trans	-72.5	115.2	179.4	-65.8	178.6	-64.5	145.2	5.1	110.8	D81 G85 E86	D81-R83 VanDerWaalsContact C-N 3.34Å; D81-R83 VanDerWaalsContact OD1-CB 3.23Å; D81-R83 WeakPolarHBondContact OD1-CB 3.39Å; D81-R83 WeakPolarHBondContact OD1-CG 3.38Å; D81-R83 IonicContact OD1-CZ 3.72Å; D81-R83 PolarHBondContact OD1-N 3.16Å; D81-R83 IonicContact OD1-NE 2.73Å; D81-R83 PolarHBondContact OD1-NE 3.1Å; D81-R83 IonicContact OD1-NH2 3.32Å; D81-R83 IonicContact OD2-CZ 2.69Å; D81-R83 VanDerWaalsContact OD2-CZ 3.3Å; D81-R83 IonicContact OD2-NE 2.68Å; D81-R83 PolarHBondContact OD2-NE 3.4Å; D81-R83 VanDerWaalsContact OD2-NE 3.16Å; D81-R83 IonicContact OD2-NH2 2.63Å; D81-R83 PolarHBondContact OD2-NH2 2.92Å; R83-G85 PolarHBondContact O-N 2.95Å; R83-E86 HydrophobicContact CB-CB 4.48Å; R83-E86 VanDerWaalsContact CZ-CD 3.46Å; R83-E86 IonicContact CZ-OE1 3.32Å; R83-E86 IonicContact CZ-OE2 3.05Å; R83-E86 IonicContact NH1-OE1 3.91Å; R83-E86 PolarHBondContact NH1-OE1 3.26Å; R83-E86 VanDerWaalsContact NH1-OE1 3.13Å; R83-E86 IonicContact NH1-OE2 2.65Å; R83-E86 PolarHBondContact NH1-OE2 3.18Å; R83-E86 IonicContact NH2-OE1 2.67Å; R83-E86 PolarHBondContact NH2-OE1 3.5Å; R83-E86 IonicContact NH2-OE2 2.87Å; R83-E86 WeakPolarHBondContact O-CB 3.36Å; R83-E86 PolarHBondContact O-N 2.92Å
84	L	68.7	Low	77	Confident	83 Å²	83	116.4 Å²	116.4	44%	0.435	58%	0.582	S	S	.	*	T	Hydrogen-bonded Turn	trans	-50.4	130.7	-176.8	-71.1	124.2	0	0	0	112.1	R82 E86 R100 I103	R82-L84 PolarHBondContact O-N 3.47Å; L84-E86 VanDerWaalsContact C-N 3.26Å; L84-E86 PolarHBondContact O-N 3.13Å; L84-R100 VanDerWaalsContact O-CZ 3.3Å; L84-R100 PolarHBondContact O-NE 3.41Å; L84-R100 PolarHBondContact O-NH2 3.11Å; L84-I103 HydrophobicContact CD1-CD1 3.71Å; L84-I103 HydrophobicContact CD1-CG2 4.17Å; L84-I103 HydrophobicContact CD2-CD1 3.88Å; L84-I103 HydrophobicContact CG-CD1 4.37Å
85	G	69.1	Low	76.6	Confident	25 Å²	25	112.7 Å²	112.7	26%	0.258	56%	0.562	S	S	.	*	T	Hydrogen-bonded Turn	trans	70.9	1.3	176.6	0	0	0	0	0	116.7	R83 Y87 D88 K96	R83-G85 PolarHBondContact O-N 2.95Å; G85-Y87 VanDerWaalsContact C-N 3.28Å; G85-Y87 PolarHBondContact O-N 3Å; G85-D88 PolarHBondContact O-N 3.35Å; G85-K96 WeakPolarHBondContact O-CD 3.42Å; G85-K96 WeakPolarHBondContact O-CE 3.41Å; G85-K96 PolarHBondContact O-NZ 3.4Å
86	E	72.7	Confident	76.4	Confident	72 Å²	72	107.1 Å²	107.1	34%	0.336	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-43.9	-178.6	-164.2	87.4	169.6	0	0	111.1	R83 L84 K96 R100	R83-E86 HydrophobicContact CB-CB 4.48Å; R83-E86 VanDerWaalsContact CZ-CD 3.46Å; R83-E86 IonicContact CZ-OE1 3.32Å; R83-E86 IonicContact CZ-OE2 3.05Å; R83-E86 IonicContact NH1-OE1 3.91Å; R83-E86 PolarHBondContact NH1-OE1 3.26Å; R83-E86 VanDerWaalsContact NH1-OE1 3.13Å; R83-E86 IonicContact NH1-OE2 2.65Å; R83-E86 PolarHBondContact NH1-OE2 3.18Å; R83-E86 IonicContact NH2-OE1 2.67Å; R83-E86 PolarHBondContact NH2-OE1 3.5Å; R83-E86 IonicContact NH2-OE2 2.87Å; R83-E86 WeakPolarHBondContact O-CB 3.36Å; R83-E86 PolarHBondContact O-N 2.92Å; L84-E86 VanDerWaalsContact C-N 3.26Å; L84-E86 PolarHBondContact O-N 3.13Å; E86-K96 PolarHBondContact O-NZ 3.26Å; E86-R100 IonicContact OE2-CZ 3.13Å; E86-R100 IonicContact OE2-NH1 3.79Å; E86-R100 PolarHBondContact OE2-NH1 3.34Å; E86-R100 IonicContact OE2-NH2 3.18Å; E86-R100 PolarHBondContact OE2-NH2 3.14Å
87	Y	67.8	Low	76.3	Confident	177 Å²	177	107.2 Å²	107.2	69%	0.694	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-12.2	-177.3	-62.8	-67.4	0	0	0	116.4	D81 G85	D81-Y87 HydrophobicContact CB-CE2 3.97Å; D81-Y87 WeakPolarHBondContact CB-OH 3.3Å; G85-Y87 VanDerWaalsContact C-N 3.28Å; G85-Y87 PolarHBondContact O-N 3Å
88	D	73.4	Confident	76.2	Confident	69 Å²	69	105.7 Å²	105.7	37%	0.369	52%	0.52	S	S	.	.			trans	-80.6	124.6	177.3	-163.1	-22.3	0	0	0	110.3	G85 K90 K96	G85-D88 PolarHBondContact O-N 3.35Å; D88-K90 VanDerWaalsContact C-N 3.33Å; D88-K90 WeakPolarHBondContact OD1-CB 3.48Å; D88-K90 WeakPolarHBondContact OD1-CG 3.49Å; D88-K90 PolarHBondContact OD1-N 2.72Å; D88-K96 WeakPolarHBondContact O-CE 3.29Å; D88-K96 PolarHBondContact O-NZ 3.37Å
89	A	72.1	Confident	76.2	Confident	104 Å²	104	101.5 Å²	101.5	86%	0.86	50%	0.503	S	S	*	.	S	Bend	trans	-83.5	-4.9	178.4	0	0	0	0	0	113.8
90	K	77.6	Confident	76.2	Confident	187 Å²	187	96.5 Å²	96.5	81%	0.813	48%	0.479	S	S	*	.	S	Bend	trans	-87	-34.5	-178.9	-62.7	175.9	-177.2	175	0	114.1	D88	D88-K90 VanDerWaalsContact C-N 3.33Å; D88-K90 WeakPolarHBondContact OD1-CB 3.48Å; D88-K90 WeakPolarHBondContact OD1-CG 3.49Å; D88-K90 PolarHBondContact OD1-N 2.72Å
91	M	73.4	Confident	76.3	Confident	61 Å²	61	97.5 Å²	97.5	30%	0.3	48%	0.48	S	S	.	.	S	Bend	trans	-77.3	139.5	-177.5	-59.9	-59.2	-59.6	0	0	111.3	D95 K96	M91-D95 HydrophobicContact CE-CB 3.61Å; M91-K96 HydrophobicContact CB-CG 4Å; M91-K96 VanDerWaalsContact O-CE 3.3Å; M91-K96 WeakPolarHBondContact O-CE 3.29Å
92	A	81.2	Confident	76.3	Confident	39 Å²	39	98.4 Å²	98.4	32%	0.322	49%	0.491	S	S	.	.			trans	-68.1	155.5	175.2	0	0	0	0	0	111	E94 D95 K96	A92-E94 PolarHBondContact O-N 2.94Å; A92-D95 HydrophobicContact CB-CB 4.5Å; A92-D95 WeakPolarHBondContact CB-OD2 3.43Å; A92-D95 PolarHBondContact N-OD2 3.28Å; A92-D95 PolarHBondContact O-N 3.37Å; A92-K96 WeakPolarHBondContact O-CG 3.37Å; A92-K96 PolarHBondContact O-N 2.72Å; A92-K96 VanDerWaalsContact O-N 3.13Å
93	P	77.9	Confident	76.1	Confident	93 Å²	93	89.9 Å²	89.9	60%	0.604	46%	0.462	S	S	*	.	H	α-helix	trans	-60.7	-29.9	176.8	25.2	-34.5	0	0	0	112.6	I97	P93-I97 WeakPolarHBondContact O-CD1 3.18Å; P93-I97 WeakPolarHBondContact O-CG1 3.49Å; P93-I97 PolarHBondContact O-N 2.87Å
94	E	77.1	Confident	76.1	Confident	150 Å²	150	90.6 Å²	90.6	70%	0.701	47%	0.47	S	S	*	.	H	α-helix	trans	-71.8	-48.2	177.8	-68.8	165.1	-161.6	0	0	111	A92 K96 I97 L98	A92-E94 PolarHBondContact O-N 2.94Å; E94-K96 VanDerWaalsContact C-N 3.26Å; E94-K96 PolarHBondContact O-N 3.01Å; E94-I97 PolarHBondContact O-N 3.41Å; E94-L98 PolarHBondContact O-N 3.17Å
95	D	78.5	Confident	76.4	Confident	72 Å²	72	94.1 Å²	94.1	39%	0.385	48%	0.478	S	S	.	.	H	α-helix	trans	-55.4	-41	174	-47.2	-29.8	0	0	0	112	M91 A92 I97 L98 Q99	M91-D95 HydrophobicContact CE-CB 3.61Å; A92-D95 HydrophobicContact CB-CB 4.5Å; A92-D95 WeakPolarHBondContact CB-OD2 3.43Å; A92-D95 PolarHBondContact N-OD2 3.28Å; A92-D95 PolarHBondContact O-N 3.37Å; D95-I97 VanDerWaalsContact C-N 3.29Å; D95-I97 PolarHBondContact O-N 3.39Å; D95-L98 PolarHBondContact O-N 3.33Å; D95-Q99 WeakPolarHBondContact O-CB 3.33Å; D95-Q99 WeakPolarHBondContact O-CG 3.36Å; D95-Q99 PolarHBondContact O-N 3.2Å
96	K	81.8	Confident	76.3	Confident	34 Å²	34	99.4 Å²	99.4	15%	0.148	50%	0.496	C	S	.	.	H	α-helix	trans	-62.5	-36.5	177.8	-69.7	176.5	-170.9	-157.5	0	111.9	G85 E86 D88 M91 A92 E94 R100	G85-K96 WeakPolarHBondContact O-CD 3.42Å; G85-K96 WeakPolarHBondContact O-CE 3.41Å; G85-K96 PolarHBondContact O-NZ 3.4Å; E86-K96 PolarHBondContact O-NZ 3.26Å; D88-K96 WeakPolarHBondContact O-CE 3.29Å; D88-K96 PolarHBondContact O-NZ 3.37Å; M91-K96 HydrophobicContact CB-CG 4Å; M91-K96 VanDerWaalsContact O-CE 3.3Å; M91-K96 WeakPolarHBondContact O-CE 3.29Å; A92-K96 WeakPolarHBondContact O-CG 3.37Å; A92-K96 PolarHBondContact O-N 2.72Å; A92-K96 VanDerWaalsContact O-N 3.13Å; E94-K96 VanDerWaalsContact C-N 3.26Å; E94-K96 PolarHBondContact O-N 3.01Å; K96-R100 WeakPolarHBondContact O-CB 3.42Å; K96-R100 WeakPolarHBondContact O-CD 3.37Å; K96-R100 WeakPolarHBondContact O-CG 3.26Å; K96-R100 PolarHBondContact O-N 2.93Å; K96-R100 PolarHBondContact O-NE 2.91Å
97	I	79.3	Confident	76.1	Confident	115 Å²	115	104.5 Å²	104.5	59%	0.59	51%	0.512	S	S	*	.	H	α-helix	trans	-72.2	-44.1	175.3	-67.6	160.9	0	0	0	109.8	P93 E94 D95 R100 F101	P93-I97 WeakPolarHBondContact O-CD1 3.18Å; P93-I97 WeakPolarHBondContact O-CG1 3.49Å; P93-I97 PolarHBondContact O-N 2.87Å; E94-I97 PolarHBondContact O-N 3.41Å; D95-I97 VanDerWaalsContact C-N 3.29Å; D95-I97 PolarHBondContact O-N 3.39Å; I97-R100 PolarHBondContact O-N 3.4Å; I97-F101 WeakPolarHBondContact O-CB 3.31Å; I97-F101 PolarHBondContact O-N 3.43Å
98	L	80.2	Confident	76.2	Confident	122 Å²	122	98.6 Å²	98.6	64%	0.639	50%	0.499	S	S	*	.	H	α-helix	trans	-64.7	-42.9	-178.6	-165.9	152	0	0	0	112.2	E94 D95 F101 A102	E94-L98 PolarHBondContact O-N 3.17Å; D95-L98 PolarHBondContact O-N 3.33Å; L98-F101 PolarHBondContact O-N 3.49Å; L98-A102 WeakPolarHBondContact O-CB 3.43Å; L98-A102 PolarHBondContact O-N 2.82Å
99	Q	76.7	Confident	75.8	Confident	84 Å²	84	99.9 Å²	99.9	39%	0.393	50%	0.503	S	S	.	.	H	α-helix	trans	-65.1	-37.5	173.8	-73.3	-177.6	-12.6	0	0	112.6	D95 I103	D95-Q99 WeakPolarHBondContact O-CB 3.33Å; D95-Q99 WeakPolarHBondContact O-CG 3.36Å; D95-Q99 PolarHBondContact O-N 3.2Å; Q99-I103 WeakPolarHBondContact O-CG1 3.45Å; Q99-I103 PolarHBondContact O-N 3.16Å; Q99-I103 VanDerWaalsContact O-N 3.11Å
100	R	81	Confident	75.3	Confident	63 Å²	63	97.1 Å²	97.1	24%	0.238	48%	0.484	C	S	.	.	H	α-helix	trans	-63.7	-46	173.7	-74.2	164.9	-165.9	-163.5	-2.1	111	L84 E86 K96 I97 I103 E104	L84-R100 VanDerWaalsContact O-CZ 3.3Å; L84-R100 PolarHBondContact O-NE 3.41Å; L84-R100 PolarHBondContact O-NH2 3.11Å; E86-R100 IonicContact OE2-CZ 3.13Å; E86-R100 IonicContact OE2-NH1 3.79Å; E86-R100 PolarHBondContact OE2-NH1 3.34Å; E86-R100 IonicContact OE2-NH2 3.18Å; E86-R100 PolarHBondContact OE2-NH2 3.14Å; K96-R100 WeakPolarHBondContact O-CB 3.42Å; K96-R100 WeakPolarHBondContact O-CD 3.37Å; K96-R100 WeakPolarHBondContact O-CG 3.26Å; K96-R100 PolarHBondContact O-N 2.93Å; K96-R100 PolarHBondContact O-NE 2.91Å; I97-R100 PolarHBondContact O-N 3.4Å; R100-I103 PolarHBondContact O-N 3.37Å; R100-E104 VanDerWaalsContact O-CB 3.26Å; R100-E104 WeakPolarHBondContact O-CB 3.46Å; R100-E104 PolarHBondContact O-N 2.93Å
101	F	80.1	Confident	74.5	Confident	127 Å²	127	95.5 Å²	95.5	56%	0.557	48%	0.478	S	S	*	.	H	α-helix	trans	-63.7	-40.7	177.9	-177.1	-106.6	0	0	0	112.5	I97 L98 E104 R105	I97-F101 WeakPolarHBondContact O-CB 3.31Å; I97-F101 PolarHBondContact O-N 3.43Å; L98-F101 PolarHBondContact O-N 3.49Å; F101-E104 PolarHBondContact O-N 3.32Å; F101-R105 WeakPolarHBondContact O-CB 3.23Å; F101-R105 PolarHBondContact O-N 3.05Å
102	A	77.4	Confident	73.9	Confident	43 Å²	43	101.7 Å²	101.7	36%	0.355	50%	0.498	S	S	.	.	H	α-helix	trans	-61.5	-47.1	175.1	0	0	0	0	0	112.1	L98 R105 Q106	L98-A102 WeakPolarHBondContact O-CB 3.43Å; L98-A102 PolarHBondContact O-N 2.82Å; A102-R105 PolarHBondContact O-N 3.19Å; A102-Q106 WeakPolarHBondContact O-CG 3.16Å; A102-Q106 PolarHBondContact O-N 2.89Å
103	I	75.4	Confident	72.8	Confident	47 Å²	47	105 Å²	105	24%	0.241	51%	0.509	C	S	.	.	H	α-helix	trans	-71.9	-32	179.7	-70.6	166.8	0	0	0	111.8	L84 Q99 R100 R107	L84-I103 HydrophobicContact CD1-CD1 3.71Å; L84-I103 HydrophobicContact CD1-CG2 4.17Å; L84-I103 HydrophobicContact CD2-CD1 3.88Å; L84-I103 HydrophobicContact CG-CD1 4.37Å; Q99-I103 WeakPolarHBondContact O-CG1 3.45Å; Q99-I103 PolarHBondContact O-N 3.16Å; Q99-I103 VanDerWaalsContact O-N 3.11Å; R100-I103 PolarHBondContact O-N 3.37Å; I103-R107 WeakPolarHBondContact O-CB 3.22Å; I103-R107 VanDerWaalsContact O-CG 3.26Å; I103-R107 WeakPolarHBondContact O-CG 3.27Å; I103-R107 PolarHBondContact O-N 3.36Å
104	E	75.9	Confident	71.9	Confident	135 Å²	135	105.2 Å²	105.2	63%	0.631	51%	0.509	S	S	*	.	H	α-helix	trans	-65	-41.3	170.3	-176.6	163.9	-145.3	0	0	111.4	R100 F101 R107 A108	R100-E104 VanDerWaalsContact O-CB 3.26Å; R100-E104 WeakPolarHBondContact O-CB 3.46Å; R100-E104 PolarHBondContact O-N 2.93Å; F101-E104 PolarHBondContact O-N 3.32Å; E104-R107 PolarHBondContact O-N 2.96Å; E104-A108 PolarHBondContact O-N 3.16Å
105	R	75.1	Confident	70.9	Confident	158 Å²	158	107.4 Å²	107.4	60%	0.596	51%	0.512	S	S	*	.	H	α-helix	trans	-65.6	-45.8	174.7	-160.9	176	-173.4	-175.5	3.4	111.8	F101 A102 R107 A108 H109	F101-R105 WeakPolarHBondContact O-CB 3.23Å; F101-R105 PolarHBondContact O-N 3.05Å; A102-R105 PolarHBondContact O-N 3.19Å; R105-R107 VanDerWaalsContact C-N 3.31Å; R105-R107 PolarHBondContact O-N 2.99Å; R105-A108 WeakPolarHBondContact O-CA 3.34Å; R105-A108 WeakPolarHBondContact O-CB 3.37Å; R105-A108 PolarHBondContact O-N 3.15Å; R105-H109 PolarHBondContact O-CD2 2.91Å; R105-H109 PolarHBondContact O-N 3.08Å
106	Q	67.3	Low	70	Confident	136 Å²	136	108.3 Å²	108.3	64%	0.636	52%	0.517	S	S	*	.	H	α-helix	trans	-56.3	-43.7	173.4	-75.1	173.7	-34.6	0	0	111.9	A102 A108 H109 G110	A102-Q106 WeakPolarHBondContact O-CG 3.16Å; A102-Q106 PolarHBondContact O-N 2.89Å; Q106-A108 PolarHBondContact O-N 3.31Å; Q106-H109 PolarHBondContact O-N 3.33Å; Q106-G110 PolarHBondContact O-N 3.28Å
107	R	69.7	Low	68.7	Low	178 Å²	178	114.9 Å²	114.9	67%	0.672	55%	0.553	S	S	*	*	H	α-helix	trans	-69.3	-14.8	175	-73.8	174	173.5	-170.6	-0.3	114.9	I103 E104 R105 K111	I103-R107 WeakPolarHBondContact O-CB 3.22Å; I103-R107 VanDerWaalsContact O-CG 3.26Å; I103-R107 WeakPolarHBondContact O-CG 3.27Å; I103-R107 PolarHBondContact O-N 3.36Å; E104-R107 PolarHBondContact O-N 2.96Å; R105-R107 VanDerWaalsContact C-N 3.31Å; R105-R107 PolarHBondContact O-N 2.99Å; R107-K111 WeakPolarHBondContact O-CG 3.4Å
108	A	68.9	Low	67.5	Low	53 Å²	53	116.3 Å²	116.3	44%	0.438	56%	0.562	S	S	.	*	H	α-helix	trans	-90.6	-30.5	173.7	0	0	0	0	0	112.3	E104 R105 Q106	E104-A108 PolarHBondContact O-N 3.16Å; R105-A108 WeakPolarHBondContact O-CA 3.34Å; R105-A108 WeakPolarHBondContact O-CB 3.37Å; R105-A108 PolarHBondContact O-N 3.15Å; Q106-A108 PolarHBondContact O-N 3.31Å
109	H	64.7	Low	65.9	Low	97 Å²	97	118.1 Å²	118.1	45%	0.449	57%	0.567	S	S	.	*	H	α-helix	trans	-68.8	-60	169.4	-81.3	-91.9	0	0	0	110.4	R105 Q106 K111 R112 D113	R105-H109 PolarHBondContact O-CD2 2.91Å; R105-H109 PolarHBondContact O-N 3.08Å; Q106-H109 PolarHBondContact O-N 3.33Å; H109-K111 PolarHBondContact O-N 2.89Å; H109-R112 PolarHBondContact O-N 2.85Å; H109-D113 VanDerWaalsContact O-CG 3.31Å
110	G	61.1	Low	64.7	Low	45 Å²	45	123.4 Å²	123.4	46%	0.464	59%	0.592	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.4	22.6	178.2	0	0	0	0	0	116.9	Q106 D113	Q106-G110 PolarHBondContact O-N 3.28Å; G110-D113 WeakPolarHBondContact CA-OD2 3.36Å; G110-D113 PolarHBondContact N-OD2 2.86Å
111	K	62.3	Low	63.5	Low	154 Å²	154	129.9 Å²	129.9	67%	0.67	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.9	-14.2	167	-82.5	-169.6	177.6	-163.3	0	113.6	R107 H109	R107-K111 WeakPolarHBondContact O-CG 3.4Å; H109-K111 PolarHBondContact O-N 2.89Å
112	R	60.5	Low	62.4	Low	191 Å²	191	131 Å²	131	72%	0.721	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-40.9	170.6	-69.9	177.1	167.6	-175.8	-6.1	109.9	H109 V114 Y115	H109-R112 PolarHBondContact O-N 2.85Å; R112-V114 PolarHBondContact O-N 3.36Å; R112-V114 VanDerWaalsContact O-N 3.1Å; R112-Y115 PolarHBondContact O-N 3.03Å
113	D	58.4	Low	61.2	Low	107 Å²	107	135.2 Å²	135.2	57%	0.572	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-65.3	-15.5	-177.4	-37.3	-29.6	0	0	0	112.5	H109 G110 Y115	H109-D113 VanDerWaalsContact O-CG 3.31Å; G110-D113 WeakPolarHBondContact CA-OD2 3.36Å; G110-D113 PolarHBondContact N-OD2 2.86Å; D113-Y115 PolarHBondContact O-N 3.03Å
114	V	58.6	Low	60.5	Low	99 Å²	99	136.9 Å²	136.9	60%	0.6	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-72.4	-11.6	178	-179.3	0	0	0	0	113.5	R112	R112-V114 PolarHBondContact O-N 3.36Å; R112-V114 VanDerWaalsContact O-N 3.1Å
115	Y	56	Low	59.7	Low	196 Å²	196	136.8 Å²	136.8	77%	0.769	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-122.7	6.5	-176	-66.4	-76	0	0	0	114.4	R112 D113 L117	R112-Y115 PolarHBondContact O-N 3.03Å; D113-Y115 PolarHBondContact O-N 3.03Å; Y115-L117 PolarHBondContact O-N 3.44Å
116	N	59	Low	58.6	Low	91 Å²	91	139.7 Å²	139.7	49%	0.487	67%	0.672	S	S	.	*			trans	-91.3	85.6	177.2	-157.6	33.6	0	0	0	110.9	N118 E119	N116-N118 PolarHBondContact O-N 3.32Å; N116-N118 VanDerWaalsContact O-N 3.12Å; N116-E119 PolarHBondContact ND2-OE2 2.97Å
117	L	55.4	Low	58.2	Low	172 Å²	172	136.4 Å²	136.4	90%	0.901	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	23.2	-174.5	-77.9	167.7	0	0	0	114.6	Y115	Y115-L117 PolarHBondContact O-N 3.44Å
118	N	53.4	Low	57.7	Low	145 Å²	145	134.2 Å²	134.2	78%	0.775	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-147.9	33.5	-166.3	-147.4	110.6	0	0	0	115	N116	N116-N118 PolarHBondContact O-N 3.32Å; N116-N118 VanDerWaalsContact O-N 3.12Å
119	E	47.8	Very low	57.3	Low	160 Å²	160	133.4 Å²	133.4	75%	0.748	66%	0.663	S	S	*	*	S	Bend	trans	-125.7	145.6	165	-73	169.5	160.7	0	0	107.9	N116	N116-E119 PolarHBondContact ND2-OE2 2.97Å
120	E	51.7	Low	56.9	Low	194 Å²	194	133 Å²	133	91%	0.907	66%	0.664	S	S	*	*			trans	-75.8	157.4	-169.8	-63.5	174.3	139.1	0	0	112	E122	E120-E122 PolarHBondContact O-N 2.79Å
121	E	55	Low	56.7	Low	200 Å²	200	134.2 Å²	134.2	94%	0.935	67%	0.669	S	S	*	*			trans	-66.3	104.4	-175.5	-69.7	-175.6	117.2	0	0	112.1	L123	E121-L123 PolarHBondContact O-N 2.63Å
122	E	57.2	Low	56.5	Low	149 Å²	149	134 Å²	134	70%	0.696	67%	0.67	S	S	*	*			trans	-61.7	108.4	164.3	-74.1	-164.2	160.5	0	0	109.5	E120 T124	E120-E122 PolarHBondContact O-N 2.79Å; E122-T124 PolarHBondContact O-N 3.32Å
123	L	52.3	Low	56.2	Low	132 Å²	132	129.9 Å²	129.9	69%	0.691	66%	0.662	S	S	*	*			trans	-66.9	108.7	-179.1	-174	64.7	0	0	0	110.5	E121 L130	E121-L123 PolarHBondContact O-N 2.63Å; L123-L130 HydrophobicContact CB-CD1 4.12Å; L123-L130 HydrophobicContact CD2-CD1 3.84Å; L123-L130 HydrophobicContact CG-CD1 3.91Å; L123-L130 WeakPolarHBondContact O-CD1 3.19Å; L123-L130 WeakPolarHBondContact O-CG 3.33Å
124	T	59.6	Low	55.9	Low	82 Å²	82	133 Å²	133	50%	0.503	67%	0.673	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.7	139.5	176.4	62.8	0	0	0	0	111.8	E122 Q128	E122-T124 PolarHBondContact O-N 3.32Å; T124-Q128 VanDerWaalsContact CA-O 3.27Å; T124-Q128 WeakPolarHBondContact CA-O 3.41Å; T124-Q128 WeakPolarHBondContact CB-O 3.25Å
125	H	59.9	Low	55.5	Low	133 Å²	133	136.8 Å²	136.8	62%	0.616	68%	0.681	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-117.5	127.8	171.8	-169.2	-129.5	0	0	0	109.3	G127 Q128	H125-G127 PolarHBondContact O-N 2.83Å; H125-Q128 PolarHBondContact N-O 2.89Å; H125-Q128 PolarHBondContact O-N 3.22Å
126	Y	50.9	Low	54.9	Low	220 Å²	220	136 Å²	136	86%	0.863	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	47.5	22.1	-173.3	-73.8	-85.5	0	0	0	116.7
127	G	60.8	Low	53.9	Low	67 Å²	67	138.9 Å²	138.9	69%	0.691	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	92.2	16.4	175.1	0	0	0	0	0	115.8	H125	H125-G127 PolarHBondContact O-N 2.83Å
128	Q	57.4	Low	53.2	Low	132 Å²	132	136.9 Å²	136.9	62%	0.617	69%	0.688	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-112.6	145.4	163.7	-65.5	-178.6	-66.9	0	0	109.8	T124 H125	T124-Q128 VanDerWaalsContact CA-O 3.27Å; T124-Q128 WeakPolarHBondContact CA-O 3.41Å; T124-Q128 WeakPolarHBondContact CB-O 3.25Å; H125-Q128 PolarHBondContact N-O 2.89Å; H125-Q128 PolarHBondContact O-N 3.22Å
129	S	60.9	Low	52.4	Low	36 Å²	36	135.8 Å²	135.8	25%	0.252	69%	0.687	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-85.9	134.9	175.5	52.1	0	0	0	0	110.7	A131 E132	S129-A131 PolarHBondContact O-N 3.15Å; S129-E132 PolarHBondContact O-N 2.91Å; S129-E132 VanDerWaalsContact O-N 3.13Å
130	L	57	Low	52.1	Low	88 Å²	88	134.1 Å²	134.1	46%	0.461	69%	0.687	S	S	.	*	G	3₁₀ helix	trans	-62.1	-27.9	-175.4	-70.5	167.1	0	0	0	112.8	L123 E132 I133	L123-L130 HydrophobicContact CB-CD1 4.12Å; L123-L130 HydrophobicContact CD2-CD1 3.84Å; L123-L130 HydrophobicContact CG-CD1 3.91Å; L123-L130 WeakPolarHBondContact O-CD1 3.19Å; L123-L130 WeakPolarHBondContact O-CG 3.33Å; L130-E132 PolarHBondContact O-N 2.95Å; L130-I133 HydrophobicContact CD2-CD1 4.3Å; L130-I133 PolarHBondContact O-N 3.14Å; L130-I133 VanDerWaalsContact O-N 3.09Å
131	A	57.7	Low	51.5	Low	71 Å²	71	128.3 Å²	128.3	59%	0.587	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-64.5	-15.2	176.9	0	0	0	0	0	114.9	S129	S129-A131 PolarHBondContact O-N 3.15Å
132	E	56.3	Low	50.8	Low	148 Å²	148	124.7 Å²	124.7	69%	0.692	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-89.7	-16.7	174.9	-138.8	173.1	-150.8	0	0	112.7	S129 L130	S129-E132 PolarHBondContact O-N 2.91Å; S129-E132 VanDerWaalsContact O-N 3.13Å; L130-E132 PolarHBondContact O-N 2.95Å
133	I	55.4	Low	50.1	Low	105 Å²	105	125.1 Å²	125.1	54%	0.538	68%	0.683	S	S	.	*	G	3₁₀ helix	trans	-83	-29.2	-178.3	-66.4	172.2	0	0	0	111.8	L130 K135 F136	L130-I133 HydrophobicContact CD2-CD1 4.3Å; L130-I133 PolarHBondContact O-N 3.14Å; L130-I133 VanDerWaalsContact O-N 3.09Å; I133-K135 PolarHBondContact O-N 3.23Å; I133-F136 PolarHBondContact O-N 2.84Å
134	E	50.6	Low	49.5	Very low	172 Å²	172	125.3 Å²	125.3	80%	0.804	69%	0.685	S	S	*	*	G	3₁₀ helix	trans	-65.8	0.1	-177.2	-134.2	-179.7	-155.3	0	0	115
135	K	50.7	Low	48.8	Very low	179 Å²	179	130.7 Å²	130.7	78%	0.778	70%	0.704	S	S	*	*	G	3₁₀ helix	trans	-112.1	20.8	-177	-71.9	178.2	-178.2	162.3	0	114.7	I133	I133-K135 PolarHBondContact O-N 3.23Å
136	F	43.1	Very low	47.8	Very low	180 Å²	180	127.3 Å²	127.3	79%	0.789	70%	0.695	S	S	*	*			trans	-130.4	62.1	169.5	-90.7	-80	0	0	0	113	I133 D138	I133-F136 PolarHBondContact O-N 2.84Å; F136-D138 PolarHBondContact O-N 3.07Å
137	N	38.6	Very low	47.6	Very low	152 Å²	152	126.7 Å²	126.7	81%	0.813	70%	0.7	S	S	*	*			trans	-76.1	70	155.3	-81.1	-6.4	0	0	0	109.7	T139	N137-T139 PolarHBondContact O-N 2.84Å
138	D	41.1	Very low	47	Very low	130 Å²	130	131.9 Å²	131.9	70%	0.695	71%	0.707	S	S	*	*			trans	-79.3	99.1	155.7	-168.8	10.1	0	0	0	106.3	F136 V140	F136-D138 PolarHBondContact O-N 3.07Å; D138-V140 VanDerWaalsContact C-N 3.29Å; D138-V140 PolarHBondContact O-N 3.29Å
139	T	36.9	Very low	46.4	Very low	122 Å²	122	133.3 Å²	133.3	75%	0.748	71%	0.711	S	S	*	*			trans	-75.3	83.2	-172.8	51.9	0	0	0	0	110.2	N137 G141	N137-T139 PolarHBondContact O-N 2.84Å; T139-G141 PolarHBondContact O-N 2.65Å; T139-G141 VanDerWaalsContact O-N 3.07Å
140	V	41.2	Very low	45.9	Very low	124 Å²	124	135.2 Å²	135.2	75%	0.752	74%	0.736	S	S	*	*			trans	-61.5	108.7	168.6	-175.2	0	0	0	0	108	D138 S142	D138-V140 VanDerWaalsContact C-N 3.29Å; D138-V140 PolarHBondContact O-N 3.29Å; V140-S142 PolarHBondContact O-N 2.69Å
141	G	38.5	Very low	45.4	Very low	72 Å²	72	138.7 Å²	138.7	74%	0.742	76%	0.755	S	S	*	*			trans	-65.3	113.8	173.7	0	0	0	0	0	109.7	T139 D143	T139-G141 PolarHBondContact O-N 2.65Å; T139-G141 VanDerWaalsContact O-N 3.07Å; G141-D143 PolarHBondContact O-N 3.07Å
142	S	41.5	Very low	45.1	Very low	124 Å²	124	140.7 Å²	140.7	87%	0.867	76%	0.755	S	S	*	*			trans	-90.9	90.2	177.8	176.9	0	0	0	0	110	V140	V140-S142 PolarHBondContact O-N 2.69Å
143	D	42.6	Very low	45.1	Very low	159 Å²	159	137.1 Å²	137.1	85%	0.85	75%	0.746	S	S	*	*			trans	-157.8	163.1	153.4	-147.5	-14.2	0	0	0	110.6	G141	G141-D143 PolarHBondContact O-N 3.07Å
144	D	38.7	Very low	45.2	Very low	135 Å²	135	136.2 Å²	136.2	72%	0.722	76%	0.755	S	S	*	*			trans	84.1	87	-176.7	-162.6	26.6	0	0	0	116.5	S146	D144-S146 PolarHBondContact O-N 2.86Å
145	E	45.8	Very low	45.5	Very low	195 Å²	195	133.9 Å²	133.9	91%	0.911	74%	0.744	S	S	*	*			trans	-74.5	111.5	170.4	-68.3	-172.9	138	0	0	111.8
146	S	38.4	Very low	45.7	Very low	62 Å²	62	129 Å²	129	43%	0.434	73%	0.726	S	S	.	*			trans	-140.5	97.2	163.6	51.5	0	0	0	0	111.8	D144 E148 K149	D144-S146 PolarHBondContact O-N 2.86Å; S146-E148 PolarHBondContact O-N 2.96Å; S146-K149 PolarHBondContact OG-NZ 2.86Å
147	E	45.8	Very low	46.6	Very low	207 Å²	207	122.9 Å²	122.9	97%	0.967	70%	0.703	S	S	*	*	S	Bend	trans	-71.2	52	-174.2	-67.7	-144.1	122.5	0	0	115.2
148	E	48.3	Very low	47.6	Very low	177 Å²	177	117.9 Å²	117.9	83%	0.827	68%	0.683	S	S	*	*			trans	-135.7	21.5	172	-139.7	-159.2	162.3	0	0	115	S146	S146-E148 PolarHBondContact O-N 2.96Å
149	K	45.1	Very low	48.5	Very low	161 Å²	161	115.8 Å²	115.8	70%	0.7	68%	0.678	S	S	*	*			trans	-117.2	18.4	180	-60.5	-173.3	-168.6	80.4	0	115.1	S146	S146-K149 PolarHBondContact OG-NZ 2.86Å
150	G	50.4	Low	49.5	Very low	76 Å²	76	117.1 Å²	117.1	78%	0.784	68%	0.676	S	S	*	*			trans	-76.3	-23.7	170.9	0	0	0	0	0	114.8	L152	G150-L152 PolarHBondContact O-N 3.17Å; G150-L152 VanDerWaalsContact O-N 3.14Å
151	L	47.1	Very low	50.3	Low	162 Å²	162	119.5 Å²	119.5	85%	0.848	68%	0.676	S	S	*	*			trans	-83.6	92	-176.7	-71.6	174.4	0	0	0	112.2	S153	L151-S153 PolarHBondContact O-N 3.43Å
152	L	50.5	Low	50.8	Low	113 Å²	113	119.5 Å²	119.5	59%	0.592	68%	0.677	S	S	*	*			trans	-50.8	121.5	161.7	-72.2	172.6	0	0	0	109.6	G150 A154 T157	G150-L152 PolarHBondContact O-N 3.17Å; G150-L152 VanDerWaalsContact O-N 3.14Å; L152-A154 PolarHBondContact O-N 3.04Å; L152-T157 WeakPolarHBondContact CB-OG1 3.14Å; L152-T157 PolarHBondContact O-OG1 3.4Å
153	S	57.5	Low	51.3	Low	72 Å²	72	117.2 Å²	117.2	50%	0.503	67%	0.673	S	S	.	*			trans	-51.6	137.7	-171.9	70	0	0	0	0	111.7	L151 E155 L156 T157	L151-S153 PolarHBondContact O-N 3.43Å; S153-E155 PolarHBondContact O-N 2.92Å; S153-L156 WeakPolarHBondContact O-CA 3.42Å; S153-L156 WeakPolarHBondContact O-CB 3.5Å; S153-L156 PolarHBondContact O-N 3.4Å; S153-T157 PolarHBondContact O-N 2.87Å; S153-T157 PolarHBondContact O-OG1 3.37Å
154	A	55.9	Low	51.2	Low	87 Å²	87	111.9 Å²	111.9	72%	0.719	66%	0.655	S	S	*	*	H	α-helix	trans	-55.6	-29.1	-167.3	0	0	0	0	0	113.6	L152 A158	L152-A154 PolarHBondContact O-N 3.04Å; A154-A158 WeakPolarHBondContact O-CB 3.14Å; A154-A158 PolarHBondContact O-N 3.41Å
155	E	56.8	Low	51.9	Low	123 Å²	123	110.1 Å²	110.1	58%	0.575	67%	0.669	S	S	*	*	H	α-helix	trans	-72.4	-39.5	174.9	-171	159.3	-142.9	0	0	113.2	S153 S159	S153-E155 PolarHBondContact O-N 2.92Å; E155-S159 WeakPolarHBondContact O-CB 3.45Å; E155-S159 PolarHBondContact O-N 3.23Å; E155-S159 VanDerWaalsContact O-N 3.14Å
156	L	56.7	Low	52.3	Low	77 Å²	77	103.4 Å²	103.4	40%	0.403	65%	0.652	S	S	.	*	H	α-helix	trans	-64.1	-49	172.4	-122	80.4	0	0	0	110.6	S153 A158 S159 H160	S153-L156 WeakPolarHBondContact O-CA 3.42Å; S153-L156 WeakPolarHBondContact O-CB 3.5Å; S153-L156 PolarHBondContact O-N 3.4Å; L156-A158 PolarHBondContact O-N 2.85Å; L156-S159 WeakPolarHBondContact O-CA 3.48Å; L156-S159 WeakPolarHBondContact O-CB 3.32Å; L156-S159 PolarHBondContact O-N 3.03Å; L156-S159 PolarHBondContact O-OG 3Å; L156-H160 PolarHBondContact O-N 2.73Å; L156-H160 VanDerWaalsContact O-N 3.08Å
157	T	61.9	Low	52.8	Low	51 Å²	51	106.6 Å²	106.6	31%	0.313	66%	0.663	S	S	.	*	H	α-helix	trans	-61.7	-43.5	-177.7	-56.9	0	0	0	0	111.4	L152 S153 S159 H160 F161	L152-T157 WeakPolarHBondContact CB-OG1 3.14Å; L152-T157 PolarHBondContact O-OG1 3.4Å; S153-T157 PolarHBondContact O-N 2.87Å; S153-T157 PolarHBondContact O-OG1 3.37Å; T157-S159 VanDerWaalsContact C-N 3.27Å; T157-S159 PolarHBondContact O-N 2.85Å; T157-H160 PolarHBondContact O-N 3.27Å; T157-F161 PolarHBondContact O-N 2.59Å
158	A	57.9	Low	52.6	Low	46 Å²	46	104.8 Å²	104.8	38%	0.38	66%	0.659	S	S	.	*	H	α-helix	trans	-63.7	-29.6	173.4	0	0	0	0	0	113.5	A154 L156	A154-A158 WeakPolarHBondContact O-CB 3.14Å; A154-A158 PolarHBondContact O-N 3.41Å; L156-A158 PolarHBondContact O-N 2.85Å
159	S	60.3	Low	52.2	Low	86 Å²	86	107.2 Å²	107.2	60%	0.601	66%	0.661	S	S	*	*	H	α-helix	trans	-75.8	-32.7	178.1	82.2	0	0	0	0	113.6	E155 L156 T157	E155-S159 WeakPolarHBondContact O-CB 3.45Å; E155-S159 PolarHBondContact O-N 3.23Å; E155-S159 VanDerWaalsContact O-N 3.14Å; L156-S159 WeakPolarHBondContact O-CA 3.48Å; L156-S159 WeakPolarHBondContact O-CB 3.32Å; L156-S159 PolarHBondContact O-N 3.03Å; L156-S159 PolarHBondContact O-OG 3Å; T157-S159 VanDerWaalsContact C-N 3.27Å; T157-S159 PolarHBondContact O-N 2.85Å
160	H	59.3	Low	52	Low	151 Å²	151	109.2 Å²	109.2	70%	0.699	67%	0.67	S	S	*	*	H	α-helix	trans	-93.6	-43.2	-176.5	-85.1	-87.2	0	0	0	114	L156 T157	L156-H160 PolarHBondContact O-N 2.73Å; L156-H160 VanDerWaalsContact O-N 3.08Å; T157-H160 PolarHBondContact O-N 3.27Å
161	F	56.4	Low	51.2	Low	173 Å²	173	115 Å²	115	76%	0.759	67%	0.673	S	S	*	*	S	Bend	trans	-92.2	-0.9	-172.5	-83.8	-86.6	0	0	0	115.3	T157 G163	T157-F161 PolarHBondContact O-N 2.59Å; F161-G163 PolarHBondContact O-N 3.3Å
162	G	50.4	Low	50.5	Low	73 Å²	73	112.4 Å²	112.4	75%	0.753	66%	0.664	S	S	*	*	S	Bend	trans	69.9	-1.9	167.3	0	0	0	0	0	116.8
163	G	52.3	Low	49.7	Very low	76 Å²	76	113 Å²	113	78%	0.784	68%	0.678	S	S	*	*			trans	-104.3	70.2	177.3	0	0	0	0	0	113.1	F161	F161-G163 PolarHBondContact O-N 3.3Å
164	G	40	Very low	48.4	Very low	47 Å²	47	113 Å²	113	49%	0.485	69%	0.69	S	S	.	*			trans	-171.6	107.5	-180	0	0	0	0	0	113.1	G166	G164-G166 PolarHBondContact O-N 3.01Å
165	G	54	Low	47.2	Very low	98 Å²	98	112.7 Å²	112.7	100%	1.01	70%	0.695	S	S	*	*			trans	-85.1	60.7	-167.2	0	0	0	0	0	116.5
166	G	52.8	Low	46.1	Very low	54 Å²	54	117.5 Å²	117.5	56%	0.557	71%	0.709	S	S	*	*	S	Bend	trans	-100.6	-96.1	-178.6	0	0	0	0	0	115.9	G164 L168	G164-G166 PolarHBondContact O-N 3.01Å; G166-L168 PolarHBondContact O-N 2.68Å
167	L	48.9	Very low	44.9	Very low	129 Å²	129	122.9 Å²	122.9	68%	0.675	73%	0.733	S	S	*	*	S	Bend	trans	-76	-23.3	-156.6	-89.5	56.3	0	0	0	116.7	R169 L192	L167-R169 VanDerWaalsContact C-N 3.34Å; L167-R169 PolarHBondContact O-N 2.8Å; L167-R169 VanDerWaalsContact O-N 3.12Å; L167-L192 HydrophobicContact CD2-CD2 4.49Å
168	L	41.2	Very low	43.5	Very low	168 Å²	168	127.4 Å²	127.4	88%	0.88	75%	0.75	S	S	*	*			trans	-90.1	39.4	-168.4	-67.1	178.8	0	0	0	115.7	G166 K170	G166-L168 PolarHBondContact O-N 2.68Å; L168-K170 PolarHBondContact O-N 3.13Å; L168-K170 VanDerWaalsContact O-N 3.11Å
169	R	41.6	Very low	42.2	Very low	228 Å²	228	132 Å²	132	86%	0.86	77%	0.768	S	S	*	*			trans	-78	93.1	168.4	-94	-163.3	176.8	-142.4	6.4	112.2	L167 K171	L167-R169 VanDerWaalsContact C-N 3.34Å; L167-R169 PolarHBondContact O-N 2.8Å; L167-R169 VanDerWaalsContact O-N 3.12Å; R169-K171 PolarHBondContact O-N 2.66Å
170	K	40	Very low	41.1	Very low	203 Å²	203	136.1 Å²	136.1	88%	0.883	78%	0.778	S	S	*	*			trans	-63.8	76.5	165.8	-170.2	167.8	-172.7	161.2	0	112	L168 T172	L168-K170 PolarHBondContact O-N 3.13Å; L168-K170 VanDerWaalsContact O-N 3.11Å; K170-T172 PolarHBondContact O-N 3.49Å
171	K	33.8	Very low	40	Very low	198 Å²	198	138 Å²	138	86%	0.861	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-63.9	127.6	173.9	-150.2	178.6	-175.4	-175.4	0	108.3	R169	R169-K171 PolarHBondContact O-N 2.66Å
172	T	31.9	Very low	38.9	Very low	107 Å²	107	133.3 Å²	133.3	66%	0.656	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-79.9	139.6	-176	50.8	0	0	0	0	111.6	K170	K170-T172 PolarHBondContact O-N 3.49Å
173	S	34.2	Very low	38.2	Very low	125 Å²	125	133.8 Å²	133.8	87%	0.874	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-56.7	147.4	-177.2	45.4	0	0	0	0	115.5
174	G	30.2	Very low	37.7	Very low	74 Å²	74	138.1 Å²	138.1	76%	0.763	79%	0.792	S	S	*	*			trans	150.1	104.6	164.8	0	0	0	0	0	113.7
175	G	30	Very low	38.4	Very low	80 Å²	80	144.7 Å²	144.7	83%	0.825	81%	0.807	S	S	*	*			trans	133	119.7	174.2	0	0	0	0	0	112.4
176	Y	34.2	Very low	38.6	Very low	223 Å²	223	148.2 Å²	148.2	88%	0.875	80%	0.801	S	S	*	*			trans	-104.6	142.6	163.5	-83.8	-106.7	0	0	0	107.6
177	Q	32.2	Very low	39.2	Very low	191 Å²	191	149.7 Å²	149.7	89%	0.893	79%	0.792	S	S	*	*			trans	-159.8	139.7	135.2	-133.8	161.9	-24	0	0	109.3
178	E	32.2	Very low	40.6	Very low	145 Å²	145	145.7 Å²	145.7	68%	0.678	78%	0.775	S	S	*	*			trans	-68	166.3	159.5	-66.2	111.1	148.7	0	0	109.6
179	D	30.3	Very low	42.1	Very low	143 Å²	143	146.7 Å²	146.7	77%	0.765	77%	0.767	S	S	*	*			cis	-145	173.1	34.8	-83.9	-70	0	0	0	114.7
180	E	38.2	Very low	43.9	Very low	172 Å²	172	142 Å²	142	80%	0.804	76%	0.755	S	S	*	*			trans	23	118.8	153.8	-60.7	-176.7	157.7	0	0	118.6
181	Q	35.7	Very low	45.8	Very low	191 Å²	191	136.7 Å²	136.7	89%	0.893	73%	0.734	S	S	*	*	S	Bend	cis	-147.1	170.8	26.3	-60.4	178.6	-4.9	0	0	111.7
182	G	34	Very low	48	Very low	74 Å²	74	131.3 Å²	131.3	76%	0.763	71%	0.714	S	S	*	*			trans	83	47.3	167.2	0	0	0	0	0	116.1	Q184	G182-Q184 PolarHBondContact O-N 2.93Å
183	G	34.5	Very low	50.2	Low	83 Å²	83	128.9 Å²	128.9	86%	0.856	70%	0.696	S	S	*	*			trans	-69.5	69.7	-173.1	0	0	0	0	0	117.2	K185	G183-K185 PolarHBondContact O-N 2.77Å
184	Q	41.9	Very low	52.5	Low	167 Å²	167	127.6 Å²	127.6	78%	0.78	68%	0.676	S	S	*	*			trans	-68.1	113.4	159.3	-73.6	-162.2	11.1	0	0	110	G182 I186	G182-Q184 PolarHBondContact O-N 2.93Å; Q184-I186 PolarHBondContact O-N 3.16Å
185	K	54.1	Low	55.1	Low	185 Å²	185	126.9 Å²	126.9	80%	0.804	65%	0.653	S	S	*	*			trans	-58.9	136.3	165.9	-66.9	171.9	-176.7	167.8	0	108.4	G183 K187	G183-K185 PolarHBondContact O-N 2.77Å; K185-K187 PolarHBondContact O-N 3.2Å
186	I	58.5	Low	57.7	Low	173 Å²	173	126.9 Å²	126.9	89%	0.887	63%	0.634	S	S	*	*			trans	-60.9	106.7	173.5	-58.9	173.6	0	0	0	107.4	Q184 S188	Q184-I186 PolarHBondContact O-N 3.16Å; I186-S188 PolarHBondContact O-N 2.69Å
187	K	65.9	Low	60.1	Low	84 Å²	84	120.1 Å²	120.1	37%	0.365	61%	0.612	S	S	.	*			trans	-54	134.2	-172.5	-59.1	-174.7	-169.5	-176.8	0	110.3	K185 E191 E195	K185-K187 PolarHBondContact O-N 3.2Å; K187-E191 VanDerWaalsContact CA-OE2 3.3Å; K187-E191 WeakPolarHBondContact CA-OE2 3.3Å; K187-E191 HydrophobicContact CB-CB 4.02Å; K187-E195 WeakPolarHBondContact CD-OE2 3.24Å; K187-E195 WeakPolarHBondContact CE-OE2 3.34Å; K187-E195 IonicContact NZ-OE1 3.85Å; K187-E195 PolarHBondContact NZ-OE1 3.04Å; K187-E195 IonicContact NZ-OE2 3.63Å; K187-E195 PolarHBondContact NZ-OE2 3.48Å
188	S	77.2	Confident	62.6	Low	45 Å²	45	117.4 Å²	117.4	32%	0.315	60%	0.599	S	S	.	*			trans	-63.5	161.1	177.2	78.1	0	0	0	0	110.8	I186 Q190 E191 L192	I186-S188 PolarHBondContact O-N 2.69Å; S188-Q190 PolarHBondContact O-N 2.98Å; S188-Q190 VanDerWaalsContact O-N 3.1Å; S188-Q190 PolarHBondContact OG-N 3.15Å; S188-E191 WeakPolarHBondContact CB-OE1 3.26Å; S188-E191 VanDerWaalsContact N-CD 3.34Å; S188-E191 PolarHBondContact N-OE2 3.44Å; S188-E191 PolarHBondContact O-N 3.35Å; S188-E191 VanDerWaalsContact O-N 3.14Å; S188-E191 PolarHBondContact OG-N 2.94Å; S188-E191 PolarHBondContact OG-OE1 3.16Å; S188-L192 WeakPolarHBondContact O-CB 3.37Å; S188-L192 PolarHBondContact O-N 3.13Å
189	R	73.8	Confident	65.1	Low	190 Å²	190	116.5 Å²	116.5	72%	0.717	59%	0.593	S	S	*	*	H	α-helix	trans	-58.2	-26.8	175.5	-178	177.1	179.8	-82.1	-1.1	111.8	I193	R189-I193 HydrophobicContact CG-CD1 3.92Å; R189-I193 VanDerWaalsContact CZ-CD1 3.46Å; R189-I193 WeakPolarHBondContact O-CB 3.22Å; R189-I193 WeakPolarHBondContact O-CD1 3.46Å; R189-I193 WeakPolarHBondContact O-CG1 3.16Å; R189-I193 PolarHBondContact O-N 3.22Å
190	Q	79.3	Confident	67.7	Low	130 Å²	130	112.1 Å²	112.1	61%	0.607	57%	0.573	S	S	*	*	H	α-helix	trans	-72.9	-52.8	174.6	178.7	168.6	-11.6	0	0	110.5	S188 L192 I193 E194	S188-Q190 PolarHBondContact O-N 2.98Å; S188-Q190 VanDerWaalsContact O-N 3.1Å; S188-Q190 PolarHBondContact OG-N 3.15Å; Q190-L192 VanDerWaalsContact C-N 3.28Å; Q190-L192 PolarHBondContact O-N 3.34Å; Q190-I193 CarbonylContact O-C 3.57Å; Q190-I193 PolarHBondContact O-N 2.83Å; Q190-E194 HydrophobicContact CG-CG 4.32Å; Q190-E194 WeakPolarHBondContact CG-OE1 3.31Å; Q190-E194 PolarHBondContact NE2-OE1 3.25Å; Q190-E194 WeakPolarHBondContact O-CB 3.42Å; Q190-E194 WeakPolarHBondContact O-CG 3.03Å; Q190-E194 PolarHBondContact O-N 2.99Å
191	E	80.6	Confident	70.1	Confident	91 Å²	91	110.9 Å²	110.9	43%	0.425	57%	0.566	S	S	.	*	H	α-helix	trans	-56.4	-39.3	176.4	-70.6	139.9	-124.1	0	0	112.8	K187 S188 E194 E195	K187-E191 VanDerWaalsContact CA-OE2 3.3Å; K187-E191 WeakPolarHBondContact CA-OE2 3.3Å; K187-E191 HydrophobicContact CB-CB 4.02Å; S188-E191 WeakPolarHBondContact CB-OE1 3.26Å; S188-E191 VanDerWaalsContact N-CD 3.34Å; S188-E191 PolarHBondContact N-OE2 3.44Å; S188-E191 PolarHBondContact O-N 3.35Å; S188-E191 VanDerWaalsContact O-N 3.14Å; S188-E191 PolarHBondContact OG-N 2.94Å; S188-E191 PolarHBondContact OG-OE1 3.16Å; E191-E194 PolarHBondContact O-N 2.9Å; E191-E195 VanDerWaalsContact O-CB 3.27Å; E191-E195 WeakPolarHBondContact O-CB 3.23Å; E191-E195 PolarHBondContact O-N 3.21Å
192	L	79.4	Confident	72.3	Confident	84 Å²	84	106.5 Å²	106.5	44%	0.44	55%	0.545	S	S	.	.	H	α-helix	trans	-66.6	-36.1	176.7	-163.9	87.1	0	0	0	112.2	L167 S188 Q190 L196	L167-L192 HydrophobicContact CD2-CD2 4.49Å; S188-L192 WeakPolarHBondContact O-CB 3.37Å; S188-L192 PolarHBondContact O-N 3.13Å; Q190-L192 VanDerWaalsContact C-N 3.28Å; Q190-L192 PolarHBondContact O-N 3.34Å; L192-L196 WeakPolarHBondContact O-CB 3.33Å; L192-L196 PolarHBondContact O-N 3.01Å
193	I	77.1	Confident	74.7	Confident	57 Å²	57	107 Å²	107	29%	0.292	53%	0.528	S	S	.	.	H	α-helix	trans	-76.1	-36.6	176.6	-73.9	171.4	0	0	0	110.7	R189 Q190 L196 I197	R189-I193 HydrophobicContact CG-CD1 3.92Å; R189-I193 VanDerWaalsContact CZ-CD1 3.46Å; R189-I193 WeakPolarHBondContact O-CB 3.22Å; R189-I193 WeakPolarHBondContact O-CD1 3.46Å; R189-I193 WeakPolarHBondContact O-CG1 3.16Å; R189-I193 PolarHBondContact O-N 3.22Å; Q190-I193 CarbonylContact O-C 3.57Å; Q190-I193 PolarHBondContact O-N 2.83Å; I193-L196 PolarHBondContact O-N 3.33Å; I193-I197 HydrophobicContact CG2-CD1 3.65Å; I193-I197 HydrophobicContact CG2-CG1 4.35Å; I193-I197 VanDerWaalsContact O-CB 3.29Å; I193-I197 WeakPolarHBondContact O-CB 3.43Å; I193-I197 WeakPolarHBondContact O-CD1 3.42Å; I193-I197 WeakPolarHBondContact O-CG1 3.47Å; I193-I197 PolarHBondContact O-N 3.25Å
194	E	84.3	Confident	77.1	Confident	98 Å²	98	110.6 Å²	110.6	46%	0.458	52%	0.52	S	S	.	.	H	α-helix	trans	-67	-40.7	174.6	-73.1	167.2	176.9	0	0	110.9	Q190 E191 I197 Q198	Q190-E194 HydrophobicContact CG-CG 4.32Å; Q190-E194 WeakPolarHBondContact CG-OE1 3.31Å; Q190-E194 PolarHBondContact NE2-OE1 3.25Å; Q190-E194 WeakPolarHBondContact O-CB 3.42Å; Q190-E194 WeakPolarHBondContact O-CG 3.03Å; Q190-E194 PolarHBondContact O-N 2.99Å; E191-E194 PolarHBondContact O-N 2.9Å; E194-I197 PolarHBondContact O-N 3.26Å; E194-Q198 WeakPolarHBondContact O-CB 3.38Å; E194-Q198 PolarHBondContact O-N 2.92Å
195	E	84.4	Confident	79.1	Confident	58 Å²	58	111 Å²	111	27%	0.271	51%	0.514	S	S	.	.	H	α-helix	trans	-63.7	-43.7	171.2	178.3	173.2	-153.5	0	0	112.3	K187 E191 Q198 K199	K187-E195 WeakPolarHBondContact CD-OE2 3.24Å; K187-E195 WeakPolarHBondContact CE-OE2 3.34Å; K187-E195 IonicContact NZ-OE1 3.85Å; K187-E195 PolarHBondContact NZ-OE1 3.04Å; K187-E195 IonicContact NZ-OE2 3.63Å; K187-E195 PolarHBondContact NZ-OE2 3.48Å; E191-E195 VanDerWaalsContact O-CB 3.27Å; E191-E195 WeakPolarHBondContact O-CB 3.23Å; E191-E195 PolarHBondContact O-N 3.21Å; E195-Q198 PolarHBondContact O-N 2.7Å; E195-K199 WeakPolarHBondContact O-CG 3.43Å; E195-K199 PolarHBondContact O-N 3.27Å
196	L	83.2	Confident	80.3	Confident	80 Å²	80	106.5 Å²	106.5	42%	0.419	50%	0.496	S	S	.	.	H	α-helix	trans	-62.5	-46.9	175.5	-172.7	73	0	0	0	111.2	L192 I193 Q198 K199 S200	L192-L196 WeakPolarHBondContact O-CB 3.33Å; L192-L196 PolarHBondContact O-N 3.01Å; I193-L196 PolarHBondContact O-N 3.33Å; L196-Q198 VanDerWaalsContact C-N 3.3Å; L196-Q198 PolarHBondContact O-N 2.78Å; L196-K199 PolarHBondContact O-N 2.74Å; L196-S200 PolarHBondContact O-N 3.41Å; L196-S200 PolarHBondContact O-OG 3.49Å
197	I	84.5	Confident	81.6	Confident	82 Å²	82	105 Å²	105	42%	0.421	48%	0.479	S	S	.	.	H	α-helix	trans	-63	-37.5	176	-71.5	167.6	0	0	0	111	I193 E194 K201	I193-I197 HydrophobicContact CG2-CD1 3.65Å; I193-I197 HydrophobicContact CG2-CG1 4.35Å; I193-I197 VanDerWaalsContact O-CB 3.29Å; I193-I197 WeakPolarHBondContact O-CB 3.43Å; I193-I197 WeakPolarHBondContact O-CD1 3.42Å; I193-I197 WeakPolarHBondContact O-CG1 3.47Å; I193-I197 PolarHBondContact O-N 3.25Å; E194-I197 PolarHBondContact O-N 3.26Å; I197-K201 HydrophobicContact CG2-CD 3.98Å; I197-K201 HydrophobicContact CG2-CG 4.39Å; I197-K201 VanDerWaalsContact O-CB 3.24Å; I197-K201 WeakPolarHBondContact O-CB 3.42Å; I197-K201 WeakPolarHBondContact O-CG 3.36Å; I197-K201 PolarHBondContact O-N 3.33Å
198	Q	86.4	Confident	82.6	Confident	134 Å²	134	106.4 Å²	106.4	63%	0.626	49%	0.487	S	S	*	.	H	α-helix	trans	-66.5	-46.2	176.9	-176.1	170.6	-8.2	0	0	111	E194 E195 L196 K201 Q202	E194-Q198 WeakPolarHBondContact O-CB 3.38Å; E194-Q198 PolarHBondContact O-N 2.92Å; E195-Q198 PolarHBondContact O-N 2.7Å; L196-Q198 VanDerWaalsContact C-N 3.3Å; L196-Q198 PolarHBondContact O-N 2.78Å; Q198-K201 PolarHBondContact O-N 3.39Å; Q198-Q202 WeakPolarHBondContact O-CB 3.25Å; Q198-Q202 PolarHBondContact O-N 3.35Å
199	K	83.3	Confident	83.1	Confident	126 Å²	126	106.8 Å²	106.8	55%	0.548	49%	0.487	S	S	.	.	H	α-helix	trans	-60.4	-51.8	174.2	-74.5	-177.1	176.4	-174	0	111.9	E195 L196 K201 Q202 E203	E195-K199 WeakPolarHBondContact O-CG 3.43Å; E195-K199 PolarHBondContact O-N 3.27Å; L196-K199 PolarHBondContact O-N 2.74Å; K199-K201 PolarHBondContact O-N 2.67Å; K199-Q202 WeakPolarHBondContact O-CB 3.16Å; K199-Q202 PolarHBondContact O-N 3Å; K199-E203 WeakPolarHBondContact O-CB 3.5Å; K199-E203 PolarHBondContact O-N 3.31Å
200	S	85.5	Confident	83.5	Confident	50 Å²	50	103.4 Å²	103.4	35%	0.35	48%	0.479	S	S	.	.	H	α-helix	trans	-67	-20.2	178.7	-58.3	0	0	0	0	114.1	L196 K204	L196-S200 PolarHBondContact O-N 3.41Å; L196-S200 PolarHBondContact O-OG 3.49Å; S200-K204 WeakPolarHBondContact O-CB 3.43Å; S200-K204 VanDerWaalsContact O-CG 3.24Å; S200-K204 WeakPolarHBondContact O-CG 3.02Å; S200-K204 PolarHBondContact O-N 2.84Å
201	K	87.6	Confident	84	Confident	147 Å²	147	103.7 Å²	103.7	64%	0.639	48%	0.478	S	S	*	.	H	α-helix	trans	-82.2	-33.3	169.3	-79.4	-179.9	-178.6	-175	0	112.9	I197 Q198 K199 R205	I197-K201 HydrophobicContact CG2-CD 3.98Å; I197-K201 HydrophobicContact CG2-CG 4.39Å; I197-K201 VanDerWaalsContact O-CB 3.24Å; I197-K201 WeakPolarHBondContact O-CB 3.42Å; I197-K201 WeakPolarHBondContact O-CG 3.36Å; I197-K201 PolarHBondContact O-N 3.33Å; Q198-K201 PolarHBondContact O-N 3.39Å; K199-K201 PolarHBondContact O-N 2.67Å; K201-R205 PolarHBondContact O-N 3.42Å
202	Q	82.1	Confident	84.3	Confident	99 Å²	99	103.5 Å²	103.5	46%	0.463	48%	0.478	S	S	.	.	H	α-helix	trans	-67.5	-54	174	172.9	170.1	-8.2	0	0	109.7	Q198 K199 K204 R205 E206	Q198-Q202 WeakPolarHBondContact O-CB 3.25Å; Q198-Q202 PolarHBondContact O-N 3.35Å; K199-Q202 WeakPolarHBondContact O-CB 3.16Å; K199-Q202 PolarHBondContact O-N 3Å; Q202-K204 VanDerWaalsContact C-N 3.3Å; Q202-K204 PolarHBondContact O-N 3.19Å; Q202-R205 CarbonylContact O-C 3.57Å; Q202-R205 WeakPolarHBondContact O-CA 3.16Å; Q202-R205 WeakPolarHBondContact O-CB 3.35Å; Q202-R205 PolarHBondContact O-N 3.37Å; Q202-E206 VanDerWaalsContact CG-CD 3.48Å; Q202-E206 HydrophobicContact CG-CG 4.36Å; Q202-E206 WeakPolarHBondContact CG-OE1 3.3Å; Q202-E206 PolarHBondContact NE2-OE1 3.18Å; Q202-E206 WeakPolarHBondContact O-CG 3.19Å; Q202-E206 PolarHBondContact O-N 3.05Å
203	E	84.4	Confident	84.7	Confident	85 Å²	85	104.7 Å²	104.7	40%	0.397	48%	0.481	S	S	.	.	H	α-helix	trans	-56.2	-41.2	177.5	-172.2	-168.6	172.1	0	0	112.3	K199 R205 E206 R207	K199-E203 WeakPolarHBondContact O-CB 3.5Å; K199-E203 PolarHBondContact O-N 3.31Å; E203-R205 VanDerWaalsContact C-N 3.33Å; E203-R205 PolarHBondContact O-N 2.82Å; E203-E206 PolarHBondContact O-N 2.89Å; E203-R207 VanDerWaalsContact O-CG 3.31Å; E203-R207 WeakPolarHBondContact O-CG 3.23Å; E203-R207 PolarHBondContact O-N 3.32Å; E203-R207 IonicContact OE1-CZ 3.28Å; E203-R207 IonicContact OE1-NE 3.74Å; E203-R207 PolarHBondContact OE1-NE 3.38Å; E203-R207 IonicContact OE1-NH2 2.65Å; E203-R207 PolarHBondContact OE1-NH2 3.4Å
204	K	85.7	Confident	85.1	Confident	158 Å²	158	104.3 Å²	104.3	69%	0.687	49%	0.487	S	S	*	.	H	α-helix	trans	-65	-34	173.7	-82	-173.5	174.6	-159.6	0	113.4	S200 Q202 Q208	S200-K204 WeakPolarHBondContact O-CB 3.43Å; S200-K204 VanDerWaalsContact O-CG 3.24Å; S200-K204 WeakPolarHBondContact O-CG 3.02Å; S200-K204 PolarHBondContact O-N 2.84Å; Q202-K204 VanDerWaalsContact C-N 3.3Å; Q202-K204 PolarHBondContact O-N 3.19Å; K204-Q208 WeakPolarHBondContact O-CB 3.37Å; K204-Q208 PolarHBondContact O-N 2.95Å; K204-Q208 VanDerWaalsContact O-N 3.14Å
205	R	83.7	Confident	85.2	Confident	176 Å²	176	104.4 Å²	104.4	66%	0.664	49%	0.487	S	S	*	.	H	α-helix	trans	-74.1	-40.6	175.2	-163.4	-159.4	-55.3	-174.1	2.7	111	K201 Q202 E203 Q208 V209	K201-R205 PolarHBondContact O-N 3.42Å; Q202-R205 CarbonylContact O-C 3.57Å; Q202-R205 WeakPolarHBondContact O-CA 3.16Å; Q202-R205 WeakPolarHBondContact O-CB 3.35Å; Q202-R205 PolarHBondContact O-N 3.37Å; E203-R205 VanDerWaalsContact C-N 3.33Å; E203-R205 PolarHBondContact O-N 2.82Å; R205-Q208 PolarHBondContact O-N 3.46Å; R205-Q208 VanDerWaalsContact O-N 3.12Å; R205-V209 HydrophobicContact CG-CG2 4.39Å; R205-V209 WeakPolarHBondContact O-CB 3.34Å; R205-V209 WeakPolarHBondContact O-CG2 3.38Å; R205-V209 PolarHBondContact O-N 3.37Å
206	E	80.1	Confident	85.5	Confident	90 Å²	90	106.7 Å²	106.7	42%	0.421	50%	0.498	S	S	.	.	H	α-helix	trans	-61.4	-44.7	177	-71.9	160.8	170.3	0	0	110.6	Q202 E203 Q208 V209 Q210	Q202-E206 VanDerWaalsContact CG-CD 3.48Å; Q202-E206 HydrophobicContact CG-CG 4.36Å; Q202-E206 WeakPolarHBondContact CG-OE1 3.3Å; Q202-E206 PolarHBondContact NE2-OE1 3.18Å; Q202-E206 WeakPolarHBondContact O-CG 3.19Å; Q202-E206 PolarHBondContact O-N 3.05Å; E203-E206 PolarHBondContact O-N 2.89Å; E206-Q208 VanDerWaalsContact C-N 3.33Å; E206-Q208 PolarHBondContact O-N 3.32Å; E206-V209 PolarHBondContact O-N 2.84Å; E206-Q210 WeakPolarHBondContact O-CB 3.13Å; E206-Q210 VanDerWaalsContact O-CG 3.25Å; E206-Q210 WeakPolarHBondContact O-CG 3.49Å; E206-Q210 PolarHBondContact O-N 2.88Å
207	R	85.6	Confident	85.7	Confident	142 Å²	142	107.9 Å²	107.9	54%	0.536	50%	0.504	S	S	.	.	H	α-helix	trans	-63	-33.6	171.4	-67.8	175.7	-170.8	-142.2	6.4	113.8	E203 K211	E203-R207 VanDerWaalsContact O-CG 3.31Å; E203-R207 WeakPolarHBondContact O-CG 3.23Å; E203-R207 PolarHBondContact O-N 3.32Å; E203-R207 IonicContact OE1-CZ 3.28Å; E203-R207 IonicContact OE1-NE 3.74Å; E203-R207 PolarHBondContact OE1-NE 3.38Å; E203-R207 IonicContact OE1-NH2 2.65Å; E203-R207 PolarHBondContact OE1-NH2 3.4Å; R207-K211 PolarHBondContact O-N 3.25Å
208	Q	85.8	Confident	85.6	Confident	112 Å²	112	108.1 Å²	108.1	52%	0.523	51%	0.509	S	S	.	.	H	α-helix	trans	-70.8	-46.8	175.7	178.8	175.6	-12.9	0	0	110.9	K204 R205 E206 Q210 K211 E212	K204-Q208 WeakPolarHBondContact O-CB 3.37Å; K204-Q208 PolarHBondContact O-N 2.95Å; K204-Q208 VanDerWaalsContact O-N 3.14Å; R205-Q208 PolarHBondContact O-N 3.46Å; R205-Q208 VanDerWaalsContact O-N 3.12Å; E206-Q208 VanDerWaalsContact C-N 3.33Å; E206-Q208 PolarHBondContact O-N 3.32Å; Q208-Q210 PolarHBondContact O-N 3.35Å; Q208-K211 CarbonylContact O-C 3.59Å; Q208-K211 WeakPolarHBondContact O-CA 3.47Å; Q208-K211 PolarHBondContact O-N 3.01Å; Q208-E212 HydrophobicContact CG-CG 4.42Å; Q208-E212 WeakPolarHBondContact CG-OE1 3.42Å; Q208-E212 PolarHBondContact NE2-OE1 2.84Å; Q208-E212 WeakPolarHBondContact O-CG 3.18Å; Q208-E212 PolarHBondContact O-N 2.92Å
209	V	87.6	Confident	85.8	Confident	53 Å²	53	107.5 Å²	107.5	32%	0.321	51%	0.506	S	S	.	.	H	α-helix	trans	-60.5	-44.1	176.4	169.3	0	0	0	0	110.5	R205 E206 K211 E212 E213	R205-V209 HydrophobicContact CG-CG2 4.39Å; R205-V209 WeakPolarHBondContact O-CB 3.34Å; R205-V209 WeakPolarHBondContact O-CG2 3.38Å; R205-V209 PolarHBondContact O-N 3.37Å; E206-V209 PolarHBondContact O-N 2.84Å; V209-K211 PolarHBondContact O-N 2.88Å; V209-E212 CarbonylContact O-C 3.53Å; V209-E212 PolarHBondContact O-N 3.25Å; V209-E212 VanDerWaalsContact O-N 3.11Å; V209-E213 HydrophobicContact CG1-CG 4.1Å; V209-E213 WeakPolarHBondContact CG1-OE1 3.2Å; V209-E213 WeakPolarHBondContact O-CB 3.43Å; V209-E213 VanDerWaalsContact O-CG 3.29Å; V209-E213 WeakPolarHBondContact O-CG 3.42Å; V209-E213 PolarHBondContact O-N 3.2Å
210	Q	83.3	Confident	86.1	Confident	120 Å²	120	105.8 Å²	105.8	56%	0.561	50%	0.499	S	S	*	.	H	α-helix	trans	-58.9	-34.5	173.9	-74.9	169.4	-18.3	0	0	112.9	E206 Q208 A214	E206-Q210 WeakPolarHBondContact O-CB 3.13Å; E206-Q210 VanDerWaalsContact O-CG 3.25Å; E206-Q210 WeakPolarHBondContact O-CG 3.49Å; E206-Q210 PolarHBondContact O-N 2.88Å; Q208-Q210 PolarHBondContact O-N 3.35Å; Q210-A214 VanDerWaalsContact O-CB 3.24Å; Q210-A214 WeakPolarHBondContact O-CB 3.3Å; Q210-A214 PolarHBondContact O-N 3.27Å
