A0A5K4F0G0_SCHMA Loading...

TBC1 domain family member 31

Molecular adapter which is involved in cilium biogenesis. Part of a functional complex including OFD1 a centriolar protein involved in cilium assembly. Could regulate the cAMP-dependent phosphorylation of OFD1, and its subsequent ubiquitination by PJA2 which ultimately leads to its proteasomal degradation.

AlphaFold DB , UniProt , Accession A0A5K4F0G0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,025 aa.

						>A0A5K4F0G0_SCHMA|A0A5K4F0G0
MRGLFILREKSGVVFRNNPVNNLRGEILSICSSKSDSSDNNRPTISNQISAYHFSPGGYKLYFALNSGDLYCLDFVKNWYQLIASLNRGITYICLCEPRGYVLLGLNDNSIRILDEESGNEINSLSGHTYRISNISVQPVSGRYGLSTALSEAILWDLDTSTCRCRLHIGQKVNLVSVTFIPPCGEQIVSCFQDGSIYVWSTDSLQCLFRLINSDYPNPPYRTITFTSKGHYLFAAGRSPFVYLWDLKGHVNCLSQDSSDLYDSNSNNQFLHELIKLPEPLKSVRRIEWIPKSCLVDFNQFYHDSMISDELSGLLLLLGTDKRLRLLIRTHEYSTKSLACTENSPKHQLSKNSTSIYWKCLFTFGFGSLEDPLLSSFSVPAYGILDLSDCQGKQRNKSFNCHSLLAILDDHGLLHINDLSIVLNFLNSSSIPVIKVKNETSNEKSSLKHIENNKRNDFPNFKMFTSYNKNMCTTDSGLSHIREPTSAFLDRKRLRLLLREFGKFPNKYRLFIWRSVLQIPCNTQAFSVLQKKGIHPAYDLLSMRYPMRSQRLLKALQKTCSALAYWCPLFGETDWLPLFVFPFLKLHQNNLLHAFEVAATILINWCGTWFEFFPNPPINILCMIENIIAYADPVLYRHFVQYNITTEIYAWPLLQTGLSEVFNEDEWLCLWDSLICYSPSLLLAVVASYSICSRGSLLMVQNTDIFEAYYHSQSTLQISNIIERAHQLLTSTPSNIHPGRLLSSLMQTDSQNKNKENTCSSFQPLTSPYYPIITRYPKFIVNYHIQERERIREEEKEYLRQKATVEDMQRRAQLMMNEEHNWYRQQQLLLDAEDHRRTLLAEEENKLREQRKRLSALIREVKLHELSLAEESRCHFRQLDIRRRQCELNKLEQELTRLTNCRIDEIDSAAYAAELADLCEKLHQRRAETLAIINEQLQSRDRNQPSNKECLFLTISPYTNDSITQGRYLERNVNEGYSDSLDYVKSPVDSDVAKSNLKRNSSNNKFNSVTMFPFTSTKLGPQTVD
					

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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	36.9	Very low	59	Low	137 Å²	137	83.5 Å²	83.5	68%	0.675	40%	0.398	S	S	*	.				0	150.6	0	-63.1	173.2	-177.5	0	0	110.1
2	R	50.8	Low	60.9	Low	84 Å²	84	77 Å²	77	32%	0.317	37%	0.37	S	S	.	.			trans	-108.3	103.2	162	-73.6	-175.1	-176.1	167.5	3.4	108.4	N17 N18 S29	R2-N17 PolarHBondContact NH1-O 3.38Å; R2-N18 VanDerWaalsContact CZ-O 3.23Å; R2-N18 PolarHBondContact NH1-O 2.94Å; R2-N18 PolarHBondContact NH2-O 2.8Å; R2-S29 PolarHBondContact O-N 2.83Å; R2-S29 VanDerWaalsContact O-N 3.11Å
3	G	58.5	Low	62.4	Low	32 Å²	32	75.1 Å²	75.1	33%	0.33	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	120.8	177.5	0	0	0	0	0	111.8	F5 S29	G3-F5 VanDerWaalsContact O-CD2 3.23Å; G3-F5 WeakPolarHBondContact O-CD2 3.38Å; G3-F5 WeakPolarHBondContact O-CE2 3.18Å; G3-S29 CarbonylContact C-O 3.55Å; G3-S29 VanDerWaalsContact CA-O 3.28Å; G3-S29 WeakPolarHBondContact CA-O 3.41Å
4	L	61.1	Low	63.1	Low	16 Å²	16	70.4 Å²	70.4	8%	0.084	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	113.6	160.6	-169.4	72.6	0	0	0	107.9	I6 L28 S29 I30 C31 L73 Y80	L4-I6 HydrophobicContact CD2-CD1 4.38Å; L4-I6 HydrophobicContact CD2-CG1 4.22Å; L4-I6 HydrophobicContact CG-CG1 4.23Å; L4-L28 HydrophobicContact CB-CD1 4.27Å; L4-L28 HydrophobicContact CB-CD2 4.23Å; L4-L28 HydrophobicContact CB-CG 4.37Å; L4-L28 HydrophobicContact CD2-CD2 4.32Å; L4-S29 PolarHBondContact N-O 3.26Å; L4-I30 HydrophobicContact CB-CG1 4.32Å; L4-I30 HydrophobicContact CD2-CG1 4.46Å; L4-C31 PolarHBondContact O-N 2.97Å; L4-L73 HydrophobicContact CD2-CD2 3.84Å; L4-Y80 HydrophobicContact CD1-CD1 4.03Å; L4-Y80 HydrophobicContact CD1-CE1 3.84Å; L4-Y80 HydrophobicContact CD2-CD1 4.13Å; L4-Y80 HydrophobicContact CD2-CG 4.22Å
5	F	64.6	Low	63.6	Low	83 Å²	83	67.3 Å²	67.3	36%	0.364	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	102.9	-176.6	-66.4	-79.7	0	0	0	110.9	G3 C31 S33 K34	G3-F5 VanDerWaalsContact O-CD2 3.23Å; G3-F5 WeakPolarHBondContact O-CD2 3.38Å; G3-F5 WeakPolarHBondContact O-CE2 3.18Å; F5-C31 WeakPolarHBondContact CA-O 3.5Å; F5-C31 HydrophobicContact CD1-CB 3.97Å; F5-C31 HydrophobicContact CE1-CB 3.98Å; F5-S33 WeakPolarHBondContact CD1-O 3.22Å; F5-S33 WeakPolarHBondContact CE1-O 3.21Å; F5-K34 HydrophobicContact CB-CD 4.42Å; F5-K34 HydrophobicContact CB-CG 3.77Å; F5-K34 HydrophobicContact CD1-CB 4.49Å; F5-K34 HydrophobicContact CD1-CG 3.71Å; F5-K34 HydrophobicContact CD2-CG 4.22Å; F5-K34 HydrophobicContact CE1-CG 4.32Å; F5-K34 HydrophobicContact CG-CG 3.64Å
6	I	59.2	Low	63.4	Low	3 Å²	3	74.5 Å²	74.5	2%	0.015	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-84.1	-24.1	-161.2	-67.7	164	0	0	0	114	L4 R8 E9 I30 C31 F63 Y71	L4-I6 HydrophobicContact CD2-CD1 4.38Å; L4-I6 HydrophobicContact CD2-CG1 4.22Å; L4-I6 HydrophobicContact CG-CG1 4.23Å; I6-R8 PolarHBondContact O-N 2.92Å; I6-E9 PolarHBondContact O-N 3.18Å; I6-I30 HydrophobicContact CD1-CG2 3.4Å; I6-I30 HydrophobicContact CG1-CG2 4.44Å; I6-C31 PolarHBondContact N-O 2.89Å; I6-F63 HydrophobicContact CD1-CE2 3.45Å; I6-F63 VanDerWaalsContact CD1-CE2 3.45Å; I6-F63 HydrophobicContact CD1-CZ 3.37Å; I6-Y71 HydrophobicContact CG2-CD1 4Å; I6-Y71 HydrophobicContact CG2-CD2 4.41Å; I6-Y71 HydrophobicContact CG2-CE1 3.36Å; I6-Y71 HydrophobicContact CG2-CE2 3.84Å; I6-Y71 HydrophobicContact CG2-CG 4.48Å; I6-Y71 WeakPolarHBondContact CG2-OH 3.48Å
7	L	52.8	Low	63	Low	99 Å²	99	76.9 Å²	76.9	52%	0.518	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-61.7	-3	-170.7	-80.2	178.4	0	0	0	117.2	S32	L7-S32 WeakPolarHBondContact CB-O 3.41Å; L7-S32 VanDerWaalsContact CD1-O 3.32Å; L7-S32 WeakPolarHBondContact CD1-O 3.36Å; L7-S32 WeakPolarHBondContact CG-O 3.23Å
8	R	49.4	Very low	62.6	Low	172 Å²	172	80.5 Å²	80.5	65%	0.649	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-110.2	-17.9	-179.3	-64.5	-163.8	-173.9	-167.7	3.9	115.5	I6 D36	I6-R8 PolarHBondContact O-N 2.92Å; R8-D36 IonicContact CZ-OD2 3.63Å; R8-D36 IonicContact NH2-OD2 2.75Å; R8-D36 PolarHBondContact NH2-OD2 3.1Å
9	E	62.2	Low	62.1	Low	85 Å²	85	79 Å²	79	40%	0.397	39%	0.385	S	S	.	.			trans	-138.5	128	-166.6	-79.2	169.1	-164.5	0	0	109.7	I6 S11 R16 Y80	I6-E9 PolarHBondContact O-N 3.18Å; E9-S11 PolarHBondContact O-N 3.48Å; E9-R16 IonicContact OE1-NH2 2.68Å; E9-R16 IonicContact OE2-NH2 3.64Å; E9-Y80 WeakPolarHBondContact CB-OH 3.29Å; E9-Y80 PolarHBondContact OE2-OH 2.95Å
10	K	73.1	Confident	61.4	Low	159 Å²	159	79.9 Å²	79.9	69%	0.691	40%	0.395	S	S	*	.	S	Bend	trans	-70.6	-21.3	175.8	-73	-168.8	176.1	-170.4	0	112.8	L82	K10-L82 HydrophobicContact CB-CB 4.46Å; K10-L82 HydrophobicContact CD-CD2 4.13Å; K10-L82 HydrophobicContact CG-CD2 4.11Å; K10-L82 WeakPolarHBondContact O-CB 3.27Å; K10-L82 PolarHBondContact O-N 3.05Å
11	S	80.3	Confident	60.9	Low	48 Å²	48	81.8 Å²	81.8	34%	0.336	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.1	159.3	177.8	52.9	0	0	0	0	110.6	E9 Y80	E9-S11 PolarHBondContact O-N 3.48Å; S11-Y80 CarbonylContact C-O 3.6Å; S11-Y80 WeakPolarHBondContact CA-O 3.43Å; S11-Y80 WeakPolarHBondContact CB-O 3.41Å
12	G	81.7	Confident	61.9	Low	6 Å²	6	78.2 Å²	78.2	6%	0.062	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.5	-174.4	178.1	0	0	0	0	0	114.5	W79 Y80	G12-W79 CarbonylContact O-C 3.59Å; G12-W79 WeakPolarHBondContact O-CA 3.4Å; G12-Y80 VanDerWaalsContact C-CD1 3.46Å; G12-Y80 VanDerWaalsContact C-CE1 3.45Å; G12-Y80 VanDerWaalsContact CA-CE1 3.45Å; G12-Y80 PolarHBondContact N-O 3.2Å; G12-Y80 WeakPolarHBondContact O-CD1 3.27Å; G12-Y80 PolarHBondContact O-N 3.15Å
13	V	80.8	Confident	62.2	Low	52 Å²	52	80.1 Å²	80.1	32%	0.315	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	133.2	179.9	-176.8	0	0	0	0	111.1	F15 R16 N78 W79	V13-F15 WeakPolarHBondContact CG1-O 3.44Å; V13-R16 HydrophobicContact CB-CG 4.48Å; V13-R16 HydrophobicContact CG1-CG 4.44Å; V13-N78 WeakPolarHBondContact CA-O 3.48Å; V13-W79 HydrophobicContact CG2-CE3 3.86Å; V13-W79 HydrophobicContact CG2-CZ3 3.61Å
14	V	72.6	Confident	62.3	Low	10 Å²	10	81.7 Å²	81.7	6%	0.061	40%	0.402	C	S	.	.	S	Bend	trans	-77.7	-54.7	-178.2	-178.1	0	0	0	0	111.5	L28 L73 N78 Y80	V14-L28 HydrophobicContact CG1-CD1 4.34Å; V14-L28 HydrophobicContact CG1-CD2 3.59Å; V14-L73 HydrophobicContact CB-CD2 4.39Å; V14-L73 HydrophobicContact CG1-CD2 3.92Å; V14-L73 HydrophobicContact CG2-CD2 3.5Å; V14-N78 PolarHBondContact N-O 2.96Å; V14-Y80 HydrophobicContact CG2-CD1 4.27Å
15	F	70.5	Confident	62.4	Low	23 Å²	23	81 Å²	81	10%	0.101	40%	0.399	C	S	.	.			trans	-109.1	100.5	178	-53.2	-62.9	0	0	0	109.8	V13 N17 I27 L28 F75 N78 F399	V13-F15 WeakPolarHBondContact CG1-O 3.44Å; F15-N17 VanDerWaalsContact C-N 3.3Å; F15-I27 HydrophobicContact CE1-CB 4.47Å; F15-I27 HydrophobicContact CE1-CG2 3.65Å; F15-I27 HydrophobicContact CZ-CG2 3.69Å; F15-L28 HydrophobicContact CD1-CD1 4.36Å; F15-L28 HydrophobicContact CE1-CB 4.1Å; F15-L28 HydrophobicContact CE1-CD1 4.09Å; F15-F75 HydrophobicContact CE2-CD1 4.32Å; F15-F75 HydrophobicContact CZ-CD1 4.47Å; F15-N78 WeakPolarHBondContact CA-OD1 3.45Å; F15-N78 VanDerWaalsContact CB-OD1 3.29Å; F15-N78 WeakPolarHBondContact CB-OD1 3.44Å; F15-N78 VanDerWaalsContact CD2-OD1 3.24Å; F15-N78 WeakPolarHBondContact CD2-OD1 3.39Å; F15-N78 PolarHBondContact N-OD1 3.47Å; F15-N78 PolarHBondContact O-ND2 3.18Å; F15-F399 HydrophobicContact CE2-CZ 4.18Å; F15-F399 HydrophobicContact CZ-CZ 4.19Å
16	R	60.8	Low	62.5	Low	183 Å²	183	78.3 Å²	78.3	69%	0.691	39%	0.388	S	S	*	.	S	Bend	trans	-73.3	-21.5	174.4	-62.6	-172.9	-176.2	-164	0	113.3	E9 V13	E9-R16 IonicContact OE1-NH2 2.68Å; E9-R16 IonicContact OE2-NH2 3.64Å; V13-R16 HydrophobicContact CB-CG 4.48Å; V13-R16 HydrophobicContact CG1-CG 4.44Å
17	N	55.9	Low	63.1	Low	115 Å²	115	78.9 Å²	78.9	62%	0.615	39%	0.391	S	S	*	.	S	Bend	trans	-134.5	158	175.1	-70.6	-12	0	0	0	109	R2 F15	R2-N17 PolarHBondContact NH1-O 3.38Å; F15-N17 VanDerWaalsContact C-N 3.3Å
18	N	54.9	Low	64.2	Low	142 Å²	142	74.4 Å²	74.4	76%	0.759	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-49.6	141.2	170.5	-74.8	-7.8	0	0	0	111.8	R2	R2-N18 VanDerWaalsContact CZ-O 3.23Å; R2-N18 PolarHBondContact NH1-O 2.94Å; R2-N18 PolarHBondContact NH2-O 2.8Å
19	P	53.1	Low	65.7	Low	52 Å²	52	66.5 Å²	66.5	34%	0.338	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-61	151	176.1	27	-34.4	0	0	0	111.2	I27	P19-I27 HydrophobicContact CB-CG2 3.72Å; P19-I27 HydrophobicContact CG-CG2 4.38Å
20	V	49.5	Very low	66.4	Low	97 Å²	97	62.5 Å²	62.5	59%	0.588	32%	0.319	S	S	*	.	P	Polyproline II helix	trans	-101.6	131.8	176	-179.4	0	0	0	0	107.6	N22	V20-N22 PolarHBondContact O-N 3.43Å
21	N	49.7	Very low	66.4	Low	119 Å²	119	55.8 Å²	55.8	64%	0.636	29%	0.292	S	S	*	.			trans	-72.5	87.3	-176.5	-68.5	3.5	0	0	0	111.3
22	N	58.3	Low	65.7	Low	63 Å²	63	54 Å²	54	34%	0.337	28%	0.28	S	S	.	.			trans	-67	144.1	167.5	-79.3	-11	0	0	0	110.6	V20 R24 G25 E26 I421	V20-N22 PolarHBondContact O-N 3.43Å; N22-R24 PolarHBondContact O-N 2.86Å; N22-G25 PolarHBondContact O-N 3.12Å; N22-E26 PolarHBondContact ND2-OE2 2.88Å; N22-I421 WeakPolarHBondContact O-CG2 3.41Å
23	L	57	Low	64.5	Low	124 Å²	124	55.2 Å²	55.2	65%	0.649	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-22.7	174.8	-83	154.6	0	0	0	114.5	F425	L23-F425 HydrophobicContact CD2-CD1 3.64Å; L23-F425 HydrophobicContact CD2-CD2 4.26Å; L23-F425 HydrophobicContact CD2-CE1 3.55Å; L23-F425 HydrophobicContact CD2-CE2 4.19Å; L23-F425 HydrophobicContact CD2-CG 4.01Å; L23-F425 HydrophobicContact CD2-CZ 3.85Å; L23-F425 HydrophobicContact CG-CZ 4.39Å