211	K	90.2	Very high	86.2	Confident	135 Å²	135	109 Å²	109	59%	0.587	51%	0.511	S	S	*	.	H	α-helix	trans	-74.8	-38.1	174.5	-175.1	165	-177.3	164.9	0	112.2	R207 Q208 V209 A214 Q215	R207-K211 PolarHBondContact O-N 3.25Å; Q208-K211 CarbonylContact O-C 3.59Å; Q208-K211 WeakPolarHBondContact O-CA 3.47Å; Q208-K211 PolarHBondContact O-N 3.01Å; V209-K211 PolarHBondContact O-N 2.88Å; K211-A214 PolarHBondContact O-N 3.11Å; K211-Q215 WeakPolarHBondContact O-CB 3.39Å; K211-Q215 VanDerWaalsContact O-CG 3.27Å; K211-Q215 WeakPolarHBondContact O-CG 3.35Å; K211-Q215 PolarHBondContact O-N 2.89Å
212	E	86.9	Confident	86.1	Confident	88 Å²	88	105.7 Å²	105.7	41%	0.411	50%	0.501	S	S	.	.	H	α-helix	trans	-66.7	-42.2	175.1	-71.5	166.5	178	0	0	111	Q208 V209 Q215 E216	Q208-E212 HydrophobicContact CG-CG 4.42Å; Q208-E212 WeakPolarHBondContact CG-OE1 3.42Å; Q208-E212 PolarHBondContact NE2-OE1 2.84Å; Q208-E212 WeakPolarHBondContact O-CG 3.18Å; Q208-E212 PolarHBondContact O-N 2.92Å; V209-E212 CarbonylContact O-C 3.53Å; V209-E212 PolarHBondContact O-N 3.25Å; V209-E212 VanDerWaalsContact O-N 3.11Å; E212-Q215 PolarHBondContact O-N 3.45Å; E212-E216 WeakPolarHBondContact O-CB 3.41Å; E212-E216 PolarHBondContact O-N 2.93Å
213	E	87.4	Confident	86.3	Confident	108 Å²	108	106.7 Å²	106.7	51%	0.505	51%	0.505	S	S	.	.	H	α-helix	trans	-62.4	-44.5	172.5	-72.8	171	163.8	0	0	111.8	V209 E216 L217	V209-E213 HydrophobicContact CG1-CG 4.1Å; V209-E213 WeakPolarHBondContact CG1-OE1 3.2Å; V209-E213 WeakPolarHBondContact O-CB 3.43Å; V209-E213 VanDerWaalsContact O-CG 3.29Å; V209-E213 WeakPolarHBondContact O-CG 3.42Å; V209-E213 PolarHBondContact O-N 3.2Å; E213-E216 PolarHBondContact O-N 3.24Å; E213-L217 WeakPolarHBondContact O-CB 3.48Å; E213-L217 VanDerWaalsContact O-CG 3.28Å; E213-L217 WeakPolarHBondContact O-CG 3.44Å; E213-L217 PolarHBondContact O-N 3.48Å
214	A	85.6	Confident	86.4	Confident	50 Å²	50	106.9 Å²	106.9	41%	0.413	51%	0.509	S	S	.	.	H	α-helix	trans	-64.1	-41.2	174.7	0	0	0	0	0	112.1	Q210 K211 L217 T218	Q210-A214 VanDerWaalsContact O-CB 3.24Å; Q210-A214 WeakPolarHBondContact O-CB 3.3Å; Q210-A214 PolarHBondContact O-N 3.27Å; K211-A214 PolarHBondContact O-N 3.11Å; A214-L217 PolarHBondContact O-N 3.45Å; A214-T218 PolarHBondContact O-N 2.85Å; A214-T218 PolarHBondContact O-OG1 3.39Å
215	Q	86.2	Confident	86.2	Confident	100 Å²	100	106.1 Å²	106.1	47%	0.467	50%	0.502	S	S	.	.	H	α-helix	trans	-65.1	-47	175.8	-77.2	-178.8	-44.9	0	0	111.3	K211 E212 L217 T218 E219	K211-Q215 WeakPolarHBondContact O-CB 3.39Å; K211-Q215 VanDerWaalsContact O-CG 3.27Å; K211-Q215 WeakPolarHBondContact O-CG 3.35Å; K211-Q215 PolarHBondContact O-N 2.89Å; E212-Q215 PolarHBondContact O-N 3.45Å; Q215-L217 VanDerWaalsContact C-N 3.29Å; Q215-L217 PolarHBondContact O-N 3.11Å; Q215-T218 WeakPolarHBondContact CA-OG1 3.4Å; Q215-T218 PolarHBondContact O-N 3.29Å; Q215-T218 VanDerWaalsContact O-N 3.16Å; Q215-T218 PolarHBondContact O-OG1 3.5Å; Q215-E219 PolarHBondContact O-N 3.29Å
216	E	89.8	Confident	86.1	Confident	106 Å²	106	102.8 Å²	102.8	50%	0.495	49%	0.492	S	S	.	.	H	α-helix	trans	-56.4	-40.6	172	-87.1	-163.1	-153.2	0	0	112.5	E212 E213 E219 K220	E212-E216 WeakPolarHBondContact O-CB 3.41Å; E212-E216 PolarHBondContact O-N 2.93Å; E213-E216 PolarHBondContact O-N 3.24Å; E216-E219 PolarHBondContact O-N 3.12Å; E216-K220 WeakPolarHBondContact O-CB 3.35Å; E216-K220 WeakPolarHBondContact O-CD 3.42Å; E216-K220 WeakPolarHBondContact O-CE 3.26Å; E216-K220 WeakPolarHBondContact O-CG 3.09Å; E216-K220 PolarHBondContact O-N 2.95Å; E216-K220 WeakPolarHBondContact OE2-CE 3.38Å; E216-K220 IonicContact OE2-NZ 2.79Å; E216-K220 PolarHBondContact OE2-NZ 3.01Å
217	L	87.2	Confident	86.2	Confident	105 Å²	105	101.2 Å²	101.2	55%	0.55	49%	0.492	S	S	.	.	H	α-helix	trans	-66.3	-42.8	176.2	-76.6	168.6	0	0	0	111.8	E213 A214 Q215 K220 L221	E213-L217 WeakPolarHBondContact O-CB 3.48Å; E213-L217 VanDerWaalsContact O-CG 3.28Å; E213-L217 WeakPolarHBondContact O-CG 3.44Å; E213-L217 PolarHBondContact O-N 3.48Å; A214-L217 PolarHBondContact O-N 3.45Å; Q215-L217 VanDerWaalsContact C-N 3.29Å; Q215-L217 PolarHBondContact O-N 3.11Å; L217-K220 PolarHBondContact O-N 2.77Å; L217-L221 WeakPolarHBondContact O-CB 3.26Å; L217-L221 WeakPolarHBondContact O-CG 3.44Å; L217-L221 PolarHBondContact O-N 2.89Å
218	T	84.1	Confident	85.7	Confident	86 Å²	86	98.2 Å²	98.2	53%	0.528	49%	0.485	S	S	.	.	H	α-helix	trans	-63.2	-43.1	173.1	55.1	0	0	0	0	111.9	A214 Q215 K220 L221 D222	A214-T218 PolarHBondContact O-N 2.85Å; A214-T218 PolarHBondContact O-OG1 3.39Å; Q215-T218 WeakPolarHBondContact CA-OG1 3.4Å; Q215-T218 PolarHBondContact O-N 3.29Å; Q215-T218 VanDerWaalsContact O-N 3.16Å; Q215-T218 PolarHBondContact O-OG1 3.5Å; T218-K220 VanDerWaalsContact C-N 3.32Å; T218-K220 PolarHBondContact O-N 3.29Å; T218-L221 PolarHBondContact O-N 2.99Å; T218-D222 WeakPolarHBondContact O-CB 3.34Å; T218-D222 PolarHBondContact O-N 2.88Å
219	E	89.8	Confident	85.1	Confident	121 Å²	121	97.6 Å²	97.6	57%	0.565	48%	0.483	S	S	*	.	H	α-helix	trans	-64.7	-33.6	176.7	-74.5	-172.9	-173.9	0	0	112.9	Q215 E216 Q223	Q215-E219 PolarHBondContact O-N 3.29Å; E216-E219 PolarHBondContact O-N 3.12Å; E219-Q223 WeakPolarHBondContact O-CB 3.21Å; E219-Q223 WeakPolarHBondContact O-CG 3.18Å; E219-Q223 PolarHBondContact O-N 3.43Å; E219-Q223 PolarHBondContact O-NE2 3.37Å
220	K	89.8	Confident	84.3	Confident	90 Å²	90	98.1 Å²	98.1	39%	0.391	49%	0.492	S	S	.	.	H	α-helix	trans	-68.1	-51	173.6	-72.1	157.7	-162.3	167.1	0	110.7	E216 L217 T218 D222 Q223 D224	E216-K220 WeakPolarHBondContact O-CB 3.35Å; E216-K220 WeakPolarHBondContact O-CD 3.42Å; E216-K220 WeakPolarHBondContact O-CE 3.26Å; E216-K220 WeakPolarHBondContact O-CG 3.09Å; E216-K220 PolarHBondContact O-N 2.95Å; E216-K220 WeakPolarHBondContact OE2-CE 3.38Å; E216-K220 IonicContact OE2-NZ 2.79Å; E216-K220 PolarHBondContact OE2-NZ 3.01Å; L217-K220 PolarHBondContact O-N 2.77Å; T218-K220 VanDerWaalsContact C-N 3.32Å; T218-K220 PolarHBondContact O-N 3.29Å; K220-D222 PolarHBondContact O-N 3.27Å; K220-Q223 WeakPolarHBondContact O-CB 3.49Å; K220-Q223 PolarHBondContact O-N 2.99Å; K220-Q223 VanDerWaalsContact O-N 3.08Å; K220-D224 WeakPolarHBondContact O-CB 3.37Å; K220-D224 VanDerWaalsContact O-CG 3.3Å; K220-D224 PolarHBondContact O-N 3.37Å
221	L	86.6	Confident	83.6	Confident	117 Å²	117	98.8 Å²	98.8	61%	0.613	50%	0.499	S	S	*	.	H	α-helix	trans	-57.4	-38.2	175.2	-71.1	170.6	0	0	0	112.3	L217 T218 W225	L217-L221 WeakPolarHBondContact O-CB 3.26Å; L217-L221 WeakPolarHBondContact O-CG 3.44Å; L217-L221 PolarHBondContact O-N 2.89Å; T218-L221 PolarHBondContact O-N 2.99Å; L221-W225 WeakPolarHBondContact O-CB 3.45Å; L221-W225 PolarHBondContact O-N 3.03Å
222	D	86.4	Confident	82.1	Confident	79 Å²	79	98.8 Å²	98.8	42%	0.422	50%	0.503	S	S	.	.	H	α-helix	trans	-76.6	-24.1	179.8	-154.9	40.4	0	0	0	112.5	T218 K220 K226	T218-D222 WeakPolarHBondContact O-CB 3.34Å; T218-D222 PolarHBondContact O-N 2.88Å; K220-D222 PolarHBondContact O-N 3.27Å; D222-K226 WeakPolarHBondContact O-CB 3.28Å; D222-K226 WeakPolarHBondContact O-CD 3.34Å; D222-K226 VanDerWaalsContact O-CE 3.26Å; D222-K226 WeakPolarHBondContact O-CE 3.48Å; D222-K226 WeakPolarHBondContact O-CG 3.43Å; D222-K226 PolarHBondContact O-N 3.31Å; D222-K226 PolarHBondContact O-NZ 2.96Å; D222-K226 IonicContact OD1-NZ 2.67Å; D222-K226 WeakPolarHBondContact OD2-CE 3.29Å; D222-K226 IonicContact OD2-NZ 3.84Å; D222-K226 PolarHBondContact OD2-NZ 3.13Å
223	Q	87.3	Confident	80.6	Confident	119 Å²	119	100.1 Å²	100.1	56%	0.556	52%	0.517	S	S	*	.	H	α-helix	trans	-77.7	-45.5	168.6	-79.2	167.6	77.9	0	0	111.7	E219 K220 K226 S227	E219-Q223 WeakPolarHBondContact O-CB 3.21Å; E219-Q223 WeakPolarHBondContact O-CG 3.18Å; E219-Q223 PolarHBondContact O-N 3.43Å; E219-Q223 PolarHBondContact O-NE2 3.37Å; K220-Q223 WeakPolarHBondContact O-CB 3.49Å; K220-Q223 PolarHBondContact O-N 2.99Å; K220-Q223 VanDerWaalsContact O-N 3.08Å; Q223-K226 PolarHBondContact O-N 3.03Å; Q223-S227 PolarHBondContact O-N 3.31Å
224	D	85.5	Confident	79	Confident	90 Å²	90	103.5 Å²	103.5	48%	0.481	53%	0.53	S	S	.	.	H	α-helix	trans	-61.3	-45.4	176.3	-69.4	-26.6	0	0	0	110	K220 K226 S227 I228	K220-D224 WeakPolarHBondContact O-CB 3.37Å; K220-D224 VanDerWaalsContact O-CG 3.3Å; K220-D224 PolarHBondContact O-N 3.37Å; D224-K226 PolarHBondContact O-N 2.79Å; D224-S227 WeakPolarHBondContact O-CA 3.39Å; D224-S227 WeakPolarHBondContact O-CB 3.42Å; D224-S227 PolarHBondContact O-N 2.82Å; D224-S227 VanDerWaalsContact O-N 3.08Å; D224-S227 PolarHBondContact O-OG 2.86Å; D224-I228 VanDerWaalsContact O-CG1 3.31Å; D224-I228 WeakPolarHBondContact O-CG1 3.15Å; D224-I228 PolarHBondContact O-N 2.59Å
225	W	81.6	Confident	77.1	Confident	142 Å²	142	110.3 Å²	110.3	54%	0.538	55%	0.55	S	S	.	.	H	α-helix	trans	-59.3	-43.8	173.4	-179.7	-116.3	0	0	0	112.6	L221 S227 I228 Q229	L221-W225 WeakPolarHBondContact O-CB 3.45Å; L221-W225 PolarHBondContact O-N 3.03Å; W225-S227 VanDerWaalsContact C-N 3.27Å; W225-S227 PolarHBondContact O-N 3.22Å; W225-I228 HydrophobicContact CE3-CG2 4.41Å; W225-I228 HydrophobicContact CZ3-CG2 4.38Å; W225-I228 PolarHBondContact O-N 2.77Å; W225-Q229 VanDerWaalsContact O-CB 3.28Å; W225-Q229 WeakPolarHBondContact O-CB 3.23Å; W225-Q229 PolarHBondContact O-N 3.34Å
226	K	81.7	Confident	74.9	Confident	105 Å²	105	112 Å²	112	46%	0.457	57%	0.567	S	S	.	*	H	α-helix	trans	-64.2	-32.3	174.4	-74.2	162.6	-158.7	149.8	0	112.2	D222 Q223 D224 A230	D222-K226 WeakPolarHBondContact O-CB 3.28Å; D222-K226 WeakPolarHBondContact O-CD 3.34Å; D222-K226 VanDerWaalsContact O-CE 3.26Å; D222-K226 WeakPolarHBondContact O-CE 3.48Å; D222-K226 WeakPolarHBondContact O-CG 3.43Å; D222-K226 PolarHBondContact O-N 3.31Å; D222-K226 PolarHBondContact O-NZ 2.96Å; D222-K226 IonicContact OD1-NZ 2.67Å; D222-K226 WeakPolarHBondContact OD2-CE 3.29Å; D222-K226 IonicContact OD2-NZ 3.84Å; D222-K226 PolarHBondContact OD2-NZ 3.13Å; Q223-K226 PolarHBondContact O-N 3.03Å; D224-K226 PolarHBondContact O-N 2.79Å; K226-A230 VanDerWaalsContact O-CB 3.3Å; K226-A230 WeakPolarHBondContact O-CB 3.33Å; K226-A230 PolarHBondContact O-N 2.68Å
227	S	81.8	Confident	72.6	Confident	58 Å²	58	112.8 Å²	112.8	41%	0.406	58%	0.582	S	S	.	*	H	α-helix	trans	-68.9	-43.4	173.6	88.4	0	0	0	0	111.9	Q223 D224 W225 A230 L231	Q223-S227 PolarHBondContact O-N 3.31Å; D224-S227 WeakPolarHBondContact O-CA 3.39Å; D224-S227 WeakPolarHBondContact O-CB 3.42Å; D224-S227 PolarHBondContact O-N 2.82Å; D224-S227 VanDerWaalsContact O-N 3.08Å; D224-S227 PolarHBondContact O-OG 2.86Å; W225-S227 VanDerWaalsContact C-N 3.27Å; W225-S227 PolarHBondContact O-N 3.22Å; S227-A230 PolarHBondContact O-N 3.26Å; S227-L231 WeakPolarHBondContact O-CG 3.09Å; S227-L231 PolarHBondContact O-N 2.94Å
228	I	76.1	Confident	70.4	Confident	78 Å²	78	117.9 Å²	117.9	40%	0.4	60%	0.599	S	S	.	*	H	α-helix	trans	-64.8	-44.4	176.4	-68.7	162.9	0	0	0	110	D224 W225 A230 L231 M232	D224-I228 VanDerWaalsContact O-CG1 3.31Å; D224-I228 WeakPolarHBondContact O-CG1 3.15Å; D224-I228 PolarHBondContact O-N 2.59Å; W225-I228 HydrophobicContact CE3-CG2 4.41Å; W225-I228 HydrophobicContact CZ3-CG2 4.38Å; W225-I228 PolarHBondContact O-N 2.77Å; I228-A230 VanDerWaalsContact C-N 3.34Å; I228-A230 PolarHBondContact O-N 3.43Å; I228-L231 WeakPolarHBondContact O-CB 3.15Å; I228-L231 PolarHBondContact O-N 3.4Å; I228-L231 VanDerWaalsContact O-N 3.12Å; I228-M232 HydrophobicContact CG2-CG 4.39Å; I228-M232 HydrophobicContact CG2-SD 4.02Å; I228-M232 WeakPolarHBondContact O-CG 3.28Å; I228-M232 PolarHBondContact O-N 2.74Å
229	Q	72.2	Confident	68	Low	100 Å²	100	118.2 Å²	118.2	47%	0.467	61%	0.611	S	S	.	*	H	α-helix	trans	-60.8	-41.7	175.1	-168.4	-178	28.4	0	0	111.5	W225 L231 M232 V233	W225-Q229 VanDerWaalsContact O-CB 3.28Å; W225-Q229 WeakPolarHBondContact O-CB 3.23Å; W225-Q229 PolarHBondContact O-N 3.34Å; Q229-L231 VanDerWaalsContact C-N 3.28Å; Q229-L231 PolarHBondContact O-N 3.11Å; Q229-M232 PolarHBondContact O-N 3.3Å; Q229-V233 HydrophobicContact CG-CG2 4.39Å; Q229-V233 WeakPolarHBondContact O-CB 3.43Å; Q229-V233 VanDerWaalsContact O-CG2 3.24Å; Q229-V233 WeakPolarHBondContact O-CG2 3.45Å; Q229-V233 PolarHBondContact O-N 3.18Å
230	A	70.8	Confident	65.4	Low	64 Å²	64	120.8 Å²	120.8	53%	0.529	62%	0.623	S	S	.	*	H	α-helix	trans	-66	-27.6	175.6	0	0	0	0	0	113.5	K226 S227 I228	K226-A230 VanDerWaalsContact O-CB 3.3Å; K226-A230 WeakPolarHBondContact O-CB 3.33Å; K226-A230 PolarHBondContact O-N 2.68Å; S227-A230 PolarHBondContact O-N 3.26Å; I228-A230 VanDerWaalsContact C-N 3.34Å; I228-A230 PolarHBondContact O-N 3.43Å
231	L	68	Low	62.8	Low	134 Å²	134	123.4 Å²	123.4	70%	0.702	64%	0.641	S	S	*	*	H	α-helix	trans	-77	-46.7	171.9	-69.4	165.1	0	0	0	111.6	S227 I228 Q229 V233 K234	S227-L231 WeakPolarHBondContact O-CG 3.09Å; S227-L231 PolarHBondContact O-N 2.94Å; I228-L231 WeakPolarHBondContact O-CB 3.15Å; I228-L231 PolarHBondContact O-N 3.4Å; I228-L231 VanDerWaalsContact O-N 3.12Å; Q229-L231 VanDerWaalsContact C-N 3.28Å; Q229-L231 PolarHBondContact O-N 3.11Å; L231-V233 PolarHBondContact O-N 3.34Å; L231-K234 PolarHBondContact O-N 3.02Å
232	M	58.9	Low	60.4	Low	135 Å²	135	123.6 Å²	123.6	67%	0.665	65%	0.647	S	S	*	*	H	α-helix	trans	-61.7	-39.4	179.3	-72.2	179.5	71	0	0	113	I228 Q229 K234	I228-M232 HydrophobicContact CG2-CG 4.39Å; I228-M232 HydrophobicContact CG2-SD 4.02Å; I228-M232 WeakPolarHBondContact O-CG 3.28Å; I228-M232 PolarHBondContact O-N 2.74Å; Q229-M232 PolarHBondContact O-N 3.3Å; M232-K234 PolarHBondContact O-N 2.92Å
233	V	57.1	Low	58.5	Low	116 Å²	116	127.3 Å²	127.3	70%	0.703	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	-2.2	-178.4	172.3	0	0	0	0	113	Q229 L231	Q229-V233 HydrophobicContact CG-CG2 4.39Å; Q229-V233 WeakPolarHBondContact O-CB 3.43Å; Q229-V233 VanDerWaalsContact O-CG2 3.24Å; Q229-V233 WeakPolarHBondContact O-CG2 3.45Å; Q229-V233 PolarHBondContact O-N 3.18Å; L231-V233 PolarHBondContact O-N 3.34Å
234	K	52.4	Low	56.2	Low	179 Å²	179	130.2 Å²	130.2	78%	0.778	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.8	37.2	179.7	-79.2	-169	176	178.3	0	116.1	L231 M232	L231-K234 PolarHBondContact O-N 3.02Å; M232-K234 PolarHBondContact O-N 2.92Å
235	K	46.8	Very low	54.1	Low	192 Å²	192	132 Å²	132	84%	0.835	69%	0.694	S	S	*	*			trans	-158.2	79.9	152.4	-119.1	176	-175.1	-173.3	0	116.6
236	T	38.8	Very low	52.1	Low	135 Å²	135	134.3 Å²	134.3	83%	0.828	71%	0.711	S	S	*	*			trans	-131.2	137.5	130.7	57.4	0	0	0	0	107.4
237	P	42	Very low	50.4	Low	124 Å²	124	137.7 Å²	137.7	81%	0.805	73%	0.728	S	S	*	*				-126.5	161.8	88.4	38	-32.2	0	0	0	113.6
238	K	40.9	Very low	48.7	Very low	211 Å²	211	144.5 Å²	144.5	92%	0.917	75%	0.751	S	S	*	*			trans	-78.3	133.1	174.6	-66.2	-179.7	175.3	-176.6	0	111.3
239	A	33.3	Very low	47.9	Very low	93 Å²	93	145.4 Å²	145.4	77%	0.769	77%	0.769	S	S	*	*			trans	-159.1	106.8	153.2	0	0	0	0	0	110.6
240	E	35.3	Very low	47.2	Very low	175 Å²	175	149.2 Å²	149.2	82%	0.818	78%	0.784	S	S	*	*			trans	45.6	127.2	146.4	-62	-176.5	166.7	0	0	123.2
241	N	34.6	Very low	46.6	Very low	146 Å²	146	149 Å²	149	78%	0.781	78%	0.778	S	S	*	*			trans	93.8	135.4	136.9	-72.9	-33.7	0	0	0	123.1
242	V	36.2	Very low	46.7	Very low	120 Å²	120	150 Å²	150	73%	0.727	78%	0.779	S	S	*	*			trans	76.7	115.4	165.1	-162.6	0	0	0	0	118.1
243	D	46.9	Very low	47.4	Very low	158 Å²	158	151.4 Å²	151.4	85%	0.845	78%	0.784	S	S	*	*			trans	-61	129	168.3	-49.6	-91.8	0	0	0	112.6
244	K	38.8	Very low	48.1	Very low	179 Å²	179	153.8 Å²	153.8	78%	0.778	78%	0.781	S	S	*	*			trans	-142.9	129.9	156.4	-70.9	-168.7	177	-177	0	109.2	E246	K244-E246 PolarHBondContact O-N 2.63Å
245	P	42.9	Very low	49.1	Very low	127 Å²	127	149 Å²	149	83%	0.825	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-68.3	123.7	165.4	29.3	-31.8	0	0	0	108.4	E247	P245-E247 PolarHBondContact O-N 3.02Å
246	E	39.8	Very low	50.4	Low	192 Å²	192	143.9 Å²	143.9	90%	0.897	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-73.9	122.1	170.3	-66.3	-166.2	143.5	0	0	108.9	K244 K248	K244-E246 PolarHBondContact O-N 2.63Å; E246-K248 PolarHBondContact O-N 3.39Å
247	E	45.2	Very low	52.4	Low	176 Å²	176	142.7 Å²	142.7	82%	0.822	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-59.8	129.8	176.3	-65.9	-177.7	113.8	0	0	109.7	P245 A249	P245-E247 PolarHBondContact O-N 3.02Å; E247-A249 PolarHBondContact O-N 2.82Å; E247-A249 VanDerWaalsContact O-N 3.14Å
248	K	46	Very low	54.1	Low	201 Å²	201	140 Å²	140	87%	0.874	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-54.7	124.2	166.1	-70.6	179.2	179.3	176	0	107.6	E246 K250	E246-K248 PolarHBondContact O-N 3.39Å; K248-K250 PolarHBondContact O-N 2.7Å
249	A	58.3	Low	55.7	Low	96 Å²	96	137.3 Å²	137.3	79%	0.793	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-50.5	128.6	177.6	0	0	0	0	0	109.3	E247	E247-A249 PolarHBondContact O-N 2.82Å; E247-A249 VanDerWaalsContact O-N 3.14Å
250	K	58.8	Low	58	Low	180 Å²	180	138.4 Å²	138.4	78%	0.783	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-57.2	128.7	-177.5	-63.7	-179.7	-178	-179.7	0	108	K248 E252	K248-K250 PolarHBondContact O-N 2.7Å; K250-E252 PolarHBondContact O-N 3.16Å
251	P	57.3	Low	60	Low	60 Å²	60	133 Å²	133	39%	0.39	66%	0.662	S	S	.	*	P	Polyproline II helix	trans	-55.1	136.6	174.8	23.5	-32.9	0	0	0	108.6	D255 M256	P251-D255 HydrophobicContact CB-CB 3.98Å; P251-M256 HydrophobicContact CB-CG 4.03Å; P251-M256 HydrophobicContact CG-CG 3.68Å; P251-M256 HydrophobicContact CG-SD 4.13Å
252	E	70.3	Confident	61.8	Low	154 Å²	154	129 Å²	129	72%	0.72	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-59.5	154.7	176.9	-61.9	-166.1	162.1	0	0	109.7	K250 Y254 D255 M256	K250-E252 PolarHBondContact O-N 3.16Å; E252-Y254 PolarHBondContact O-N 3.1Å; E252-D255 PolarHBondContact O-N 3.43Å; E252-M256 PolarHBondContact O-N 2.83Å; E252-M256 VanDerWaalsContact O-N 3.11Å
253	E	74.3	Confident	63.5	Low	165 Å²	165	131.8 Å²	131.8	77%	0.771	66%	0.658	S	S	*	*	H	α-helix	trans	-54.1	-29.9	-177.8	-64.6	-179.2	146.1	0	0	111.9	M257	E253-M257 WeakPolarHBondContact O-CB 3.24Å; E253-M257 PolarHBondContact O-N 3.37Å
254	Y	70.8	Confident	64.6	Low	167 Å²	167	129.6 Å²	129.6	66%	0.655	64%	0.642	S	S	*	*	H	α-helix	trans	-63.3	-44.1	172.2	-172.8	-95.8	0	0	0	113.7	E252 M257 V258	E252-Y254 PolarHBondContact O-N 3.1Å; Y254-M257 PolarHBondContact O-N 3.24Å; Y254-V258 HydrophobicContact CD1-CG2 4.1Å; Y254-V258 HydrophobicContact CE1-CG2 3.76Å; Y254-V258 HydrophobicContact CE2-CG2 4.39Å; Y254-V258 WeakPolarHBondContact O-CB 3.35Å; Y254-V258 VanDerWaalsContact O-CG2 3.25Å; Y254-V258 WeakPolarHBondContact O-CG2 3.3Å; Y254-V258 PolarHBondContact O-N 3.31Å
255	D	74	Confident	65.6	Low	79 Å²	79	130.1 Å²	130.1	42%	0.422	65%	0.65	S	S	.	*	H	α-helix	trans	-73.5	-31.3	179.9	-93.8	14	0	0	0	112.5	P251 E252 R259	P251-D255 HydrophobicContact CB-CB 3.98Å; E252-D255 PolarHBondContact O-N 3.43Å; D255-R259 WeakPolarHBondContact O-CG 3.16Å; D255-R259 PolarHBondContact O-N 3.43Å
256	M	74.9	Confident	66.6	Low	83 Å²	83	130.3 Å²	130.3	41%	0.409	64%	0.638	S	S	.	*	H	α-helix	trans	-66.2	-52.2	168.3	-58.5	-160	-49.2	0	0	109.8	P251 E252 V258 R259 E260	P251-M256 HydrophobicContact CB-CG 4.03Å; P251-M256 HydrophobicContact CG-CG 3.68Å; P251-M256 HydrophobicContact CG-SD 4.13Å; E252-M256 PolarHBondContact O-N 2.83Å; E252-M256 VanDerWaalsContact O-N 3.11Å; M256-V258 VanDerWaalsContact C-N 3.31Å; M256-V258 PolarHBondContact O-N 3.04Å; M256-R259 PolarHBondContact O-N 3.45Å; M256-R259 VanDerWaalsContact O-N 3.09Å; M256-E260 WeakPolarHBondContact O-CG 3.42Å; M256-E260 PolarHBondContact O-N 2.78Å
257	M	78.9	Confident	67.8	Low	110 Å²	110	125.7 Å²	125.7	54%	0.542	63%	0.632	S	S	.	*	H	α-helix	trans	-59.1	-39.7	179.8	-164.4	-174.3	-152.4	0	0	111.8	E253 Y254 E260 L261	E253-M257 WeakPolarHBondContact O-CB 3.24Å; E253-M257 PolarHBondContact O-N 3.37Å; Y254-M257 PolarHBondContact O-N 3.24Å; M257-E260 PolarHBondContact O-N 3.16Å; M257-L261 HydrophobicContact CG-CD1 3.83Å; M257-L261 HydrophobicContact CG-CG 4.18Å; M257-L261 WeakPolarHBondContact O-CB 3.48Å; M257-L261 VanDerWaalsContact O-CD1 3.29Å; M257-L261 WeakPolarHBondContact O-CD1 3.36Å; M257-L261 WeakPolarHBondContact O-CG 3.42Å; M257-L261 PolarHBondContact O-N 2.87Å; M257-L261 HydrophobicContact SD-CD1 4.42Å
258	V	78.4	Confident	68.8	Low	69 Å²	69	125.6 Å²	125.6	42%	0.418	63%	0.632	S	S	.	*	H	α-helix	trans	-67.2	-36	177.2	166.5	0	0	0	0	112.3	Y254 M256 G262	Y254-V258 HydrophobicContact CD1-CG2 4.1Å; Y254-V258 HydrophobicContact CE1-CG2 3.76Å; Y254-V258 HydrophobicContact CE2-CG2 4.39Å; Y254-V258 WeakPolarHBondContact O-CB 3.35Å; Y254-V258 VanDerWaalsContact O-CG2 3.25Å; Y254-V258 WeakPolarHBondContact O-CG2 3.3Å; Y254-V258 PolarHBondContact O-N 3.31Å; M256-V258 VanDerWaalsContact C-N 3.31Å; M256-V258 PolarHBondContact O-N 3.04Å; V258-G262 PolarHBondContact O-N 2.92Å; V258-G262 VanDerWaalsContact O-N 3.15Å
259	R	75.3	Confident	69.7	Low	154 Å²	154	121.9 Å²	121.9	58%	0.581	63%	0.628	S	S	*	*	H	α-helix	trans	-68.1	-46.8	171.9	-75.1	-178.2	175.7	113.2	1.2	111.4	D255 M256 L261 G262 F263	D255-R259 WeakPolarHBondContact O-CG 3.16Å; D255-R259 PolarHBondContact O-N 3.43Å; M256-R259 PolarHBondContact O-N 3.45Å; M256-R259 VanDerWaalsContact O-N 3.09Å; R259-L261 PolarHBondContact O-N 3.47Å; R259-G262 WeakPolarHBondContact O-CA 3.22Å; R259-G262 PolarHBondContact O-N 2.88Å; R259-F263 WeakPolarHBondContact O-CD2 3.5Å; R259-F263 PolarHBondContact O-N 3.14Å; R259-F263 VanDerWaalsContact O-N 3.12Å
260	E	80.4	Confident	70.1	Confident	115 Å²	115	123.1 Å²	123.1	54%	0.537	63%	0.631	S	S	.	*	H	α-helix	trans	-57.7	-47.5	175.8	-70.2	166	179.1	0	0	111.1	M256 M257 G262 F263 E264	M256-E260 WeakPolarHBondContact O-CG 3.42Å; M256-E260 PolarHBondContact O-N 2.78Å; M257-E260 PolarHBondContact O-N 3.16Å; E260-G262 PolarHBondContact O-N 3.27Å; E260-F263 CarbonylContact O-C 3.55Å; E260-F263 PolarHBondContact O-N 3.25Å; E260-E264 WeakPolarHBondContact O-CG 3.33Å; E260-E264 PolarHBondContact O-N 2.82Å
261	L	77.4	Confident	70.7	Confident	63 Å²	63	120.6 Å²	120.6	33%	0.33	62%	0.622	S	S	.	*	H	α-helix	trans	-60	-22.4	173.7	-73.6	166.5	0	0	0	114.1	M257 R259	M257-L261 HydrophobicContact CG-CD1 3.83Å; M257-L261 HydrophobicContact CG-CG 4.18Å; M257-L261 WeakPolarHBondContact O-CB 3.48Å; M257-L261 VanDerWaalsContact O-CD1 3.29Å; M257-L261 WeakPolarHBondContact O-CD1 3.36Å; M257-L261 WeakPolarHBondContact O-CG 3.42Å; M257-L261 PolarHBondContact O-N 2.87Å; M257-L261 HydrophobicContact SD-CD1 4.42Å; R259-L261 PolarHBondContact O-N 3.47Å
262	G	73.2	Confident	71.8	Confident	62 Å²	62	125.2 Å²	125.2	64%	0.639	64%	0.636	S	S	*	*	H	α-helix	trans	-85.2	-25.9	174.5	0	0	0	0	0	113.8	V258 R259 E260	V258-G262 PolarHBondContact O-N 2.92Å; V258-G262 VanDerWaalsContact O-N 3.15Å; R259-G262 WeakPolarHBondContact O-CA 3.22Å; R259-G262 PolarHBondContact O-N 2.88Å; E260-G262 PolarHBondContact O-N 3.27Å
263	F	72.3	Confident	72.2	Confident	178 Å²	178	126.3 Å²	126.3	78%	0.781	64%	0.643	S	S	*	*	H	α-helix	trans	-92.7	-21.9	173	-64.8	-63.6	0	0	0	112.9	R259 E260 M265	R259-F263 WeakPolarHBondContact O-CD2 3.5Å; R259-F263 PolarHBondContact O-N 3.14Å; R259-F263 VanDerWaalsContact O-N 3.12Å; E260-F263 CarbonylContact O-C 3.55Å; E260-F263 PolarHBondContact O-N 3.25Å; F263-M265 PolarHBondContact O-N 3.1Å; F263-M265 VanDerWaalsContact O-N 3.15Å
264	E	69.2	Low	72.8	Confident	112 Å²	112	121.6 Å²	121.6	52%	0.523	62%	0.62	S	S	.	*	S	Bend	trans	-61.5	110.8	166.4	-79.1	-168.4	156.2	0	0	110.4	E260 K266	E260-E264 WeakPolarHBondContact O-CG 3.33Å; E260-E264 PolarHBondContact O-N 2.82Å; E264-K266 VanDerWaalsContact C-N 3.28Å; E264-K266 HydrophobicContact CB-CG 4.38Å; E264-K266 PolarHBondContact O-N 2.81Å; E264-K266 WeakPolarHBondContact OE2-CE 3.29Å; E264-K266 IonicContact OE2-NZ 3.45Å
265	M	60.5	Low	73.8	Confident	189 Å²	189	115.8 Å²	115.8	93%	0.931	60%	0.604	S	S	*	*			trans	-66.8	83	172.6	-75.6	-176.9	64.1	0	0	111.8	F263 A267	F263-M265 PolarHBondContact O-N 3.1Å; F263-M265 VanDerWaalsContact O-N 3.15Å; M265-A267 VanDerWaalsContact C-N 3.3Å; M265-A267 PolarHBondContact O-N 3.02Å
266	K	62.9	Low	74.6	Confident	131 Å²	131	117.2 Å²	117.2	57%	0.57	62%	0.617	S	S	*	*			trans	-73.7	81	175.5	-67.5	-169.2	179.2	-160.7	0	111.7	E264 Q268	E264-K266 VanDerWaalsContact C-N 3.28Å; E264-K266 HydrophobicContact CB-CG 4.38Å; E264-K266 PolarHBondContact O-N 2.81Å; E264-K266 WeakPolarHBondContact OE2-CE 3.29Å; E264-K266 IonicContact OE2-NZ 3.45Å; K266-Q268 PolarHBondContact O-N 3.28Å
267	A	66.1	Low	75.4	Confident	95 Å²	95	119.3 Å²	119.3	79%	0.785	63%	0.626	S	S	*	*			trans	-57.7	100.9	165.4	0	0	0	0	0	109.7	M265	M265-A267 VanDerWaalsContact C-N 3.3Å; M265-A267 PolarHBondContact O-N 3.02Å
268	Q	65.8	Low	75.9	Confident	175 Å²	175	117.6 Å²	117.6	82%	0.818	62%	0.617	S	S	*	*			trans	-66.7	135.5	173.6	-65.8	-162.7	10.9	0	0	109.5	K266 S270	K266-Q268 PolarHBondContact O-N 3.28Å; Q268-S270 PolarHBondContact O-N 3.47Å
269	P	65.6	Low	76.5	Confident	123 Å²	123	118.1 Å²	118.1	80%	0.799	62%	0.617	S	S	*	*			trans	-60.9	104.2	173.6	-23.7	34.7	0	0	0	110.7	E271	P269-E271 VanDerWaalsContact C-N 3.28Å; P269-E271 PolarHBondContact O-N 3.12Å
270	S	65.4	Low	77.4	Confident	121 Å²	121	113.4 Å²	113.4	85%	0.846	61%	0.611	S	S	*	*	S	Bend	trans	-67.8	-26.8	-176.3	51.7	0	0	0	0	113.3	Q268	Q268-S270 PolarHBondContact O-N 3.47Å
271	E	72.3	Confident	78.1	Confident	127 Å²	127	112.7 Å²	112.7	59%	0.593	61%	0.606	S	S	*	*	S	Bend	trans	-119.4	139	175.7	-68.9	-164.6	-148.4	0	0	111.9	P269 M273 K274	P269-E271 VanDerWaalsContact C-N 3.28Å; P269-E271 PolarHBondContact O-N 3.12Å; E271-M273 PolarHBondContact O-N 3.06Å; E271-K274 WeakPolarHBondContact OE2-CE 3.38Å; E271-K274 IonicContact OE2-NZ 2.78Å; E271-K274 PolarHBondContact OE2-NZ 3.13Å
272	K	80.4	Confident	78.8	Confident	157 Å²	157	114 Å²	114	68%	0.683	61%	0.61	S	S	*	*			trans	-61.5	129.2	167.1	175.7	-160.7	168	-153.6	0	108.7	K274 E278	K272-K274 WeakPolarHBondContact O-CG 3.17Å; K272-K274 PolarHBondContact O-N 2.81Å; K272-E278 IonicContact NZ-OE1 2.71Å
273	M	78.6	Confident	79.8	Confident	178 Å²	178	117.1 Å²	117.1	88%	0.877	61%	0.608	S	S	*	*			trans	-51.6	109.6	169.6	-70.5	-65.7	-72.1	0	0	110.6	E271	E271-M273 PolarHBondContact O-N 3.06Å
274	K	86.6	Confident	80.9	Confident	65 Å²	65	114.6 Å²	114.6	28%	0.283	60%	0.597	S	S	.	*			trans	-82.2	145.9	-179.7	-51.3	-173.4	-164.3	-179.3	0	109.8	E271 K272 E278 L279 E282	E271-K274 WeakPolarHBondContact OE2-CE 3.38Å; E271-K274 IonicContact OE2-NZ 2.78Å; E271-K274 PolarHBondContact OE2-NZ 3.13Å; K272-K274 WeakPolarHBondContact O-CG 3.17Å; K272-K274 PolarHBondContact O-N 2.81Å; K274-E278 HydrophobicContact CB-CB 4.21Å; K274-L279 HydrophobicContact CB-CD2 4.09Å; K274-L279 HydrophobicContact CB-CG 4Å; K274-L279 HydrophobicContact CD-CD2 4.01Å; K274-E282 WeakPolarHBondContact CD-OE1 3.38Å; K274-E282 WeakPolarHBondContact CD-OE2 3.35Å; K274-E282 IonicContact NZ-OE1 3.1Å; K274-E282 PolarHBondContact NZ-OE1 2.83Å; K274-E282 IonicContact NZ-OE2 2.62Å; K274-E282 PolarHBondContact NZ-OE2 2.89Å
275	S	91.3	Very high	82.2	Confident	45 Å²	45	115.4 Å²	115.4	32%	0.315	60%	0.601	S	S	.	*			trans	-67.5	154.7	170.9	64.3	0	0	0	0	110.8	E277 E278 L279	S275-E277 PolarHBondContact O-N 3.35Å; S275-E278 VanDerWaalsContact CB-OE2 3.25Å; S275-E278 WeakPolarHBondContact CB-OE2 3.28Å; S275-E278 PolarHBondContact N-OE2 3.12Å; S275-E278 PolarHBondContact O-N 3.45Å; S275-E278 VanDerWaalsContact OG-CD 3.27Å; S275-E278 VanDerWaalsContact OG-CG 3.28Å; S275-E278 WeakPolarHBondContact OG-CG 3.46Å; S275-E278 PolarHBondContact OG-N 3.12Å; S275-E278 PolarHBondContact OG-OE2 2.99Å; S275-L279 PolarHBondContact O-N 2.78Å
276	P	91.4	Very high	83.9	Confident	109 Å²	109	113.3 Å²	113.3	71%	0.708	59%	0.587	S	S	*	*	H	α-helix	trans	-60.7	-26	175.9	24.5	-34.7	0	0	0	112.6	A280	P276-A280 VanDerWaalsContact O-CB 3.3Å; P276-A280 WeakPolarHBondContact O-CB 3.3Å; P276-A280 PolarHBondContact O-N 2.78Å
277	E	91	Very high	85.4	Confident	128 Å²	128	112.7 Å²	112.7	60%	0.598	59%	0.589	S	S	*	*	H	α-helix	trans	-70.1	-39	170.8	-80.1	-161.8	-151.7	0	0	113.7	S275 K281	S275-E277 PolarHBondContact O-N 3.35Å; E277-K281 WeakPolarHBondContact O-CB 3.49Å; E277-K281 WeakPolarHBondContact O-CD 3.27Å; E277-K281 WeakPolarHBondContact O-CE 3.47Å; E277-K281 WeakPolarHBondContact O-CG 3.19Å; E277-K281 PolarHBondContact O-N 3.27Å; E277-K281 IonicContact OE2-NZ 2.67Å; E277-K281 PolarHBondContact OE2-NZ 3.03Å
278	E	90.3	Very high	86.9	Confident	74 Å²	74	113.7 Å²	113.7	35%	0.346	58%	0.577	S	S	.	*	H	α-helix	trans	-67.2	-43.7	176.1	-75.3	159.5	133.6	0	0	110.1	K272 K274 S275 A280 K281 E282	K272-E278 IonicContact NZ-OE1 2.71Å; K274-E278 HydrophobicContact CB-CB 4.21Å; S275-E278 VanDerWaalsContact CB-OE2 3.25Å; S275-E278 WeakPolarHBondContact CB-OE2 3.28Å; S275-E278 PolarHBondContact N-OE2 3.12Å; S275-E278 PolarHBondContact O-N 3.45Å; S275-E278 VanDerWaalsContact OG-CD 3.27Å; S275-E278 VanDerWaalsContact OG-CG 3.28Å; S275-E278 WeakPolarHBondContact OG-CG 3.46Å; S275-E278 PolarHBondContact OG-N 3.12Å; S275-E278 PolarHBondContact OG-OE2 2.99Å; E278-A280 PolarHBondContact O-N 3.39Å; E278-K281 WeakPolarHBondContact O-CB 3.47Å; E278-K281 PolarHBondContact O-N 3.26Å; E278-K281 VanDerWaalsContact O-N 3.13Å; E278-E282 WeakPolarHBondContact O-CG 3.34Å; E278-E282 PolarHBondContact O-N 2.74Å
279	L	91.8	Very high	88.3	Confident	80 Å²	80	112.1 Å²	112.1	42%	0.419	57%	0.568	S	S	.	*	H	α-helix	trans	-58.7	-48.1	173.8	-68	170.3	0	0	0	111.9	K274 S275 K281 E282 E283	K274-L279 HydrophobicContact CB-CD2 4.09Å; K274-L279 HydrophobicContact CB-CG 4Å; K274-L279 HydrophobicContact CD-CD2 4.01Å; S275-L279 PolarHBondContact O-N 2.78Å; L279-K281 PolarHBondContact O-N 3.07Å; L279-E282 PolarHBondContact O-N 3.44Å; L279-E283 WeakPolarHBondContact O-CB 3.29Å; L279-E283 WeakPolarHBondContact O-CG 3.42Å; L279-E283 PolarHBondContact O-N 3.01Å
280	A	93.8	Very high	89.6	Confident	54 Å²	54	110.8 Å²	110.8	45%	0.446	55%	0.553	S	S	.	*	H	α-helix	trans	-64.6	-25.3	177.1	0	0	0	0	0	113.6	P276 E278 K284	P276-A280 VanDerWaalsContact O-CB 3.3Å; P276-A280 WeakPolarHBondContact O-CB 3.3Å; P276-A280 PolarHBondContact O-N 2.78Å; E278-A280 PolarHBondContact O-N 3.39Å; A280-K284 VanDerWaalsContact O-CB 3.23Å; A280-K284 WeakPolarHBondContact O-CB 3.21Å; A280-K284 PolarHBondContact O-N 3.22Å
281	K	94.2	Very high	91	Very high	100 Å²	100	108.7 Å²	108.7	44%	0.435	53%	0.53	S	S	.	.	H	α-helix	trans	-75.7	-46.9	172.3	-71.3	157.5	-161.6	162.6	0	110.7	E277 E278 L279 E283 K284 E285	E277-K281 WeakPolarHBondContact O-CB 3.49Å; E277-K281 WeakPolarHBondContact O-CD 3.27Å; E277-K281 WeakPolarHBondContact O-CE 3.47Å; E277-K281 WeakPolarHBondContact O-CG 3.19Å; E277-K281 PolarHBondContact O-N 3.27Å; E277-K281 IonicContact OE2-NZ 2.67Å; E277-K281 PolarHBondContact OE2-NZ 3.03Å; E278-K281 WeakPolarHBondContact O-CB 3.47Å; E278-K281 PolarHBondContact O-N 3.26Å; E278-K281 VanDerWaalsContact O-N 3.13Å; L279-K281 PolarHBondContact O-N 3.07Å; K281-E283 PolarHBondContact O-N 3.17Å; K281-K284 PolarHBondContact O-N 3.47Å; K281-E285 WeakPolarHBondContact O-CG 3.34Å; K281-E285 PolarHBondContact O-N 2.84Å
282	E	93.1	Very high	92	Very high	90 Å²	90	104.7 Å²	104.7	42%	0.421	52%	0.519	S	S	.	.	H	α-helix	trans	-60.4	-43.9	175.8	-71.5	-178.1	165.8	0	0	112.1	K274 E278 L279 E285 K286	K274-E282 WeakPolarHBondContact CD-OE1 3.38Å; K274-E282 WeakPolarHBondContact CD-OE2 3.35Å; K274-E282 IonicContact NZ-OE1 3.1Å; K274-E282 PolarHBondContact NZ-OE1 2.83Å; K274-E282 IonicContact NZ-OE2 2.62Å; K274-E282 PolarHBondContact NZ-OE2 2.89Å; E278-E282 WeakPolarHBondContact O-CG 3.34Å; E278-E282 PolarHBondContact O-N 2.74Å; L279-E282 PolarHBondContact O-N 3.44Å; E282-E285 PolarHBondContact O-N 3.42Å; E282-K286 VanDerWaalsContact O-CB 3.24Å; E282-K286 WeakPolarHBondContact O-CB 3.17Å; E282-K286 PolarHBondContact O-N 2.87Å
283	E	94.4	Very high	92.5	Very high	128 Å²	128	99.3 Å²	99.3	60%	0.598	50%	0.498	S	S	*	.	H	α-helix	trans	-62.1	-42.9	174.5	-74.4	-176.2	163.7	0	0	112	L279 K281 K286 L287	L279-E283 WeakPolarHBondContact O-CB 3.29Å; L279-E283 WeakPolarHBondContact O-CG 3.42Å; L279-E283 PolarHBondContact O-N 3.01Å; K281-E283 PolarHBondContact O-N 3.17Å; E283-K286 PolarHBondContact O-N 2.73Å; E283-L287 WeakPolarHBondContact O-CB 3.32Å; E283-L287 VanDerWaalsContact O-CG 3.29Å; E283-L287 WeakPolarHBondContact O-CG 3.44Å; E283-L287 PolarHBondContact O-N 2.81Å
284	K	95.3	Very high	93.2	Very high	126 Å²	126	93.9 Å²	93.9	55%	0.548	47%	0.467	S	S	.	.	H	α-helix	trans	-63.9	-43.7	176.4	179.4	-174.8	174.2	-170.9	0	111.9	A280 K281 L287 Q288	A280-K284 VanDerWaalsContact O-CB 3.23Å; A280-K284 WeakPolarHBondContact O-CB 3.21Å; A280-K284 PolarHBondContact O-N 3.22Å; K281-K284 PolarHBondContact O-N 3.47Å; K284-L287 PolarHBondContact O-N 2.78Å; K284-Q288 WeakPolarHBondContact O-CB 3.21Å; K284-Q288 VanDerWaalsContact O-CG 3.32Å; K284-Q288 WeakPolarHBondContact O-CG 3.49Å; K284-Q288 PolarHBondContact O-N 2.67Å
285	E	95.8	Very high	93.4	Very high	128 Å²	128	94.3 Å²	94.3	60%	0.598	47%	0.472	S	S	*	.	H	α-helix	trans	-66.4	-40	177.1	-73.7	177.8	-165.5	0	0	111.4	K281 E282 Q288 K289	K281-E285 WeakPolarHBondContact O-CG 3.34Å; K281-E285 PolarHBondContact O-N 2.84Å; E282-E285 PolarHBondContact O-N 3.42Å; E285-Q288 PolarHBondContact O-N 3.14Å; E285-K289 WeakPolarHBondContact O-CB 3.28Å; E285-K289 PolarHBondContact O-N 2.67Å
286	K	95.9	Very high	93.4	Very high	146 Å²	146	98.9 Å²	98.9	64%	0.635	48%	0.483	S	S	*	.	H	α-helix	trans	-59.7	-46	171.9	-177.5	177.7	179.7	180	0	111.8	E282 E283 K289 L290	E282-K286 VanDerWaalsContact O-CB 3.24Å; E282-K286 WeakPolarHBondContact O-CB 3.17Å; E282-K286 PolarHBondContact O-N 2.87Å; E283-K286 PolarHBondContact O-N 2.73Å; K286-K289 PolarHBondContact O-N 3.01Å; K286-L290 HydrophobicContact CG-CD1 4.16Å; K286-L290 WeakPolarHBondContact O-CB 3.22Å; K286-L290 VanDerWaalsContact O-CG 3.28Å; K286-L290 WeakPolarHBondContact O-CG 3.45Å; K286-L290 PolarHBondContact O-N 3.42Å
287	L	95.5	Very high	93.4	Very high	118 Å²	118	98.4 Å²	98.4	62%	0.618	47%	0.467	S	S	*	.	H	α-helix	trans	-65	-41.8	175.8	-73.6	171.2	0	0	0	112.2	E283 K284 K289 L290 E291	E283-L287 WeakPolarHBondContact O-CB 3.32Å; E283-L287 VanDerWaalsContact O-CG 3.29Å; E283-L287 WeakPolarHBondContact O-CG 3.44Å; E283-L287 PolarHBondContact O-N 2.81Å; K284-L287 PolarHBondContact O-N 2.78Å; L287-K289 VanDerWaalsContact C-N 3.35Å; L287-K289 PolarHBondContact O-N 3.35Å; L287-L290 PolarHBondContact O-N 2.99Å; L287-E291 WeakPolarHBondContact O-CB 3.44Å; L287-E291 PolarHBondContact O-N 2.85Å
288	Q	95.8	Very high	93.4	Very high	116 Å²	116	95 Å²	95	54%	0.542	45%	0.452	S	S	.	.	H	α-helix	trans	-63.6	-39.1	175.5	-76.3	-177.7	-21.7	0	0	112.3	K284 E285 A292	K284-Q288 WeakPolarHBondContact O-CB 3.21Å; K284-Q288 VanDerWaalsContact O-CG 3.32Å; K284-Q288 WeakPolarHBondContact O-CG 3.49Å; K284-Q288 PolarHBondContact O-N 2.67Å; E285-Q288 PolarHBondContact O-N 3.14Å; Q288-A292 WeakPolarHBondContact O-CB 3.11Å; Q288-A292 PolarHBondContact O-N 3.2Å
289	K	95.9	Very high	93.4	Very high	141 Å²	141	98.4 Å²	98.4	61%	0.613	47%	0.469	S	S	*	.	H	α-helix	trans	-64.7	-49	173.5	-177.5	178.5	176.9	-173.5	0	111.5	E285 K286 L287 E291 A292 D293	E285-K289 WeakPolarHBondContact O-CB 3.28Å; E285-K289 PolarHBondContact O-N 2.67Å; K286-K289 PolarHBondContact O-N 3.01Å; L287-K289 VanDerWaalsContact C-N 3.35Å; L287-K289 PolarHBondContact O-N 3.35Å; K289-E291 VanDerWaalsContact C-N 3.28Å; K289-E291 PolarHBondContact O-N 2.99Å; K289-A292 PolarHBondContact O-N 3.37Å; K289-A292 VanDerWaalsContact O-N 3.16Å; K289-D293 WeakPolarHBondContact CE-OD2 3.34Å; K289-D293 WeakPolarHBondContact CG-OD2 3.21Å; K289-D293 WeakPolarHBondContact O-CB 3.48Å; K289-D293 PolarHBondContact O-N 3Å
290	L	93.4	Very high	93.1	Very high	96 Å²	96	96.1 Å²	96.1	50%	0.503	47%	0.465	S	S	.	.	H	α-helix	trans	-60.6	-37.3	178.4	-72.5	169.6	0	0	0	112.3	K286 L287 R294	K286-L290 HydrophobicContact CG-CD1 4.16Å; K286-L290 WeakPolarHBondContact O-CB 3.22Å; K286-L290 VanDerWaalsContact O-CG 3.28Å; K286-L290 WeakPolarHBondContact O-CG 3.45Å; K286-L290 PolarHBondContact O-N 3.42Å; L287-L290 PolarHBondContact O-N 2.99Å; L290-R294 VanDerWaalsContact O-CB 3.26Å; L290-R294 WeakPolarHBondContact O-CB 3.27Å; L290-R294 PolarHBondContact O-N 3.44Å
291	E	93.8	Very high	92.2	Very high	76 Å²	76	99 Å²	99	36%	0.355	47%	0.473	S	S	.	.	H	α-helix	trans	-67.4	-42.3	174.2	179.7	58.2	-163.9	0	0	112.1	L287 K289 R294 L295	L287-E291 WeakPolarHBondContact O-CB 3.44Å; L287-E291 PolarHBondContact O-N 2.85Å; K289-E291 VanDerWaalsContact C-N 3.28Å; K289-E291 PolarHBondContact O-N 2.99Å; E291-R294 WeakPolarHBondContact O-CB 3.43Å; E291-R294 PolarHBondContact O-N 3.36Å; E291-R294 IonicContact OE1-CZ 3.41Å; E291-R294 IonicContact OE1-NE 2.71Å; E291-R294 IonicContact OE1-NH2 2.84Å; E291-R294 PolarHBondContact OE1-NH2 3.27Å; E291-R294 IonicContact OE2-CZ 3.79Å; E291-R294 IonicContact OE2-NE 3.07Å; E291-R294 PolarHBondContact OE2-NE 3.06Å; E291-R294 IonicContact OE2-NH1 2.58Å; E291-R294 IonicContact OE2-NH2 3.22Å; E291-R294 PolarHBondContact OE2-NH2 2.8Å; E291-L295 HydrophobicContact CG-CD1 4.38Å; E291-L295 WeakPolarHBondContact O-CG 3.24Å; E291-L295 PolarHBondContact O-N 3.08Å
292	A	93.1	Very high	90.4	Very high	44 Å²	44	100.7 Å²	100.7	36%	0.364	48%	0.483	S	S	.	.	H	α-helix	trans	-64.1	-43.1	174.7	0	0	0	0	0	112.3	Q288 K289 R294 L295 R296	Q288-A292 WeakPolarHBondContact O-CB 3.11Å; Q288-A292 PolarHBondContact O-N 3.2Å; K289-A292 PolarHBondContact O-N 3.37Å; K289-A292 VanDerWaalsContact O-N 3.16Å; A292-R294 VanDerWaalsContact C-N 3.31Å; A292-R294 PolarHBondContact O-N 3.49Å; A292-L295 PolarHBondContact O-N 3.17Å; A292-R296 WeakPolarHBondContact O-CG 3.35Å; A292-R296 PolarHBondContact O-N 3.31Å
293	D	92.4	Very high	88.2	Confident	43 Å²	43	100.2 Å²	100.2	23%	0.23	50%	0.502	C	S	.	.	H	α-helix	trans	-72.3	-23.9	177.6	-67.6	-27.5	0	0	0	112.1	K289 R296 R297	K289-D293 WeakPolarHBondContact CE-OD2 3.34Å; K289-D293 WeakPolarHBondContact CG-OD2 3.21Å; K289-D293 WeakPolarHBondContact O-CB 3.48Å; K289-D293 PolarHBondContact O-N 3Å; D293-R296 IonicContact OD1-CZ 3.7Å; D293-R296 IonicContact OD1-NH1 2.77Å; D293-R296 PolarHBondContact OD1-NH1 2.88Å; D293-R297 WeakPolarHBondContact O-CG 3.49Å; D293-R297 PolarHBondContact O-N 2.98Å; D293-R297 PolarHBondContact O-NE 2.92Å
294	R	92.4	Very high	85.7	Confident	64 Å²	64	97.6 Å²	97.6	24%	0.242	51%	0.509	C	S	.	.	H	α-helix	trans	-68.8	-47.4	165.8	-173.6	-176.5	73.8	149.5	5	111.6	L290 E291 A292 R296 R297 M298 S579	L290-R294 VanDerWaalsContact O-CB 3.26Å; L290-R294 WeakPolarHBondContact O-CB 3.27Å; L290-R294 PolarHBondContact O-N 3.44Å; E291-R294 WeakPolarHBondContact O-CB 3.43Å; E291-R294 PolarHBondContact O-N 3.36Å; E291-R294 IonicContact OE1-CZ 3.41Å; E291-R294 IonicContact OE1-NE 2.71Å; E291-R294 IonicContact OE1-NH2 2.84Å; E291-R294 PolarHBondContact OE1-NH2 3.27Å; E291-R294 IonicContact OE2-CZ 3.79Å; E291-R294 IonicContact OE2-NE 3.07Å; E291-R294 PolarHBondContact OE2-NE 3.06Å; E291-R294 IonicContact OE2-NH1 2.58Å; E291-R294 IonicContact OE2-NH2 3.22Å; E291-R294 PolarHBondContact OE2-NH2 2.8Å; A292-R294 VanDerWaalsContact C-N 3.31Å; A292-R294 PolarHBondContact O-N 3.49Å; R294-R296 PolarHBondContact O-N 3.43Å; R294-R297 PolarHBondContact O-N 3.42Å; R294-M298 WeakPolarHBondContact O-CB 3.24Å; R294-M298 PolarHBondContact O-N 2.97Å; R294-S579 WeakPolarHBondContact CG-OG 3.45Å
295	L	91.7	Very high	83.1	Confident	74 Å²	74	98.8 Å²	98.8	39%	0.387	52%	0.521	S	S	.	.	H	α-helix	trans	-64.3	-38.8	179.3	-70.7	170.1	0	0	0	112.1	E291 A292 M298 M299	E291-L295 HydrophobicContact CG-CD1 4.38Å; E291-L295 WeakPolarHBondContact O-CG 3.24Å; E291-L295 PolarHBondContact O-N 3.08Å; A292-L295 PolarHBondContact O-N 3.17Å; L295-M298 HydrophobicContact CD2-CE 3.68Å; L295-M298 PolarHBondContact O-N 2.62Å; L295-M299 VanDerWaalsContact O-CG 3.31Å; L295-M299 WeakPolarHBondContact O-CG 3.39Å; L295-M299 PolarHBondContact O-N 2.86Å
296	R	91.1	Very high	80.4	Confident	141 Å²	141	95.4 Å²	95.4	53%	0.532	52%	0.52	S	S	.	.	H	α-helix	trans	-56.3	-54.7	171	-76.2	164.9	162.6	176.7	-10.5	112.1	A292 D293 R294 M298 M299 G300 D301	A292-R296 WeakPolarHBondContact O-CG 3.35Å; A292-R296 PolarHBondContact O-N 3.31Å; D293-R296 IonicContact OD1-CZ 3.7Å; D293-R296 IonicContact OD1-NH1 2.77Å; D293-R296 PolarHBondContact OD1-NH1 2.88Å; R294-R296 PolarHBondContact O-N 3.43Å; R296-M298 VanDerWaalsContact C-N 3.3Å; R296-M298 PolarHBondContact O-N 3.31Å; R296-M299 PolarHBondContact O-N 3.24Å; R296-M299 VanDerWaalsContact O-N 3.09Å; R296-G300 PolarHBondContact O-N 2.95Å; R296-D301 PolarHBondContact O-N 3.34Å
297	R	91.4	Very high	77.7	Confident	100 Å²	100	94.2 Å²	94.2	38%	0.377	53%	0.525	S	S	.	.	H	α-helix	trans	-60.4	-36.7	177.3	-72.6	177.4	-68.1	146.3	3	112.6	D293 R294 M299 G300 D580 F581	D293-R297 WeakPolarHBondContact O-CG 3.49Å; D293-R297 PolarHBondContact O-N 2.98Å; D293-R297 PolarHBondContact O-NE 2.92Å; R294-R297 PolarHBondContact O-N 3.42Å; R297-M299 VanDerWaalsContact C-N 3.34Å; R297-G300 PolarHBondContact O-N 2.85Å; R297-D580 HydrophobicContact CB-CB 4.06Å; R297-D580 WeakPolarHBondContact CD-OD2 3.43Å; R297-D580 IonicContact CZ-OD1 2.63Å; R297-D580 IonicContact CZ-OD2 2.68Å; R297-D580 VanDerWaalsContact CZ-OD2 3.32Å; R297-D580 IonicContact NE-OD2 2.73Å; R297-D580 IonicContact NH1-OD1 3.17Å; R297-D580 IonicContact NH1-OD2 3.5Å; R297-D580 PolarHBondContact NH1-OD2 3.25Å; R297-F581 VanDerWaalsContact O-CB 3.23Å; R297-F581 WeakPolarHBondContact O-CB 3.36Å; R297-F581 PolarHBondContact O-N 2.88Å
298	M	91.1	Very high	75.3	Confident	56 Å²	56	97.1 Å²	97.1	28%	0.276	54%	0.536	S	S	.	.	H	α-helix	trans	-64.1	-36.8	174.9	-174.8	-178.2	76.2	0	0	112.7	R294 L295 R296 G300 S579	R294-M298 WeakPolarHBondContact O-CB 3.24Å; R294-M298 PolarHBondContact O-N 2.97Å; L295-M298 HydrophobicContact CD2-CE 3.68Å; L295-M298 PolarHBondContact O-N 2.62Å; R296-M298 VanDerWaalsContact C-N 3.3Å; R296-M298 PolarHBondContact O-N 3.31Å; M298-G300 VanDerWaalsContact C-N 3.25Å; M298-G300 PolarHBondContact O-N 3.18Å; M298-S579 WeakPolarHBondContact CG-O 3.39Å
299	M	88.6	Confident	72.8	Confident	145 Å²	145	96.1 Å²	96.1	71%	0.714	54%	0.542	S	S	*	.	H	α-helix	trans	-74.6	-10.4	178.3	-70.6	-62.7	-61.1	0	0	114	L295 R296 R297 D301	L295-M299 VanDerWaalsContact O-CG 3.31Å; L295-M299 WeakPolarHBondContact O-CG 3.39Å; L295-M299 PolarHBondContact O-N 2.86Å; R296-M299 PolarHBondContact O-N 3.24Å; R296-M299 VanDerWaalsContact O-N 3.09Å; R297-M299 VanDerWaalsContact C-N 3.34Å; M299-D301 HydrophobicContact CB-CB 4.37Å
300	G	86.1	Confident	70.6	Confident	32 Å²	32	98.6 Å²	98.6	33%	0.33	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	75.4	13.2	-171	0	0	0	0	0	113.3	R296 R297 M298 E302	R296-G300 PolarHBondContact O-N 2.95Å; R297-G300 PolarHBondContact O-N 2.85Å; M298-G300 VanDerWaalsContact C-N 3.25Å; M298-G300 PolarHBondContact O-N 3.18Å; G300-E302 PolarHBondContact O-N 3.13Å
301	D	75.3	Confident	68.9	Low	115 Å²	115	99.7 Å²	99.7	62%	0.615	57%	0.566	S	S	*	*			trans	-80.8	63.7	174.6	-157.8	37.6	0	0	0	108.4	R296 M299	R296-D301 PolarHBondContact O-N 3.34Å; M299-D301 HydrophobicContact CB-CB 4.37Å
302	E	56.3	Low	66.8	Low	136 Å²	136	102.6 Å²	102.6	64%	0.636	58%	0.579	S	S	*	*			trans	-58.5	154.8	165.5	-70.4	-178.4	-173.9	0	0	109	G300 G304	G300-E302 PolarHBondContact O-N 3.13Å; E302-G304 PolarHBondContact O-N 3.42Å
303	G	47.1	Very low	65	Low	80 Å²	80	104.2 Å²	104.2	83%	0.825	58%	0.58	S	S	*	*	S	Bend	trans	-66.4	28.5	-168.9	0	0	0	0	0	116.9	D305	G303-D305 PolarHBondContact O-N 3.38Å
304	G	42.2	Very low	63.2	Low	72 Å²	72	105 Å²	105	74%	0.742	59%	0.589	S	S	*	*			trans	-64.9	31.6	171.2	0	0	0	0	0	115.2	E302 G306	E302-G304 PolarHBondContact O-N 3.42Å; G304-G306 PolarHBondContact O-N 2.96Å
305	D	40.6	Very low	61.3	Low	151 Å²	151	105.6 Å²	105.6	81%	0.807	61%	0.607	S	S	*	*			trans	-71.4	43.8	144.9	-139.2	3.3	0	0	0	109.1	G303 V307	G303-D305 PolarHBondContact O-N 3.38Å; D305-V307 PolarHBondContact O-N 3.03Å
306	G	38.3	Very low	59.6	Low	57 Å²	57	109.6 Å²	109.6	59%	0.588	63%	0.629	S	S	*	*			trans	-66.3	85.7	163.4	0	0	0	0	0	105.7	G304 Q308	G304-G306 PolarHBondContact O-N 2.96Å; G306-Q308 PolarHBondContact O-N 3.19Å
307	V	40.4	Very low	58	Low	121 Å²	121	107.5 Å²	107.5	73%	0.733	63%	0.629	S	S	*	*			trans	-38.5	108	-176.4	176.1	0	0	0	0	107.8	D305 S309	D305-V307 PolarHBondContact O-N 3.03Å; V307-S309 PolarHBondContact O-N 2.9Å
308	Q	45.1	Very low	56.2	Low	179 Å²	179	110 Å²	110	84%	0.836	65%	0.649	S	S	*	*			trans	-62.3	95.3	178.6	-74.6	-170.5	-9.5	0	0	106.8	G306 Q310	G306-Q308 PolarHBondContact O-N 3.19Å; Q308-Q310 PolarHBondContact O-N 3.02Å
309	S	42.8	Very low	53.9	Low	96 Å²	96	111.6 Å²	111.6	67%	0.671	66%	0.658	S	S	*	*			trans	-58	113.4	179.6	52.5	0	0	0	0	105.3	V307 V311	V307-S309 PolarHBondContact O-N 2.9Å; S309-V311 PolarHBondContact O-N 3.38Å
310	Q	50.2	Low	51.8	Low	193 Å²	193	112 Å²	112	90%	0.902	66%	0.663	S	S	*	*			trans	-73.9	79.4	-171.5	-72.2	-168.9	-13.1	0	0	108.6	Q308 H312	Q308-Q310 PolarHBondContact O-N 3.02Å; Q310-H312 PolarHBondContact O-N 3.25Å; Q310-H312 VanDerWaalsContact O-N 3.1Å
311	V	56.1	Low	49.9	Very low	119 Å²	119	113.7 Å²	113.7	72%	0.721	68%	0.681	S	S	*	*			trans	-51.9	118.9	172.4	-179.2	0	0	0	0	106.4	S309 M313	S309-V311 PolarHBondContact O-N 3.38Å; V311-M313 VanDerWaalsContact C-N 3.29Å; V311-M313 PolarHBondContact O-N 3.33Å
312	H	50.5	Low	48.2	Very low	136 Å²	136	116.9 Å²	116.9	63%	0.63	69%	0.69	S	S	*	*			trans	-69.6	84.3	-169.3	175.7	-65.9	0	0	0	110.4	Q310 S314	Q310-H312 PolarHBondContact O-N 3.25Å; Q310-H312 VanDerWaalsContact O-N 3.1Å; H312-S314 PolarHBondContact CE1-OG 3.2Å; H312-S314 PolarHBondContact ND1-OG 3.21Å; H312-S314 PolarHBondContact O-N 3.06Å
313	M	55.6	Low	47.5	Very low	78 Å²	78	115.8 Å²	115.8	38%	0.384	69%	0.692	S	S	.	*			trans	-63.9	119.1	169.6	-65.5	-171.2	80.4	0	0	108.9	V311 D317	V311-M313 VanDerWaalsContact C-N 3.29Å; V311-M313 PolarHBondContact O-N 3.33Å; M313-D317 VanDerWaalsContact CE-OD2 3.28Å; M313-D317 WeakPolarHBondContact CE-OD2 3.46Å
314	S	54.5	Low	47.4	Very low	61 Å²	61	118.9 Å²	118.9	43%	0.427	69%	0.689	S	S	.	*			trans	-86.5	154.2	179.7	-62.4	0	0	0	0	110.9	H312 D316 D317	H312-S314 PolarHBondContact CE1-OG 3.2Å; H312-S314 PolarHBondContact ND1-OG 3.21Å; H312-S314 PolarHBondContact O-N 3.06Å; S314-D316 PolarHBondContact O-N 3.1Å; S314-D316 VanDerWaalsContact O-N 3.12Å; S314-D317 WeakPolarHBondContact O-CB 3.4Å; S314-D317 PolarHBondContact O-N 3.05Å
315	A	53.3	Low	47.3	Very low	75 Å²	75	121.3 Å²	121.3	62%	0.62	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	-10.3	-174.1	0	0	0	0	0	115.5
316	D	55.8	Low	47.5	Very low	159 Å²	159	123.6 Å²	123.6	85%	0.85	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-11.2	171.3	-68.7	-44.4	0	0	0	112.9	S314 L318	S314-D316 PolarHBondContact O-N 3.1Å; S314-D316 VanDerWaalsContact O-N 3.12Å; D316-L318 VanDerWaalsContact C-N 3.33Å; D316-L318 PolarHBondContact O-N 2.76Å
317	D	55.9	Low	47.3	Very low	97 Å²	97	128 Å²	128	52%	0.519	69%	0.693	S	S	.	*			trans	-80.2	80	175.8	-172.6	22.2	0	0	0	110	M313 S314 N319	M313-D317 VanDerWaalsContact CE-OD2 3.28Å; M313-D317 WeakPolarHBondContact CE-OD2 3.46Å; S314-D317 WeakPolarHBondContact O-CB 3.4Å; S314-D317 PolarHBondContact O-N 3.05Å; D317-N319 VanDerWaalsContact C-N 3.29Å; D317-N319 PolarHBondContact O-N 2.69Å
318	L	53.7	Low	47.5	Very low	152 Å²	152	129.7 Å²	129.7	80%	0.796	70%	0.697	S	S	*	*			trans	-72.7	82.1	-179.2	-68.4	176.4	0	0	0	110.7	D316 D320	D316-L318 VanDerWaalsContact C-N 3.33Å; D316-L318 PolarHBondContact O-N 2.76Å; L318-D320 PolarHBondContact O-N 3.47Å