24	R	60.5	Low	62.8	Low	64 Å²	64	57.3 Å²	57.3	24%	0.242	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	6	-179.5	-74.7	175.5	170.4	-99.8	13.1	114	N22 E26 F362 F364 D371 V422	N22-R24 PolarHBondContact O-N 2.86Å; R24-E26 PolarHBondContact O-N 3.37Å; R24-F362 HydrophobicContact CG-CZ 4.17Å; R24-F364 HydrophobicContact CB-CE1 4.18Å; R24-D371 IonicContact CZ-OD1 2.93Å; R24-D371 IonicContact CZ-OD2 2.75Å; R24-D371 VanDerWaalsContact CZ-OD2 3.24Å; R24-D371 IonicContact NH1-OD1 3.77Å; R24-D371 PolarHBondContact NH1-OD1 3.43Å; R24-D371 IonicContact NH1-OD2 3.5Å; R24-D371 PolarHBondContact NH1-OD2 3.33Å; R24-D371 VanDerWaalsContact NH2-CB 3.34Å; R24-D371 IonicContact NH2-OD2 2.83Å; R24-D371 PolarHBondContact NH2-OD2 3.03Å; R24-V422 VanDerWaalsContact O-CG2 3.28Å; R24-V422 WeakPolarHBondContact O-CG2 3.37Å
25	G	64.1	Low	61.1	Low	1 Å²	1	62.7 Å²	62.7	1%	0.01	33%	0.33	C	S	.	.			trans	69.2	4.7	-178.4	0	0	0	0	0	115.9	N22 I27 N417 D418	N22-G25 PolarHBondContact O-N 3.12Å; G25-I27 VanDerWaalsContact O-CG1 3.22Å; G25-I27 WeakPolarHBondContact O-CG1 3.46Å; G25-I27 PolarHBondContact O-N 3.47Å; G25-N417 CarbonylContact O-C 3.59Å; G25-N417 VanDerWaalsContact O-CA 3.32Å; G25-N417 WeakPolarHBondContact O-CA 3.46Å; G25-D418 PolarHBondContact O-N 3.34Å
26	E	67	Low	59.2	Low	28 Å²	28	67 Å²	67	13%	0.131	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	120.2	177.9	-175	-162.3	-140.2	0	0	111.1	N22 R24 H415 N417	N22-E26 PolarHBondContact ND2-OE2 2.88Å; R24-E26 PolarHBondContact O-N 3.37Å; E26-H415 IonicContact OE1-CE1 3.83Å; E26-H415 IonicContact OE1-CG 3.54Å; E26-H415 IonicContact OE1-ND1 2.67Å; E26-H415 PolarHBondContact OE1-ND1 2.98Å; E26-N417 VanDerWaalsContact CA-OD1 3.29Å; E26-N417 WeakPolarHBondContact CA-OD1 3.35Å
27	I	70.3	Confident	57.8	Low	15 Å²	15	63 Å²	63	8%	0.077	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	-40.4	-176.6	-33	174.8	0	0	0	110.8	F15 P19 G25 F399 L404 I416 D418	F15-I27 HydrophobicContact CE1-CB 4.47Å; F15-I27 HydrophobicContact CE1-CG2 3.65Å; F15-I27 HydrophobicContact CZ-CG2 3.69Å; P19-I27 HydrophobicContact CB-CG2 3.72Å; P19-I27 HydrophobicContact CG-CG2 4.38Å; G25-I27 VanDerWaalsContact O-CG1 3.22Å; G25-I27 WeakPolarHBondContact O-CG1 3.46Å; G25-I27 PolarHBondContact O-N 3.47Å; I27-F399 HydrophobicContact CD1-CE2 4.05Å; I27-F399 HydrophobicContact CD1-CZ 3.57Å; I27-F399 HydrophobicContact CG2-CE2 4.06Å; I27-F399 HydrophobicContact CG2-CZ 4.09Å; I27-L404 HydrophobicContact CD1-CD2 3.37Å; I27-I416 HydrophobicContact CD1-CG2 4.29Å; I27-I416 WeakPolarHBondContact CG1-O 3.45Å; I27-I416 PolarHBondContact N-O 2.99Å; I27-D418 HydrophobicContact CD1-CB 3.81Å; I27-D418 HydrophobicContact CG1-CB 4.21Å
28	L	76.9	Confident	57.1	Low	4 Å²	4	63.2 Å²	63.2	2%	0.021	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	142.6	-175.9	-164.5	72.8	0	0	0	109.6	L4 V14 F15 I30 L73 I416	L4-L28 HydrophobicContact CB-CD1 4.27Å; L4-L28 HydrophobicContact CB-CD2 4.23Å; L4-L28 HydrophobicContact CB-CG 4.37Å; L4-L28 HydrophobicContact CD2-CD2 4.32Å; V14-L28 HydrophobicContact CG1-CD1 4.34Å; V14-L28 HydrophobicContact CG1-CD2 3.59Å; F15-L28 HydrophobicContact CD1-CD1 4.36Å; F15-L28 HydrophobicContact CE1-CB 4.1Å; F15-L28 HydrophobicContact CE1-CD1 4.09Å; L28-I30 HydrophobicContact CD2-CD1 4.4Å; L28-I30 HydrophobicContact CD2-CG1 3.96Å; L28-I30 HydrophobicContact CG-CG1 4.42Å; L28-L73 HydrophobicContact CD2-CD2 4.48Å; L28-I416 HydrophobicContact CB-CB 4.49Å; L28-I416 HydrophobicContact CB-CD1 4.34Å; L28-I416 HydrophobicContact CD2-CD1 4.1Å; L28-I416 PolarHBondContact N-O 3.45Å; L28-I416 PolarHBondContact O-N 3.42Å
29	S	79.9	Confident	56	Low	6 Å²	6	61.9 Å²	61.9	4%	0.042	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	140.6	160.3	61.6	0	0	0	0	109.7	R2 G3 L4	R2-S29 PolarHBondContact O-N 2.83Å; R2-S29 VanDerWaalsContact O-N 3.11Å; G3-S29 CarbonylContact C-O 3.55Å; G3-S29 VanDerWaalsContact CA-O 3.28Å; G3-S29 WeakPolarHBondContact CA-O 3.41Å; L4-S29 PolarHBondContact N-O 3.26Å
30	I	77.7	Confident	55	Low	1 Å²	1	66.4 Å²	66.4	1%	0.005	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	129.3	-175.6	-60.7	157.4	0	0	0	108.9	L4 I6 L28 I49 F63 L73 L414 I416	L4-I30 HydrophobicContact CB-CG1 4.32Å; L4-I30 HydrophobicContact CD2-CG1 4.46Å; I6-I30 HydrophobicContact CD1-CG2 3.4Å; I6-I30 HydrophobicContact CG1-CG2 4.44Å; L28-I30 HydrophobicContact CD2-CD1 4.4Å; L28-I30 HydrophobicContact CD2-CG1 3.96Å; L28-I30 HydrophobicContact CG-CG1 4.42Å; I30-I49 HydrophobicContact CG2-CD1 4.14Å; I30-F63 HydrophobicContact CG2-CE2 4.14Å; I30-F63 HydrophobicContact CG2-CZ 4.35Å; I30-L73 HydrophobicContact CD1-CD1 3.45Å; I30-L73 VanDerWaalsContact CD1-CD1 3.45Å; I30-L73 HydrophobicContact CG1-CD1 4.47Å; I30-L414 HydrophobicContact CB-CB 4.24Å; I30-L414 HydrophobicContact CD1-CB 4.41Å; I30-L414 HydrophobicContact CD1-CD2 4.06Å; I30-L414 HydrophobicContact CD1-CG 4.3Å; I30-L414 PolarHBondContact N-O 2.89Å; I30-L414 PolarHBondContact O-N 3.05Å; I30-I416 HydrophobicContact CD1-CD1 3.64Å; I30-I416 HydrophobicContact CD1-CG1 4.5Å; I30-I416 HydrophobicContact CG1-CD1 4.49Å
31	C	73.3	Confident	54.5	Low	18 Å²	18	70 Å²	70	12%	0.122	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	147.5	179.5	-168.4	0	0	0	0	110.4	L4 F5 I6 S33 L413	L4-C31 PolarHBondContact O-N 2.97Å; F5-C31 WeakPolarHBondContact CA-O 3.5Å; F5-C31 HydrophobicContact CD1-CB 3.97Å; F5-C31 HydrophobicContact CE1-CB 3.98Å; I6-C31 PolarHBondContact N-O 2.89Å; C31-S33 PolarHBondContact SG-O 3.33Å; C31-S33 VanDerWaalsContact SG-O 3.42Å; C31-L413 HydrophobicContact CB-CD2 3.64Å; C31-L413 VanDerWaalsContact SG-CD2 3.52Å
32	S	65.6	Low	53.6	Low	10 Å²	10	74.7 Å²	74.7	7%	0.07	40%	0.404	C	S	.	.	S	Bend	trans	-77	-58.3	169.5	48.3	0	0	0	0	111.2	L7 N47	L7-S32 WeakPolarHBondContact CB-O 3.41Å; L7-S32 VanDerWaalsContact CD1-O 3.32Å; L7-S32 WeakPolarHBondContact CD1-O 3.36Å; L7-S32 WeakPolarHBondContact CG-O 3.23Å; S32-N47 WeakPolarHBondContact CB-O 3.47Å; S32-N47 PolarHBondContact OG-O 2.76Å
33	S	55.6	Low	52.5	Low	32 Å²	32	76.5 Å²	76.5	22%	0.224	42%	0.419	C	S	.	.			trans	-84.6	128.5	-171.3	56.3	0	0	0	0	114.7	F5 C31	F5-S33 WeakPolarHBondContact CD1-O 3.22Å; F5-S33 WeakPolarHBondContact CE1-O 3.21Å; C31-S33 PolarHBondContact SG-O 3.33Å; C31-S33 VanDerWaalsContact SG-O 3.42Å
34	K	44.9	Very low	51.6	Low	97 Å²	97	76.9 Å²	76.9	42%	0.422	43%	0.427	S	S	.	.			trans	-75.9	146.3	152.1	-74.8	-171.1	175.1	-175.4	0	109.8	F5 D36	F5-K34 HydrophobicContact CB-CD 4.42Å; F5-K34 HydrophobicContact CB-CG 3.77Å; F5-K34 HydrophobicContact CD1-CB 4.49Å; F5-K34 HydrophobicContact CD1-CG 3.71Å; F5-K34 HydrophobicContact CD2-CG 4.22Å; F5-K34 HydrophobicContact CE1-CG 4.32Å; F5-K34 HydrophobicContact CG-CG 3.64Å; K34-D36 WeakPolarHBondContact CB-OD2 3.48Å; K34-D36 PolarHBondContact O-N 3.1Å
35	S	38.2	Very low	51.1	Low	122 Å²	122	76.2 Å²	76.2	85%	0.853	43%	0.428	S	S	*	.			trans	-79.2	62	175.7	57.3	0	0	0	0	111.9
36	D	30.6	Very low	50.6	Low	114 Å²	114	80.5 Å²	80.5	61%	0.61	46%	0.457	S	S	*	.			trans	-100	58	178	-66.8	-43.2	0	0	0	111.2	R8 K34	R8-D36 IonicContact CZ-OD2 3.63Å; R8-D36 IonicContact NH2-OD2 2.75Å; R8-D36 PolarHBondContact NH2-OD2 3.1Å; K34-D36 WeakPolarHBondContact CB-OD2 3.48Å; K34-D36 PolarHBondContact O-N 3.1Å
37	S	31.7	Very low	50.7	Low	99 Å²	99	81 Å²	81	69%	0.692	46%	0.46	S	S	*	.			trans	-148.7	123.9	167.6	60.9	0	0	0	0	111.9	D39	S37-D39 PolarHBondContact O-N 3.32Å
38	S	40.2	Very low	51.1	Low	120 Å²	120	84 Å²	84	84%	0.839	47%	0.474	S	S	*	.			trans	-76.6	3.9	-176.4	45.8	0	0	0	0	115
39	D	30.9	Very low	51.5	Low	114 Å²	114	84.4 Å²	84.4	61%	0.61	48%	0.476	S	S	*	.	S	Bend	trans	-123.5	128.1	-168.2	-75.1	-81.1	0	0	0	113	S37	S37-D39 PolarHBondContact O-N 3.32Å
40	N	32.5	Very low	51.7	Low	146 Å²	146	85.7 Å²	85.7	78%	0.781	49%	0.485	S	S	*	.	S	Bend	trans	58.4	50.5	156.6	-66	-51.4	0	0	0	119.5	R42	N40-R42 VanDerWaalsContact C-N 3.26Å; N40-R42 PolarHBondContact O-N 2.97Å
41	N	39.4	Very low	52.2	Low	173 Å²	173	86 Å²	86	93%	0.925	49%	0.489	S	S	*	.	S	Bend	trans	52.2	16.6	135.1	-97.6	0.3	0	0	0	120.6
42	R	30.2	Very low	53.1	Low	218 Å²	218	86.4 Å²	86.4	82%	0.823	49%	0.487	S	S	*	.			trans	-140.5	114.8	165.6	-73.9	-171.7	174.8	-179.9	-1.5	109.7	N40 T44	N40-R42 VanDerWaalsContact C-N 3.26Å; N40-R42 PolarHBondContact O-N 2.97Å; R42-T44 PolarHBondContact O-N 2.8Å; R42-T44 VanDerWaalsContact O-N 3.16Å
43	P	36.8	Very low	54.3	Low	101 Å²	101	87.5 Å²	87.5	66%	0.656	49%	0.492	S	S	*	.			trans	-64.9	118.3	171.1	27.6	-32.7	0	0	0	108.9	I45	P43-I45 VanDerWaalsContact C-N 3.29Å; P43-I45 HydrophobicContact CB-CG1 4.11Å; P43-I45 HydrophobicContact CG-CD1 4.45Å; P43-I45 HydrophobicContact CG-CG1 4.36Å; P43-I45 PolarHBondContact O-N 3.05Å
44	T	37.7	Very low	56	Low	132 Å²	132	86 Å²	86	81%	0.81	48%	0.481	S	S	*	.			trans	-79.1	80.2	173.1	50.2	0	0	0	0	109.1	R42 S46	R42-T44 PolarHBondContact O-N 2.8Å; R42-T44 VanDerWaalsContact O-N 3.16Å; T44-S46 PolarHBondContact O-N 2.91Å
45	I	48.9	Very low	57.9	Low	50 Å²	50	81.4 Å²	81.4	26%	0.256	46%	0.461	S	S	.	.			trans	-71.9	77.3	-178.8	-49.9	173.5	0	0	0	109.4	P43 N47 Q48 H411	P43-I45 VanDerWaalsContact C-N 3.29Å; P43-I45 HydrophobicContact CB-CG1 4.11Å; P43-I45 HydrophobicContact CG-CD1 4.45Å; P43-I45 HydrophobicContact CG-CG1 4.36Å; P43-I45 PolarHBondContact O-N 3.05Å; I45-N47 VanDerWaalsContact C-N 3.33Å; I45-Q48 HydrophobicContact CG2-CG 3.78Å; I45-H411 WeakPolarHBondContact CD1-O 3.39Å
46	S	55.5	Low	59.7	Low	90 Å²	90	76.7 Å²	76.7	63%	0.629	43%	0.428	S	S	*	.			trans	-66.5	-35.5	179.2	60.2	0	0	0	0	112.5	T44	T44-S46 PolarHBondContact O-N 2.91Å
47	N	68.1	Low	61.7	Low	38 Å²	38	71.4 Å²	71.4	20%	0.203	40%	0.4	C	S	.	.	S	Bend	trans	-106.7	72.6	-172.8	-64	27.6	0	0	0	109.5	S32 I45	S32-N47 WeakPolarHBondContact CB-O 3.47Å; S32-N47 PolarHBondContact OG-O 2.76Å; I45-N47 VanDerWaalsContact C-N 3.33Å
48	Q	77.9	Confident	64	Low	79 Å²	79	66.7 Å²	66.7	37%	0.369	37%	0.367	S	S	.	.			trans	-73.2	158.7	167.4	-66.1	-176	-44.1	0	0	111	I45 N66 H411	I45-Q48 HydrophobicContact CG2-CG 3.78Å; Q48-N66 PolarHBondContact O-N 3.32Å; Q48-H411 PolarHBondContact NE2-O 3.29Å
49	I	85.8	Confident	66.1	Low	12 Å²	12	64.6 Å²	64.6	6%	0.062	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	126.8	174.4	-68.2	165.6	0	0	0	109	I30 Y52 F63 A64 L65 L408 L414	I30-I49 HydrophobicContact CG2-CD1 4.14Å; I49-Y52 HydrophobicContact CG2-CD1 4.01Å; I49-F63 HydrophobicContact CD1-CD2 4.24Å; I49-F63 HydrophobicContact CG1-CD2 4.29Å; I49-F63 HydrophobicContact CG2-CB 4.38Å; I49-A64 CarbonylContact C-O 3.51Å; I49-A64 WeakPolarHBondContact CA-O 3.33Å; I49-L65 HydrophobicContact CG1-CD2 3.78Å; I49-L408 HydrophobicContact CB-CD1 4.01Å; I49-L408 HydrophobicContact CG2-CD1 4.33Å; I49-L414 HydrophobicContact CD1-CB 3.42Å; I49-L414 VanDerWaalsContact CD1-CB 3.42Å; I49-L414 HydrophobicContact CD1-CD2 4.09Å; I49-L414 HydrophobicContact CD1-CG 4.4Å; I49-L414 HydrophobicContact CG2-CD2 4.48Å
50	S	84.8	Confident	68.8	Low	33 Å²	33	60.5 Å²	60.5	23%	0.231	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	-32.7	-170.8	74.8	0	0	0	0	113.7	A64 N66 I90	S50-A64 PolarHBondContact N-O 3.3Å; S50-N66 VanDerWaalsContact CB-OD1 3.25Å; S50-N66 WeakPolarHBondContact CB-OD1 3.4Å; S50-I90 WeakPolarHBondContact CB-O 3.31Å; S50-I90 PolarHBondContact OG-O 2.92Å
51	A	87.8	Confident	71.6	Confident	9 Å²	9	53.6 Å²	53.6	7%	0.074	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	151.5	178.8	0	0	0	0	0	109.9	F63 A64 I90 I93	A51-F63 CarbonylContact O-C 3.59Å; A51-F63 WeakPolarHBondContact O-CA 3.36Å; A51-A64 PolarHBondContact O-N 2.72Å; A51-I90 HydrophobicContact CB-CG2 4.21Å; A51-I93 HydrophobicContact CB-CD1 4.13Å; A51-I93 HydrophobicContact CB-CG1 3.99Å
52	Y	92.1	Very high	74.1	Confident	25 Å²	25	45.4 Å²	45.4	10%	0.098	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	144.4	176.9	57.4	-79.6	0	0	0	111.5	I49 Y62 S376 F377 S378 A406 L408 L414	I49-Y52 HydrophobicContact CG2-CD1 4.01Å; Y52-Y62 CarbonylContact C-O 3.16Å; Y52-Y62 WeakPolarHBondContact CA-O 3.22Å; Y52-S376 WeakPolarHBondContact OH-CB 3.39Å; Y52-S376 PolarHBondContact OH-O 3.37Å; Y52-S376 VanDerWaalsContact OH-O 3.12Å; Y52-S376 PolarHBondContact OH-OG 3.32Å; Y52-F377 VanDerWaalsContact OH-CA 3.25Å; Y52-F377 WeakPolarHBondContact OH-CA 3.5Å; Y52-F377 PolarHBondContact OH-N 2.81Å; Y52-F377 VanDerWaalsContact OH-N 3.14Å; Y52-S378 WeakPolarHBondContact CD2-OG 3.45Å; Y52-S378 WeakPolarHBondContact CE2-OG 3.48Å; Y52-A406 HydrophobicContact CD2-CB 3.99Å; Y52-A406 HydrophobicContact CE2-CB 3.98Å; Y52-L408 HydrophobicContact CE1-CB 3.69Å; Y52-L408 HydrophobicContact CE1-CD2 4.01Å; Y52-L408 HydrophobicContact CE1-CG 4.35Å; Y52-L408 WeakPolarHBondContact OH-CB 3.34Å; Y52-L408 PolarHBondContact OH-N 2.9Å; Y52-L414 HydrophobicContact CD1-CD1 4.1Å; Y52-L414 HydrophobicContact CD2-CD1 3.66Å; Y52-L414 HydrophobicContact CD2-CD2 4.3Å; Y52-L414 HydrophobicContact CE1-CD1 4.1Å; Y52-L414 HydrophobicContact CE2-CD1 3.63Å; Y52-L414 HydrophobicContact CG-CD1 3.91Å; Y52-L414 HydrophobicContact CG-CD2 4.06Å
53	H	91.6	Very high	77	Confident	34 Å²	34	35 Å²	35	16%	0.157	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	131.6	-173.8	-164.2	-76.2	0	0	0	110.5	Y62 I93	H53-Y62 PolarHBondContact N-O 3.26Å; H53-Y62 PolarHBondContact O-N 3.5Å; H53-I93 HydrophobicContact CB-CB 3.91Å; H53-I93 HydrophobicContact CB-CG2 3.98Å; H53-I93 WeakPolarHBondContact CB-O 3.31Å; H53-I93 PolarHBondContact CD2-O 3.42Å; H53-I93 VanDerWaalsContact CG-O 3.3Å
54	F	90.4	Very high	79.6	Confident	1 Å²	1	30.2 Å²	30.2	0%	0.004	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	153.8	172.9	-79.4	-82.6	0	0	0	111.8	K60 L61 F75 L95 S378 P380 L404 A406	F54-K60 CarbonylContact C-O 3.54Å; F54-K60 WeakPolarHBondContact CA-O 3.31Å; F54-L61 HydrophobicContact CD1-CB 3.92Å; F54-L61 HydrophobicContact CD1-CD1 4.03Å; F54-L61 HydrophobicContact CD1-CG 4.5Å; F54-L61 HydrophobicContact CD2-CD1 4Å; F54-L61 HydrophobicContact CE1-CB 3.99Å; F54-L61 HydrophobicContact CE1-CD1 4.2Å; F54-L61 HydrophobicContact CE1-CD2 4.44Å; F54-L61 HydrophobicContact CE1-CG 4.44Å; F54-L61 HydrophobicContact CE2-CD1 4.19Å; F54-L61 HydrophobicContact CG-CD1 3.93Å; F54-L61 HydrophobicContact CZ-CD1 4.28Å; F54-L61 HydrophobicContact CZ-CD2 4.45Å; F54-F75 HydrophobicContact CD1-CE2 4.3Å; F54-F75 AromaticContact CE1-CE2 3.8Å; F54-F75 HydrophobicContact CE1-CE2 3.8Å; F54-F75 HydrophobicContact CE1-CZ 4.27Å; F54-L95 WeakPolarHBondContact O-CD1 3.38Å; F54-S378 WeakPolarHBondContact CE2-O 3.43Å; F54-P380 HydrophobicContact CB-CB 4.09Å; F54-P380 HydrophobicContact CB-CG 3.9Å; F54-P380 HydrophobicContact CD1-CG 3.87Å; F54-P380 HydrophobicContact CD2-CG 4.02Å; F54-P380 HydrophobicContact CE1-CG 4.33Å; F54-P380 HydrophobicContact CE2-CG 4.44Å; F54-P380 HydrophobicContact CG-CB 4.43Å; F54-P380 HydrophobicContact CG-CG 3.7Å; F54-L404 HydrophobicContact CE1-CB 3.82Å; F54-L404 HydrophobicContact CE1-CD1 4.08Å; F54-L404 HydrophobicContact CZ-CB 3.78Å; F54-A406 HydrophobicContact CD2-CB 4.3Å; F54-A406 HydrophobicContact CE2-CB 3.35Å; F54-A406 HydrophobicContact CZ-CB 3.73Å
55	S	85.1	Confident	81.9	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.129	C	C	.	.			trans	-63.6	153	161.7	78.2	0	0	0	0	110.4	G57 G58 Y59 K60 E97	S55-G57 PolarHBondContact O-N 3.08Å; S55-G58 WeakPolarHBondContact O-CA 3.25Å; S55-G58 PolarHBondContact O-N 3.01Å; S55-Y59 VanDerWaalsContact OG-CD1 3.25Å; S55-Y59 WeakPolarHBondContact OG-CD1 3.42Å; S55-Y59 VanDerWaalsContact OG-CE1 3.27Å; S55-Y59 WeakPolarHBondContact OG-CE1 3.24Å; S55-Y59 PolarHBondContact OG-N 3.19Å; S55-K60 PolarHBondContact N-O 3.38Å; S55-K60 PolarHBondContact OG-N 3.43Å; S55-E97 VanDerWaalsContact CB-OE1 3.27Å; S55-E97 WeakPolarHBondContact CB-OE1 3.11Å
56	P	76.2	Confident	83.6	Confident	23 Å²	23	25.5 Å²	25.5	15%	0.149	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-40.8	136.3	156	-26.7	28.7	0	0	0	112.1	G58 Y59 E97 A381	P56-G58 PolarHBondContact O-N 3.21Å; P56-Y59 WeakPolarHBondContact O-CD1 3.43Å; P56-Y59 WeakPolarHBondContact O-CE1 3.5Å; P56-E97 WeakPolarHBondContact CB-OE1 3.5Å; P56-E97 WeakPolarHBondContact CD-OE1 3.24Å; P56-E97 HydrophobicContact CG-CB 4.41Å; P56-E97 HydrophobicContact CG-CG 3.99Å; P56-E97 WeakPolarHBondContact CG-OE1 3.45Å; P56-A381 WeakPolarHBondContact CA-O 3.32Å
57	G	73.3	Confident	84.9	Confident	3 Å²	3	23 Å²	23	3%	0.031	12%	0.119	C	C	.	.	G	3₁₀ helix	trans	67.7	-13.8	-173	0	0	0	0	0	116.7	S55 A381 H402	S55-G57 PolarHBondContact O-N 3.08Å; G57-A381 PolarHBondContact N-O 3.46Å; G57-H402 PolarHBondContact O-ND1 2.86Å
58	G	79.6	Confident	85.6	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	85.1	10	165.8	0	0	0	0	0	116.7	S55 P56 K60 F75	S55-G58 WeakPolarHBondContact O-CA 3.25Å; S55-G58 PolarHBondContact O-N 3.01Å; P56-G58 PolarHBondContact O-N 3.21Å; G58-K60 VanDerWaalsContact C-N 3.27Å; G58-K60 PolarHBondContact O-N 3.47Å; G58-F75 WeakPolarHBondContact O-CD2 3.3Å
59	Y	84	Confident	86.1	Confident	76 Å²	76	18.7 Å²	18.7	30%	0.298	10%	0.099	S	C	.	.	S	Bend	trans	-72.1	-21.2	-178.3	64.2	-88.1	0	0	0	113.2	S55 P56 F75 E97	S55-Y59 VanDerWaalsContact OG-CD1 3.25Å; S55-Y59 WeakPolarHBondContact OG-CD1 3.42Å; S55-Y59 VanDerWaalsContact OG-CE1 3.27Å; S55-Y59 WeakPolarHBondContact OG-CE1 3.24Å; S55-Y59 PolarHBondContact OG-N 3.19Å; P56-Y59 WeakPolarHBondContact O-CD1 3.43Å; P56-Y59 WeakPolarHBondContact O-CE1 3.5Å; Y59-F75 WeakPolarHBondContact O-CD2 3.28Å; Y59-F75 PolarHBondContact O-N 3.34Å; Y59-E97 VanDerWaalsContact CE1-OE1 3.26Å; Y59-E97 WeakPolarHBondContact CE1-OE1 3.4Å; Y59-E97 PolarHBondContact OH-OE1 2.84Å; Y59-E97 VanDerWaalsContact OH-OE1 3.13Å
60	K	87.9	Confident	86.4	Confident	28 Å²	28	18.1 Å²	18.1	12%	0.122	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	150.8	167.8	-69.2	170.6	-177.3	179.6	0	112.3	F54 S55 G58 Y62 L73 D74 E116	F54-K60 CarbonylContact C-O 3.54Å; F54-K60 WeakPolarHBondContact CA-O 3.31Å; S55-K60 PolarHBondContact N-O 3.38Å; S55-K60 PolarHBondContact OG-N 3.43Å; G58-K60 VanDerWaalsContact C-N 3.27Å; G58-K60 PolarHBondContact O-N 3.47Å; K60-Y62 HydrophobicContact CB-CD2 4.28Å; K60-Y62 HydrophobicContact CB-CE2 3.67Å; K60-Y62 HydrophobicContact CD-CE2 3.89Å; K60-Y62 WeakPolarHBondContact CD-OH 3.25Å; K60-Y62 HydrophobicContact CG-CE2 4.42Å; K60-L73 CarbonylContact C-O 3.57Å; K60-L73 WeakPolarHBondContact CA-O 3.42Å; K60-D74 HydrophobicContact CG-CB 4.19Å; K60-E116 IonicContact NZ-OE1 2.76Å; K60-E116 PolarHBondContact NZ-OE1 3.35Å
61	L	91.1	Very high	86.6	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	121.4	167.1	173.4	66	0	0	0	110.2	F54 C72 L73 F75 A406 L414 I416	F54-L61 HydrophobicContact CD1-CB 3.92Å; F54-L61 HydrophobicContact CD1-CD1 4.03Å; F54-L61 HydrophobicContact CD1-CG 4.5Å; F54-L61 HydrophobicContact CD2-CD1 4Å; F54-L61 HydrophobicContact CE1-CB 3.99Å; F54-L61 HydrophobicContact CE1-CD1 4.2Å; F54-L61 HydrophobicContact CE1-CD2 4.44Å; F54-L61 HydrophobicContact CE1-CG 4.44Å; F54-L61 HydrophobicContact CE2-CD1 4.19Å; F54-L61 HydrophobicContact CG-CD1 3.93Å; F54-L61 HydrophobicContact CZ-CD1 4.28Å; F54-L61 HydrophobicContact CZ-CD2 4.45Å; L61-C72 WeakPolarHBondContact O-CA 3.34Å; L61-L73 HydrophobicContact CB-CB 4.27Å; L61-L73 HydrophobicContact CD2-CD1 4.14Å; L61-L73 PolarHBondContact N-O 2.87Å; L61-L73 PolarHBondContact O-N 3.5Å; L61-F75 HydrophobicContact CB-CE2 3.67Å; L61-F75 HydrophobicContact CB-CZ 3.8Å; L61-F75 HydrophobicContact CD2-CZ 4.28Å; L61-A406 HydrophobicContact CD1-CB 4.35Å; L61-A406 HydrophobicContact CD2-CB 4.26Å; L61-L414 HydrophobicContact CD2-CD2 4.22Å; L61-I416 HydrophobicContact CD2-CD1 3.69Å; L61-I416 HydrophobicContact CD2-CG1 3.93Å
62	Y	91.7	Very high	86.8	Confident	1 Å²	1	17.4 Å²	17.4	0%	0.004	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	136.2	175.7	-69.1	-109.3	0	0	0	108.9	Y52 H53 K60 L70 Y71 C72 I83 L95 V102 E116	Y52-Y62 CarbonylContact C-O 3.16Å; Y52-Y62 WeakPolarHBondContact CA-O 3.22Å; H53-Y62 PolarHBondContact N-O 3.26Å; H53-Y62 PolarHBondContact O-N 3.5Å; K60-Y62 HydrophobicContact CB-CD2 4.28Å; K60-Y62 HydrophobicContact CB-CE2 3.67Å; K60-Y62 HydrophobicContact CD-CE2 3.89Å; K60-Y62 WeakPolarHBondContact CD-OH 3.25Å; K60-Y62 HydrophobicContact CG-CE2 4.42Å; Y62-L70 HydrophobicContact CD1-CD2 4.49Å; Y62-Y71 WeakPolarHBondContact CA-O 3.32Å; Y62-C72 HydrophobicContact CD1-CB 4.05Å; Y62-C72 HydrophobicContact CE1-CB 3.86Å; Y62-C72 HydrophobicContact CE2-CB 4.48Å; Y62-C72 HydrophobicContact CG-CB 4.44Å; Y62-C72 VanDerWaalsContact CZ-SG 3.52Å; Y62-I83 HydrophobicContact CD1-CD1 4.14Å; Y62-I83 HydrophobicContact CE1-CD1 3.48Å; Y62-I83 VanDerWaalsContact CE1-CD1 3.48Å; Y62-L95 HydrophobicContact CD1-CD2 4.28Å; Y62-L95 HydrophobicContact CD2-CD1 3.52Å; Y62-L95 HydrophobicContact CD2-CD2 4.03Å; Y62-L95 HydrophobicContact CD2-CG 4.37Å; Y62-L95 HydrophobicContact CE1-CD2 4.18Å; Y62-L95 HydrophobicContact CE2-CD1 3.83Å; Y62-L95 HydrophobicContact CE2-CD2 3.96Å; Y62-L95 HydrophobicContact CG-CD1 4.22Å; Y62-L95 HydrophobicContact CG-CD2 4.23Å; Y62-V102 HydrophobicContact CD1-CG1 4.36Å; Y62-V102 HydrophobicContact CD1-CG2 4.48Å; Y62-V102 HydrophobicContact CE1-CG2 3.97Å; Y62-E116 WeakPolarHBondContact OH-CG 3.5Å; Y62-E116 PolarHBondContact OH-OE1 3.03Å
63	F	91.5	Very high	86.6	Confident	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	147.3	176.6	65.5	-76.6	0	0	0	111.2	I6 I30 I49 A51 Y71 L73 L414	I6-F63 HydrophobicContact CD1-CE2 3.45Å; I6-F63 VanDerWaalsContact CD1-CE2 3.45Å; I6-F63 HydrophobicContact CD1-CZ 3.37Å; I30-F63 HydrophobicContact CG2-CE2 4.14Å; I30-F63 HydrophobicContact CG2-CZ 4.35Å; I49-F63 HydrophobicContact CD1-CD2 4.24Å; I49-F63 HydrophobicContact CG1-CD2 4.29Å; I49-F63 HydrophobicContact CG2-CB 4.38Å; A51-F63 CarbonylContact O-C 3.59Å; A51-F63 WeakPolarHBondContact O-CA 3.36Å; F63-Y71 VanDerWaalsContact CE1-CB 3.46Å; F63-Y71 HydrophobicContact CE2-CD2 4.18Å; F63-Y71 HydrophobicContact CE2-CG 4.19Å; F63-Y71 HydrophobicContact CZ-CD2 4.37Å; F63-Y71 AromaticContact CZ-CG 3.91Å; F63-Y71 HydrophobicContact CZ-CG 3.91Å; F63-Y71 PolarHBondContact N-O 3.44Å; F63-Y71 PolarHBondContact O-N 2.99Å; F63-L73 HydrophobicContact CD1-CD1 3.85Å; F63-L73 HydrophobicContact CE1-CD1 3.36Å; F63-L73 HydrophobicContact CE1-CG 3.79Å; F63-L73 HydrophobicContact CZ-CD1 4.22Å; F63-L414 HydrophobicContact CB-CD2 4.12Å; F63-L414 HydrophobicContact CG-CD2 4.37Å