319	N	43.4	Very low	47.1	Very low	90 Å²	90	129.8 Å²	129.8	48%	0.481	70%	0.695	S	S	.	*			trans	-56.3	86.2	177.1	-174.3	123.1	0	0	0	112.1	D317 G321	D317-N319 VanDerWaalsContact C-N 3.29Å; D317-N319 PolarHBondContact O-N 2.69Å; N319-G321 VanDerWaalsContact C-N 3.3Å; N319-G321 PolarHBondContact O-N 3.15Å
320	D	44.2	Very low	47	Very low	153 Å²	153	133.3 Å²	133.3	82%	0.818	70%	0.698	S	S	*	*			trans	-80.5	63.8	-165.5	-157.4	20.2	0	0	0	114.2	L318 F322	L318-D320 PolarHBondContact O-N 3.47Å; D320-F322 PolarHBondContact O-N 3.07Å
321	G	47.7	Very low	46.4	Very low	68 Å²	68	130.3 Å²	130.3	70%	0.701	69%	0.693	S	S	*	*	S	Bend	trans	72.6	-34.6	168	0	0	0	0	0	117.3	N319 V323	N319-G321 VanDerWaalsContact C-N 3.3Å; N319-G321 PolarHBondContact O-N 3.15Å; G321-V323 PolarHBondContact O-N 2.76Å
322	F	37.8	Very low	45.8	Very low	182 Å²	182	131 Å²	131	80%	0.798	69%	0.692	S	S	*	*			trans	-79.6	97.3	-179.5	-90.8	-94.6	0	0	0	111.9	D320 L324	D320-F322 PolarHBondContact O-N 3.07Å; F322-L324 VanDerWaalsContact C-N 3.33Å; F322-L324 PolarHBondContact O-N 2.83Å; F322-L324 VanDerWaalsContact O-N 3.15Å
323	V	43.2	Very low	45.5	Very low	112 Å²	112	128.8 Å²	128.8	68%	0.679	70%	0.698	S	S	*	*			trans	-73	95.6	152.6	-179.1	0	0	0	0	107	G321 D325	G321-V323 PolarHBondContact O-N 2.76Å; V323-D325 PolarHBondContact O-N 3.19Å
324	L	43.4	Very low	45.2	Very low	145 Å²	145	131.8 Å²	131.8	76%	0.759	71%	0.706	S	S	*	*			trans	-71.4	115.7	152.2	-73.5	170.3	0	0	0	106.4	F322 K326	F322-L324 VanDerWaalsContact C-N 3.33Å; F322-L324 PolarHBondContact O-N 2.83Å; F322-L324 VanDerWaalsContact O-N 3.15Å; L324-K326 PolarHBondContact O-N 3.35Å
325	D	41	Very low	44.5	Very low	124 Å²	124	137 Å²	137	66%	0.663	72%	0.724	S	S	*	*			trans	-56.6	130.1	167.2	-72.7	-47.2	0	0	0	108.4	V323 H327	V323-D325 PolarHBondContact O-N 3.19Å; D325-H327 PolarHBondContact O-N 3.23Å
326	K	44.6	Very low	44.1	Very low	198 Å²	198	141.5 Å²	141.5	86%	0.861	74%	0.737	S	S	*	*			trans	-74.7	69.4	176.4	-73.2	-166.3	173.5	-166.4	0	110.9	L324	L324-K326 PolarHBondContact O-N 3.35Å
327	H	34.9	Very low	44	Very low	151 Å²	151	136.7 Å²	136.7	70%	0.699	73%	0.725	S	S	*	*			trans	-92.1	114.4	152.9	-72	-63.7	0	0	0	107.5	D325 K329	D325-H327 PolarHBondContact O-N 3.23Å; H327-K329 PolarHBondContact O-N 2.92Å
328	D	43	Very low	43.3	Very low	155 Å²	155	140.4 Å²	140.4	83%	0.829	74%	0.736	S	S	*	*			trans	-71	75.3	179	-68	-52.3	0	0	0	111.4	K330	D328-K330 PolarHBondContact O-N 3.44Å
329	K	38.2	Very low	42.8	Very low	181 Å²	181	141.8 Å²	141.8	79%	0.787	73%	0.731	S	S	*	*			trans	-76.5	96.7	163.9	-70.7	-174.6	174.8	-176.5	0	107.8	H327 T331	H327-K329 PolarHBondContact O-N 2.92Å; K329-T331 PolarHBondContact O-N 3.17Å
330	K	40.3	Very low	42.8	Very low	170 Å²	170	144.1 Å²	144.1	74%	0.739	74%	0.743	S	S	*	*			trans	-40.9	110.5	166.5	-75.3	179.9	174.6	175.5	0	108.4	D328 L332 E342	D328-K330 PolarHBondContact O-N 3.44Å; K330-L332 PolarHBondContact O-N 3.09Å; K330-E342 IonicContact NZ-OE2 3.34Å; K330-E342 PolarHBondContact NZ-OE2 3.14Å
331	T	36.6	Very low	42.6	Very low	130 Å²	130	143.1 Å²	143.1	80%	0.798	74%	0.737	S	S	*	*			trans	-73.8	123.8	-179.4	47.6	0	0	0	0	109.2	K329 A333	K329-T331 PolarHBondContact O-N 3.17Å; T331-A333 PolarHBondContact O-N 2.94Å
332	L	43.8	Very low	42	Very low	134 Å²	134	146.8 Å²	146.8	70%	0.702	74%	0.735	S	S	*	*			trans	-51.6	106.8	178.4	-71	164	0	0	0	111.1	K330	K330-L332 PolarHBondContact O-N 3.09Å
333	A	45.4	Very low	41.7	Very low	90 Å²	90	146.3 Å²	146.3	74%	0.744	74%	0.736	S	S	*	*			trans	-92.5	136.6	170.1	0	0	0	0	0	109.2	T331	T331-A333 PolarHBondContact O-N 2.94Å
334	Y	48	Very low	40.9	Very low	140 Å²	140	150.4 Å²	150.4	55%	0.549	75%	0.748	S	S	.	*			trans	-102	125	172.8	-103.6	-96.6	0	0	0	109.5	W339	Y334-W339 PolarHBondContact OH-NE1 3.41Å
335	Q	40.9	Very low	40.1	Very low	172 Å²	172	149.8 Å²	149.8	80%	0.804	75%	0.75	S	S	*	*	S	Bend	trans	-121.5	132	151.1	-75.6	-178.7	-74.9	0	0	107.8	G337	Q335-G337 VanDerWaalsContact C-N 3.29Å; Q335-G337 PolarHBondContact O-N 3.47Å
336	D	44.7	Very low	39.4	Very low	169 Å²	169	152.6 Å²	152.6	90%	0.904	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	45.4	39.9	166.9	-55.6	-18.9	0	0	0	118	K338	D336-K338 PolarHBondContact O-N 2.82Å
337	G	52.5	Low	38.6	Very low	57 Å²	57	150.9 Å²	150.9	59%	0.588	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	85.4	3.6	151.7	0	0	0	0	0	117.2	Q335	Q335-G337 VanDerWaalsContact C-N 3.29Å; Q335-G337 PolarHBondContact O-N 3.47Å
338	K	41.8	Very low	38.2	Very low	176 Å²	176	151.3 Å²	151.3	77%	0.765	77%	0.767	S	S	*	*			trans	-112.3	161.9	167.4	-76.1	-176.1	177.1	179.1	0	111.4	D336	D336-K338 PolarHBondContact O-N 2.82Å
339	W	43.2	Very low	37.3	Very low	181 Å²	181	151.3 Å²	151.3	69%	0.686	76%	0.759	S	S	*	*			trans	-98.7	121.3	-175.6	-62.2	59	0	0	0	108.9	Y334	Y334-W339 PolarHBondContact OH-NE1 3.41Å
340	N	44	Very low	36.7	Very low	138 Å²	138	149.3 Å²	149.3	74%	0.738	75%	0.753	S	S	*	*			trans	-84.4	115.8	166.5	-81.9	26.8	0	0	0	109.5
341	I	39.4	Very low	35.8	Very low	132 Å²	132	149.2 Å²	149.2	68%	0.677	76%	0.755	S	S	*	*			trans	-117.5	119.4	156.7	-62.5	175.3	0	0	0	104.5	E343	I341-E343 HydrophobicContact CG2-CG 4.31Å; I341-E343 PolarHBondContact O-N 2.95Å
342	E	34.7	Very low	35.1	Very low	145 Å²	145	152 Å²	152	68%	0.678	76%	0.759	S	S	*	*			trans	-80	107.6	167.9	-66.6	162	141.4	0	0	106.3	K330	K330-E342 IonicContact NZ-OE2 3.34Å; K330-E342 PolarHBondContact NZ-OE2 3.14Å
343	E	32	Very low	34.1	Very low	172 Å²	172	149.2 Å²	149.2	80%	0.804	76%	0.763	S	S	*	*			trans	-81.8	130.8	165.5	-68.1	-173.1	139	0	0	108.1	I341 T345	I341-E343 HydrophobicContact CG2-CG 4.31Å; I341-E343 PolarHBondContact O-N 2.95Å; E343-T345 PolarHBondContact O-N 2.9Å
344	E	27.1	Very low	33.1	Very low	199 Å²	199	154 Å²	154	93%	0.93	77%	0.77	S	S	*	*			trans	-80.7	114.9	175.7	-67.2	175.5	153	0	0	108.9
345	T	26.8	Very low	31.8	Very low	132 Å²	132	152.6 Å²	152.6	81%	0.81	78%	0.781	S	S	*	*			trans	-126.8	132.9	164.2	52.9	0	0	0	0	109.8	E343	E343-T345 PolarHBondContact O-N 2.9Å
346	E	26.4	Very low	30.9	Very low	182 Å²	182	151.2 Å²	151.2	85%	0.85	77%	0.774	S	S	*	*			trans	-67.9	131.6	176.6	-60.8	159.2	128.2	0	0	110.2
347	D	26.6	Very low	29.8	Very low	163 Å²	163	149.4 Å²	149.4	87%	0.872	76%	0.758	S	S	*	*				176.1	137.9	111.6	-93.9	-29.1	0	0	0	111.8
348	D	26.1	Very low	28.4	Very low	159 Å²	159	154.2 Å²	154.2	85%	0.85	77%	0.766	S	S	*	*			trans	-80.7	127.1	165	-82.2	-52.7	0	0	0	109.4
349	K	25.9	Very low	27.5	Very low	155 Å²	155	154.6 Å²	154.6	67%	0.674	77%	0.77	S	S	*	*			trans	170.7	147.4	141.7	-98.5	161	154.3	-67.8	0	113.7
350	E	23.5	Very low	26.6	Very low	139 Å²	139	148.8 Å²	148.8	65%	0.65	77%	0.766	S	S	*	*			trans	46	133.4	145.9	-71	128	-147.6	0	0	118.8
351	E	22.9	Very low	25.7	Very low	169 Å²	169	147.3 Å²	147.3	79%	0.79	77%	0.767	S	S	*	*			cis	-160.1	-168.1	15.6	-129	167.4	-162.8	0	0	111.3
352	E	21.5	Very low	24.9	Very low	187 Å²	187	149.6 Å²	149.6	87%	0.874	78%	0.775	S	S	*	*			trans	-29.5	158.3	178.9	-56.9	178.7	161.6	0	0	120.9
353	G	23.6	Very low	24.5	Very low	77 Å²	77	146.7 Å²	146.7	79%	0.794	78%	0.775	S	S	*	*			trans	163.5	92.5	162.7	0	0	0	0	0	115.4
354	E	22.8	Very low	24.2	Very low	189 Å²	189	148.2 Å²	148.2	88%	0.883	78%	0.782	S	S	*	*			trans	-78.7	174.4	168.8	-66.8	-167.3	123.8	0	0	112.9
355	S	21.4	Very low	24.2	Very low	112 Å²	112	142.1 Å²	142.1	78%	0.783	77%	0.774	S	S	*	*			trans	76.2	149.3	161.9	85	0	0	0	0	117.2
356	E	22.1	Very low	24.2	Very low	142 Å²	142	145.1 Å²	145.1	66%	0.664	78%	0.778	S	S	*	*			cis	-165.2	164.8	-18.9	-117.3	-162.9	153.3	0	0	109.5
357	K	22.2	Very low	24.1	Very low	131 Å²	131	143.1 Å²	143.1	57%	0.57	77%	0.774	S	S	*	*			trans	62	118.3	146.9	-71.7	-176.5	174.4	107.3	0	119.2
358	E	22.5	Very low	24.3	Very low	159 Å²	159	142.9 Å²	142.9	74%	0.743	77%	0.767	S	S	*	*				79.1	151.8	92.1	-71.3	169.5	179.9	0	0	113.7
359	E	22.5	Very low	24.4	Very low	184 Å²	184	143.5 Å²	143.5	86%	0.86	77%	0.765	S	S	*	*			cis	-150	-176.7	-0.9	-139.8	-162.4	-177.9	0	0	110.2
360	G	24.7	Very low	24.6	Very low	58 Å²	58	142.7 Å²	142.7	60%	0.598	77%	0.768	S	S	*	*			trans	132.4	61.5	158.3	0	0	0	0	0	118.5
361	S	24.3	Very low	24.9	Very low	108 Å²	108	143.5 Å²	143.5	76%	0.755	78%	0.777	S	S	*	*				44.8	157	116.8	77.1	0	0	0	0	121.6
362	E	22.9	Very low	25.2	Very low	179 Å²	179	142.6 Å²	142.6	84%	0.836	78%	0.777	S	S	*	*			cis	-142.4	165.3	9.1	-68.7	178	166.6	0	0	111.2
363	A	26.3	Very low	25.5	Very low	84 Å²	84	141.1 Å²	141.1	69%	0.694	78%	0.775	S	S	*	*				143.8	109.3	117.8	0	0	0	0	0	116.7
364	E	26.6	Very low	25.7	Very low	204 Å²	204	144.8 Å²	144.8	95%	0.953	78%	0.777	S	S	*	*			trans	59.3	135.9	150	-55.7	-176.8	-163.7	0	0	120.7
365	G	26.4	Very low	25.9	Very low	72 Å²	72	143.1 Å²	143.1	74%	0.742	77%	0.774	S	S	*	*			cis	171.2	173	-4.1	0	0	0	0	0	114.2
366	E	27	Very low	26.2	Very low	194 Å²	194	145.9 Å²	145.9	91%	0.907	78%	0.775	S	S	*	*			trans	74	96.2	170.8	-59.2	-174	165.4	0	0	119.5
367	N	25.1	Very low	26.4	Very low	141 Å²	141	146.1 Å²	146.1	75%	0.754	78%	0.78	S	S	*	*				1	172.7	127.7	-49.8	6.3	0	0	0	119.3
368	E	29.7	Very low	26.6	Very low	157 Å²	157	146.2 Å²	146.2	73%	0.734	79%	0.787	S	S	*	*			cis	-167.2	157.9	29.3	-126.9	131.9	-115.5	0	0	104.8
369	E	28.7	Very low	26.8	Very low	172 Å²	172	144 Å²	144	80%	0.804	78%	0.784	S	S	*	*			cis	-145.7	171.9	14.5	-61	141.7	124.9	0	0	107.3
370	D	29.1	Very low	26.9	Very low	139 Å²	139	144.7 Å²	144.7	74%	0.743	79%	0.788	S	S	*	*			cis	-170.9	-168.4	-29.5	-77.2	-20.4	0	0	0	108.3
371	D	29.8	Very low	27	Very low	155 Å²	155	150.1 Å²	150.1	83%	0.829	80%	0.797	S	S	*	*			trans	81.6	68.4	167.7	-67.5	-9	0	0	0	122.5
372	D	29.2	Very low	27	Very low	151 Å²	151	153 Å²	153	81%	0.807	80%	0.799	S	S	*	*				47.6	168.2	101.1	-57.5	-7.1	0	0	0	126.6
373	D	28.3	Very low	27.1	Very low	155 Å²	155	147.5 Å²	147.5	83%	0.829	79%	0.79	S	S	*	*			trans	76.9	103.8	176.6	-60.4	-16.7	0	0	0	117.1
374	D	27.9	Very low	27.2	Very low	155 Å²	155	151.8 Å²	151.8	83%	0.829	80%	0.796	S	S	*	*			cis	91	161.7	37.6	-82.6	-11.6	0	0	0	116.8
375	D	28.2	Very low	27.1	Very low	154 Å²	154	149.2 Å²	149.2	82%	0.824	78%	0.784	S	S	*	*			trans	73.3	129.6	178.4	-69.7	-7.1	0	0	0	117.2
376	E	26.4	Very low	27.2	Very low	170 Å²	170	148.5 Å²	148.5	79%	0.794	78%	0.776	S	S	*	*			cis	60	123	10.6	-57.9	-175.1	-177.7	0	0	115.2
377	D	27.2	Very low	27.2	Very low	146 Å²	146	143.6 Å²	143.6	78%	0.781	76%	0.763	S	S	*	*			cis	-163.9	166.8	3.4	-106	4.8	0	0	0	107
378	D	25.9	Very low	27.5	Very low	133 Å²	133	140.1 Å²	140.1	71%	0.711	76%	0.761	S	S	*	*			cis	-169.4	-178.4	-17.7	-180	30.8	0	0	0	107
379	V	26.3	Very low	27.6	Very low	112 Å²	112	140.1 Å²	140.1	68%	0.679	76%	0.761	S	S	*	*			trans	64.8	122.5	166.9	-133.7	0	0	0	0	118.9
380	E	25.3	Very low	27.7	Very low	200 Å²	200	139.3 Å²	139.3	94%	0.935	76%	0.762	S	S	*	*				-161	162.8	112.5	-112.9	177.6	-161	0	0	111.3
381	E	25.7	Very low	27.8	Very low	172 Å²	172	140.5 Å²	140.5	80%	0.804	76%	0.763	S	S	*	*			trans	-120.2	-171.8	-159.7	-164.6	169.6	-149	0	0	111.7
382	E	25.2	Very low	27.7	Very low	168 Å²	168	139.5 Å²	139.5	79%	0.785	76%	0.758	S	S	*	*			trans	81.3	143.3	162.1	-65.1	-75.1	-166.9	0	0	120.8
383	G	26	Very low	27.7	Very low	64 Å²	64	135.4 Å²	135.4	66%	0.66	75%	0.751	S	S	*	*			trans	84	103.1	173.2	0	0	0	0	0	115.2
384	E	26.8	Very low	28	Very low	173 Å²	173	136.5 Å²	136.5	81%	0.808	75%	0.751	S	S	*	*			cis	53.9	129.2	32.6	-104.3	-176.4	-147.6	0	0	111.7
385	E	25.8	Very low	28	Very low	151 Å²	151	133.9 Å²	133.9	71%	0.706	75%	0.745	S	S	*	*			cis	-141.1	171.3	22.4	-96.3	-82.7	102.7	0	0	109
386	G	27.1	Very low	28	Very low	56 Å²	56	133.1 Å²	133.1	58%	0.577	74%	0.741	S	S	*	*			cis	135.5	178.1	6.9	0	0	0	0	0	111.3
387	S	28.4	Very low	28	Very low	91 Å²	91	132.4 Å²	132.4	64%	0.636	74%	0.741	S	S	*	*			trans	58.2	145.7	163.4	178.7	0	0	0	0	119	E389	S387-E389 WeakPolarHBondContact CB-OE1 3.41Å; S387-E389 PolarHBondContact OG-OE1 2.7Å
388	G	30.7	Very low	28.2	Very low	68 Å²	68	134 Å²	134	70%	0.701	74%	0.744	S	S	*	*			cis	-174.7	-167.5	3.6	0	0	0	0	0	109.2
389	E	31.1	Very low	28.3	Very low	158 Å²	158	133.5 Å²	133.5	74%	0.738	75%	0.751	S	S	*	*			cis	162.2	-178.8	2.9	-104.2	162.4	-141	0	0	104.3	S387	S387-E389 WeakPolarHBondContact CB-OE1 3.41Å; S387-E389 PolarHBondContact OG-OE1 2.7Å
390	D	30.9	Very low	28.3	Very low	154 Å²	154	136.7 Å²	136.7	82%	0.824	76%	0.759	S	S	*	*				-145.4	-148.5	-80.4	-125.5	70.8	0	0	0	106.8
391	E	31.7	Very low	28.3	Very low	165 Å²	165	134.4 Å²	134.4	77%	0.771	75%	0.748	S	S	*	*			cis	-150.4	-143.3	8.8	-156.7	-169.4	146.3	0	0	108
392	D	27.8	Very low	28.2	Very low	134 Å²	134	133.7 Å²	133.7	72%	0.717	75%	0.745	S	S	*	*			trans	67.1	117.5	163.4	-65.9	-27	0	0	0	119.2
393	G	30.2	Very low	28.2	Very low	64 Å²	64	131 Å²	131	66%	0.66	74%	0.744	S	S	*	*			cis	117.3	157	-3.3	0	0	0	0	0	114.5
394	H	32.6	Very low	28.2	Very low	178 Å²	178	136.8 Å²	136.8	82%	0.824	75%	0.754	S	S	*	*			trans	67.8	142.7	-180	-52.5	-56.5	0	0	0	117.1
395	S	27.8	Very low	28	Very low	101 Å²	101	134.7 Å²	134.7	71%	0.706	75%	0.748	S	S	*	*			cis	-161	124.8	-14.5	50.5	0	0	0	0	111.9
396	D	29	Very low	28.1	Very low	138 Å²	138	134.8 Å²	134.8	74%	0.738	75%	0.749	S	S	*	*				32.6	124.2	118.3	-168.2	29	0	0	0	120.4
397	L	26.9	Very low	28	Very low	154 Å²	154	140.5 Å²	140.5	81%	0.806	76%	0.76	S	S	*	*				179.8	128.2	118.2	-96.5	172.8	0	0	0	112.5
398	E	30.9	Very low	27.8	Very low	180 Å²	180	142.1 Å²	142.1	84%	0.841	76%	0.762	S	S	*	*			trans	-96.3	140.4	162.4	-64.4	-173.4	136.5	0	0	110.8
399	S	27.5	Very low	27.5	Very low	123 Å²	123	146.3 Å²	146.3	86%	0.86	77%	0.769	S	S	*	*			trans	-170.6	138.7	138.7	14.5	0	0	0	0	115.1
400	E	26.8	Very low	27.3	Very low	179 Å²	179	146.6 Å²	146.6	84%	0.836	77%	0.77	S	S	*	*			trans	-31.3	164.5	174.1	-53.9	-170.3	122.8	0	0	123.5
401	Q	24.8	Very low	27.1	Very low	151 Å²	151	147 Å²	147	71%	0.706	77%	0.767	S	S	*	*			trans	90.1	105.4	144.3	-86.1	-171	-42.4	0	0	123.6
402	E	24.6	Very low	26.9	Very low	158 Å²	158	147.3 Å²	147.3	74%	0.738	77%	0.768	S	S	*	*				67.4	134	125.1	-73.3	177.7	-132.9	0	0	124.1
403	S	25.1	Very low	27	Very low	110 Å²	110	148.6 Å²	148.6	77%	0.769	77%	0.77	S	S	*	*			trans	96.5	123.1	142.1	72.8	0	0	0	0	122.2
404	E	25.2	Very low	26.9	Very low	186 Å²	186	148.9 Å²	148.9	87%	0.869	77%	0.766	S	S	*	*			trans	56.6	98.1	140	-61.8	-174.2	-168.2	0	0	123.3
405	N	24	Very low	26.6	Very low	129 Å²	129	145.4 Å²	145.4	69%	0.69	76%	0.761	S	S	*	*				70.5	135.5	107	-146.7	41	0	0	0	123.3
406	E	26.9	Very low	26.4	Very low	154 Å²	154	145.1 Å²	145.1	72%	0.72	76%	0.759	S	S	*	*			trans	76	144.7	147.5	-97.3	160.4	-135	0	0	124.1
407	E	25	Very low	26.4	Very low	175 Å²	175	143.6 Å²	143.6	82%	0.818	76%	0.76	S	S	*	*			trans	59.1	98.2	160.5	-58.8	-165.1	153.8	0	0	122.7
408	N	24.6	Very low	26.5	Very low	126 Å²	126	146.8 Å²	146.8	67%	0.674	76%	0.761	S	S	*	*				59	122.7	111.7	-160.5	90.6	0	0	0	121.5
409	D	23.6	Very low	26.5	Very low	156 Å²	156	147.8 Å²	147.8	83%	0.834	77%	0.766	S	S	*	*			trans	-162.2	157.7	130.9	-109.2	-9.8	0	0	0	114.4
410	E	26.5	Very low	26.6	Very low	163 Å²	163	149.4 Å²	149.4	76%	0.762	76%	0.76	S	S	*	*			trans	-95.8	174.1	176.9	-57.2	169.6	142.3	0	0	109.3
411	E	27	Very low	26.6	Very low	163 Å²	163	148.4 Å²	148.4	76%	0.762	76%	0.755	S	S	*	*			cis	-162.7	166	9.8	-146.8	174.5	-154.1	0	0	110.3
412	E	29.2	Very low	26.8	Very low	171 Å²	171	148.8 Å²	148.8	80%	0.799	76%	0.757	S	S	*	*			trans	2.3	176.1	163.4	-67.9	-169.1	170.1	0	0	124.8
413	E	27.9	Very low	27	Very low	162 Å²	162	148.8 Å²	148.8	76%	0.757	76%	0.757	S	S	*	*			cis	-132.8	-163.1	-0.2	-143.8	-127	126.2	0	0	107.2	S415	E413-S415 PolarHBondContact OE1-N 3.33Å
414	A	28.1	Very low	27.4	Very low	69 Å²	69	150.6 Å²	150.6	57%	0.57	75%	0.753	S	S	*	*			cis	-155.8	145.3	15	0	0	0	0	0	117.9
415	S	27.3	Very low	28.2	Very low	105 Å²	105	148.6 Å²	148.6	73%	0.734	75%	0.754	S	S	*	*			trans	65.6	156.5	152.2	87.4	0	0	0	0	119.8	E413	E413-S415 PolarHBondContact OE1-N 3.33Å
416	S	24.6	Very low	29	Very low	95 Å²	95	146.4 Å²	146.4	66%	0.664	74%	0.742	S	S	*	*			cis	-149.3	135.6	8.7	70.5	0	0	0	0	115.6
417	S	28.9	Very low	30.2	Very low	107 Å²	107	143.9 Å²	143.9	75%	0.748	73%	0.733	S	S	*	*			trans	64.1	148.2	136.8	78.5	0	0	0	0	122.3
418	R	28.8	Very low	31.5	Very low	220 Å²	220	145.2 Å²	145.2	83%	0.83	73%	0.731	S	S	*	*			cis	-172.1	118.3	-32.9	-120.9	-179.9	-172.3	174.1	4.2	108.8
419	Q	29.2	Very low	33	Very low	201 Å²	201	146.3 Å²	146.3	94%	0.939	73%	0.732	S	S	*	*			trans	-142.7	140.9	145.1	-74.5	-160	3.5	0	0	108.8
420	Q	29.7	Very low	34.6	Very low	158 Å²	158	143.2 Å²	143.2	74%	0.738	71%	0.712	S	S	*	*			trans	-127.9	139.6	-179.9	-64.6	176.3	-33.4	0	0	108.4
421	Q	28.2	Very low	36	Very low	157 Å²	157	140 Å²	140	73%	0.734	70%	0.7	S	S	*	*				174.5	117	103.7	-91.8	178.7	10.3	0	0	113.6
422	Q	28.4	Very low	37.5	Very low	159 Å²	159	137.9 Å²	137.9	74%	0.743	69%	0.688	S	S	*	*			trans	69.1	153.7	136.1	-59.8	-177	-3	0	0	121.9
423	Q	28.8	Very low	38.9	Very low	159 Å²	159	132.4 Å²	132.4	74%	0.743	67%	0.672	S	S	*	*			trans	74.6	128.7	171.9	-49.8	-170.9	31.4	0	0	114.9
424	Q	33.8	Very low	40.2	Very low	147 Å²	147	132.8 Å²	132.8	69%	0.687	67%	0.666	S	S	*	*			cis	-151.9	153.9	-2.1	-116.2	163.9	16.4	0	0	109.7	L426	Q424-L426 PolarHBondContact O-N 2.8Å
425	T	41.7	Very low	41.2	Very low	144 Å²	144	135.1 Å²	135.1	88%	0.883	67%	0.666	S	S	*	*			trans	-73	103.8	171.7	47.9	0	0	0	0	109.7
426	L	40.3	Very low	42.7	Very low	83 Å²	83	136.3 Å²	136.3	44%	0.435	66%	0.66	S	S	.	*			trans	-77.8	147	173.3	-60.7	-175.8	0	0	0	111.1	Q424 E430	Q424-L426 PolarHBondContact O-N 2.8Å; L426-E430 WeakPolarHBondContact CA-OE2 3.45Å; L426-E430 HydrophobicContact CB-CB 4.27Å
427	N	52.6	Low	44.3	Very low	101 Å²	101	134 Å²	134	54%	0.54	65%	0.646	S	S	.	*			trans	-73.3	157.9	-168.2	-130.9	-22	0	0	0	112.2	E429 E430 L431	N427-E429 PolarHBondContact O-N 3.27Å; N427-E429 VanDerWaalsContact O-N 3.11Å; N427-E430 HydrophobicContact CB-CB 4.5Å; N427-E430 HydrophobicContact CB-CG 4.15Å; N427-E430 WeakPolarHBondContact CB-OE2 3.31Å; N427-E430 PolarHBondContact N-OE2 2.8Å; N427-E430 PolarHBondContact O-N 3.4Å; N427-L431 PolarHBondContact O-N 2.83Å
428	R	52.5	Low	45.5	Very low	204 Å²	204	131.6 Å²	131.6	77%	0.77	63%	0.633	S	S	*	*	H	α-helix	trans	-61.6	-22.6	174.6	-167.5	168.1	70.7	168.2	0.5	112.3	K432	R428-K432 WeakPolarHBondContact O-CG 3.5Å; R428-K432 PolarHBondContact O-N 3.12Å; R428-K432 VanDerWaalsContact O-N 3.11Å
429	E	56.9	Low	46.7	Very low	148 Å²	148	129.5 Å²	129.5	69%	0.692	63%	0.63	S	S	*	*	H	α-helix	trans	-77.4	-34.2	172.8	-63.6	178.2	157.3	0	0	112.4	N427 K432 A433	N427-E429 PolarHBondContact O-N 3.27Å; N427-E429 VanDerWaalsContact O-N 3.11Å; E429-K432 PolarHBondContact O-N 2.9Å; E429-A433 WeakPolarHBondContact O-CB 3.47Å; E429-A433 PolarHBondContact O-N 3.47Å
430	E	55.4	Low	48.1	Very low	91 Å²	91	123 Å²	123	43%	0.425	61%	0.61	S	S	.	*	H	α-helix	trans	-74.5	-32	173.9	-65.3	175.8	109.8	0	0	111.8	L426 N427 R434	L426-E430 WeakPolarHBondContact CA-OE2 3.45Å; L426-E430 HydrophobicContact CB-CB 4.27Å; N427-E430 HydrophobicContact CB-CB 4.5Å; N427-E430 HydrophobicContact CB-CG 4.15Å; N427-E430 WeakPolarHBondContact CB-OE2 3.31Å; N427-E430 PolarHBondContact N-OE2 2.8Å; N427-E430 PolarHBondContact O-N 3.4Å; E430-R434 WeakPolarHBondContact O-CB 3.32Å; E430-R434 PolarHBondContact O-N 2.96Å
431	L	56.8	Low	49.6	Very low	96 Å²	96	122.5 Å²	122.5	50%	0.503	61%	0.608	S	S	.	*	H	α-helix	trans	-66	-39.9	168.2	-82.6	163.3	0	0	0	111.8	N427 R434 Q435	N427-L431 PolarHBondContact O-N 2.83Å; L431-R434 PolarHBondContact O-N 2.68Å; L431-Q435 WeakPolarHBondContact O-CB 3.4Å; L431-Q435 VanDerWaalsContact O-CG 3.3Å; L431-Q435 WeakPolarHBondContact O-CG 3.36Å; L431-Q435 PolarHBondContact O-N 2.87Å
432	K	57.9	Low	51.6	Low	119 Å²	119	116 Å²	116	52%	0.517	58%	0.578	S	S	.	*	H	α-helix	trans	-66.4	-44.2	171.4	-81.2	-172.8	171	-165.4	0	112.3	R428 E429 R434 Q435 E436	R428-K432 WeakPolarHBondContact O-CG 3.5Å; R428-K432 PolarHBondContact O-N 3.12Å; R428-K432 VanDerWaalsContact O-N 3.11Å; E429-K432 PolarHBondContact O-N 2.9Å; K432-R434 VanDerWaalsContact C-N 3.28Å; K432-R434 PolarHBondContact O-N 3.48Å; K432-Q435 CarbonylContact O-C 3.5Å; K432-Q435 WeakPolarHBondContact O-CA 3.43Å; K432-Q435 PolarHBondContact O-N 3Å; K432-E436 WeakPolarHBondContact O-CB 3.35Å; K432-E436 WeakPolarHBondContact O-CG 3.47Å; K432-E436 PolarHBondContact O-N 3.34Å
433	A	58.2	Low	53.9	Low	55 Å²	55	112.1 Å²	112.1	46%	0.455	57%	0.567	S	S	.	*	H	α-helix	trans	-61.5	-36.5	174.9	0	0	0	0	0	111.8	E429 A437	E429-A433 WeakPolarHBondContact O-CB 3.47Å; E429-A433 PolarHBondContact O-N 3.47Å; A433-A437 WeakPolarHBondContact O-CB 3.44Å; A433-A437 PolarHBondContact O-N 3.14Å
434	R	55.2	Low	55.8	Low	171 Å²	171	113 Å²	113	65%	0.645	57%	0.565	S	S	*	*	H	α-helix	trans	-67.3	-36	169.4	-89.2	-177.4	158.1	-179.5	-5.8	113.2	E430 L431 K432 A438	E430-R434 WeakPolarHBondContact O-CB 3.32Å; E430-R434 PolarHBondContact O-N 2.96Å; L431-R434 PolarHBondContact O-N 2.68Å; K432-R434 VanDerWaalsContact C-N 3.28Å; K432-R434 PolarHBondContact O-N 3.48Å; R434-A438 WeakPolarHBondContact O-CB 3.5Å; R434-A438 PolarHBondContact O-N 3.39Å
435	Q	50.5	Low	57.9	Low	118 Å²	118	110.8 Å²	110.8	55%	0.551	56%	0.561	S	S	*	*	H	α-helix	trans	-74.6	-28.5	175.3	-75.2	173.7	-8.9	0	0	112.9	L431 K432 K439	L431-Q435 WeakPolarHBondContact O-CB 3.4Å; L431-Q435 VanDerWaalsContact O-CG 3.3Å; L431-Q435 WeakPolarHBondContact O-CG 3.36Å; L431-Q435 PolarHBondContact O-N 2.87Å; K432-Q435 CarbonylContact O-C 3.5Å; K432-Q435 WeakPolarHBondContact O-CA 3.43Å; K432-Q435 PolarHBondContact O-N 3Å; Q435-K439 WeakPolarHBondContact O-CB 3.41Å; Q435-K439 WeakPolarHBondContact O-CG 3.25Å; Q435-K439 PolarHBondContact O-N 3.14Å
436	E	59	Low	59.8	Low	130 Å²	130	105.3 Å²	105.3	61%	0.607	53%	0.525	S	S	*	.	H	α-helix	trans	-78.3	-38	173.1	-73.1	168.5	-175.1	0	0	110.7	K432 K439 A440	K432-E436 WeakPolarHBondContact O-CB 3.35Å; K432-E436 WeakPolarHBondContact O-CG 3.47Å; K432-E436 PolarHBondContact O-N 3.34Å; E436-K439 PolarHBondContact O-N 2.81Å; E436-A440 PolarHBondContact O-N 2.87Å
437	A	57	Low	61.7	Low	45 Å²	45	105.1 Å²	105.1	37%	0.372	54%	0.535	S	S	.	.	H	α-helix	trans	-61.5	-45.6	166.5	0	0	0	0	0	111.7	A433 K439 A440 E441	A433-A437 WeakPolarHBondContact O-CB 3.44Å; A433-A437 PolarHBondContact O-N 3.14Å; A437-K439 PolarHBondContact O-N 2.92Å; A437-A440 CarbonylContact O-C 3.49Å; A437-A440 WeakPolarHBondContact O-CA 3.26Å; A437-A440 WeakPolarHBondContact O-CB 3.31Å; A437-A440 PolarHBondContact O-N 2.93Å; A437-E441 PolarHBondContact O-N 3.4Å
438	A	54.1	Low	63.1	Low	58 Å²	58	100.4 Å²	100.4	48%	0.479	51%	0.511	S	S	.	.	H	α-helix	trans	-67.7	-16.6	175.6	0	0	0	0	0	113.8	R434	R434-A438 WeakPolarHBondContact O-CB 3.5Å; R434-A438 PolarHBondContact O-N 3.39Å
439	K	55.6	Low	64.7	Low	175 Å²	175	91.1 Å²	91.1	76%	0.761	48%	0.477	S	S	*	.	H	α-helix	trans	-86.4	-21	167.8	-77.2	170.4	-178.8	-177.3	0	113	Q435 E436 A437	Q435-K439 WeakPolarHBondContact O-CB 3.41Å; Q435-K439 WeakPolarHBondContact O-CG 3.25Å; Q435-K439 PolarHBondContact O-N 3.14Å; E436-K439 PolarHBondContact O-N 2.81Å; A437-K439 PolarHBondContact O-N 2.92Å
440	A	57.8	Low	65.9	Low	65 Å²	65	89.7 Å²	89.7	54%	0.537	47%	0.47	S	S	.	.	H	α-helix	trans	-82.7	-29.1	168.6	0	0	0	0	0	112	E436 A437 L442	E436-A440 PolarHBondContact O-N 2.87Å; A437-A440 CarbonylContact O-C 3.49Å; A437-A440 WeakPolarHBondContact O-CA 3.26Å; A437-A440 WeakPolarHBondContact O-CB 3.31Å; A437-A440 PolarHBondContact O-N 2.93Å; A440-L442 PolarHBondContact O-N 2.78Å; A440-L442 VanDerWaalsContact O-N 3.15Å
441	E	61.8	Low	67.4	Low	147 Å²	147	87.4 Å²	87.4	69%	0.687	46%	0.464	S	S	*	.	S	Bend	trans	-75.2	93.9	170.9	-71.1	178.6	-167.7	0	0	110.6	A437	A437-E441 PolarHBondContact O-N 3.4Å
442	L	69.3	Low	68.8	Low	21 Å²	21	85.1 Å²	85.1	11%	0.11	45%	0.449	C	S	.	.			trans	-52.7	144.5	175.6	-72.4	167.2	0	0	0	112.6	A440 F446 N466 L469 I470 R473	A440-L442 PolarHBondContact O-N 2.78Å; A440-L442 VanDerWaalsContact O-N 3.15Å; L442-F446 HydrophobicContact CB-CZ 4.39Å; L442-F446 HydrophobicContact CD2-CZ 4.49Å; L442-N466 HydrophobicContact CD1-CB 3.77Å; L442-L469 HydrophobicContact CB-CD2 4.48Å; L442-L469 HydrophobicContact CD1-CD2 3.67Å; L442-I470 HydrophobicContact CD1-CD1 4.17Å; L442-I470 HydrophobicContact CD1-CG1 3.7Å; L442-I470 HydrophobicContact CD2-CD1 3.8Å; L442-I470 HydrophobicContact CD2-CG1 3.92Å; L442-I470 HydrophobicContact CG-CG1 4.37Å; L442-R473 PolarHBondContact O-NH1 2.81Å
443	P	76.4	Confident	70.3	Confident	77 Å²	77	86 Å²	86	50%	0.5	46%	0.455	S	S	.	.			trans	-51.1	140	170.3	-28.8	35.1	0	0	0	113.5	F446 R473	P443-F446 HydrophobicContact CB-CE1 4.03Å; P443-F446 HydrophobicContact CB-CZ 4.01Å; P443-F446 HydrophobicContact CG-CE1 4.14Å; P443-F446 HydrophobicContact CG-CZ 4.24Å; P443-F446 WeakPolarHBondContact O-CE2 3.39Å; P443-F446 WeakPolarHBondContact O-CZ 3.38Å; P443-R473 VanDerWaalsContact C-NH1 3.31Å; P443-R473 PolarHBondContact O-NH1 3.09Å
444	Y	69.6	Low	71.6	Confident	179 Å²	179	87.1 Å²	87.1	70%	0.702	45%	0.453	S	S	*	.	S	Bend	trans	-71.2	-35.9	-179.8	-173.3	-102.8	0	0	0	112.5
445	T	77.2	Confident	73.1	Confident	100 Å²	100	79.1 Å²	79.1	61%	0.613	42%	0.423	S	S	*	.			trans	-106	131.5	-179.1	49.9	0	0	0	0	111.6
446	F	81.6	Confident	74.8	Confident	29 Å²	29	76.5 Å²	76.5	13%	0.127	41%	0.41	C	S	.	.			trans	-128.9	138.5	170	-65.5	-75.3	0	0	0	110.1	L442 P443 L458 I470 R473 T474 N478	L442-F446 HydrophobicContact CB-CZ 4.39Å; L442-F446 HydrophobicContact CD2-CZ 4.49Å; P443-F446 HydrophobicContact CB-CE1 4.03Å; P443-F446 HydrophobicContact CB-CZ 4.01Å; P443-F446 HydrophobicContact CG-CE1 4.14Å; P443-F446 HydrophobicContact CG-CZ 4.24Å; P443-F446 WeakPolarHBondContact O-CE2 3.39Å; P443-F446 WeakPolarHBondContact O-CZ 3.38Å; F446-L458 HydrophobicContact CD1-CD1 3.77Å; F446-L458 HydrophobicContact CE1-CD1 3.91Å; F446-I470 HydrophobicContact CD1-CG2 4.46Å; F446-I470 HydrophobicContact CD2-CG2 4.12Å; F446-I470 HydrophobicContact CE1-CG2 4.36Å; F446-I470 HydrophobicContact CE2-CB 4.18Å; F446-I470 HydrophobicContact CE2-CG1 3.98Å; F446-I470 HydrophobicContact CE2-CG2 4.01Å; F446-I470 HydrophobicContact CG-CG2 4.35Å; F446-I470 HydrophobicContact CZ-CB 4.42Å; F446-I470 HydrophobicContact CZ-CG1 3.85Å; F446-I470 HydrophobicContact CZ-CG2 4.13Å; F446-R473 HydrophobicContact CD2-CB 3.78Å; F446-R473 HydrophobicContact CE2-CB 4.18Å; F446-T474 WeakPolarHBondContact CB-OG1 3.43Å; F446-N478 PolarHBondContact O-ND2 3Å
447	A	80.6	Confident	76.1	Confident	78 Å²	78	76.3 Å²	76.3	65%	0.645	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-69.9	149.4	167.3	0	0	0	0	0	110
448	A	82.3	Confident	77.4	Confident	3 Å²	3	76.3 Å²	76.3	3%	0.025	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-70.1	127	167.2	0	0	0	0	0	109.7	T474 N478 K489	A448-T474 HydrophobicContact CB-CG2 4.27Å; A448-N478 HydrophobicContact CB-CB 4.06Å; A448-N478 PolarHBondContact N-ND2 3.48Å; A448-N478 PolarHBondContact N-OD1 3.27Å; A448-N478 VanDerWaalsContact N-OD1 3.13Å; A448-K489 HydrophobicContact CB-CB 3.86Å; A448-K489 HydrophobicContact CB-CD 4.21Å
449	P	85.1	Confident	78.8	Confident	9 Å²	9	73.5 Å²	73.5	6%	0.058	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-64.4	150.5	178.9	26	-33.2	0	0	0	111.3	D454 L455 L493	P449-D454 HydrophobicContact CB-CB 3.61Å; P449-L455 HydrophobicContact CB-CB 4.19Å; P449-L455 HydrophobicContact CG-CB 3.94Å; P449-L455 HydrophobicContact CG-CD1 4.08Å; P449-L493 HydrophobicContact CG-CD1 3.88Å
450	E	82.7	Confident	80	Confident	118 Å²	118	71 Å²	71	55%	0.551	38%	0.375	S	S	*	.	S	Bend	trans	-106.7	-24.4	-177.5	-60.8	-165.8	-175.7	0	0	112.5	D454 K489 F496	E450-D454 PolarHBondContact N-OD2 3.47Å; E450-K489 WeakPolarHBondContact OE1-CE 3.37Å; E450-K489 IonicContact OE1-NZ 2.72Å; E450-K489 PolarHBondContact OE1-NZ 2.85Å; E450-F496 WeakPolarHBondContact O-CE2 3.23Å; E450-F496 WeakPolarHBondContact O-CZ 3.44Å
451	S	87.9	Confident	80.9	Confident	43 Å²	43	71.6 Å²	71.6	30%	0.301	39%	0.386	S	S	.	.	S	Bend	trans	-112.3	159.9	170.4	-175.2	0	0	0	0	112.4	E453 D454 L455	S451-E453 PolarHBondContact O-N 2.96Å; S451-E453 PolarHBondContact OG-N 2.74Å; S451-D454 PolarHBondContact N-OD2 2.88Å; S451-L455 PolarHBondContact O-N 3.37Å
452	Y	86.2	Confident	82	Confident	47 Å²	47	67.9 Å²	67.9	18%	0.184	37%	0.369	C	S	.	.	H	α-helix	trans	-60.5	-36.1	166.2	175.8	-99.3	0	0	0	111.8	L455 K456 F496 E499 E503	Y452-L455 PolarHBondContact O-N 2.97Å; Y452-K456 HydrophobicContact CE1-CD 3.97Å; Y452-K456 WeakPolarHBondContact O-CB 3.47Å; Y452-K456 PolarHBondContact O-N 2.79Å; Y452-F496 HydrophobicContact CD2-CB 4.27Å; Y452-E499 HydrophobicContact CD2-CB 3.98Å; Y452-E499 WeakPolarHBondContact CD2-OE2 3.26Å; Y452-E499 HydrophobicContact CE2-CB 3.7Å; Y452-E503 PolarHBondContact OH-OE2 3.3Å
453	E	87.8	Confident	82.8	Confident	139 Å²	139	70.4 Å²	70.4	65%	0.65	39%	0.386	S	S	*	.	H	α-helix	trans	-66.8	-43.1	-178.6	-61.3	-174.3	145.3	0	0	111.1	S451 L455 K456 D457	S451-E453 PolarHBondContact O-N 2.96Å; S451-E453 PolarHBondContact OG-N 2.74Å; E453-L455 VanDerWaalsContact C-N 3.31Å; E453-L455 PolarHBondContact O-N 3.06Å; E453-K456 WeakPolarHBondContact O-CB 3.13Å; E453-K456 PolarHBondContact O-N 3.25Å; E453-K456 VanDerWaalsContact O-N 3.12Å; E453-D457 PolarHBondContact O-N 2.77Å
454	D	86.4	Confident	83.2	Confident	77 Å²	77	68.6 Å²	68.6	41%	0.412	37%	0.374	S	S	.	.	H	α-helix	trans	-55.6	-44.5	173.1	-44.9	-20.1	0	0	0	111.9	P449 E450 S451 L458	P449-D454 HydrophobicContact CB-CB 3.61Å; E450-D454 PolarHBondContact N-OD2 3.47Å; S451-D454 PolarHBondContact N-OD2 2.88Å; D454-L458 WeakPolarHBondContact O-CB 3.37Å; D454-L458 PolarHBondContact O-N 3.4Å
455	L	86.6	Confident	84.1	Confident	3 Å²	3	64.3 Å²	64.3	2%	0.016	36%	0.363	C	S	.	.	H	α-helix	trans	-65.6	-41.6	178.5	177.3	66.8	0	0	0	111	P449 S451 Y452 E453 L458 L459 L493 F496 L497	P449-L455 HydrophobicContact CB-CB 4.19Å; P449-L455 HydrophobicContact CG-CB 3.94Å; P449-L455 HydrophobicContact CG-CD1 4.08Å; S451-L455 PolarHBondContact O-N 3.37Å; Y452-L455 PolarHBondContact O-N 2.97Å; E453-L455 VanDerWaalsContact C-N 3.31Å; E453-L455 PolarHBondContact O-N 3.06Å; L455-L458 PolarHBondContact O-N 2.86Å; L455-L459 HydrophobicContact CD1-CD1 3.79Å; L455-L459 HydrophobicContact CD1-CG 4.17Å; L455-L459 HydrophobicContact CG-CD1 4.12Å; L455-L459 WeakPolarHBondContact O-CG 3.46Å; L455-L459 PolarHBondContact O-N 3.41Å; L455-L459 VanDerWaalsContact O-N 3.12Å; L455-L493 HydrophobicContact CD1-CD1 3.97Å; L455-L493 HydrophobicContact CD2-CD1 4.22Å; L455-F496 HydrophobicContact CD2-CB 3.49Å; L455-F496 VanDerWaalsContact CD2-CB 3.49Å; L455-L497 HydrophobicContact CD1-CD2 4.34Å; L455-L497 HydrophobicContact CD2-CD2 4.06Å; L455-L497 HydrophobicContact CD2-CG 4.15Å
456	K	85.7	Confident	84.6	Confident	64 Å²	64	61.8 Å²	61.8	28%	0.278	35%	0.346	S	S	.	.	H	α-helix	trans	-63.5	-45.7	-179.5	-179.7	169.4	179	165.8	0	111.4	Y452 E453 L459 H460 Y500 E503	Y452-K456 HydrophobicContact CE1-CD 3.97Å; Y452-K456 WeakPolarHBondContact O-CB 3.47Å; Y452-K456 PolarHBondContact O-N 2.79Å; E453-K456 WeakPolarHBondContact O-CB 3.13Å; E453-K456 PolarHBondContact O-N 3.25Å; E453-K456 VanDerWaalsContact O-N 3.12Å; K456-L459 PolarHBondContact O-N 3.43Å; K456-H460 WeakPolarHBondContact O-CB 3.43Å; K456-H460 PolarHBondContact O-N 3.32Å; K456-Y500 HydrophobicContact CG-CE2 4.35Å; K456-E503 VanDerWaalsContact CE-OE1 3.29Å; K456-E503 WeakPolarHBondContact CE-OE1 3.47Å; K456-E503 WeakPolarHBondContact CE-OE2 3.48Å; K456-E503 IonicContact NZ-OE1 2.58Å; K456-E503 PolarHBondContact NZ-OE1 3.16Å; K456-E503 IonicContact NZ-OE2 3.78Å; K456-E503 PolarHBondContact NZ-OE2 2.98Å
457	D	86.2	Confident	84.9	Confident	125 Å²	125	60.8 Å²	60.8	67%	0.668	34%	0.341	S	S	*	.	H	α-helix	trans	-68.7	-40.3	177.4	-78.6	-3	0	0	0	111.8	E453 L459 H460	E453-D457 PolarHBondContact O-N 2.77Å; D457-L459 PolarHBondContact O-N 3.07Å; D457-H460 PolarHBondContact O-N 3.49Å
458	L	84.6	Confident	85.3	Confident	45 Å²	45	61.9 Å²	61.9	24%	0.236	33%	0.329	C	S	.	.	H	α-helix	trans	-61	-25.7	175.1	-180	63.9	0	0	0	113.5	F446 D454 L455 H462 I470	F446-L458 HydrophobicContact CD1-CD1 3.77Å; F446-L458 HydrophobicContact CE1-CD1 3.91Å; D454-L458 WeakPolarHBondContact O-CB 3.37Å; D454-L458 PolarHBondContact O-N 3.4Å; L455-L458 PolarHBondContact O-N 2.86Å; L458-H462 PolarHBondContact O-CD2 3.43Å; L458-I470 HydrophobicContact CD1-CG2 4.14Å; L458-I470 HydrophobicContact CD2-CG2 4.04Å; L458-I470 HydrophobicContact CG-CG2 3.87Å
459	L	84.1	Confident	85.6	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-102.9	-10.9	178.3	-62.3	-179.2	0	0	0	113.7	L455 K456 D457 Q467 I470 V471 Y500	L455-L459 HydrophobicContact CD1-CD1 3.79Å; L455-L459 HydrophobicContact CD1-CG 4.17Å; L455-L459 HydrophobicContact CG-CD1 4.12Å; L455-L459 WeakPolarHBondContact O-CG 3.46Å; L455-L459 PolarHBondContact O-N 3.41Å; L455-L459 VanDerWaalsContact O-N 3.12Å; K456-L459 PolarHBondContact O-N 3.43Å; D457-L459 PolarHBondContact O-N 3.07Å; L459-Q467 HydrophobicContact CB-CG 4.22Å; L459-Q467 HydrophobicContact CD2-CB 4.03Å; L459-Q467 HydrophobicContact CD2-CG 4.19Å; L459-I470 HydrophobicContact CD2-CB 4.2Å; L459-I470 HydrophobicContact CD2-CD1 4.4Å; L459-I470 HydrophobicContact CD2-CG2 4.06Å; L459-V471 HydrophobicContact CD1-CG2 4.33Å; L459-V471 HydrophobicContact CD2-CG2 4.05Å; L459-Y500 HydrophobicContact CB-CE1 4.3Å; L459-Y500 HydrophobicContact CB-CE2 4.46Å; L459-Y500 WeakPolarHBondContact CB-OH 3.28Å; L459-Y500 HydrophobicContact CD1-CD1 3.99Å; L459-Y500 HydrophobicContact CD1-CE1 3.62Å
460	H	80.4	Confident	85.8	Confident	123 Å²	123	64.9 Å²	64.9	57%	0.569	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	142.8	-175.5	-160.8	76.7	0	0	0	112.3	K456 D457 H462	K456-H460 WeakPolarHBondContact O-CB 3.43Å; K456-H460 PolarHBondContact O-N 3.32Å; D457-H460 PolarHBondContact O-N 3.49Å; H460-H462 PolarHBondContact O-N 2.98Å
461	G	77	Confident	86.1	Confident	76 Å²	76	59.5 Å²	59.5	78%	0.784	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	70	-7.8	178.6	0	0	0	0	0	116.3
462	H	83.6	Confident	86.1	Confident	70 Å²	70	58.1 Å²	58.1	32%	0.324	31%	0.31	S	S	.	.			trans	-85.4	147.8	178.3	-69.5	-51	0	0	0	112.9	L458 H460 N466 Q467 I470	L458-H462 PolarHBondContact O-CD2 3.43Å; H460-H462 PolarHBondContact O-N 2.98Å; H462-N466 HydrophobicContact CB-CB 4.14Å; H462-Q467 HydrophobicContact CB-CG 3.91Å; H462-Q467 PolarHBondContact O-NE2 3.34Å; H462-I470 HydrophobicContact CB-CD1 4.33Å; H462-I470 WeakPolarHBondContact CD2-CD1 3.27Å
463	T	87.3	Confident	86.3	Confident	74 Å²	74	58.9 Å²	58.9	45%	0.454	31%	0.313	S	S	.	.			trans	-64	155.2	173.9	64.3	0	0	0	0	110.9	D465 N466 Q467	T463-D465 VanDerWaalsContact C-N 3.25Å; T463-D465 PolarHBondContact O-N 3.07Å; T463-N466 CarbonylContact O-C 3.58Å; T463-N466 WeakPolarHBondContact O-CA 3.39Å; T463-N466 WeakPolarHBondContact O-CB 3.17Å; T463-N466 PolarHBondContact O-N 3.45Å; T463-N466 VanDerWaalsContact OG1-CB 3.27Å; T463-N466 WeakPolarHBondContact OG1-CB 3.29Å; T463-N466 PolarHBondContact OG1-N 2.65Å; T463-N466 PolarHBondContact OG1-OD1 3.48Å; T463-Q467 PolarHBondContact O-N 2.94Å
464	P	85.3	Confident	86.3	Confident	39 Å²	39	52.5 Å²	52.5	25%	0.253	28%	0.283	S	S	.	.	H	α-helix	trans	-65	-26.6	-174.9	25.9	-36.5	0	0	0	113.8	R468 T514 K517	P464-R468 PolarHBondContact O-N 3.04Å; P464-T514 HydrophobicContact CB-CG2 4.12Å; P464-K517 HydrophobicContact CB-CD 4.12Å
465	D	88.3	Confident	86.4	Confident	88 Å²	88	49.4 Å²	49.4	47%	0.471	27%	0.266	S	S	.	.	H	α-helix	trans	-71.2	-38.7	170.6	-58.2	-83.2	0	0	0	111.8	T463 L469 K517	T463-D465 VanDerWaalsContact C-N 3.25Å; T463-D465 PolarHBondContact O-N 3.07Å; D465-L469 VanDerWaalsContact O-CB 3.3Å; D465-L469 WeakPolarHBondContact O-CB 3.43Å; D465-L469 PolarHBondContact O-N 3.17Å; D465-K517 WeakPolarHBondContact OD1-CD 3.14Å; D465-K517 IonicContact OD1-NZ 2.65Å; D465-K517 PolarHBondContact OD1-NZ 2.82Å; D465-K517 IonicContact OD2-NZ 3.48Å; D465-K517 PolarHBondContact OD2-NZ 3.48Å
466	N	87.7	Confident	86.5	Confident	48 Å²	48	56.7 Å²	56.7	26%	0.257	30%	0.298	S	S	.	.	H	α-helix	trans	-68.1	-44.4	175.4	-78.8	22	0	0	0	111.2	L442 H462 T463 R468 L469 I470	L442-N466 HydrophobicContact CD1-CB 3.77Å; H462-N466 HydrophobicContact CB-CB 4.14Å; T463-N466 CarbonylContact O-C 3.58Å; T463-N466 WeakPolarHBondContact O-CA 3.39Å; T463-N466 WeakPolarHBondContact O-CB 3.17Å; T463-N466 PolarHBondContact O-N 3.45Å; T463-N466 VanDerWaalsContact OG1-CB 3.27Å; T463-N466 WeakPolarHBondContact OG1-CB 3.29Å; T463-N466 PolarHBondContact OG1-N 2.65Å; T463-N466 PolarHBondContact OG1-OD1 3.48Å; N466-R468 PolarHBondContact O-N 2.82Å; N466-L469 CarbonylContact O-C 3.49Å; N466-L469 PolarHBondContact O-N 3.02Å; N466-L469 VanDerWaalsContact O-N 3.08Å; N466-I470 VanDerWaalsContact O-CG1 3.25Å; N466-I470 WeakPolarHBondContact O-CG1 3.24Å; N466-I470 PolarHBondContact O-N 3.31Å
467	Q	87.4	Confident	86.6	Confident	7 Å²	7	55.5 Å²	55.5	3%	0.033	30%	0.297	C	S	.	.	H	α-helix	trans	-56.5	-47.7	174.8	-70.6	-178	34.3	0	0	111.6	L459 H462 T463 L469 I470 V471	L459-Q467 HydrophobicContact CB-CG 4.22Å; L459-Q467 HydrophobicContact CD2-CB 4.03Å; L459-Q467 HydrophobicContact CD2-CG 4.19Å; H462-Q467 HydrophobicContact CB-CG 3.91Å; H462-Q467 PolarHBondContact O-NE2 3.34Å; T463-Q467 PolarHBondContact O-N 2.94Å; Q467-L469 VanDerWaalsContact C-N 3.32Å; Q467-L469 PolarHBondContact O-N 3.19Å; Q467-I470 PolarHBondContact O-N 2.99Å; Q467-V471 WeakPolarHBondContact O-CG2 3.34Å; Q467-V471 PolarHBondContact O-N 3.36Å
468	R	89.4	Confident	86.6	Confident	101 Å²	101	50.4 Å²	50.4	38%	0.381	27%	0.27	S	S	.	.	H	α-helix	trans	-55.8	-47.1	172.6	-178.7	-171.7	175.6	-169.1	-3.2	111.7	P464 N466 V471 A472 K517 E521	P464-R468 PolarHBondContact O-N 3.04Å; N466-R468 PolarHBondContact O-N 2.82Å; R468-V471 PolarHBondContact O-N 3.32Å; R468-A472 VanDerWaalsContact O-CB 3.3Å; R468-A472 WeakPolarHBondContact O-CB 3.32Å; R468-A472 PolarHBondContact O-N 3.19Å; R468-K517 HydrophobicContact CB-CB 4.31Å; R468-K517 WeakPolarHBondContact CD-O 3.35Å; R468-K517 VanDerWaalsContact CG-O 3.23Å; R468-K517 WeakPolarHBondContact CG-O 3.42Å; R468-E521 HydrophobicContact CG-CG 3.72Å; R468-E521 IonicContact CZ-OE1 3.89Å; R468-E521 IonicContact NE-OE1 3.55Å; R468-E521 PolarHBondContact NE-OE1 2.9Å; R468-E521 IonicContact NH2-OE1 2.68Å; R468-E521 PolarHBondContact NH2-OE1 3.32Å
469	L	88.2	Confident	86.7	Confident	75 Å²	75	52 Å²	52	39%	0.393	28%	0.276	S	S	.	.	H	α-helix	trans	-70	-30.1	-176.6	-173.3	135.2	0	0	0	113.1	L442 D465 N466 Q467 R473	L442-L469 HydrophobicContact CB-CD2 4.48Å; L442-L469 HydrophobicContact CD1-CD2 3.67Å; D465-L469 VanDerWaalsContact O-CB 3.3Å; D465-L469 WeakPolarHBondContact O-CB 3.43Å; D465-L469 PolarHBondContact O-N 3.17Å; N466-L469 CarbonylContact O-C 3.49Å; N466-L469 PolarHBondContact O-N 3.02Å; N466-L469 VanDerWaalsContact O-N 3.08Å; Q467-L469 VanDerWaalsContact C-N 3.32Å; Q467-L469 PolarHBondContact O-N 3.19Å; L469-R473 WeakPolarHBondContact O-CB 3.43Å; L469-R473 VanDerWaalsContact O-CG 3.3Å; L469-R473 WeakPolarHBondContact O-CG 3.35Å; L469-R473 PolarHBondContact O-N 3.4Å; L469-R473 VanDerWaalsContact O-N 3.07Å
470	I	89.1	Confident	86.9	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-63	-57.1	168.3	-67	163.7	0	0	0	109.2	L442 F446 L458 L459 H462 N466 Q467 A472 R473 T474	L442-I470 HydrophobicContact CD1-CD1 4.17Å; L442-I470 HydrophobicContact CD1-CG1 3.7Å; L442-I470 HydrophobicContact CD2-CD1 3.8Å; L442-I470 HydrophobicContact CD2-CG1 3.92Å; L442-I470 HydrophobicContact CG-CG1 4.37Å; F446-I470 HydrophobicContact CD1-CG2 4.46Å; F446-I470 HydrophobicContact CD2-CG2 4.12Å; F446-I470 HydrophobicContact CE1-CG2 4.36Å; F446-I470 HydrophobicContact CE2-CB 4.18Å; F446-I470 HydrophobicContact CE2-CG1 3.98Å; F446-I470 HydrophobicContact CE2-CG2 4.01Å; F446-I470 HydrophobicContact CG-CG2 4.35Å; F446-I470 HydrophobicContact CZ-CB 4.42Å; F446-I470 HydrophobicContact CZ-CG1 3.85Å; F446-I470 HydrophobicContact CZ-CG2 4.13Å; L458-I470 HydrophobicContact CD1-CG2 4.14Å; L458-I470 HydrophobicContact CD2-CG2 4.04Å; L458-I470 HydrophobicContact CG-CG2 3.87Å; L459-I470 HydrophobicContact CD2-CB 4.2Å; L459-I470 HydrophobicContact CD2-CD1 4.4Å; L459-I470 HydrophobicContact CD2-CG2 4.06Å; H462-I470 HydrophobicContact CB-CD1 4.33Å; H462-I470 WeakPolarHBondContact CD2-CD1 3.27Å; N466-I470 VanDerWaalsContact O-CG1 3.25Å; N466-I470 WeakPolarHBondContact O-CG1 3.24Å; N466-I470 PolarHBondContact O-N 3.31Å; Q467-I470 PolarHBondContact O-N 2.99Å; I470-A472 VanDerWaalsContact C-N 3.31Å; I470-A472 PolarHBondContact O-N 3.32Å; I470-R473 CarbonylContact O-C 3.56Å; I470-R473 WeakPolarHBondContact O-CA 3.43Å; I470-R473 WeakPolarHBondContact O-CB 3.2Å; I470-R473 PolarHBondContact O-N 3.09Å; I470-T474 PolarHBondContact O-N 3.03Å; I470-T474 PolarHBondContact O-OG1 2.98Å; I470-T474 VanDerWaalsContact O-OG1 3.1Å
471	V	88.9	Confident	87.2	Confident	4 Å²	4	52.8 Å²	52.8	2%	0.024	29%	0.294	C	S	.	.	H	α-helix	trans	-56.9	-44.1	180	175.1	0	0	0	0	111.6	L459 Q467 R468 R473 T474 Q475 L497 L518 E521	L459-V471 HydrophobicContact CD1-CG2 4.33Å; L459-V471 HydrophobicContact CD2-CG2 4.05Å; Q467-V471 WeakPolarHBondContact O-CG2 3.34Å; Q467-V471 PolarHBondContact O-N 3.36Å; R468-V471 PolarHBondContact O-N 3.32Å; V471-R473 VanDerWaalsContact C-N 3.3Å; V471-R473 PolarHBondContact O-N 3.34Å; V471-T474 PolarHBondContact O-N 2.67Å; V471-Q475 WeakPolarHBondContact O-CG 3.26Å; V471-Q475 PolarHBondContact O-N 2.95Å; V471-L497 HydrophobicContact CG1-CD1 4Å; V471-L497 HydrophobicContact CG1-CD2 4.37Å; V471-L497 HydrophobicContact CG2-CD2 4Å; V471-L518 HydrophobicContact CG2-CD2 4.13Å; V471-E521 HydrophobicContact CG1-CB 3.95Å
472	A	88.7	Confident	87.7	Confident	15 Å²	15	54.6 Å²	54.6	12%	0.124	29%	0.285	C	S	.	.	H	α-helix	trans	-62.9	-31.8	176.9	0	0	0	0	0	113.4	R468 I470 K476 E521	R468-A472 VanDerWaalsContact O-CB 3.3Å; R468-A472 WeakPolarHBondContact O-CB 3.32Å; R468-A472 PolarHBondContact O-N 3.19Å; I470-A472 VanDerWaalsContact C-N 3.31Å; I470-A472 PolarHBondContact O-N 3.32Å; A472-K476 WeakPolarHBondContact O-CD 3.38Å; A472-K476 VanDerWaalsContact O-CG 3.28Å; A472-K476 WeakPolarHBondContact O-CG 3.46Å; A472-K476 PolarHBondContact O-N 3.24Å; A472-E521 HydrophobicContact CB-CG 4.41Å; A472-E521 VanDerWaalsContact CB-OE2 3.31Å; A472-E521 WeakPolarHBondContact CB-OE2 3.44Å
473	R	89.9	Confident	87.8	Confident	63 Å²	63	53.5 Å²	53.5	24%	0.238	29%	0.289	C	S	.	.	H	α-helix	trans	-75.2	-45.9	172.1	-78.6	174.2	175.9	179.9	1.6	111.1	L442 P443 F446 L469 I470 V471 Q475 K476 C477	L442-R473 PolarHBondContact O-NH1 2.81Å; P443-R473 VanDerWaalsContact C-NH1 3.31Å; P443-R473 PolarHBondContact O-NH1 3.09Å; F446-R473 HydrophobicContact CD2-CB 3.78Å; F446-R473 HydrophobicContact CE2-CB 4.18Å; L469-R473 WeakPolarHBondContact O-CB 3.43Å; L469-R473 VanDerWaalsContact O-CG 3.3Å; L469-R473 WeakPolarHBondContact O-CG 3.35Å; L469-R473 PolarHBondContact O-N 3.4Å; L469-R473 VanDerWaalsContact O-N 3.07Å; I470-R473 CarbonylContact O-C 3.56Å; I470-R473 WeakPolarHBondContact O-CA 3.43Å; I470-R473 WeakPolarHBondContact O-CB 3.2Å; I470-R473 PolarHBondContact O-N 3.09Å; V471-R473 VanDerWaalsContact C-N 3.3Å; V471-R473 PolarHBondContact O-N 3.34Å; R473-Q475 VanDerWaalsContact C-N 3.31Å; R473-Q475 PolarHBondContact O-N 3.2Å; R473-K476 PolarHBondContact O-N 3.38Å; R473-C477 WeakPolarHBondContact O-CB 3.32Å; R473-C477 PolarHBondContact O-N 2.87Å; R473-C477 PolarHBondContact O-SG 3.38Å; R473-C477 VanDerWaalsContact O-SG 3.36Å
474	T	87.9	Confident	87.4	Confident	4 Å²	4	54.8 Å²	54.8	3%	0.025	31%	0.306	C	S	.	.	H	α-helix	trans	-54.3	-45.7	175.4	-54.8	0	0	0	0	111.4	F446 A448 I470 V471 K476 N478 L493	F446-T474 WeakPolarHBondContact CB-OG1 3.43Å; A448-T474 HydrophobicContact CB-CG2 4.27Å; I470-T474 PolarHBondContact O-N 3.03Å; I470-T474 PolarHBondContact O-OG1 2.98Å; I470-T474 VanDerWaalsContact O-OG1 3.1Å; V471-T474 PolarHBondContact O-N 2.67Å; T474-K476 PolarHBondContact O-N 3.01Å; T474-N478 WeakPolarHBondContact O-CB 3.41Å; T474-N478 PolarHBondContact O-N 2.87Å; T474-N478 PolarHBondContact O-ND2 2.76Å; T474-L493 HydrophobicContact CG2-CD2 4.31Å
475	Q	88.9	Confident	87.3	Confident	12 Å²	12	55.1 Å²	55.1	6%	0.056	32%	0.317	C	S	.	.	H	α-helix	trans	-61.7	-39.2	176.4	-70.5	-175.7	28.7	0	0	113.4	V471 R473 N478 H479 E521 L525	V471-Q475 WeakPolarHBondContact O-CG 3.26Å; V471-Q475 PolarHBondContact O-N 2.95Å; R473-Q475 VanDerWaalsContact C-N 3.31Å; R473-Q475 PolarHBondContact O-N 3.2Å; Q475-N478 CarbonylContact O-C 3.47Å; Q475-H479 PolarHBondContact O-N 3.19Å; Q475-E521 PolarHBondContact NE2-O 2.76Å; Q475-E521 PolarHBondContact OE1-O 3.31Å; Q475-L525 HydrophobicContact CG-CD1 4.42Å; Q475-L525 HydrophobicContact CG-CD2 4.16Å; Q475-L525 HydrophobicContact CG-CG 4.22Å
476	K	88.2	Confident	87.3	Confident	156 Å²	156	52 Å²	52	68%	0.678	30%	0.3	S	S	*	.	H	α-helix	trans	-73.6	-45.2	179.7	-72.3	172	-175	177.4	0	112.3	A472 R473 T474 N478 H479 L482	A472-K476 WeakPolarHBondContact O-CD 3.38Å; A472-K476 VanDerWaalsContact O-CG 3.28Å; A472-K476 WeakPolarHBondContact O-CG 3.46Å; A472-K476 PolarHBondContact O-N 3.24Å; R473-K476 PolarHBondContact O-N 3.38Å; T474-K476 PolarHBondContact O-N 3.01Å; K476-N478 PolarHBondContact O-N 2.74Å; K476-H479 PolarHBondContact O-N 3.39Å; K476-L482 WeakPolarHBondContact O-CD1 3.34Å
477	C	87.3	Confident	87.3	Confident	40 Å²	40	55 Å²	55	27%	0.27	31%	0.311	S	S	.	.	H	α-helix	trans	-66.5	-27.4	178.5	-66	0	0	0	0	112.8	R473 L482	R473-C477 WeakPolarHBondContact O-CB 3.32Å; R473-C477 PolarHBondContact O-N 2.87Å; R473-C477 PolarHBondContact O-SG 3.38Å; R473-C477 VanDerWaalsContact O-SG 3.36Å; C477-L482 WeakPolarHBondContact O-CD1 3.41Å
478	N	86.1	Confident	87.4	Confident	17 Å²	17	60.1 Å²	60.1	9%	0.091	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	29.8	179.8	-55.8	-98	0	0	0	111.4	F446 A448 T474 Q475 K476 N486 L490	F446-N478 PolarHBondContact O-ND2 3Å; A448-N478 HydrophobicContact CB-CB 4.06Å; A448-N478 PolarHBondContact N-ND2 3.48Å; A448-N478 PolarHBondContact N-OD1 3.27Å; A448-N478 VanDerWaalsContact N-OD1 3.13Å; T474-N478 WeakPolarHBondContact O-CB 3.41Å; T474-N478 PolarHBondContact O-N 2.87Å; T474-N478 PolarHBondContact O-ND2 2.76Å; Q475-N478 CarbonylContact O-C 3.47Å; K476-N478 PolarHBondContact O-N 2.74Å; N478-N486 VanDerWaalsContact O-CB 3.32Å; N478-N486 WeakPolarHBondContact O-CB 3.26Å; N478-L490 HydrophobicContact CB-CD2 4.19Å; N478-L490 WeakPolarHBondContact O-CD1 3.5Å
479	H	87.8	Confident	87.3	Confident	79 Å²	79	58.5 Å²	58.5	37%	0.366	33%	0.334	S	S	.	.			trans	-61.2	144.1	177.7	-172.2	-105.7	0	0	0	111.1	Q475 K476 S481 L482 N486	Q475-H479 PolarHBondContact O-N 3.19Å; K476-H479 PolarHBondContact O-N 3.39Å; H479-S481 PolarHBondContact ND1-N 3.11Å; H479-S481 PolarHBondContact ND1-OG 3.49Å; H479-S481 PolarHBondContact O-N 2.87Å; H479-S481 VanDerWaalsContact O-N 3.09Å; H479-L482 HydrophobicContact CB-CD1 4.1Å; H479-L482 HydrophobicContact CB-CG 4.3Å; H479-L482 WeakPolarHBondContact O-CB 3.42Å; H479-L482 PolarHBondContact O-N 3.23Å; H479-N486 PolarHBondContact O-ND2 3.36Å
480	P	87.8	Confident	87.3	Confident	45 Å²	45	55 Å²	55	29%	0.292	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-19.2	-174.5	-27.3	37.8	0	0	0	115.6	L482 L490 F529	P480-L482 VanDerWaalsContact C-N 3.26Å; P480-L482 PolarHBondContact O-N 3.34Å; P480-L490 HydrophobicContact CG-CD1 4.27Å; P480-F529 HydrophobicContact CG-CE1 4.36Å; P480-F529 HydrophobicContact CG-CZ 3.7Å
481	S	85.9	Confident	87.4	Confident	95 Å²	95	57.4 Å²	57.4	66%	0.664	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-6.4	175.4	69.4	0	0	0	0	114.2	H479	H479-S481 PolarHBondContact ND1-N 3.11Å; H479-S481 PolarHBondContact ND1-OG 3.49Å; H479-S481 PolarHBondContact O-N 2.87Å; H479-S481 VanDerWaalsContact O-N 3.09Å