64	A	90	Very high	86.4	Confident	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	144.4	-178.7	0	0	0	0	0	111.4	I49 S50 A51 D69 I90 I93	I49-A64 CarbonylContact C-O 3.51Å; I49-A64 WeakPolarHBondContact CA-O 3.33Å; S50-A64 PolarHBondContact N-O 3.3Å; A51-A64 PolarHBondContact O-N 2.72Å; A64-D69 CarbonylContact C-O 3.54Å; A64-D69 VanDerWaalsContact CA-O 3.28Å; A64-D69 WeakPolarHBondContact CA-O 3.3Å; A64-I90 HydrophobicContact CB-CB 3.66Å; A64-I90 HydrophobicContact CB-CD1 3.58Å; A64-I90 HydrophobicContact CB-CG1 4.17Å; A64-I90 HydrophobicContact CB-CG2 3.99Å; A64-I93 HydrophobicContact CB-CD1 4.03Å
65	L	87.7	Confident	86	Confident	4 Å²	4	15.7 Å²	15.7	2%	0.021	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	157.6	168	-61.5	-180	0	0	0	110.8	I49 S67 G68 D69 Y71	I49-L65 HydrophobicContact CG1-CD2 3.78Å; L65-S67 WeakPolarHBondContact CB-OG 3.46Å; L65-S67 PolarHBondContact O-N 2.88Å; L65-G68 PolarHBondContact O-N 3.11Å; L65-D69 HydrophobicContact CD1-CB 4.5Å; L65-D69 PolarHBondContact N-O 3.03Å; L65-Y71 HydrophobicContact CD1-CE2 3.9Å; L65-Y71 HydrophobicContact CG-CE2 4.35Å
66	N	83.5	Confident	85.6	Confident	79 Å²	79	20.8 Å²	20.8	42%	0.422	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-23.3	172.4	-82.6	-15	0	0	0	113.7	Q48 S50 G68	Q48-N66 PolarHBondContact O-N 3.32Å; S50-N66 VanDerWaalsContact CB-OD1 3.25Å; S50-N66 WeakPolarHBondContact CB-OD1 3.4Å; N66-G68 PolarHBondContact O-N 3.14Å
67	S	82.3	Confident	85.7	Confident	37 Å²	37	26.8 Å²	26.8	26%	0.259	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-20.2	172.1	47.1	0	0	0	0	113.8	L65 D69 N87	L65-S67 WeakPolarHBondContact CB-OG 3.46Å; L65-S67 PolarHBondContact O-N 2.88Å; S67-D69 VanDerWaalsContact CB-OD2 3.28Å; S67-D69 WeakPolarHBondContact CB-OD2 3.32Å; S67-D69 PolarHBondContact OG-OD2 3.36Å; S67-N87 CarbonylContact O-C 3.54Å; S67-N87 VanDerWaalsContact O-CA 3.25Å; S67-N87 WeakPolarHBondContact O-CA 3.46Å
68	G	84.1	Confident	86.1	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.147	C	C	.	.	S	Bend	trans	91.3	13.1	-171.7	0	0	0	0	0	114.5	L65 N66 L86 R88	L65-G68 PolarHBondContact O-N 3.11Å; N66-G68 PolarHBondContact O-N 3.14Å; G68-L86 PolarHBondContact O-N 2.82Å; G68-R88 WeakPolarHBondContact CA-O 3.5Å
69	D	88.6	Confident	86.4	Confident	27 Å²	27	34.2 Å²	34.2	14%	0.144	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	121.6	170.9	-60.9	-61	0	0	0	110.5	A64 L65 S67 Y71 L82 S85	A64-D69 CarbonylContact C-O 3.54Å; A64-D69 VanDerWaalsContact CA-O 3.28Å; A64-D69 WeakPolarHBondContact CA-O 3.3Å; L65-D69 HydrophobicContact CD1-CB 4.5Å; L65-D69 PolarHBondContact N-O 3.03Å; S67-D69 VanDerWaalsContact CB-OD2 3.28Å; S67-D69 WeakPolarHBondContact CB-OD2 3.32Å; S67-D69 PolarHBondContact OG-OD2 3.36Å; D69-Y71 HydrophobicContact CB-CD2 4.27Å; D69-Y71 HydrophobicContact CB-CE2 3.64Å; D69-L82 HydrophobicContact CB-CD1 3.84Å; D69-S85 VanDerWaalsContact OD1-CB 3.23Å; D69-S85 WeakPolarHBondContact OD1-CB 3.2Å; D69-S85 PolarHBondContact OD1-OG 3.35Å
70	L	90.3	Very high	86.6	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	120.8	174	177.8	73.7	0	0	0	110.4	Y62 I83 A84 I90 I93 V102 L104 L114	Y62-L70 HydrophobicContact CD1-CD2 4.49Å; L70-I83 HydrophobicContact CD2-CB 4.25Å; L70-I83 HydrophobicContact CD2-CG2 4.25Å; L70-I83 PolarHBondContact O-N 3.17Å; L70-A84 PolarHBondContact N-O 3.02Å; L70-A84 PolarHBondContact O-N 2.85Å; L70-I90 HydrophobicContact CB-CD1 4.23Å; L70-I93 HydrophobicContact CD1-CD1 3.72Å; L70-I93 HydrophobicContact CD1-CG1 4.47Å; L70-V102 HydrophobicContact CD2-CG1 4.26Å; L70-L104 HydrophobicContact CD1-CD2 4.11Å; L70-L104 HydrophobicContact CD2-CD1 4.09Å; L70-L104 HydrophobicContact CD2-CD2 4.13Å; L70-L114 HydrophobicContact CD2-CD1 4.07Å
71	Y	90.7	Very high	86.6	Confident	17 Å²	17	34.3 Å²	34.3	7%	0.067	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	150.4	173.6	-69.2	-94.6	0	0	0	111.1	I6 Y62 F63 L65 D69 Y80 Q81 L82	I6-Y71 HydrophobicContact CG2-CD1 4Å; I6-Y71 HydrophobicContact CG2-CD2 4.41Å; I6-Y71 HydrophobicContact CG2-CE1 3.36Å; I6-Y71 HydrophobicContact CG2-CE2 3.84Å; I6-Y71 HydrophobicContact CG2-CG 4.48Å; I6-Y71 WeakPolarHBondContact CG2-OH 3.48Å; Y62-Y71 WeakPolarHBondContact CA-O 3.32Å; F63-Y71 VanDerWaalsContact CE1-CB 3.46Å; F63-Y71 HydrophobicContact CE2-CD2 4.18Å; F63-Y71 HydrophobicContact CE2-CG 4.19Å; F63-Y71 HydrophobicContact CZ-CD2 4.37Å; F63-Y71 AromaticContact CZ-CG 3.91Å; F63-Y71 HydrophobicContact CZ-CG 3.91Å; F63-Y71 PolarHBondContact N-O 3.44Å; F63-Y71 PolarHBondContact O-N 2.99Å; L65-Y71 HydrophobicContact CD1-CE2 3.9Å; L65-Y71 HydrophobicContact CG-CE2 4.35Å; D69-Y71 HydrophobicContact CB-CD2 4.27Å; D69-Y71 HydrophobicContact CB-CE2 3.64Å; Y71-Y80 HydrophobicContact CD1-CD2 4.46Å; Y71-Q81 WeakPolarHBondContact CA-O 3.41Å; Y71-L82 HydrophobicContact CD1-CB 3.97Å; Y71-L82 HydrophobicContact CD1-CD1 4.41Å; Y71-L82 HydrophobicContact CD2-CD1 4.26Å; Y71-L82 HydrophobicContact CE1-CB 3.67Å; Y71-L82 HydrophobicContact CE1-CD1 4.05Å; Y71-L82 HydrophobicContact CE1-CG 4.42Å; Y71-L82 HydrophobicContact CE2-CD1 3.87Å
72	C	90.9	Very high	86.5	Confident	11 Å²	11	35.6 Å²	35.6	7%	0.074	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	138.9	167.3	177	0	0	0	0	110.2	L61 Y62 Y80 Q81 I83	L61-C72 WeakPolarHBondContact O-CA 3.34Å; Y62-C72 HydrophobicContact CD1-CB 4.05Å; Y62-C72 HydrophobicContact CE1-CB 3.86Å; Y62-C72 HydrophobicContact CE2-CB 4.48Å; Y62-C72 HydrophobicContact CG-CB 4.44Å; Y62-C72 VanDerWaalsContact CZ-SG 3.52Å; C72-Y80 CarbonylContact O-C 3.55Å; C72-Y80 VanDerWaalsContact O-CA 3.23Å; C72-Y80 WeakPolarHBondContact O-CA 3.42Å; C72-Q81 PolarHBondContact N-O 2.96Å; C72-Q81 PolarHBondContact O-N 3.22Å; C72-I83 HydrophobicContact CB-CD1 3.44Å; C72-I83 VanDerWaalsContact CB-CD1 3.44Å; C72-I83 HydrophobicContact CB-CG1 4.11Å
73	L	89.1	Confident	86.3	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	115.1	169.9	-77.8	151	0	0	0	108.3	L4 V14 L28 I30 K60 L61 F63 F75 I416	L4-L73 HydrophobicContact CD2-CD2 3.84Å; V14-L73 HydrophobicContact CB-CD2 4.39Å; V14-L73 HydrophobicContact CG1-CD2 3.92Å; V14-L73 HydrophobicContact CG2-CD2 3.5Å; L28-L73 HydrophobicContact CD2-CD2 4.48Å; I30-L73 HydrophobicContact CD1-CD1 3.45Å; I30-L73 VanDerWaalsContact CD1-CD1 3.45Å; I30-L73 HydrophobicContact CG1-CD1 4.47Å; K60-L73 CarbonylContact C-O 3.57Å; K60-L73 WeakPolarHBondContact CA-O 3.42Å; L61-L73 HydrophobicContact CB-CB 4.27Å; L61-L73 HydrophobicContact CD2-CD1 4.14Å; L61-L73 PolarHBondContact N-O 2.87Å; L61-L73 PolarHBondContact O-N 3.5Å; F63-L73 HydrophobicContact CD1-CD1 3.85Å; F63-L73 HydrophobicContact CE1-CD1 3.36Å; F63-L73 HydrophobicContact CE1-CG 3.79Å; F63-L73 HydrophobicContact CZ-CD1 4.22Å; L73-F75 HydrophobicContact CB-CZ 4.31Å; L73-I416 HydrophobicContact CD1-CD1 4.35Å
74	D	86.3	Confident	86	Confident	14 Å²	14	38 Å²	38	8%	0.075	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	105.7	172.9	-171.1	-40.1	0	0	0	108.5	K60 V76 K77 N78 W79	K60-D74 HydrophobicContact CG-CB 4.19Å; D74-V76 VanDerWaalsContact C-N 3.28Å; D74-V76 PolarHBondContact O-N 2.61Å; D74-V76 PolarHBondContact OD1-N 2.97Å; D74-V76 VanDerWaalsContact OD1-N 3.13Å; D74-K77 HydrophobicContact CB-CB 4.13Å; D74-K77 HydrophobicContact CB-CD 4.46Å; D74-K77 HydrophobicContact CB-CG 4.5Å; D74-K77 PolarHBondContact OD1-N 3.29Å; D74-K77 WeakPolarHBondContact OD2-CD 3.37Å; D74-K77 WeakPolarHBondContact OD2-CE 3.4Å; D74-K77 WeakPolarHBondContact OD2-CG 3.48Å; D74-K77 IonicContact OD2-NZ 2.98Å; D74-K77 PolarHBondContact OD2-NZ 2.94Å; D74-N78 WeakPolarHBondContact O-CA 3.25Å; D74-N78 PolarHBondContact O-N 2.94Å; D74-W79 PolarHBondContact N-O 2.81Å; D74-W79 PolarHBondContact O-N 2.66Å
75	F	82.1	Confident	85.8	Confident	9 Å²	9	40.9 Å²	40.9	4%	0.039	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-23.2	-176.7	-60.5	-70.7	0	0	0	112.5	F15 F54 G58 Y59 L61 L73 F399 L404 I416	F15-F75 HydrophobicContact CE2-CD1 4.32Å; F15-F75 HydrophobicContact CZ-CD1 4.47Å; F54-F75 HydrophobicContact CD1-CE2 4.3Å; F54-F75 AromaticContact CE1-CE2 3.8Å; F54-F75 HydrophobicContact CE1-CE2 3.8Å; F54-F75 HydrophobicContact CE1-CZ 4.27Å; G58-F75 WeakPolarHBondContact O-CD2 3.3Å; Y59-F75 WeakPolarHBondContact O-CD2 3.28Å; Y59-F75 PolarHBondContact O-N 3.34Å; L61-F75 HydrophobicContact CB-CE2 3.67Å; L61-F75 HydrophobicContact CB-CZ 3.8Å; L61-F75 HydrophobicContact CD2-CZ 4.28Å; L73-F75 HydrophobicContact CB-CZ 4.31Å; F75-F399 HydrophobicContact CB-CD1 4.18Å; F75-F399 HydrophobicContact CB-CE1 3.98Å; F75-F399 HydrophobicContact CD1-CE1 4.24Å; F75-F399 HydrophobicContact CG-CE1 4.24Å; F75-L404 HydrophobicContact CD1-CD1 4.47Å; F75-L404 HydrophobicContact CD2-CD1 3.64Å; F75-L404 HydrophobicContact CE2-CD1 3.73Å; F75-L404 HydrophobicContact CG-CD1 4.05Å; F75-L404 HydrophobicContact CZ-CD1 4.19Å; F75-I416 HydrophobicContact CE1-CD1 4.02Å; F75-I416 HydrophobicContact CE1-CG2 4.42Å; F75-I416 HydrophobicContact CZ-CD1 3.91Å; F75-I416 HydrophobicContact CZ-CG2 4.35Å
76	V	76.9	Confident	85.6	Confident	107 Å²	107	42 Å²	42	65%	0.648	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-41.2	179.6	178	0	0	0	0	110.5	D74 N78	D74-V76 VanDerWaalsContact C-N 3.28Å; D74-V76 PolarHBondContact O-N 2.61Å; D74-V76 PolarHBondContact OD1-N 2.97Å; D74-V76 VanDerWaalsContact OD1-N 3.13Å; V76-N78 VanDerWaalsContact C-N 3.29Å
77	K	78.9	Confident	85.5	Confident	149 Å²	149	44.6 Å²	44.6	65%	0.648	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-8.2	172.4	-61.7	177.6	-163.3	155.1	0	113.4	D74 W79	D74-K77 HydrophobicContact CB-CB 4.13Å; D74-K77 HydrophobicContact CB-CD 4.46Å; D74-K77 HydrophobicContact CB-CG 4.5Å; D74-K77 PolarHBondContact OD1-N 3.29Å; D74-K77 WeakPolarHBondContact OD2-CD 3.37Å; D74-K77 WeakPolarHBondContact OD2-CE 3.4Å; D74-K77 WeakPolarHBondContact OD2-CG 3.48Å; D74-K77 IonicContact OD2-NZ 2.98Å; D74-K77 PolarHBondContact OD2-NZ 2.94Å; K77-W79 HydrophobicContact CB-CB 4.15Å; K77-W79 PolarHBondContact O-N 2.85Å
78	N	81.2	Confident	85.6	Confident	50 Å²	50	48.7 Å²	48.7	27%	0.267	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	36.4	-175.2	-171.6	21.8	0	0	0	112.7	V13 V14 F15 D74 V76	V13-N78 WeakPolarHBondContact CA-O 3.48Å; V14-N78 PolarHBondContact N-O 2.96Å; F15-N78 WeakPolarHBondContact CA-OD1 3.45Å; F15-N78 VanDerWaalsContact CB-OD1 3.29Å; F15-N78 WeakPolarHBondContact CB-OD1 3.44Å; F15-N78 VanDerWaalsContact CD2-OD1 3.24Å; F15-N78 WeakPolarHBondContact CD2-OD1 3.39Å; F15-N78 PolarHBondContact N-OD1 3.47Å; F15-N78 PolarHBondContact O-ND2 3.18Å; D74-N78 WeakPolarHBondContact O-CA 3.25Å; D74-N78 PolarHBondContact O-N 2.94Å; V76-N78 VanDerWaalsContact C-N 3.29Å
79	W	85.8	Confident	85.6	Confident	109 Å²	109	49.3 Å²	49.3	41%	0.413	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	140.8	-166.8	-166	-94.4	0	0	0	112.4	G12 V13 D74 K77	G12-W79 CarbonylContact O-C 3.59Å; G12-W79 WeakPolarHBondContact O-CA 3.4Å; V13-W79 HydrophobicContact CG2-CE3 3.86Å; V13-W79 HydrophobicContact CG2-CZ3 3.61Å; D74-W79 PolarHBondContact N-O 2.81Å; D74-W79 PolarHBondContact O-N 2.66Å; K77-W79 HydrophobicContact CB-CB 4.15Å; K77-W79 PolarHBondContact O-N 2.85Å
80	Y	88.6	Confident	85.6	Confident	3 Å²	3	48 Å²	48	1%	0.012	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	149.8	172.2	76.7	-85.5	0	0	0	111.4	L4 E9 S11 G12 V14 Y71 C72	L4-Y80 HydrophobicContact CD1-CD1 4.03Å; L4-Y80 HydrophobicContact CD1-CE1 3.84Å; L4-Y80 HydrophobicContact CD2-CD1 4.13Å; L4-Y80 HydrophobicContact CD2-CG 4.22Å; E9-Y80 WeakPolarHBondContact CB-OH 3.29Å; E9-Y80 PolarHBondContact OE2-OH 2.95Å; S11-Y80 CarbonylContact C-O 3.6Å; S11-Y80 WeakPolarHBondContact CA-O 3.43Å; S11-Y80 WeakPolarHBondContact CB-O 3.41Å; G12-Y80 VanDerWaalsContact C-CD1 3.46Å; G12-Y80 VanDerWaalsContact C-CE1 3.45Å; G12-Y80 VanDerWaalsContact CA-CE1 3.45Å; G12-Y80 PolarHBondContact N-O 3.2Å; G12-Y80 WeakPolarHBondContact O-CD1 3.27Å; G12-Y80 PolarHBondContact O-N 3.15Å; V14-Y80 HydrophobicContact CG2-CD1 4.27Å; Y71-Y80 HydrophobicContact CD1-CD2 4.46Å; C72-Y80 CarbonylContact O-C 3.55Å; C72-Y80 VanDerWaalsContact O-CA 3.23Å; C72-Y80 WeakPolarHBondContact O-CA 3.42Å
81	Q	88.2	Confident	85.6	Confident	104 Å²	104	48.8 Å²	48.8	49%	0.486	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	137.5	-179.3	175.7	167	-23.5	0	0	112.1	Y71 C72 I83	Y71-Q81 WeakPolarHBondContact CA-O 3.41Å; C72-Q81 PolarHBondContact N-O 2.96Å; C72-Q81 PolarHBondContact O-N 3.22Å; Q81-I83 PolarHBondContact O-N 2.99Å
82	L	88.5	Confident	85.5	Confident	27 Å²	27	49.6 Å²	49.6	14%	0.141	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	119.3	162.6	178.1	69.5	0	0	0	109	K10 D69 Y71	K10-L82 HydrophobicContact CB-CB 4.46Å; K10-L82 HydrophobicContact CD-CD2 4.13Å; K10-L82 HydrophobicContact CG-CD2 4.11Å; K10-L82 WeakPolarHBondContact O-CB 3.27Å; K10-L82 PolarHBondContact O-N 3.05Å; D69-L82 HydrophobicContact CB-CD1 3.84Å; Y71-L82 HydrophobicContact CD1-CB 3.97Å; Y71-L82 HydrophobicContact CD1-CD1 4.41Å; Y71-L82 HydrophobicContact CD2-CD1 4.26Å; Y71-L82 HydrophobicContact CE1-CB 3.67Å; Y71-L82 HydrophobicContact CE1-CD1 4.05Å; Y71-L82 HydrophobicContact CE1-CG 4.42Å; Y71-L82 HydrophobicContact CE2-CD1 3.87Å
83	I	86.8	Confident	85.6	Confident	35 Å²	35	49.2 Å²	49.2	18%	0.179	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	-50.3	177.8	-68.1	-177.4	0	0	0	110.3	Y62 L70 C72 Q81 G119	Y62-I83 HydrophobicContact CD1-CD1 4.14Å; Y62-I83 HydrophobicContact CE1-CD1 3.48Å; Y62-I83 VanDerWaalsContact CE1-CD1 3.48Å; L70-I83 HydrophobicContact CD2-CB 4.25Å; L70-I83 HydrophobicContact CD2-CG2 4.25Å; L70-I83 PolarHBondContact O-N 3.17Å; C72-I83 HydrophobicContact CB-CD1 3.44Å; C72-I83 VanDerWaalsContact CB-CD1 3.44Å; C72-I83 HydrophobicContact CB-CG1 4.11Å; Q81-I83 PolarHBondContact O-N 2.99Å; I83-G119 VanDerWaalsContact CG2-CA 3.4Å
84	A	86.4	Confident	85.7	Confident	15 Å²	15	49.7 Å²	49.7	12%	0.124	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	148.4	-176.9	0	0	0	0	0	111.9	L70 L114	L70-A84 PolarHBondContact N-O 3.02Å; L70-A84 PolarHBondContact O-N 2.85Å; A84-L114 HydrophobicContact CB-CD1 3.62Å
85	S	85.6	Confident	85.8	Confident	62 Å²	62	49.6 Å²	49.6	43%	0.434	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	98.3	172.4	-65.8	0	0	0	0	109.1	D69	D69-S85 VanDerWaalsContact OD1-CB 3.23Å; D69-S85 WeakPolarHBondContact OD1-CB 3.2Å; D69-S85 PolarHBondContact OD1-OG 3.35Å
86	L	83	Confident	86	Confident	26 Å²	26	49.2 Å²	49.2	14%	0.136	25%	0.247	C	C	.	.			trans	-87.7	-7.8	-174.7	-65.6	178.1	0	0	0	113.7	G68 R88 I90 L104 L106	G68-L86 PolarHBondContact O-N 2.82Å; L86-R88 WeakPolarHBondContact O-CG 3.41Å; L86-R88 PolarHBondContact O-N 2.96Å; L86-I90 HydrophobicContact CD1-CD1 4.32Å; L86-I90 HydrophobicContact CD1-CG1 4.49Å; L86-L104 HydrophobicContact CD1-CD1 3.62Å; L86-L106 HydrophobicContact CD1-CD2 4.1Å
87	N	82.1	Confident	86	Confident	135 Å²	135	47 Å²	47	72%	0.722	23%	0.229	S	C	*	.	S	Bend	trans	51.7	24.8	-175.7	-64.1	-16.2	0	0	0	114	S67	S67-N87 CarbonylContact O-C 3.54Å; S67-N87 VanDerWaalsContact O-CA 3.25Å; S67-N87 WeakPolarHBondContact O-CA 3.46Å
88	R	83.6	Confident	85.9	Confident	123 Å²	123	43 Å²	43	46%	0.464	22%	0.219	S	C	.	.	S	Bend	trans	-141.4	129.6	-178.3	-66.3	-179	-171.8	-166.2	-0.5	108.6	G68 L86 I90 L106 D108	G68-R88 WeakPolarHBondContact CA-O 3.5Å; L86-R88 WeakPolarHBondContact O-CG 3.41Å; L86-R88 PolarHBondContact O-N 2.96Å; R88-I90 PolarHBondContact O-N 2.84Å; R88-L106 HydrophobicContact CB-CD2 4.29Å; R88-D108 VanDerWaalsContact CD-OD2 3.27Å; R88-D108 WeakPolarHBondContact CD-OD2 3.39Å; R88-D108 IonicContact CZ-OD2 2.72Å; R88-D108 IonicContact NE-OD2 3.73Å; R88-D108 IonicContact NH1-OD2 3.84Å; R88-D108 PolarHBondContact NH1-OD2 3.16Å
89	G	83.7	Confident	85.9	Confident	12 Å²	12	43.7 Å²	43.7	12%	0.124	22%	0.218	C	C	.	.			trans	-58.6	122	-179.7	0	0	0	0	0	112.4	N107	G89-N107 PolarHBondContact O-N 3.4Å; G89-N107 VanDerWaalsContact O-N 3.13Å; G89-N107 PolarHBondContact O-ND2 3.4Å
90	I	89.9	Confident	85.9	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	133.3	177.4	-65.4	160.4	0	0	0	108.8	S50 A51 A64 L70 L86 R88 I93 L104 G105 L106	S50-I90 WeakPolarHBondContact CB-O 3.31Å; S50-I90 PolarHBondContact OG-O 2.92Å; A51-I90 HydrophobicContact CB-CG2 4.21Å; A64-I90 HydrophobicContact CB-CB 3.66Å; A64-I90 HydrophobicContact CB-CD1 3.58Å; A64-I90 HydrophobicContact CB-CG1 4.17Å; A64-I90 HydrophobicContact CB-CG2 3.99Å; L70-I90 HydrophobicContact CB-CD1 4.23Å; L86-I90 HydrophobicContact CD1-CD1 4.32Å; L86-I90 HydrophobicContact CD1-CG1 4.49Å; R88-I90 PolarHBondContact O-N 2.84Å; I90-I93 HydrophobicContact CG2-CD1 4.47Å; I90-I93 HydrophobicContact CG2-CG1 3.8Å; I90-L104 HydrophobicContact CD1-CD1 4.27Å; I90-L104 HydrophobicContact CD1-CD2 4.46Å; I90-L104 HydrophobicContact CG2-CD2 4.25Å; I90-G105 CarbonylContact C-O 3.49Å; I90-G105 WeakPolarHBondContact CA-O 3.45Å; I90-L106 HydrophobicContact CB-CD2 4.44Å; I90-L106 HydrophobicContact CG1-CD2 3.66Å
91	T	88.5	Confident	85.9	Confident	15 Å²	15	41.9 Å²	41.9	9%	0.092	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	-29.2	-171.6	73.1	0	0	0	0	113.1	G105 N107 R131 I132	T91-G105 PolarHBondContact N-O 3.24Å; T91-G105 PolarHBondContact OG1-O 2.99Å; T91-N107 HydrophobicContact CG2-CB 4.38Å; T91-N107 VanDerWaalsContact CG2-OD1 3.25Å; T91-N107 WeakPolarHBondContact CG2-OD1 3.41Å; T91-R131 HydrophobicContact CG2-CG 4.01Å; T91-R131 VanDerWaalsContact CG2-NE 3.29Å; T91-I132 PolarHBondContact OG1-O 2.99Å
92	Y	90.1	Very high	86.1	Confident	35 Å²	35	37 Å²	37	14%	0.137	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	146.7	177.5	-153.1	-93.2	0	0	0	109.2	C94 G105 N134 I135	Y92-C94 HydrophobicContact CD1-CB 4.46Å; Y92-C94 HydrophobicContact CE1-CB 4.4Å; Y92-G105 PolarHBondContact O-N 3.38Å; Y92-N134 WeakPolarHBondContact CE1-OD1 3.28Å; Y92-N134 PolarHBondContact OH-OD1 3.49Å; Y92-N134 VanDerWaalsContact OH-OD1 3.09Å; Y92-I135 HydrophobicContact CD1-CB 3.88Å; Y92-I135 HydrophobicContact CD1-CD1 4.48Å; Y92-I135 HydrophobicContact CD1-CG1 4.09Å; Y92-I135 HydrophobicContact CE1-CB 4.34Å
93	I	92.1	Very high	86.3	Confident	3 Å²	3	35.8 Å²	35.8	2%	0.015	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	135.3	173.9	-57.6	171.2	0	0	0	106.5	A51 H53 A64 L70 I90 V102 L103 L104	A51-I93 HydrophobicContact CB-CD1 4.13Å; A51-I93 HydrophobicContact CB-CG1 3.99Å; H53-I93 HydrophobicContact CB-CB 3.91Å; H53-I93 HydrophobicContact CB-CG2 3.98Å; H53-I93 WeakPolarHBondContact CB-O 3.31Å; H53-I93 PolarHBondContact CD2-O 3.42Å; H53-I93 VanDerWaalsContact CG-O 3.3Å; A64-I93 HydrophobicContact CB-CD1 4.03Å; L70-I93 HydrophobicContact CD1-CD1 3.72Å; L70-I93 HydrophobicContact CD1-CG1 4.47Å; I90-I93 HydrophobicContact CG2-CD1 4.47Å; I90-I93 HydrophobicContact CG2-CG1 3.8Å; I93-V102 HydrophobicContact CG2-CG1 4.19Å; I93-L103 WeakPolarHBondContact CA-O 3.44Å; I93-L104 HydrophobicContact CB-CD2 4.35Å; I93-L104 HydrophobicContact CG1-CD2 3.86Å; I93-L104 HydrophobicContact CG2-CD2 4.08Å
94	C	90.9	Very high	86.5	Confident	9 Å²	9	34.1 Å²	34.1	6%	0.061	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	155.5	170.9	-167.8	0	0	0	0	109.1	Y92 L103 I135	Y92-C94 HydrophobicContact CD1-CB 4.46Å; Y92-C94 HydrophobicContact CE1-CB 4.4Å; C94-L103 HydrophobicContact CB-CB 4.37Å; C94-L103 PolarHBondContact N-O 3.15Å; C94-L103 PolarHBondContact O-N 3Å; C94-I135 HydrophobicContact CB-CB 3.92Å; C94-I135 HydrophobicContact CB-CG2 3.82Å; C94-I135 PolarHBondContact SG-O 3.2Å
95	L	89.2	Confident	86.8	Confident	12 Å²	12	33.4 Å²	33.4	6%	0.063	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	141.8	-172.7	-68.2	161.6	0	0	0	110.7	F54 Y62 V102	F54-L95 WeakPolarHBondContact O-CD1 3.38Å; Y62-L95 HydrophobicContact CD1-CD2 4.28Å; Y62-L95 HydrophobicContact CD2-CD1 3.52Å; Y62-L95 HydrophobicContact CD2-CD2 4.03Å; Y62-L95 HydrophobicContact CD2-CG 4.37Å; Y62-L95 HydrophobicContact CE1-CD2 4.18Å; Y62-L95 HydrophobicContact CE2-CD1 3.83Å; Y62-L95 HydrophobicContact CE2-CD2 3.96Å; Y62-L95 HydrophobicContact CG-CD1 4.22Å; Y62-L95 HydrophobicContact CG-CD2 4.23Å; L95-V102 HydrophobicContact CD2-CB 4.12Å; L95-V102 HydrophobicContact CD2-CG1 3.86Å; L95-V102 HydrophobicContact CD2-CG2 3.76Å
96	C	85.6	Confident	87	Confident	2 Å²	2	30.4 Å²	30.4	1%	0.014	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	72.5	178.8	179	0	0	0	0	109.2	P98 R99 G100 Y101 V137 G142	C96-P98 VanDerWaalsContact C-N 3.32Å; C96-R99 CarbonylContact O-C 3.6Å; C96-R99 PolarHBondContact O-N 3.46Å; C96-G100 PolarHBondContact O-N 2.99Å; C96-Y101 PolarHBondContact N-O 2.87Å; C96-Y101 PolarHBondContact O-N 2.79Å; C96-V137 HydrophobicContact CB-CG1 3.93Å; C96-V137 HydrophobicContact CB-CG2 4.34Å; C96-G142 VanDerWaalsContact SG-CA 3.54Å
97	E	77.8	Confident	87.2	Confident	59 Å²	59	33.2 Å²	33.2	28%	0.276	17%	0.167	S	C	.	.	G	3₁₀ helix	trans	-50.9	-38.7	179	-83.5	-176.6	-160.2	0	0	114.7	S55 P56 Y59 R99 G100	S55-E97 VanDerWaalsContact CB-OE1 3.27Å; S55-E97 WeakPolarHBondContact CB-OE1 3.11Å; P56-E97 WeakPolarHBondContact CB-OE1 3.5Å; P56-E97 WeakPolarHBondContact CD-OE1 3.24Å; P56-E97 HydrophobicContact CG-CB 4.41Å; P56-E97 HydrophobicContact CG-CG 3.99Å; P56-E97 WeakPolarHBondContact CG-OE1 3.45Å; Y59-E97 VanDerWaalsContact CE1-OE1 3.26Å; Y59-E97 WeakPolarHBondContact CE1-OE1 3.4Å; Y59-E97 PolarHBondContact OH-OE1 2.84Å; Y59-E97 VanDerWaalsContact OH-OE1 3.13Å; E97-R99 PolarHBondContact O-N 3.46Å; E97-G100 PolarHBondContact O-N 2.72Å; E97-G100 VanDerWaalsContact O-N 3.14Å
98	P	76.7	Confident	87.5	Confident	67 Å²	67	29.6 Å²	29.6	44%	0.435	15%	0.148	S	C	.	.	G	3₁₀ helix	trans	-59.1	-11	177.1	-25.5	34.4	0	0	0	115.4	C96 P139	C96-P98 VanDerWaalsContact C-N 3.32Å; P98-P139 VanDerWaalsContact CG-O 3.31Å; P98-P139 WeakPolarHBondContact CG-O 3.38Å
99	R	80.7	Confident	87.8	Confident	63 Å²	63	25.7 Å²	25.7	24%	0.238	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-130.3	-3.7	178.1	-59.4	-177.3	172.6	-143.2	-7.8	113.6	C96 E97 Y101 G142 D159	C96-R99 CarbonylContact O-C 3.6Å; C96-R99 PolarHBondContact O-N 3.46Å; E97-R99 PolarHBondContact O-N 3.46Å; R99-Y101 HydrophobicContact CB-CD1 4.11Å; R99-Y101 HydrophobicContact CB-CD2 3.85Å; R99-Y101 HydrophobicContact CB-CE1 4.11Å; R99-Y101 HydrophobicContact CB-CE2 3.88Å; R99-Y101 HydrophobicContact CB-CG 3.96Å; R99-Y101 HydrophobicContact CG-CE2 4.49Å; R99-Y101 WeakPolarHBondContact O-CD1 3.32Å; R99-Y101 WeakPolarHBondContact O-CE1 3.43Å; R99-G142 VanDerWaalsContact CD-O 3.32Å; R99-G142 WeakPolarHBondContact CD-O 3.38Å; R99-G142 PolarHBondContact NE-O 3.01Å; R99-G142 VanDerWaalsContact NE-O 3.11Å; R99-D159 IonicContact CZ-OD1 2.73Å; R99-D159 IonicContact CZ-OD2 3.08Å; R99-D159 VanDerWaalsContact NH1-CG 3.3Å; R99-D159 IonicContact NH1-OD1 3.53Å; R99-D159 PolarHBondContact NH1-OD1 3.28Å; R99-D159 IonicContact NH1-OD2 2.8Å; R99-D159 IonicContact NH2-OD1 3.2Å; R99-D159 PolarHBondContact NH2-OD1 2.93Å; R99-D159 IonicContact NH2-OD2 3.47Å; R99-D159 PolarHBondContact NH2-OD2 2.94Å