482	L	87.6	Confident	87.5	Confident	113 Å²	113	63.2 Å²	63.2	59%	0.592	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-36.7	-176.5	-61	174.4	0	0	0	112.5	K476 C477 H479 P480	K476-L482 WeakPolarHBondContact O-CD1 3.34Å; C477-L482 WeakPolarHBondContact O-CD1 3.41Å; H479-L482 HydrophobicContact CB-CD1 4.1Å; H479-L482 HydrophobicContact CB-CG 4.3Å; H479-L482 WeakPolarHBondContact O-CB 3.42Å; H479-L482 PolarHBondContact O-N 3.23Å; P480-L482 VanDerWaalsContact C-N 3.26Å; P480-L482 PolarHBondContact O-N 3.34Å
483	A	85.7	Confident	87.5	Confident	48 Å²	48	62.6 Å²	62.6	40%	0.397	35%	0.346	S	S	.	.			trans	-157.9	142.9	175.3	0	0	0	0	0	111.2	G485 N486	A483-G485 VanDerWaalsContact C-N 3.35Å; A483-G485 PolarHBondContact O-N 3.4Å; A483-N486 VanDerWaalsContact O-CB 3.28Å; A483-N486 WeakPolarHBondContact O-CB 3.41Å; A483-N486 PolarHBondContact O-N 2.87Å; A483-N486 VanDerWaalsContact O-N 3.14Å
484	A	79.9	Confident	87.6	Confident	100 Å²	100	59.6 Å²	59.6	83%	0.826	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-39.1	-174.2	0	0	0	0	0	113.7	N486	A484-N486 PolarHBondContact O-N 3.34Å
485	G	83.4	Confident	87.6	Confident	46 Å²	46	60 Å²	60	47%	0.474	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-20.2	179.3	0	0	0	0	0	114.6	A483 K487 L488	A483-G485 VanDerWaalsContact C-N 3.35Å; A483-G485 PolarHBondContact O-N 3.4Å; G485-K487 PolarHBondContact O-N 2.82Å; G485-L488 PolarHBondContact O-N 3.04Å
486	N	87.2	Confident	87.8	Confident	22 Å²	22	60.9 Å²	60.9	12%	0.118	34%	0.343	C	S	.	.	H	α-helix	trans	-63	-30.1	-176.3	-70	-3.8	0	0	0	113.1	N478 H479 A483 A484 L488 K489 L490	N478-N486 VanDerWaalsContact O-CB 3.32Å; N478-N486 WeakPolarHBondContact O-CB 3.26Å; H479-N486 PolarHBondContact O-ND2 3.36Å; A483-N486 VanDerWaalsContact O-CB 3.28Å; A483-N486 WeakPolarHBondContact O-CB 3.41Å; A483-N486 PolarHBondContact O-N 2.87Å; A483-N486 VanDerWaalsContact O-N 3.14Å; A484-N486 PolarHBondContact O-N 3.34Å; N486-L488 VanDerWaalsContact C-N 3.34Å; N486-L488 PolarHBondContact O-N 2.86Å; N486-K489 PolarHBondContact O-N 3.44Å; N486-L490 PolarHBondContact O-N 2.93Å
487	K	88.4	Confident	87.9	Confident	112 Å²	112	53.6 Å²	53.6	49%	0.487	31%	0.312	S	S	.	.	H	α-helix	trans	-56.6	-47.4	179.6	-178.6	178.9	177.5	-173.7	0	111.7	G485 Q491 F529	G485-K487 PolarHBondContact O-N 2.82Å; K487-Q491 WeakPolarHBondContact O-CB 3.27Å; K487-Q491 VanDerWaalsContact O-CG 3.3Å; K487-Q491 WeakPolarHBondContact O-CG 3.48Å; K487-Q491 PolarHBondContact O-N 2.93Å; K487-F529 HydrophobicContact CG-CE1 3.94Å
488	L	89.2	Confident	88	Confident	115 Å²	115	52 Å²	52	60%	0.602	30%	0.3	S	S	*	.	H	α-helix	trans	-69.7	-38.6	-179.2	-63.2	176.5	0	0	0	111.6	G485 N486 Q491 K492	G485-L488 PolarHBondContact O-N 3.04Å; N486-L488 VanDerWaalsContact C-N 3.34Å; N486-L488 PolarHBondContact O-N 2.86Å; L488-Q491 PolarHBondContact O-N 3.33Å; L488-K492 PolarHBondContact O-N 3Å
489	K	87.8	Confident	88.2	Confident	67 Å²	67	55.6 Å²	55.6	29%	0.291	32%	0.316	S	S	.	.	H	α-helix	trans	-63	-46.3	176	-65.5	-168.6	171	-163.9	0	112	A448 E450 N486 Q491 K492 L493	A448-K489 HydrophobicContact CB-CB 3.86Å; A448-K489 HydrophobicContact CB-CD 4.21Å; E450-K489 WeakPolarHBondContact OE1-CE 3.37Å; E450-K489 IonicContact OE1-NZ 2.72Å; E450-K489 PolarHBondContact OE1-NZ 2.85Å; N486-K489 PolarHBondContact O-N 3.44Å; K489-Q491 VanDerWaalsContact C-N 3.32Å; K489-Q491 PolarHBondContact O-N 3.16Å; K489-K492 PolarHBondContact O-N 3.36Å; K489-L493 WeakPolarHBondContact O-CB 3.42Å; K489-L493 PolarHBondContact O-N 2.84Å
490	L	88.4	Confident	88.3	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-67	-30.7	175.7	-69.1	-171.9	0	0	0	113	N478 P480 N486 L493 V494 L525 F529	N478-L490 HydrophobicContact CB-CD2 4.19Å; N478-L490 WeakPolarHBondContact O-CD1 3.5Å; P480-L490 HydrophobicContact CG-CD1 4.27Å; N486-L490 PolarHBondContact O-N 2.93Å; L490-L493 HydrophobicContact CD2-CD2 3.85Å; L490-L493 PolarHBondContact O-N 2.72Å; L490-V494 PolarHBondContact O-N 2.86Å; L490-L525 HydrophobicContact CB-CD2 4.18Å; L490-L525 HydrophobicContact CD1-CD2 4.49Å; L490-L525 HydrophobicContact CD2-CD2 4.31Å; L490-F529 HydrophobicContact CB-CD2 4.37Å; L490-F529 HydrophobicContact CB-CE2 3.53Å; L490-F529 HydrophobicContact CB-CZ 4.05Å; L490-F529 HydrophobicContact CD1-CE2 3.94Å; L490-F529 HydrophobicContact CD1-CZ 4.22Å; L490-F529 HydrophobicContact CG-CE2 4.42Å
491	Q	90.5	Very high	88.3	Confident	52 Å²	52	49.8 Å²	49.8	24%	0.243	29%	0.286	C	S	.	.	H	α-helix	trans	-66.9	-42.8	173	-76.9	176.3	-34.1	0	0	112.1	K487 L488 K489 V494 F529 A532	K487-Q491 WeakPolarHBondContact O-CB 3.27Å; K487-Q491 VanDerWaalsContact O-CG 3.3Å; K487-Q491 WeakPolarHBondContact O-CG 3.48Å; K487-Q491 PolarHBondContact O-N 2.93Å; L488-Q491 PolarHBondContact O-N 3.33Å; K489-Q491 VanDerWaalsContact C-N 3.32Å; K489-Q491 PolarHBondContact O-N 3.16Å; Q491-V494 PolarHBondContact O-N 3.43Å; Q491-F529 HydrophobicContact CG-CB 4.18Å; Q491-F529 HydrophobicContact CG-CD1 3.89Å; Q491-F529 HydrophobicContact CG-CD2 4.34Å; Q491-F529 HydrophobicContact CG-CE1 4.4Å; Q491-F529 HydrophobicContact CG-CG 3.85Å; Q491-A532 HydrophobicContact CB-CB 4.29Å; Q491-A532 HydrophobicContact CG-CB 4.05Å
492	K	90.1	Very high	88.4	Confident	126 Å²	126	45.5 Å²	45.5	55%	0.548	26%	0.257	S	S	.	.	H	α-helix	trans	-61.7	-42	171.8	-71.9	-174.7	175.4	-171.8	0	112.3	L488 K489 V494 G495 F496	L488-K492 PolarHBondContact O-N 3Å; K489-K492 PolarHBondContact O-N 3.36Å; K492-V494 PolarHBondContact O-N 2.98Å; K492-V494 VanDerWaalsContact O-N 3.14Å; K492-G495 PolarHBondContact O-N 3.44Å; K492-F496 HydrophobicContact CB-CE2 3.96Å; K492-F496 HydrophobicContact CB-CZ 4.18Å; K492-F496 PolarHBondContact O-N 2.86Å; K492-F496 VanDerWaalsContact O-N 3.16Å
493	L	90.4	Very high	88.4	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.01	24%	0.238	C	C	.	.	H	α-helix	trans	-57	-28.1	177.9	-179.1	61.9	0	0	0	113.3	P449 L455 T474 K489 L490 L497 L525	P449-L493 HydrophobicContact CG-CD1 3.88Å; L455-L493 HydrophobicContact CD1-CD1 3.97Å; L455-L493 HydrophobicContact CD2-CD1 4.22Å; T474-L493 HydrophobicContact CG2-CD2 4.31Å; K489-L493 WeakPolarHBondContact O-CB 3.42Å; K489-L493 PolarHBondContact O-N 2.84Å; L490-L493 HydrophobicContact CD2-CD2 3.85Å; L490-L493 PolarHBondContact O-N 2.72Å; L493-L497 HydrophobicContact CD1-CD1 4.03Å; L493-L497 HydrophobicContact CD1-CG 3.96Å; L493-L497 HydrophobicContact CG-CD1 3.86Å; L493-L497 HydrophobicContact CG-CG 4.26Å; L493-L497 WeakPolarHBondContact O-CB 3.42Å; L493-L497 VanDerWaalsContact O-CG 3.3Å; L493-L497 WeakPolarHBondContact O-CG 3.08Å; L493-L497 PolarHBondContact O-N 2.99Å; L493-L525 HydrophobicContact CD2-CD1 4.44Å; L493-L525 HydrophobicContact CG-CD1 4.4Å
494	V	90.7	Very high	88.4	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.006	22%	0.219	C	C	.	.	H	α-helix	trans	-63.1	-46	172.4	177.7	0	0	0	0	111.4	L490 Q491 K492 M498 L522 L525 A533	L490-V494 PolarHBondContact O-N 2.86Å; Q491-V494 PolarHBondContact O-N 3.43Å; K492-V494 PolarHBondContact O-N 2.98Å; K492-V494 VanDerWaalsContact O-N 3.14Å; V494-M498 VanDerWaalsContact O-CG 3.25Å; V494-M498 WeakPolarHBondContact O-CG 3.37Å; V494-M498 PolarHBondContact O-N 3.24Å; V494-M498 VanDerWaalsContact O-N 3.1Å; V494-L522 HydrophobicContact CG1-CD1 4.41Å; V494-L525 HydrophobicContact CG2-CB 3.78Å; V494-L525 HydrophobicContact CG2-CD1 4.19Å; V494-L525 HydrophobicContact CG2-CD2 4.41Å; V494-L525 HydrophobicContact CG2-CG 4.36Å; V494-A533 HydrophobicContact CG1-CB 3.99Å
495	G	89.4	Confident	88.7	Confident	11 Å²	11	35.1 Å²	35.1	11%	0.113	18%	0.18	C	C	.	.	H	α-helix	trans	-61	-52.5	176.5	0	0	0	0	0	111.5	K492 L497 M498 E499	K492-G495 PolarHBondContact O-N 3.44Å; G495-L497 VanDerWaalsContact C-N 3.33Å; G495-L497 PolarHBondContact O-N 2.92Å; G495-M498 WeakPolarHBondContact O-CB 3.42Å; G495-M498 PolarHBondContact O-N 3.09Å; G495-E499 WeakPolarHBondContact O-CG 3.45Å; G495-E499 PolarHBondContact O-N 3.48Å
496	F	91.4	Very high	88.8	Confident	31 Å²	31	36.4 Å²	36.4	14%	0.136	18%	0.179	C	C	.	.	H	α-helix	trans	-61	-37.9	-178.7	-54.5	-30.4	0	0	0	113.1	E450 Y452 L455 K492 Y500	E450-F496 WeakPolarHBondContact O-CE2 3.23Å; E450-F496 WeakPolarHBondContact O-CZ 3.44Å; Y452-F496 HydrophobicContact CD2-CB 4.27Å; L455-F496 HydrophobicContact CD2-CB 3.49Å; L455-F496 VanDerWaalsContact CD2-CB 3.49Å; K492-F496 HydrophobicContact CB-CE2 3.96Å; K492-F496 HydrophobicContact CB-CZ 4.18Å; K492-F496 PolarHBondContact O-N 2.86Å; K492-F496 VanDerWaalsContact O-N 3.16Å; F496-Y500 VanDerWaalsContact O-CB 3.25Å; F496-Y500 WeakPolarHBondContact O-CB 3.25Å; F496-Y500 PolarHBondContact O-N 2.92Å
497	L	90.4	Very high	88.7	Confident	4 Å²	4	38.3 Å²	38.3	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-68.6	-36.7	175.1	-77.3	169.5	0	0	0	112.5	L455 V471 L493 G495 M501 L525	L455-L497 HydrophobicContact CD1-CD2 4.34Å; L455-L497 HydrophobicContact CD2-CD2 4.06Å; L455-L497 HydrophobicContact CD2-CG 4.15Å; V471-L497 HydrophobicContact CG1-CD1 4Å; V471-L497 HydrophobicContact CG1-CD2 4.37Å; V471-L497 HydrophobicContact CG2-CD2 4Å; L493-L497 HydrophobicContact CD1-CD1 4.03Å; L493-L497 HydrophobicContact CD1-CG 3.96Å; L493-L497 HydrophobicContact CG-CD1 3.86Å; L493-L497 HydrophobicContact CG-CG 4.26Å; L493-L497 WeakPolarHBondContact O-CB 3.42Å; L493-L497 VanDerWaalsContact O-CG 3.3Å; L493-L497 WeakPolarHBondContact O-CG 3.08Å; L493-L497 PolarHBondContact O-N 2.99Å; G495-L497 VanDerWaalsContact C-N 3.33Å; G495-L497 PolarHBondContact O-N 2.92Å; L497-M501 VanDerWaalsContact O-CG 3.29Å; L497-M501 WeakPolarHBondContact O-CG 3.49Å; L497-M501 PolarHBondContact O-N 3.49Å; L497-L525 HydrophobicContact CD1-CD1 3.54Å
498	M	89.7	Confident	88.1	Confident	6 Å²	6	37.3 Å²	37.3	3%	0.03	19%	0.191	C	C	.	.	H	α-helix	trans	-63.1	-52	173.8	-74.3	-64.2	-57.2	0	0	110.7	V494 G495 Y500 M501 G502 L522 M537 I540 Y568 V571	V494-M498 VanDerWaalsContact O-CG 3.25Å; V494-M498 WeakPolarHBondContact O-CG 3.37Å; V494-M498 PolarHBondContact O-N 3.24Å; V494-M498 VanDerWaalsContact O-N 3.1Å; G495-M498 WeakPolarHBondContact O-CB 3.42Å; G495-M498 PolarHBondContact O-N 3.09Å; M498-Y500 VanDerWaalsContact C-N 3.29Å; M498-Y500 PolarHBondContact O-N 3.26Å; M498-M501 WeakPolarHBondContact O-CB 3.23Å; M498-M501 PolarHBondContact O-N 2.88Å; M498-M501 VanDerWaalsContact O-N 3.13Å; M498-G502 PolarHBondContact O-N 3.34Å; M498-G502 VanDerWaalsContact O-N 3.13Å; M498-L522 HydrophobicContact CG-CD1 4.4Å; M498-L522 HydrophobicContact SD-CD1 4.15Å; M498-L522 HydrophobicContact SD-CD2 3.61Å; M498-L522 HydrophobicContact SD-CG 4.5Å; M498-M537 HydrophobicContact CE-CE 3.31Å; M498-M537 HydrophobicContact CE-SD 3.94Å; M498-M537 HydrophobicContact SD-CE 4.36Å; M498-I540 HydrophobicContact CB-CD1 4.25Å; M498-I540 HydrophobicContact CE-CD1 4.15Å; M498-Y568 HydrophobicContact CE-CD1 3.55Å; M498-Y568 HydrophobicContact CE-CE1 3.73Å; M498-Y568 WeakPolarHBondContact O-CE1 3.42Å; M498-Y568 PolarHBondContact O-OH 2.85Å; M498-Y568 VanDerWaalsContact O-OH 3.12Å; M498-V571 HydrophobicContact SD-CG1 4.44Å
499	E	89.8	Confident	87.6	Confident	92 Å²	92	37.2 Å²	37.2	43%	0.43	20%	0.198	S	C	.	.	H	α-helix	trans	-55.2	-43.8	176.2	-69.9	155.6	-159.8	0	0	111.7	Y452 G495 M501 G502 E503	Y452-E499 HydrophobicContact CD2-CB 3.98Å; Y452-E499 WeakPolarHBondContact CD2-OE2 3.26Å; Y452-E499 HydrophobicContact CE2-CB 3.7Å; G495-E499 WeakPolarHBondContact O-CG 3.45Å; G495-E499 PolarHBondContact O-N 3.48Å; E499-M501 PolarHBondContact O-N 3.31Å; E499-G502 WeakPolarHBondContact O-CA 3.48Å; E499-G502 PolarHBondContact O-N 2.63Å; E499-G502 VanDerWaalsContact O-N 3.08Å; E499-E503 PolarHBondContact O-N 2.88Å
500	Y	90.3	Very high	87.4	Confident	1 Å²	1	35 Å²	35	0%	0.004	19%	0.19	C	C	.	.	H	α-helix	trans	-63.8	-38.8	178.6	-172.3	-104.3	0	0	0	112.1	K456 L459 F496 M498 G502 E503 L504 L518	K456-Y500 HydrophobicContact CG-CE2 4.35Å; L459-Y500 HydrophobicContact CB-CE1 4.3Å; L459-Y500 HydrophobicContact CB-CE2 4.46Å; L459-Y500 WeakPolarHBondContact CB-OH 3.28Å; L459-Y500 HydrophobicContact CD1-CD1 3.99Å; L459-Y500 HydrophobicContact CD1-CE1 3.62Å; F496-Y500 VanDerWaalsContact O-CB 3.25Å; F496-Y500 WeakPolarHBondContact O-CB 3.25Å; F496-Y500 PolarHBondContact O-N 2.92Å; M498-Y500 VanDerWaalsContact C-N 3.29Å; M498-Y500 PolarHBondContact O-N 3.26Å; Y500-G502 VanDerWaalsContact C-N 3.28Å; Y500-G502 PolarHBondContact O-N 2.96Å; Y500-E503 PolarHBondContact O-N 3.29Å; Y500-L504 HydrophobicContact CD1-CD1 3.77Å; Y500-L504 HydrophobicContact CD1-CG 4.07Å; Y500-L504 HydrophobicContact CE1-CD1 3.58Å; Y500-L504 HydrophobicContact CE1-CD2 4.09Å; Y500-L504 HydrophobicContact CE1-CG 3.88Å; Y500-L504 WeakPolarHBondContact O-CG 3.49Å; Y500-L504 PolarHBondContact O-N 2.85Å; Y500-L518 HydrophobicContact CD1-CD1 4.22Å; Y500-L518 HydrophobicContact CE1-CD1 4.29Å
501	M	89.1	Confident	87.1	Confident	2 Å²	2	37.9 Å²	37.9	1%	0.01	20%	0.204	C	C	.	.	H	α-helix	trans	-65.2	-31.4	173.7	-71.4	167.7	69.6	0	0	112.3	L497 M498 E499 A505 I515 L518 I519 L522 V571	L497-M501 VanDerWaalsContact O-CG 3.29Å; L497-M501 WeakPolarHBondContact O-CG 3.49Å; L497-M501 PolarHBondContact O-N 3.49Å; M498-M501 WeakPolarHBondContact O-CB 3.23Å; M498-M501 PolarHBondContact O-N 2.88Å; M498-M501 VanDerWaalsContact O-N 3.13Å; E499-M501 PolarHBondContact O-N 3.31Å; M501-A505 WeakPolarHBondContact O-CB 3.3Å; M501-A505 PolarHBondContact O-N 3.43Å; M501-A505 VanDerWaalsContact O-N 3.14Å; M501-I515 HydrophobicContact CE-CG2 3.76Å; M501-L518 HydrophobicContact CG-CD1 4.5Å; M501-L518 HydrophobicContact SD-CB 4.49Å; M501-I519 HydrophobicContact CE-CD1 4.42Å; M501-I519 HydrophobicContact CE-CG1 3.66Å; M501-L522 HydrophobicContact CE-CD2 4.08Å; M501-L522 HydrophobicContact SD-CD2 3.74Å; M501-V571 HydrophobicContact CE-CG2 3.75Å
502	G	87.3	Confident	86.9	Confident	5 Å²	5	38.1 Å²	38.1	5%	0.052	21%	0.206	C	C	.	.	H	α-helix	trans	-66.2	-44.1	168.5	0	0	0	0	0	113.1	M498 E499 Y500 A505 T506 Y568	M498-G502 PolarHBondContact O-N 3.34Å; M498-G502 VanDerWaalsContact O-N 3.13Å; E499-G502 WeakPolarHBondContact O-CA 3.48Å; E499-G502 PolarHBondContact O-N 2.63Å; E499-G502 VanDerWaalsContact O-N 3.08Å; Y500-G502 VanDerWaalsContact C-N 3.28Å; Y500-G502 PolarHBondContact O-N 2.96Å; G502-A505 PolarHBondContact O-N 2.82Å; G502-T506 PolarHBondContact O-N 3.11Å; G502-T506 PolarHBondContact O-OG1 3.46Å; G502-Y568 WeakPolarHBondContact CA-OH 3.27Å
503	E	87.7	Confident	86.7	Confident	43 Å²	43	34.3 Å²	34.3	20%	0.201	20%	0.202	C	C	.	.	H	α-helix	trans	-61.5	-46.7	174.9	-163.7	-170	122.6	0	0	111.3	Y452 K456 E499 Y500 A505 T506 R507	Y452-E503 PolarHBondContact OH-OE2 3.3Å; K456-E503 VanDerWaalsContact CE-OE1 3.29Å; K456-E503 WeakPolarHBondContact CE-OE1 3.47Å; K456-E503 WeakPolarHBondContact CE-OE2 3.48Å; K456-E503 IonicContact NZ-OE1 2.58Å; K456-E503 PolarHBondContact NZ-OE1 3.16Å; K456-E503 IonicContact NZ-OE2 3.78Å; K456-E503 PolarHBondContact NZ-OE2 2.98Å; E499-E503 PolarHBondContact O-N 2.88Å; Y500-E503 PolarHBondContact O-N 3.29Å; E503-A505 PolarHBondContact O-N 2.74Å; E503-T506 WeakPolarHBondContact CA-OG1 3.42Å; E503-T506 PolarHBondContact O-N 2.95Å; E503-T506 PolarHBondContact O-OG1 2.71Å; E503-R507 WeakPolarHBondContact O-CG 3.22Å; E503-R507 PolarHBondContact O-N 2.8Å; E503-R507 VanDerWaalsContact O-N 3.17Å; E503-R507 IonicContact OE1-CZ 2.82Å; E503-R507 IonicContact OE1-NE 2.93Å; E503-R507 IonicContact OE1-NH2 2.74Å; E503-R507 PolarHBondContact OE1-NH2 3.19Å
504	L	86.3	Confident	86.6	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-58.2	-31.8	175.4	-70.2	178.9	0	0	0	113.1	Y500 E511 T514 I515 L518	Y500-L504 HydrophobicContact CD1-CD1 3.77Å; Y500-L504 HydrophobicContact CD1-CG 4.07Å; Y500-L504 HydrophobicContact CE1-CD1 3.58Å; Y500-L504 HydrophobicContact CE1-CD2 4.09Å; Y500-L504 HydrophobicContact CE1-CG 3.88Å; Y500-L504 WeakPolarHBondContact O-CG 3.49Å; Y500-L504 PolarHBondContact O-N 2.85Å; L504-E511 HydrophobicContact CB-CB 4.25Å; L504-E511 HydrophobicContact CD2-CB 3.97Å; L504-E511 HydrophobicContact CD2-CG 4.35Å; L504-E511 PolarHBondContact O-N 2.83Å; L504-T514 HydrophobicContact CD1-CG2 3.66Å; L504-T514 HydrophobicContact CD2-CG2 4.44Å; L504-I515 HydrophobicContact CB-CD1 3.83Å; L504-I515 HydrophobicContact CB-CG1 3.79Å; L504-I515 HydrophobicContact CD1-CG1 3.92Å; L504-L518 HydrophobicContact CD1-CD1 4.08Å
505	A	86.2	Confident	86.5	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-79.9	-21.7	177.2	0	0	0	0	0	113.5	M501 G502 E503 I515 D564 V567 Q690	M501-A505 WeakPolarHBondContact O-CB 3.3Å; M501-A505 PolarHBondContact O-N 3.43Å; M501-A505 VanDerWaalsContact O-N 3.14Å; G502-A505 PolarHBondContact O-N 2.82Å; E503-A505 PolarHBondContact O-N 2.74Å; A505-I515 HydrophobicContact CB-CD1 4Å; A505-D564 HydrophobicContact CB-CB 4.08Å; A505-V567 HydrophobicContact CB-CB 4.43Å; A505-V567 HydrophobicContact CB-CG2 4.19Å; A505-Q690 PolarHBondContact O-NE2 2.84Å
506	T	84.8	Confident	86.6	Confident	73 Å²	73	39.7 Å²	39.7	45%	0.448	23%	0.229	S	C	.	.	H	α-helix	trans	-91.5	-15.7	177.7	50.6	0	0	0	0	114.3	G502 E503 D564	G502-T506 PolarHBondContact O-N 3.11Å; G502-T506 PolarHBondContact O-OG1 3.46Å; E503-T506 WeakPolarHBondContact CA-OG1 3.42Å; E503-T506 PolarHBondContact O-N 2.95Å; E503-T506 PolarHBondContact O-OG1 2.71Å; T506-D564 HydrophobicContact CG2-CB 4.01Å
507	R	84.8	Confident	86.6	Confident	61 Å²	61	41.2 Å²	41.2	23%	0.23	24%	0.235	C	C	.	.	S	Bend	trans	-59.8	153	172	-72	176.4	-171.9	176.3	7.3	112.3	E503 P509 P510 E511	E503-R507 WeakPolarHBondContact O-CG 3.22Å; E503-R507 PolarHBondContact O-N 2.8Å; E503-R507 VanDerWaalsContact O-N 3.17Å; E503-R507 IonicContact OE1-CZ 2.82Å; E503-R507 IonicContact OE1-NE 2.93Å; E503-R507 IonicContact OE1-NH2 2.74Å; E503-R507 PolarHBondContact OE1-NH2 3.19Å; R507-P509 CarbonylContact C-O 3.55Å; R507-P509 CarbonylContact O-C 3.16Å; R507-P510 VanDerWaalsContact O-CA 3.24Å; R507-P510 WeakPolarHBondContact O-CA 3.13Å; R507-E511 VanDerWaalsContact CD-OE1 3.27Å; R507-E511 WeakPolarHBondContact CD-OE1 3.4Å; R507-E511 IonicContact CZ-OE1 3.05Å; R507-E511 IonicContact NE-OE1 2.58Å; R507-E511 IonicContact NH1-OE1 2.7Å; R507-E511 PolarHBondContact NH1-OE1 2.62Å
508	S	76.4	Confident	86.6	Confident	91 Å²	91	41.2 Å²	41.2	64%	0.636	24%	0.235	S	C	*	.	S	Bend	trans	-121.7	108.9	178	50.1	0	0	0	0	111
509	P	78.8	Confident	86.7	Confident	114 Å²	114	42.1 Å²	42.1	74%	0.74	24%	0.24	S	C	*	.	S	Bend	cis	-70.8	156.3	-3.1	32.4	-36.6	0	0	0	113.3	R507	R507-P509 CarbonylContact C-O 3.55Å; R507-P509 CarbonylContact O-C 3.16Å
510	P	82.2	Confident	86.8	Confident	21 Å²	21	40.4 Å²	40.4	14%	0.136	24%	0.237	C	C	.	.			trans	-74.7	136.7	-179	28.9	-35.4	0	0	0	112.2	R507 L512 L563	R507-P510 VanDerWaalsContact O-CA 3.24Å; R507-P510 WeakPolarHBondContact O-CA 3.13Å; P510-L512 HydrophobicContact CB-CD2 4.37Å; P510-L512 HydrophobicContact CB-CG 4.33Å; P510-L512 HydrophobicContact CG-CG 4.4Å; P510-L512 PolarHBondContact O-N 2.63Å; P510-L563 HydrophobicContact CB-CD2 3.84Å; P510-L563 HydrophobicContact CG-CD2 3.78Å
511	E	83.8	Confident	86.9	Confident	60 Å²	60	41.5 Å²	41.5	28%	0.28	24%	0.242	S	C	.	.			trans	-84.6	52.7	-172.7	-73	-172.3	-123.2	0	0	113.2	L504 R507 G513 T514 I515	L504-E511 HydrophobicContact CB-CB 4.25Å; L504-E511 HydrophobicContact CD2-CB 3.97Å; L504-E511 HydrophobicContact CD2-CG 4.35Å; L504-E511 PolarHBondContact O-N 2.83Å; R507-E511 VanDerWaalsContact CD-OE1 3.27Å; R507-E511 WeakPolarHBondContact CD-OE1 3.4Å; R507-E511 IonicContact CZ-OE1 3.05Å; R507-E511 IonicContact NE-OE1 2.58Å; R507-E511 IonicContact NH1-OE1 2.7Å; R507-E511 PolarHBondContact NH1-OE1 2.62Å; E511-G513 PolarHBondContact O-N 2.8Å; E511-G513 VanDerWaalsContact O-N 3.15Å; E511-T514 WeakPolarHBondContact O-CA 3.29Å; E511-T514 WeakPolarHBondContact O-CB 3.42Å; E511-T514 PolarHBondContact O-N 3.2Å; E511-T514 PolarHBondContact OE2-OG1 3.22Å; E511-T514 VanDerWaalsContact OE2-OG1 3.08Å; E511-I515 PolarHBondContact O-N 3.13Å; E511-I515 VanDerWaalsContact O-N 3.15Å
512	L	84.8	Confident	87	Confident	56 Å²	56	41.5 Å²	41.5	29%	0.293	24%	0.242	S	C	.	.	H	α-helix	trans	-58.4	-31.8	-175.1	-58.3	179.6	0	0	0	113.4	P510 T514 I515 D516 V567 L686	P510-L512 HydrophobicContact CB-CD2 4.37Å; P510-L512 HydrophobicContact CB-CG 4.33Å; P510-L512 HydrophobicContact CG-CG 4.4Å; P510-L512 PolarHBondContact O-N 2.63Å; L512-T514 VanDerWaalsContact C-N 3.31Å; L512-I515 HydrophobicContact CD2-CD1 4.27Å; L512-I515 PolarHBondContact O-N 3.07Å; L512-D516 WeakPolarHBondContact O-CB 3.28Å; L512-D516 PolarHBondContact O-N 2.89Å; L512-V567 HydrophobicContact CD2-CG2 4.23Å; L512-L686 HydrophobicContact CD1-CB 3.93Å; L512-L686 HydrophobicContact CD1-CD1 3.94Å
513	G	87.2	Confident	87.3	Confident	46 Å²	46	46.3 Å²	46.3	47%	0.474	26%	0.26	S	S	.	.	H	α-helix	trans	-75.8	-14	175.7	0	0	0	0	0	114.9	E511 K517	E511-G513 PolarHBondContact O-N 2.8Å; E511-G513 VanDerWaalsContact O-N 3.15Å; G513-K517 WeakPolarHBondContact O-CG 3.28Å
514	T	87.9	Confident	87.5	Confident	8 Å²	8	46 Å²	46	5%	0.049	26%	0.264	C	S	.	.	H	α-helix	trans	-82.8	-47.9	169.1	-52.1	0	0	0	0	109.2	P464 L504 E511 L512 D516 K517 L518	P464-T514 HydrophobicContact CB-CG2 4.12Å; L504-T514 HydrophobicContact CD1-CG2 3.66Å; L504-T514 HydrophobicContact CD2-CG2 4.44Å; E511-T514 WeakPolarHBondContact O-CA 3.29Å; E511-T514 WeakPolarHBondContact O-CB 3.42Å; E511-T514 PolarHBondContact O-N 3.2Å; E511-T514 PolarHBondContact OE2-OG1 3.22Å; E511-T514 VanDerWaalsContact OE2-OG1 3.08Å; L512-T514 VanDerWaalsContact C-N 3.31Å; T514-D516 PolarHBondContact O-N 2.65Å; T514-K517 PolarHBondContact O-N 2.93Å; T514-K517 VanDerWaalsContact O-N 3.14Å; T514-L518 HydrophobicContact CG2-CD1 4.3Å; T514-L518 PolarHBondContact O-N 3.23Å
515	I	89.3	Confident	87.6	Confident	7 Å²	7	46 Å²	46	4%	0.036	26%	0.264	C	S	.	.	H	α-helix	trans	-54.1	-49.7	176.6	-67.2	169.1	0	0	0	111.5	M501 L504 A505 E511 L512 K517 L518 I519 V567	M501-I515 HydrophobicContact CE-CG2 3.76Å; L504-I515 HydrophobicContact CB-CD1 3.83Å; L504-I515 HydrophobicContact CB-CG1 3.79Å; L504-I515 HydrophobicContact CD1-CG1 3.92Å; A505-I515 HydrophobicContact CB-CD1 4Å; E511-I515 PolarHBondContact O-N 3.13Å; E511-I515 VanDerWaalsContact O-N 3.15Å; L512-I515 HydrophobicContact CD2-CD1 4.27Å; L512-I515 PolarHBondContact O-N 3.07Å; I515-K517 PolarHBondContact O-N 3.47Å; I515-L518 PolarHBondContact O-N 3.27Å; I515-I519 HydrophobicContact CG2-CD1 4.39Å; I515-I519 WeakPolarHBondContact O-CG1 3.24Å; I515-I519 PolarHBondContact O-N 3.49Å; I515-V567 HydrophobicContact CD1-CG1 4.44Å; I515-V567 HydrophobicContact CG2-CG1 4.02Å
516	D	90.8	Very high	87.9	Confident	113 Å²	113	46.3 Å²	46.3	60%	0.604	27%	0.267	S	S	*	.	H	α-helix	trans	-57.3	-34.7	179.8	-171	57.7	0	0	0	113.2	L512 T514 P520	L512-D516 WeakPolarHBondContact O-CB 3.28Å; L512-D516 PolarHBondContact O-N 2.89Å; T514-D516 PolarHBondContact O-N 2.65Å; D516-P520 WeakPolarHBondContact O-CD 3.41Å
517	K	90.8	Very high	88.2	Confident	62 Å²	62	48.7 Å²	48.7	27%	0.27	27%	0.273	S	S	.	.	H	α-helix	trans	-80.5	-20	178.2	-62.9	-170.3	-163.8	-166	0	113.8	P464 D465 R468 G513 T514 I515	P464-K517 HydrophobicContact CB-CD 4.12Å; D465-K517 WeakPolarHBondContact OD1-CD 3.14Å; D465-K517 IonicContact OD1-NZ 2.65Å; D465-K517 PolarHBondContact OD1-NZ 2.82Å; D465-K517 IonicContact OD2-NZ 3.48Å; D465-K517 PolarHBondContact OD2-NZ 3.48Å; R468-K517 HydrophobicContact CB-CB 4.31Å; R468-K517 WeakPolarHBondContact CD-O 3.35Å; R468-K517 VanDerWaalsContact CG-O 3.23Å; R468-K517 WeakPolarHBondContact CG-O 3.42Å; G513-K517 WeakPolarHBondContact O-CG 3.28Å; T514-K517 PolarHBondContact O-N 2.93Å; T514-K517 VanDerWaalsContact O-N 3.14Å; I515-K517 PolarHBondContact O-N 3.47Å
518	L	91	Very high	88.4	Confident	4 Å²	4	49 Å²	49	2%	0.021	28%	0.277	C	S	.	.	H	α-helix	trans	-85.1	-28	176.3	-67.2	174.1	0	0	0	112.7	V471 Y500 M501 L504 T514 I515 E521 L522	V471-L518 HydrophobicContact CG2-CD2 4.13Å; Y500-L518 HydrophobicContact CD1-CD1 4.22Å; Y500-L518 HydrophobicContact CE1-CD1 4.29Å; M501-L518 HydrophobicContact CG-CD1 4.5Å; M501-L518 HydrophobicContact SD-CB 4.49Å; L504-L518 HydrophobicContact CD1-CD1 4.08Å; T514-L518 HydrophobicContact CG2-CD1 4.3Å; T514-L518 PolarHBondContact O-N 3.23Å; I515-L518 PolarHBondContact O-N 3.27Å; L518-E521 PolarHBondContact O-N 2.87Å; L518-E521 VanDerWaalsContact O-N 3.07Å; L518-L522 PolarHBondContact O-N 3.41Å
519	I	92.1	Very high	89.1	Confident	25 Å²	25	45.4 Å²	45.4	13%	0.128	25%	0.251	C	S	.	.	H	α-helix	trans	-51.2	-43.1	179.8	-71.6	169.4	0	0	0	113.9	M501 I515 E521 L522 Y523 V571 L574	M501-I519 HydrophobicContact CE-CD1 4.42Å; M501-I519 HydrophobicContact CE-CG1 3.66Å; I515-I519 HydrophobicContact CG2-CD1 4.39Å; I515-I519 WeakPolarHBondContact O-CG1 3.24Å; I515-I519 PolarHBondContact O-N 3.49Å; I519-E521 VanDerWaalsContact C-N 3.35Å; I519-E521 PolarHBondContact O-N 3.49Å; I519-L522 PolarHBondContact O-N 2.85Å; I519-Y523 WeakPolarHBondContact O-CB 3.46Å; I519-Y523 PolarHBondContact O-N 2.86Å; I519-V571 HydrophobicContact CD1-CG2 4.09Å; I519-V571 HydrophobicContact CG1-CG2 4.32Å; I519-L574 HydrophobicContact CD1-CD1 4.04Å; I519-L574 HydrophobicContact CG2-CD1 4.4Å
520	P	92.4	Very high	89.8	Confident	56 Å²	56	43.6 Å²	43.6	36%	0.364	24%	0.239	S	C	.	.	H	α-helix	trans	-62.6	-37.3	177.6	-25.2	35.6	0	0	0	114.1	D516 Y523 A524	D516-P520 WeakPolarHBondContact O-CD 3.41Å; P520-Y523 PolarHBondContact O-N 3.23Å; P520-A524 PolarHBondContact O-N 2.71Å; P520-A524 VanDerWaalsContact O-N 3.13Å
521	E	90.9	Very high	90.2	Very high	25 Å²	25	50 Å²	50	12%	0.117	27%	0.267	C	S	.	.	H	α-helix	trans	-78.3	-34.3	-179.8	-46.6	-54.5	138.7	0	0	110.6	R468 V471 A472 Q475 L518 I519 A524 L525	R468-E521 HydrophobicContact CG-CG 3.72Å; R468-E521 IonicContact CZ-OE1 3.89Å; R468-E521 IonicContact NE-OE1 3.55Å; R468-E521 PolarHBondContact NE-OE1 2.9Å; R468-E521 IonicContact NH2-OE1 2.68Å; R468-E521 PolarHBondContact NH2-OE1 3.32Å; V471-E521 HydrophobicContact CG1-CB 3.95Å; A472-E521 HydrophobicContact CB-CG 4.41Å; A472-E521 VanDerWaalsContact CB-OE2 3.31Å; A472-E521 WeakPolarHBondContact CB-OE2 3.44Å; Q475-E521 PolarHBondContact NE2-O 2.76Å; Q475-E521 PolarHBondContact OE1-O 3.31Å; L518-E521 PolarHBondContact O-N 2.87Å; L518-E521 VanDerWaalsContact O-N 3.07Å; I519-E521 VanDerWaalsContact C-N 3.35Å; I519-E521 PolarHBondContact O-N 3.49Å; E521-A524 PolarHBondContact O-N 2.67Å; E521-L525 PolarHBondContact O-N 3.38Å
522	L	91.6	Very high	90.6	Very high	2 Å²	2	48 Å²	48	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-61.7	-44.7	168.2	176.2	63.8	0	0	0	111.3	V494 M498 M501 L518 I519 A524 L525 C526 V571 L575	V494-L522 HydrophobicContact CG1-CD1 4.41Å; M498-L522 HydrophobicContact CG-CD1 4.4Å; M498-L522 HydrophobicContact SD-CD1 4.15Å; M498-L522 HydrophobicContact SD-CD2 3.61Å; M498-L522 HydrophobicContact SD-CG 4.5Å; M501-L522 HydrophobicContact CE-CD2 4.08Å; M501-L522 HydrophobicContact SD-CD2 3.74Å; L518-L522 PolarHBondContact O-N 3.41Å; I519-L522 PolarHBondContact O-N 2.85Å; L522-A524 VanDerWaalsContact C-N 3.29Å; L522-A524 PolarHBondContact O-N 2.9Å; L522-L525 WeakPolarHBondContact O-CB 3.46Å; L522-L525 PolarHBondContact O-N 3.34Å; L522-L525 VanDerWaalsContact O-N 3.1Å; L522-C526 PolarHBondContact O-N 2.9Å; L522-C526 PolarHBondContact O-SG 3.34Å; L522-V571 HydrophobicContact CD2-CG1 4Å; L522-L575 HydrophobicContact CD2-CD1 3.93Å; L522-L575 HydrophobicContact CG-CD1 4.21Å; L522-L575 HydrophobicContact CG-CD2 4.33Å
523	Y	93.1	Very high	90.9	Very high	105 Å²	105	45.6 Å²	45.6	41%	0.412	25%	0.249	S	C	.	.	H	α-helix	trans	-59.8	-38.8	176.3	-179.9	-97.4	0	0	0	112.1	I519 P520 L525 C526 Q527 L575	I519-Y523 WeakPolarHBondContact O-CB 3.46Å; I519-Y523 PolarHBondContact O-N 2.86Å; P520-Y523 PolarHBondContact O-N 3.23Å; Y523-L525 PolarHBondContact O-N 2.77Å; Y523-C526 PolarHBondContact O-N 2.83Å; Y523-Q527 HydrophobicContact CD1-CG 4.17Å; Y523-Q527 HydrophobicContact CE1-CG 3.78Å; Y523-Q527 HydrophobicContact CE2-CG 4.46Å; Y523-Q527 WeakPolarHBondContact O-CG 3.41Å; Y523-Q527 PolarHBondContact O-N 2.93Å; Y523-Q527 PolarHBondContact OH-NE2 3.16Å; Y523-L575 HydrophobicContact CD2-CD2 3.94Å; Y523-L575 HydrophobicContact CG-CD2 4.4Å
524	A	91.7	Very high	91.1	Very high	36 Å²	36	43.9 Å²	43.9	30%	0.298	23%	0.231	S	C	.	.	H	α-helix	trans	-60	-43.2	173.4	0	0	0	0	0	112.2	P520 E521 L522 Q527 M528	P520-A524 PolarHBondContact O-N 2.71Å; P520-A524 VanDerWaalsContact O-N 3.13Å; E521-A524 PolarHBondContact O-N 2.67Å; L522-A524 VanDerWaalsContact C-N 3.29Å; L522-A524 PolarHBondContact O-N 2.9Å; A524-Q527 PolarHBondContact O-N 3.33Å; A524-M528 PolarHBondContact O-N 3.18Å
525	L	90	Very high	91.3	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-63.7	-41.5	172.2	-72.8	163.2	0	0	0	112.6	Q475 L490 L493 V494 L497 E521 L522 Y523 Q527 M528 F529	Q475-L525 HydrophobicContact CG-CD1 4.42Å; Q475-L525 HydrophobicContact CG-CD2 4.16Å; Q475-L525 HydrophobicContact CG-CG 4.22Å; L490-L525 HydrophobicContact CB-CD2 4.18Å; L490-L525 HydrophobicContact CD1-CD2 4.49Å; L490-L525 HydrophobicContact CD2-CD2 4.31Å; L493-L525 HydrophobicContact CD2-CD1 4.44Å; L493-L525 HydrophobicContact CG-CD1 4.4Å; V494-L525 HydrophobicContact CG2-CB 3.78Å; V494-L525 HydrophobicContact CG2-CD1 4.19Å; V494-L525 HydrophobicContact CG2-CD2 4.41Å; V494-L525 HydrophobicContact CG2-CG 4.36Å; L497-L525 HydrophobicContact CD1-CD1 3.54Å; E521-L525 PolarHBondContact O-N 3.38Å; L522-L525 WeakPolarHBondContact O-CB 3.46Å; L522-L525 PolarHBondContact O-N 3.34Å; L522-L525 VanDerWaalsContact O-N 3.1Å; Y523-L525 PolarHBondContact O-N 2.77Å; L525-Q527 VanDerWaalsContact C-N 3.29Å; L525-Q527 PolarHBondContact O-N 2.67Å; L525-M528 HydrophobicContact CD2-CE 4.03Å; L525-M528 PolarHBondContact O-N 3.31Å; L525-M528 VanDerWaalsContact O-N 3.11Å; L525-F529 HydrophobicContact CD2-CD2 4.35Å; L525-F529 HydrophobicContact CD2-CE2 4.29Å; L525-F529 PolarHBondContact O-N 2.97Å
526	C	92.1	Very high	91.4	Very high	8 Å²	8	52 Å²	52	5%	0.054	27%	0.269	C	S	.	.	H	α-helix	trans	-63.2	-33.1	177.6	-62.5	0	0	0	0	112.8	L522 Y523 F529 P530 A533	L522-C526 PolarHBondContact O-N 2.9Å; L522-C526 PolarHBondContact O-SG 3.34Å; Y523-C526 PolarHBondContact O-N 2.83Å; C526-F529 CarbonylContact O-C 3.59Å; C526-P530 VanDerWaalsContact O-CA 3.3Å; C526-P530 WeakPolarHBondContact O-CA 3.4Å; C526-P530 WeakPolarHBondContact O-CD 3.46Å; C526-A533 HydrophobicContact CB-CB 4.16Å; C526-A533 VanDerWaalsContact SG-CB 3.58Å
527	Q	90.9	Very high	91.5	Very high	122 Å²	122	46.7 Å²	46.7	57%	0.57	24%	0.241	S	C	*	.	H	α-helix	trans	-72.1	-29.6	173.6	-67.1	-63.2	-48.3	0	0	112.6	Y523 A524 L525	Y523-Q527 HydrophobicContact CD1-CG 4.17Å; Y523-Q527 HydrophobicContact CE1-CG 3.78Å; Y523-Q527 HydrophobicContact CE2-CG 4.46Å; Y523-Q527 WeakPolarHBondContact O-CG 3.41Å; Y523-Q527 PolarHBondContact O-N 2.93Å; Y523-Q527 PolarHBondContact OH-NE2 3.16Å; A524-Q527 PolarHBondContact O-N 3.33Å; L525-Q527 VanDerWaalsContact C-N 3.29Å; L525-Q527 PolarHBondContact O-N 2.67Å
528	M	89.4	Confident	91.6	Very high	67 Å²	67	47.7 Å²	47.7	33%	0.33	25%	0.247	S	C	.	.	H	α-helix	trans	-80.4	-34.8	173.9	-68.6	-174.1	-74.3	0	0	112.9	A524 L525	A524-M528 PolarHBondContact O-N 3.18Å; L525-M528 HydrophobicContact CD2-CE 4.03Å; L525-M528 PolarHBondContact O-N 3.31Å; L525-M528 VanDerWaalsContact O-N 3.11Å
529	F	91.6	Very high	91.7	Very high	17 Å²	17	50.6 Å²	50.6	8%	0.075	27%	0.267	C	S	.	.			trans	-135.9	63.4	-172.5	-49.7	-62.9	0	0	0	112.9	P480 K487 L490 Q491 L525 C526 E531 A532 A533	P480-F529 HydrophobicContact CG-CE1 4.36Å; P480-F529 HydrophobicContact CG-CZ 3.7Å; K487-F529 HydrophobicContact CG-CE1 3.94Å; L490-F529 HydrophobicContact CB-CD2 4.37Å; L490-F529 HydrophobicContact CB-CE2 3.53Å; L490-F529 HydrophobicContact CB-CZ 4.05Å; L490-F529 HydrophobicContact CD1-CE2 3.94Å; L490-F529 HydrophobicContact CD1-CZ 4.22Å; L490-F529 HydrophobicContact CG-CE2 4.42Å; Q491-F529 HydrophobicContact CG-CB 4.18Å; Q491-F529 HydrophobicContact CG-CD1 3.89Å; Q491-F529 HydrophobicContact CG-CD2 4.34Å; Q491-F529 HydrophobicContact CG-CE1 4.4Å; Q491-F529 HydrophobicContact CG-CG 3.85Å; L525-F529 HydrophobicContact CD2-CD2 4.35Å; L525-F529 HydrophobicContact CD2-CE2 4.29Å; L525-F529 PolarHBondContact O-N 2.97Å; C526-F529 CarbonylContact O-C 3.59Å; F529-E531 VanDerWaalsContact C-N 3.29Å; F529-E531 PolarHBondContact O-N 3.08Å; F529-A532 HydrophobicContact CB-CB 4.11Å; F529-A532 PolarHBondContact O-N 3.12Å; F529-A533 PolarHBondContact O-N 3.42Å; F529-A533 VanDerWaalsContact O-N 3.14Å
530	P	91.8	Very high	91.7	Very high	76 Å²	76	51.1 Å²	51.1	49%	0.494	27%	0.27	S	S	.	.	H	α-helix	trans	-61.9	-34	-174.7	24.1	-34.5	0	0	0	113.3	C526 G534	C526-P530 VanDerWaalsContact O-CA 3.3Å; C526-P530 WeakPolarHBondContact O-CA 3.4Å; C526-P530 WeakPolarHBondContact O-CD 3.46Å; P530-G534 PolarHBondContact O-N 3.23Å
531	E	91.3	Very high	91.7	Very high	156 Å²	156	48.7 Å²	48.7	73%	0.729	25%	0.254	S	S	*	.	H	α-helix	trans	-66.8	-41.9	177.5	-65.3	175.4	-176.3	0	0	112.7	F529 G534 K535	F529-E531 VanDerWaalsContact C-N 3.29Å; F529-E531 PolarHBondContact O-N 3.08Å; E531-G534 PolarHBondContact O-N 3.27Å; E531-K535 WeakPolarHBondContact O-CG 3.35Å; E531-K535 PolarHBondContact O-N 3Å
532	A	91.2	Very high	91.8	Very high	18 Å²	18	48.6 Å²	48.6	15%	0.149	26%	0.259	C	S	.	.	H	α-helix	trans	-68.1	-48.8	179.6	0	0	0	0	0	110.5	Q491 F529 G534 K535 S536	Q491-A532 HydrophobicContact CB-CB 4.29Å; Q491-A532 HydrophobicContact CG-CB 4.05Å; F529-A532 HydrophobicContact CB-CB 4.11Å; F529-A532 PolarHBondContact O-N 3.12Å; A532-G534 VanDerWaalsContact C-N 3.26Å; A532-G534 PolarHBondContact O-N 3.24Å; A532-K535 PolarHBondContact O-N 2.89Å; A532-S536 PolarHBondContact O-N 2.77Å; A532-S536 PolarHBondContact O-OG 3.41Å
533	A	91.7	Very high	91.8	Very high	5 Å²	5	52.7 Å²	52.7	4%	0.041	28%	0.281	C	S	.	.	H	α-helix	trans	-59.4	-37.4	174.2	0	0	0	0	0	112.5	V494 C526 F529 M537 F576	V494-A533 HydrophobicContact CG1-CB 3.99Å; C526-A533 HydrophobicContact CB-CB 4.16Å; C526-A533 VanDerWaalsContact SG-CB 3.58Å; F529-A533 PolarHBondContact O-N 3.42Å; F529-A533 VanDerWaalsContact O-N 3.14Å; A533-M537 WeakPolarHBondContact O-CB 3.39Å; A533-M537 PolarHBondContact O-N 3.09Å; A533-M537 VanDerWaalsContact O-N 3.13Å; A533-F576 HydrophobicContact CB-CZ 4.32Å
534	G	91.9	Very high	91.7	Very high	9 Å²	9	49 Å²	49	9%	0.093	27%	0.272	C	S	.	.	H	α-helix	trans	-61.3	-52	173.8	0	0	0	0	0	112.4	P530 E531 A532 M537 Q538	P530-G534 PolarHBondContact O-N 3.23Å; E531-G534 PolarHBondContact O-N 3.27Å; A532-G534 VanDerWaalsContact C-N 3.26Å; A532-G534 PolarHBondContact O-N 3.24Å; G534-M537 PolarHBondContact O-N 2.87Å; G534-Q538 WeakPolarHBondContact O-CB 3.32Å; G534-Q538 VanDerWaalsContact O-CG 3.26Å; G534-Q538 WeakPolarHBondContact O-CG 3.45Å; G534-Q538 PolarHBondContact O-N 2.84Å
535	K	92.3	Very high	91.6	Very high	152 Å²	152	48.7 Å²	48.7	66%	0.661	27%	0.27	S	S	*	.	H	α-helix	trans	-62.2	-45.7	178.7	-73.9	-178.4	177.9	-172.9	0	112.6	E531 A532 M537 Q538 S539	E531-K535 WeakPolarHBondContact O-CG 3.35Å; E531-K535 PolarHBondContact O-N 3Å; A532-K535 PolarHBondContact O-N 2.89Å; K535-M537 PolarHBondContact O-N 3.49Å; K535-Q538 PolarHBondContact O-N 3.26Å; K535-S539 PolarHBondContact O-N 3.45Å
536	S	91.3	Very high	91.7	Very high	33 Å²	33	54.1 Å²	54.1	23%	0.231	30%	0.295	C	S	.	.	H	α-helix	trans	-60.1	-45.2	177.9	-62.5	0	0	0	0	112.1	A532 S539 I540	A532-S536 PolarHBondContact O-N 2.77Å; A532-S536 PolarHBondContact O-OG 3.41Å; S536-S539 PolarHBondContact O-N 3.45Å; S536-I540 WeakPolarHBondContact O-CG1 3.35Å; S536-I540 PolarHBondContact O-N 3.31Å
537	M	92.8	Very high	91.6	Very high	3 Å²	3	57.4 Å²	57.4	2%	0.015	32%	0.318	C	S	.	.	H	α-helix	trans	-68.5	-35.1	175.8	-170	69.2	80.2	0	0	111.9	M498 A533 G534 K535 S539 I540 L541 V571 T572 V585	M498-M537 HydrophobicContact CE-CE 3.31Å; M498-M537 HydrophobicContact CE-SD 3.94Å; M498-M537 HydrophobicContact SD-CE 4.36Å; A533-M537 WeakPolarHBondContact O-CB 3.39Å; A533-M537 PolarHBondContact O-N 3.09Å; A533-M537 VanDerWaalsContact O-N 3.13Å; G534-M537 PolarHBondContact O-N 2.87Å; K535-M537 PolarHBondContact O-N 3.49Å; M537-S539 PolarHBondContact O-N 2.88Å; M537-I540 PolarHBondContact O-N 2.92Å; M537-L541 HydrophobicContact CG-CD1 3.92Å; M537-L541 HydrophobicContact CG-CG 4.14Å; M537-L541 WeakPolarHBondContact O-CB 3.5Å; M537-L541 WeakPolarHBondContact O-CG 3.25Å; M537-L541 PolarHBondContact O-N 3.13Å; M537-L541 HydrophobicContact SD-CG 4.43Å; M537-V571 HydrophobicContact CE-CG1 4.28Å; M537-T572 WeakPolarHBondContact CE-OG1 3.48Å; M537-T572 PolarHBondContact SD-OG1 2.96Å; M537-T572 VanDerWaalsContact SD-OG1 3.37Å; M537-V585 HydrophobicContact CB-CG1 3.74Å; M537-V585 HydrophobicContact CG-CG1 3.31Å
538	Q	92.8	Very high	91.4	Very high	83 Å²	83	52.4 Å²	52.4	39%	0.388	30%	0.295	S	S	.	.	H	α-helix	trans	-62.8	-39	175.4	-80	176.2	-35	0	0	112.8	G534 K535 G542 P584 V585	G534-Q538 WeakPolarHBondContact O-CB 3.32Å; G534-Q538 VanDerWaalsContact O-CG 3.26Å; G534-Q538 WeakPolarHBondContact O-CG 3.45Å; G534-Q538 PolarHBondContact O-N 2.84Å; K535-Q538 PolarHBondContact O-N 3.26Å; Q538-G542 PolarHBondContact O-N 2.89Å; Q538-P584 PolarHBondContact NE2-O 3.35Å; Q538-V585 HydrophobicContact CG-CG2 4.45Å
539	S	93.3	Very high	91.3	Very high	64 Å²	64	54.8 Å²	54.8	45%	0.448	31%	0.305	S	S	.	.	H	α-helix	trans	-60.3	-59.1	172	-158.4	0	0	0	0	110	K535 S536 M537 L541 G542 D543	K535-S539 PolarHBondContact O-N 3.45Å; S536-S539 PolarHBondContact O-N 3.45Å; M537-S539 PolarHBondContact O-N 2.88Å; S539-L541 PolarHBondContact O-N 2.66Å; S539-L541 VanDerWaalsContact O-N 3.1Å; S539-G542 CarbonylContact O-C 3.56Å; S539-G542 WeakPolarHBondContact O-CA 3.26Å; S539-G542 PolarHBondContact O-N 3.07Å; S539-D543 WeakPolarHBondContact O-CB 3.5Å; S539-D543 PolarHBondContact O-N 2.98Å; S539-D543 PolarHBondContact OG-OD2 3.1Å
540	I	92	Very high	91.2	Very high	36 Å²	36	60 Å²	60	19%	0.185	33%	0.329	C	S	.	.	H	α-helix	trans	-51.9	-42.6	-178.2	-64.7	166.3	0	0	0	112.2	M498 S536 M537 A544 Y568	M498-I540 HydrophobicContact CB-CD1 4.25Å; M498-I540 HydrophobicContact CE-CD1 4.15Å; S536-I540 WeakPolarHBondContact O-CG1 3.35Å; S536-I540 PolarHBondContact O-N 3.31Å; M537-I540 PolarHBondContact O-N 2.92Å; I540-A544 VanDerWaalsContact O-CB 3.24Å; I540-A544 WeakPolarHBondContact O-CB 3.21Å; I540-A544 PolarHBondContact O-N 3.19Å; I540-Y568 HydrophobicContact CD1-CE1 4.35Å; I540-Y568 HydrophobicContact CG2-CD2 3.51Å; I540-Y568 HydrophobicContact CG2-CE2 3.7Å; I540-Y568 HydrophobicContact CG2-CG 4.06Å
541	L	92.8	Very high	91	Very high	6 Å²	6	57.4 Å²	57.4	3%	0.031	32%	0.315	C	S	.	.	H	α-helix	trans	-71.1	-36.7	176.8	-66.5	175.8	0	0	0	113.1	M537 S539 A545 M565 L569 V585 P588 A589	M537-L541 HydrophobicContact CG-CD1 3.92Å; M537-L541 HydrophobicContact CG-CG 4.14Å; M537-L541 WeakPolarHBondContact O-CB 3.5Å; M537-L541 WeakPolarHBondContact O-CG 3.25Å; M537-L541 PolarHBondContact O-N 3.13Å; M537-L541 HydrophobicContact SD-CG 4.43Å; S539-L541 PolarHBondContact O-N 2.66Å; S539-L541 VanDerWaalsContact O-N 3.1Å; L541-A545 VanDerWaalsContact O-CB 3.29Å; L541-A545 WeakPolarHBondContact O-CB 3.46Å; L541-A545 PolarHBondContact O-N 3.28Å; L541-A545 VanDerWaalsContact O-N 3.09Å; L541-M565 HydrophobicContact CD2-CE 3.63Å; L541-M565 HydrophobicContact CD2-SD 4.47Å; L541-L569 HydrophobicContact CD2-CD2 3.99Å; L541-V585 HydrophobicContact CD1-CG1 4.05Å; L541-P588 HydrophobicContact CD1-CB 4.34Å; L541-A589 HydrophobicContact CD1-CB 3.91Å; L541-A589 HydrophobicContact CD2-CB 4.25Å
542	G	92.7	Very high	90.8	Very high	23 Å²	23	51.6 Å²	51.6	24%	0.237	29%	0.29	C	S	.	.	H	α-helix	trans	-71.6	-50	178.3	0	0	0	0	0	112.5	Q538 S539 A544 A545 H546	Q538-G542 PolarHBondContact O-N 2.89Å; S539-G542 CarbonylContact O-C 3.56Å; S539-G542 WeakPolarHBondContact O-CA 3.26Å; S539-G542 PolarHBondContact O-N 3.07Å; G542-A544 VanDerWaalsContact C-N 3.29Å; G542-A544 PolarHBondContact O-N 3.06Å; G542-A545 CarbonylContact O-C 3.4Å; G542-A545 WeakPolarHBondContact O-CA 3.37Å; G542-A545 WeakPolarHBondContact O-CB 3.31Å; G542-A545 PolarHBondContact O-N 3.33Å; G542-H546 PolarHBondContact O-CD2 2.92Å; G542-H546 PolarHBondContact O-N 2.93Å
543	D	91.9	Very high	90.6	Very high	88 Å²	88	58.5 Å²	58.5	47%	0.471	32%	0.319	S	S	.	.	H	α-helix	trans	-57.5	-42.9	177.7	-59.6	-41.5	0	0	0	110.9	S539 S547	S539-D543 WeakPolarHBondContact O-CB 3.5Å; S539-D543 PolarHBondContact O-N 2.98Å; S539-D543 PolarHBondContact OG-OD2 3.1Å; D543-S547 VanDerWaalsContact O-CB 3.29Å; D543-S547 WeakPolarHBondContact O-CB 3.19Å; D543-S547 PolarHBondContact O-N 3.26Å; D543-S547 PolarHBondContact O-OG 3.31Å
544	A	90.3	Very high	90.5	Very high	27 Å²	27	63.9 Å²	63.9	22%	0.223	35%	0.351	C	S	.	.	H	α-helix	trans	-67.8	-34.3	173.1	0	0	0	0	0	113.4	I540 G542 M548 M565 F592	I540-A544 VanDerWaalsContact O-CB 3.24Å; I540-A544 WeakPolarHBondContact O-CB 3.21Å; I540-A544 PolarHBondContact O-N 3.19Å; G542-A544 VanDerWaalsContact C-N 3.29Å; G542-A544 PolarHBondContact O-N 3.06Å; A544-M548 WeakPolarHBondContact O-CB 3.48Å; A544-M548 PolarHBondContact O-N 2.65Å; A544-M565 HydrophobicContact CB-CE 3.65Å; A544-M565 HydrophobicContact CB-SD 4.14Å; A544-F592 HydrophobicContact CB-CE2 4Å; A544-F592 HydrophobicContact CB-CZ 4.33Å
545	A	90	Very high	89.8	Confident	29 Å²	29	70 Å²	70	24%	0.24	38%	0.375	C	S	.	.	H	α-helix	trans	-70.1	-46.9	176.7	0	0	0	0	0	111.8	L541 G542 M548 E549 F592	L541-A545 VanDerWaalsContact O-CB 3.29Å; L541-A545 WeakPolarHBondContact O-CB 3.46Å; L541-A545 PolarHBondContact O-N 3.28Å; L541-A545 VanDerWaalsContact O-N 3.09Å; G542-A545 CarbonylContact O-C 3.4Å; G542-A545 WeakPolarHBondContact O-CA 3.37Å; G542-A545 WeakPolarHBondContact O-CB 3.31Å; G542-A545 PolarHBondContact O-N 3.33Å; A545-M548 PolarHBondContact O-N 3.23Å; A545-E549 PolarHBondContact O-N 3.37Å; A545-F592 HydrophobicContact CB-CD2 4.2Å
546	H	91.4	Very high	89.1	Confident	115 Å²	115	65.8 Å²	65.8	53%	0.532	38%	0.375	S	S	.	.	H	α-helix	trans	-62	-46.7	176	-68.4	-55.3	0	0	0	111.5	G542 M548 E549 E550	G542-H546 PolarHBondContact O-CD2 2.92Å; G542-H546 PolarHBondContact O-N 2.93Å; H546-M548 PolarHBondContact O-N 2.91Å; H546-M548 VanDerWaalsContact O-N 3.17Å; H546-E549 PolarHBondContact O-N 3.43Å; H546-E550 WeakPolarHBondContact O-CG 3.29Å; H546-E550 PolarHBondContact O-N 3.47Å
547	S	89.8	Confident	88.4	Confident	77 Å²	77	66.8 Å²	66.8	54%	0.538	38%	0.376	S	S	.	.	H	α-helix	trans	-56.2	-33.9	174.4	-60.7	0	0	0	0	113.2	D543 A551	D543-S547 VanDerWaalsContact O-CB 3.29Å; D543-S547 WeakPolarHBondContact O-CB 3.19Å; D543-S547 PolarHBondContact O-N 3.26Å; D543-S547 PolarHBondContact O-OG 3.31Å; S547-A551 WeakPolarHBondContact O-CB 3.49Å; S547-A551 PolarHBondContact O-N 2.9Å
548	M	87.4	Confident	88	Confident	17 Å²	17	66.8 Å²	66.8	8%	0.084	38%	0.376	C	S	.	.	H	α-helix	trans	-77.4	-37.6	175.5	179.5	172.9	52.2	0	0	112.4	A544 A545 H546 A551 V552 A558 F592 L595 T596	A544-M548 WeakPolarHBondContact O-CB 3.48Å; A544-M548 PolarHBondContact O-N 2.65Å; A545-M548 PolarHBondContact O-N 3.23Å; H546-M548 PolarHBondContact O-N 2.91Å; H546-M548 VanDerWaalsContact O-N 3.17Å; M548-A551 PolarHBondContact O-N 3.17Å; M548-V552 WeakPolarHBondContact O-CG2 3.38Å; M548-V552 PolarHBondContact O-N 3.18Å; M548-A558 HydrophobicContact CG-CB 3.7Å; M548-A558 HydrophobicContact SD-CB 4.05Å; M548-F592 HydrophobicContact CE-CD2 3.81Å; M548-F592 HydrophobicContact CE-CE2 3.56Å; M548-F592 HydrophobicContact CE-CZ 4.18Å; M548-L595 HydrophobicContact CE-CB 4.11Å; M548-L595 HydrophobicContact CE-CD2 3.55Å; M548-L595 HydrophobicContact CE-CG 3.67Å; M548-T596 HydrophobicContact CE-CG2 3.92Å; M548-T596 HydrophobicContact SD-CG2 3.54Å; M548-T596 VanDerWaalsContact SD-CG2 3.54Å
549	E	88	Confident	87.6	Confident	116 Å²	116	66.6 Å²	66.6	54%	0.542	39%	0.389	S	S	.	.	H	α-helix	trans	-65.5	-48.8	178.1	-171.8	150	-125.9	0	0	111.1	A545 H546 A551 V552 E553	A545-E549 PolarHBondContact O-N 3.37Å; H546-E549 PolarHBondContact O-N 3.43Å; E549-A551 VanDerWaalsContact C-N 3.28Å; E549-A551 PolarHBondContact O-N 3Å; E549-V552 CarbonylContact O-C 3.58Å; E549-V552 WeakPolarHBondContact O-CA 3.47Å; E549-V552 WeakPolarHBondContact O-CB 3.34Å; E549-V552 PolarHBondContact O-N 2.56Å; E549-E553 PolarHBondContact O-N 3.49Å
550	E	89.3	Confident	87.3	Confident	126 Å²	126	64.5 Å²	64.5	59%	0.589	37%	0.372	S	S	*	.	H	α-helix	trans	-53.2	-44.3	171.2	-70	179.2	-169.3	0	0	112.1	H546 V552 E553 V554	H546-E550 WeakPolarHBondContact O-CG 3.29Å; H546-E550 PolarHBondContact O-N 3.47Å; E550-V552 VanDerWaalsContact C-N 3.29Å; E550-V552 PolarHBondContact O-N 3.16Å; E550-E553 PolarHBondContact O-N 2.94Å; E550-V554 WeakPolarHBondContact O-CB 3.47Å; E550-V554 WeakPolarHBondContact O-CG2 3.23Å; E550-V554 PolarHBondContact O-N 3.41Å
551	A	87	Confident	87.2	Confident	23 Å²	23	63.8 Å²	63.8	19%	0.19	37%	0.37	C	S	.	.	H	α-helix	trans	-64.7	-33.7	177.3	0	0	0	0	0	112.4	S547 M548 E549 K555	S547-A551 WeakPolarHBondContact O-CB 3.49Å; S547-A551 PolarHBondContact O-N 2.9Å; M548-A551 PolarHBondContact O-N 3.17Å; E549-A551 VanDerWaalsContact C-N 3.28Å; E549-A551 PolarHBondContact O-N 3Å; A551-K555 VanDerWaalsContact O-CB 3.29Å; A551-K555 WeakPolarHBondContact O-CB 3.33Å; A551-K555 PolarHBondContact O-N 2.9Å; A551-K555 VanDerWaalsContact O-N 3.1Å
552	V	86.6	Confident	86.9	Confident	34 Å²	34	67.6 Å²	67.6	21%	0.206	39%	0.394	C	S	.	.	H	α-helix	trans	-72.5	-39.1	174.2	168.6	0	0	0	0	111.6	M548 E549 E550 G556 A558 K599	M548-V552 WeakPolarHBondContact O-CG2 3.38Å; M548-V552 PolarHBondContact O-N 3.18Å; E549-V552 CarbonylContact O-C 3.58Å; E549-V552 WeakPolarHBondContact O-CA 3.47Å; E549-V552 WeakPolarHBondContact O-CB 3.34Å; E549-V552 PolarHBondContact O-N 2.56Å; E550-V552 VanDerWaalsContact C-N 3.29Å; E550-V552 PolarHBondContact O-N 3.16Å; V552-G556 CarbonylContact O-C 3.55Å; V552-G556 WeakPolarHBondContact O-CA 3.21Å; V552-G556 PolarHBondContact O-N 3.46Å; V552-A558 HydrophobicContact CG2-CB 3.92Å; V552-K599 HydrophobicContact CG2-CB 4.15Å
553	E	88.1	Confident	86.7	Confident	162 Å²	162	66.6 Å²	66.6	76%	0.757	38%	0.383	S	S	*	.	H	α-helix	trans	-65.7	-51.2	175.4	-66.2	-159.5	143	0	0	111.7	E549 E550 K555	E549-E553 PolarHBondContact O-N 3.49Å; E550-E553 PolarHBondContact O-N 2.94Å; E553-K555 PolarHBondContact O-N 3.31Å
554	V	88.4	Confident	86.6	Confident	118 Å²	118	64.1 Å²	64.1	72%	0.715	37%	0.37	S	S	*	.	H	α-helix	trans	-70.5	-33.7	-175.1	176.1	0	0	0	0	112.6	E550	E550-V554 WeakPolarHBondContact O-CB 3.47Å; E550-V554 WeakPolarHBondContact O-CG2 3.23Å; E550-V554 PolarHBondContact O-N 3.41Å
555	K	78.3	Confident	86.7	Confident	137 Å²	137	63.3 Å²	63.3	60%	0.596	36%	0.361	S	S	*	.	H	α-helix	trans	-118.3	-4.4	-170.9	-54.7	164.7	-174.3	155.9	0	113.9	A551 E553 H557	A551-K555 VanDerWaalsContact O-CB 3.29Å; A551-K555 WeakPolarHBondContact O-CB 3.33Å; A551-K555 PolarHBondContact O-N 2.9Å; A551-K555 VanDerWaalsContact O-N 3.1Å; E553-K555 PolarHBondContact O-N 3.31Å; K555-H557 PolarHBondContact O-CD2 3.48Å; K555-H557 VanDerWaalsContact O-CD2 3.29Å; K555-H557 PolarHBondContact O-N 3.34Å; K555-H557 PolarHBondContact O-NE2 3.42Å
556	G	77.4	Confident	86.8	Confident	64 Å²	64	62.2 Å²	62.2	66%	0.66	35%	0.351	S	S	*	.	S	Bend	trans	69.2	5.5	-173.4	0	0	0	0	0	114.7	V552	V552-G556 CarbonylContact O-C 3.55Å; V552-G556 WeakPolarHBondContact O-CA 3.21Å; V552-G556 PolarHBondContact O-N 3.46Å