100	G	85.1	Confident	88.1	Confident	18 Å²	18	25.9 Å²	25.9	19%	0.186	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	39	-170.8	0	0	0	0	0	113.7	C96 E97 E116	C96-G100 PolarHBondContact O-N 2.99Å; E97-G100 PolarHBondContact O-N 2.72Å; E97-G100 VanDerWaalsContact O-N 3.14Å; G100-E116 WeakPolarHBondContact O-CB 3.37Å; G100-E116 PolarHBondContact O-N 3.39Å
101	Y	89.9	Confident	88.3	Confident	57 Å²	57	26 Å²	26	22%	0.224	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	138.2	-179.7	-59.1	-15.4	0	0	0	113	C96 R99 I113 L114 I122	C96-Y101 PolarHBondContact N-O 2.87Å; C96-Y101 PolarHBondContact O-N 2.79Å; R99-Y101 HydrophobicContact CB-CD1 4.11Å; R99-Y101 HydrophobicContact CB-CD2 3.85Å; R99-Y101 HydrophobicContact CB-CE1 4.11Å; R99-Y101 HydrophobicContact CB-CE2 3.88Å; R99-Y101 HydrophobicContact CB-CG 3.96Å; R99-Y101 HydrophobicContact CG-CE2 4.49Å; R99-Y101 WeakPolarHBondContact O-CD1 3.32Å; R99-Y101 WeakPolarHBondContact O-CE1 3.43Å; Y101-I113 HydrophobicContact CD2-CG2 3.87Å; Y101-I113 HydrophobicContact CG-CG2 3.91Å; Y101-L114 CarbonylContact C-O 3.54Å; Y101-L114 WeakPolarHBondContact CA-O 3.45Å; Y101-I122 HydrophobicContact CD1-CD1 3.41Å; Y101-I122 VanDerWaalsContact CD1-CD1 3.41Å; Y101-I122 HydrophobicContact CE1-CD1 3.36Å; Y101-I122 HydrophobicContact CG-CD1 4.16Å
102	V	91.2	Very high	88.5	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	117.4	171.8	-167.2	0	0	0	0	109.5	Y62 L70 I93 L95 L104 L114 E116	Y62-V102 HydrophobicContact CD1-CG1 4.36Å; Y62-V102 HydrophobicContact CD1-CG2 4.48Å; Y62-V102 HydrophobicContact CE1-CG2 3.97Å; L70-V102 HydrophobicContact CD2-CG1 4.26Å; I93-V102 HydrophobicContact CG2-CG1 4.19Å; L95-V102 HydrophobicContact CD2-CB 4.12Å; L95-V102 HydrophobicContact CD2-CG1 3.86Å; L95-V102 HydrophobicContact CD2-CG2 3.76Å; V102-L104 HydrophobicContact CG1-CD2 3.84Å; V102-L104 HydrophobicContact CG1-CG 4.27Å; V102-L114 HydrophobicContact CB-CB 4.29Å; V102-L114 PolarHBondContact N-O 2.83Å; V102-L114 PolarHBondContact O-N 3.34Å; V102-E116 HydrophobicContact CG2-CB 4.14Å; V102-E116 HydrophobicContact CG2-CG 4.26Å
103	L	92.6	Very high	88.6	Confident	2 Å²	2	25.8 Å²	25.8	1%	0.01	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	120.9	175.9	-60.4	-175.8	0	0	0	110.5	I93 C94 I111 R112 I113 I135 V137 L158	I93-L103 WeakPolarHBondContact CA-O 3.44Å; C94-L103 HydrophobicContact CB-CB 4.37Å; C94-L103 PolarHBondContact N-O 3.15Å; C94-L103 PolarHBondContact O-N 3Å; L103-I111 HydrophobicContact CB-CG2 4.16Å; L103-I111 HydrophobicContact CD2-CG2 4.49Å; L103-R112 WeakPolarHBondContact CA-O 3.36Å; L103-I113 HydrophobicContact CD2-CB 4.15Å; L103-I113 HydrophobicContact CD2-CD1 4.28Å; L103-I113 HydrophobicContact CD2-CG1 3.7Å; L103-I113 HydrophobicContact CD2-CG2 3.98Å; L103-I135 HydrophobicContact CB-CG2 4.21Å; L103-I135 HydrophobicContact CD1-CG2 3.85Å; L103-V137 HydrophobicContact CD1-CG2 3.47Å; L103-V137 VanDerWaalsContact CD1-CG2 3.47Å; L103-V137 HydrophobicContact CG-CG2 4.48Å; L103-L158 HydrophobicContact CD1-CD1 4.49Å; L103-L158 HydrophobicContact CD2-CD2 4.46Å
104	L	92.5	Very high	88.6	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	109.3	-177	-58.2	176.9	0	0	0	110.6	L70 L86 I90 I93 V102 I111 R112 L114	L70-L104 HydrophobicContact CD1-CD2 4.11Å; L70-L104 HydrophobicContact CD2-CD1 4.09Å; L70-L104 HydrophobicContact CD2-CD2 4.13Å; L86-L104 HydrophobicContact CD1-CD1 3.62Å; I90-L104 HydrophobicContact CD1-CD1 4.27Å; I90-L104 HydrophobicContact CD1-CD2 4.46Å; I90-L104 HydrophobicContact CG2-CD2 4.25Å; I93-L104 HydrophobicContact CB-CD2 4.35Å; I93-L104 HydrophobicContact CG1-CD2 3.86Å; I93-L104 HydrophobicContact CG2-CD2 4.08Å; V102-L104 HydrophobicContact CG1-CD2 3.84Å; V102-L104 HydrophobicContact CG1-CG 4.27Å; L104-I111 CarbonylContact O-C 3.34Å; L104-I111 VanDerWaalsContact O-CA 3.26Å; L104-I111 WeakPolarHBondContact O-CA 3.49Å; L104-R112 PolarHBondContact N-O 3.02Å; L104-R112 PolarHBondContact O-N 2.92Å; L104-L114 HydrophobicContact CD1-CD1 3.53Å; L104-L114 HydrophobicContact CD1-CG 3.81Å
105	G	91.6	Very high	88.5	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	131.7	168.4	0	0	0	0	0	110.3	I90 T91 Y92	I90-G105 CarbonylContact C-O 3.49Å; I90-G105 WeakPolarHBondContact CA-O 3.45Å; T91-G105 PolarHBondContact N-O 3.24Å; T91-G105 PolarHBondContact OG1-O 2.99Å; Y92-G105 PolarHBondContact O-N 3.38Å
106	L	90.7	Very high	88.3	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	157.8	-177.4	-69.6	-178.4	0	0	0	112.8	L86 R88 I90 D108 N109 S110 R112	L86-L106 HydrophobicContact CD1-CD2 4.1Å; R88-L106 HydrophobicContact CB-CD2 4.29Å; I90-L106 HydrophobicContact CB-CD2 4.44Å; I90-L106 HydrophobicContact CG1-CD2 3.66Å; L106-D108 WeakPolarHBondContact CB-OD1 3.45Å; L106-D108 PolarHBondContact O-N 3.42Å; L106-D108 VanDerWaalsContact O-N 3.1Å; L106-N109 PolarHBondContact O-N 3.19Å; L106-N109 VanDerWaalsContact O-N 3.1Å; L106-S110 PolarHBondContact N-O 3.26Å; L106-R112 HydrophobicContact CD1-CG 3.87Å; L106-R112 VanDerWaalsContact CD1-NE 3.34Å
107	N	87	Confident	88.2	Confident	84 Å²	84	36.3 Å²	36.3	45%	0.449	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-8.6	173.1	-87.9	-30.9	0	0	0	114.3	G89 T91 R131	G89-N107 PolarHBondContact O-N 3.4Å; G89-N107 VanDerWaalsContact O-N 3.13Å; G89-N107 PolarHBondContact O-ND2 3.4Å; T91-N107 HydrophobicContact CG2-CB 4.38Å; T91-N107 VanDerWaalsContact CG2-OD1 3.25Å; T91-N107 WeakPolarHBondContact CG2-OD1 3.41Å; N107-R131 VanDerWaalsContact OD1-CZ 3.3Å; N107-R131 PolarHBondContact OD1-NH1 2.86Å
108	D	87.3	Confident	88.5	Confident	59 Å²	59	36.7 Å²	36.7	32%	0.316	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	9.9	174.7	60.1	26.7	0	0	0	113.4	R88 L106 S110	R88-D108 VanDerWaalsContact CD-OD2 3.27Å; R88-D108 WeakPolarHBondContact CD-OD2 3.39Å; R88-D108 IonicContact CZ-OD2 2.72Å; R88-D108 IonicContact NE-OD2 3.73Å; R88-D108 IonicContact NH1-OD2 3.84Å; R88-D108 PolarHBondContact NH1-OD2 3.16Å; L106-D108 WeakPolarHBondContact CB-OD1 3.45Å; L106-D108 PolarHBondContact O-N 3.42Å; L106-D108 VanDerWaalsContact O-N 3.1Å; D108-S110 PolarHBondContact O-N 3.09Å; D108-S110 VanDerWaalsContact OD1-CB 3.29Å; D108-S110 WeakPolarHBondContact OD1-CB 3.36Å; D108-S110 PolarHBondContact OD1-N 3.1Å; D108-S110 PolarHBondContact OD1-OG 3.38Å
109	N	90.3	Very high	88.8	Confident	42 Å²	42	34 Å²	34	23%	0.225	18%	0.176	C	C	.	.	S	Bend	trans	66.6	10.2	-177.5	-45.2	-24.9	0	0	0	115.1	L106 H128 T129 Y130 R131	L106-N109 PolarHBondContact O-N 3.19Å; L106-N109 VanDerWaalsContact O-N 3.1Å; N109-H128 HydrophobicContact CB-CB 4.26Å; N109-H128 WeakPolarHBondContact CB-O 3.42Å; N109-T129 PolarHBondContact ND2-O 3.4Å; N109-T129 VanDerWaalsContact ND2-O 3.13Å; N109-Y130 PolarHBondContact OD1-O 3.31Å; N109-R131 WeakPolarHBondContact OD1-CA 3.42Å; N109-R131 PolarHBondContact OD1-N 2.91Å
110	S	91.1	Very high	89.2	Confident	16 Å²	16	36 Å²	36	11%	0.112	19%	0.192	C	C	.	.			trans	-90.8	158.7	168.3	73.4	0	0	0	0	112.2	L106 D108 L125 I132	L106-S110 PolarHBondContact N-O 3.26Å; D108-S110 PolarHBondContact O-N 3.09Å; D108-S110 VanDerWaalsContact OD1-CB 3.29Å; D108-S110 WeakPolarHBondContact OD1-CB 3.36Å; D108-S110 PolarHBondContact OD1-N 3.1Å; D108-S110 PolarHBondContact OD1-OG 3.38Å; S110-L125 WeakPolarHBondContact CA-O 3.24Å; S110-I132 WeakPolarHBondContact O-CD1 3.48Å
111	I	93.1	Very high	89.3	Confident	2 Å²	2	38.8 Å²	38.8	1%	0.01	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	122.7	166.8	-52.9	163.8	0	0	0	107.4	L103 L104 S124 L125 I132 I135	L103-I111 HydrophobicContact CB-CG2 4.16Å; L103-I111 HydrophobicContact CD2-CG2 4.49Å; L104-I111 CarbonylContact O-C 3.34Å; L104-I111 VanDerWaalsContact O-CA 3.26Å; L104-I111 WeakPolarHBondContact O-CA 3.49Å; I111-S124 CarbonylContact O-C 3.58Å; I111-S124 WeakPolarHBondContact O-CA 3.4Å; I111-L125 HydrophobicContact CB-CB 4.18Å; I111-L125 HydrophobicContact CB-CD1 4.28Å; I111-L125 HydrophobicContact CD1-CD1 4.48Å; I111-L125 HydrophobicContact CG2-CD1 4.39Å; I111-L125 PolarHBondContact N-O 3.27Å; I111-L125 PolarHBondContact O-N 3.23Å; I111-I132 HydrophobicContact CD1-CD1 4.46Å; I111-I132 HydrophobicContact CG1-CD1 3.56Å; I111-I132 HydrophobicContact CG1-CG1 4.3Å; I111-I135 HydrophobicContact CD1-CD1 4.29Å; I111-I135 HydrophobicContact CG1-CD1 4.16Å; I111-I135 HydrophobicContact CG2-CD1 3.96Å
112	R	92.6	Very high	89.2	Confident	45 Å²	45	39.2 Å²	39.2	17%	0.17	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	140.2	170.6	-65.4	-173.6	-175.6	-143.4	1.5	110.3	L103 L104 L106 L114 E121	L103-R112 WeakPolarHBondContact CA-O 3.36Å; L104-R112 PolarHBondContact N-O 3.02Å; L104-R112 PolarHBondContact O-N 2.92Å; L106-R112 HydrophobicContact CD1-CG 3.87Å; L106-R112 VanDerWaalsContact CD1-NE 3.34Å; R112-L114 HydrophobicContact CB-CD2 4.49Å; R112-E121 VanDerWaalsContact CD-OE1 3.28Å; R112-E121 WeakPolarHBondContact CD-OE1 3.47Å; R112-E121 WeakPolarHBondContact CD-OE2 3.33Å; R112-E121 WeakPolarHBondContact CG-OE1 3.43Å; R112-E121 IonicContact CZ-OE1 3.71Å; R112-E121 IonicContact CZ-OE2 2.68Å; R112-E121 IonicContact NE-OE1 3.79Å; R112-E121 IonicContact NE-OE2 3.81Å; R112-E121 IonicContact NH1-OE1 2.68Å; R112-E121 IonicContact NH1-OE2 3.18Å; R112-E121 PolarHBondContact NH1-OE2 3.26Å
113	I	92.4	Very high	89.1	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	111.7	171.1	-45.7	-173.4	0	0	0	106.4	Y101 L103 I122 N123 L125 L158	Y101-I113 HydrophobicContact CD2-CG2 3.87Å; Y101-I113 HydrophobicContact CG-CG2 3.91Å; L103-I113 HydrophobicContact CD2-CB 4.15Å; L103-I113 HydrophobicContact CD2-CD1 4.28Å; L103-I113 HydrophobicContact CD2-CG1 3.7Å; L103-I113 HydrophobicContact CD2-CG2 3.98Å; I113-I122 HydrophobicContact CB-CB 4.47Å; I113-I122 HydrophobicContact CG2-CB 4.36Å; I113-I122 HydrophobicContact CG2-CD1 4.24Å; I113-I122 PolarHBondContact O-N 2.93Å; I113-N123 HydrophobicContact CD1-CB 4.14Å; I113-N123 HydrophobicContact CG1-CB 4.43Å; I113-N123 PolarHBondContact N-O 2.86Å; I113-N123 PolarHBondContact O-N 2.99Å; I113-L125 HydrophobicContact CD1-CD1 4.14Å; I113-L125 HydrophobicContact CD1-CD2 4.19Å; I113-L125 HydrophobicContact CD1-CG 4.12Å; I113-L125 HydrophobicContact CG1-CD1 4.32Å; I113-L125 HydrophobicContact CG1-CG 4.28Å; I113-L158 HydrophobicContact CD1-CD2 4.05Å
114	L	92.1	Very high	89	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.01	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	151	168.9	-49.3	-171.7	0	0	0	110.3	L70 A84 Y101 V102 L104 R112 N120 E121	L70-L114 HydrophobicContact CD2-CD1 4.07Å; A84-L114 HydrophobicContact CB-CD1 3.62Å; Y101-L114 CarbonylContact C-O 3.54Å; Y101-L114 WeakPolarHBondContact CA-O 3.45Å; V102-L114 HydrophobicContact CB-CB 4.29Å; V102-L114 PolarHBondContact N-O 2.83Å; V102-L114 PolarHBondContact O-N 3.34Å; L104-L114 HydrophobicContact CD1-CD1 3.53Å; L104-L114 HydrophobicContact CD1-CG 3.81Å; R112-L114 HydrophobicContact CB-CD2 4.49Å; L114-N120 CarbonylContact C-O 3.58Å; L114-N120 VanDerWaalsContact CA-O 3.26Å; L114-N120 WeakPolarHBondContact CA-O 3.34Å; L114-E121 HydrophobicContact CD2-CB 3.74Å; L114-E121 HydrophobicContact CD2-CG 4.14Å
115	D	89.5	Confident	88.9	Confident	39 Å²	39	45.8 Å²	45.8	21%	0.209	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	134.9	161.8	174.2	24.4	0	0	0	110.3	E117 S118 G119 N120 I122	D115-E117 PolarHBondContact OD1-N 2.65Å; D115-E117 VanDerWaalsContact OD1-N 3.07Å; D115-S118 WeakPolarHBondContact OD2-CA 3.49Å; D115-S118 WeakPolarHBondContact OD2-CB 3.47Å; D115-S118 PolarHBondContact OD2-N 3.24Å; D115-S118 PolarHBondContact OD2-OG 2.88Å; D115-G119 WeakPolarHBondContact O-CA 3.38Å; D115-G119 PolarHBondContact O-N 3.17Å; D115-N120 PolarHBondContact N-O 2.74Å; D115-I122 HydrophobicContact CB-CD1 3.93Å; D115-I122 HydrophobicContact CB-CG1 4.12Å
116	E	85.2	Confident	88.7	Confident	21 Å²	21	50.2 Å²	50.2	10%	0.098	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-31.3	178.1	-165.9	-174.2	140.1	0	0	112.6	K60 Y62 G100 V102	K60-E116 IonicContact NZ-OE1 2.76Å; K60-E116 PolarHBondContact NZ-OE1 3.35Å; Y62-E116 WeakPolarHBondContact OH-CG 3.5Å; Y62-E116 PolarHBondContact OH-OE1 3.03Å; G100-E116 WeakPolarHBondContact O-CB 3.37Å; G100-E116 PolarHBondContact O-N 3.39Å; V102-E116 HydrophobicContact CG2-CB 4.14Å; V102-E116 HydrophobicContact CG2-CG 4.26Å
117	E	83.8	Confident	88.4	Confident	185 Å²	185	51.7 Å²	51.7	86%	0.864	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-49.7	-177	-63.5	-152.3	140.9	0	0	112.7	D115	D115-E117 PolarHBondContact OD1-N 2.65Å; D115-E117 VanDerWaalsContact OD1-N 3.07Å
118	S	83.2	Confident	88.4	Confident	66 Å²	66	48.3 Å²	48.3	46%	0.462	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-14.3	-178.1	74.6	0	0	0	0	114.8	D115 N120	D115-S118 WeakPolarHBondContact OD2-CA 3.49Å; D115-S118 WeakPolarHBondContact OD2-CB 3.47Å; D115-S118 PolarHBondContact OD2-N 3.24Å; D115-S118 PolarHBondContact OD2-OG 2.88Å; S118-N120 VanDerWaalsContact CB-ND2 3.28Å; S118-N120 WeakPolarHBondContact CB-ND2 3.47Å; S118-N120 PolarHBondContact O-N 3.28Å; S118-N120 PolarHBondContact OG-ND2 3.03Å
119	G	83.9	Confident	88.3	Confident	11 Å²	11	49.2 Å²	49.2	11%	0.113	28%	0.281	C	S	.	.			trans	71.6	0.2	-177.9	0	0	0	0	0	115.5	I83 D115	I83-G119 VanDerWaalsContact CG2-CA 3.4Å; D115-G119 WeakPolarHBondContact O-CA 3.38Å; D115-G119 PolarHBondContact O-N 3.17Å
120	N	87.6	Confident	88.2	Confident	104 Å²	104	52.8 Å²	52.8	56%	0.556	29%	0.292	S	S	*	.			trans	-72.7	150	179.9	-67.5	-64.3	0	0	0	111.7	L114 D115 S118 I122	L114-N120 CarbonylContact C-O 3.58Å; L114-N120 VanDerWaalsContact CA-O 3.26Å; L114-N120 WeakPolarHBondContact CA-O 3.34Å; D115-N120 PolarHBondContact N-O 2.74Å; S118-N120 VanDerWaalsContact CB-ND2 3.28Å; S118-N120 WeakPolarHBondContact CB-ND2 3.47Å; S118-N120 PolarHBondContact O-N 3.28Å; S118-N120 PolarHBondContact OG-ND2 3.03Å; N120-I122 PolarHBondContact O-N 3.49Å
121	E	87.2	Confident	88	Confident	78 Å²	78	58.4 Å²	58.4	36%	0.364	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	117	172.5	-174	171.3	175.6	0	0	110.4	R112 L114	R112-E121 VanDerWaalsContact CD-OE1 3.28Å; R112-E121 WeakPolarHBondContact CD-OE1 3.47Å; R112-E121 WeakPolarHBondContact CD-OE2 3.33Å; R112-E121 WeakPolarHBondContact CG-OE1 3.43Å; R112-E121 IonicContact CZ-OE1 3.71Å; R112-E121 IonicContact CZ-OE2 2.68Å; R112-E121 IonicContact NE-OE1 3.79Å; R112-E121 IonicContact NE-OE2 3.81Å; R112-E121 IonicContact NH1-OE1 2.68Å; R112-E121 IonicContact NH1-OE2 3.18Å; R112-E121 PolarHBondContact NH1-OE2 3.26Å; L114-E121 HydrophobicContact CD2-CB 3.74Å; L114-E121 HydrophobicContact CD2-CG 4.14Å
122	I	88.2	Confident	87.9	Confident	66 Å²	66	58.5 Å²	58.5	34%	0.338	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	-47.2	177.1	-60.3	170.1	0	0	0	109.7	Y101 I113 D115 N120	Y101-I122 HydrophobicContact CD1-CD1 3.41Å; Y101-I122 VanDerWaalsContact CD1-CD1 3.41Å; Y101-I122 HydrophobicContact CE1-CD1 3.36Å; Y101-I122 HydrophobicContact CG-CD1 4.16Å; I113-I122 HydrophobicContact CB-CB 4.47Å; I113-I122 HydrophobicContact CG2-CB 4.36Å; I113-I122 HydrophobicContact CG2-CD1 4.24Å; I113-I122 PolarHBondContact O-N 2.93Å; D115-I122 HydrophobicContact CB-CD1 3.93Å; D115-I122 HydrophobicContact CB-CG1 4.12Å; N120-I122 PolarHBondContact O-N 3.49Å
123	N	89.9	Confident	87.6	Confident	75 Å²	75	59.1 Å²	59.1	40%	0.401	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	162.4	-174.5	-97.9	-42.8	0	0	0	111.2	I113	I113-N123 HydrophobicContact CD1-CB 4.14Å; I113-N123 HydrophobicContact CG1-CB 4.43Å; I113-N123 PolarHBondContact N-O 2.86Å; I113-N123 PolarHBondContact O-N 2.99Å
124	S	89	Confident	87.5	Confident	62 Å²	62	60.4 Å²	60.4	43%	0.434	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	127.6	169.4	54.3	0	0	0	0	111.9	I111	I111-S124 CarbonylContact O-C 3.58Å; I111-S124 WeakPolarHBondContact O-CA 3.4Å
125	L	91.6	Very high	87.5	Confident	3 Å²	3	60.6 Å²	60.6	2%	0.016	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	108.9	176.1	-49.6	169.6	0	0	0	107.7	S110 I111 I113 W156 L158 S161	S110-L125 WeakPolarHBondContact CA-O 3.24Å; I111-L125 HydrophobicContact CB-CB 4.18Å; I111-L125 HydrophobicContact CB-CD1 4.28Å; I111-L125 HydrophobicContact CD1-CD1 4.48Å; I111-L125 HydrophobicContact CG2-CD1 4.39Å; I111-L125 PolarHBondContact N-O 3.27Å; I111-L125 PolarHBondContact O-N 3.23Å; I113-L125 HydrophobicContact CD1-CD1 4.14Å; I113-L125 HydrophobicContact CD1-CD2 4.19Å; I113-L125 HydrophobicContact CD1-CG 4.12Å; I113-L125 HydrophobicContact CG1-CD1 4.32Å; I113-L125 HydrophobicContact CG1-CG 4.28Å; L125-W156 HydrophobicContact CB-CD2 3.98Å; L125-W156 HydrophobicContact CB-CE3 4.02Å; L125-W156 HydrophobicContact CB-CH2 4.05Å; L125-W156 HydrophobicContact CB-CZ2 3.98Å; L125-W156 HydrophobicContact CB-CZ3 4.06Å; L125-W156 HydrophobicContact CD1-CB 4.13Å; L125-W156 HydrophobicContact CD1-CD2 3.93Å; L125-W156 HydrophobicContact CD1-CE3 4.49Å; L125-W156 HydrophobicContact CD1-CG 3.73Å; L125-W156 HydrophobicContact CD2-CD2 4.13Å; L125-W156 HydrophobicContact CD2-CE3 3.86Å; L125-W156 HydrophobicContact CD2-CG 4.45Å; L125-W156 HydrophobicContact CD2-CZ3 4.44Å; L125-W156 HydrophobicContact CG-CD2 4.24Å; L125-W156 HydrophobicContact CG-CE3 4.34Å; L125-L158 HydrophobicContact CD1-CD2 4.11Å; L125-S161 WeakPolarHBondContact CD2-O 3.3Å
126	S	87.2	Confident	87.6	Confident	92 Å²	92	59.4 Å²	59.4	64%	0.643	33%	0.325	S	S	*	.			trans	-110.7	136	177	58.8	0	0	0	0	110.3	W156	S126-W156 WeakPolarHBondContact O-CH2 3.31Å
127	G	83.6	Confident	87.8	Confident	32 Å²	32	59.1 Å²	59.1	33%	0.33	33%	0.325	S	S	.	.			trans	159.9	-13.9	178.2	0	0	0	0	0	117.3	R166	G127-R166 VanDerWaalsContact O-CZ 3.25Å; G127-R166 PolarHBondContact O-NH1 2.95Å; G127-R166 PolarHBondContact O-NH2 3.44Å
128	H	87.7	Confident	88	Confident	12 Å²	12	51.1 Å²	51.1	6%	0.056	29%	0.288	C	S	.	.			trans	-72.8	139.9	172.8	-79.6	-71.1	0	0	0	111.3	N109 I132 S147	N109-H128 HydrophobicContact CB-CB 4.26Å; N109-H128 WeakPolarHBondContact CB-O 3.42Å; H128-I132 HydrophobicContact CB-CG1 4.46Å; H128-S147 PolarHBondContact CE1-O 3.13Å; H128-S147 WeakPolarHBondContact NE2-CB 3.35Å; H128-S147 PolarHBondContact NE2-OG 3.41Å
129	T	85.4	Confident	87.8	Confident	79 Å²	79	49.3 Å²	49.3	49%	0.485	28%	0.275	S	S	.	.	S	Bend	trans	-86	-19.5	176.2	57.2	0	0	0	0	113.6	N109 E152	N109-T129 PolarHBondContact ND2-O 3.4Å; N109-T129 VanDerWaalsContact ND2-O 3.13Å; T129-E152 WeakPolarHBondContact CB-OE2 3.35Å; T129-E152 PolarHBondContact N-OE2 2.98Å; T129-E152 PolarHBondContact OG1-OE2 2.85Å
130	Y	87.4	Confident	87.6	Confident	117 Å²	117	53.1 Å²	53.1	46%	0.459	30%	0.295	S	S	.	.	S	Bend	trans	-127.2	165.7	178.6	-58.5	-86.2	0	0	0	111.4	N109 I132 S151	N109-Y130 PolarHBondContact OD1-O 3.31Å; Y130-I132 PolarHBondContact O-N 2.95Å; Y130-S151 WeakPolarHBondContact CE2-OG 3.41Å
131	R	87.5	Confident	87.2	Confident	134 Å²	134	50.4 Å²	50.4	51%	0.506	28%	0.284	S	S	.	.			trans	-55.3	130.6	177.9	175.8	171.7	165.7	163.5	-3.3	111.4	T91 N107 N109 S133	T91-R131 HydrophobicContact CG2-CG 4.01Å; T91-R131 VanDerWaalsContact CG2-NE 3.29Å; N107-R131 VanDerWaalsContact OD1-CZ 3.3Å; N107-R131 PolarHBondContact OD1-NH1 2.86Å; N109-R131 WeakPolarHBondContact OD1-CA 3.42Å; N109-R131 PolarHBondContact OD1-N 2.91Å; R131-S133 PolarHBondContact O-N 2.95Å
132	I	90.2	Very high	86.9	Confident	3 Å²	3	46.7 Å²	46.7	2%	0.015	27%	0.267	C	S	.	.			trans	-65.9	128.4	178.3	-61.3	137.1	0	0	0	109.9	T91 S110 I111 H128 Y130 I135 T148	T91-I132 PolarHBondContact OG1-O 2.99Å; S110-I132 WeakPolarHBondContact O-CD1 3.48Å; I111-I132 HydrophobicContact CD1-CD1 4.46Å; I111-I132 HydrophobicContact CG1-CD1 3.56Å; I111-I132 HydrophobicContact CG1-CG1 4.3Å; H128-I132 HydrophobicContact CB-CG1 4.46Å; Y130-I132 PolarHBondContact O-N 2.95Å; I132-I135 HydrophobicContact CG2-CD1 4.02Å; I132-I135 HydrophobicContact CG2-CG1 3.65Å; I132-T148 CarbonylContact C-O 3.59Å; I132-T148 WeakPolarHBondContact CA-O 3.46Å
133	S	88.2	Confident	86.8	Confident	59 Å²	59	48 Å²	48	41%	0.413	27%	0.268	S	S	.	.			trans	-104.4	-31.2	-175.3	59.7	0	0	0	0	114.1	R131 T148	R131-S133 PolarHBondContact O-N 2.95Å; S133-T148 PolarHBondContact N-O 2.87Å; S133-T148 PolarHBondContact OG-O 2.83Å; S133-T148 VanDerWaalsContact OG-O 3.09Å; S133-T148 PolarHBondContact OG-OG1 3.23Å; S133-T148 VanDerWaalsContact OG-OG1 3.07Å
134	N	89.4	Confident	86.8	Confident	29 Å²	29	44.9 Å²	44.9	16%	0.155	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	148.8	177.2	-167	6.6	0	0	0	110	Y92 T148 S177	Y92-N134 WeakPolarHBondContact CE1-OD1 3.28Å; Y92-N134 PolarHBondContact OH-OD1 3.49Å; Y92-N134 VanDerWaalsContact OH-OD1 3.09Å; N134-T148 WeakPolarHBondContact CB-OG1 3.4Å; N134-T148 PolarHBondContact N-OG1 2.97Å; N134-T148 PolarHBondContact O-N 3.37Å; N134-T148 PolarHBondContact O-OG1 3.18Å; N134-S177 PolarHBondContact ND2-OG 3.47Å
135	I	91.9	Very high	86.9	Confident	5 Å²	5	42 Å²	42	3%	0.026	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	134.7	173.9	-56.1	176.3	0	0	0	107.5	Y92 C94 L103 I111 I132 L146	Y92-I135 HydrophobicContact CD1-CB 3.88Å; Y92-I135 HydrophobicContact CD1-CD1 4.48Å; Y92-I135 HydrophobicContact CD1-CG1 4.09Å; Y92-I135 HydrophobicContact CE1-CB 4.34Å; C94-I135 HydrophobicContact CB-CB 3.92Å; C94-I135 HydrophobicContact CB-CG2 3.82Å; C94-I135 PolarHBondContact SG-O 3.2Å; L103-I135 HydrophobicContact CB-CG2 4.21Å; L103-I135 HydrophobicContact CD1-CG2 3.85Å; I111-I135 HydrophobicContact CD1-CD1 4.29Å; I111-I135 HydrophobicContact CG1-CD1 4.16Å; I111-I135 HydrophobicContact CG2-CD1 3.96Å; I132-I135 HydrophobicContact CG2-CD1 4.02Å; I132-I135 HydrophobicContact CG2-CG1 3.65Å; I135-L146 WeakPolarHBondContact CA-O 3.43Å
136	S	91.2	Very high	86.9	Confident	14 Å²	14	42.1 Å²	42.1	10%	0.098	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	132.5	-178.6	176.7	0	0	0	0	109.3	L146 T179 F180	S136-L146 PolarHBondContact N-O 2.91Å; S136-L146 WeakPolarHBondContact O-CA 3.43Å; S136-L146 PolarHBondContact O-N 2.88Å; S136-T179 WeakPolarHBondContact OG-CG2 3.36Å; S136-F180 WeakPolarHBondContact O-CE2 3.41Å; S136-F180 PolarHBondContact OG-N 3.5Å