557	H	75.3	Confident	86.8	Confident	54 Å²	54	57.5 Å²	57.5	25%	0.25	33%	0.33	C	S	.	.	S	Bend	trans	-163.8	147.5	-174.8	56.3	50.3	0	0	0	113	K555 L601 R603	K555-H557 PolarHBondContact O-CD2 3.48Å; K555-H557 VanDerWaalsContact O-CD2 3.29Å; K555-H557 PolarHBondContact O-N 3.34Å; K555-H557 PolarHBondContact O-NE2 3.42Å; H557-L601 HydrophobicContact CB-CD1 3.51Å; H557-L601 HydrophobicContact CB-CG 3.89Å; H557-R603 PolarHBondContact CD2-NH2 3.32Å; H557-R603 PolarHBondContact CE1-NH2 3.09Å; H557-R603 VanDerWaalsContact CE1-NH2 3.29Å; H557-R603 PolarHBondContact NE2-NH2 3.01Å
558	A	84.3	Confident	87	Confident	3 Å²	3	54.9 Å²	54.9	3%	0.025	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-88.6	157.4	170.7	0	0	0	0	0	112	M548 V552 K599 L601	M548-A558 HydrophobicContact CG-CB 3.7Å; M548-A558 HydrophobicContact SD-CB 4.05Å; V552-A558 HydrophobicContact CG2-CB 3.92Å; A558-K599 HydrophobicContact CB-CB 4.35Å; A558-K599 PolarHBondContact N-O 2.83Å; A558-L601 PolarHBondContact O-N 2.86Å
559	A	85.1	Confident	87.4	Confident	79 Å²	79	54 Å²	54	65%	0.653	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-84.6	165	155.1	0	0	0	0	0	109.2	C600	A559-C600 PolarHBondContact O-SG 3.35Å
560	F	88.3	Confident	87.6	Confident	20 Å²	20	52 Å²	52	9%	0.088	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-71.3	150	171.9	-80	-90	0	0	0	111.5	C600 V602 D607 S610 L614 F635	F560-C600 HydrophobicContact CD1-CB 3.79Å; F560-C600 HydrophobicContact CD2-CB 3.64Å; F560-C600 HydrophobicContact CE1-CB 3.64Å; F560-C600 HydrophobicContact CE2-CB 3.48Å; F560-C600 VanDerWaalsContact CE2-CB 3.48Å; F560-C600 WeakPolarHBondContact CE2-O 3.35Å; F560-C600 HydrophobicContact CG-CB 3.79Å; F560-C600 HydrophobicContact CZ-CB 3.48Å; F560-C600 VanDerWaalsContact CZ-CB 3.48Å; F560-C600 WeakPolarHBondContact CZ-O 3.48Å; F560-V602 HydrophobicContact CE2-CG2 3.88Å; F560-V602 HydrophobicContact CZ-CG2 3.82Å; F560-D607 HydrophobicContact CD2-CB 3.57Å; F560-D607 HydrophobicContact CE2-CB 3.75Å; F560-S610 VanDerWaalsContact CB-OG 3.27Å; F560-S610 WeakPolarHBondContact CB-OG 3.16Å; F560-S610 WeakPolarHBondContact CG-OG 3.44Å; F560-L614 HydrophobicContact CD1-CD1 3.99Å; F560-L614 HydrophobicContact CE1-CD1 4.26Å; F560-F635 HydrophobicContact CE1-CE2 4.37Å; F560-F635 HydrophobicContact CZ-CE2 4.06Å; F560-F635 HydrophobicContact CZ-CZ 4.42Å
561	P	88.6	Confident	87.8	Confident	21 Å²	21	46 Å²	46	14%	0.136	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-63.5	149.9	175	27.3	-35.7	0	0	0	112.1	M565 L566 F592 T596 L614	P561-M565 HydrophobicContact CB-CB 4.01Å; P561-M565 HydrophobicContact CB-CG 3.97Å; P561-L566 HydrophobicContact CG-CD2 4.07Å; P561-F592 HydrophobicContact CB-CE1 4.34Å; P561-F592 HydrophobicContact CB-CZ 4.43Å; P561-F592 HydrophobicContact CG-CE1 4.36Å; P561-T596 HydrophobicContact CG-CG2 4.14Å; P561-L614 HydrophobicContact CG-CD1 4.07Å
562	T	87	Confident	88.1	Confident	87 Å²	87	45 Å²	45	53%	0.534	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-74.6	168.1	175.6	38	0	0	0	0	112.5	D564 M565 L566	T562-D564 VanDerWaalsContact C-N 3.33Å; T562-D564 WeakPolarHBondContact CB-OD1 3.43Å; T562-D564 PolarHBondContact O-N 3.17Å; T562-D564 PolarHBondContact OG1-OD1 3.01Å; T562-M565 PolarHBondContact O-N 2.99Å; T562-M565 VanDerWaalsContact O-N 3.16Å; T562-L566 PolarHBondContact O-N 3.43Å; T562-L566 VanDerWaalsContact O-N 3.14Å
563	L	88.6	Confident	88.5	Confident	1 Å²	1	44 Å²	44	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-64.4	-33	-170.5	179.5	59.6	0	0	0	113.7	P510 L566 V567 L686 Q690	P510-L563 HydrophobicContact CB-CD2 3.84Å; P510-L563 HydrophobicContact CG-CD2 3.78Å; L563-L566 HydrophobicContact CD1-CB 4.48Å; L563-L566 PolarHBondContact O-N 2.9Å; L563-V567 HydrophobicContact CD1-CG2 4.41Å; L563-V567 WeakPolarHBondContact O-CB 3.34Å; L563-V567 WeakPolarHBondContact O-CG2 3.18Å; L563-V567 PolarHBondContact O-N 2.94Å; L563-L686 HydrophobicContact CD1-CB 4.26Å; L563-Q690 HydrophobicContact CB-CG 3.84Å; L563-Q690 HydrophobicContact CD2-CG 4.33Å
564	D	89.8	Confident	88.7	Confident	37 Å²	37	40 Å²	40	20%	0.198	24%	0.237	C	C	.	.	H	α-helix	trans	-53	-50.6	169.2	56.5	-25.7	0	0	0	112.3	A505 T506 T562 L566 V567 Y568	A505-D564 HydrophobicContact CB-CB 4.08Å; T506-D564 HydrophobicContact CG2-CB 4.01Å; T562-D564 VanDerWaalsContact C-N 3.33Å; T562-D564 WeakPolarHBondContact CB-OD1 3.43Å; T562-D564 PolarHBondContact O-N 3.17Å; T562-D564 PolarHBondContact OG1-OD1 3.01Å; D564-L566 PolarHBondContact O-N 3.36Å; D564-V567 CarbonylContact O-C 3.59Å; D564-V567 WeakPolarHBondContact O-CA 3.12Å; D564-V567 WeakPolarHBondContact O-CB 3.5Å; D564-V567 PolarHBondContact O-N 3.4Å; D564-V567 VanDerWaalsContact O-N 3.11Å; D564-Y568 WeakPolarHBondContact O-CD2 3.38Å; D564-Y568 PolarHBondContact O-N 3.28Å
565	M	91.6	Very high	88.9	Confident	10 Å²	10	35.2 Å²	35.2	5%	0.049	21%	0.207	C	C	.	.	H	α-helix	trans	-68.7	-33.8	178.2	-175	57.6	170.1	0	0	112.3	L541 A544 P561 T562 V567 Y568 L569 F592	L541-M565 HydrophobicContact CD2-CE 3.63Å; L541-M565 HydrophobicContact CD2-SD 4.47Å; A544-M565 HydrophobicContact CB-CE 3.65Å; A544-M565 HydrophobicContact CB-SD 4.14Å; P561-M565 HydrophobicContact CB-CB 4.01Å; P561-M565 HydrophobicContact CB-CG 3.97Å; T562-M565 PolarHBondContact O-N 2.99Å; T562-M565 VanDerWaalsContact O-N 3.16Å; M565-V567 VanDerWaalsContact C-N 3.3Å; M565-V567 PolarHBondContact O-N 3.35Å; M565-Y568 PolarHBondContact O-N 3.02Å; M565-Y568 HydrophobicContact SD-CD2 4.36Å; M565-L569 HydrophobicContact CE-CD2 4.42Å; M565-L569 HydrophobicContact CE-CG 4.42Å; M565-L569 HydrophobicContact CG-CD1 4.44Å; M565-L569 WeakPolarHBondContact O-CB 3.19Å; M565-L569 VanDerWaalsContact O-CG 3.25Å; M565-L569 WeakPolarHBondContact O-CG 3.11Å; M565-L569 PolarHBondContact O-N 2.96Å; M565-F592 HydrophobicContact CE-CD1 3.62Å; M565-F592 HydrophobicContact CE-CD2 3.98Å; M565-F592 HydrophobicContact CE-CE1 3.4Å; M565-F592 VanDerWaalsContact CE-CE1 3.4Å; M565-F592 HydrophobicContact CE-CE2 3.78Å; M565-F592 HydrophobicContact CE-CG 3.91Å; M565-F592 HydrophobicContact CE-CZ 3.5Å; M565-F592 HydrophobicContact CG-CE1 3.9Å; M565-F592 HydrophobicContact CG-CZ 4.09Å
566	L	92	Very high	89.6	Confident	5 Å²	5	29.9 Å²	29.9	3%	0.026	18%	0.184	C	C	.	.	H	α-helix	trans	-64.7	-35.3	170.6	-61.8	176.6	0	0	0	111.9	P561 T562 L563 D564 K570 V613 L614 T689	P561-L566 HydrophobicContact CG-CD2 4.07Å; T562-L566 PolarHBondContact O-N 3.43Å; T562-L566 VanDerWaalsContact O-N 3.14Å; L563-L566 HydrophobicContact CD1-CB 4.48Å; L563-L566 PolarHBondContact O-N 2.9Å; D564-L566 PolarHBondContact O-N 3.36Å; L566-K570 PolarHBondContact O-N 3.43Å; L566-K570 VanDerWaalsContact O-N 3.15Å; L566-V613 HydrophobicContact CB-CG1 4.46Å; L566-V613 HydrophobicContact CD1-CB 4.46Å; L566-V613 HydrophobicContact CD1-CG1 4.15Å; L566-V613 HydrophobicContact CD2-CG1 4.34Å; L566-L614 HydrophobicContact CD2-CD1 4.46Å; L566-L614 HydrophobicContact CD2-CD2 3.63Å; L566-L614 HydrophobicContact CD2-CG 3.73Å; L566-T689 HydrophobicContact CD1-CG2 3.96Å
567	V	92.3	Very high	90.3	Very high	16 Å²	16	28.6 Å²	28.6	10%	0.097	16%	0.164	C	C	.	.	H	α-helix	trans	-69.4	-45	172.7	167.7	0	0	0	0	110.9	A505 L512 I515 L563 D564 M565 L569 K570 V571	A505-V567 HydrophobicContact CB-CB 4.43Å; A505-V567 HydrophobicContact CB-CG2 4.19Å; L512-V567 HydrophobicContact CD2-CG2 4.23Å; I515-V567 HydrophobicContact CD1-CG1 4.44Å; I515-V567 HydrophobicContact CG2-CG1 4.02Å; L563-V567 HydrophobicContact CD1-CG2 4.41Å; L563-V567 WeakPolarHBondContact O-CB 3.34Å; L563-V567 WeakPolarHBondContact O-CG2 3.18Å; L563-V567 PolarHBondContact O-N 2.94Å; D564-V567 CarbonylContact O-C 3.59Å; D564-V567 WeakPolarHBondContact O-CA 3.12Å; D564-V567 WeakPolarHBondContact O-CB 3.5Å; D564-V567 PolarHBondContact O-N 3.4Å; D564-V567 VanDerWaalsContact O-N 3.11Å; M565-V567 VanDerWaalsContact C-N 3.3Å; M565-V567 PolarHBondContact O-N 3.35Å; V567-L569 VanDerWaalsContact C-N 3.35Å; V567-L569 PolarHBondContact O-N 2.99Å; V567-K570 CarbonylContact O-C 3.56Å; V567-K570 WeakPolarHBondContact O-CA 3.3Å; V567-K570 WeakPolarHBondContact O-CB 3.38Å; V567-K570 PolarHBondContact O-N 3.07Å; V567-V571 HydrophobicContact CG1-CG2 4.11Å; V567-V571 WeakPolarHBondContact O-CB 3.49Å; V567-V571 WeakPolarHBondContact O-CG2 3.43Å; V567-V571 PolarHBondContact O-N 2.65Å
568	Y	93.8	Very high	91.2	Very high	22 Å²	22	26.9 Å²	26.9	9%	0.086	16%	0.157	C	C	.	.	H	α-helix	trans	-60.4	-41	176	-68	-44.4	0	0	0	112.8	M498 G502 I540 D564 M565 K570 V571 T572	M498-Y568 HydrophobicContact CE-CD1 3.55Å; M498-Y568 HydrophobicContact CE-CE1 3.73Å; M498-Y568 WeakPolarHBondContact O-CE1 3.42Å; M498-Y568 PolarHBondContact O-OH 2.85Å; M498-Y568 VanDerWaalsContact O-OH 3.12Å; G502-Y568 WeakPolarHBondContact CA-OH 3.27Å; I540-Y568 HydrophobicContact CD1-CE1 4.35Å; I540-Y568 HydrophobicContact CG2-CD2 3.51Å; I540-Y568 HydrophobicContact CG2-CE2 3.7Å; I540-Y568 HydrophobicContact CG2-CG 4.06Å; D564-Y568 WeakPolarHBondContact O-CD2 3.38Å; D564-Y568 PolarHBondContact O-N 3.28Å; M565-Y568 PolarHBondContact O-N 3.02Å; M565-Y568 HydrophobicContact SD-CD2 4.36Å; Y568-K570 VanDerWaalsContact C-N 3.3Å; Y568-K570 PolarHBondContact O-N 3.12Å; Y568-V571 PolarHBondContact O-N 3.22Å; Y568-T572 WeakPolarHBondContact O-CB 3.42Å; Y568-T572 PolarHBondContact O-N 2.98Å; Y568-T572 PolarHBondContact O-OG1 3.22Å
569	L	94.8	Very high	91.6	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-64.7	-33	174	-69.6	168.4	0	0	0	112.3	L541 M565 V567 A573 A589 F592 I593 L614 L617 Y621	L541-L569 HydrophobicContact CD2-CD2 3.99Å; M565-L569 HydrophobicContact CE-CD2 4.42Å; M565-L569 HydrophobicContact CE-CG 4.42Å; M565-L569 HydrophobicContact CG-CD1 4.44Å; M565-L569 WeakPolarHBondContact O-CB 3.19Å; M565-L569 VanDerWaalsContact O-CG 3.25Å; M565-L569 WeakPolarHBondContact O-CG 3.11Å; M565-L569 PolarHBondContact O-N 2.96Å; V567-L569 VanDerWaalsContact C-N 3.35Å; V567-L569 PolarHBondContact O-N 2.99Å; L569-A573 PolarHBondContact O-N 3.13Å; L569-A589 HydrophobicContact CD2-CB 3.83Å; L569-F592 HydrophobicContact CD1-CD1 3.93Å; L569-F592 HydrophobicContact CD1-CE1 4.11Å; L569-F592 HydrophobicContact CD2-CD1 4.26Å; L569-I593 HydrophobicContact CD1-CG1 3.99Å; L569-I593 HydrophobicContact CD2-CD1 4.25Å; L569-I593 HydrophobicContact CD2-CG1 4.14Å; L569-L614 HydrophobicContact CD1-CD2 3.86Å; L569-L617 HydrophobicContact CB-CD1 3.98Å; L569-Y621 WeakPolarHBondContact O-CE2 3.43Å; L569-Y621 PolarHBondContact O-OH 3.18Å
570	K	93.3	Very high	92	Very high	72 Å²	72	23.5 Å²	23.5	31%	0.313	13%	0.128	S	C	.	.	H	α-helix	trans	-72.8	-44.6	172.8	179	55.4	178.1	176.3	0	112.3	L566 V567 Y568 T572 A573 L574 L617 E620	L566-K570 PolarHBondContact O-N 3.43Å; L566-K570 VanDerWaalsContact O-N 3.15Å; V567-K570 CarbonylContact O-C 3.56Å; V567-K570 WeakPolarHBondContact O-CA 3.3Å; V567-K570 WeakPolarHBondContact O-CB 3.38Å; V567-K570 PolarHBondContact O-N 3.07Å; Y568-K570 VanDerWaalsContact C-N 3.3Å; Y568-K570 PolarHBondContact O-N 3.12Å; K570-T572 VanDerWaalsContact C-N 3.32Å; K570-T572 PolarHBondContact O-N 3.07Å; K570-A573 WeakPolarHBondContact O-CB 3.42Å; K570-A573 PolarHBondContact O-N 3.03Å; K570-A573 VanDerWaalsContact O-N 3.14Å; K570-L574 HydrophobicContact CG-CD1 4.44Å; K570-L574 WeakPolarHBondContact O-CG 3.34Å; K570-L574 PolarHBondContact O-N 3.09Å; K570-L617 HydrophobicContact CB-CD2 3.91Å; K570-L617 HydrophobicContact CD-CD2 3.9Å; K570-L617 HydrophobicContact CG-CD2 4.45Å; K570-E620 IonicContact NZ-OE1 2.71Å; K570-E620 PolarHBondContact NZ-OE1 3.29Å; K570-E620 IonicContact NZ-OE2 3.68Å; K570-E620 PolarHBondContact NZ-OE2 3.39Å
571	V	93	Very high	92.1	Very high	2 Å²	2	28.4 Å²	28.4	1%	0.012	15%	0.149	C	C	.	.	H	α-helix	trans	-60.9	-42.2	176.7	169.1	0	0	0	0	110.2	M498 M501 I519 L522 M537 V567 Y568 A573 L574 L575	M498-V571 HydrophobicContact SD-CG1 4.44Å; M501-V571 HydrophobicContact CE-CG2 3.75Å; I519-V571 HydrophobicContact CD1-CG2 4.09Å; I519-V571 HydrophobicContact CG1-CG2 4.32Å; L522-V571 HydrophobicContact CD2-CG1 4Å; M537-V571 HydrophobicContact CE-CG1 4.28Å; V567-V571 HydrophobicContact CG1-CG2 4.11Å; V567-V571 WeakPolarHBondContact O-CB 3.49Å; V567-V571 WeakPolarHBondContact O-CG2 3.43Å; V567-V571 PolarHBondContact O-N 2.65Å; Y568-V571 PolarHBondContact O-N 3.22Å; V571-A573 VanDerWaalsContact C-N 3.28Å; V571-A573 PolarHBondContact O-N 3.2Å; V571-L574 PolarHBondContact O-N 3.43Å; V571-L575 HydrophobicContact CG1-CD1 3.49Å; V571-L575 VanDerWaalsContact CG1-CD1 3.49Å; V571-L575 HydrophobicContact CG1-CG 3.94Å; V571-L575 WeakPolarHBondContact O-CG 3.26Å; V571-L575 PolarHBondContact O-N 3.44Å
572	T	94.1	Very high	92.2	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-53.6	-43.3	173.1	-60.4	0	0	0	0	112.3	M537 Y568 K570 L574 F576 V585 A589 Y621	M537-T572 WeakPolarHBondContact CE-OG1 3.48Å; M537-T572 PolarHBondContact SD-OG1 2.96Å; M537-T572 VanDerWaalsContact SD-OG1 3.37Å; Y568-T572 WeakPolarHBondContact O-CB 3.42Å; Y568-T572 PolarHBondContact O-N 2.98Å; Y568-T572 PolarHBondContact O-OG1 3.22Å; K570-T572 VanDerWaalsContact C-N 3.32Å; K570-T572 PolarHBondContact O-N 3.07Å; T572-L574 VanDerWaalsContact C-N 3.28Å; T572-L574 PolarHBondContact O-N 2.9Å; T572-F576 HydrophobicContact CG2-CD2 4.18Å; T572-F576 WeakPolarHBondContact O-CB 3.41Å; T572-F576 PolarHBondContact O-N 3.5Å; T572-V585 HydrophobicContact CG2-CG1 3.94Å; T572-A589 HydrophobicContact CG2-CB 3.92Å; T572-Y621 WeakPolarHBondContact CB-OH 3.46Å; T572-Y621 WeakPolarHBondContact CG2-OH 3.36Å
573	A	93.8	Very high	92.5	Very high	14 Å²	14	33.9 Å²	33.9	12%	0.116	16%	0.159	C	C	.	.	H	α-helix	trans	-70.4	-21	179.6	0	0	0	0	0	114.3	L569 K570 V571 T578 Y621	L569-A573 PolarHBondContact O-N 3.13Å; K570-A573 WeakPolarHBondContact O-CB 3.42Å; K570-A573 PolarHBondContact O-N 3.03Å; K570-A573 VanDerWaalsContact O-N 3.14Å; V571-A573 VanDerWaalsContact C-N 3.28Å; V571-A573 PolarHBondContact O-N 3.2Å; A573-T578 HydrophobicContact CB-CG2 4.25Å; A573-Y621 HydrophobicContact CB-CD2 4.05Å; A573-Y621 HydrophobicContact CB-CE2 3.6Å
574	L	93.1	Very high	92.6	Very high	79 Å²	79	37.7 Å²	37.7	41%	0.414	18%	0.183	S	C	.	.	H	α-helix	trans	-91.5	-35	178.3	-65.2	172.6	0	0	0	112.1	I519 K570 V571 T572	I519-L574 HydrophobicContact CD1-CD1 4.04Å; I519-L574 HydrophobicContact CG2-CD1 4.4Å; K570-L574 HydrophobicContact CG-CD1 4.44Å; K570-L574 WeakPolarHBondContact O-CG 3.34Å; K570-L574 PolarHBondContact O-N 3.09Å; V571-L574 PolarHBondContact O-N 3.43Å; T572-L574 VanDerWaalsContact C-N 3.28Å; T572-L574 PolarHBondContact O-N 2.9Å
575	L	91.9	Very high	92.9	Very high	16 Å²	16	36 Å²	36	8%	0.084	17%	0.174	C	C	.	.	H	α-helix	trans	-82.5	-38.4	-179.7	-63.9	178.5	0	0	0	113.1	L522 Y523 V571	L522-L575 HydrophobicContact CD2-CD1 3.93Å; L522-L575 HydrophobicContact CG-CD1 4.21Å; L522-L575 HydrophobicContact CG-CD2 4.33Å; Y523-L575 HydrophobicContact CD2-CD2 3.94Å; Y523-L575 HydrophobicContact CG-CD2 4.4Å; V571-L575 HydrophobicContact CG1-CD1 3.49Å; V571-L575 VanDerWaalsContact CG1-CD1 3.49Å; V571-L575 HydrophobicContact CG1-CG 3.94Å; V571-L575 WeakPolarHBondContact O-CG 3.26Å; V571-L575 PolarHBondContact O-N 3.44Å
576	F	92.7	Very high	93	Very high	25 Å²	25	35.8 Å²	35.8	11%	0.11	17%	0.174	C	C	.	.	S	Bend	trans	-117.8	148.6	-169.2	-61.9	-74	0	0	0	112.5	A533 T572 T578 H583 V585	A533-F576 HydrophobicContact CB-CZ 4.32Å; T572-F576 HydrophobicContact CG2-CD2 4.18Å; T572-F576 WeakPolarHBondContact O-CB 3.41Å; T572-F576 PolarHBondContact O-N 3.5Å; F576-T578 PolarHBondContact O-N 3.08Å; F576-H583 AromaticContact CD1-CE1 3.55Å; F576-H583 AromaticContact CG-CE1 3.81Å; F576-V585 HydrophobicContact CD2-CB 4.19Å; F576-V585 HydrophobicContact CD2-CG1 3.93Å; F576-V585 HydrophobicContact CE1-CG2 4.21Å; F576-V585 HydrophobicContact CE2-CB 4.29Å; F576-V585 HydrophobicContact CE2-CG1 3.88Å; F576-V585 HydrophobicContact CE2-CG2 4.27Å; F576-V585 HydrophobicContact CG-CB 4.38Å; F576-V585 HydrophobicContact CZ-CG1 4.49Å; F576-V585 HydrophobicContact CZ-CG2 4.08Å
577	P	93	Very high	93.1	Very high	37 Å²	37	37.5 Å²	37.5	24%	0.24	18%	0.184	C	C	.	.			trans	-65.2	134.1	179.9	27.2	-35.1	0	0	0	112	D580 T586	P577-D580 WeakPolarHBondContact CG-OD2 3.11Å; P577-T586 WeakPolarHBondContact O-CG2 3.25Å; P577-T586 PolarHBondContact O-OG1 3.44Å
578	T	93.4	Very high	93.2	Very high	19 Å²	19	39.2 Å²	39.2	12%	0.117	20%	0.196	C	C	.	.	S	Bend	trans	-95.4	-9.2	176.9	56.8	0	0	0	0	113.8	A573 F576 T586 Y621	A573-T578 HydrophobicContact CB-CG2 4.25Å; F576-T578 PolarHBondContact O-N 3.08Å; T578-T586 HydrophobicContact CG2-CG2 4.19Å; T578-Y621 WeakPolarHBondContact CB-O 3.37Å; T578-Y621 HydrophobicContact CG2-CD1 4.16Å; T578-Y621 HydrophobicContact CG2-CG 4.17Å
579	S	93.3	Very high	93.2	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.014	19%	0.192	C	C	.	.	S	Bend	trans	-75.4	-38.8	179.5	39.3	0	0	0	0	114.4	R294 M298 R627	R294-S579 WeakPolarHBondContact CG-OG 3.45Å; M298-S579 WeakPolarHBondContact CG-O 3.39Å; S579-R627 PolarHBondContact O-NH2 3.24Å
580	D	92.7	Very high	93.2	Very high	9 Å²	9	39.8 Å²	39.8	5%	0.048	20%	0.2	C	C	.	.	S	Bend	trans	-71.7	138.7	-152.6	-61.8	6.6	0	0	0	112.9	R297 P577 R582 H583 R627	R297-D580 HydrophobicContact CB-CB 4.06Å; R297-D580 WeakPolarHBondContact CD-OD2 3.43Å; R297-D580 IonicContact CZ-OD1 2.63Å; R297-D580 IonicContact CZ-OD2 2.68Å; R297-D580 VanDerWaalsContact CZ-OD2 3.32Å; R297-D580 IonicContact NE-OD2 2.73Å; R297-D580 IonicContact NH1-OD1 3.17Å; R297-D580 IonicContact NH1-OD2 3.5Å; R297-D580 PolarHBondContact NH1-OD2 3.25Å; P577-D580 WeakPolarHBondContact CG-OD2 3.11Å; D580-R582 VanDerWaalsContact C-N 3.31Å; D580-R582 PolarHBondContact O-N 3.5Å; D580-H583 HydrophobicContact CB-CB 4.36Å; D580-R627 PolarHBondContact O-NH2 2.95Å
581	F	91.4	Very high	93.2	Very high	122 Å²	122	41.4 Å²	41.4	54%	0.535	21%	0.212	S	C	.	.	S	Bend	trans	-48.7	-51.3	-168.8	179.9	-103.6	0	0	0	112.5	R297 R627	R297-F581 VanDerWaalsContact O-CB 3.23Å; R297-F581 WeakPolarHBondContact O-CB 3.36Å; R297-F581 PolarHBondContact O-N 2.88Å; F581-R627 VanDerWaalsContact CA-NH2 3.26Å; F581-R627 PolarHBondContact O-NH1 3.28Å; F581-R627 PolarHBondContact O-NH2 2.95Å
582	R	91.6	Very high	93.3	Very high	196 Å²	196	41.9 Å²	41.9	74%	0.74	21%	0.214	S	C	*	.	S	Bend	trans	-131.8	137	167.7	-176	-179.8	-177.1	-177.9	-0.1	107.6	D580	D580-R582 VanDerWaalsContact C-N 3.31Å; D580-R582 PolarHBondContact O-N 3.5Å
583	H	92.2	Very high	93.3	Very high	28 Å²	28	41.9 Å²	41.9	13%	0.13	21%	0.214	C	C	.	.			trans	-142.6	133	176.2	-177	-93.4	0	0	0	110.1	F576 D580 V585 T586 T587	F576-H583 AromaticContact CD1-CE1 3.55Å; F576-H583 AromaticContact CG-CE1 3.81Å; D580-H583 HydrophobicContact CB-CB 4.36Å; H583-V585 PolarHBondContact O-N 3.24Å; H583-T586 PolarHBondContact ND1-N 2.93Å; H583-T586 PolarHBondContact ND1-OG1 3.01Å; H583-T587 PolarHBondContact N-OG1 3.32Å; H583-T587 VanDerWaalsContact O-CB 3.26Å; H583-T587 WeakPolarHBondContact O-CB 3.28Å; H583-T587 PolarHBondContact O-N 3.06Å; H583-T587 VanDerWaalsContact O-N 3.09Å; H583-T587 PolarHBondContact O-OG1 3.43Å
584	P	91.9	Very high	93.3	Very high	80 Å²	80	42.4 Å²	42.4	52%	0.519	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-21.3	-167.3	20.5	-33.9	0	0	0	115.6	Q538 P588	Q538-P584 PolarHBondContact NE2-O 3.35Å; P584-P588 WeakPolarHBondContact O-CG 3.36Å
585	V	94.4	Very high	93.2	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.006	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.2	-57.6	-178	-171	0	0	0	0	111.3	M537 Q538 L541 T572 F576 H583 T587 P588 A589	M537-V585 HydrophobicContact CB-CG1 3.74Å; M537-V585 HydrophobicContact CG-CG1 3.31Å; Q538-V585 HydrophobicContact CG-CG2 4.45Å; L541-V585 HydrophobicContact CD1-CG1 4.05Å; T572-V585 HydrophobicContact CG2-CG1 3.94Å; F576-V585 HydrophobicContact CD2-CB 4.19Å; F576-V585 HydrophobicContact CD2-CG1 3.93Å; F576-V585 HydrophobicContact CE1-CG2 4.21Å; F576-V585 HydrophobicContact CE2-CB 4.29Å; F576-V585 HydrophobicContact CE2-CG1 3.88Å; F576-V585 HydrophobicContact CE2-CG2 4.27Å; F576-V585 HydrophobicContact CG-CB 4.38Å; F576-V585 HydrophobicContact CZ-CG1 4.49Å; F576-V585 HydrophobicContact CZ-CG2 4.08Å; H583-V585 PolarHBondContact O-N 3.24Å; V585-T587 VanDerWaalsContact C-N 3.31Å; V585-T587 PolarHBondContact O-N 3.36Å; V585-P588 VanDerWaalsContact O-CD 3.28Å; V585-P588 WeakPolarHBondContact O-CD 3.46Å; V585-A589 PolarHBondContact O-N 2.92Å
586	T	94.7	Very high	93.1	Very high	7 Å²	7	40.6 Å²	40.6	4%	0.043	21%	0.207	C	C	.	.	H	α-helix	trans	-53.9	-40.1	178.5	-43.2	0	0	0	0	113.6	P577 T578 H583 A589 L590 Y621	P577-T586 WeakPolarHBondContact O-CG2 3.25Å; P577-T586 PolarHBondContact O-OG1 3.44Å; T578-T586 HydrophobicContact CG2-CG2 4.19Å; H583-T586 PolarHBondContact ND1-N 2.93Å; H583-T586 PolarHBondContact ND1-OG1 3.01Å; T586-A589 PolarHBondContact O-N 3.02Å; T586-L590 WeakPolarHBondContact O-CB 3.39Å; T586-L590 PolarHBondContact O-N 3.45Å; T586-Y621 HydrophobicContact CG2-CD1 3.73Å; T586-Y621 HydrophobicContact CG2-CE1 3.67Å
587	T	93.5	Very high	93	Very high	40 Å²	40	39.5 Å²	39.5	25%	0.245	20%	0.202	C	C	.	.	H	α-helix	trans	-69.4	-48.6	-177.9	-56.2	0	0	0	0	111.5	H583 V585 A589 L590 L591	H583-T587 PolarHBondContact N-OG1 3.32Å; H583-T587 VanDerWaalsContact O-CB 3.26Å; H583-T587 WeakPolarHBondContact O-CB 3.28Å; H583-T587 PolarHBondContact O-N 3.06Å; H583-T587 VanDerWaalsContact O-N 3.09Å; H583-T587 PolarHBondContact O-OG1 3.43Å; V585-T587 VanDerWaalsContact C-N 3.31Å; V585-T587 PolarHBondContact O-N 3.36Å; T587-A589 VanDerWaalsContact C-N 3.35Å; T587-A589 PolarHBondContact O-N 2.84Å; T587-L590 PolarHBondContact O-N 2.91Å; T587-L591 HydrophobicContact CG2-CD1 4.31Å; T587-L591 WeakPolarHBondContact O-CG 3.26Å; T587-L591 PolarHBondContact O-N 3.37Å
588	P	94.5	Very high	92.8	Very high	52 Å²	52	39.9 Å²	39.9	34%	0.338	20%	0.204	S	C	.	.	H	α-helix	trans	-52.2	-44.5	166	-31.6	37.2	0	0	0	114.6	L541 P584 V585 L590 L591 F592	L541-P588 HydrophobicContact CD1-CB 4.34Å; P584-P588 WeakPolarHBondContact O-CG 3.36Å; V585-P588 VanDerWaalsContact O-CD 3.28Å; V585-P588 WeakPolarHBondContact O-CD 3.46Å; P588-L590 PolarHBondContact O-N 3.27Å; P588-L591 WeakPolarHBondContact O-CB 3.43Å; P588-L591 PolarHBondContact O-N 3.13Å; P588-F592 PolarHBondContact O-N 3.31Å
589	A	95.1	Very high	92.5	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-61.4	-42.1	178.1	0	0	0	0	0	112.7	L541 L569 T572 V585 T586 T587 F592 I593 Y621	L541-A589 HydrophobicContact CD1-CB 3.91Å; L541-A589 HydrophobicContact CD2-CB 4.25Å; L569-A589 HydrophobicContact CD2-CB 3.83Å; T572-A589 HydrophobicContact CG2-CB 3.92Å; V585-A589 PolarHBondContact O-N 2.92Å; T586-A589 PolarHBondContact O-N 3.02Å; T587-A589 VanDerWaalsContact C-N 3.35Å; T587-A589 PolarHBondContact O-N 2.84Å; A589-F592 PolarHBondContact O-N 2.84Å; A589-I593 WeakPolarHBondContact O-CG1 3.43Å; A589-I593 PolarHBondContact O-N 2.92Å; A589-Y621 HydrophobicContact CB-CE1 3.96Å; A589-Y621 WeakPolarHBondContact CB-OH 3.48Å
590	L	94.4	Very high	92.2	Very high	34 Å²	34	43.5 Å²	43.5	18%	0.178	22%	0.218	C	C	.	.	H	α-helix	trans	-66.8	-37	175.5	-171.9	62.4	0	0	0	112.2	T586 T587 P588 I593 S594 Y621 L629	T586-L590 WeakPolarHBondContact O-CB 3.39Å; T586-L590 PolarHBondContact O-N 3.45Å; T587-L590 PolarHBondContact O-N 2.91Å; P588-L590 PolarHBondContact O-N 3.27Å; L590-I593 PolarHBondContact O-N 3.1Å; L590-S594 PolarHBondContact O-N 2.82Å; L590-Y621 HydrophobicContact CB-CD1 4.18Å; L590-Y621 HydrophobicContact CD1-CD1 4.16Å; L590-Y621 HydrophobicContact CD1-CG 4.24Å; L590-L629 HydrophobicContact CD1-CD1 3.56Å; L590-L629 HydrophobicContact CG-CD1 4.06Å
591	L	93.6	Very high	91.8	Very high	107 Å²	107	44.5 Å²	44.5	56%	0.56	22%	0.223	S	C	*	.	H	α-helix	trans	-64.9	-43.9	173.6	-71.5	170.2	0	0	0	111.2	T587 P588 I593 S594 L595	T587-L591 HydrophobicContact CG2-CD1 4.31Å; T587-L591 WeakPolarHBondContact O-CG 3.26Å; T587-L591 PolarHBondContact O-N 3.37Å; P588-L591 WeakPolarHBondContact O-CB 3.43Å; P588-L591 PolarHBondContact O-N 3.13Å; L591-I593 VanDerWaalsContact C-N 3.32Å; L591-I593 PolarHBondContact O-N 2.94Å; L591-S594 PolarHBondContact O-N 3.39Å; L591-S594 VanDerWaalsContact O-N 3.09Å; L591-S594 PolarHBondContact O-OG 3.43Å; L591-L595 WeakPolarHBondContact O-CB 3.28Å; L591-L595 PolarHBondContact O-N 3.29Å
592	F	94.1	Very high	91.6	Very high	12 Å²	12	39.4 Å²	39.4	5%	0.053	20%	0.202	C	C	.	.	H	α-helix	trans	-60.1	-40.1	174.6	-176.3	-86.6	0	0	0	112.1	A544 A545 M548 P561 M565 L569 P588 A589 L595 T596	A544-F592 HydrophobicContact CB-CE2 4Å; A544-F592 HydrophobicContact CB-CZ 4.33Å; A545-F592 HydrophobicContact CB-CD2 4.2Å; M548-F592 HydrophobicContact CE-CD2 3.81Å; M548-F592 HydrophobicContact CE-CE2 3.56Å; M548-F592 HydrophobicContact CE-CZ 4.18Å; P561-F592 HydrophobicContact CB-CE1 4.34Å; P561-F592 HydrophobicContact CB-CZ 4.43Å; P561-F592 HydrophobicContact CG-CE1 4.36Å; M565-F592 HydrophobicContact CE-CD1 3.62Å; M565-F592 HydrophobicContact CE-CD2 3.98Å; M565-F592 HydrophobicContact CE-CE1 3.4Å; M565-F592 VanDerWaalsContact CE-CE1 3.4Å; M565-F592 HydrophobicContact CE-CE2 3.78Å; M565-F592 HydrophobicContact CE-CG 3.91Å; M565-F592 HydrophobicContact CE-CZ 3.5Å; M565-F592 HydrophobicContact CG-CE1 3.9Å; M565-F592 HydrophobicContact CG-CZ 4.09Å; L569-F592 HydrophobicContact CD1-CD1 3.93Å; L569-F592 HydrophobicContact CD1-CE1 4.11Å; L569-F592 HydrophobicContact CD2-CD1 4.26Å; P588-F592 PolarHBondContact O-N 3.31Å; A589-F592 PolarHBondContact O-N 2.84Å; F592-L595 PolarHBondContact O-N 3.28Å; F592-T596 HydrophobicContact CD1-CG2 3.99Å; F592-T596 HydrophobicContact CE1-CG2 3.5Å; F592-T596 VanDerWaalsContact CE1-CG2 3.5Å; F592-T596 HydrophobicContact CE2-CG2 4.41Å; F592-T596 HydrophobicContact CZ-CG2 3.73Å; F592-T596 WeakPolarHBondContact O-CB 3.2Å; F592-T596 WeakPolarHBondContact O-CG2 3.34Å; F592-T596 PolarHBondContact O-N 3.41Å; F592-T596 PolarHBondContact O-OG1 2.83Å
593	I	94.6	Very high	91.2	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.8	-43.3	172.4	-68	164.9	0	0	0	111.1	L569 A589 L590 L591 L595 T596 L597 L614 L617 A618 Y621	L569-I593 HydrophobicContact CD1-CG1 3.99Å; L569-I593 HydrophobicContact CD2-CD1 4.25Å; L569-I593 HydrophobicContact CD2-CG1 4.14Å; A589-I593 WeakPolarHBondContact O-CG1 3.43Å; A589-I593 PolarHBondContact O-N 2.92Å; L590-I593 PolarHBondContact O-N 3.1Å; L591-I593 VanDerWaalsContact C-N 3.32Å; L591-I593 PolarHBondContact O-N 2.94Å; I593-L595 VanDerWaalsContact C-N 3.35Å; I593-L595 PolarHBondContact O-N 3.09Å; I593-T596 WeakPolarHBondContact CA-OG1 3.45Å; I593-T596 PolarHBondContact O-OG1 3.47Å; I593-L597 HydrophobicContact CG2-CD1 3.88Å; I593-L597 HydrophobicContact CG2-CG 4.46Å; I593-L597 WeakPolarHBondContact O-CB 3.37Å; I593-L597 WeakPolarHBondContact O-CG 3.41Å; I593-L597 PolarHBondContact O-N 2.96Å; I593-L614 HydrophobicContact CG1-CD2 4.1Å; I593-L617 HydrophobicContact CD1-CB 4.19Å; I593-A618 HydrophobicContact CG2-CB 3.94Å; I593-Y621 HydrophobicContact CD1-CD2 4.25Å; I593-Y621 HydrophobicContact CD1-CE2 3.96Å
594	S	92.4	Very high	91	Very high	24 Å²	24	35.3 Å²	35.3	17%	0.168	19%	0.191	C	C	.	.	H	α-helix	trans	-66.7	-35	177	76.6	0	0	0	0	113.1	L590 L591 T598	L590-S594 PolarHBondContact O-N 2.82Å; L591-S594 PolarHBondContact O-N 3.39Å; L591-S594 VanDerWaalsContact O-N 3.09Å; L591-S594 PolarHBondContact O-OG 3.43Å; S594-T598 WeakPolarHBondContact O-CG2 3.4Å; S594-T598 PolarHBondContact O-N 3.38Å; S594-T598 PolarHBondContact O-OG1 2.93Å
595	L	90.9	Very high	90.7	Very high	58 Å²	58	32.7 Å²	32.7	30%	0.304	17%	0.172	S	C	.	.	H	α-helix	trans	-73.8	-44	-179.1	-172.1	59.7	0	0	0	111	M548 L591 F592 I593 T598 K599	M548-L595 HydrophobicContact CE-CB 4.11Å; M548-L595 HydrophobicContact CE-CD2 3.55Å; M548-L595 HydrophobicContact CE-CG 3.67Å; L591-L595 WeakPolarHBondContact O-CB 3.28Å; L591-L595 PolarHBondContact O-N 3.29Å; F592-L595 PolarHBondContact O-N 3.28Å; I593-L595 VanDerWaalsContact C-N 3.35Å; I593-L595 PolarHBondContact O-N 3.09Å; L595-T598 PolarHBondContact O-N 3.3Å; L595-T598 PolarHBondContact O-OG1 3.05Å; L595-T598 VanDerWaalsContact O-OG1 3.07Å; L595-K599 HydrophobicContact CD1-CD 4.3Å; L595-K599 HydrophobicContact CD1-CG 3.61Å; L595-K599 HydrophobicContact CG-CG 4.21Å; L595-K599 WeakPolarHBondContact O-CB 3.44Å; L595-K599 VanDerWaalsContact O-CG 3.24Å; L595-K599 WeakPolarHBondContact O-CG 3.33Å; L595-K599 PolarHBondContact O-N 2.91Å
596	T	90.9	Very high	90.4	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-62.8	-46.6	173.5	46.2	0	0	0	0	111.7	M548 P561 F592 I593 T598 K599 C600	M548-T596 HydrophobicContact CE-CG2 3.92Å; M548-T596 HydrophobicContact SD-CG2 3.54Å; M548-T596 VanDerWaalsContact SD-CG2 3.54Å; P561-T596 HydrophobicContact CG-CG2 4.14Å; F592-T596 HydrophobicContact CD1-CG2 3.99Å; F592-T596 HydrophobicContact CE1-CG2 3.5Å; F592-T596 VanDerWaalsContact CE1-CG2 3.5Å; F592-T596 HydrophobicContact CE2-CG2 4.41Å; F592-T596 HydrophobicContact CZ-CG2 3.73Å; F592-T596 WeakPolarHBondContact O-CB 3.2Å; F592-T596 WeakPolarHBondContact O-CG2 3.34Å; F592-T596 PolarHBondContact O-N 3.41Å; F592-T596 PolarHBondContact O-OG1 2.83Å; I593-T596 WeakPolarHBondContact CA-OG1 3.45Å; I593-T596 PolarHBondContact O-OG1 3.47Å; T596-T598 PolarHBondContact O-N 3.02Å; T596-K599 PolarHBondContact O-N 3.06Å; T596-C600 VanDerWaalsContact CA-SG 3.54Å; T596-C600 VanDerWaalsContact O-CB 3.22Å; T596-C600 WeakPolarHBondContact O-CB 3.21Å; T596-C600 PolarHBondContact O-N 2.82Å; T596-C600 VanDerWaalsContact O-N 3.08Å; T596-C600 PolarHBondContact O-SG 3.38Å
597	L	90.9	Very high	90.1	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-61.3	-17.2	177.6	-72.5	174.1	0	0	0	114.4	I593 L614 E631 F635 P657	I593-L597 HydrophobicContact CG2-CD1 3.88Å; I593-L597 HydrophobicContact CG2-CG 4.46Å; I593-L597 WeakPolarHBondContact O-CB 3.37Å; I593-L597 WeakPolarHBondContact O-CG 3.41Å; I593-L597 PolarHBondContact O-N 2.96Å; L597-L614 HydrophobicContact CD2-CB 3.91Å; L597-L614 HydrophobicContact CG-CB 4.27Å; L597-E631 HydrophobicContact CB-CB 4.3Å; L597-F635 HydrophobicContact CD2-CB 4.25Å; L597-F635 HydrophobicContact CD2-CD1 4.31Å; L597-F635 HydrophobicContact CD2-CD2 3.71Å; L597-F635 HydrophobicContact CD2-CE2 4.15Å; L597-F635 HydrophobicContact CD2-CG 3.82Å; L597-P657 WeakPolarHBondContact O-CD 3.5Å
598	T	88.4	Confident	89.9	Confident	46 Å²	46	35.4 Å²	35.4	28%	0.282	18%	0.182	S	C	.	.	H	α-helix	trans	-105.8	-32.5	178.4	50.7	0	0	0	0	114.6	S594 L595 T596 E631	S594-T598 WeakPolarHBondContact O-CG2 3.4Å; S594-T598 PolarHBondContact O-N 3.38Å; S594-T598 PolarHBondContact O-OG1 2.93Å; L595-T598 PolarHBondContact O-N 3.3Å; L595-T598 PolarHBondContact O-OG1 3.05Å; L595-T598 VanDerWaalsContact O-OG1 3.07Å; T596-T598 PolarHBondContact O-N 3.02Å; T598-E631 HydrophobicContact CG2-CB 3.99Å; T598-E631 HydrophobicContact CG2-CG 3.42Å; T598-E631 VanDerWaalsContact CG2-CG 3.42Å
599	K	86.6	Confident	89.7	Confident	96 Å²	96	33 Å²	33	42%	0.417	17%	0.167	S	C	.	.	H	α-helix	trans	-100.1	-23.2	-173	-56.3	-72.8	-178.1	155.2	0	114.3	V552 A558 L595 T596	V552-K599 HydrophobicContact CG2-CB 4.15Å; A558-K599 HydrophobicContact CB-CB 4.35Å; A558-K599 PolarHBondContact N-O 2.83Å; L595-K599 HydrophobicContact CD1-CD 4.3Å; L595-K599 HydrophobicContact CD1-CG 3.61Å; L595-K599 HydrophobicContact CG-CG 4.21Å; L595-K599 WeakPolarHBondContact O-CB 3.44Å; L595-K599 VanDerWaalsContact O-CG 3.24Å; L595-K599 WeakPolarHBondContact O-CG 3.33Å; L595-K599 PolarHBondContact O-N 2.91Å; T596-K599 PolarHBondContact O-N 3.06Å
600	C	87.4	Confident	89.5	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.168	C	C	.	.	B	Isolated β-bridge	trans	-82.1	119.7	-177.5	-57.3	0	0	0	0	111	A559 F560 T596 V602 P657	A559-C600 PolarHBondContact O-SG 3.35Å; F560-C600 HydrophobicContact CD1-CB 3.79Å; F560-C600 HydrophobicContact CD2-CB 3.64Å; F560-C600 HydrophobicContact CE1-CB 3.64Å; F560-C600 HydrophobicContact CE2-CB 3.48Å; F560-C600 VanDerWaalsContact CE2-CB 3.48Å; F560-C600 WeakPolarHBondContact CE2-O 3.35Å; F560-C600 HydrophobicContact CG-CB 3.79Å; F560-C600 HydrophobicContact CZ-CB 3.48Å; F560-C600 VanDerWaalsContact CZ-CB 3.48Å; F560-C600 WeakPolarHBondContact CZ-O 3.48Å; T596-C600 VanDerWaalsContact CA-SG 3.54Å; T596-C600 VanDerWaalsContact O-CB 3.22Å; T596-C600 WeakPolarHBondContact O-CB 3.21Å; T596-C600 PolarHBondContact O-N 2.82Å; T596-C600 VanDerWaalsContact O-N 3.08Å; T596-C600 PolarHBondContact O-SG 3.38Å; C600-V602 PolarHBondContact O-N 3.48Å; C600-P657 WeakPolarHBondContact O-CB 3.26Å; C600-P657 WeakPolarHBondContact O-CG 3.34Å
601	L	83.9	Confident	89.4	Confident	31 Å²	31	31.6 Å²	31.6	16%	0.162	16%	0.16	C	C	.	.			trans	-83	117.9	-176.6	-71.1	176.9	0	0	0	112.2	H557 A558 R603 P657	H557-L601 HydrophobicContact CB-CD1 3.51Å; H557-L601 HydrophobicContact CB-CG 3.89Å; A558-L601 PolarHBondContact O-N 2.86Å; L601-R603 PolarHBondContact O-N 2.91Å; L601-P657 HydrophobicContact CD2-CB 4.06Å; L601-P657 WeakPolarHBondContact CD2-O 3.37Å
602	V	86.9	Confident	89.3	Confident	15 Å²	15	26.7 Å²	26.7	9%	0.091	13%	0.134	C	C	.	.			trans	-67.3	114.1	173.3	-176.5	0	0	0	0	110.3	F560 C600 D607 L608 F635 L642 F658 L667	F560-V602 HydrophobicContact CE2-CG2 3.88Å; F560-V602 HydrophobicContact CZ-CG2 3.82Å; C600-V602 PolarHBondContact O-N 3.48Å; V602-D607 HydrophobicContact CG1-CB 4.26Å; V602-L608 HydrophobicContact CG1-CB 3.98Å; V602-L608 HydrophobicContact CG1-CD1 4.29Å; V602-F635 HydrophobicContact CG2-CE2 3.98Å; V602-F635 HydrophobicContact CG2-CZ 3.98Å; V602-L642 HydrophobicContact CG1-CD1 4.26Å; V602-F658 HydrophobicContact CB-CE1 4.5Å; V602-F658 HydrophobicContact CG2-CE1 4.13Å; V602-F658 HydrophobicContact CG2-CZ 4.04Å; V602-L667 HydrophobicContact CG1-CD1 3.95Å
603	R	84.6	Confident	89.2	Confident	104 Å²	104	27.5 Å²	27.5	39%	0.392	14%	0.14	S	C	.	.			trans	-119.6	-25.4	-180	-65.5	168	-178.3	-163	-5	112.8	H557 L601 D607 Y664	H557-R603 PolarHBondContact CD2-NH2 3.32Å; H557-R603 PolarHBondContact CE1-NH2 3.09Å; H557-R603 VanDerWaalsContact CE1-NH2 3.29Å; H557-R603 PolarHBondContact NE2-NH2 3.01Å; L601-R603 PolarHBondContact O-N 2.91Å; R603-D607 WeakPolarHBondContact CA-OD2 3.26Å; R603-D607 WeakPolarHBondContact CB-OD2 3.48Å; R603-D607 PolarHBondContact N-OD2 3.41Å; R603-Y664 HydrophobicContact CB-CD1 4.44Å; R603-Y664 HydrophobicContact CB-CE1 4.35Å; R603-Y664 HydrophobicContact CB-CE2 4.47Å; R603-Y664 HydrophobicContact CG-CD2 4.28Å; R603-Y664 HydrophobicContact CG-CE2 4.1Å; R603-Y664 WeakPolarHBondContact O-CD1 3.38Å
604	S	87.1	Confident	89.2	Confident	34 Å²	34	27.5 Å²	27.5	24%	0.238	14%	0.14	C	C	.	.	S	Bend	trans	-135.3	172.3	-174	70.3	0	0	0	0	111.7	Q606 D607 L608	S604-Q606 PolarHBondContact O-N 3.06Å; S604-Q606 PolarHBondContact OG-N 3.03Å; S604-D607 WeakPolarHBondContact CB-OD2 3.11Å; S604-D607 PolarHBondContact N-OD2 3.2Å; S604-D607 PolarHBondContact OG-N 2.85Å; S604-D607 VanDerWaalsContact OG-N 3.12Å; S604-D607 PolarHBondContact OG-OD2 2.96Å; S604-L608 PolarHBondContact O-N 3.4Å
605	L	85.4	Confident	89.3	Confident	25 Å²	25	26.3 Å²	26.3	13%	0.131	13%	0.132	C	C	.	.	H	α-helix	trans	-69.5	-21.4	170.2	-64.9	175.5	0	0	0	112.5	L608 T609 L668 L692 L694 Y703 R704	L605-L608 HydrophobicContact CD2-CD2 4.5Å; L605-T609 WeakPolarHBondContact O-CB 3.49Å; L605-T609 PolarHBondContact O-N 3.01Å; L605-T609 VanDerWaalsContact O-N 3.08Å; L605-T609 PolarHBondContact O-OG1 2.87Å; L605-L668 HydrophobicContact CD2-CD2 4.19Å; L605-L692 HydrophobicContact CB-CD2 3.93Å; L605-L694 HydrophobicContact CD1-CD1 4Å; L605-Y703 HydrophobicContact CB-CD1 4.24Å; L605-Y703 HydrophobicContact CB-CE1 4.17Å; L605-Y703 HydrophobicContact CD1-CD1 4.21Å; L605-R704 HydrophobicContact CD1-CG 4.49Å; L605-R704 HydrophobicContact CD2-CG 4.26Å
606	Q	88.1	Confident	89.5	Confident	74 Å²	74	26.4 Å²	26.4	35%	0.346	14%	0.136	S	C	.	.	H	α-helix	trans	-70.2	-50.7	173.9	-64.8	169.6	-14.4	0	0	110.3	S604 L608 T609 S610 L692	S604-Q606 PolarHBondContact O-N 3.06Å; S604-Q606 PolarHBondContact OG-N 3.03Å; Q606-L608 VanDerWaalsContact C-N 3.25Å; Q606-L608 PolarHBondContact O-N 2.71Å; Q606-T609 WeakPolarHBondContact O-CA 3.16Å; Q606-T609 WeakPolarHBondContact O-CB 3.48Å; Q606-T609 PolarHBondContact O-N 3.42Å; Q606-S610 PolarHBondContact O-N 3.25Å; Q606-S610 PolarHBondContact O-OG 3.37Å; Q606-L692 HydrophobicContact CG-CB 3.67Å; Q606-L692 HydrophobicContact CG-CD2 4.03Å; Q606-L692 HydrophobicContact CG-CG 4.49Å
607	D	88.5	Confident	89.7	Confident	31 Å²	31	26.8 Å²	26.8	17%	0.166	14%	0.138	C	C	.	.	H	α-helix	trans	-55.8	-40.5	174.9	-58.6	-58.4	0	0	0	112.1	F560 V602 R603 S604 T609 S610 G611	F560-D607 HydrophobicContact CD2-CB 3.57Å; F560-D607 HydrophobicContact CE2-CB 3.75Å; V602-D607 HydrophobicContact CG1-CB 4.26Å; R603-D607 WeakPolarHBondContact CA-OD2 3.26Å; R603-D607 WeakPolarHBondContact CB-OD2 3.48Å; R603-D607 PolarHBondContact N-OD2 3.41Å; S604-D607 WeakPolarHBondContact CB-OD2 3.11Å; S604-D607 PolarHBondContact N-OD2 3.2Å; S604-D607 PolarHBondContact OG-N 2.85Å; S604-D607 VanDerWaalsContact OG-N 3.12Å; S604-D607 PolarHBondContact OG-OD2 2.96Å; D607-T609 VanDerWaalsContact C-N 3.31Å; D607-S610 PolarHBondContact O-OG 3.06Å; D607-S610 VanDerWaalsContact O-OG 3.1Å; D607-G611 PolarHBondContact O-N 3.27Å
608	L	89.3	Confident	89.9	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-67.9	-34.2	176.4	-174.6	65.3	0	0	0	111.7	V602 S604 L605 Q606 L612 F635 T639 L668 C707	V602-L608 HydrophobicContact CG1-CB 3.98Å; V602-L608 HydrophobicContact CG1-CD1 4.29Å; S604-L608 PolarHBondContact O-N 3.4Å; L605-L608 HydrophobicContact CD2-CD2 4.5Å; Q606-L608 VanDerWaalsContact C-N 3.25Å; Q606-L608 PolarHBondContact O-N 2.71Å; L608-L612 HydrophobicContact CG-CD1 4.09Å; L608-L612 WeakPolarHBondContact O-CB 3.39Å; L608-L612 WeakPolarHBondContact O-CD1 3.48Å; L608-L612 VanDerWaalsContact O-CG 3.25Å; L608-L612 WeakPolarHBondContact O-CG 3.4Å; L608-L612 PolarHBondContact O-N 2.82Å; L608-F635 HydrophobicContact CD1-CE1 4.31Å; L608-F635 HydrophobicContact CD1-CZ 4.37Å; L608-T639 HydrophobicContact CD1-CG2 3.94Å; L608-L668 HydrophobicContact CD2-CD1 3.91Å; L608-L668 HydrophobicContact CD2-CD2 3.6Å; L608-L668 HydrophobicContact CD2-CG 3.77Å; L608-C707 HydrophobicContact CD2-CB 4.22Å
609	T	90.6	Very high	90.2	Very high	2 Å²	2	25.4 Å²	25.4	1%	0.012	13%	0.13	C	C	.	.	H	α-helix	trans	-70.5	-46.1	178.7	-56.9	0	0	0	0	111.2	L605 Q606 D607 L612 V613 L684 A688 T689 Y703	L605-T609 WeakPolarHBondContact O-CB 3.49Å; L605-T609 PolarHBondContact O-N 3.01Å; L605-T609 VanDerWaalsContact O-N 3.08Å; L605-T609 PolarHBondContact O-OG1 2.87Å; Q606-T609 WeakPolarHBondContact O-CA 3.16Å; Q606-T609 WeakPolarHBondContact O-CB 3.48Å; Q606-T609 PolarHBondContact O-N 3.42Å; D607-T609 VanDerWaalsContact C-N 3.31Å; T609-L612 PolarHBondContact O-N 2.79Å; T609-V613 WeakPolarHBondContact O-CG2 3.37Å; T609-V613 PolarHBondContact O-N 3.27Å; T609-L684 HydrophobicContact CG2-CD1 4.49Å; T609-A688 HydrophobicContact CG2-CB 4.45Å; T609-T689 HydrophobicContact CG2-CG2 4.08Å; T609-Y703 WeakPolarHBondContact CG2-OH 3.4Å; T609-Y703 WeakPolarHBondContact OG1-CE1 3.47Å; T609-Y703 PolarHBondContact OG1-OH 3.25Å
610	S	90.6	Very high	90.5	Very high	4 Å²	4	23.9 Å²	23.9	3%	0.028	12%	0.124	C	C	.	.	H	α-helix	trans	-64.7	-39.3	174.7	50.6	0	0	0	0	111.7	F560 Q606 D607 L612 V613 L614	F560-S610 VanDerWaalsContact CB-OG 3.27Å; F560-S610 WeakPolarHBondContact CB-OG 3.16Å; F560-S610 WeakPolarHBondContact CG-OG 3.44Å; Q606-S610 PolarHBondContact O-N 3.25Å; Q606-S610 PolarHBondContact O-OG 3.37Å; D607-S610 PolarHBondContact O-OG 3.06Å; D607-S610 VanDerWaalsContact O-OG 3.1Å; S610-L612 PolarHBondContact O-N 2.9Å; S610-V613 PolarHBondContact O-N 3.45Å; S610-L614 WeakPolarHBondContact O-CG 3.49Å; S610-L614 PolarHBondContact O-N 3.29Å
611	G	91.8	Very high	90.9	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-59.4	-41.8	169.9	0	0	0	0	0	113.9	D607 L614 C615	D607-G611 PolarHBondContact O-N 3.27Å; G611-L614 WeakPolarHBondContact O-CB 3.4Å; G611-L614 PolarHBondContact O-N 3.07Å; G611-C615 PolarHBondContact O-N 3.4Å; G611-C615 PolarHBondContact O-SG 2.93Å
612	L	92	Very high	91.4	Very high	4 Å²	4	22.6 Å²	22.6	2%	0.021	12%	0.117	C	C	.	.	H	α-helix	trans	-68.4	-34.6	174.7	-75.7	165.5	0	0	0	112.6	L608 T609 S610 C615 C616 L636 C707 C711 L714	L608-L612 HydrophobicContact CG-CD1 4.09Å; L608-L612 WeakPolarHBondContact O-CB 3.39Å; L608-L612 WeakPolarHBondContact O-CD1 3.48Å; L608-L612 VanDerWaalsContact O-CG 3.25Å; L608-L612 WeakPolarHBondContact O-CG 3.4Å; L608-L612 PolarHBondContact O-N 2.82Å; T609-L612 PolarHBondContact O-N 2.79Å; S610-L612 PolarHBondContact O-N 2.9Å; L612-C615 WeakPolarHBondContact O-CB 3.42Å; L612-C615 PolarHBondContact O-N 3.23Å; L612-C616 PolarHBondContact O-N 3.08Å; L612-C616 PolarHBondContact O-SG 3.17Å; L612-C616 VanDerWaalsContact O-SG 3.39Å; L612-L636 HydrophobicContact CD2-CD2 4.48Å; L612-C707 HydrophobicContact CD1-CB 3.89Å; L612-C711 HydrophobicContact CD2-CB 4.12Å; L612-L714 HydrophobicContact CD2-CD1 4.06Å
613	V	93.1	Very high	91.6	Very high	28 Å²	28	24.8 Å²	24.8	17%	0.17	13%	0.133	C	C	.	.	H	α-helix	trans	-65	-43.1	171.3	172.2	0	0	0	0	110.9	L566 T609 S610 C615 C616 L617 L686 T689	L566-V613 HydrophobicContact CB-CG1 4.46Å; L566-V613 HydrophobicContact CD1-CB 4.46Å; L566-V613 HydrophobicContact CD1-CG1 4.15Å; L566-V613 HydrophobicContact CD2-CG1 4.34Å; T609-V613 WeakPolarHBondContact O-CG2 3.37Å; T609-V613 PolarHBondContact O-N 3.27Å; S610-V613 PolarHBondContact O-N 3.45Å; V613-C615 VanDerWaalsContact C-N 3.29Å; V613-C615 PolarHBondContact O-N 2.58Å; V613-C616 WeakPolarHBondContact O-CB 3.37Å; V613-C616 PolarHBondContact O-N 2.8Å; V613-C616 VanDerWaalsContact O-N 3.14Å; V613-L617 HydrophobicContact CG1-CD1 4.34Å; V613-L617 WeakPolarHBondContact O-CG 3.28Å; V613-L617 PolarHBondContact O-N 3.15Å; V613-L686 HydrophobicContact CG1-CD2 4.19Å; V613-L686 HydrophobicContact CG2-CD2 3.95Å; V613-T689 HydrophobicContact CG2-CG2 4.45Å
614	L	94	Very high	91.9	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-60.4	-36.7	171.9	-72.2	165.7	0	0	0	112	F560 P561 L566 L569 I593 L597 S610 G611 L617 A618	F560-L614 HydrophobicContact CD1-CD1 3.99Å; F560-L614 HydrophobicContact CE1-CD1 4.26Å; P561-L614 HydrophobicContact CG-CD1 4.07Å; L566-L614 HydrophobicContact CD2-CD1 4.46Å; L566-L614 HydrophobicContact CD2-CD2 3.63Å; L566-L614 HydrophobicContact CD2-CG 3.73Å; L569-L614 HydrophobicContact CD1-CD2 3.86Å; I593-L614 HydrophobicContact CG1-CD2 4.1Å; L597-L614 HydrophobicContact CD2-CB 3.91Å; L597-L614 HydrophobicContact CG-CB 4.27Å; S610-L614 WeakPolarHBondContact O-CG 3.49Å; S610-L614 PolarHBondContact O-N 3.29Å; G611-L614 WeakPolarHBondContact O-CB 3.4Å; G611-L614 PolarHBondContact O-N 3.07Å; L614-L617 PolarHBondContact O-N 2.9Å; L614-A618 WeakPolarHBondContact O-CB 3.47Å; L614-A618 PolarHBondContact O-N 2.71Å
615	C	94.8	Very high	92	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-66.6	-38.8	172.2	-68.1	0	0	0	0	113.2	G611 L612 V613 A618 V619 L632 F635 L714	G611-C615 PolarHBondContact O-N 3.4Å; G611-C615 PolarHBondContact O-SG 2.93Å; L612-C615 WeakPolarHBondContact O-CB 3.42Å; L612-C615 PolarHBondContact O-N 3.23Å; V613-C615 VanDerWaalsContact C-N 3.29Å; V613-C615 PolarHBondContact O-N 2.58Å; C615-A618 PolarHBondContact O-N 3.34Å; C615-V619 WeakPolarHBondContact O-CG2 3.31Å; C615-V619 PolarHBondContact O-N 3.3Å; C615-L632 HydrophobicContact CB-CD1 3.54Å; C615-F635 WeakPolarHBondContact SG-CD1 3.38Å; C615-L714 HydrophobicContact CB-CD1 3.82Å
616	C	94.4	Very high	92.3	Very high	59 Å²	59	26.7 Å²	26.7	40%	0.399	15%	0.145	S	C	.	.	H	α-helix	trans	-59.8	-45.9	171.6	-70.1	0	0	0	0	111.5	L612 V613 V619 E620	L612-C616 PolarHBondContact O-N 3.08Å; L612-C616 PolarHBondContact O-SG 3.17Å; L612-C616 VanDerWaalsContact O-SG 3.39Å; V613-C616 WeakPolarHBondContact O-CB 3.37Å; V613-C616 PolarHBondContact O-N 2.8Å; V613-C616 VanDerWaalsContact O-N 3.14Å; C616-V619 PolarHBondContact O-N 2.84Å; C616-E620 PolarHBondContact O-N 2.95Å
617	L	94.5	Very high	92.4	Very high	9 Å²	9	27.1 Å²	27.1	5%	0.047	14%	0.143	C	C	.	.	H	α-helix	trans	-63.6	-44.7	176.6	-67.3	170.6	0	0	0	111.5	L569 K570 I593 V613 L614 V619 E620 Y621	L569-L617 HydrophobicContact CB-CD1 3.98Å; K570-L617 HydrophobicContact CB-CD2 3.91Å; K570-L617 HydrophobicContact CD-CD2 3.9Å; K570-L617 HydrophobicContact CG-CD2 4.45Å; I593-L617 HydrophobicContact CD1-CB 4.19Å; V613-L617 HydrophobicContact CG1-CD1 4.34Å; V613-L617 WeakPolarHBondContact O-CG 3.28Å; V613-L617 PolarHBondContact O-N 3.15Å; L614-L617 PolarHBondContact O-N 2.9Å; L617-V619 VanDerWaalsContact C-N 3.3Å; L617-V619 PolarHBondContact O-N 3.15Å; L617-E620 WeakPolarHBondContact O-CA 3.47Å; L617-E620 WeakPolarHBondContact O-CB 3.38Å; L617-E620 PolarHBondContact O-N 2.71Å; L617-Y621 VanDerWaalsContact O-CD2 3.25Å; L617-Y621 WeakPolarHBondContact O-CD2 3.44Å; L617-Y621 PolarHBondContact O-N 3.04Å
618	A	95.4	Very high	92.6	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-56.3	-43.5	175.8	0	0	0	0	0	112.2	I593 L614 C615 E620 V622 L632	I593-A618 HydrophobicContact CG2-CB 3.94Å; L614-A618 WeakPolarHBondContact O-CB 3.47Å; L614-A618 PolarHBondContact O-N 2.71Å; C615-A618 PolarHBondContact O-N 3.34Å; A618-E620 VanDerWaalsContact C-N 3.34Å; A618-V622 VanDerWaalsContact O-CB 3.26Å; A618-V622 WeakPolarHBondContact O-CB 3.3Å; A618-V622 VanDerWaalsContact O-CG2 3.25Å; A618-V622 WeakPolarHBondContact O-CG2 3.49Å; A618-V622 PolarHBondContact O-N 2.93Å; A618-L632 HydrophobicContact CB-CD1 4.39Å; A618-L632 HydrophobicContact CB-CD2 4.2Å
619	V	94.8	Very high	92.8	Very high	17 Å²	17	30.1 Å²	30.1	10%	0.103	16%	0.155	C	C	.	.	H	α-helix	trans	-64.8	-37.1	174.7	172.1	0	0	0	0	111.7	C615 C616 L617 V622 S623 L632 L714 R717	C615-V619 WeakPolarHBondContact O-CG2 3.31Å; C615-V619 PolarHBondContact O-N 3.3Å; C616-V619 PolarHBondContact O-N 2.84Å; L617-V619 VanDerWaalsContact C-N 3.3Å; L617-V619 PolarHBondContact O-N 3.15Å; V619-V622 PolarHBondContact O-N 3.49Å; V619-S623 WeakPolarHBondContact O-CA 3.48Å; V619-S623 WeakPolarHBondContact O-CB 3.25Å; V619-S623 PolarHBondContact O-N 3.23Å; V619-L632 HydrophobicContact CG2-CD1 4.34Å; V619-L632 HydrophobicContact CG2-CD2 3.73Å; V619-L714 HydrophobicContact CB-CD2 4.5Å; V619-L714 HydrophobicContact CG2-CD2 4Å; V619-R717 HydrophobicContact CG1-CB 4.41Å
620	E	94.1	Very high	92.8	Very high	64 Å²	64	32.1 Å²	32.1	30%	0.299	17%	0.168	S	C	.	.	H	α-helix	trans	-65.6	-49.6	177.1	-172	173.4	163.8	0	0	112.1	K570 C616 L617 A618 V622 S623	K570-E620 IonicContact NZ-OE1 2.71Å; K570-E620 PolarHBondContact NZ-OE1 3.29Å; K570-E620 IonicContact NZ-OE2 3.68Å; K570-E620 PolarHBondContact NZ-OE2 3.39Å; C616-E620 PolarHBondContact O-N 2.95Å; L617-E620 WeakPolarHBondContact O-CA 3.47Å; L617-E620 WeakPolarHBondContact O-CB 3.38Å; L617-E620 PolarHBondContact O-N 2.71Å; A618-E620 VanDerWaalsContact C-N 3.34Å; E620-V622 VanDerWaalsContact C-N 3.28Å; E620-V622 PolarHBondContact O-N 2.62Å; E620-S623 WeakPolarHBondContact O-CB 3.44Å; E620-S623 PolarHBondContact O-N 3.11Å; E620-S623 PolarHBondContact O-OG 3.39Å
621	Y	94.8	Very high	92.9	Very high	3 Å²	3	34.3 Å²	34.3	1%	0.012	18%	0.178	C	C	.	.	H	α-helix	trans	-59.2	-38.6	175.6	-83.8	-116.8	0	0	0	112.3	L569 T572 A573 T578 T586 A589 L590 I593 L617	L569-Y621 WeakPolarHBondContact O-CE2 3.43Å; L569-Y621 PolarHBondContact O-OH 3.18Å; T572-Y621 WeakPolarHBondContact CB-OH 3.46Å; T572-Y621 WeakPolarHBondContact CG2-OH 3.36Å; A573-Y621 HydrophobicContact CB-CD2 4.05Å; A573-Y621 HydrophobicContact CB-CE2 3.6Å; T578-Y621 WeakPolarHBondContact CB-O 3.37Å; T578-Y621 HydrophobicContact CG2-CD1 4.16Å; T578-Y621 HydrophobicContact CG2-CG 4.17Å; T586-Y621 HydrophobicContact CG2-CD1 3.73Å; T586-Y621 HydrophobicContact CG2-CE1 3.67Å; A589-Y621 HydrophobicContact CB-CE1 3.96Å; A589-Y621 WeakPolarHBondContact CB-OH 3.48Å; L590-Y621 HydrophobicContact CB-CD1 4.18Å; L590-Y621 HydrophobicContact CD1-CD1 4.16Å; L590-Y621 HydrophobicContact CD1-CG 4.24Å; I593-Y621 HydrophobicContact CD1-CD2 4.25Å; I593-Y621 HydrophobicContact CD1-CE2 3.96Å; L617-Y621 VanDerWaalsContact O-CD2 3.25Å; L617-Y621 WeakPolarHBondContact O-CD2 3.44Å; L617-Y621 PolarHBondContact O-N 3.04Å
622	V	93.6	Very high	93	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.006	18%	0.178	C	C	.	.	H	α-helix	trans	-83.9	-18	-177.1	170.4	0	0	0	0	112.7	A618 V619 E620 L624 S625 K626 R627 L629 L721 Y722	A618-V622 VanDerWaalsContact O-CB 3.26Å; A618-V622 WeakPolarHBondContact O-CB 3.3Å; A618-V622 VanDerWaalsContact O-CG2 3.25Å; A618-V622 WeakPolarHBondContact O-CG2 3.49Å; A618-V622 PolarHBondContact O-N 2.93Å; V619-V622 PolarHBondContact O-N 3.49Å; E620-V622 VanDerWaalsContact C-N 3.28Å; E620-V622 PolarHBondContact O-N 2.62Å; V622-L624 VanDerWaalsContact C-N 3.28Å; V622-L624 PolarHBondContact O-N 3.38Å; V622-L624 VanDerWaalsContact O-N 3.13Å; V622-S625 PolarHBondContact O-N 2.97Å; V622-K626 PolarHBondContact O-N 3.42Å; V622-R627 WeakPolarHBondContact CG1-O 3.48Å; V622-L629 HydrophobicContact CG2-CB 4.41Å; V622-L629 HydrophobicContact CG2-CD1 4.32Å; V622-L721 HydrophobicContact CG1-CD1 4.05Å; V622-L721 HydrophobicContact CG1-CD2 3.83Å; V622-Y722 HydrophobicContact CG1-CE1 4.32Å
623	S	92.1	Very high	93	Very high	61 Å²	61	34.7 Å²	34.7	43%	0.427	18%	0.18	S	C	.	.	H	α-helix	trans	-51.8	-40.6	-172.5	64.7	0	0	0	0	114.8	V619 E620	V619-S623 WeakPolarHBondContact O-CA 3.48Å; V619-S623 WeakPolarHBondContact O-CB 3.25Å; V619-S623 PolarHBondContact O-N 3.23Å; E620-S623 WeakPolarHBondContact O-CB 3.44Å; E620-S623 PolarHBondContact O-N 3.11Å; E620-S623 PolarHBondContact O-OG 3.39Å
624	L	90.3	Very high	92.9	Very high	81 Å²	81	36.3 Å²	36.3	42%	0.424	19%	0.188	S	C	.	.	H	α-helix	trans	-88.8	-38.8	179.7	-65.3	175	0	0	0	112.7	V622	V622-L624 VanDerWaalsContact C-N 3.28Å; V622-L624 PolarHBondContact O-N 3.38Å; V622-L624 VanDerWaalsContact O-N 3.13Å
625	S	90.3	Very high	92.8	Very high	17 Å²	17	36.4 Å²	36.4	12%	0.119	19%	0.188	C	C	.	.	H	α-helix	trans	-85.3	-14.3	-172.8	64.3	0	0	0	0	114.1	V622 R627	V622-S625 PolarHBondContact O-N 2.97Å; S625-R627 PolarHBondContact O-N 2.99Å
626	K	90.9	Very high	92.6	Very high	106 Å²	106	36.4 Å²	36.4	46%	0.461	19%	0.188	S	C	.	.			trans	52.7	15.8	-177.6	-69.9	-171.2	170.9	-174.4	0	115.8	V622 D724	V622-K626 PolarHBondContact O-N 3.42Å; K626-D724 IonicContact NZ-OD2 3.86Å; K626-D724 PolarHBondContact NZ-OD2 3.17Å
627	R	90.8	Very high	92.4	Very high	82 Å²	82	34.5 Å²	34.5	31%	0.309	18%	0.176	S	C	.	.			trans	-67.3	135.7	-176.5	-61.8	-176.9	-159.8	-175.7	14.7	111.6	S579 D580 F581 V622 S625 L629 Y722	S579-R627 PolarHBondContact O-NH2 3.24Å; D580-R627 PolarHBondContact O-NH2 2.95Å; F581-R627 VanDerWaalsContact CA-NH2 3.26Å; F581-R627 PolarHBondContact O-NH1 3.28Å; F581-R627 PolarHBondContact O-NH2 2.95Å; V622-R627 WeakPolarHBondContact CG1-O 3.48Å; S625-R627 PolarHBondContact O-N 2.99Å; R627-L629 PolarHBondContact O-N 3.05Å; R627-Y722 WeakPolarHBondContact O-CE1 3.29Å; R627-Y722 PolarHBondContact O-OH 3.39Å
628	F	92.6	Very high	92.1	Very high	83 Å²	83	34.3 Å²	34.3	36%	0.364	18%	0.175	S	C	.	.			trans	-73.6	117	177.6	-177	-114.7	0	0	0	111.8	P630 I633 Y722 L725 I731	F628-P630 HydrophobicContact CE1-CB 3.71Å; F628-P630 HydrophobicContact CE1-CG 4.28Å; F628-P630 HydrophobicContact CZ-CB 4Å; F628-I633 HydrophobicContact CE2-CG1 4Å; F628-Y722 HydrophobicContact CB-CE1 4.27Å; F628-Y722 HydrophobicContact CD2-CD1 4.16Å; F628-Y722 HydrophobicContact CD2-CD2 4.42Å; F628-Y722 AromaticContact CD2-CE1 3.92Å; F628-Y722 HydrophobicContact CD2-CE1 3.92Å; F628-Y722 HydrophobicContact CD2-CE2 4.19Å; F628-Y722 HydrophobicContact CD2-CG 4.41Å; F628-Y722 AromaticContact CD2-CZ 3.91Å; F628-Y722 HydrophobicContact CE2-CE2 4.48Å; F628-L725 HydrophobicContact CB-CD1 4.04Å; F628-L725 HydrophobicContact CD2-CD1 3.78Å; F628-L725 HydrophobicContact CG-CD1 4.09Å; F628-I731 HydrophobicContact CD2-CD1 4.28Å; F628-I731 HydrophobicContact CE1-CD1 4.28Å; F628-I731 HydrophobicContact CE2-CD1 3.79Å; F628-I731 HydrophobicContact CE2-CG1 4.37Å; F628-I731 HydrophobicContact CE2-CG2 3.81Å; F628-I731 HydrophobicContact CZ-CD1 3.79Å; F628-I731 HydrophobicContact CZ-CG1 4.06Å; F628-I731 HydrophobicContact CZ-CG2 3.9Å
629	L	93.1	Very high	91.8	Very high	12 Å²	12	34.3 Å²	34.3	6%	0.063	18%	0.175	C	C	.	.			trans	-111.9	99.1	176.4	-162	149.7	0	0	0	109.2	L590 V622 R627 E631 L632 Y722	L590-L629 HydrophobicContact CD1-CD1 3.56Å; L590-L629 HydrophobicContact CG-CD1 4.06Å; V622-L629 HydrophobicContact CG2-CB 4.41Å; V622-L629 HydrophobicContact CG2-CD1 4.32Å; R627-L629 PolarHBondContact O-N 3.05Å; L629-E631 VanDerWaalsContact C-N 3.34Å; L629-E631 HydrophobicContact CD2-CB 3.89Å; L629-E631 VanDerWaalsContact CD2-OE2 3.29Å; L629-E631 WeakPolarHBondContact CD2-OE2 3.34Å; L629-E631 WeakPolarHBondContact CG-OE2 3.39Å; L629-E631 PolarHBondContact O-N 3.4Å; L629-L632 HydrophobicContact CD2-CB 3.69Å; L629-Y722 PolarHBondContact N-OH 3.35Å; L629-Y722 VanDerWaalsContact N-OH 3.1Å
630	P	91.9	Very high	91.4	Very high	44 Å²	44	33.5 Å²	33.5	29%	0.286	17%	0.171	S	C	.	.	H	α-helix	trans	-69.2	-27.9	-172.1	23.6	-30.8	0	0	0	113.8	F628 L632 I633 N634	F628-P630 HydrophobicContact CE1-CB 3.71Å; F628-P630 HydrophobicContact CE1-CG 4.28Å; F628-P630 HydrophobicContact CZ-CB 4Å; P630-L632 VanDerWaalsContact C-N 3.29Å; P630-L632 PolarHBondContact O-N 3.14Å; P630-I633 PolarHBondContact O-N 3.14Å; P630-I633 VanDerWaalsContact O-N 3.17Å; P630-N634 WeakPolarHBondContact O-CB 3.25Å; P630-N634 VanDerWaalsContact O-CG 3.26Å; P630-N634 PolarHBondContact O-N 3.28Å; P630-N634 PolarHBondContact O-ND2 2.86Å
631	E	92.1	Very high	91	Very high	50 Å²	50	30.5 Å²	30.5	23%	0.234	16%	0.157	C	C	.	.	H	α-helix	trans	-60.6	-39.5	-179	-59.5	70.2	-151.5	0	0	111.2	L597 T598 L629 N634 F635	L597-E631 HydrophobicContact CB-CB 4.3Å; T598-E631 HydrophobicContact CG2-CB 3.99Å; T598-E631 HydrophobicContact CG2-CG 3.42Å; T598-E631 VanDerWaalsContact CG2-CG 3.42Å; L629-E631 VanDerWaalsContact C-N 3.34Å; L629-E631 HydrophobicContact CD2-CB 3.89Å; L629-E631 VanDerWaalsContact CD2-OE2 3.29Å; L629-E631 WeakPolarHBondContact CD2-OE2 3.34Å; L629-E631 WeakPolarHBondContact CG-OE2 3.39Å; L629-E631 PolarHBondContact O-N 3.4Å; E631-N634 PolarHBondContact O-N 3.46Å; E631-F635 WeakPolarHBondContact O-CB 3.46Å; E631-F635 PolarHBondContact O-N 2.72Å
632	L	93.2	Very high	90.5	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-61.8	-46.1	174.3	167.5	64.6	0	0	0	112	C615 A618 V619 L629 P630 F635 L636	C615-L632 HydrophobicContact CB-CD1 3.54Å; A618-L632 HydrophobicContact CB-CD1 4.39Å; A618-L632 HydrophobicContact CB-CD2 4.2Å; V619-L632 HydrophobicContact CG2-CD1 4.34Å; V619-L632 HydrophobicContact CG2-CD2 3.73Å; L629-L632 HydrophobicContact CD2-CB 3.69Å; P630-L632 VanDerWaalsContact C-N 3.29Å; P630-L632 PolarHBondContact O-N 3.14Å; L632-F635 PolarHBondContact O-N 3.4Å; L632-L636 HydrophobicContact CD1-CD1 3.79Å; L632-L636 HydrophobicContact CD1-CG 4.18Å; L632-L636 HydrophobicContact CG-CD1 4.19Å; L632-L636 WeakPolarHBondContact O-CB 3.33Å; L632-L636 VanDerWaalsContact O-CG 3.28Å; L632-L636 WeakPolarHBondContact O-CG 3.2Å; L632-L636 PolarHBondContact O-N 3.22Å
633	I	92	Very high	90	Very high	10 Å²	10	31.4 Å²	31.4	5%	0.051	16%	0.164	C	C	.	.	H	α-helix	trans	-68.2	-39.2	178.6	-58	-56.7	0	0	0	110.8	F628 P630 S637 C718 Y722 I731 F732 I735	F628-I633 HydrophobicContact CE2-CG1 4Å; P630-I633 PolarHBondContact O-N 3.14Å; P630-I633 VanDerWaalsContact O-N 3.17Å; I633-S637 VanDerWaalsContact O-CB 3.31Å; I633-S637 WeakPolarHBondContact O-CB 3.4Å; I633-S637 PolarHBondContact O-N 3.46Å; I633-C718 HydrophobicContact CD1-CB 3.9Å; I633-Y722 HydrophobicContact CD1-CD2 4.25Å; I633-Y722 HydrophobicContact CD1-CE2 3.99Å; I633-Y722 HydrophobicContact CG1-CE2 4.35Å; I633-I731 HydrophobicContact CG1-CG2 4.41Å; I633-I731 HydrophobicContact CG2-CG2 4.04Å; I633-F732 HydrophobicContact CD1-CE1 4.2Å; I633-F732 HydrophobicContact CD1-CZ 3.93Å; I633-I735 HydrophobicContact CG2-CD1 3.99Å
634	N	91.2	Very high	89.5	Confident	63 Å²	63	28.6 Å²	28.6	34%	0.337	14%	0.144	S	C	.	.	H	α-helix	trans	-62.7	-43.6	173.9	-70.1	-25.6	0	0	0	111.5	P630 E631 S637 G638 V655	P630-N634 WeakPolarHBondContact O-CB 3.25Å; P630-N634 VanDerWaalsContact O-CG 3.26Å; P630-N634 PolarHBondContact O-N 3.28Å; P630-N634 PolarHBondContact O-ND2 2.86Å; E631-N634 PolarHBondContact O-N 3.46Å; N634-S637 PolarHBondContact O-N 2.82Å; N634-G638 PolarHBondContact O-N 3.19Å; N634-V655 HydrophobicContact CB-CB 4.42Å
635	F	91.8	Very high	88.7	Confident	1 Å²	1	30.9 Å²	30.9	0%	0.004	15%	0.153	C	C	.	.	H	α-helix	trans	-67.4	-42.1	179.6	-167.4	-80.9	0	0	0	112.4	F560 L597 V602 L608 C615 E631 L632 G638 T639 P657 F658	F560-F635 HydrophobicContact CE1-CE2 4.37Å; F560-F635 HydrophobicContact CZ-CE2 4.06Å; F560-F635 HydrophobicContact CZ-CZ 4.42Å; L597-F635 HydrophobicContact CD2-CB 4.25Å; L597-F635 HydrophobicContact CD2-CD1 4.31Å; L597-F635 HydrophobicContact CD2-CD2 3.71Å; L597-F635 HydrophobicContact CD2-CE2 4.15Å; L597-F635 HydrophobicContact CD2-CG 3.82Å; V602-F635 HydrophobicContact CG2-CE2 3.98Å; V602-F635 HydrophobicContact CG2-CZ 3.98Å; L608-F635 HydrophobicContact CD1-CE1 4.31Å; L608-F635 HydrophobicContact CD1-CZ 4.37Å; C615-F635 WeakPolarHBondContact SG-CD1 3.38Å; E631-F635 WeakPolarHBondContact O-CB 3.46Å; E631-F635 PolarHBondContact O-N 2.72Å; L632-F635 PolarHBondContact O-N 3.4Å; F635-G638 PolarHBondContact O-N 3Å; F635-T639 WeakPolarHBondContact CE1-OG1 3.42Å; F635-T639 WeakPolarHBondContact O-CB 3.46Å; F635-T639 PolarHBondContact O-N 3.31Å; F635-T639 PolarHBondContact O-OG1 3.14Å; F635-P657 HydrophobicContact CD2-CG 4.35Å; F635-P657 HydrophobicContact CE2-CG 4.34Å; F635-F658 HydrophobicContact CB-CE2 4.36Å; F635-F658 HydrophobicContact CD1-CE2 4.47Å; F635-F658 HydrophobicContact CD1-CZ 4.23Å; F635-F658 AromaticContact CD2-CE2 3.53Å; F635-F658 HydrophobicContact CD2-CE2 3.53Å; F635-F658 AromaticContact CD2-CZ 3.84Å; F635-F658 HydrophobicContact CD2-CZ 3.84Å; F635-F658 HydrophobicContact CE1-CZ 4.1Å; F635-F658 AromaticContact CE2-CE2 3.78Å; F635-F658 HydrophobicContact CE2-CE2 3.78Å; F635-F658 AromaticContact CE2-CZ 3.68Å; F635-F658 HydrophobicContact CE2-CZ 3.68Å; F635-F658 AromaticContact CG-CE2 3.89Å; F635-F658 HydrophobicContact CG-CE2 3.89Å; F635-F658 HydrophobicContact CG-CZ 4.09Å; F635-F658 HydrophobicContact CZ-CE2 4.35Å; F635-F658 AromaticContact CZ-CZ 3.81Å; F635-F658 HydrophobicContact CZ-CZ 3.81Å
636	L	91.4	Very high	87.8	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-65.1	-43.1	174.3	-68.8	170.5	0	0	0	111.3	L612 L632 G638 T639 L640 L714 V715	L612-L636 HydrophobicContact CD2-CD2 4.48Å; L632-L636 HydrophobicContact CD1-CD1 3.79Å; L632-L636 HydrophobicContact CD1-CG 4.18Å; L632-L636 HydrophobicContact CG-CD1 4.19Å; L632-L636 WeakPolarHBondContact O-CB 3.33Å; L632-L636 VanDerWaalsContact O-CG 3.28Å; L632-L636 WeakPolarHBondContact O-CG 3.2Å; L632-L636 PolarHBondContact O-N 3.22Å; L636-G638 VanDerWaalsContact C-N 3.34Å; L636-G638 PolarHBondContact O-N 3.27Å; L636-T639 PolarHBondContact O-N 3.18Å; L636-L640 WeakPolarHBondContact O-CG 3.25Å; L636-L640 PolarHBondContact O-N 3.49Å; L636-L714 HydrophobicContact CD1-CB 4.1Å; L636-L714 HydrophobicContact CD2-CB 3.75Å; L636-L714 HydrophobicContact CD2-CD1 4.07Å; L636-V715 HydrophobicContact CB-CG2 3.94Å; L636-V715 HydrophobicContact CD1-CG2 4.05Å; L636-V715 HydrophobicContact CG-CG2 4.39Å
637	S	89.4	Confident	86.7	Confident	20 Å²	20	31 Å²	31	14%	0.14	16%	0.155	C	C	.	.	H	α-helix	trans	-66.6	-34.1	175.9	-166.2	0	0	0	0	112.9	I633 N634 H641 L738	I633-S637 VanDerWaalsContact O-CB 3.31Å; I633-S637 WeakPolarHBondContact O-CB 3.4Å; I633-S637 PolarHBondContact O-N 3.46Å; N634-S637 PolarHBondContact O-N 2.82Å; S637-H641 PolarHBondContact O-N 2.9Å; S637-H641 VanDerWaalsContact O-N 3.1Å; S637-L738 WeakPolarHBondContact OG-CD1 3.4Å
638	G	87.9	Confident	85.4	Confident	4 Å²	4	31.9 Å²	31.9	4%	0.041	18%	0.18	C	C	.	.	H	α-helix	trans	-69	-39.8	172.8	0	0	0	0	0	112.4	N634 F635 L636 H641 L642	N634-G638 PolarHBondContact O-N 3.19Å; F635-G638 PolarHBondContact O-N 3Å; L636-G638 VanDerWaalsContact C-N 3.34Å; L636-G638 PolarHBondContact O-N 3.27Å; G638-H641 WeakPolarHBondContact O-CB 3.34Å; G638-H641 PolarHBondContact O-N 2.92Å; G638-H641 VanDerWaalsContact O-N 3.13Å; G638-L642 PolarHBondContact O-N 3.24Å
639	T	88.9	Confident	83.8	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-61.7	-45.2	173.4	-61.3	0	0	0	0	111.5	L608 F635 L636 H641 L642 L668 C711	L608-T639 HydrophobicContact CD1-CG2 3.94Å; F635-T639 WeakPolarHBondContact CE1-OG1 3.42Å; F635-T639 WeakPolarHBondContact O-CB 3.46Å; F635-T639 PolarHBondContact O-N 3.31Å; F635-T639 PolarHBondContact O-OG1 3.14Å; L636-T639 PolarHBondContact O-N 3.18Å; T639-H641 VanDerWaalsContact C-N 3.27Å; T639-H641 PolarHBondContact O-N 3.34Å; T639-L642 WeakPolarHBondContact O-CB 3.46Å; T639-L642 PolarHBondContact O-N 3.29Å; T639-L668 HydrophobicContact CG2-CD1 3.88Å; T639-C711 HydrophobicContact CG2-CB 3.91Å
640	L	87.4	Confident	82.3	Confident	1 Å²	1	30.4 Å²	30.4	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-61.3	-34.7	172.9	-68.6	176	0	0	0	112.4	L636 A643 L708 L712 V715 I735 L738 L739 L743	L636-L640 WeakPolarHBondContact O-CG 3.25Å; L636-L640 PolarHBondContact O-N 3.49Å; L640-A643 PolarHBondContact O-N 3.24Å; L640-L708 HydrophobicContact CD2-CD1 3.78Å; L640-L712 HydrophobicContact CD2-CD2 3.94Å; L640-L712 HydrophobicContact CD2-CG 4.44Å; L640-V715 HydrophobicContact CD1-CG2 4.41Å; L640-I735 HydrophobicContact CD1-CG2 3.95Å; L640-L738 HydrophobicContact CB-CD1 4.38Å; L640-L739 HydrophobicContact CD1-CD2 4.22Å; L640-L739 HydrophobicContact CD1-CG 4.47Å; L640-L739 HydrophobicContact CD2-CD2 4.29Å; L640-L743 HydrophobicContact CD2-CD2 4.2Å
641	H	84.7	Confident	80.8	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-67.9	-31.6	175.6	-172.9	87.5	0	0	0	113	S637 G638 T639 A643 V644 V654	S637-H641 PolarHBondContact O-N 2.9Å; S637-H641 VanDerWaalsContact O-N 3.1Å; G638-H641 WeakPolarHBondContact O-CB 3.34Å; G638-H641 PolarHBondContact O-N 2.92Å; G638-H641 VanDerWaalsContact O-N 3.13Å; T639-H641 VanDerWaalsContact C-N 3.27Å; T639-H641 PolarHBondContact O-N 3.34Å; H641-A643 PolarHBondContact O-N 2.81Å; H641-V644 PolarHBondContact O-N 3.37Å; H641-V654 HydrophobicContact CB-CG2 4.33Å
642	L	85.6	Confident	79.4	Confident	7 Å²	7	30.7 Å²	30.7	4%	0.037	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-16.9	173.6	-67.1	-174.8	0	0	0	114.1	V602 G638 T639 F658 Y664 L667 L668	V602-L642 HydrophobicContact CG1-CD1 4.26Å; G638-L642 PolarHBondContact O-N 3.24Å; T639-L642 WeakPolarHBondContact O-CB 3.46Å; T639-L642 PolarHBondContact O-N 3.29Å; L642-F658 HydrophobicContact CD1-CD1 3.93Å; L642-F658 HydrophobicContact CD1-CE1 3.63Å; L642-F658 HydrophobicContact CD2-CD1 4.19Å; L642-F658 HydrophobicContact CG-CD1 3.87Å; L642-F658 HydrophobicContact CG-CE1 3.98Å; L642-Y664 WeakPolarHBondContact CD2-O 3.46Å; L642-L667 HydrophobicContact CD1-CB 4.37Å; L642-L667 HydrophobicContact CD1-CD1 4.39Å; L642-L668 HydrophobicContact CB-CB 4.29Å; L642-L668 HydrophobicContact CB-CD1 4.37Å; L642-L668 HydrophobicContact CB-CG 4.31Å; L642-L668 PolarHBondContact O-N 2.89Å
643	A	83.1	Confident	78.2	Confident	15 Å²	15	39.1 Å²	39.1	12%	0.124	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-5.8	177.2	0	0	0	0	0	113.3	L640 H641 L668 L708 L743	L640-A643 PolarHBondContact O-N 3.24Å; H641-A643 PolarHBondContact O-N 2.81Å; A643-L668 HydrophobicContact CB-CB 3.87Å; A643-L668 HydrophobicContact CB-CD1 4.35Å; A643-L708 HydrophobicContact CB-CD1 4.36Å; A643-L743 HydrophobicContact CB-CD1 4Å; A643-L743 HydrophobicContact CB-CD2 4.36Å
644	V	81.2	Confident	77.3	Confident	2 Å²	2	40.1 Å²	40.1	1%	0.012	25%	0.25	C	S	.	.			trans	-82.5	128.9	-179.2	173	0	0	0	0	110.9	H641 D646 K647 L738 H742 L743	H641-V644 PolarHBondContact O-N 3.37Å; V644-D646 WeakPolarHBondContact CG1-O 3.47Å; V644-K647 VanDerWaalsContact O-CE 3.25Å; V644-K647 WeakPolarHBondContact O-CE 3.45Å; V644-L738 HydrophobicContact CG2-CD2 4.26Å; V644-H742 HydrophobicContact CG1-CB 3.89Å; V644-H742 HydrophobicContact CG2-CB 3.81Å; V644-L743 HydrophobicContact CG2-CD1 3.72Å
645	Q	73.7	Confident	76.7	Confident	130 Å²	130	40.1 Å²	40.1	61%	0.607	25%	0.253	S	S	*	.	S	Bend	trans	-76	-52.5	176.3	-67.9	177.7	0.4	0	0	112.6	V669	Q645-V669 HydrophobicContact CG-CG1 3.93Å
646	D	71.1	Confident	75.8	Confident	85 Å²	85	44.4 Å²	44.4	46%	0.455	28%	0.281	S	S	.	.			trans	-94	106.2	175.2	175	25.6	0	0	0	112	V644 A648 S649	V644-D646 WeakPolarHBondContact CG1-O 3.47Å; D646-A648 WeakPolarHBondContact OD1-CB 3.48Å; D646-A648 PolarHBondContact OD1-N 3.34Å; D646-S649 VanDerWaalsContact OD2-CB 3.23Å; D646-S649 WeakPolarHBondContact OD2-CB 3.21Å; D646-S649 PolarHBondContact OD2-OG 3.1Å
647	K	68.2	Low	75.1	Confident	39 Å²	39	44.9 Å²	44.9	17%	0.17	28%	0.284	C	S	.	.			trans	-89.4	-16.7	179	-68.9	153.4	-175.9	161.3	0	113.5	V644 S649 A650 S665 D666	V644-K647 VanDerWaalsContact O-CE 3.25Å; V644-K647 WeakPolarHBondContact O-CE 3.45Å; K647-S649 VanDerWaalsContact C-N 3.33Å; K647-S649 PolarHBondContact O-N 2.77Å; K647-A650 WeakPolarHBondContact O-CB 3.39Å; K647-A650 PolarHBondContact O-N 2.91Å; K647-S665 WeakPolarHBondContact CE-O 3.05Å; K647-S665 PolarHBondContact NZ-O 3.19Å; K647-S665 PolarHBondContact NZ-OG 3.4Å; K647-D666 IonicContact NZ-OD1 2.62Å; K647-D666 PolarHBondContact NZ-OD1 2.89Å; K647-D666 IonicContact NZ-OD2 3.8Å; K647-D666 PolarHBondContact NZ-OD2 2.94Å; K647-D666 VanDerWaalsContact NZ-OD2 3.1Å
648	A	62.1	Low	74.7	Confident	102 Å²	102	44.5 Å²	44.5	84%	0.843	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-30.4	-177.4	0	0	0	0	0	112	D646	D646-A648 WeakPolarHBondContact OD1-CB 3.48Å; D646-A648 PolarHBondContact OD1-N 3.34Å
649	S	60.4	Low	74.1	Confident	61 Å²	61	52.4 Å²	52.4	43%	0.427	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-5.8	178.2	62.4	0	0	0	0	114.9	D646 K647 G651 H742	D646-S649 VanDerWaalsContact OD2-CB 3.23Å; D646-S649 WeakPolarHBondContact OD2-CB 3.21Å; D646-S649 PolarHBondContact OD2-OG 3.1Å; K647-S649 VanDerWaalsContact C-N 3.33Å; K647-S649 PolarHBondContact O-N 2.77Å; S649-G651 VanDerWaalsContact C-N 3.31Å; S649-G651 PolarHBondContact O-N 2.66Å; S649-G651 VanDerWaalsContact O-N 3.16Å; S649-H742 VanDerWaalsContact C-CE1 3.5Å; S649-H742 PolarHBondContact O-CE1 2.77Å; S649-H742 PolarHBondContact OG-CE1 3.47Å; S649-H742 VanDerWaalsContact OG-CE1 3.23Å; S649-H742 PolarHBondContact OG-ND1 3.15Å
650	A	61.2	Low	73	Confident	2 Å²	2	56.7 Å²	56.7	2%	0.017	33%	0.331	C	S	.	.			trans	-59.4	-32.1	-164.9	0	0	0	0	0	115.5	K647 C652	K647-A650 WeakPolarHBondContact O-CB 3.39Å; K647-A650 PolarHBondContact O-N 2.91Å; A650-C652 PolarHBondContact O-N 2.8Å
651	G	61.1	Low	72	Confident	84 Å²	84	61.3 Å²	61.3	87%	0.866	36%	0.363	S	S	*	.			trans	61.7	7.2	174.3	0	0	0	0	0	116.5	S649	S649-G651 VanDerWaalsContact C-N 3.31Å; S649-G651 PolarHBondContact O-N 2.66Å; S649-G651 VanDerWaalsContact O-N 3.16Å
652	C	62.5	Low	71.3	Confident	16 Å²	16	63.4 Å²	63.4	11%	0.108	39%	0.385	C	S	.	.			trans	-102.4	136.9	-177.1	60.1	0	0	0	0	111.8	A650 V654	A650-C652 PolarHBondContact O-N 2.8Å; C652-V654 PolarHBondContact O-N 2.89Å
653	M	67.2	Low	70.6	Confident	179 Å²	179	72.4 Å²	72.4	88%	0.882	42%	0.424	S	S	*	.			trans	-75.3	114.2	168.3	-67.2	-60.1	-66.5	0	0	109.3
654	V	72.9	Confident	70.2	Confident	30 Å²	30	77.4 Å²	77.4	18%	0.182	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-92.2	129.5	175.7	175.5	0	0	0	0	109.4	H641 C652 F658 L660	H641-V654 HydrophobicContact CB-CG2 4.33Å; C652-V654 PolarHBondContact O-N 2.89Å; V654-F658 HydrophobicContact CG1-CB 3.44Å; V654-F658 VanDerWaalsContact CG1-CB 3.44Å; V654-L660 HydrophobicContact CB-CD2 3.83Å; V654-L660 HydrophobicContact CB-CG 4.18Å; V654-L660 HydrophobicContact CG2-CD2 3.55Å; V654-L660 HydrophobicContact CG2-CG 4.4Å
655	V	78.2	Confident	69.8	Low	64 Å²	64	77.8 Å²	77.8	39%	0.388	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-96.9	147.1	-178.2	-174.5	0	0	0	0	109.3	N634 F658	N634-V655 HydrophobicContact CB-CB 4.42Å; V655-F658 PolarHBondContact O-N 3.18Å
656	P	74.1	Confident	70.1	Confident	90 Å²	90	75 Å²	75	58%	0.584	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.9	144.1	168	-28.7	36.6	0	0	0	112
657	P	76.3	Confident	70.6	Confident	10 Å²	10	72.3 Å²	72.3	7%	0.065	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	cis	-80.6	-8.9	14.3	30.5	-36.4	0	0	0	115.7	L597 C600 L601 F635	L597-P657 WeakPolarHBondContact O-CD 3.5Å; C600-P657 WeakPolarHBondContact O-CB 3.26Å; C600-P657 WeakPolarHBondContact O-CG 3.34Å; L601-P657 HydrophobicContact CD2-CB 4.06Å; L601-P657 WeakPolarHBondContact CD2-O 3.37Å; F635-P657 HydrophobicContact CD2-CG 4.35Å; F635-P657 HydrophobicContact CE2-CG 4.34Å
658	F	81.6	Confident	71.2	Confident	12 Å²	12	70.8 Å²	70.8	5%	0.053	41%	0.411	C	S	.	.			trans	-77.2	160.2	-176.5	-57.8	-94.6	0	0	0	112.1	V602 F635 L642 V654 V655	V602-F658 HydrophobicContact CB-CE1 4.5Å; V602-F658 HydrophobicContact CG2-CE1 4.13Å; V602-F658 HydrophobicContact CG2-CZ 4.04Å; F635-F658 HydrophobicContact CB-CE2 4.36Å; F635-F658 HydrophobicContact CD1-CE2 4.47Å; F635-F658 HydrophobicContact CD1-CZ 4.23Å; F635-F658 AromaticContact CD2-CE2 3.53Å; F635-F658 HydrophobicContact CD2-CE2 3.53Å; F635-F658 AromaticContact CD2-CZ 3.84Å; F635-F658 HydrophobicContact CD2-CZ 3.84Å; F635-F658 HydrophobicContact CE1-CZ 4.1Å; F635-F658 AromaticContact CE2-CE2 3.78Å; F635-F658 HydrophobicContact CE2-CE2 3.78Å; F635-F658 AromaticContact CE2-CZ 3.68Å; F635-F658 HydrophobicContact CE2-CZ 3.68Å; F635-F658 AromaticContact CG-CE2 3.89Å; F635-F658 HydrophobicContact CG-CE2 3.89Å; F635-F658 HydrophobicContact CG-CZ 4.09Å; F635-F658 HydrophobicContact CZ-CE2 4.35Å; F635-F658 AromaticContact CZ-CZ 3.81Å; F635-F658 HydrophobicContact CZ-CZ 3.81Å; L642-F658 HydrophobicContact CD1-CD1 3.93Å; L642-F658 HydrophobicContact CD1-CE1 3.63Å; L642-F658 HydrophobicContact CD2-CD1 4.19Å; L642-F658 HydrophobicContact CG-CD1 3.87Å; L642-F658 HydrophobicContact CG-CE1 3.98Å; V654-F658 HydrophobicContact CG1-CB 3.44Å; V654-F658 VanDerWaalsContact CG1-CB 3.44Å; V655-F658 PolarHBondContact O-N 3.18Å
659	R	74.4	Confident	72.1	Confident	171 Å²	171	67.2 Å²	67.2	65%	0.645	38%	0.379	S	S	*	.			trans	-138	139.7	-179.7	-58.8	-175	-174.3	-165.1	-0.3	110.5	S661	R659-S661 PolarHBondContact O-N 2.89Å
660	L	67	Low	72.9	Confident	90 Å²	90	66.3 Å²	66.3	47%	0.471	37%	0.369	S	S	.	.	S	Bend	trans	-58.9	-26.2	179.6	-68	168	0	0	0	113.9	V654	V654-L660 HydrophobicContact CB-CD2 3.83Å; V654-L660 HydrophobicContact CB-CG 4.18Å; V654-L660 HydrophobicContact CG2-CD2 3.55Å; V654-L660 HydrophobicContact CG2-CG 4.4Å
661	S	64.7	Low	73.3	Confident	97 Å²	97	69.6 Å²	69.6	68%	0.678	39%	0.392	S	S	*	.	S	Bend	trans	-149.4	139.2	178.7	59.2	0	0	0	0	111.3	R659	R659-S661 PolarHBondContact O-N 2.89Å
662	G	70.3	Confident	73.6	Confident	45 Å²	45	69.7 Å²	69.7	46%	0.464	37%	0.372	S	S	.	.	S	Bend	trans	158.8	169.6	175.3	0	0	0	0	0	113.2	Y664 S665	G662-Y664 PolarHBondContact O-N 3.44Å; G662-S665 WeakPolarHBondContact O-CB 3.41Å; G662-S665 PolarHBondContact O-N 2.99Å; G662-S665 PolarHBondContact O-OG 3.5Å
663	K	71.3	Confident	73.8	Confident	197 Å²	197	73.4 Å²	73.4	86%	0.857	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-26.6	-176.3	-63.9	-176.3	178.2	-177.1	0	114.7
664	Y	74.7	Confident	73.6	Confident	120 Å²	120	72.2 Å²	72.2	47%	0.471	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	4.1	-178.6	-49.7	-60.4	0	0	0	113.1	R603 L642 G662 D666 L667	R603-Y664 HydrophobicContact CB-CD1 4.44Å; R603-Y664 HydrophobicContact CB-CE1 4.35Å; R603-Y664 HydrophobicContact CB-CE2 4.47Å; R603-Y664 HydrophobicContact CG-CD2 4.28Å; R603-Y664 HydrophobicContact CG-CE2 4.1Å; R603-Y664 WeakPolarHBondContact O-CD1 3.38Å; L642-Y664 WeakPolarHBondContact CD2-O 3.46Å; G662-Y664 PolarHBondContact O-N 3.44Å; Y664-D666 PolarHBondContact O-N 3.08Å; Y664-L667 WeakPolarHBondContact O-CD1 3.22Å; Y664-L667 VanDerWaalsContact O-CG 3.3Å; Y664-L667 WeakPolarHBondContact O-CG 3.32Å
665	S	73.6	Confident	73.2	Confident	10 Å²	10	70.8 Å²	70.8	7%	0.07	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-13.6	-177.5	75.1	0	0	0	0	113.7	K647 G662	K647-S665 WeakPolarHBondContact CE-O 3.05Å; K647-S665 PolarHBondContact NZ-O 3.19Å; K647-S665 PolarHBondContact NZ-OG 3.4Å; G662-S665 WeakPolarHBondContact O-CB 3.41Å; G662-S665 PolarHBondContact O-N 2.99Å; G662-S665 PolarHBondContact O-OG 3.5Å
666	D	78.8	Confident	72.5	Confident	72 Å²	72	69 Å²	69	39%	0.385	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	16.1	-173.4	-58.4	-87.4	0	0	0	112.3	K647 Y664 L668 V669	K647-D666 IonicContact NZ-OD1 2.62Å; K647-D666 PolarHBondContact NZ-OD1 2.89Å; K647-D666 IonicContact NZ-OD2 3.8Å; K647-D666 PolarHBondContact NZ-OD2 2.94Å; K647-D666 VanDerWaalsContact NZ-OD2 3.1Å; Y664-D666 PolarHBondContact O-N 3.08Å; D666-L668 VanDerWaalsContact C-N 3.3Å; D666-L668 PolarHBondContact O-N 3.43Å; D666-V669 HydrophobicContact CB-CB 4.37Å; D666-V669 HydrophobicContact CB-CG2 4.14Å; D666-V669 PolarHBondContact O-N 2.91Å; D666-V669 VanDerWaalsContact O-N 3.13Å
667	L	81.5	Confident	72.2	Confident	28 Å²	28	70 Å²	70	15%	0.147	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-38.3	-174.1	-82.1	170	0	0	0	113.6	V602 L642 Y664 R704	V602-L667 HydrophobicContact CG1-CD1 3.95Å; L642-L667 HydrophobicContact CD1-CB 4.37Å; L642-L667 HydrophobicContact CD1-CD1 4.39Å; Y664-L667 WeakPolarHBondContact O-CD1 3.22Å; Y664-L667 VanDerWaalsContact O-CG 3.3Å; Y664-L667 WeakPolarHBondContact O-CG 3.32Å; L667-R704 PolarHBondContact O-NE 3.24Å
668	L	80.4	Confident	72.2	Confident	7 Å²	7	72.4 Å²	72.4	4%	0.037	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	0.2	178.7	-70	-176.2	0	0	0	114.3	L605 L608 T639 L642 A643 D666 L670 R704 C707	L605-L668 HydrophobicContact CD2-CD2 4.19Å; L608-L668 HydrophobicContact CD2-CD1 3.91Å; L608-L668 HydrophobicContact CD2-CD2 3.6Å; L608-L668 HydrophobicContact CD2-CG 3.77Å; T639-L668 HydrophobicContact CG2-CD1 3.88Å; L642-L668 HydrophobicContact CB-CB 4.29Å; L642-L668 HydrophobicContact CB-CD1 4.37Å; L642-L668 HydrophobicContact CB-CG 4.31Å; L642-L668 PolarHBondContact O-N 2.89Å; A643-L668 HydrophobicContact CB-CB 3.87Å; A643-L668 HydrophobicContact CB-CD1 4.35Å; D666-L668 VanDerWaalsContact C-N 3.3Å; D666-L668 PolarHBondContact O-N 3.43Å; L668-L670 PolarHBondContact O-N 2.86Å; L668-R704 HydrophobicContact CD2-CB 3.97Å; L668-R704 HydrophobicContact CD2-CG 4.03Å; L668-C707 HydrophobicContact CD2-CB 4Å
669	V	82.8	Confident	72.2	Confident	26 Å²	26	72.8 Å²	72.8	16%	0.158	40%	0.4	C	S	.	.	S	Bend	trans	-67.7	121.9	175.4	175.3	0	0	0	0	109	Q645 D666 R704	Q645-V669 HydrophobicContact CG-CG1 3.93Å; D666-V669 HydrophobicContact CB-CB 4.37Å; D666-V669 HydrophobicContact CB-CG2 4.14Å; D666-V669 PolarHBondContact O-N 2.91Å; D666-V669 VanDerWaalsContact O-N 3.13Å; V669-R704 PolarHBondContact O-NE 3.23Å; V669-R704 PolarHBondContact O-NH1 3.09Å; V669-R704 PolarHBondContact O-NH2 2.92Å; V669-R704 VanDerWaalsContact O-NH2 3.11Å
670	L	76.8	Confident	72.3	Confident	42 Å²	42	74.2 Å²	74.2	22%	0.22	41%	0.405	C	S	.	.			trans	-63.8	138.8	-179.7	-57.7	176.6	0	0	0	111	L668 C676 D701 R704 L705	L668-L670 PolarHBondContact O-N 2.86Å; L670-C676 VanDerWaalsContact CD1-SG 3.54Å; L670-D701 HydrophobicContact CD2-CB 4.42Å; L670-R704 HydrophobicContact CD2-CB 4.24Å; L670-L705 HydrophobicContact CD1-CD2 4.11Å; L670-L705 HydrophobicContact CD2-CD1 4.47Å; L670-L705 HydrophobicContact CD2-CD2 3.97Å; L670-L705 HydrophobicContact CD2-CG 3.85Å
671	S	69.6	Low	72.9	Confident	72 Å²	72	74.9 Å²	74.9	50%	0.503	40%	0.404	S	S	.	.	S	Bend	trans	-83.9	-36.6	179.5	-71.3	0	0	0	0	112.6	D701 R704	S671-D701 PolarHBondContact N-OD1 3.09Å; S671-D701 PolarHBondContact N-OD2 2.91Å; S671-D701 VanDerWaalsContact N-OD2 3.13Å; S671-R704 PolarHBondContact OG-NH1 2.89Å
672	N	67.7	Low	73.6	Confident	85 Å²	85	76.3 Å²	76.3	46%	0.455	40%	0.4	S	S	.	.			trans	-128.6	135.4	176.5	-71.1	-42.1	0	0	0	112.2	E674 S675 D701	N672-E674 PolarHBondContact O-N 3.02Å; N672-S675 VanDerWaalsContact O-CB 3.29Å; N672-S675 WeakPolarHBondContact O-CB 3.24Å; N672-S675 PolarHBondContact O-N 3.19Å; N672-S675 PolarHBondContact O-OG 2.85Å; N672-D701 PolarHBondContact N-OD2 3.35Å
673	S	65.2	Low	74.1	Confident	94 Å²	94	81.2 Å²	81.2	66%	0.657	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-21	175.1	-170.3	0	0	0	0	113.3	S675	S673-S675 VanDerWaalsContact C-N 3.3Å
674	E	62.9	Low	74.7	Confident	155 Å²	155	73.5 Å²	73.5	72%	0.724	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-20.1	176.8	-60.6	-176.5	168.5	0	0	112.5	N672 C676 S677	N672-E674 PolarHBondContact O-N 3.02Å; E674-C676 PolarHBondContact O-N 2.84Å; E674-C676 VanDerWaalsContact O-N 3.13Å; E674-S677 PolarHBondContact O-N 3.28Å; E674-S677 VanDerWaalsContact O-N 3.15Å; E674-S677 PolarHBondContact O-OG 3.05Å
675	S	64.6	Low	74.9	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-58.1	-27.5	174.5	-56.4	0	0	0	0	112.1	N672 S673 S677 S678 W679 D701 H702	N672-S675 VanDerWaalsContact O-CB 3.29Å; N672-S675 WeakPolarHBondContact O-CB 3.24Å; N672-S675 PolarHBondContact O-N 3.19Å; N672-S675 PolarHBondContact O-OG 2.85Å; S673-S675 VanDerWaalsContact C-N 3.3Å; S675-S677 PolarHBondContact O-N 2.69Å; S675-S678 PolarHBondContact O-OG 3.29Å; S675-W679 PolarHBondContact O-N 2.87Å; S675-D701 WeakPolarHBondContact CB-OD2 3.29Å; S675-D701 WeakPolarHBondContact OG-CB 3.42Å; S675-D701 PolarHBondContact OG-OD2 2.92Å; S675-H702 PolarHBondContact O-NE2 3.3Å
676	C	65.1	Low	75.2	Confident	26 Å²	26	74.3 Å²	74.3	18%	0.176	40%	0.399	C	S	.	.	H	α-helix	trans	-71.7	-22.3	179.4	-65.7	0	0	0	0	114.9	L670 E674 P749	L670-C676 VanDerWaalsContact CD1-SG 3.54Å; E674-C676 PolarHBondContact O-N 2.84Å; E674-C676 VanDerWaalsContact O-N 3.13Å; C676-P749 HydrophobicContact CB-CG 4Å
677	S	67.9	Low	75	Confident	110 Å²	110	73.3 Å²	73.3	77%	0.769	40%	0.398	S	S	*	.	H	α-helix	trans	-91	-19.5	-179.5	67.1	0	0	0	0	113.5	E674 S675	E674-S677 PolarHBondContact O-N 3.28Å; E674-S677 VanDerWaalsContact O-N 3.15Å; E674-S677 PolarHBondContact O-OG 3.05Å; S675-S677 PolarHBondContact O-N 2.69Å
678	S	75.3	Confident	74.8	Confident	62 Å²	62	72.1 Å²	72.1	43%	0.434	39%	0.391	S	S	.	.	H	α-helix	trans	-95.9	-16.1	178.2	52.8	0	0	0	0	113.7	S675 H702	S675-S678 PolarHBondContact O-OG 3.29Å; S678-H702 PolarHBondContact OG-NE2 3.25Å
679	W	81.2	Confident	74.7	Confident	20 Å²	20	72.7 Å²	72.7	8%	0.076	40%	0.396	C	S	.	.			trans	-66.2	144.1	-176.4	179.4	71.9	0	0	0	113.5	S675 K681 L705 N706 P749 P751 L752	S675-W679 PolarHBondContact O-N 2.87Å; W679-K681 HydrophobicContact CH2-CB 3.75Å; W679-K681 HydrophobicContact CH2-CG 4.23Å; W679-K681 HydrophobicContact CZ2-CB 3.97Å; W679-K681 HydrophobicContact CZ2-CG 4.34Å; W679-K681 HydrophobicContact CZ3-CB 4.4Å; W679-L705 HydrophobicContact CB-CD1 3.74Å; W679-L705 HydrophobicContact CD2-CB 4.11Å; W679-L705 HydrophobicContact CD2-CD1 4.24Å; W679-L705 HydrophobicContact CG-CB 4.03Å; W679-L705 HydrophobicContact CG-CD1 3.65Å; W679-L705 HydrophobicContact CG-CG 4.48Å; W679-L705 HydrophobicContact CZ2-CB 4.35Å; W679-N706 WeakPolarHBondContact CZ2-OD1 3.38Å; W679-N706 PolarHBondContact NE1-OD1 3.11Å; W679-P749 HydrophobicContact CD2-CB 4.48Å; W679-P749 HydrophobicContact CD2-CG 4.24Å; W679-P749 HydrophobicContact CE3-CB 3.49Å; W679-P749 VanDerWaalsContact CE3-CB 3.49Å; W679-P749 HydrophobicContact CE3-CG 3.69Å; W679-P749 HydrophobicContact CZ3-CB 3.87Å; W679-P749 HydrophobicContact CZ3-CG 4.27Å; W679-P751 HydrophobicContact CZ3-CB 4.23Å; W679-P751 HydrophobicContact CZ3-CG 4.12Å; W679-L752 HydrophobicContact CE3-CD1 4.45Å; W679-L752 HydrophobicContact CH2-CD1 3.67Å; W679-L752 HydrophobicContact CH2-CD2 4.1Å; W679-L752 HydrophobicContact CH2-CG 3.74Å; W679-L752 HydrophobicContact CZ2-CD1 4.21Å; W679-L752 HydrophobicContact CZ3-CD1 3.82Å; W679-L752 HydrophobicContact CZ3-CG 3.88Å
680	R	77.5	Confident	74.3	Confident	200 Å²	200	74.1 Å²	74.1	76%	0.755	40%	0.4	S	S	*	.			trans	-128.8	145.6	165.9	-65.5	-174.9	175.6	-154.6	-2.6	108.7	E682	R680-E682 PolarHBondContact O-N 3.38Å; R680-E682 VanDerWaalsContact O-N 3.14Å
681	K	78.8	Confident	74.2	Confident	105 Å²	105	78.6 Å²	78.6	46%	0.457	42%	0.42	S	S	.	.			trans	-67.8	110.9	176.7	-175.6	178.2	179.5	177.2	0	110	W679 S709	W679-K681 HydrophobicContact CH2-CB 3.75Å; W679-K681 HydrophobicContact CH2-CG 4.23Å; W679-K681 HydrophobicContact CZ2-CB 3.97Å; W679-K681 HydrophobicContact CZ2-CG 4.34Å; W679-K681 HydrophobicContact CZ3-CB 4.4Å; K681-S709 WeakPolarHBondContact CE-OG 3.45Å
682	E	80.4	Confident	74.6	Confident	126 Å²	126	76.9 Å²	76.9	59%	0.589	41%	0.405	S	S	*	.			trans	-117.9	152.7	174.4	-66.6	179.2	169.6	0	0	110.3	R680 N706	R680-E682 PolarHBondContact O-N 3.38Å; R680-E682 VanDerWaalsContact O-N 3.14Å; E682-N706 PolarHBondContact N-OD1 3.08Å
683	N	81.1	Confident	74.7	Confident	148 Å²	148	79.7 Å²	79.7	79%	0.791	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-79.2	135.6	176.7	-68	-20.4	0	0	0	109.8	P685	N683-P685 WeakPolarHBondContact O-CD 3.41Å
684	L	82.4	Confident	75.1	Confident	36 Å²	36	77.1 Å²	77.1	19%	0.188	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-65.8	123.3	173.7	-62.6	175.3	0	0	0	109.8	T609 Y703 N706 T710	T609-L684 HydrophobicContact CG2-CD1 4.49Å; L684-Y703 HydrophobicContact CD2-CD2 4.23Å; L684-Y703 HydrophobicContact CD2-CE1 4.22Å; L684-Y703 HydrophobicContact CD2-CE2 3.78Å; L684-N706 HydrophobicContact CD2-CB 3.61Å; L684-N706 HydrophobicContact CG-CB 4.33Å; L684-T710 HydrophobicContact CD1-CG2 4.08Å; L684-T710 HydrophobicContact CG-CG2 4.35Å
685	P	80.2	Confident	75.5	Confident	71 Å²	71	77.8 Å²	77.8	46%	0.461	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-76.1	137.2	179.2	30.3	-33.3	0	0	0	110.8	N683 S687 A688	N683-P685 WeakPolarHBondContact O-CD 3.41Å; P685-S687 PolarHBondContact O-N 3.45Å; P685-A688 HydrophobicContact CG-CB 4.21Å; P685-A688 VanDerWaalsContact O-CB 3.27Å; P685-A688 WeakPolarHBondContact O-CB 3.35Å; P685-A688 PolarHBondContact O-N 2.78Å
686	L	78.6	Confident	76.1	Confident	76 Å²	76	79.9 Å²	79.9	40%	0.398	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-59.8	-29.8	-177.8	-77.5	165.4	0	0	0	113.6	L512 L563 V613 A688 T689	L512-L686 HydrophobicContact CD1-CB 3.93Å; L512-L686 HydrophobicContact CD1-CD1 3.94Å; L563-L686 HydrophobicContact CD1-CB 4.26Å; V613-L686 HydrophobicContact CG1-CD2 4.19Å; V613-L686 HydrophobicContact CG2-CD2 3.95Å; L686-A688 PolarHBondContact O-N 2.99Å; L686-T689 PolarHBondContact O-N 2.93Å; L686-T689 PolarHBondContact O-OG1 2.88Å
687	S	76.1	Confident	76.7	Confident	51 Å²	51	82.9 Å²	82.9	36%	0.357	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-61.5	-21.4	174.5	50.1	0	0	0	0	114	P685 T689 Q690 Q691	P685-S687 PolarHBondContact O-N 3.45Å; S687-T689 PolarHBondContact O-N 3.13Å; S687-T689 VanDerWaalsContact O-N 3.16Å; S687-Q690 PolarHBondContact O-N 3.49Å; S687-Q691 PolarHBondContact O-N 3.49Å
688	A	76.6	Confident	77.2	Confident	2 Å²	2	81.7 Å²	81.7	2%	0.017	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-67.7	-10	176.1	0	0	0	0	0	114	T609 P685 L686 L692 Y703	T609-A688 HydrophobicContact CG2-CB 4.45Å; P685-A688 HydrophobicContact CG-CB 4.21Å; P685-A688 VanDerWaalsContact O-CB 3.27Å; P685-A688 WeakPolarHBondContact O-CB 3.35Å; P685-A688 PolarHBondContact O-N 2.78Å; L686-A688 PolarHBondContact O-N 2.99Å; A688-L692 HydrophobicContact CB-CD1 4.08Å; A688-Y703 HydrophobicContact CB-CE2 4.31Å; A688-Y703 VanDerWaalsContact CB-OH 3.27Å; A688-Y703 WeakPolarHBondContact CB-OH 3.43Å
689	T	77.3	Confident	77.5	Confident	20 Å²	20	82.9 Å²	82.9	12%	0.123	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-75.4	-24.4	169.6	61.6	0	0	0	0	112.8	L566 T609 V613 L686 S687	L566-T689 HydrophobicContact CD1-CG2 3.96Å; T609-T689 HydrophobicContact CG2-CG2 4.08Å; V613-T689 HydrophobicContact CG2-CG2 4.45Å; L686-T689 PolarHBondContact O-N 2.93Å; L686-T689 PolarHBondContact O-OG1 2.88Å; S687-T689 PolarHBondContact O-N 3.13Å; S687-T689 VanDerWaalsContact O-N 3.16Å
690	Q	74.8	Confident	77.5	Confident	55 Å²	55	85.3 Å²	85.3	26%	0.257	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-49	175.9	-71.2	168.8	-39.8	0	0	112	A505 L563 S687	A505-Q690 PolarHBondContact O-NE2 2.84Å; L563-Q690 HydrophobicContact CB-CG 3.84Å; L563-Q690 HydrophobicContact CD2-CG 4.33Å; S687-Q690 PolarHBondContact O-N 3.49Å
691	Q	75.4	Confident	77.8	Confident	136 Å²	136	75.8 Å²	75.8	64%	0.636	39%	0.385	S	S	*	.			trans	-142.2	122	-174	-65.6	-174.3	-4.1	0	0	110.7	S687	S687-Q691 PolarHBondContact O-N 3.49Å
692	L	77.2	Confident	78.2	Confident	36 Å²	36	73 Å²	73	19%	0.188	37%	0.373	C	S	.	.			trans	-130.2	91.1	-177.7	179.5	56.5	0	0	0	110.4	L605 Q606 A688 L694 Y703	L605-L692 HydrophobicContact CB-CD2 3.93Å; Q606-L692 HydrophobicContact CG-CB 3.67Å; Q606-L692 HydrophobicContact CG-CD2 4.03Å; Q606-L692 HydrophobicContact CG-CG 4.49Å; A688-L692 HydrophobicContact CB-CD1 4.08Å; L692-L694 HydrophobicContact CD1-CD1 3.91Å; L692-L694 HydrophobicContact CD1-CD2 4.06Å; L692-L694 HydrophobicContact CD1-CG 3.74Å; L692-L694 HydrophobicContact CD2-CD1 3.88Å; L692-L694 HydrophobicContact CG-CD1 3.78Å; L692-L694 HydrophobicContact CG-CG 3.88Å; L692-L694 PolarHBondContact O-N 2.84Å; L692-Y703 HydrophobicContact CD1-CD2 3.96Å; L692-Y703 HydrophobicContact CD1-CE2 3.55Å; L692-Y703 HydrophobicContact CD2-CD1 4.23Å; L692-Y703 HydrophobicContact CD2-CE1 3.7Å; L692-Y703 HydrophobicContact CD2-CE2 4.17Å
693	E	69.4	Low	78.5	Confident	145 Å²	145	67.7 Å²	67.7	68%	0.678	35%	0.348	S	S	*	.			trans	-87.9	88.3	178.4	-68.6	-160.9	140.2	0	0	112.6	K695	E693-K695 PolarHBondContact O-N 2.93Å; E693-K695 IonicContact OE1-NZ 3.03Å; E693-K695 VanDerWaalsContact OE2-CE 3.25Å; E693-K695 WeakPolarHBondContact OE2-CE 3.42Å; E693-K695 IonicContact OE2-NZ 2.86Å; E693-K695 PolarHBondContact OE2-NZ 3.19Å
694	L	75.1	Confident	78.8	Confident	40 Å²	40	62.4 Å²	62.4	21%	0.209	32%	0.317	C	S	.	.			trans	-95.4	86.6	177.2	-66.6	169	0	0	0	111.8	L605 L692 S696 N699 K700 Y703	L605-L694 HydrophobicContact CD1-CD1 4Å; L692-L694 HydrophobicContact CD1-CD1 3.91Å; L692-L694 HydrophobicContact CD1-CD2 4.06Å; L692-L694 HydrophobicContact CD1-CG 3.74Å; L692-L694 HydrophobicContact CD2-CD1 3.88Å; L692-L694 HydrophobicContact CG-CD1 3.78Å; L692-L694 HydrophobicContact CG-CG 3.88Å; L692-L694 PolarHBondContact O-N 2.84Å; L694-S696 PolarHBondContact O-N 3.42Å; L694-N699 HydrophobicContact CD2-CB 4.1Å; L694-K700 HydrophobicContact CB-CG 3.65Å; L694-K700 HydrophobicContact CD1-CG 4.08Å; L694-K700 HydrophobicContact CG-CG 4.42Å; L694-K700 WeakPolarHBondContact O-CE 3.31Å; L694-Y703 HydrophobicContact CD1-CD1 4.36Å; L694-Y703 HydrophobicContact CD1-CD2 4.45Å; L694-Y703 HydrophobicContact CD1-CG 4.02Å; L694-Y703 HydrophobicContact CD2-CD2 4.3Å; L694-Y703 HydrophobicContact CD2-CG 4.44Å
695	K	69.8	Low	79	Confident	169 Å²	169	60.7 Å²	60.7	74%	0.735	31%	0.308	S	S	*	.			trans	-75.9	-11.4	-171.2	-71.9	167	171.2	158.1	0	115.9	E693	E693-K695 PolarHBondContact O-N 2.93Å; E693-K695 IonicContact OE1-NZ 3.03Å; E693-K695 VanDerWaalsContact OE2-CE 3.25Å; E693-K695 WeakPolarHBondContact OE2-CE 3.42Å; E693-K695 IonicContact OE2-NZ 2.86Å; E693-K695 PolarHBondContact OE2-NZ 3.19Å
696	S	78.9	Confident	79.4	Confident	43 Å²	43	57.8 Å²	57.8	30%	0.301	29%	0.288	S	S	.	.	S	Bend	trans	-134.7	155.3	175.2	77.7	0	0	0	0	110.9	L694 N699 K700	L694-S696 PolarHBondContact O-N 3.42Å; S696-N699 PolarHBondContact O-N 3.28Å; S696-N699 WeakPolarHBondContact OG-CB 3.36Å; S696-N699 PolarHBondContact OG-N 3.43Å; S696-N699 VanDerWaalsContact OG-N 3.15Å; S696-N699 PolarHBondContact OG-OD1 3.4Å; S696-K700 WeakPolarHBondContact O-CG 3.04Å; S696-K700 PolarHBondContact O-N 3.43Å
697	D	76.5	Confident	79.9	Confident	90 Å²	90	54.1 Å²	54.1	48%	0.481	27%	0.269	S	S	.	.	H	α-helix	trans	-73.6	-28	179.7	-60.6	-52.1	0	0	0	113.1	K700 D701	D697-K700 WeakPolarHBondContact O-CB 3.41Å; D697-K700 PolarHBondContact O-N 2.85Å; D697-K700 WeakPolarHBondContact OD1-CD 3.47Å; D697-K700 WeakPolarHBondContact OD1-CE 3.28Å; D697-K700 IonicContact OD1-NZ 3.84Å; D697-K700 PolarHBondContact OD1-NZ 3.48Å; D697-D701 PolarHBondContact O-N 3.21Å
698	L	79.1	Confident	80.5	Confident	84 Å²	84	52.3 Å²	52.3	44%	0.44	26%	0.255	S	S	.	.	H	α-helix	trans	-61.5	-43.5	169.6	-70	174.3	0	0	0	111.3	K700 D701 H702	L698-K700 VanDerWaalsContact C-N 3.26Å; L698-K700 PolarHBondContact O-N 3.36Å; L698-D701 PolarHBondContact O-N 2.89Å; L698-H702 PolarHBondContact O-N 3.45Å
699	N	81.3	Confident	81.1	Confident	87 Å²	87	52.3 Å²	52.3	47%	0.465	26%	0.255	S	S	.	.	H	α-helix	trans	-65.2	-32.2	176.3	-67.2	27.5	0	0	0	111.2	L694 S696 Y703	L694-N699 HydrophobicContact CD2-CB 4.1Å; S696-N699 PolarHBondContact O-N 3.28Å; S696-N699 WeakPolarHBondContact OG-CB 3.36Å; S696-N699 PolarHBondContact OG-N 3.43Å; S696-N699 VanDerWaalsContact OG-N 3.15Å; S696-N699 PolarHBondContact OG-OD1 3.4Å; N699-Y703 VanDerWaalsContact O-CB 3.32Å; N699-Y703 WeakPolarHBondContact O-CB 3.35Å; N699-Y703 PolarHBondContact O-N 3.44Å
700	K	81.6	Confident	81.8	Confident	71 Å²	71	53 Å²	53	31%	0.309	26%	0.26	S	S	.	.	H	α-helix	trans	-67	-44.5	173.5	-63.2	169.1	-158.5	164.5	0	111.6	L694 S696 D697 L698 Y703 R704	L694-K700 HydrophobicContact CB-CG 3.65Å; L694-K700 HydrophobicContact CD1-CG 4.08Å; L694-K700 HydrophobicContact CG-CG 4.42Å; L694-K700 WeakPolarHBondContact O-CE 3.31Å; S696-K700 WeakPolarHBondContact O-CG 3.04Å; S696-K700 PolarHBondContact O-N 3.43Å; D697-K700 WeakPolarHBondContact O-CB 3.41Å; D697-K700 PolarHBondContact O-N 2.85Å; D697-K700 WeakPolarHBondContact OD1-CD 3.47Å; D697-K700 WeakPolarHBondContact OD1-CE 3.28Å; D697-K700 IonicContact OD1-NZ 3.84Å; D697-K700 PolarHBondContact OD1-NZ 3.48Å; L698-K700 VanDerWaalsContact C-N 3.26Å; L698-K700 PolarHBondContact O-N 3.36Å; K700-Y703 PolarHBondContact O-N 3.38Å; K700-R704 VanDerWaalsContact O-CG 3.24Å; K700-R704 WeakPolarHBondContact O-CG 3.39Å; K700-R704 PolarHBondContact O-N 3.22Å
701	D	83.9	Confident	82.6	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-65.4	-40.2	175.8	-82.7	-7.1	0	0	0	112.4	L670 S671 N672 S675 D697 L698 Y703 R704 L705	L670-D701 HydrophobicContact CD2-CB 4.42Å; S671-D701 PolarHBondContact N-OD1 3.09Å; S671-D701 PolarHBondContact N-OD2 2.91Å; S671-D701 VanDerWaalsContact N-OD2 3.13Å; N672-D701 PolarHBondContact N-OD2 3.35Å; S675-D701 WeakPolarHBondContact CB-OD2 3.29Å; S675-D701 WeakPolarHBondContact OG-CB 3.42Å; S675-D701 PolarHBondContact OG-OD2 2.92Å; D697-D701 PolarHBondContact O-N 3.21Å; L698-D701 PolarHBondContact O-N 2.89Å; D701-Y703 VanDerWaalsContact C-N 3.33Å; D701-Y703 PolarHBondContact O-N 3.1Å; D701-R704 WeakPolarHBondContact O-CB 3.49Å; D701-R704 PolarHBondContact O-N 3.22Å; D701-R704 IonicContact OD1-CZ 2.73Å; D701-R704 IonicContact OD1-NH1 3.51Å; D701-R704 PolarHBondContact OD1-NH1 3.45Å; D701-L705 WeakPolarHBondContact O-CG 3.5Å; D701-L705 PolarHBondContact O-N 2.91Å
702	H	86.2	Confident	83.3	Confident	46 Å²	46	44 Å²	44	21%	0.213	22%	0.218	C	C	.	.	H	α-helix	trans	-62.8	-39.6	172.3	-70.9	-178.8	0	0	0	112	S675 S678 L698 L705 N706	S675-H702 PolarHBondContact O-NE2 3.3Å; S678-H702 PolarHBondContact OG-NE2 3.25Å; L698-H702 PolarHBondContact O-N 3.45Å; H702-L705 PolarHBondContact O-N 2.94Å; H702-N706 PolarHBondContact O-N 3.07Å; H702-N706 PolarHBondContact O-ND2 3.27Å
703	Y	86.6	Confident	84	Confident	16 Å²	16	44.1 Å²	44.1	6%	0.063	22%	0.219	C	C	.	.	H	α-helix	trans	-65	-43.1	175	-161.9	-87.1	0	0	0	112.1	L605 T609 L684 A688 L692 L694 N699 K700 D701 L705 N706 C707	L605-Y703 HydrophobicContact CB-CD1 4.24Å; L605-Y703 HydrophobicContact CB-CE1 4.17Å; L605-Y703 HydrophobicContact CD1-CD1 4.21Å; T609-Y703 WeakPolarHBondContact CG2-OH 3.4Å; T609-Y703 WeakPolarHBondContact OG1-CE1 3.47Å; T609-Y703 PolarHBondContact OG1-OH 3.25Å; L684-Y703 HydrophobicContact CD2-CD2 4.23Å; L684-Y703 HydrophobicContact CD2-CE1 4.22Å; L684-Y703 HydrophobicContact CD2-CE2 3.78Å; A688-Y703 HydrophobicContact CB-CE2 4.31Å; A688-Y703 VanDerWaalsContact CB-OH 3.27Å; A688-Y703 WeakPolarHBondContact CB-OH 3.43Å; L692-Y703 HydrophobicContact CD1-CD2 3.96Å; L692-Y703 HydrophobicContact CD1-CE2 3.55Å; L692-Y703 HydrophobicContact CD2-CD1 4.23Å; L692-Y703 HydrophobicContact CD2-CE1 3.7Å; L692-Y703 HydrophobicContact CD2-CE2 4.17Å; L694-Y703 HydrophobicContact CD1-CD1 4.36Å; L694-Y703 HydrophobicContact CD1-CD2 4.45Å; L694-Y703 HydrophobicContact CD1-CG 4.02Å; L694-Y703 HydrophobicContact CD2-CD2 4.3Å; L694-Y703 HydrophobicContact CD2-CG 4.44Å; N699-Y703 VanDerWaalsContact O-CB 3.32Å; N699-Y703 WeakPolarHBondContact O-CB 3.35Å; N699-Y703 PolarHBondContact O-N 3.44Å; K700-Y703 PolarHBondContact O-N 3.38Å; D701-Y703 VanDerWaalsContact C-N 3.33Å; D701-Y703 PolarHBondContact O-N 3.1Å; Y703-L705 VanDerWaalsContact C-N 3.34Å; Y703-L705 PolarHBondContact O-N 3.15Å; Y703-N706 PolarHBondContact O-N 2.78Å; Y703-C707 VanDerWaalsContact CE1-SG 3.51Å; Y703-C707 PolarHBondContact O-N 3.23Å; Y703-C707 PolarHBondContact O-SG 3.25Å
704	R	87.8	Confident	85.1	Confident	36 Å²	36	37.4 Å²	37.4	14%	0.136	19%	0.187	C	C	.	.	H	α-helix	trans	-57.4	-45.1	172.8	-71.7	161.2	158.2	165.9	-12.8	111.6	L605 L667 L668 V669 L670 S671 K700 D701 C707 L708	L605-R704 HydrophobicContact CD1-CG 4.49Å; L605-R704 HydrophobicContact CD2-CG 4.26Å; L667-R704 PolarHBondContact O-NE 3.24Å; L668-R704 HydrophobicContact CD2-CB 3.97Å; L668-R704 HydrophobicContact CD2-CG 4.03Å; V669-R704 PolarHBondContact O-NE 3.23Å; V669-R704 PolarHBondContact O-NH1 3.09Å; V669-R704 PolarHBondContact O-NH2 2.92Å; V669-R704 VanDerWaalsContact O-NH2 3.11Å; L670-R704 HydrophobicContact CD2-CB 4.24Å; S671-R704 PolarHBondContact OG-NH1 2.89Å; K700-R704 VanDerWaalsContact O-CG 3.24Å; K700-R704 WeakPolarHBondContact O-CG 3.39Å; K700-R704 PolarHBondContact O-N 3.22Å; D701-R704 WeakPolarHBondContact O-CB 3.49Å; D701-R704 PolarHBondContact O-N 3.22Å; D701-R704 IonicContact OD1-CZ 2.73Å; D701-R704 IonicContact OD1-NH1 3.51Å; D701-R704 PolarHBondContact OD1-NH1 3.45Å; R704-C707 PolarHBondContact O-N 3.4Å; R704-L708 WeakPolarHBondContact O-CB 3.43Å; R704-L708 PolarHBondContact O-N 2.87Å
705	L	86.9	Confident	86	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-64.9	-36.2	176.2	-72.4	170.9	0	0	0	112.4	L670 W679 D701 H702 Y703 L708 S709 P749 L752	L670-L705 HydrophobicContact CD1-CD2 4.11Å; L670-L705 HydrophobicContact CD2-CD1 4.47Å; L670-L705 HydrophobicContact CD2-CD2 3.97Å; L670-L705 HydrophobicContact CD2-CG 3.85Å; W679-L705 HydrophobicContact CB-CD1 3.74Å; W679-L705 HydrophobicContact CD2-CB 4.11Å; W679-L705 HydrophobicContact CD2-CD1 4.24Å; W679-L705 HydrophobicContact CG-CB 4.03Å; W679-L705 HydrophobicContact CG-CD1 3.65Å; W679-L705 HydrophobicContact CG-CG 4.48Å; W679-L705 HydrophobicContact CZ2-CB 4.35Å; D701-L705 WeakPolarHBondContact O-CG 3.5Å; D701-L705 PolarHBondContact O-N 2.91Å; H702-L705 PolarHBondContact O-N 2.94Å; Y703-L705 VanDerWaalsContact C-N 3.34Å; Y703-L705 PolarHBondContact O-N 3.15Å; L705-L708 PolarHBondContact O-N 3.43Å; L705-S709 WeakPolarHBondContact O-CB 3.33Å; L705-S709 PolarHBondContact O-N 2.94Å; L705-P749 HydrophobicContact CD1-CG 4.04Å; L705-P749 HydrophobicContact CD2-CG 4.02Å; L705-L752 HydrophobicContact CD2-CD1 4.16Å
706	N	88.9	Confident	87	Confident	9 Å²	9	30.1 Å²	30.1	5%	0.048	15%	0.154	C	C	.	.	H	α-helix	trans	-66.5	-44.3	172.8	-71.3	-19.9	0	0	0	111.9	W679 E682 L684 H702 Y703 L708 S709 T710	W679-N706 WeakPolarHBondContact CZ2-OD1 3.38Å; W679-N706 PolarHBondContact NE1-OD1 3.11Å; E682-N706 PolarHBondContact N-OD1 3.08Å; L684-N706 HydrophobicContact CD2-CB 3.61Å; L684-N706 HydrophobicContact CG-CB 4.33Å; H702-N706 PolarHBondContact O-N 3.07Å; H702-N706 PolarHBondContact O-ND2 3.27Å; Y703-N706 PolarHBondContact O-N 2.78Å; N706-L708 VanDerWaalsContact C-N 3.32Å; N706-L708 PolarHBondContact O-N 3.36Å; N706-S709 WeakPolarHBondContact O-CB 3.49Å; N706-S709 PolarHBondContact O-N 2.98Å; N706-S709 VanDerWaalsContact O-N 3.15Å; N706-T710 PolarHBondContact O-N 2.96Å; N706-T710 PolarHBondContact O-OG1 3.41Å
707	C	88.8	Confident	87.7	Confident	0 Å²	0	34 Å²	34	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-60.3	-39	172.6	-68	0	0	0	0	112.8	L608 L612 L668 Y703 R704 T710 C711	L608-C707 HydrophobicContact CD2-CB 4.22Å; L612-C707 HydrophobicContact CD1-CB 3.89Å; L668-C707 HydrophobicContact CD2-CB 4Å; Y703-C707 VanDerWaalsContact CE1-SG 3.51Å; Y703-C707 PolarHBondContact O-N 3.23Å; Y703-C707 PolarHBondContact O-SG 3.25Å; R704-C707 PolarHBondContact O-N 3.4Å; C707-T710 PolarHBondContact O-OG1 3.13Å; C707-T710 VanDerWaalsContact O-OG1 3.05Å; C707-C711 VanDerWaalsContact O-CB 3.31Å; C707-C711 WeakPolarHBondContact O-CB 3.3Å; C707-C711 PolarHBondContact O-N 2.84Å
708	L	88.7	Confident	88.5	Confident	12 Å²	12	29.8 Å²	29.8	6%	0.063	14%	0.14	C	C	.	.	H	α-helix	trans	-68.7	-37.2	174.3	-174.4	58.5	0	0	0	111.5	L640 A643 R704 L705 N706 C711 L712 L743 L748	L640-L708 HydrophobicContact CD2-CD1 3.78Å; A643-L708 HydrophobicContact CB-CD1 4.36Å; R704-L708 WeakPolarHBondContact O-CB 3.43Å; R704-L708 PolarHBondContact O-N 2.87Å; L705-L708 PolarHBondContact O-N 3.43Å; N706-L708 VanDerWaalsContact C-N 3.32Å; N706-L708 PolarHBondContact O-N 3.36Å; L708-C711 PolarHBondContact O-N 3.08Å; L708-L712 HydrophobicContact CD1-CD1 4.42Å; L708-L712 HydrophobicContact CD1-CG 4.41Å; L708-L712 HydrophobicContact CG-CD1 4.22Å; L708-L712 WeakPolarHBondContact O-CB 3.5Å; L708-L712 WeakPolarHBondContact O-CG 3.42Å; L708-L712 PolarHBondContact O-N 3.11Å; L708-L743 HydrophobicContact CD1-CD2 3.99Å; L708-L743 HydrophobicContact CD2-CD2 4.27Å; L708-L748 HydrophobicContact CD2-CD2 3.68Å
709	S	89.9	Confident	89.1	Confident	2 Å²	2	26 Å²	26	1%	0.014	12%	0.12	C	C	.	.	H	α-helix	trans	-63.1	-41.8	174.9	-171.4	0	0	0	0	113	K681 L705 N706 D713	K681-S709 WeakPolarHBondContact CE-OG 3.45Å; L705-S709 WeakPolarHBondContact O-CB 3.33Å; L705-S709 PolarHBondContact O-N 2.94Å; N706-S709 WeakPolarHBondContact O-CB 3.49Å; N706-S709 PolarHBondContact O-N 2.98Å; N706-S709 VanDerWaalsContact O-N 3.15Å; S709-D713 WeakPolarHBondContact O-CB 3.3Å; S709-D713 PolarHBondContact O-N 3.14Å; S709-D713 VanDerWaalsContact O-N 3.08Å
710	T	90.9	Very high	89.5	Confident	36 Å²	36	27.4 Å²	27.4	22%	0.221	13%	0.127	C	C	.	.	H	α-helix	trans	-72.7	-37.6	177.3	52	0	0	0	0	111.1	L684 N706 C707 L712 D713 L714	L684-T710 HydrophobicContact CD1-CG2 4.08Å; L684-T710 HydrophobicContact CG-CG2 4.35Å; N706-T710 PolarHBondContact O-N 2.96Å; N706-T710 PolarHBondContact O-OG1 3.41Å; C707-T710 PolarHBondContact O-OG1 3.13Å; C707-T710 VanDerWaalsContact O-OG1 3.05Å; T710-L712 PolarHBondContact O-N 3.48Å; T710-D713 PolarHBondContact O-N 3.46Å; T710-L714 WeakPolarHBondContact O-CB 3.48Å; T710-L714 VanDerWaalsContact O-CG 3.28Å; T710-L714 WeakPolarHBondContact O-CG 3.44Å; T710-L714 PolarHBondContact O-N 3.13Å
711	C	91.9	Very high	89.9	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-59.2	-45.3	172	-173.8	0	0	0	0	112.2	L612 T639 C707 L708 L714 V715	L612-C711 HydrophobicContact CD2-CB 4.12Å; T639-C711 HydrophobicContact CG2-CB 3.91Å; C707-C711 VanDerWaalsContact O-CB 3.31Å; C707-C711 WeakPolarHBondContact O-CB 3.3Å; C707-C711 PolarHBondContact O-N 2.84Å; L708-C711 PolarHBondContact O-N 3.08Å; C711-L714 PolarHBondContact O-N 3.23Å; C711-V715 WeakPolarHBondContact O-CG2 3.44Å; C711-V715 PolarHBondContact O-N 3.23Å
712	L	90.6	Very high	90.3	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-68.3	-40.9	178.6	-72	170.6	0	0	0	112.4	L640 L708 T710 V715 K716 L739 L752 I759	L640-L712 HydrophobicContact CD2-CD2 3.94Å; L640-L712 HydrophobicContact CD2-CG 4.44Å; L708-L712 HydrophobicContact CD1-CD1 4.42Å; L708-L712 HydrophobicContact CD1-CG 4.41Å; L708-L712 HydrophobicContact CG-CD1 4.22Å; L708-L712 WeakPolarHBondContact O-CB 3.5Å; L708-L712 WeakPolarHBondContact O-CG 3.42Å; L708-L712 PolarHBondContact O-N 3.11Å; T710-L712 PolarHBondContact O-N 3.48Å; L712-V715 PolarHBondContact O-N 3.28Å; L712-K716 PolarHBondContact O-N 3.26Å; L712-L739 HydrophobicContact CD2-CD2 3.87Å; L712-L752 HydrophobicContact CD1-CD2 4.13Å; L712-I759 HydrophobicContact CB-CD1 4.15Å; L712-I759 HydrophobicContact CD2-CD1 3.94Å; L712-I759 VanDerWaalsContact O-CD1 3.3Å; L712-I759 WeakPolarHBondContact O-CD1 3.29Å
713	D	91.7	Very high	90.3	Very high	39 Å²	39	29.1 Å²	29.1	21%	0.209	14%	0.135	C	C	.	.	H	α-helix	trans	-63.2	-40.7	173.9	-175.9	20.6	0	0	0	111.7	S709 T710 V715 K716 R717	S709-D713 WeakPolarHBondContact O-CB 3.3Å; S709-D713 PolarHBondContact O-N 3.14Å; S709-D713 VanDerWaalsContact O-N 3.08Å; T710-D713 PolarHBondContact O-N 3.46Å; D713-V715 PolarHBondContact O-N 2.97Å; D713-K716 WeakPolarHBondContact O-CB 3.48Å; D713-K716 PolarHBondContact O-N 2.94Å; D713-R717 VanDerWaalsContact O-CG 3.26Å; D713-R717 WeakPolarHBondContact O-CG 3.39Å; D713-R717 PolarHBondContact O-N 3.24Å; D713-R717 IonicContact OD1-CZ 2.74Å; D713-R717 IonicContact OD1-NE 2.67Å; D713-R717 PolarHBondContact OD1-NE 3.38Å; D713-R717 IonicContact OD1-NH2 3.77Å; D713-R717 IonicContact OD2-CZ 2.69Å; D713-R717 IonicContact OD2-NE 2.67Å; D713-R717 PolarHBondContact OD2-NE 2.81Å; D713-R717 IonicContact OD2-NH2 2.97Å; D713-R717 PolarHBondContact OD2-NH2 3.43Å
714	L	93	Very high	90.3	Very high	4 Å²	4	33.8 Å²	33.8	2%	0.021	16%	0.161	C	C	.	.	H	α-helix	trans	-61.7	-42.8	172	-74.1	167.2	0	0	0	112.2	L612 C615 V619 L636 T710 C711 K716 R717 C718	L612-L714 HydrophobicContact CD2-CD1 4.06Å; C615-L714 HydrophobicContact CB-CD1 3.82Å; V619-L714 HydrophobicContact CB-CD2 4.5Å; V619-L714 HydrophobicContact CG2-CD2 4Å; L636-L714 HydrophobicContact CD1-CB 4.1Å; L636-L714 HydrophobicContact CD2-CB 3.75Å; L636-L714 HydrophobicContact CD2-CD1 4.07Å; T710-L714 WeakPolarHBondContact O-CB 3.48Å; T710-L714 VanDerWaalsContact O-CG 3.28Å; T710-L714 WeakPolarHBondContact O-CG 3.44Å; T710-L714 PolarHBondContact O-N 3.13Å; C711-L714 PolarHBondContact O-N 3.23Å; L714-K716 PolarHBondContact O-N 3.1Å; L714-R717 PolarHBondContact O-N 3.5Å; L714-C718 WeakPolarHBondContact O-CB 3.27Å; L714-C718 PolarHBondContact O-N 2.98Å; L714-C718 PolarHBondContact O-SG 2.94Å
715	V	93.1	Very high	90.3	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-60.5	-44.1	173.3	169.2	0	0	0	0	111.1	L636 L640 C711 L712 D713 R717 C718 C719 I735 I759	L636-V715 HydrophobicContact CB-CG2 3.94Å; L636-V715 HydrophobicContact CD1-CG2 4.05Å; L636-V715 HydrophobicContact CG-CG2 4.39Å; L640-V715 HydrophobicContact CD1-CG2 4.41Å; C711-V715 WeakPolarHBondContact O-CG2 3.44Å; C711-V715 PolarHBondContact O-N 3.23Å; L712-V715 PolarHBondContact O-N 3.28Å; D713-V715 PolarHBondContact O-N 2.97Å; V715-R717 PolarHBondContact O-N 3.29Å; V715-C718 PolarHBondContact O-N 3.21Å; V715-C719 PolarHBondContact O-N 3.1Å; V715-C719 PolarHBondContact O-SG 2.93Å; V715-I735 HydrophobicContact CG1-CG2 3.99Å; V715-I759 HydrophobicContact CB-CD1 4.37Å; V715-I759 HydrophobicContact CG1-CD1 4.15Å; V715-I759 HydrophobicContact CG1-CG1 4.45Å; V715-I759 HydrophobicContact CG1-CG2 3.77Å
716	K	91.9	Very high	90.2	Very high	56 Å²	56	39.2 Å²	39.2	24%	0.243	20%	0.196	C	C	.	.	H	α-helix	trans	-58.2	-46.3	175.3	-175	179.7	-179	176.7	0	111.6	L712 D713 L714 C719 L720 L755 E758 I759	L712-K716 PolarHBondContact O-N 3.26Å; D713-K716 WeakPolarHBondContact O-CB 3.48Å; D713-K716 PolarHBondContact O-N 2.94Å; L714-K716 PolarHBondContact O-N 3.1Å; K716-C719 PolarHBondContact O-N 3.42Å; K716-L720 WeakPolarHBondContact O-CG 3.41Å; K716-L720 PolarHBondContact O-N 3.02Å; K716-L720 VanDerWaalsContact O-N 3.09Å; K716-L755 HydrophobicContact CD-CD2 3.94Å; K716-E758 WeakPolarHBondContact CE-OE2 3.24Å; K716-E758 IonicContact NZ-OE1 2.66Å; K716-E758 PolarHBondContact NZ-OE1 3.13Å; K716-E758 IonicContact NZ-OE2 2.73Å; K716-E758 PolarHBondContact NZ-OE2 3.46Å; K716-I759 HydrophobicContact CB-CD1 4.24Å; K716-I759 HydrophobicContact CB-CG1 3.95Å; K716-I759 HydrophobicContact CG-CG1 4.5Å
717	R	92.6	Very high	90.1	Very high	125 Å²	125	41.8 Å²	41.8	47%	0.472	22%	0.215	S	C	.	.	H	α-helix	trans	-61.7	-45.2	176	-66.7	167.1	-167.8	-144.2	9.8	111.7	V619 D713 L714 V715 C719 L720 L721	V619-R717 HydrophobicContact CG1-CB 4.41Å; D713-R717 VanDerWaalsContact O-CG 3.26Å; D713-R717 WeakPolarHBondContact O-CG 3.39Å; D713-R717 PolarHBondContact O-N 3.24Å; D713-R717 IonicContact OD1-CZ 2.74Å; D713-R717 IonicContact OD1-NE 2.67Å; D713-R717 PolarHBondContact OD1-NE 3.38Å; D713-R717 IonicContact OD1-NH2 3.77Å; D713-R717 IonicContact OD2-CZ 2.69Å; D713-R717 IonicContact OD2-NE 2.67Å; D713-R717 PolarHBondContact OD2-NE 2.81Å; D713-R717 IonicContact OD2-NH2 2.97Å; D713-R717 PolarHBondContact OD2-NH2 3.43Å; L714-R717 PolarHBondContact O-N 3.5Å; V715-R717 PolarHBondContact O-N 3.29Å; R717-C719 VanDerWaalsContact C-N 3.34Å; R717-C719 PolarHBondContact O-N 3.46Å; R717-L720 PolarHBondContact O-N 3.23Å; R717-L721 WeakPolarHBondContact O-CB 3.39Å; R717-L721 PolarHBondContact O-N 3.1Å
718	C	92.9	Very high	90.1	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.014	22%	0.216	C	C	.	.	H	α-helix	trans	-61.5	-38.9	174.6	-70.8	0	0	0	0	112.5	I633 L714 V715 L720 L721 Y722 F732	I633-C718 HydrophobicContact CD1-CB 3.9Å; L714-C718 WeakPolarHBondContact O-CB 3.27Å; L714-C718 PolarHBondContact O-N 2.98Å; L714-C718 PolarHBondContact O-SG 2.94Å; V715-C718 PolarHBondContact O-N 3.21Å; C718-L720 VanDerWaalsContact C-N 3.34Å; C718-L720 PolarHBondContact O-N 3.42Å; C718-L721 PolarHBondContact O-N 3.18Å; C718-Y722 HydrophobicContact CB-CD2 4.24Å; C718-Y722 HydrophobicContact CB-CE2 4.4Å; C718-Y722 WeakPolarHBondContact O-CB 3.41Å; C718-Y722 WeakPolarHBondContact O-CD2 3.29Å; C718-Y722 PolarHBondContact O-N 2.97Å; C718-F732 HydrophobicContact CB-CE1 4.31Å; C718-F732 HydrophobicContact CB-CZ 4.05Å
719	C	91.4	Very high	90	Very high	4 Å²	4	42.9 Å²	42.9	3%	0.027	22%	0.221	C	C	.	.	H	α-helix	trans	-63.8	-38	175.8	-70.3	0	0	0	0	112.4	V715 K716 R717 K723 F728 F732	V715-C719 PolarHBondContact O-N 3.1Å; V715-C719 PolarHBondContact O-SG 2.93Å; K716-C719 PolarHBondContact O-N 3.42Å; R717-C719 VanDerWaalsContact C-N 3.34Å; R717-C719 PolarHBondContact O-N 3.46Å; C719-K723 PolarHBondContact O-N 2.73Å; C719-F728 HydrophobicContact CB-CZ 4.41Å; C719-F728 WeakPolarHBondContact O-CE2 3.45Å; C719-F732 VanDerWaalsContact SG-CD1 3.56Å; C719-F732 WeakPolarHBondContact SG-CE1 3.44Å
720	L	90.2	Very high	89.8	Confident	117 Å²	117	49 Å²	49	61%	0.613	25%	0.249	S	C	*	.	H	α-helix	trans	-71.9	-42.6	175.9	-67.2	172.9	0	0	0	112	K716 R717 C718	K716-L720 WeakPolarHBondContact O-CG 3.41Å; K716-L720 PolarHBondContact O-N 3.02Å; K716-L720 VanDerWaalsContact O-N 3.09Å; R717-L720 PolarHBondContact O-N 3.23Å; C718-L720 VanDerWaalsContact C-N 3.34Å; C718-L720 PolarHBondContact O-N 3.42Å
721	L	90.8	Very high	89.7	Confident	26 Å²	26	49 Å²	49	14%	0.136	25%	0.248	C	C	.	.	H	α-helix	trans	-67.2	-44.9	-177.3	-169.9	158.7	0	0	0	112	V622 R717 C718	V622-L721 HydrophobicContact CG1-CD1 4.05Å; V622-L721 HydrophobicContact CG1-CD2 3.83Å; R717-L721 WeakPolarHBondContact O-CB 3.39Å; R717-L721 PolarHBondContact O-N 3.1Å; C718-L721 PolarHBondContact O-N 3.18Å
722	Y	91.2	Very high	89.6	Confident	3 Å²	3	49 Å²	49	1%	0.012	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	5.8	-175.9	-64.7	-50.1	0	0	0	114.9	V622 R627 F628 L629 I633 C718 D724 L725 F728 F732	V622-Y722 HydrophobicContact CG1-CE1 4.32Å; R627-Y722 WeakPolarHBondContact O-CE1 3.29Å; R627-Y722 PolarHBondContact O-OH 3.39Å; F628-Y722 HydrophobicContact CB-CE1 4.27Å; F628-Y722 HydrophobicContact CD2-CD1 4.16Å; F628-Y722 HydrophobicContact CD2-CD2 4.42Å; F628-Y722 AromaticContact CD2-CE1 3.92Å; F628-Y722 HydrophobicContact CD2-CE1 3.92Å; F628-Y722 HydrophobicContact CD2-CE2 4.19Å; F628-Y722 HydrophobicContact CD2-CG 4.41Å; F628-Y722 AromaticContact CD2-CZ 3.91Å; F628-Y722 HydrophobicContact CE2-CE2 4.48Å; L629-Y722 PolarHBondContact N-OH 3.35Å; L629-Y722 VanDerWaalsContact N-OH 3.1Å; I633-Y722 HydrophobicContact CD1-CD2 4.25Å; I633-Y722 HydrophobicContact CD1-CE2 3.99Å; I633-Y722 HydrophobicContact CG1-CE2 4.35Å; C718-Y722 HydrophobicContact CB-CD2 4.24Å; C718-Y722 HydrophobicContact CB-CE2 4.4Å; C718-Y722 WeakPolarHBondContact O-CB 3.41Å; C718-Y722 WeakPolarHBondContact O-CD2 3.29Å; C718-Y722 PolarHBondContact O-N 2.97Å; Y722-D724 PolarHBondContact O-N 2.84Å; Y722-L725 HydrophobicContact CD1-CD1 3.64Å; Y722-L725 HydrophobicContact CD1-CG 4.25Å; Y722-L725 HydrophobicContact CE1-CD1 4.47Å; Y722-L725 HydrophobicContact CG-CD1 3.99Å; Y722-L725 WeakPolarHBondContact O-CB 3.44Å; Y722-L725 WeakPolarHBondContact O-CG 3.49Å; Y722-L725 PolarHBondContact O-N 2.73Å; Y722-F728 VanDerWaalsContact O-CD2 3.26Å; Y722-F728 WeakPolarHBondContact O-CD2 3.37Å; Y722-F732 HydrophobicContact CD2-CE2 4.37Å; Y722-F732 HydrophobicContact CD2-CZ 4.17Å
723	K	87.6	Confident	89.5	Confident	123 Å²	123	53.5 Å²	53.5	54%	0.535	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-30.5	-178.9	-173.3	176	179.9	176.4	0	113.7	C719 L725	C719-K723 PolarHBondContact O-N 2.73Å; K723-L725 VanDerWaalsContact C-N 3.29Å; K723-L725 PolarHBondContact O-N 3.01Å
724	D	85.5	Confident	89.3	Confident	115 Å²	115	54.3 Å²	54.3	62%	0.615	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-7.3	-178.5	-54.9	-33.6	0	0	0	113.6	K626 Y722	K626-D724 IonicContact NZ-OD2 3.86Å; K626-D724 PolarHBondContact NZ-OD2 3.17Å; Y722-D724 PolarHBondContact O-N 2.84Å
725	L	86.9	Confident	89	Confident	55 Å²	55	54.2 Å²	54.2	29%	0.288	28%	0.276	S	S	.	.			trans	-78.1	130.1	-178.1	-62.8	-173.8	0	0	0	112.3	F628 Y722 K723 S727 F728 I731	F628-L725 HydrophobicContact CB-CD1 4.04Å; F628-L725 HydrophobicContact CD2-CD1 3.78Å; F628-L725 HydrophobicContact CG-CD1 4.09Å; Y722-L725 HydrophobicContact CD1-CD1 3.64Å; Y722-L725 HydrophobicContact CD1-CG 4.25Å; Y722-L725 HydrophobicContact CE1-CD1 4.47Å; Y722-L725 HydrophobicContact CG-CD1 3.99Å; Y722-L725 WeakPolarHBondContact O-CB 3.44Å; Y722-L725 WeakPolarHBondContact O-CG 3.49Å; Y722-L725 PolarHBondContact O-N 2.73Å; K723-L725 VanDerWaalsContact C-N 3.29Å; K723-L725 PolarHBondContact O-N 3.01Å; L725-S727 PolarHBondContact O-N 2.78Å; L725-S727 VanDerWaalsContact O-N 3.14Å; L725-F728 HydrophobicContact CB-CB 4.38Å; L725-F728 WeakPolarHBondContact O-CB 3.29Å; L725-F728 PolarHBondContact O-N 2.85Å; L725-I731 HydrophobicContact CD1-CD1 4.23Å
726	T	85.3	Confident	88.8	Confident	95 Å²	95	58.8 Å²	58.8	58%	0.583	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-29.6	175	51.4	0	0	0	0	113.9
727	S	86.3	Confident	88.5	Confident	64 Å²	64	57.5 Å²	57.5	45%	0.448	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	2.3	178.4	-59.8	0	0	0	0	114.4	L725 T729 H730 I731	L725-S727 PolarHBondContact O-N 2.78Å; L725-S727 VanDerWaalsContact O-N 3.14Å; S727-T729 VanDerWaalsContact C-N 3.29Å; S727-T729 PolarHBondContact O-N 3.29Å; S727-T729 VanDerWaalsContact O-N 3.17Å; S727-H730 PolarHBondContact O-N 3.41Å; S727-I731 WeakPolarHBondContact O-CG1 3.34Å; S727-I731 PolarHBondContact O-N 2.96Å; S727-I731 VanDerWaalsContact O-N 3.09Å
728	F	88.9	Confident	88	Confident	7 Å²	7	51.6 Å²	51.6	3%	0.031	27%	0.268	C	S	.	.	H	α-helix	trans	-48.2	-47.5	-172.9	174.2	-92.3	0	0	0	113.5	C719 Y722 L725 H730 I731 F732 I763 A766	C719-F728 HydrophobicContact CB-CZ 4.41Å; C719-F728 WeakPolarHBondContact O-CE2 3.45Å; Y722-F728 VanDerWaalsContact O-CD2 3.26Å; Y722-F728 WeakPolarHBondContact O-CD2 3.37Å; L725-F728 HydrophobicContact CB-CB 4.38Å; L725-F728 WeakPolarHBondContact O-CB 3.29Å; L725-F728 PolarHBondContact O-N 2.85Å; F728-H730 VanDerWaalsContact C-N 3.29Å; F728-H730 PolarHBondContact O-N 3.29Å; F728-I731 PolarHBondContact O-N 3.18Å; F728-F732 AromaticContact CD2-CD2 3.51Å; F728-F732 HydrophobicContact CD2-CD2 3.51Å; F728-F732 AromaticContact CD2-CE2 3.55Å; F728-F732 HydrophobicContact CD2-CE2 3.55Å; F728-F732 HydrophobicContact CE1-CD2 4.43Å; F728-F732 AromaticContact CE2-CD2 3.4Å; F728-F732 HydrophobicContact CE2-CD2 3.4Å; F728-F732 VanDerWaalsContact CE2-CD2 3.4Å; F728-F732 AromaticContact CE2-CE2 3.41Å; F728-F732 HydrophobicContact CE2-CE2 3.41Å; F728-F732 VanDerWaalsContact CE2-CE2 3.41Å; F728-F732 HydrophobicContact CE2-CG 4.24Å; F728-F732 HydrophobicContact CE2-CZ 4.24Å; F728-F732 HydrophobicContact CG-CD2 4.11Å; F728-F732 AromaticContact CZ-CD2 3.9Å; F728-F732 HydrophobicContact CZ-CD2 3.9Å; F728-F732 HydrophobicContact CZ-CE2 4.28Å; F728-F732 HydrophobicContact CZ-CG 4.35Å; F728-F732 WeakPolarHBondContact O-CD2 3.25Å; F728-F732 PolarHBondContact O-N 3.47Å; F728-I763 HydrophobicContact CZ-CG1 4.49Å; F728-A766 HydrophobicContact CD1-CB 3.47Å; F728-A766 VanDerWaalsContact CD1-CB 3.47Å; F728-A766 HydrophobicContact CE1-CB 3.45Å; F728-A766 VanDerWaalsContact CE1-CB 3.45Å
729	T	86.8	Confident	87.6	Confident	28 Å²	28	51.6 Å²	51.6	17%	0.172	27%	0.267	C	S	.	.	H	α-helix	trans	-61.3	-36.1	-177.4	54	0	0	0	0	112.6	S727 Q733 A766 V768	S727-T729 VanDerWaalsContact C-N 3.29Å; S727-T729 PolarHBondContact O-N 3.29Å; S727-T729 VanDerWaalsContact O-N 3.17Å; T729-Q733 WeakPolarHBondContact O-CB 3.3Å; T729-Q733 PolarHBondContact O-N 3.25Å; T729-A766 HydrophobicContact CG2-CB 4.32Å; T729-V768 HydrophobicContact CG2-CG1 4.33Å; T729-V768 HydrophobicContact CG2-CG2 4.16Å
730	H	86.3	Confident	87.2	Confident	130 Å²	130	54.6 Å²	54.6	60%	0.602	29%	0.289	S	S	*	.	H	α-helix	trans	-76.5	-38.2	176.8	-67.3	-77.9	0	0	0	112	S727 F728	S727-H730 PolarHBondContact O-N 3.41Å; F728-H730 VanDerWaalsContact C-N 3.29Å; F728-H730 PolarHBondContact O-N 3.29Å
731	I	89.3	Confident	86.7	Confident	37 Å²	37	56 Å²	56	19%	0.19	29%	0.29	C	S	.	.	H	α-helix	trans	-64.3	-43.5	179.6	-67.6	162.1	0	0	0	111.3	F628 I633 L725 S727 F728 P734	F628-I731 HydrophobicContact CD2-CD1 4.28Å; F628-I731 HydrophobicContact CE1-CD1 4.28Å; F628-I731 HydrophobicContact CE2-CD1 3.79Å; F628-I731 HydrophobicContact CE2-CG1 4.37Å; F628-I731 HydrophobicContact CE2-CG2 3.81Å; F628-I731 HydrophobicContact CZ-CD1 3.79Å; F628-I731 HydrophobicContact CZ-CG1 4.06Å; F628-I731 HydrophobicContact CZ-CG2 3.9Å; I633-I731 HydrophobicContact CG1-CG2 4.41Å; I633-I731 HydrophobicContact CG2-CG2 4.04Å; L725-I731 HydrophobicContact CD1-CD1 4.23Å; S727-I731 WeakPolarHBondContact O-CG1 3.34Å; S727-I731 PolarHBondContact O-N 2.96Å; S727-I731 VanDerWaalsContact O-N 3.09Å; F728-I731 PolarHBondContact O-N 3.18Å; I731-P734 WeakPolarHBondContact O-CD 2.98Å
732	F	89.8	Confident	85.9	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-91.2	-3.9	-177.2	-73.8	-85.8	0	0	0	114.5	I633 C718 C719 Y722 F728 I735 R736 I763	I633-F732 HydrophobicContact CD1-CE1 4.2Å; I633-F732 HydrophobicContact CD1-CZ 3.93Å; C718-F732 HydrophobicContact CB-CE1 4.31Å; C718-F732 HydrophobicContact CB-CZ 4.05Å; C719-F732 VanDerWaalsContact SG-CD1 3.56Å; C719-F732 WeakPolarHBondContact SG-CE1 3.44Å; Y722-F732 HydrophobicContact CD2-CE2 4.37Å; Y722-F732 HydrophobicContact CD2-CZ 4.17Å; F728-F732 AromaticContact CD2-CD2 3.51Å; F728-F732 HydrophobicContact CD2-CD2 3.51Å; F728-F732 AromaticContact CD2-CE2 3.55Å; F728-F732 HydrophobicContact CD2-CE2 3.55Å; F728-F732 HydrophobicContact CE1-CD2 4.43Å; F728-F732 AromaticContact CE2-CD2 3.4Å; F728-F732 HydrophobicContact CE2-CD2 3.4Å; F728-F732 VanDerWaalsContact CE2-CD2 3.4Å; F728-F732 AromaticContact CE2-CE2 3.41Å; F728-F732 HydrophobicContact CE2-CE2 3.41Å; F728-F732 VanDerWaalsContact CE2-CE2 3.41Å; F728-F732 HydrophobicContact CE2-CG 4.24Å; F728-F732 HydrophobicContact CE2-CZ 4.24Å; F728-F732 HydrophobicContact CG-CD2 4.11Å; F728-F732 AromaticContact CZ-CD2 3.9Å; F728-F732 HydrophobicContact CZ-CD2 3.9Å; F728-F732 HydrophobicContact CZ-CE2 4.28Å; F728-F732 HydrophobicContact CZ-CG 4.35Å; F728-F732 WeakPolarHBondContact O-CD2 3.25Å; F728-F732 PolarHBondContact O-N 3.47Å; F732-I735 HydrophobicContact CD1-CD1 4.05Å; F732-I735 HydrophobicContact CE1-CD1 4.33Å; F732-I735 PolarHBondContact O-N 2.97Å; F732-R736 WeakPolarHBondContact O-CB 2.98Å; F732-R736 PolarHBondContact O-N 3.36Å; F732-I763 HydrophobicContact CB-CD1 4.03Å; F732-I763 HydrophobicContact CB-CG1 4Å; F732-I763 HydrophobicContact CB-CG2 3.97Å; F732-I763 HydrophobicContact CD1-CD1 4.29Å; F732-I763 HydrophobicContact CD1-CG1 4.49Å; F732-I763 HydrophobicContact CG-CG1 4.42Å
733	Q	87.9	Confident	85	Confident	94 Å²	94	56.8 Å²	56.8	44%	0.439	29%	0.293	S	S	.	.	H	α-helix	trans	-60	-37.9	178	-173.8	66.5	-4.5	0	0	114.5	T729 T737	T729-Q733 WeakPolarHBondContact O-CB 3.3Å; T729-Q733 PolarHBondContact O-N 3.25Å; Q733-T737 WeakPolarHBondContact O-CB 3.14Å; Q733-T737 PolarHBondContact O-N 3.1Å; Q733-T737 PolarHBondContact O-OG1 2.93Å
734	P	87.1	Confident	84.1	Confident	56 Å²	56	52.8 Å²	52.8	36%	0.364	28%	0.281	S	S	.	.	H	α-helix	trans	-63.4	-45.7	174.5	-22.2	34.6	0	0	0	111.9	I731 T737 L738	I731-P734 WeakPolarHBondContact O-CD 2.98Å; P734-T737 WeakPolarHBondContact O-CB 3.38Å; P734-T737 PolarHBondContact O-N 3.48Å; P734-T737 VanDerWaalsContact O-N 3.11Å; P734-L738 PolarHBondContact O-N 3.39Å
735	I	87.9	Confident	83.2	Confident	1 Å²	1	50 Å²	50	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-61.8	-46.5	177.3	-67.5	172.8	0	0	0	110.4	I633 L640 V715 F732 T737 L738 L739 I763	I633-I735 HydrophobicContact CG2-CD1 3.99Å; L640-I735 HydrophobicContact CD1-CG2 3.95Å; V715-I735 HydrophobicContact CG1-CG2 3.99Å; F732-I735 HydrophobicContact CD1-CD1 4.05Å; F732-I735 HydrophobicContact CE1-CD1 4.33Å; F732-I735 PolarHBondContact O-N 2.97Å; I735-T737 VanDerWaalsContact C-N 3.26Å; I735-T737 PolarHBondContact O-N 3.37Å; I735-L738 PolarHBondContact O-N 3.17Å; I735-L739 HydrophobicContact CG2-CD1 3.83Å; I735-L739 HydrophobicContact CG2-CG 4.33Å; I735-L739 WeakPolarHBondContact O-CG 3.46Å; I735-L739 PolarHBondContact O-N 3.39Å; I735-I763 HydrophobicContact CG2-CD1 4.47Å
736	R	87.9	Confident	82.2	Confident	97 Å²	97	53.9 Å²	53.9	37%	0.366	29%	0.287	S	S	.	.	H	α-helix	trans	-56.5	-40.4	173	-176.8	-179.9	-179.6	168.2	3	111.9	F732 S740 L760 I763	F732-R736 WeakPolarHBondContact O-CB 2.98Å; F732-R736 PolarHBondContact O-N 3.36Å; R736-S740 VanDerWaalsContact O-CB 3.27Å; R736-S740 WeakPolarHBondContact O-CB 3.43Å; R736-S740 PolarHBondContact O-N 2.92Å; R736-S740 PolarHBondContact O-OG 3.18Å; R736-L760 HydrophobicContact CG-CD2 4Å; R736-I763 HydrophobicContact CB-CD1 4.4Å; R736-I763 HydrophobicContact CB-CG2 4.19Å; R736-I763 HydrophobicContact CG-CG2 4.5Å
737	T	85.8	Confident	81.3	Confident	28 Å²	28	53.1 Å²	53.1	17%	0.172	28%	0.277	C	S	.	.	H	α-helix	trans	-67.6	-44.7	179.5	-56.8	0	0	0	0	111.2	Q733 P734 I735 K741	Q733-T737 WeakPolarHBondContact O-CB 3.14Å; Q733-T737 PolarHBondContact O-N 3.1Å; Q733-T737 PolarHBondContact O-OG1 2.93Å; P734-T737 WeakPolarHBondContact O-CB 3.38Å; P734-T737 PolarHBondContact O-N 3.48Å; P734-T737 VanDerWaalsContact O-N 3.11Å; I735-T737 VanDerWaalsContact C-N 3.26Å; I735-T737 PolarHBondContact O-N 3.37Å; T737-K741 HydrophobicContact CG2-CD 3.86Å; T737-K741 WeakPolarHBondContact O-CB 3.5Å; T737-K741 PolarHBondContact O-N 3.02Å; T737-K741 VanDerWaalsContact O-N 3.07Å
738	L	83.5	Confident	80.7	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-58.7	-51.7	174.4	-73.8	169.4	0	0	0	111.9	S637 L640 V644 P734 I735 H742 L743	S637-L738 WeakPolarHBondContact OG-CD1 3.4Å; L640-L738 HydrophobicContact CB-CD1 4.38Å; V644-L738 HydrophobicContact CG2-CD2 4.26Å; P734-L738 PolarHBondContact O-N 3.39Å; I735-L738 PolarHBondContact O-N 3.17Å; L738-H742 WeakPolarHBondContact O-CA 3.24Å; L738-H742 PolarHBondContact O-N 2.8Å; L738-L743 PolarHBondContact O-N 3.12Å
739	L	83.8	Confident	80.3	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-67.2	-36.6	-178.1	-65.4	176.3	0	0	0	113.2	L640 L712 I735 L743 H756 I759 L760	L640-L739 HydrophobicContact CD1-CD2 4.22Å; L640-L739 HydrophobicContact CD1-CG 4.47Å; L640-L739 HydrophobicContact CD2-CD2 4.29Å; L712-L739 HydrophobicContact CD2-CD2 3.87Å; I735-L739 HydrophobicContact CG2-CD1 3.83Å; I735-L739 HydrophobicContact CG2-CG 4.33Å; I735-L739 WeakPolarHBondContact O-CG 3.46Å; I735-L739 PolarHBondContact O-N 3.39Å; L739-L743 HydrophobicContact CD2-CB 4.26Å; L739-L743 HydrophobicContact CD2-CD2 4.35Å; L739-L743 CarbonylContact O-C 3.51Å; L739-H756 PolarHBondContact O-CE1 3.22Å; L739-H756 PolarHBondContact O-NE2 2.73Å; L739-I759 HydrophobicContact CD1-CB 4.46Å; L739-I759 HydrophobicContact CD1-CG2 3.67Å; L739-L760 HydrophobicContact CB-CD2 4.01Å; L739-L760 HydrophobicContact CB-CG 4.45Å
740	S	83.3	Confident	79.8	Confident	68 Å²	68	53 Å²	53	48%	0.476	28%	0.277	S	S	.	.	H	α-helix	trans	-83.8	-25.6	-177.2	58.8	0	0	0	0	115	R736	R736-S740 VanDerWaalsContact O-CB 3.27Å; R736-S740 WeakPolarHBondContact O-CB 3.43Å; R736-S740 PolarHBondContact O-N 2.92Å; R736-S740 PolarHBondContact O-OG 3.18Å
741	K	78.1	Confident	79.5	Confident	146 Å²	146	49.2 Å²	49.2	64%	0.635	26%	0.264	S	S	*	.	H	α-helix	trans	-109.2	-32.4	-176.9	-63.5	-177	-174.8	175.5	0	115	T737	T737-K741 HydrophobicContact CG2-CD 3.86Å; T737-K741 WeakPolarHBondContact O-CB 3.5Å; T737-K741 PolarHBondContact O-N 3.02Å; T737-K741 VanDerWaalsContact O-N 3.07Å
742	H	74	Confident	79.1	Confident	34 Å²	34	47.5 Å²	47.5	16%	0.157	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.3	-43.6	-167.8	-55.2	-75.9	0	0	0	112.3	V644 S649 L738 S744	V644-H742 HydrophobicContact CG1-CB 3.89Å; V644-H742 HydrophobicContact CG2-CB 3.81Å; S649-H742 VanDerWaalsContact C-CE1 3.5Å; S649-H742 PolarHBondContact O-CE1 2.77Å; S649-H742 PolarHBondContact OG-CE1 3.47Å; S649-H742 VanDerWaalsContact OG-CE1 3.23Å; S649-H742 PolarHBondContact OG-ND1 3.15Å; L738-H742 WeakPolarHBondContact O-CA 3.24Å; L738-H742 PolarHBondContact O-N 2.8Å; H742-S744 VanDerWaalsContact C-N 3.35Å; H742-S744 PolarHBondContact O-N 3.4Å
743	L	73.9	Confident	78.7	Confident	12 Å²	12	51.1 Å²	51.1	6%	0.063	27%	0.272	C	S	.	.	S	Bend	trans	-91.9	64.7	173.5	-116	72.5	0	0	0	111.2	L640 A643 V644 L708 L738 L739 H756	L640-L743 HydrophobicContact CD2-CD2 4.2Å; A643-L743 HydrophobicContact CB-CD1 4Å; A643-L743 HydrophobicContact CB-CD2 4.36Å; V644-L743 HydrophobicContact CG2-CD1 3.72Å; L708-L743 HydrophobicContact CD1-CD2 3.99Å; L708-L743 HydrophobicContact CD2-CD2 4.27Å; L738-L743 PolarHBondContact O-N 3.12Å; L739-L743 HydrophobicContact CD2-CB 4.26Å; L739-L743 HydrophobicContact CD2-CD2 4.35Å; L739-L743 CarbonylContact O-C 3.51Å; L743-H756 PolarHBondContact O-CD2 3.14Å; L743-H756 PolarHBondContact O-NE2 3.06Å
744	S	68.4	Low	78.6	Confident	39 Å²	39	52.8 Å²	52.8	27%	0.273	28%	0.28	S	S	.	.			trans	-69.8	143.6	-178.2	66	0	0	0	0	113	H742 H746 M747	H742-S744 VanDerWaalsContact C-N 3.35Å; H742-S744 PolarHBondContact O-N 3.4Å; S744-H746 VanDerWaalsContact C-N 3.27Å; S744-H746 PolarHBondContact O-N 2.84Å; S744-H746 VanDerWaalsContact O-N 3.13Å; S744-H746 PolarHBondContact OG-CE1 3.44Å; S744-H746 PolarHBondContact OG-ND1 3.37Å; S744-M747 PolarHBondContact O-N 3.09Å; S744-M747 VanDerWaalsContact O-N 3.09Å
745	S	66.3	Low	78.4	Confident	57 Å²	57	51 Å²	51	40%	0.399	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-59	-30.7	-168.3	53.4	0	0	0	0	114.9	M747 L748 Q753	S745-M747 PolarHBondContact O-N 3.25Å; S745-L748 PolarHBondContact O-N 3.3Å; S745-Q753 WeakPolarHBondContact O-CG 3.41Å; S745-Q753 PolarHBondContact O-NE2 3.01Å; S745-Q753 VanDerWaalsContact O-NE2 3.17Å
746	H	65.9	Low	78.3	Confident	136 Å²	136	51.6 Å²	51.6	63%	0.63	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-69.7	-10.8	-179.8	72	-91.3	0	0	0	114.3	S744	S744-H746 VanDerWaalsContact C-N 3.27Å; S744-H746 PolarHBondContact O-N 2.84Å; S744-H746 VanDerWaalsContact O-N 3.13Å; S744-H746 PolarHBondContact OG-CE1 3.44Å; S744-H746 PolarHBondContact OG-ND1 3.37Å
747	M	67.1	Low	78.2	Confident	78 Å²	78	49.6 Å²	49.6	38%	0.384	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-90.5	-2.7	171.2	-69.5	-75.1	100.9	0	0	113.2	S744 S745	S744-M747 PolarHBondContact O-N 3.09Å; S744-M747 VanDerWaalsContact O-N 3.09Å; S745-M747 PolarHBondContact O-N 3.25Å
748	L	73.4	Confident	78.3	Confident	11 Å²	11	52 Å²	52	6%	0.058	28%	0.28	C	S	.	.	S	Bend	trans	-112.9	142.1	-174.1	-63.1	172.7	0	0	0	111.8	L708 S745 L752 Q753 H756	L708-L748 HydrophobicContact CD2-CD2 3.68Å; S745-L748 PolarHBondContact O-N 3.3Å; L748-L752 HydrophobicContact CB-CB 4.1Å; L748-Q753 HydrophobicContact CB-CG 4.17Å; L748-Q753 PolarHBondContact O-NE2 3.48Å; L748-H756 HydrophobicContact CD1-CB 4.32Å
749	P	80.1	Confident	78.5	Confident	9 Å²	9	51.9 Å²	51.9	6%	0.058	28%	0.28	C	S	.	.			trans	-54.3	150.7	164.7	-24.6	31.9	0	0	0	112.9	C676 W679 L705 P751 L752 Q753	C676-P749 HydrophobicContact CB-CG 4Å; W679-P749 HydrophobicContact CD2-CB 4.48Å; W679-P749 HydrophobicContact CD2-CG 4.24Å; W679-P749 HydrophobicContact CE3-CB 3.49Å; W679-P749 VanDerWaalsContact CE3-CB 3.49Å; W679-P749 HydrophobicContact CE3-CG 3.69Å; W679-P749 HydrophobicContact CZ3-CB 3.87Å; W679-P749 HydrophobicContact CZ3-CG 4.27Å; L705-P749 HydrophobicContact CD1-CG 4.04Å; L705-P749 HydrophobicContact CD2-CG 4.02Å; P749-P751 VanDerWaalsContact C-CD 3.48Å; P749-L752 HydrophobicContact CB-CD1 4.48Å; P749-L752 HydrophobicContact CG-CD1 4.15Å; P749-L752 WeakPolarHBondContact O-CA 3.23Å; P749-L752 WeakPolarHBondContact O-CB 3.2Å; P749-L752 PolarHBondContact O-N 2.99Å; P749-Q753 PolarHBondContact O-N 3.15Å; P749-Q753 VanDerWaalsContact O-N 3.12Å
750	S	77.2	Confident	78.7	Confident	77 Å²	77	53.7 Å²	53.7	54%	0.538	29%	0.289	S	S	.	.	H	α-helix	trans	-54.9	-39.5	-173.7	46.1	0	0	0	0	116	L752 Q753 E754	S750-L752 PolarHBondContact O-N 2.77Å; S750-L752 VanDerWaalsContact O-N 3.15Å; S750-Q753 WeakPolarHBondContact O-CB 3.31Å; S750-Q753 PolarHBondContact O-N 3.12Å; S750-E754 PolarHBondContact O-N 3.15Å
751	P	79.1	Confident	78.9	Confident	51 Å²	51	57 Å²	57	33%	0.331	30%	0.297	S	S	.	.	H	α-helix	trans	-66	-18.9	176.4	-19.1	33	0	0	0	113.6	W679 P749	W679-P751 HydrophobicContact CZ3-CB 4.23Å; W679-P751 HydrophobicContact CZ3-CG 4.12Å; P749-P751 VanDerWaalsContact C-CD 3.48Å
752	L	80.1	Confident	79.3	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-91	-24.3	175.6	-64.3	170.6	0	0	0	111.8	W679 L705 L712 L748 P749 S750 L755 H756	W679-L752 HydrophobicContact CE3-CD1 4.45Å; W679-L752 HydrophobicContact CH2-CD1 3.67Å; W679-L752 HydrophobicContact CH2-CD2 4.1Å; W679-L752 HydrophobicContact CH2-CG 3.74Å; W679-L752 HydrophobicContact CZ2-CD1 4.21Å; W679-L752 HydrophobicContact CZ3-CD1 3.82Å; W679-L752 HydrophobicContact CZ3-CG 3.88Å; L705-L752 HydrophobicContact CD2-CD1 4.16Å; L712-L752 HydrophobicContact CD1-CD2 4.13Å; L748-L752 HydrophobicContact CB-CB 4.1Å; P749-L752 HydrophobicContact CB-CD1 4.48Å; P749-L752 HydrophobicContact CG-CD1 4.15Å; P749-L752 WeakPolarHBondContact O-CA 3.23Å; P749-L752 WeakPolarHBondContact O-CB 3.2Å; P749-L752 PolarHBondContact O-N 2.99Å; S750-L752 PolarHBondContact O-N 2.77Å; S750-L752 VanDerWaalsContact O-N 3.15Å; L752-L755 HydrophobicContact CD2-CD1 4.27Å; L752-H756 WeakPolarHBondContact O-CB 3.33Å; L752-H756 PolarHBondContact O-N 3.33Å
753	Q	83.1	Confident	79.9	Confident	76 Å²	76	50.2 Å²	50.2	36%	0.355	27%	0.273	S	S	.	.	H	α-helix	trans	-66.6	-41.5	169.7	-61	178.7	8.1	0	0	111.4	S745 L748 P749 S750 H756 S757	S745-Q753 WeakPolarHBondContact O-CG 3.41Å; S745-Q753 PolarHBondContact O-NE2 3.01Å; S745-Q753 VanDerWaalsContact O-NE2 3.17Å; L748-Q753 HydrophobicContact CB-CG 4.17Å; L748-Q753 PolarHBondContact O-NE2 3.48Å; P749-Q753 PolarHBondContact O-N 3.15Å; P749-Q753 VanDerWaalsContact O-N 3.12Å; S750-Q753 WeakPolarHBondContact O-CB 3.31Å; S750-Q753 PolarHBondContact O-N 3.12Å; Q753-H756 PolarHBondContact O-N 2.73Å; Q753-S757 PolarHBondContact O-N 3.42Å; Q753-S757 PolarHBondContact O-OG 3.29Å
754	E	84.3	Confident	80.4	Confident	130 Å²	130	52.9 Å²	52.9	61%	0.607	29%	0.293	S	S	*	.	H	α-helix	trans	-58.9	-58.4	174.4	-68.4	172.3	-175.3	0	0	110.6	S750 H756 S757 E758	S750-E754 PolarHBondContact O-N 3.15Å; E754-H756 VanDerWaalsContact C-N 3.27Å; E754-H756 PolarHBondContact O-N 3.14Å; E754-S757 PolarHBondContact O-N 3.44Å; E754-S757 VanDerWaalsContact O-N 3.08Å; E754-S757 PolarHBondContact O-OG 3.23Å; E754-E758 PolarHBondContact O-N 3Å
755	L	82.9	Confident	81	Confident	19 Å²	19	54.7 Å²	54.7	10%	0.099	31%	0.305	C	S	.	.	H	α-helix	trans	-55.9	-39.2	177.7	-72.4	169.1	0	0	0	113.1	K716 L752 I759	K716-L755 HydrophobicContact CD-CD2 3.94Å; L752-L755 HydrophobicContact CD2-CD1 4.27Å; L755-I759 VanDerWaalsContact O-CD1 3.27Å; L755-I759 WeakPolarHBondContact O-CD1 3.44Å; L755-I759 WeakPolarHBondContact O-CG1 3.28Å; L755-I759 PolarHBondContact O-N 3.21Å; L755-I759 VanDerWaalsContact O-N 3.12Å
756	H	86.3	Confident	81.4	Confident	13 Å²	13	52.7 Å²	52.7	6%	0.06	29%	0.292	C	S	.	.	H	α-helix	trans	-61.8	-46.4	176.1	176.7	-78	0	0	0	112.1	L739 L743 L748 L752 Q753 E754 I759 L760	L739-H756 PolarHBondContact O-CE1 3.22Å; L739-H756 PolarHBondContact O-NE2 2.73Å; L743-H756 PolarHBondContact O-CD2 3.14Å; L743-H756 PolarHBondContact O-NE2 3.06Å; L748-H756 HydrophobicContact CD1-CB 4.32Å; L752-H756 WeakPolarHBondContact O-CB 3.33Å; L752-H756 PolarHBondContact O-N 3.33Å; Q753-H756 PolarHBondContact O-N 2.73Å; E754-H756 VanDerWaalsContact C-N 3.27Å; E754-H756 PolarHBondContact O-N 3.14Å; H756-I759 PolarHBondContact O-N 3.5Å; H756-L760 VanDerWaalsContact CE1-CD1 3.41Å; H756-L760 WeakPolarHBondContact CE1-CD1 3.46Å; H756-L760 PolarHBondContact O-N 3.36Å; H756-L760 VanDerWaalsContact O-N 3.09Å
757	S	86.4	Confident	81.4	Confident	54 Å²	54	50.9 Å²	50.9	38%	0.378	30%	0.295	S	S	.	.	H	α-helix	trans	-62.9	-46.2	176.1	63.7	0	0	0	0	112.6	Q753 E754 I759 L760 E761	Q753-S757 PolarHBondContact O-N 3.42Å; Q753-S757 PolarHBondContact O-OG 3.29Å; E754-S757 PolarHBondContact O-N 3.44Å; E754-S757 VanDerWaalsContact O-N 3.08Å; E754-S757 PolarHBondContact O-OG 3.23Å; S757-I759 VanDerWaalsContact C-N 3.29Å; S757-I759 PolarHBondContact O-N 3.39Å; S757-L760 PolarHBondContact O-N 3.38Å; S757-E761 PolarHBondContact O-N 3.35Å
758	E	88.4	Confident	81.3	Confident	78 Å²	78	51 Å²	51	36%	0.364	30%	0.3	S	S	.	.	H	α-helix	trans	-58.7	-39.4	177.9	-70.2	-179.9	110.7	0	0	112.4	K716 E754 A762	K716-E758 WeakPolarHBondContact CE-OE2 3.24Å; K716-E758 IonicContact NZ-OE1 2.66Å; K716-E758 PolarHBondContact NZ-OE1 3.13Å; K716-E758 IonicContact NZ-OE2 2.73Å; K716-E758 PolarHBondContact NZ-OE2 3.46Å; E754-E758 PolarHBondContact O-N 3Å; E758-A762 WeakPolarHBondContact O-CB 3.46Å; E758-A762 PolarHBondContact O-N 3.05Å
759	I	87.5	Confident	80.8	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.005	32%	0.32	C	S	.	.	H	α-helix	trans	-68.5	-43.3	177.9	-68.5	162	0	0	0	110.7	L712 V715 K716 L739 L755 H756 S757 A762 I763	L712-I759 HydrophobicContact CB-CD1 4.15Å; L712-I759 HydrophobicContact CD2-CD1 3.94Å; L712-I759 VanDerWaalsContact O-CD1 3.3Å; L712-I759 WeakPolarHBondContact O-CD1 3.29Å; V715-I759 HydrophobicContact CB-CD1 4.37Å; V715-I759 HydrophobicContact CG1-CD1 4.15Å; V715-I759 HydrophobicContact CG1-CG1 4.45Å; V715-I759 HydrophobicContact CG1-CG2 3.77Å; K716-I759 HydrophobicContact CB-CD1 4.24Å; K716-I759 HydrophobicContact CB-CG1 3.95Å; K716-I759 HydrophobicContact CG-CG1 4.5Å; L739-I759 HydrophobicContact CD1-CB 4.46Å; L739-I759 HydrophobicContact CD1-CG2 3.67Å; L755-I759 VanDerWaalsContact O-CD1 3.27Å; L755-I759 WeakPolarHBondContact O-CD1 3.44Å; L755-I759 WeakPolarHBondContact O-CG1 3.28Å; L755-I759 PolarHBondContact O-N 3.21Å; L755-I759 VanDerWaalsContact O-N 3.12Å; H756-I759 PolarHBondContact O-N 3.5Å; S757-I759 VanDerWaalsContact C-N 3.29Å; S757-I759 PolarHBondContact O-N 3.39Å; I759-A762 PolarHBondContact O-N 2.96Å; I759-I763 HydrophobicContact CG2-CD1 3.74Å; I759-I763 WeakPolarHBondContact O-CD1 3.5Å; I759-I763 VanDerWaalsContact O-CG1 3.26Å; I759-I763 WeakPolarHBondContact O-CG1 3.38Å; I759-I763 PolarHBondContact O-N 3.07Å
760	L	87.6	Confident	79.9	Confident	38 Å²	38	61.2 Å²	61.2	20%	0.199	35%	0.352	C	S	.	.	H	α-helix	trans	-65.2	-41.7	176.5	-74	179.4	0	0	0	111.9	R736 L739 H756 S757 S764	R736-L760 HydrophobicContact CG-CD2 4Å; L739-L760 HydrophobicContact CB-CD2 4.01Å; L739-L760 HydrophobicContact CB-CG 4.45Å; H756-L760 VanDerWaalsContact CE1-CD1 3.41Å; H756-L760 WeakPolarHBondContact CE1-CD1 3.46Å; H756-L760 PolarHBondContact O-N 3.36Å; H756-L760 VanDerWaalsContact O-N 3.09Å; S757-L760 PolarHBondContact O-N 3.38Å; L760-S764 VanDerWaalsContact O-CB 3.26Å; L760-S764 WeakPolarHBondContact O-CB 3.43Å; L760-S764 PolarHBondContact O-N 3.21Å; L760-S764 PolarHBondContact O-OG 3.22Å
761	E	87.8	Confident	79.5	Confident	138 Å²	138	62.5 Å²	62.5	65%	0.645	36%	0.357	S	S	*	.	H	α-helix	trans	-61	-51.8	172.9	-75.5	-170.6	179.2	0	0	111	S757 I763 S764 S765	S757-E761 PolarHBondContact O-N 3.35Å; E761-I763 PolarHBondContact O-N 3.4Å; E761-S764 WeakPolarHBondContact CA-OG 3.32Å; E761-S764 CarbonylContact O-C 3.54Å; E761-S764 PolarHBondContact O-N 3.04Å; E761-S764 PolarHBondContact O-OG 3.22Å; E761-S765 WeakPolarHBondContact O-CB 3.22Å; E761-S765 PolarHBondContact O-N 3.18Å
762	A	86.1	Confident	79.5	Confident	32 Å²	32	70.9 Å²	70.9	26%	0.264	38%	0.381	S	S	.	.	H	α-helix	trans	-54.3	-49.4	178.9	0	0	0	0	0	112.3	E758 I759 S764 S765	E758-A762 WeakPolarHBondContact O-CB 3.46Å; E758-A762 PolarHBondContact O-N 3.05Å; I759-A762 PolarHBondContact O-N 2.96Å; A762-S764 VanDerWaalsContact C-N 3.32Å; A762-S764 PolarHBondContact O-N 3.49Å; A762-S765 PolarHBondContact O-N 3.02Å; A762-S765 PolarHBondContact O-OG 2.96Å
763	I	85.7	Confident	79.4	Confident	6 Å²	6	78.3 Å²	78.3	3%	0.031	42%	0.42	C	S	.	.	H	α-helix	trans	-65.6	-35.1	178.1	-60.7	163.5	0	0	0	111.3	F728 F732 I735 R736 I759 E761	F728-I763 HydrophobicContact CZ-CG1 4.49Å; F732-I763 HydrophobicContact CB-CD1 4.03Å; F732-I763 HydrophobicContact CB-CG1 4Å; F732-I763 HydrophobicContact CB-CG2 3.97Å; F732-I763 HydrophobicContact CD1-CD1 4.29Å; F732-I763 HydrophobicContact CD1-CG1 4.49Å; F732-I763 HydrophobicContact CG-CG1 4.42Å; I735-I763 HydrophobicContact CG2-CD1 4.47Å; R736-I763 HydrophobicContact CB-CD1 4.4Å; R736-I763 HydrophobicContact CB-CG2 4.19Å; R736-I763 HydrophobicContact CG-CG2 4.5Å; I759-I763 HydrophobicContact CG2-CD1 3.74Å; I759-I763 WeakPolarHBondContact O-CD1 3.5Å; I759-I763 VanDerWaalsContact O-CG1 3.26Å; I759-I763 WeakPolarHBondContact O-CG1 3.38Å; I759-I763 PolarHBondContact O-N 3.07Å; E761-I763 PolarHBondContact O-N 3.4Å
764	S	84	Confident	79.4	Confident	67 Å²	67	80.1 Å²	80.1	47%	0.469	44%	0.436	S	S	.	.	H	α-helix	trans	-74.7	-27	178	77.2	0	0	0	0	114.2	L760 E761 A762 A766	L760-S764 VanDerWaalsContact O-CB 3.26Å; L760-S764 WeakPolarHBondContact O-CB 3.43Å; L760-S764 PolarHBondContact O-N 3.21Å; L760-S764 PolarHBondContact O-OG 3.22Å; E761-S764 WeakPolarHBondContact CA-OG 3.32Å; E761-S764 CarbonylContact O-C 3.54Å; E761-S764 PolarHBondContact O-N 3.04Å; E761-S764 PolarHBondContact O-OG 3.22Å; A762-S764 VanDerWaalsContact C-N 3.32Å; A762-S764 PolarHBondContact O-N 3.49Å; S764-A766 VanDerWaalsContact C-N 3.32Å; S764-A766 PolarHBondContact O-N 2.83Å
765	S	82.5	Confident	79.1	Confident	77 Å²	77	83.1 Å²	83.1	54%	0.538	45%	0.448	S	S	.	.	H	α-helix	trans	-77.2	-14.1	-177.6	76.2	0	0	0	0	114.3	E761 A762 S767	E761-S765 WeakPolarHBondContact O-CB 3.22Å; E761-S765 PolarHBondContact O-N 3.18Å; A762-S765 PolarHBondContact O-N 3.02Å; A762-S765 PolarHBondContact O-OG 2.96Å; S765-S767 PolarHBondContact O-N 2.75Å
766	A	75	Confident	78.9	Confident	15 Å²	15	91.2 Å²	91.2	12%	0.124	49%	0.485	C	S	.	.	S	Bend	trans	-71.4	121.4	-177.5	0	0	0	0	0	111.4	F728 T729 S764 V768	F728-A766 HydrophobicContact CD1-CB 3.47Å; F728-A766 VanDerWaalsContact CD1-CB 3.47Å; F728-A766 HydrophobicContact CE1-CB 3.45Å; F728-A766 VanDerWaalsContact CE1-CB 3.45Å; T729-A766 HydrophobicContact CG2-CB 4.32Å; S764-A766 VanDerWaalsContact C-N 3.32Å; S764-A766 PolarHBondContact O-N 2.83Å; A766-V768 PolarHBondContact O-N 3.18Å
767	S	65	Low	78.8	Confident	99 Å²	99	99.8 Å²	99.8	69%	0.692	52%	0.522	S	S	*	.			trans	-67.6	121.1	-179.7	44.3	0	0	0	0	111.3	S765 T769	S765-S767 PolarHBondContact O-N 2.75Å; S767-T769 PolarHBondContact O-N 3.13Å
768	V	64.8	Low	78.5	Confident	80 Å²	80	106.9 Å²	106.9	49%	0.485	55%	0.546	S	S	.	.			trans	-78.2	84.3	-177.4	-157	0	0	0	0	110.9	T729 A766 H770	T729-V768 HydrophobicContact CG2-CG1 4.33Å; T729-V768 HydrophobicContact CG2-CG2 4.16Å; A766-V768 PolarHBondContact O-N 3.18Å; V768-H770 VanDerWaalsContact C-N 3.33Å; V768-H770 VanDerWaalsContact CG1-CE1 3.4Å; V768-H770 WeakPolarHBondContact CG1-CE1 3.37Å; V768-H770 WeakPolarHBondContact CG1-NE2 3.24Å; V768-H770 PolarHBondContact O-N 2.93Å
769	T	62.9	Low	78.3	Confident	76 Å²	76	112.2 Å²	112.2	47%	0.466	57%	0.568	S	S	.	*			trans	-75	81.9	176.9	53.5	0	0	0	0	111.1	S767 T771	S767-T769 PolarHBondContact O-N 3.13Å; T769-T771 PolarHBondContact O-N 2.89Å; T769-T771 PolarHBondContact O-OG1 2.74Å
770	H	62.4	Low	78.2	Confident	158 Å²	158	118.1 Å²	118.1	73%	0.731	61%	0.607	S	S	*	*			trans	-70.9	43.2	172.3	-68.8	-53.8	0	0	0	113.3	V768 R772	V768-H770 VanDerWaalsContact C-N 3.33Å; V768-H770 VanDerWaalsContact CG1-CE1 3.4Å; V768-H770 WeakPolarHBondContact CG1-CE1 3.37Å; V768-H770 WeakPolarHBondContact CG1-NE2 3.24Å; V768-H770 PolarHBondContact O-N 2.93Å; H770-R772 PolarHBondContact O-N 3.35Å
771	T	68.4	Low	78.1	Confident	105 Å²	105	124 Å²	124	64%	0.644	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-71.3	121.3	170.8	46.7	0	0	0	0	109.6	T769 L773	T769-T771 PolarHBondContact O-N 2.89Å; T769-T771 PolarHBondContact O-OG1 2.74Å; T771-L773 PolarHBondContact O-N 3.25Å
772	R	77.9	Confident	78	Confident	226 Å²	226	122.6 Å²	122.6	85%	0.853	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-57	132.1	171.2	-178.8	-179.7	179	174.6	2.3	109.5	H770 V774	H770-R772 PolarHBondContact O-N 3.35Å; R772-V774 PolarHBondContact O-N 3.48Å
773	L	79.4	Confident	78.1	Confident	156 Å²	156	128.6 Å²	128.6	82%	0.817	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-58.4	128.4	173	-64	175.3	0	0	0	110.3	T771	T771-L773 PolarHBondContact O-N 3.25Å
774	V	82.1	Confident	78.1	Confident	114 Å²	114	134.6 Å²	134.6	69%	0.691	69%	0.692	S	S	*	*			trans	-122.8	118.6	176	177.7	0	0	0	0	107.2	R772	R772-V774 PolarHBondContact O-N 3.48Å
775	F	78.6	Confident	78.3	Confident	193 Å²	193	139.4 Å²	139.4	85%	0.846	71%	0.712	S	S	*	*			trans	-60.7	141.2	172.3	-67.6	-75.7	0	0	0	110.6	K777	F775-K777 PolarHBondContact O-N 2.96Å
776	E	79	Confident	78.4	Confident	190 Å²	190	141.8 Å²	141.8	89%	0.888	71%	0.713	S	S	*	*			trans	-58.2	126.8	176.2	-64.3	-160.1	152.1	0	0	110.9	K778	E776-K778 PolarHBondContact O-N 3.29Å
777	K	83.4	Confident	78.8	Confident	192 Å²	192	146.7 Å²	146.7	84%	0.835	74%	0.741	S	S	*	*			trans	-73.6	102.7	176	-65.5	-178.7	-178	178.3	0	108.1	F775 K779	F775-K777 PolarHBondContact O-N 2.96Å; K777-K779 PolarHBondContact O-N 2.88Å
778	K	79.5	Confident	79.7	Confident	203 Å²	203	146.8 Å²	146.8	88%	0.883	74%	0.739	S	S	*	*			trans	-45.9	125.8	171.2	-69	-169.4	176.8	-172.2	0	109.2	E776	E776-K778 PolarHBondContact O-N 3.29Å
779	K	84.5	Confident	80.2	Confident	191 Å²	191	152.1 Å²	152.1	83%	0.83	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-59.2	139.1	176.3	-65.3	173.5	-175.9	169.1	0	108.4	K777 I781	K777-K779 PolarHBondContact O-N 2.88Å; K779-I781 PolarHBondContact O-N 2.95Å
780	P	85.9	Confident	80.6	Confident	124 Å²	124	155.6 Å²	155.6	81%	0.805	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-61.1	133.4	178.3	26.2	-34	0	0	0	109.7
781	I	84.1	Confident	80.8	Confident	162 Å²	162	151.8 Å²	151.8	83%	0.831	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-64.4	127.2	-179.9	-57.2	175.4	0	0	0	108.1	K779	K779-I781 PolarHBondContact O-N 2.95Å
782	P	86.8	Confident	80.6	Confident	109 Å²	109	153.2 Å²	153.2	71%	0.708	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-66.7	152.1	177.2	28.5	-34.8	0	0	0	111	K784	P782-K784 PolarHBondContact O-N 3Å
783	L	88.6	Confident	80	Confident	158 Å²	158	146.9 Å²	146.9	83%	0.827	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-58.5	132.2	173.5	-66.1	171.4	0	0	0	110.1	L785	L783-L785 PolarHBondContact O-N 2.7Å; L783-L785 VanDerWaalsContact O-N 3.13Å
784	K	84.8	Confident	79	Confident	131 Å²	131	145.7 Å²	145.7	57%	0.57	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-57.3	117.7	176.3	-69.5	-170.5	179	-174.7	0	109.5	P782 F786	P782-K784 PolarHBondContact O-N 3Å; K784-F786 HydrophobicContact CB-CE2 4.45Å
785	L	87.8	Confident	77.7	Confident	169 Å²	169	144.2 Å²	144.2	89%	0.885	73%	0.726	S	S	*	*			trans	-88.4	109.8	176.6	-62.1	-179.4	0	0	0	109.4	L783	L783-L785 PolarHBondContact O-N 2.7Å; L783-L785 VanDerWaalsContact O-N 3.13Å
786	F	84.6	Confident	76.7	Confident	126 Å²	126	144.1 Å²	144.1	55%	0.553	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-81.7	131.6	174.3	-64.7	-80.8	0	0	0	110.8	K784 P788	K784-F786 HydrophobicContact CB-CE2 4.45Å; F786-P788 WeakPolarHBondContact O-CD 3.32Å
787	T	84.3	Confident	75.8	Confident	119 Å²	119	139 Å²	139	73%	0.73	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-70.5	122.6	172.5	44.7	0	0	0	0	109.8	K789	T787-K789 PolarHBondContact O-N 2.76Å
788	P	83.1	Confident	74.8	Confident	100 Å²	100	136.3 Å²	136.3	65%	0.649	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-67	135.7	176.6	27.2	-33.2	0	0	0	109.5	F786 I790	F786-P788 WeakPolarHBondContact O-CD 3.32Å; P788-I790 HydrophobicContact CB-CG1 4.47Å; P788-I790 HydrophobicContact CG-CD1 4.32Å; P788-I790 HydrophobicContact CG-CG1 4.22Å; P788-I790 PolarHBondContact O-N 3.19Å
789	K	76.5	Confident	73.9	Confident	192 Å²	192	132.7 Å²	132.7	84%	0.835	69%	0.692	S	S	*	*			trans	-73.1	74.3	178.1	-166.9	165	-172	159.7	0	111	T787 V791	T787-K789 PolarHBondContact O-N 2.76Å; K789-V791 HydrophobicContact CG-CG2 4.3Å; K789-V791 PolarHBondContact O-N 3.21Å; K789-V791 VanDerWaalsContact O-N 3.16Å
790	I	70.8	Confident	72.7	Confident	149 Å²	149	130.5 Å²	130.5	76%	0.764	68%	0.679	S	S	*	*			trans	-66.6	110.8	177.9	-61.2	171.4	0	0	0	108.4	P788	P788-I790 HydrophobicContact CB-CG1 4.47Å; P788-I790 HydrophobicContact CG-CD1 4.32Å; P788-I790 HydrophobicContact CG-CG1 4.22Å; P788-I790 PolarHBondContact O-N 3.19Å
791	V	67.3	Low	71.7	Confident	78 Å²	78	128.6 Å²	128.6	47%	0.473	68%	0.682	S	S	.	*			trans	-108.4	117.2	176.1	177	0	0	0	0	108.4	K789 V793	K789-V791 HydrophobicContact CG-CG2 4.3Å; K789-V791 PolarHBondContact O-N 3.21Å; K789-V791 VanDerWaalsContact O-N 3.16Å; V791-V793 WeakPolarHBondContact O-CG2 3.27Å; V791-V793 PolarHBondContact O-N 3.46Å
792	E	64.3	Low	70.8	Confident	135 Å²	135	122.1 Å²	122.1	63%	0.631	65%	0.651	S	S	*	*			trans	-58.3	109.2	179	-64.2	-172.7	150.1	0	0	112.2	L794 R800	E792-L794 HydrophobicContact CB-CD1 4.4Å; E792-L794 PolarHBondContact O-N 3.18Å; E792-R800 PolarHBondContact O-NH1 2.98Å; E792-R800 PolarHBondContact O-NH2 3.34Å
793	V	64.3	Low	70.5	Confident	93 Å²	93	120.8 Å²	120.8	56%	0.564	64%	0.641	S	S	*	*			trans	-84	52.8	-171.9	-162.5	0	0	0	0	112.1	V791 D795 Y796	V791-V793 WeakPolarHBondContact O-CG2 3.27Å; V791-V793 PolarHBondContact O-N 3.46Å; V793-D795 VanDerWaalsContact C-N 3.27Å; V793-D795 PolarHBondContact O-N 2.91Å; V793-Y796 HydrophobicContact CG1-CD1 4.06Å; V793-Y796 HydrophobicContact CG1-CE1 3.82Å; V793-Y796 HydrophobicContact CG1-CE2 4.29Å; V793-Y796 HydrophobicContact CG1-CG 4.41Å
794	L	58.7	Low	70.2	Confident	132 Å²	132	122.1 Å²	122.1	69%	0.691	64%	0.635	S	S	*	*			trans	-70.8	-12.9	-178.4	-75.9	165.8	0	0	0	114.8	E792	E792-L794 HydrophobicContact CB-CD1 4.4Å; E792-L794 PolarHBondContact O-N 3.18Å
795	D	55.3	Low	70.2	Confident	83 Å²	83	121.5 Å²	121.5	44%	0.444	63%	0.634	S	S	.	*	S	Bend	trans	-145.7	86.5	-178.9	-101.5	-50	0	0	0	112.8	V793 G797 K798	V793-D795 VanDerWaalsContact C-N 3.27Å; V793-D795 PolarHBondContact O-N 2.91Å; D795-G797 PolarHBondContact O-N 3.28Å; D795-K798 HydrophobicContact CB-CD 3.74Å; D795-K798 HydrophobicContact CB-CG 4.13Å; D795-K798 PolarHBondContact O-N 3.23Å; D795-K798 WeakPolarHBondContact OD2-CE 3.36Å; D795-K798 IonicContact OD2-NZ 3.8Å; D795-K798 PolarHBondContact OD2-NZ 3.4Å
796	Y	57.6	Low	70	Confident	190 Å²	190	118 Å²	118	75%	0.745	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.4	110.2	170.9	-70.4	-85.2	0	0	0	111.9	V793	V793-Y796 HydrophobicContact CG1-CD1 4.06Å; V793-Y796 HydrophobicContact CG1-CE1 3.82Å; V793-Y796 HydrophobicContact CG1-CE2 4.29Å; V793-Y796 HydrophobicContact CG1-CG 4.41Å
797	G	60	Low	70	Confident	84 Å²	84	117.7 Å²	117.7	87%	0.866	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	113.9	-1.5	174	0	0	0	0	0	115.7	D795	D795-G797 PolarHBondContact O-N 3.28Å
798	K	62.2	Low	70.1	Confident	134 Å²	134	115.8 Å²	115.8	58%	0.583	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-82.1	124.9	159.7	-70	178.1	-179.9	167.8	0	108.7	D795 R800	D795-K798 HydrophobicContact CB-CD 3.74Å; D795-K798 HydrophobicContact CB-CG 4.13Å; D795-K798 PolarHBondContact O-N 3.23Å; D795-K798 WeakPolarHBondContact OD2-CE 3.36Å; D795-K798 IonicContact OD2-NZ 3.8Å; D795-K798 PolarHBondContact OD2-NZ 3.4Å; K798-R800 PolarHBondContact O-N 3.32Å
799	K	60	Low	70.3	Confident	128 Å²	128	116.3 Å²	116.3	56%	0.557	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-65.2	127.8	159	-68.2	-172.1	-176.9	178.6	0	108	E810	K799-E810 VanDerWaalsContact CD-OE2 3.28Å; K799-E810 WeakPolarHBondContact CD-OE2 3.44Å; K799-E810 VanDerWaalsContact CE-OE2 3.23Å; K799-E810 WeakPolarHBondContact CE-OE2 3.27Å; K799-E810 IonicContact NZ-OE1 3.94Å; K799-E810 PolarHBondContact NZ-OE1 3.25Å; K799-E810 IonicContact NZ-OE2 2.66Å; K799-E810 PolarHBondContact NZ-OE2 3.14Å
800	R	60.4	Low	70.8	Confident	144 Å²	144	111.5 Å²	111.5	54%	0.543	56%	0.564	S	S	.	*	P	Polyproline II helix	trans	-101.8	160.9	164.8	-72.5	-174.7	172.2	165.3	0.1	108.5	E792 K798	E792-R800 PolarHBondContact O-NH1 2.98Å; E792-R800 PolarHBondContact O-NH2 3.34Å; K798-R800 PolarHBondContact O-N 3.32Å
801	G	64.3	Low	71.7	Confident	85 Å²	85	111.5 Å²	111.5	88%	0.876	55%	0.554	S	S	*	*	S	Bend	trans	99.3	-26.9	-177.2	0	0	0	0	0	114.9
802	S	64.9	Low	72.9	Confident	26 Å²	26	112.6 Å²	112.6	18%	0.182	56%	0.557	C	S	.	*	S	Bend	trans	-78.9	152.8	173.7	83.2	0	0	0	0	112	E806 R807	S802-E806 WeakPolarHBondContact CA-OE2 3.33Å; S802-E806 VanDerWaalsContact CB-OE2 3.29Å; S802-E806 WeakPolarHBondContact CB-OE2 3.49Å; S802-R807 PolarHBondContact O-NH2 3.37Å
803	T	81	Confident	74.2	Confident	81 Å²	81	112.9 Å²	112.9	50%	0.497	56%	0.556	S	S	.	*			trans	-62.1	170.5	168.9	74.8	0	0	0	0	111.5	E806 R807	T803-E806 PolarHBondContact N-OE2 2.94Å; T803-E806 WeakPolarHBondContact OG1-CG 3.41Å; T803-E806 PolarHBondContact OG1-N 3.25Å; T803-R807 WeakPolarHBondContact O-CB 3.46Å; T803-R807 PolarHBondContact O-N 3.29Å
804	R	81.8	Confident	75.5	Confident	185 Å²	185	114.6 Å²	114.6	70%	0.698	56%	0.558	S	S	*	*	H	α-helix	trans	-59.2	-49.6	174.1	178.4	176.9	173.2	-175.5	-8.5	110.5	R807 E808	R804-R807 WeakPolarHBondContact O-CB 3.29Å; R804-R807 PolarHBondContact O-N 3.3Å; R804-E808 WeakPolarHBondContact CG-OE1 3.28Å; R804-E808 IonicContact CZ-OE1 3.3Å; R804-E808 IonicContact NE-OE1 3.49Å; R804-E808 PolarHBondContact NE-OE1 2.66Å; R804-E808 IonicContact NH2-OE1 2.93Å; R804-E808 WeakPolarHBondContact O-CG 3.3Å; R804-E808 PolarHBondContact O-N 3.12Å
805	E	85.4	Confident	77.2	Confident	118 Å²	118	113.2 Å²	113.2	55%	0.551	55%	0.546	S	S	*	.	H	α-helix	trans	-60.6	-48.6	-179.6	-70.3	-173.5	-150.7	0	0	113.1	R807 E808 K809	E805-R807 PolarHBondContact O-N 3.16Å; E805-E808 CarbonylContact O-C 3.56Å; E805-E808 PolarHBondContact O-N 2.93Å; E805-K809 HydrophobicContact CB-CD 4.26Å; E805-K809 VanDerWaalsContact O-CB 3.3Å; E805-K809 WeakPolarHBondContact O-CB 3.45Å; E805-K809 VanDerWaalsContact O-CG 3.28Å; E805-K809 WeakPolarHBondContact O-CG 3.36Å; E805-K809 PolarHBondContact O-N 3.13Å; E805-K809 IonicContact OE2-NZ 3.16Å; E805-K809 PolarHBondContact OE2-NZ 3.07Å
806	E	83.9	Confident	79.1	Confident	97 Å²	97	116.6 Å²	116.6	45%	0.453	55%	0.554	S	S	.	*	H	α-helix	trans	-56.8	-40.4	178.6	-72.9	178.8	131.5	0	0	111.4	S802 T803 E808 K809 E810	S802-E806 WeakPolarHBondContact CA-OE2 3.33Å; S802-E806 VanDerWaalsContact CB-OE2 3.29Å; S802-E806 WeakPolarHBondContact CB-OE2 3.49Å; T803-E806 PolarHBondContact N-OE2 2.94Å; T803-E806 WeakPolarHBondContact OG1-CG 3.41Å; T803-E806 PolarHBondContact OG1-N 3.25Å; E806-E808 VanDerWaalsContact C-N 3.3Å; E806-E808 PolarHBondContact O-N 3.13Å; E806-K809 PolarHBondContact O-N 3.47Å; E806-E810 WeakPolarHBondContact O-CB 3.36Å; E806-E810 WeakPolarHBondContact O-CG 3.38Å; E806-E810 PolarHBondContact O-N 3.16Å
807	R	83.1	Confident	80.9	Confident	118 Å²	118	114.6 Å²	114.6	45%	0.445	55%	0.549	S	S	.	.	H	α-helix	trans	-64.8	-36	177.7	-153.7	179.1	-57.4	143.2	4.4	111.9	S802 T803 R804 E805 R811	S802-R807 PolarHBondContact O-NH2 3.37Å; T803-R807 WeakPolarHBondContact O-CB 3.46Å; T803-R807 PolarHBondContact O-N 3.29Å; R804-R807 WeakPolarHBondContact O-CB 3.29Å; R804-R807 PolarHBondContact O-N 3.3Å; E805-R807 PolarHBondContact O-N 3.16Å; R807-R811 WeakPolarHBondContact O-CB 3.38Å; R807-R811 PolarHBondContact O-N 3.1Å
808	E	86.3	Confident	82.5	Confident	80 Å²	80	116 Å²	116	37%	0.374	53%	0.531	S	S	.	.	H	α-helix	trans	-77.5	-44	176.6	-66.1	-168.2	-140.5	0	0	111.5	R804 E805 E806 E810 R811 L812	R804-E808 WeakPolarHBondContact CG-OE1 3.28Å; R804-E808 IonicContact CZ-OE1 3.3Å; R804-E808 IonicContact NE-OE1 3.49Å; R804-E808 PolarHBondContact NE-OE1 2.66Å; R804-E808 IonicContact NH2-OE1 2.93Å; R804-E808 WeakPolarHBondContact O-CG 3.3Å; R804-E808 PolarHBondContact O-N 3.12Å; E805-E808 CarbonylContact O-C 3.56Å; E805-E808 PolarHBondContact O-N 2.93Å; E806-E808 VanDerWaalsContact C-N 3.3Å; E806-E808 PolarHBondContact O-N 3.13Å; E808-E810 PolarHBondContact O-N 3.34Å; E808-R811 PolarHBondContact O-N 3.3Å; E808-R811 VanDerWaalsContact O-N 3.16Å; E808-L812 WeakPolarHBondContact O-CB 3.5Å; E808-L812 VanDerWaalsContact O-CG 3.28Å; E808-L812 WeakPolarHBondContact O-CG 3.32Å; E808-L812 PolarHBondContact O-N 2.97Å
809	K	88	Confident	84.1	Confident	111 Å²	111	114.5 Å²	114.5	48%	0.483	53%	0.526	S	S	.	.	H	α-helix	trans	-54.9	-45.8	170.6	-72.3	164.3	174.2	168.2	0	111	E805 E806 K813	E805-K809 HydrophobicContact CB-CD 4.26Å; E805-K809 VanDerWaalsContact O-CB 3.3Å; E805-K809 WeakPolarHBondContact O-CB 3.45Å; E805-K809 VanDerWaalsContact O-CG 3.28Å; E805-K809 WeakPolarHBondContact O-CG 3.36Å; E805-K809 PolarHBondContact O-N 3.13Å; E805-K809 IonicContact OE2-NZ 3.16Å; E805-K809 PolarHBondContact OE2-NZ 3.07Å; E806-K809 PolarHBondContact O-N 3.47Å; K809-K813 WeakPolarHBondContact O-CB 3.25Å; K809-K813 VanDerWaalsContact O-CG 3.24Å; K809-K813 WeakPolarHBondContact O-CG 3.37Å; K809-K813 PolarHBondContact O-N 3.32Å
810	E	87.6	Confident	85.7	Confident	91 Å²	91	114 Å²	114	43%	0.425	52%	0.524	S	S	.	.	H	α-helix	trans	-65.3	-45.6	172.7	-80.9	-143	140.1	0	0	113.1	K799 E806 E808 L812 K813 H814	K799-E810 VanDerWaalsContact CD-OE2 3.28Å; K799-E810 WeakPolarHBondContact CD-OE2 3.44Å; K799-E810 VanDerWaalsContact CE-OE2 3.23Å; K799-E810 WeakPolarHBondContact CE-OE2 3.27Å; K799-E810 IonicContact NZ-OE1 3.94Å; K799-E810 PolarHBondContact NZ-OE1 3.25Å; K799-E810 IonicContact NZ-OE2 2.66Å; K799-E810 PolarHBondContact NZ-OE2 3.14Å; E806-E810 WeakPolarHBondContact O-CB 3.36Å; E806-E810 WeakPolarHBondContact O-CG 3.38Å; E806-E810 PolarHBondContact O-N 3.16Å; E808-E810 PolarHBondContact O-N 3.34Å; E810-L812 VanDerWaalsContact C-N 3.27Å; E810-L812 PolarHBondContact O-N 3.14Å; E810-K813 PolarHBondContact O-N 2.97Å; E810-H814 WeakPolarHBondContact O-CB 3.35Å; E810-H814 PolarHBondContact O-N 3.16Å
811	R	88.3	Confident	87.4	Confident	148 Å²	148	113.4 Å²	113.4	56%	0.558	53%	0.526	S	S	*	.	H	α-helix	trans	-60.3	-38.4	178.9	180	-177.2	179.7	-145.5	2.4	111.3	R807 E808 K815	R807-R811 WeakPolarHBondContact O-CB 3.38Å; R807-R811 PolarHBondContact O-N 3.1Å; E808-R811 PolarHBondContact O-N 3.3Å; E808-R811 VanDerWaalsContact O-N 3.16Å; R811-K815 WeakPolarHBondContact O-CB 3.45Å; R811-K815 WeakPolarHBondContact O-CG 3.47Å; R811-K815 PolarHBondContact O-N 3.45Å
812	L	92.6	Very high	88.8	Confident	102 Å²	102	110.3 Å²	110.3	53%	0.534	49%	0.494	S	S	.	.	H	α-helix	trans	-68.6	-50.4	173.3	-69.6	170.2	0	0	0	111.3	E808 E810 H814 K815 Y816	E808-L812 WeakPolarHBondContact O-CB 3.5Å; E808-L812 VanDerWaalsContact O-CG 3.28Å; E808-L812 WeakPolarHBondContact O-CG 3.32Å; E808-L812 PolarHBondContact O-N 2.97Å; E810-L812 VanDerWaalsContact C-N 3.27Å; E810-L812 PolarHBondContact O-N 3.14Å; L812-H814 PolarHBondContact O-N 3.33Å; L812-K815 HydrophobicContact CD2-CD 4.36Å; L812-K815 PolarHBondContact O-N 3.31Å; L812-K815 VanDerWaalsContact O-N 3.13Å; L812-Y816 WeakPolarHBondContact O-CB 3Å; L812-Y816 PolarHBondContact O-N 3.04Å
813	K	93.3	Very high	90.3	Very high	141 Å²	141	111.8 Å²	111.8	61%	0.613	51%	0.508	S	S	*	.	H	α-helix	trans	-53.8	-39.1	174.4	-75.1	169.6	-179.8	177.8	0	112	K809 E810 K817	K809-K813 WeakPolarHBondContact O-CB 3.25Å; K809-K813 VanDerWaalsContact O-CG 3.24Å; K809-K813 WeakPolarHBondContact O-CG 3.37Å; K809-K813 PolarHBondContact O-N 3.32Å; E810-K813 PolarHBondContact O-N 2.97Å; K813-K817 WeakPolarHBondContact O-CB 3.17Å; K813-K817 VanDerWaalsContact O-CG 3.29Å; K813-K817 WeakPolarHBondContact O-CG 3.4Å; K813-K817 PolarHBondContact O-N 2.64Å; K813-K817 VanDerWaalsContact O-N 3.11Å
814	H	91.2	Very high	91	Very high	129 Å²	129	110.8 Å²	110.8	60%	0.597	50%	0.499	S	S	*	.	H	α-helix	trans	-72	-45.4	175.3	178	-99.7	0	0	0	113.2	E810 L812 Y816 K817 K818	E810-H814 WeakPolarHBondContact O-CB 3.35Å; E810-H814 PolarHBondContact O-N 3.16Å; L812-H814 PolarHBondContact O-N 3.33Å; H814-Y816 PolarHBondContact O-N 3.01Å; H814-K817 PolarHBondContact O-N 2.77Å; H814-K818 WeakPolarHBondContact O-CB 3.47Å; H814-K818 PolarHBondContact O-N 3.12Å
815	K	93.3	Very high	91.5	Very high	102 Å²	102	108 Å²	108	44%	0.443	49%	0.489	S	S	.	.	H	α-helix	trans	-54.2	-53.2	173	-80.7	175.5	176.7	-177.1	0	110.6	R811 L812 K817 K818 E819	R811-K815 WeakPolarHBondContact O-CB 3.45Å; R811-K815 WeakPolarHBondContact O-CG 3.47Å; R811-K815 PolarHBondContact O-N 3.45Å; L812-K815 HydrophobicContact CD2-CD 4.36Å; L812-K815 PolarHBondContact O-N 3.31Å; L812-K815 VanDerWaalsContact O-N 3.13Å; K815-K817 PolarHBondContact O-N 3.04Å; K815-K818 WeakPolarHBondContact O-CB 3.35Å; K815-K818 PolarHBondContact O-N 2.59Å; K815-K818 VanDerWaalsContact O-N 3.12Å; K815-E819 PolarHBondContact O-N 2.99Å
816	Y	95.9	Very high	91.9	Very high	154 Å²	154	106 Å²	106	60%	0.604	48%	0.479	S	S	*	.	H	α-helix	trans	-55.1	-54.1	179.5	175.3	-94	0	0	0	111.5	L812 H814 K818 E819 F820	L812-Y816 WeakPolarHBondContact O-CB 3Å; L812-Y816 PolarHBondContact O-N 3.04Å; H814-Y816 PolarHBondContact O-N 3.01Å; Y816-K818 VanDerWaalsContact C-N 3.25Å; Y816-K818 PolarHBondContact O-N 2.89Å; Y816-E819 PolarHBondContact O-N 2.84Å; Y816-F820 WeakPolarHBondContact O-CB 3.16Å; Y816-F820 PolarHBondContact O-N 3.35Å
817	K	95.5	Very high	92.4	Very high	149 Å²	149	106 Å²	106	65%	0.648	48%	0.481	S	S	*	.	H	α-helix	trans	-60.4	-31.9	178.2	-72.9	176.8	179.4	-178.8	0	112.9	K813 H814 K815 K821	K813-K817 WeakPolarHBondContact O-CB 3.17Å; K813-K817 VanDerWaalsContact O-CG 3.29Å; K813-K817 WeakPolarHBondContact O-CG 3.4Å; K813-K817 PolarHBondContact O-N 2.64Å; K813-K817 VanDerWaalsContact O-N 3.11Å; H814-K817 PolarHBondContact O-N 2.77Å; K815-K817 PolarHBondContact O-N 3.04Å; K817-K821 WeakPolarHBondContact O-CB 3.44Å; K817-K821 PolarHBondContact O-N 3.36Å
818	K	93.6	Very high	93	Very high	113 Å²	113	107.9 Å²	107.9	49%	0.491	49%	0.488	S	S	.	.	H	α-helix	trans	-70.2	-51.4	175.5	176.7	178.9	168	-80.6	0	112.1	H814 K815 Y816 G822	H814-K818 WeakPolarHBondContact O-CB 3.47Å; H814-K818 PolarHBondContact O-N 3.12Å; K815-K818 WeakPolarHBondContact O-CB 3.35Å; K815-K818 PolarHBondContact O-N 2.59Å; K815-K818 VanDerWaalsContact O-N 3.12Å; Y816-K818 VanDerWaalsContact C-N 3.25Å; Y816-K818 PolarHBondContact O-N 2.89Å; K818-G822 PolarHBondContact O-N 3.11Å
819	E	94.6	Very high	93.4	Very high	102 Å²	102	108.6 Å²	108.6	48%	0.477	49%	0.49	S	S	.	.	H	α-helix	trans	-74.6	-40.8	-175.6	-57	-38.3	134.8	0	0	112.5	K815 Y816 K821 G822 A823	K815-E819 PolarHBondContact O-N 2.99Å; Y816-E819 PolarHBondContact O-N 2.84Å; E819-K821 VanDerWaalsContact C-N 3.34Å; E819-K821 PolarHBondContact O-N 3.04Å; E819-G822 CarbonylContact O-C 3.54Å; E819-G822 WeakPolarHBondContact O-CA 3.12Å; E819-G822 PolarHBondContact O-N 2.79Å; E819-A823 PolarHBondContact O-N 3.42Å
820	F	95.6	Very high	93.7	Very high	118 Å²	118	105.2 Å²	105.2	52%	0.518	48%	0.478	S	S	.	.	H	α-helix	trans	-55.9	-48.3	172.8	178.2	-98.8	0	0	0	111.3	Y816 G822 A823 L824	Y816-F820 WeakPolarHBondContact O-CB 3.16Å; Y816-F820 PolarHBondContact O-N 3.35Å; F820-G822 PolarHBondContact O-N 2.87Å; F820-A823 PolarHBondContact O-N 3.05Å; F820-L824 HydrophobicContact CE1-CD2 4.25Å; F820-L824 VanDerWaalsContact O-CB 3.3Å; F820-L824 WeakPolarHBondContact O-CB 3.47Å; F820-L824 PolarHBondContact O-N 2.67Å
821	K	96	Very high	94	Very high	131 Å²	131	104.2 Å²	104.2	57%	0.57	48%	0.481	S	S	*	.	H	α-helix	trans	-65.3	-27.8	174	-163.4	170.3	-173.5	166.8	0	111.4	K817 E819 R825	K817-K821 WeakPolarHBondContact O-CB 3.44Å; K817-K821 PolarHBondContact O-N 3.36Å; E819-K821 VanDerWaalsContact C-N 3.34Å; E819-K821 PolarHBondContact O-N 3.04Å; K821-R825 VanDerWaalsContact C-NH2 3.35Å; K821-R825 WeakPolarHBondContact O-CB 3.3Å; K821-R825 VanDerWaalsContact O-CG 3.25Å; K821-R825 WeakPolarHBondContact O-CG 3.3Å; K821-R825 PolarHBondContact O-N 3.08Å; K821-R825 PolarHBondContact O-NE 2.87Å; K821-R825 PolarHBondContact O-NH2 3.44Å
822	G	93.6	Very high	94.3	Very high	21 Å²	21	106 Å²	106	22%	0.216	49%	0.487	C	S	.	.	H	α-helix	trans	-62.4	-64.3	170.4	0	0	0	0	0	112.3	K818 E819 F820 L824 R825 E826	K818-G822 PolarHBondContact O-N 3.11Å; E819-G822 CarbonylContact O-C 3.54Å; E819-G822 WeakPolarHBondContact O-CA 3.12Å; E819-G822 PolarHBondContact O-N 2.79Å; F820-G822 PolarHBondContact O-N 2.87Å; G822-L824 PolarHBondContact O-N 3.24Å; G822-R825 WeakPolarHBondContact O-CB 3.48Å; G822-R825 PolarHBondContact O-N 3Å; G822-E826 PolarHBondContact O-N 3.18Å
823	A	95	Very high	94.5	Very high	56 Å²	56	101.9 Å²	101.9	46%	0.463	47%	0.465	S	S	.	.	H	α-helix	trans	-52.8	-50.3	179.7	0	0	0	0	0	111.9	E819 F820 R825 E826 I827	E819-A823 PolarHBondContact O-N 3.42Å; F820-A823 PolarHBondContact O-N 3.05Å; A823-R825 PolarHBondContact O-N 3.41Å; A823-R825 VanDerWaalsContact O-N 3.15Å; A823-E826 PolarHBondContact O-N 3.07Å; A823-I827 WeakPolarHBondContact O-CG1 3.49Å; A823-I827 PolarHBondContact O-N 3.36Å
824	L	95.5	Very high	94.5	Very high	61 Å²	61	97.4 Å²	97.4	32%	0.319	45%	0.448	S	S	.	.	H	α-helix	trans	-59.9	-27.7	178.4	-174.7	61	0	0	0	113.2	F820 G822 R828	F820-L824 HydrophobicContact CE1-CD2 4.25Å; F820-L824 VanDerWaalsContact O-CB 3.3Å; F820-L824 WeakPolarHBondContact O-CB 3.47Å; F820-L824 PolarHBondContact O-N 2.67Å; G822-L824 PolarHBondContact O-N 3.24Å; L824-R828 HydrophobicContact CD1-CG 4.4Å; L824-R828 WeakPolarHBondContact O-CB 3.46Å; L824-R828 WeakPolarHBondContact O-CD 3.5Å; L824-R828 WeakPolarHBondContact O-CG 3.34Å; L824-R828 PolarHBondContact O-N 2.69Å
825	R	93.9	Very high	94.6	Very high	127 Å²	127	93.9 Å²	93.9	48%	0.479	44%	0.441	S	S	.	.	H	α-helix	trans	-78.5	-31.1	175	-82.1	176.4	-65.2	-163.6	-4.8	113.2	K821 G822 A823 K829	K821-R825 VanDerWaalsContact C-NH2 3.35Å; K821-R825 WeakPolarHBondContact O-CB 3.3Å; K821-R825 VanDerWaalsContact O-CG 3.25Å; K821-R825 WeakPolarHBondContact O-CG 3.3Å; K821-R825 PolarHBondContact O-N 3.08Å; K821-R825 PolarHBondContact O-NE 2.87Å; K821-R825 PolarHBondContact O-NH2 3.44Å; G822-R825 WeakPolarHBondContact O-CB 3.48Å; G822-R825 PolarHBondContact O-N 3Å; A823-R825 PolarHBondContact O-N 3.41Å; A823-R825 VanDerWaalsContact O-N 3.15Å; R825-K829 VanDerWaalsContact O-CD 3.32Å; R825-K829 WeakPolarHBondContact O-CD 3.45Å; R825-K829 VanDerWaalsContact O-CG 3.24Å; R825-K829 WeakPolarHBondContact O-CG 3.44Å; R825-K829 PolarHBondContact O-N 3.34Å
826	E	93.2	Very high	94.7	Very high	76 Å²	76	97.9 Å²	97.9	36%	0.355	45%	0.453	S	S	.	.	H	α-helix	trans	-77.3	-47	172.8	-63	-44.2	122.2	0	0	111.2	R62 G822 A823 R828 K829 D830	R62-E826 IonicContact CZ-OE2 2.65Å; R62-E826 IonicContact NH1-OE2 3.67Å; R62-E826 IonicContact NH2-OE2 3.64Å; R62-E826 PolarHBondContact NH2-OE2 3.3Å; G822-E826 PolarHBondContact O-N 3.18Å; A823-E826 PolarHBondContact O-N 3.07Å; E826-R828 VanDerWaalsContact C-N 3.29Å; E826-R828 PolarHBondContact O-N 3.36Å; E826-K829 CarbonylContact O-C 3.56Å; E826-K829 WeakPolarHBondContact O-CA 3.48Å; E826-K829 WeakPolarHBondContact O-CB 3.36Å; E826-K829 PolarHBondContact O-N 2.99Å; E826-K829 IonicContact OE1-NZ 2.8Å; E826-K829 PolarHBondContact OE1-NZ 3.15Å; E826-K829 VanDerWaalsContact OE2-CD 3.31Å; E826-K829 WeakPolarHBondContact OE2-CD 3.42Å; E826-K829 IonicContact OE2-NZ 2.74Å; E826-K829 PolarHBondContact OE2-NZ 2.96Å; E826-D830 PolarHBondContact O-N 3.49Å
827	I	94.9	Very high	94.5	Very high	96 Å²	96	92.2 Å²	92.2	49%	0.492	43%	0.432	S	S	.	.	H	α-helix	trans	-50.6	-49.6	175.3	-65	165.4	0	0	0	110.7	A823 K829 D830 S831	A823-I827 WeakPolarHBondContact O-CG1 3.49Å; A823-I827 PolarHBondContact O-N 3.36Å; I827-K829 VanDerWaalsContact C-N 3.26Å; I827-K829 PolarHBondContact O-N 2.85Å; I827-D830 PolarHBondContact O-N 3.15Å; I827-D830 VanDerWaalsContact O-N 3.07Å; I827-S831 PolarHBondContact O-N 2.91Å; I827-S831 PolarHBondContact O-OG 3.05Å
828	R	95.3	Very high	94.4	Very high	157 Å²	157	90.3 Å²	90.3	59%	0.592	42%	0.424	S	S	*	.	H	α-helix	trans	-62.8	-25.2	177.5	-73.8	173.8	178.3	-170.5	-0.6	114.1	L824 E826 R832	L824-R828 HydrophobicContact CD1-CG 4.4Å; L824-R828 WeakPolarHBondContact O-CB 3.46Å; L824-R828 WeakPolarHBondContact O-CD 3.5Å; L824-R828 WeakPolarHBondContact O-CG 3.34Å; L824-R828 PolarHBondContact O-N 2.69Å; E826-R828 VanDerWaalsContact C-N 3.29Å; E826-R828 PolarHBondContact O-N 3.36Å; R828-R832 VanDerWaalsContact O-CD 3.23Å; R828-R832 WeakPolarHBondContact O-CD 3.39Å; R828-R832 WeakPolarHBondContact O-CG 3.33Å
829	K	94.1	Very high	94.5	Very high	95 Å²	95	90 Å²	90	41%	0.413	43%	0.427	S	S	.	.	H	α-helix	trans	-81.3	-36.3	171.9	-69.6	163.1	-175	175.6	0	111.5	R825 E826 I827 R832 F833	R825-K829 VanDerWaalsContact O-CD 3.32Å; R825-K829 WeakPolarHBondContact O-CD 3.45Å; R825-K829 VanDerWaalsContact O-CG 3.24Å; R825-K829 WeakPolarHBondContact O-CG 3.44Å; R825-K829 PolarHBondContact O-N 3.34Å; E826-K829 CarbonylContact O-C 3.56Å; E826-K829 WeakPolarHBondContact O-CA 3.48Å; E826-K829 WeakPolarHBondContact O-CB 3.36Å; E826-K829 PolarHBondContact O-N 2.99Å; E826-K829 IonicContact OE1-NZ 2.8Å; E826-K829 PolarHBondContact OE1-NZ 3.15Å; E826-K829 VanDerWaalsContact OE2-CD 3.31Å; E826-K829 WeakPolarHBondContact OE2-CD 3.42Å; E826-K829 IonicContact OE2-NZ 2.74Å; E826-K829 PolarHBondContact OE2-NZ 2.96Å; I827-K829 VanDerWaalsContact C-N 3.26Å; I827-K829 PolarHBondContact O-N 2.85Å; K829-R832 CarbonylContact O-C 3.59Å; K829-R832 PolarHBondContact O-N 3.33Å; K829-F833 WeakPolarHBondContact O-CB 3.46Å; K829-F833 PolarHBondContact O-N 2.83Å
830	D	94.6	Very high	94.5	Very high	41 Å²	41	87.3 Å²	87.3	22%	0.219	42%	0.419	C	S	.	.	H	α-helix	trans	-66.9	-46.9	-179.5	-61.6	-23.8	0	0	0	110.6	R62 L66 E826 I827 R832 F833 L834	R62-D830 IonicContact CZ-OD1 2.96Å; R62-D830 IonicContact NE-OD1 2.72Å; R62-D830 PolarHBondContact NE-OD1 2.87Å; R62-D830 IonicContact NH2-OD1 3.23Å; R62-D830 PolarHBondContact NH2-OD1 3.44Å; L66-D830 HydrophobicContact CD1-CB 3.7Å; E826-D830 PolarHBondContact O-N 3.49Å; I827-D830 PolarHBondContact O-N 3.15Å; I827-D830 VanDerWaalsContact O-N 3.07Å; D830-R832 VanDerWaalsContact C-N 3.31Å; D830-R832 PolarHBondContact O-N 2.92Å; D830-F833 PolarHBondContact O-N 2.84Å; D830-F833 VanDerWaalsContact O-N 3.15Å; D830-L834 PolarHBondContact O-N 3.1Å
831	S	94.9	Very high	94.3	Very high	70 Å²	70	83.5 Å²	83.5	49%	0.49	40%	0.403	S	S	.	.	H	α-helix	trans	-57.8	-42.2	171	-45.7	0	0	0	0	111.9	I827 A835	I827-S831 PolarHBondContact O-N 2.91Å; I827-S831 PolarHBondContact O-OG 3.05Å; S831-A835 WeakPolarHBondContact O-CB 3.38Å; S831-A835 PolarHBondContact O-N 2.79Å
832	R	94.6	Very high	94.3	Very high	184 Å²	184	80.9 Å²	80.9	69%	0.694	40%	0.398	S	S	*	.	H	α-helix	trans	-67.8	-32.3	177	-76.4	173.3	180	-166.4	-3.3	113.1	R828 K829 D830 R836	R828-R832 VanDerWaalsContact O-CD 3.23Å; R828-R832 WeakPolarHBondContact O-CD 3.39Å; R828-R832 WeakPolarHBondContact O-CG 3.33Å; K829-R832 CarbonylContact O-C 3.59Å; K829-R832 PolarHBondContact O-N 3.33Å; D830-R832 VanDerWaalsContact C-N 3.31Å; D830-R832 PolarHBondContact O-N 2.92Å; R832-R836 VanDerWaalsContact O-CG 3.3Å; R832-R836 WeakPolarHBondContact O-CG 3.47Å; R832-R836 PolarHBondContact O-N 3.25Å
833	F	95.2	Very high	94.4	Very high	16 Å²	16	85.7 Å²	85.7	7%	0.07	42%	0.416	C	S	.	.	H	α-helix	trans	-71	-52.2	175.1	174.9	-100.7	0	0	0	110.6	R62 K63 L66 L67 K829 D830 A835 R836 E837	R62-F833 HydrophobicContact CB-CD1 3.78Å; R62-F833 HydrophobicContact CB-CD2 4.18Å; R62-F833 HydrophobicContact CB-CE1 3.76Å; R62-F833 HydrophobicContact CB-CE2 4.18Å; R62-F833 HydrophobicContact CB-CG 4Å; R62-F833 HydrophobicContact CB-CZ 3.98Å; R62-F833 HydrophobicContact CG-CD1 4.45Å; R62-F833 HydrophobicContact CG-CG 4.48Å; R62-F833 WeakPolarHBondContact O-CE1 3.39Å; K63-F833 HydrophobicContact CG-CE2 4.03Å; K63-F833 HydrophobicContact CG-CZ 3.77Å; L66-F833 HydrophobicContact CB-CD1 4.4Å; L66-F833 HydrophobicContact CB-CE1 4.32Å; L66-F833 HydrophobicContact CD1-CD1 4.34Å; L67-F833 HydrophobicContact CB-CE1 4.1Å; L67-F833 HydrophobicContact CB-CZ 4.16Å; L67-F833 HydrophobicContact CD2-CZ 4.48Å; K829-F833 WeakPolarHBondContact O-CB 3.46Å; K829-F833 PolarHBondContact O-N 2.83Å; D830-F833 PolarHBondContact O-N 2.84Å; D830-F833 VanDerWaalsContact O-N 3.15Å; F833-A835 VanDerWaalsContact C-N 3.29Å; F833-A835 PolarHBondContact O-N 2.88Å; F833-R836 WeakPolarHBondContact O-CB 3.43Å; F833-R836 PolarHBondContact O-N 3.31Å; F833-R836 VanDerWaalsContact O-N 3.08Å; F833-E837 HydrophobicContact CD1-CG 4.39Å; F833-E837 HydrophobicContact CD2-CG 4.46Å; F833-E837 HydrophobicContact CE1-CG 3.93Å; F833-E837 HydrophobicContact CE2-CG 3.99Å; F833-E837 WeakPolarHBondContact CE2-OE1 3.25Å; F833-E837 HydrophobicContact CZ-CG 3.7Å; F833-E837 WeakPolarHBondContact CZ-OE1 3.48Å; F833-E837 PolarHBondContact O-N 3.37Å
834	L	93.4	Very high	94.4	Very high	47 Å²	47	87.8 Å²	87.8	25%	0.246	42%	0.42	C	S	.	.	H	α-helix	trans	-60.9	-36.2	177.1	-70.3	172.9	0	0	0	112.6	L66 Y70 D830 K838	L66-L834 HydrophobicContact CB-CD2 4.31Å; Y70-L834 HydrophobicContact CG-CD2 4.31Å; D830-L834 PolarHBondContact O-N 3.1Å; L834-K838 VanDerWaalsContact O-CB 3.27Å; L834-K838 WeakPolarHBondContact O-CB 3.41Å; L834-K838 WeakPolarHBondContact O-CG 3.14Å; L834-K838 PolarHBondContact O-N 3.23Å
835	A	94.8	Very high	94.3	Very high	56 Å²	56	91.6 Å²	91.6	46%	0.463	43%	0.43	S	S	.	.	H	α-helix	trans	-63.3	-38.9	174.2	0	0	0	0	0	112.7	S831 F833 L839	S831-A835 WeakPolarHBondContact O-CB 3.38Å; S831-A835 PolarHBondContact O-N 2.79Å; F833-A835 VanDerWaalsContact C-N 3.29Å; F833-A835 PolarHBondContact O-N 2.88Å; A835-L839 VanDerWaalsContact O-CB 3.29Å; A835-L839 WeakPolarHBondContact O-CB 3.11Å; A835-L839 PolarHBondContact O-N 3.36Å
836	R	94.4	Very high	94.4	Very high	186 Å²	186	88.6 Å²	88.6	70%	0.702	42%	0.423	S	S	*	.	H	α-helix	trans	-69.5	-46.1	176.6	-74.9	170	173.4	-165.2	-5.6	112.3	R832 F833 L839 S840	R832-R836 VanDerWaalsContact O-CG 3.3Å; R832-R836 WeakPolarHBondContact O-CG 3.47Å; R832-R836 PolarHBondContact O-N 3.25Å; F833-R836 WeakPolarHBondContact O-CB 3.43Å; F833-R836 PolarHBondContact O-N 3.31Å; F833-R836 VanDerWaalsContact O-N 3.08Å; R836-L839 PolarHBondContact O-N 3.03Å; R836-S840 WeakPolarHBondContact O-CB 3.4Å; R836-S840 PolarHBondContact O-N 3.15Å
837	E	92.5	Very high	94.5	Very high	34 Å²	34	87.6 Å²	87.6	16%	0.159	43%	0.429	C	S	.	.	H	α-helix	trans	-61.3	-48.8	177.3	-64	-75.8	158.9	0	0	109.6	L67 F833 L839 S840 E841	L67-E837 HydrophobicContact CD1-CB 4.23Å; L67-E837 HydrophobicContact CD1-CG 3.98Å; L67-E837 WeakPolarHBondContact CD1-OE2 3.43Å; F833-E837 HydrophobicContact CD1-CG 4.39Å; F833-E837 HydrophobicContact CD2-CG 4.46Å; F833-E837 HydrophobicContact CE1-CG 3.93Å; F833-E837 HydrophobicContact CE2-CG 3.99Å; F833-E837 WeakPolarHBondContact CE2-OE1 3.25Å; F833-E837 HydrophobicContact CZ-CG 3.7Å; F833-E837 WeakPolarHBondContact CZ-OE1 3.48Å; F833-E837 PolarHBondContact O-N 3.37Å; E837-L839 PolarHBondContact O-N 3.19Å; E837-S840 PolarHBondContact O-N 3Å; E837-S840 VanDerWaalsContact O-N 3.13Å; E837-S840 PolarHBondContact O-OG 3.13Å; E837-E841 WeakPolarHBondContact O-CG 3.43Å; E837-E841 PolarHBondContact O-N 2.67Å
838	K	92.8	Very high	94.5	Very high	110 Å²	110	88 Å²	88	48%	0.478	43%	0.428	S	S	.	.	H	α-helix	trans	-52.7	-49.4	173.2	-78.8	175.9	178	-173.9	0	113.1	Y70 L834 S840 E841 V842	Y70-K838 HydrophobicContact CE1-CG 4.34Å; Y70-K838 HydrophobicContact CE2-CG 4.46Å; L834-K838 VanDerWaalsContact O-CB 3.27Å; L834-K838 WeakPolarHBondContact O-CB 3.41Å; L834-K838 WeakPolarHBondContact O-CG 3.14Å; L834-K838 PolarHBondContact O-N 3.23Å; K838-S840 VanDerWaalsContact C-N 3.33Å; K838-S840 PolarHBondContact O-N 3.14Å; K838-E841 PolarHBondContact O-N 3.35Å; K838-V842 WeakPolarHBondContact O-CG2 3.41Å; K838-V842 PolarHBondContact O-N 3.05Å
839	L	95.3	Very high	94.5	Very high	106 Å²	106	88.9 Å²	88.9	56%	0.555	43%	0.432	S	S	*	.	H	α-helix	trans	-62.2	-41.4	179.2	-175.8	153.6	0	0	0	111.2	A835 R836 E837 E841 V842 M843	A835-L839 VanDerWaalsContact O-CB 3.29Å; A835-L839 WeakPolarHBondContact O-CB 3.11Å; A835-L839 PolarHBondContact O-N 3.36Å; R836-L839 PolarHBondContact O-N 3.03Å; E837-L839 PolarHBondContact O-N 3.19Å; L839-E841 PolarHBondContact O-N 3.02Å; L839-V842 PolarHBondContact O-N 3.07Å; L839-M843 HydrophobicContact CD2-CG 4.12Å; L839-M843 HydrophobicContact CD2-SD 3.58Å; L839-M843 VanDerWaalsContact CD2-SD 3.58Å; L839-M843 WeakPolarHBondContact O-CG 3.43Å; L839-M843 PolarHBondContact O-N 2.96Å
840	S	94.4	Very high	94.6	Very high	45 Å²	45	91.4 Å²	91.4	32%	0.315	44%	0.442	S	S	.	.	H	α-helix	trans	-65.3	-37.1	176.3	76.7	0	0	0	0	112.7	R836 E837 K838 M843 N844	R836-S840 WeakPolarHBondContact O-CB 3.4Å; R836-S840 PolarHBondContact O-N 3.15Å; E837-S840 PolarHBondContact O-N 3Å; E837-S840 VanDerWaalsContact O-N 3.13Å; E837-S840 PolarHBondContact O-OG 3.13Å; K838-S840 VanDerWaalsContact C-N 3.33Å; K838-S840 PolarHBondContact O-N 3.14Å; S840-M843 PolarHBondContact O-N 3.06Å; S840-N844 WeakPolarHBondContact O-CB 3.34Å; S840-N844 PolarHBondContact O-N 2.89Å; S840-N844 PolarHBondContact O-ND2 3.43Å
841	E	92.8	Very high	94.6	Very high	38 Å²	38	97.3 Å²	97.3	18%	0.178	46%	0.462	C	S	.	.	H	α-helix	trans	-67.7	-38.6	174.2	-64.1	-169	162.8	0	0	112.2	E837 K838 L839 N844 R845	E837-E841 WeakPolarHBondContact O-CG 3.43Å; E837-E841 PolarHBondContact O-N 2.67Å; K838-E841 PolarHBondContact O-N 3.35Å; L839-E841 PolarHBondContact O-N 3.02Å; E841-N844 PolarHBondContact O-N 3.2Å; E841-R845 WeakPolarHBondContact O-CB 3.3Å; E841-R845 WeakPolarHBondContact O-CG 3.47Å; E841-R845 PolarHBondContact O-N 3.08Å; E841-R845 IonicContact OE2-CZ 3.78Å; E841-R845 VanDerWaalsContact OE2-CZ 3.23Å; E841-R845 IonicContact OE2-NH1 2.71Å; E841-R845 PolarHBondContact OE2-NH1 3.02Å; E841-R845 IonicContact OE2-NH2 2.65Å; E841-R845 PolarHBondContact OE2-NH2 2.78Å
842	V	94.9	Very high	94.6	Very high	77 Å²	77	99.4 Å²	99.4	47%	0.467	46%	0.462	S	S	.	.	H	α-helix	trans	-63	-48.7	174.7	171.6	0	0	0	0	110.3	K838 L839 N844 R845 D846	K838-V842 WeakPolarHBondContact O-CG2 3.41Å; K838-V842 PolarHBondContact O-N 3.05Å; L839-V842 PolarHBondContact O-N 3.07Å; V842-N844 VanDerWaalsContact C-N 3.31Å; V842-N844 PolarHBondContact O-N 2.97Å; V842-R845 PolarHBondContact O-N 3.22Å; V842-D846 PolarHBondContact O-N 3.44Å
843	M	95.3	Very high	94.7	Very high	121 Å²	121	94 Å²	94	60%	0.596	45%	0.45	S	S	*	.	H	α-helix	trans	-58.2	-41.1	175.9	-73.2	-174.3	69.3	0	0	112.6	L839 S840 D846 A847	L839-M843 HydrophobicContact CD2-CG 4.12Å; L839-M843 HydrophobicContact CD2-SD 3.58Å; L839-M843 VanDerWaalsContact CD2-SD 3.58Å; L839-M843 WeakPolarHBondContact O-CG 3.43Å; L839-M843 PolarHBondContact O-N 2.96Å; S840-M843 PolarHBondContact O-N 3.06Å; M843-D846 PolarHBondContact O-N 3.19Å; M843-A847 VanDerWaalsContact O-CB 3.29Å; M843-A847 WeakPolarHBondContact O-CB 3.43Å; M843-A847 PolarHBondContact O-N 3.21Å
844	N	95.1	Very high	94.7	Very high	100 Å²	100	101.2 Å²	101.2	54%	0.535	48%	0.481	S	S	.	.	H	α-helix	trans	-67.6	-44.5	177.5	-70.1	-15.3	0	0	0	111.9	S840 E841 V842 D846 A847 E848	S840-N844 WeakPolarHBondContact O-CB 3.34Å; S840-N844 PolarHBondContact O-N 2.89Å; S840-N844 PolarHBondContact O-ND2 3.43Å; E841-N844 PolarHBondContact O-N 3.2Å; V842-N844 VanDerWaalsContact C-N 3.31Å; V842-N844 PolarHBondContact O-N 2.97Å; N844-D846 VanDerWaalsContact C-N 3.33Å; N844-D846 PolarHBondContact O-N 2.94Å; N844-A847 PolarHBondContact O-N 2.57Å; N844-E848 WeakPolarHBondContact O-CB 3.25Å; N844-E848 PolarHBondContact O-N 3.21Å
845	R	94.6	Very high	94.7	Very high	142 Å²	142	103.6 Å²	103.6	54%	0.536	49%	0.49	S	S	.	.	H	α-helix	trans	-59.2	-43	174.8	-73.7	168.7	-175.8	122.5	9.7	111.6	E841 V842 R849	E841-R845 WeakPolarHBondContact O-CB 3.3Å; E841-R845 WeakPolarHBondContact O-CG 3.47Å; E841-R845 PolarHBondContact O-N 3.08Å; E841-R845 IonicContact OE2-CZ 3.78Å; E841-R845 VanDerWaalsContact OE2-CZ 3.23Å; E841-R845 IonicContact OE2-NH1 2.71Å; E841-R845 PolarHBondContact OE2-NH1 3.02Å; E841-R845 IonicContact OE2-NH2 2.65Å; E841-R845 PolarHBondContact OE2-NH2 2.78Å; V842-R845 PolarHBondContact O-N 3.22Å; R845-R849 VanDerWaalsContact O-CB 3.23Å; R845-R849 WeakPolarHBondContact O-CB 3.27Å; R845-R849 PolarHBondContact O-N 3.35Å
846	D	95.1	Very high	94.7	Very high	63 Å²	63	106 Å²	106	34%	0.337	50%	0.495	S	S	.	.	H	α-helix	trans	-69.3	-37.1	176.6	-84.5	-30.3	0	0	0	112.9	V842 M843 N844 R849 K850	V842-D846 PolarHBondContact O-N 3.44Å; M843-D846 PolarHBondContact O-N 3.19Å; N844-D846 VanDerWaalsContact C-N 3.33Å; N844-D846 PolarHBondContact O-N 2.94Å; D846-R849 PolarHBondContact O-N 2.71Å; D846-K850 VanDerWaalsContact O-CB 3.31Å; D846-K850 WeakPolarHBondContact O-CB 3.38Å; D846-K850 WeakPolarHBondContact O-CG 3.1Å; D846-K850 PolarHBondContact O-N 2.7Å
847	A	95.8	Very high	94.7	Very high	56 Å²	56	102.3 Å²	102.3	46%	0.463	49%	0.489	S	S	.	.	H	α-helix	trans	-65.7	-45.6	174.8	0	0	0	0	0	111.5	M843 N844 K850 R851	M843-A847 VanDerWaalsContact O-CB 3.29Å; M843-A847 WeakPolarHBondContact O-CB 3.43Å; M843-A847 PolarHBondContact O-N 3.21Å; N844-A847 PolarHBondContact O-N 2.57Å; A847-K850 PolarHBondContact O-N 2.83Å; A847-R851 WeakPolarHBondContact O-CB 3.34Å; A847-R851 PolarHBondContact O-N 3.39Å
848	E	95.6	Very high	94.8	Very high	105 Å²	105	102.5 Å²	102.5	49%	0.491	50%	0.499	S	S	.	.	H	α-helix	trans	-60.4	-44.8	172.6	-79	-172.1	-139.1	0	0	112.2	N844 R851 K852	N844-E848 WeakPolarHBondContact O-CB 3.25Å; N844-E848 PolarHBondContact O-N 3.21Å; E848-R851 PolarHBondContact O-N 3.22Å; E848-K852 WeakPolarHBondContact O-CB 3.24Å; E848-K852 WeakPolarHBondContact O-CG 3.34Å; E848-K852 PolarHBondContact O-N 2.9Å; E848-K852 IonicContact OE2-NZ 2.62Å; E848-K852 PolarHBondContact OE2-NZ 3.14Å
849	R	94.6	Very high	94.8	Very high	174 Å²	174	99.6 Å²	99.6	66%	0.657	49%	0.493	S	S	*	.	H	α-helix	trans	-61.3	-48.7	177.5	-178.9	-177.6	174.6	-147.9	-0.6	111	R845 D846 R851 K852 V853	R845-R849 VanDerWaalsContact O-CB 3.23Å; R845-R849 WeakPolarHBondContact O-CB 3.27Å; R845-R849 PolarHBondContact O-N 3.35Å; D846-R849 PolarHBondContact O-N 2.71Å; R849-R851 VanDerWaalsContact C-N 3.32Å; R849-R851 PolarHBondContact O-N 2.81Å; R849-K852 PolarHBondContact O-N 3.43Å; R849-V853 WeakPolarHBondContact O-CB 3.48Å; R849-V853 VanDerWaalsContact O-CG2 3.27Å; R849-V853 WeakPolarHBondContact O-CG2 3.29Å; R849-V853 PolarHBondContact O-N 2.71Å
850	K	95.6	Very high	94.7	Very high	148 Å²	148	99.2 Å²	99.2	64%	0.643	49%	0.491	S	S	*	.	H	α-helix	trans	-61.4	-40	177	-73.5	169.7	-171.5	177.8	0	111.7	D846 A847 K854	D846-K850 VanDerWaalsContact O-CB 3.31Å; D846-K850 WeakPolarHBondContact O-CB 3.38Å; D846-K850 WeakPolarHBondContact O-CG 3.1Å; D846-K850 PolarHBondContact O-N 2.7Å; A847-K850 PolarHBondContact O-N 2.83Å; K850-K854 WeakPolarHBondContact O-CB 3.38Å; K850-K854 PolarHBondContact O-N 2.97Å
851	R	95.5	Very high	94.5	Very high	166 Å²	166	99.9 Å²	99.9	63%	0.626	50%	0.5	S	S	*	.	H	α-helix	trans	-61.9	-54.5	174	179.5	-179.4	167.6	176.6	-2.3	111.5	A847 E848 R849 V853 K854 E855	A847-R851 WeakPolarHBondContact O-CB 3.34Å; A847-R851 PolarHBondContact O-N 3.39Å; E848-R851 PolarHBondContact O-N 3.22Å; R849-R851 VanDerWaalsContact C-N 3.32Å; R849-R851 PolarHBondContact O-N 2.81Å; R851-V853 VanDerWaalsContact C-N 3.33Å; R851-V853 PolarHBondContact O-N 3.34Å; R851-K854 WeakPolarHBondContact O-CB 3.43Å; R851-K854 PolarHBondContact O-N 3.08Å; R851-E855 HydrophobicContact CG-CG 4.46Å; R851-E855 IonicContact CZ-OE1 4Å; R851-E855 VanDerWaalsContact CZ-OE1 3.22Å; R851-E855 IonicContact NE-OE1 3.54Å; R851-E855 PolarHBondContact NE-OE1 2.7Å; R851-E855 IonicContact NE-OE2 3.22Å; R851-E855 IonicContact NH2-OE1 3.64Å; R851-E855 PolarHBondContact NH2-OE1 2.96Å; R851-E855 WeakPolarHBondContact O-CG 3.46Å; R851-E855 PolarHBondContact O-N 3.46Å
852	K	95.5	Very high	94.5	Very high	114 Å²	114	102.2 Å²	102.2	50%	0.496	52%	0.516	S	S	.	.	H	α-helix	trans	-59.4	-41.2	-179.8	-73.2	165.8	179.2	159.8	0	111.8	E848 R849 E855 L856	E848-K852 WeakPolarHBondContact O-CB 3.24Å; E848-K852 WeakPolarHBondContact O-CG 3.34Å; E848-K852 PolarHBondContact O-N 2.9Å; E848-K852 IonicContact OE2-NZ 2.62Å; E848-K852 PolarHBondContact OE2-NZ 3.14Å; R849-K852 PolarHBondContact O-N 3.43Å; K852-E855 PolarHBondContact O-N 3.17Å; K852-L856 WeakPolarHBondContact O-CB 3.27Å; K852-L856 VanDerWaalsContact O-CG 3.29Å; K852-L856 WeakPolarHBondContact O-CG 3.39Å; K852-L856 PolarHBondContact O-N 3.38Å
853	V	95.3	Very high	94.4	Very high	71 Å²	71	103.9 Å²	103.9	43%	0.43	52%	0.519	S	S	.	.	H	α-helix	trans	-63.1	-41.6	173.9	169.4	0	0	0	0	111.6	R849 R851 L856 L857	R849-V853 WeakPolarHBondContact O-CB 3.48Å; R849-V853 VanDerWaalsContact O-CG2 3.27Å; R849-V853 WeakPolarHBondContact O-CG2 3.29Å; R849-V853 PolarHBondContact O-N 2.71Å; R851-V853 VanDerWaalsContact C-N 3.33Å; R851-V853 PolarHBondContact O-N 3.34Å; V853-L856 PolarHBondContact O-N 2.73Å; V853-L857 HydrophobicContact CG1-CD1 3.86Å; V853-L857 HydrophobicContact CG1-CG 4.41Å; V853-L857 WeakPolarHBondContact O-CB 3.41Å; V853-L857 VanDerWaalsContact O-CG 3.29Å; V853-L857 WeakPolarHBondContact O-CG 3.22Å; V853-L857 PolarHBondContact O-N 3.12Å
854	K	95.3	Very high	94.1	Very high	166 Å²	166	103 Å²	103	72%	0.722	51%	0.513	S	S	*	.	H	α-helix	trans	-66	-39.4	175.6	-174.7	176.4	179.2	-178.9	0	112.4	K850 R851 G858	K850-K854 WeakPolarHBondContact O-CB 3.38Å; K850-K854 PolarHBondContact O-N 2.97Å; R851-K854 WeakPolarHBondContact O-CB 3.43Å; R851-K854 PolarHBondContact O-N 3.08Å; K854-G858 PolarHBondContact O-N 3.12Å
855	E	94.6	Very high	93.9	Very high	97 Å²	97	100 Å²	100	45%	0.453	51%	0.506	S	S	.	.	H	α-helix	trans	-64.5	-45	175.7	-72.2	167.9	159.9	0	0	111.2	R851 K852 G858 S859	R851-E855 HydrophobicContact CG-CG 4.46Å; R851-E855 IonicContact CZ-OE1 4Å; R851-E855 VanDerWaalsContact CZ-OE1 3.22Å; R851-E855 IonicContact NE-OE1 3.54Å; R851-E855 PolarHBondContact NE-OE1 2.7Å; R851-E855 IonicContact NE-OE2 3.22Å; R851-E855 IonicContact NH2-OE1 3.64Å; R851-E855 PolarHBondContact NH2-OE1 2.96Å; R851-E855 WeakPolarHBondContact O-CG 3.46Å; R851-E855 PolarHBondContact O-N 3.46Å; K852-E855 PolarHBondContact O-N 3.17Å; E855-G858 PolarHBondContact O-N 3.05Å; E855-S859 PolarHBondContact O-N 2.71Å
856	L	94.2	Very high	93.8	Very high	108 Å²	108	99.2 Å²	99.2	57%	0.565	51%	0.509	S	S	*	.	H	α-helix	trans	-64.9	-43.7	176.1	-72.1	169.1	0	0	0	113.2	K852 V853 G858 S859 L860	K852-L856 WeakPolarHBondContact O-CB 3.27Å; K852-L856 VanDerWaalsContact O-CG 3.29Å; K852-L856 WeakPolarHBondContact O-CG 3.39Å; K852-L856 PolarHBondContact O-N 3.38Å; V853-L856 PolarHBondContact O-N 2.73Å; L856-G858 VanDerWaalsContact C-N 3.26Å; L856-G858 PolarHBondContact O-N 3.31Å; L856-S859 WeakPolarHBondContact CA-OG 3.41Å; L856-S859 PolarHBondContact O-N 3.44Å; L856-S859 PolarHBondContact O-OG 2.83Å; L856-L860 WeakPolarHBondContact O-CG 3.25Å; L856-L860 PolarHBondContact O-N 2.92Å
857	L	93.9	Very high	93.5	Very high	108 Å²	108	103.1 Å²	103.1	57%	0.565	52%	0.519	S	S	*	.	H	α-helix	trans	-63.5	-34.6	174	-72.8	170.6	0	0	0	111.5	V853 L860 A861	V853-L857 HydrophobicContact CG1-CD1 3.86Å; V853-L857 HydrophobicContact CG1-CG 4.41Å; V853-L857 WeakPolarHBondContact O-CB 3.41Å; V853-L857 VanDerWaalsContact O-CG 3.29Å; V853-L857 WeakPolarHBondContact O-CG 3.22Å; V853-L857 PolarHBondContact O-N 3.12Å; L857-L860 HydrophobicContact CD2-CD1 4.48Å; L857-L860 PolarHBondContact O-N 3.26Å; L857-A861 WeakPolarHBondContact O-CB 3.13Å; L857-A861 PolarHBondContact O-N 3.48Å
858	G	94.1	Very high	93.2	Very high	37 Å²	37	104.9 Å²	104.9	38%	0.381	52%	0.516	S	S	.	.	H	α-helix	trans	-60.5	-47.3	170.1	0	0	0	0	0	112.6	K854 E855 L856 L860 A861 T862	K854-G858 PolarHBondContact O-N 3.12Å; E855-G858 PolarHBondContact O-N 3.05Å; L856-G858 VanDerWaalsContact C-N 3.26Å; L856-G858 PolarHBondContact O-N 3.31Å; G858-L860 VanDerWaalsContact C-N 3.35Å; G858-L860 PolarHBondContact O-N 2.58Å; G858-A861 PolarHBondContact O-N 3.35Å; G858-T862 PolarHBondContact O-N 3.15Å; G858-T862 PolarHBondContact O-OG1 2.99Å
859	S	93.2	Very high	92.8	Very high	49 Å²	49	102.2 Å²	102.2	34%	0.343	51%	0.512	S	S	.	.	H	α-helix	trans	-65.8	-35.2	178.3	60.1	0	0	0	0	113.3	E855 L856 T862 Q863	E855-S859 PolarHBondContact O-N 2.71Å; L856-S859 WeakPolarHBondContact CA-OG 3.41Å; L856-S859 PolarHBondContact O-N 3.44Å; L856-S859 PolarHBondContact O-OG 2.83Å; S859-T862 WeakPolarHBondContact CA-OG1 3.15Å; S859-T862 PolarHBondContact O-N 3.02Å; S859-T862 PolarHBondContact O-OG1 3.22Å; S859-Q863 WeakPolarHBondContact O-CG 3.4Å; S859-Q863 PolarHBondContact O-N 3.33Å
860	L	92.9	Very high	92.5	Very high	98 Å²	98	99 Å²	99	51%	0.513	51%	0.507	S	S	.	.	H	α-helix	trans	-66.9	-40	173.8	-71.6	168	0	0	0	111.4	L856 L857 G858 T862 Q863 E864	L856-L860 WeakPolarHBondContact O-CG 3.25Å; L856-L860 PolarHBondContact O-N 2.92Å; L857-L860 HydrophobicContact CD2-CD1 4.48Å; L857-L860 PolarHBondContact O-N 3.26Å; G858-L860 VanDerWaalsContact C-N 3.35Å; G858-L860 PolarHBondContact O-N 2.58Å; L860-T862 VanDerWaalsContact C-N 3.34Å; L860-T862 PolarHBondContact O-N 3.43Å; L860-Q863 PolarHBondContact O-N 3.37Å; L860-E864 PolarHBondContact O-N 2.97Å
861	A	91.9	Very high	92.1	Very high	60 Å²	60	97.2 Å²	97.2	50%	0.496	50%	0.5	S	S	.	.	H	α-helix	trans	-64.8	-35.9	175	0	0	0	0	0	112.5	L857 G858 G865	L857-A861 WeakPolarHBondContact O-CB 3.13Å; L857-A861 PolarHBondContact O-N 3.48Å; G858-A861 PolarHBondContact O-N 3.35Å; A861-G865 PolarHBondContact O-N 3.43Å
862	T	92.1	Very high	91.6	Very high	86 Å²	86	98.8 Å²	98.8	53%	0.528	51%	0.505	S	S	.	.	H	α-helix	trans	-67.3	-41.8	172.1	44.8	0	0	0	0	112.4	G858 S859 L860 E864 G865 E866	G858-T862 PolarHBondContact O-N 3.15Å; G858-T862 PolarHBondContact O-OG1 2.99Å; S859-T862 WeakPolarHBondContact CA-OG1 3.15Å; S859-T862 PolarHBondContact O-N 3.02Å; S859-T862 PolarHBondContact O-OG1 3.22Å; L860-T862 VanDerWaalsContact C-N 3.34Å; L860-T862 PolarHBondContact O-N 3.43Å; T862-E864 VanDerWaalsContact C-N 3.34Å; T862-E864 PolarHBondContact O-N 2.58Å; T862-G865 CarbonylContact O-C 3.59Å; T862-G865 WeakPolarHBondContact O-CA 3.33Å; T862-G865 PolarHBondContact O-N 3.23Å; T862-G865 VanDerWaalsContact O-N 3.11Å; T862-E866 WeakPolarHBondContact O-CG 3.43Å; T862-E866 PolarHBondContact O-N 2.95Å
863	Q	91.4	Very high	91.1	Very high	113 Å²	113	101 Å²	101	53%	0.528	52%	0.515	S	S	.	.	H	α-helix	trans	-62.1	-39.7	174.4	-73.9	176.9	-7.6	0	0	112.3	S859 L860 G865 E866 W867	S859-Q863 WeakPolarHBondContact O-CG 3.4Å; S859-Q863 PolarHBondContact O-N 3.33Å; L860-Q863 PolarHBondContact O-N 3.37Å; Q863-G865 VanDerWaalsContact C-N 3.3Å; Q863-G865 PolarHBondContact O-N 2.94Å; Q863-E866 PolarHBondContact O-N 3.03Å; Q863-W867 WeakPolarHBondContact O-CB 3.45Å; Q863-W867 PolarHBondContact O-N 3.25Å
864	E	90.9	Very high	90.4	Very high	101 Å²	101	106.5 Å²	106.5	47%	0.472	53%	0.533	S	S	.	.	H	α-helix	trans	-65.5	-35.8	174.3	-157	-144.3	-179.6	0	0	111.5	L860 T862 K868	L860-E864 PolarHBondContact O-N 2.97Å; T862-E864 VanDerWaalsContact C-N 3.34Å; T862-E864 PolarHBondContact O-N 2.58Å; E864-K868 WeakPolarHBondContact O-CB 3.46Å; E864-K868 WeakPolarHBondContact O-CD 3.38Å; E864-K868 WeakPolarHBondContact O-CG 3.48Å; E864-K868 PolarHBondContact O-N 3.38Å; E864-K868 WeakPolarHBondContact OE1-CE 3.48Å; E864-K868 IonicContact OE1-NZ 2.7Å; E864-K868 IonicContact OE2-NZ 2.65Å; E864-K868 PolarHBondContact OE1-NZ 2.83Å; E864-K868 PolarHBondContact OE2-NZ 2.83Å
865	G	91	Very high	89.5	Confident	37 Å²	37	109 Å²	109	38%	0.381	54%	0.538	S	S	.	.	H	α-helix	trans	-62.4	-46.6	171.3	0	0	0	0	0	113.2	A861 T862 Q863 K868 A869	A861-G865 PolarHBondContact O-N 3.43Å; T862-G865 CarbonylContact O-C 3.59Å; T862-G865 WeakPolarHBondContact O-CA 3.33Å; T862-G865 PolarHBondContact O-N 3.23Å; T862-G865 VanDerWaalsContact O-N 3.11Å; Q863-G865 VanDerWaalsContact C-N 3.3Å; Q863-G865 PolarHBondContact O-N 2.94Å; G865-K868 PolarHBondContact O-N 3.37Å; G865-A869 WeakPolarHBondContact O-CB 3.35Å; G865-A869 PolarHBondContact O-N 2.8Å
866	E	90.6	Very high	87.9	Confident	127 Å²	127	115.8 Å²	115.8	59%	0.593	57%	0.566	S	S	*	*	H	α-helix	trans	-62.5	-43.8	174.8	-71.5	176.4	164.4	0	0	111.7	T862 Q863 K868 A869 L870	T862-E866 WeakPolarHBondContact O-CG 3.43Å; T862-E866 PolarHBondContact O-N 2.95Å; Q863-E866 PolarHBondContact O-N 3.03Å; E866-K868 PolarHBondContact O-N 3.44Å; E866-A869 CarbonylContact O-C 3.56Å; E866-A869 WeakPolarHBondContact O-CB 3.3Å; E866-A869 PolarHBondContact O-N 2.89Å; E866-A869 VanDerWaalsContact O-N 3.15Å; E866-L870 WeakPolarHBondContact O-CG 3.46Å; E866-L870 PolarHBondContact O-N 2.81Å
867	W	89.4	Confident	87.6	Confident	144 Å²	144	116.2 Å²	116.2	55%	0.545	57%	0.566	S	S	.	*	H	α-helix	trans	-63	-41.7	174.8	-178.4	91.1	0	0	0	112	Q863 A869 L870 K871	Q863-W867 WeakPolarHBondContact O-CB 3.45Å; Q863-W867 PolarHBondContact O-N 3.25Å; W867-A869 VanDerWaalsContact C-N 3.31Å; W867-A869 PolarHBondContact O-N 3.02Å; W867-L870 PolarHBondContact O-N 3.06Å; W867-K871 PolarHBondContact O-N 3.24Å; W867-K871 WeakPolarHBondContact O-CB 3.22Å; W867-K871 VanDerWaalsContact O-CB 3.3Å; W867-K871 HydrophobicContact CZ3-CD 3.82Å; W867-K871 HydrophobicContact CH2-CD 3.61Å; W867-K871 HydrophobicContact CE3-CD 4.45Å; W867-K871 HydrophobicContact CZ2-CD 4.04Å
868	K	90	Very high	87.3	Confident	94 Å²	94	116.6 Å²	116.6	41%	0.409	57%	0.566	S	S	.	*	H	α-helix	trans	-62	-37.8	172.1	-77	166.4	179.9	168.2	0	111.5	E864 G865 E866 R872	E864-K868 WeakPolarHBondContact O-CB 3.46Å; E864-K868 WeakPolarHBondContact O-CD 3.38Å; E864-K868 WeakPolarHBondContact O-CG 3.48Å; E864-K868 PolarHBondContact O-N 3.38Å; E864-K868 WeakPolarHBondContact OE1-CE 3.48Å; E864-K868 IonicContact OE1-NZ 2.7Å; E864-K868 IonicContact OE2-NZ 2.65Å; E864-K868 PolarHBondContact OE1-NZ 2.83Å; E864-K868 PolarHBondContact OE2-NZ 2.83Å; G865-K868 PolarHBondContact O-N 3.37Å; E866-K868 PolarHBondContact O-N 3.44Å; K868-R872 WeakPolarHBondContact O-CG 3.47Å; K868-R872 PolarHBondContact O-N 2.76Å
869	A	87.8	Confident	86.9	Confident	49 Å²	49	121.1 Å²	121.1	41%	0.405	58%	0.577	S	S	.	*	H	α-helix	trans	-68	-43.1	175.2	0	0	0	0	0	112.2	G865 E866 W867 R872 K873	G865-A869 WeakPolarHBondContact O-CB 3.35Å; G865-A869 PolarHBondContact O-N 2.8Å; E866-A869 CarbonylContact O-C 3.56Å; E866-A869 WeakPolarHBondContact O-CB 3.3Å; E866-A869 PolarHBondContact O-N 2.89Å; E866-A869 VanDerWaalsContact O-N 3.15Å; W867-A869 VanDerWaalsContact C-N 3.31Å; W867-A869 PolarHBondContact O-N 3.02Å; A869-R872 PolarHBondContact O-N 3.18Å; A869-K873 PolarHBondContact O-N 3.36Å
870	L	87.3	Confident	86.6	Confident	106 Å²	106	125.3 Å²	125.3	56%	0.555	59%	0.59	S	S	*	*	H	α-helix	trans	-62.5	-42	172.8	-73.2	169.9	0	0	0	111.8	E866 W867 R872 K873 K874	E866-L870 WeakPolarHBondContact O-CG 3.46Å; E866-L870 PolarHBondContact O-N 2.81Å; W867-L870 PolarHBondContact O-N 3.06Å; L870-R872 VanDerWaalsContact C-N 3.3Å; L870-R872 PolarHBondContact O-N 2.94Å; L870-K873 CarbonylContact O-C 3.6Å; L870-K873 VanDerWaalsContact O-N 3.15Å; L870-K873 PolarHBondContact O-N 3.11Å; L870-K874 PolarHBondContact O-N 2.97Å
871	K	88.3	Confident	86.2	Confident	111 Å²	111	127 Å²	127	48%	0.483	60%	0.595	S	S	.	*	H	α-helix	trans	-66.2	-30.6	176	-170.5	170.2	-177.3	173.3	0	112.6	W867 R875	W867-K871 PolarHBondContact O-N 3.24Å; W867-K871 WeakPolarHBondContact O-CB 3.22Å; W867-K871 VanDerWaalsContact O-CB 3.3Å; W867-K871 HydrophobicContact CZ3-CD 3.82Å; W867-K871 HydrophobicContact CH2-CD 3.61Å; W867-K871 HydrophobicContact CE3-CD 4.45Å; W867-K871 HydrophobicContact CZ2-CD 4.04Å; K871-R875 PolarHBondContact O-N 3.11Å
872	R	84.9	Confident	85.8	Confident	198 Å²	198	131.5 Å²	131.5	75%	0.747	60%	0.602	S	S	*	*	H	α-helix	trans	-71.1	-41.9	168.2	-75.6	173.6	175.9	-178.6	-1.5	111.8	K868 A869 L870 K874 R875 K876	K868-R872 WeakPolarHBondContact O-CG 3.47Å; K868-R872 PolarHBondContact O-N 2.76Å; A869-R872 PolarHBondContact O-N 3.18Å; L870-R872 VanDerWaalsContact C-N 3.3Å; L870-R872 PolarHBondContact O-N 2.94Å; R872-K874 VanDerWaalsContact C-N 3.3Å; R872-K874 PolarHBondContact O-N 2.95Å; R872-R875 PolarHBondContact O-N 2.76Å; R872-R875 VanDerWaalsContact O-N 3.1Å; R872-K876 PolarHBondContact O-N 2.8Å
873	K	83.6	Confident	85.3	Confident	161 Å²	161	134.7 Å²	134.7	70%	0.7	61%	0.607	S	S	*	*	H	α-helix	trans	-64.3	-27.8	174.6	-77	-175	175	-176.2	0	113.7	A869 L870	A869-K873 PolarHBondContact O-N 3.36Å; L870-K873 CarbonylContact O-C 3.6Å; L870-K873 VanDerWaalsContact O-N 3.15Å; L870-K873 PolarHBondContact O-N 3.11Å
874	K	81.2	Confident	84.9	Confident	186 Å²	186	136.4 Å²	136.4	81%	0.809	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	0.5	172	-73.6	-167.3	173.7	-169.1	0	114.6	L870 R872	L870-K874 PolarHBondContact O-N 2.97Å; R872-K874 VanDerWaalsContact C-N 3.3Å; R872-K874 PolarHBondContact O-N 2.95Å
875	R	76.2	Confident	84.3	Confident	218 Å²	218	139.3 Å²	139.3	82%	0.823	63%	0.625	S	S	*	*			trans	-113.9	-3.9	176.8	-93.4	-173	163.8	-160.8	-4.8	113	K871 R872	K871-R875 PolarHBondContact O-N 3.11Å; R872-R875 PolarHBondContact O-N 2.76Å; R872-R875 VanDerWaalsContact O-N 3.1Å
876	K	61.9	Low	83.7	Confident	241 Å²	241	148.6 Å²	148.6	100%	1.048	65%	0.647	S	S	*	*			trans	-98.5	0	156.7	-71.7	-169.7	164.8	-165.8	0	107.9	R872	R872-K876 PolarHBondContact O-N 2.8Å

Retrieved 876 of 876 residues in 805.6 ms (Link to these results)

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