137	V	90.4	Very high	87.1	Confident	15 Å²	15	37.8 Å²	37.8	9%	0.091	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	146.7	179.8	179.7	0	0	0	0	109.8	C96 L103 P139 L158 F180	C96-V137 HydrophobicContact CB-CG1 3.93Å; C96-V137 HydrophobicContact CB-CG2 4.34Å; L103-V137 HydrophobicContact CD1-CG2 3.47Å; L103-V137 VanDerWaalsContact CD1-CG2 3.47Å; L103-V137 HydrophobicContact CG-CG2 4.48Å; V137-P139 WeakPolarHBondContact O-CD 3.32Å; V137-L158 HydrophobicContact CG1-CD1 4.39Å; V137-F180 WeakPolarHBondContact O-CD2 3.33Å
138	Q	87	Confident	87.4	Confident	17 Å²	17	36.3 Å²	36.3	8%	0.079	19%	0.185	C	C	.	.			trans	-65.3	116.6	174.9	-165.9	-173	-2.4	0	0	109.6	V140 S141 G142 Y144 F180 C184 G185	Q138-V140 PolarHBondContact O-N 3.41Å; Q138-S141 PolarHBondContact OE1-OG 2.81Å; Q138-G142 WeakPolarHBondContact O-CA 3.5Å; Q138-G142 PolarHBondContact O-N 3.33Å; Q138-G142 VanDerWaalsContact O-N 3.08Å; Q138-Y144 PolarHBondContact N-O 2.66Å; Q138-F180 HydrophobicContact CB-CD1 4.38Å; Q138-F180 HydrophobicContact CB-CD2 4.23Å; Q138-F180 HydrophobicContact CB-CE1 4.21Å; Q138-F180 HydrophobicContact CB-CE2 4.05Å; Q138-F180 HydrophobicContact CB-CG 4.39Å; Q138-F180 HydrophobicContact CB-CZ 4.04Å; Q138-F180 HydrophobicContact CG-CD1 4.35Å; Q138-F180 HydrophobicContact CG-CE1 4.42Å; Q138-F180 VanDerWaalsContact N-CD2 3.31Å; Q138-F180 VanDerWaalsContact N-CE2 3.27Å; Q138-C184 PolarHBondContact NE2-O 2.95Å; Q138-G185 PolarHBondContact NE2-O 2.78Å
139	P	79.7	Confident	87.4	Confident	29 Å²	29	35.7 Å²	35.7	19%	0.188	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-37.4	-161.8	-22.4	32.9	0	0	0	115.1	P98 V137 P183 I384	P98-P139 VanDerWaalsContact CG-O 3.31Å; P98-P139 WeakPolarHBondContact CG-O 3.38Å; V137-P139 WeakPolarHBondContact O-CD 3.32Å; P139-P183 WeakPolarHBondContact CB-O 3.45Å; P139-P183 WeakPolarHBondContact CG-O 3.32Å; P139-I384 HydrophobicContact CB-CD1 4.04Å; P139-I384 HydrophobicContact CB-CG1 4.12Å; P139-I384 VanDerWaalsContact O-CD1 3.24Å; P139-I384 WeakPolarHBondContact O-CD1 3.43Å
140	V	78.9	Confident	87.3	Confident	90 Å²	90	36.9 Å²	36.9	55%	0.545	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-44.6	-175.2	174.3	0	0	0	0	112.7	Q138	Q138-V140 PolarHBondContact O-N 3.41Å
141	S	79.7	Confident	87.1	Confident	47 Å²	47	32.2 Å²	32.2	33%	0.329	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-25.3	-174.4	71.7	0	0	0	0	113.8	Q138 R143	Q138-S141 PolarHBondContact OE1-OG 2.81Å; S141-R143 PolarHBondContact O-N 2.81Å; S141-R143 WeakPolarHBondContact OG-CB 3.46Å; S141-R143 PolarHBondContact OG-N 2.89Å
142	G	81	Confident	87.1	Confident	0 Å²	0	26 Å²	26	0%	0	15%	0.146	C	C	.	.			trans	57.3	6.1	-164.7	0	0	0	0	0	114.8	C96 R99 Q138 L158	C96-G142 VanDerWaalsContact SG-CA 3.54Å; R99-G142 VanDerWaalsContact CD-O 3.32Å; R99-G142 WeakPolarHBondContact CD-O 3.38Å; R99-G142 PolarHBondContact NE-O 3.01Å; R99-G142 VanDerWaalsContact NE-O 3.11Å; Q138-G142 WeakPolarHBondContact O-CA 3.5Å; Q138-G142 PolarHBondContact O-N 3.33Å; Q138-G142 VanDerWaalsContact O-N 3.08Å; G142-L158 WeakPolarHBondContact O-CD1 3.38Å
143	R	86.3	Confident	87.1	Confident	95 Å²	95	26 Å²	26	36%	0.358	15%	0.147	S	C	.	.			trans	-80	-42	-166.1	179.2	170.2	175.4	-168.5	-2.8	113.3	S141 D157 L158 D159	S141-R143 PolarHBondContact O-N 2.81Å; S141-R143 WeakPolarHBondContact OG-CB 3.46Å; S141-R143 PolarHBondContact OG-N 2.89Å; R143-D157 IonicContact CZ-OD2 3.85Å; R143-D157 IonicContact NE-OD1 3.68Å; R143-D157 PolarHBondContact NE-OD1 3.38Å; R143-D157 IonicContact NE-OD2 2.68Å; R143-D157 PolarHBondContact NE-OD2 3.41Å; R143-D157 IonicContact NH2-OD2 3.58Å; R143-D157 PolarHBondContact NH2-OD2 2.91Å; R143-L158 VanDerWaalsContact O-CB 3.26Å; R143-L158 WeakPolarHBondContact O-CB 3.44Å; R143-L158 PolarHBondContact O-N 3.27Å; R143-D159 WeakPolarHBondContact CD-OD2 3.12Å; R143-D159 WeakPolarHBondContact CG-OD2 3.37Å; R143-D159 IonicContact NE-OD2 3.37Å; R143-D159 PolarHBondContact NE-OD2 3.08Å
144	Y	89.9	Confident	87.3	Confident	9 Å²	9	23.2 Å²	23.2	4%	0.035	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	135.2	-177.1	-49.9	-55.7	0	0	0	111.5	Q138 L155 W156 D157 R164 F180 T202 D203	Q138-Y144 PolarHBondContact N-O 2.66Å; Y144-L155 HydrophobicContact CG-CD1 4.48Å; Y144-W156 VanDerWaalsContact CA-O 3.32Å; Y144-W156 WeakPolarHBondContact CA-O 3.34Å; Y144-D157 HydrophobicContact CD1-CB 4.39Å; Y144-R164 VanDerWaalsContact CE1-NH1 3.28Å; Y144-R164 VanDerWaalsContact CZ-NH1 3.26Å; Y144-R164 PolarHBondContact OH-NH1 3.2Å; Y144-F180 WeakPolarHBondContact O-CE2 3.27Å; Y144-T202 HydrophobicContact CD2-CG2 3.43Å; Y144-T202 VanDerWaalsContact CD2-CG2 3.43Å; Y144-T202 HydrophobicContact CE2-CG2 3.69Å; Y144-T202 HydrophobicContact CG-CG2 4.46Å; Y144-D203 PolarHBondContact OH-OD1 2.98Å; Y144-D203 VanDerWaalsContact OH-OD1 3.11Å
145	G	90.4	Very high	87.4	Confident	2 Å²	2	22.1 Å²	22.1	2%	0.021	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	118.3	172.9	0	0	0	0	0	110.4	W156	G145-W156 PolarHBondContact N-O 2.89Å; G145-W156 VanDerWaalsContact O-CD1 3.31Å; G145-W156 PolarHBondContact O-N 3.08Å
146	L	91.3	Very high	87.5	Confident	5 Å²	5	22.3 Å²	22.3	3%	0.026	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	142.7	166.8	-83.2	167.8	0	0	0	110.4	I135 S136 L155 V178 F180 I188	I135-L146 WeakPolarHBondContact CA-O 3.43Å; S136-L146 PolarHBondContact N-O 2.91Å; S136-L146 WeakPolarHBondContact O-CA 3.43Å; S136-L146 PolarHBondContact O-N 2.88Å; L146-L155 HydrophobicContact CD2-CB 4.11Å; L146-L155 HydrophobicContact CD2-CD1 3.76Å; L146-L155 HydrophobicContact CG-CD1 3.77Å; L146-V178 HydrophobicContact CD1-CG1 4.09Å; L146-V178 HydrophobicContact CD2-CG1 4.07Å; L146-F180 HydrophobicContact CB-CD2 4.42Å; L146-F180 HydrophobicContact CB-CE2 3.88Å; L146-F180 HydrophobicContact CB-CZ 4.33Å; L146-F180 HydrophobicContact CD1-CD1 3.94Å; L146-F180 HydrophobicContact CD1-CD2 3.76Å; L146-F180 HydrophobicContact CD1-CE1 3.75Å; L146-F180 HydrophobicContact CD1-CE2 3.58Å; L146-F180 HydrophobicContact CD1-CG 3.95Å; L146-F180 HydrophobicContact CD1-CZ 3.57Å; L146-F180 HydrophobicContact CG-CD2 4.3Å; L146-F180 HydrophobicContact CG-CE1 4.24Å; L146-F180 HydrophobicContact CG-CE2 3.65Å; L146-F180 HydrophobicContact CG-CZ 3.61Å; L146-I188 HydrophobicContact CD1-CB 4.31Å; L146-I188 HydrophobicContact CD1-CD1 4.09Å; L146-I188 HydrophobicContact CD1-CG1 3.95Å; L146-I188 HydrophobicContact CD1-CG2 3.57Å; L146-I188 HydrophobicContact CD2-CD1 4.4Å; L146-I188 HydrophobicContact CD2-CG2 4.48Å
147	S	91.7	Very high	87.4	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	143	177.5	57.5	0	0	0	0	110.6	H128 A153 I154 W156	H128-S147 PolarHBondContact CE1-O 3.13Å; H128-S147 WeakPolarHBondContact NE2-CB 3.35Å; H128-S147 PolarHBondContact NE2-OG 3.41Å; S147-A153 WeakPolarHBondContact O-CA 3.32Å; S147-I154 PolarHBondContact N-O 2.82Å; S147-I154 PolarHBondContact O-N 3.38Å; S147-I154 PolarHBondContact OG-O 3.39Å; S147-W156 PolarHBondContact OG-NE1 3.13Å
148	T	90.4	Very high	87.3	Confident	1 Å²	1	21.9 Å²	21.9	1%	0.006	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	146.3	-172	61.3	0	0	0	0	113.3	I132 S133 N134 E152 A153 L175 V178	I132-T148 CarbonylContact C-O 3.59Å; I132-T148 WeakPolarHBondContact CA-O 3.46Å; S133-T148 PolarHBondContact N-O 2.87Å; S133-T148 PolarHBondContact OG-O 2.83Å; S133-T148 VanDerWaalsContact OG-O 3.09Å; S133-T148 PolarHBondContact OG-OG1 3.23Å; S133-T148 VanDerWaalsContact OG-OG1 3.07Å; N134-T148 WeakPolarHBondContact CB-OG1 3.4Å; N134-T148 PolarHBondContact N-OG1 2.97Å; N134-T148 PolarHBondContact O-N 3.37Å; N134-T148 PolarHBondContact O-OG1 3.18Å; T148-E152 WeakPolarHBondContact CA-O 3.35Å; T148-A153 HydrophobicContact CG2-CB 4.13Å; T148-L175 HydrophobicContact CG2-CD2 4.25Å; T148-V178 HydrophobicContact CG2-CB 3.56Å; T148-V178 HydrophobicContact CG2-CG2 3.71Å
149	A	88.2	Confident	87.2	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	174	168.7	0	0	0	0	0	108.9	S151 E152	A149-S151 VanDerWaalsContact C-N 3.25Å; A149-S151 PolarHBondContact O-N 2.92Å; A149-E152 PolarHBondContact N-O 3.03Å; A149-E152 PolarHBondContact O-N 3.18Å; A149-E152 VanDerWaalsContact O-O 3.09Å
150	L	82	Confident	87.5	Confident	103 Å²	103	27.8 Å²	27.8	54%	0.539	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-33.9	-165.4	-69.2	169.5	0	0	0	116	L175	L150-L175 PolarHBondContact O-N 2.85Å
151	S	83.2	Confident	87.8	Confident	19 Å²	19	25 Å²	25	13%	0.133	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.7	9.3	180	63.2	0	0	0	0	113.6	Y130 A149 I169	Y130-S151 WeakPolarHBondContact CE2-OG 3.41Å; A149-S151 VanDerWaalsContact C-N 3.25Å; A149-S151 PolarHBondContact O-N 2.92Å; S151-I169 WeakPolarHBondContact O-CB 3.3Å; S151-I169 PolarHBondContact O-N 3.4Å
152	E	87.7	Confident	88.1	Confident	3 Å²	3	26.5 Å²	26.5	1%	0.014	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	137.6	-168.8	-52.2	-163.4	104.8	0	0	112.4	T129 T148 A149 R166 L167 H168	T129-E152 WeakPolarHBondContact CB-OE2 3.35Å; T129-E152 PolarHBondContact N-OE2 2.98Å; T129-E152 PolarHBondContact OG1-OE2 2.85Å; T148-E152 WeakPolarHBondContact CA-O 3.35Å; A149-E152 PolarHBondContact N-O 3.03Å; A149-E152 PolarHBondContact O-N 3.18Å; A149-E152 VanDerWaalsContact O-O 3.09Å; E152-R166 IonicContact OE1-CZ 3.93Å; E152-R166 IonicContact OE1-NE 3.95Å; E152-R166 PolarHBondContact OE1-NE 2.9Å; E152-R166 IonicContact OE1-NH2 3.17Å; E152-R166 PolarHBondContact OE1-NH2 3.44Å; E152-R166 IonicContact OE2-CZ 2.8Å; E152-R166 IonicContact OE2-NH2 3.21Å; E152-R166 PolarHBondContact OE2-NH2 3.46Å; E152-L167 WeakPolarHBondContact CA-O 3.47Å; E152-H168 IonicContact OE1-CE1 3.22Å; E152-H168 IonicContact OE1-CG 3.74Å; E152-H168 IonicContact OE1-ND1 3.67Å; E152-H168 PolarHBondContact OE1-ND1 3.48Å
153	A	90.6	Very high	88.4	Confident	4 Å²	4	29.3 Å²	29.3	3%	0.033	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	142.6	159	0	0	0	0	0	110.7	S147 T148 R166 L167 L175 V178	S147-A153 WeakPolarHBondContact O-CA 3.32Å; T148-A153 HydrophobicContact CG2-CB 4.13Å; A153-R166 CarbonylContact O-C 3.43Å; A153-R166 WeakPolarHBondContact O-CA 3.48Å; A153-L167 HydrophobicContact CB-CB 4.26Å; A153-L167 PolarHBondContact N-O 3.3Å; A153-L167 PolarHBondContact O-N 2.99Å; A153-L175 HydrophobicContact CB-CD2 3.77Å; A153-V178 HydrophobicContact CB-CB 4.26Å; A153-V178 HydrophobicContact CB-CG2 3.8Å
154	I	92.4	Very high	88.4	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	126.8	173.4	-55.9	173	0	0	0	108.7	S147 W156 C163 C165 R166	S147-I154 PolarHBondContact N-O 2.82Å; S147-I154 PolarHBondContact O-N 3.38Å; S147-I154 PolarHBondContact OG-O 3.39Å; I154-W156 HydrophobicContact CB-CZ2 3.99Å; I154-W156 HydrophobicContact CD1-CH2 4.1Å; I154-W156 HydrophobicContact CD1-CZ2 3.65Å; I154-W156 HydrophobicContact CG1-CZ2 4.42Å; I154-W156 HydrophobicContact CG2-CD2 3.67Å; I154-W156 HydrophobicContact CG2-CE3 4.12Å; I154-W156 HydrophobicContact CG2-CG 4.18Å; I154-W156 HydrophobicContact CG2-CH2 4.02Å; I154-W156 HydrophobicContact CG2-CZ2 3.58Å; I154-W156 HydrophobicContact CG2-CZ3 4.28Å; I154-C163 HydrophobicContact CG2-CB 4.08Å; I154-C165 WeakPolarHBondContact CA-O 3.5Å; I154-R166 HydrophobicContact CG1-CG 4.18Å
155	L	92.4	Very high	88.3	Confident	6 Å²	6	30.7 Å²	30.7	3%	0.031	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	113	165.5	-176.6	71	0	0	0	107.9	Y144 L146 R164 C165 F180 I188 L205	Y144-L155 HydrophobicContact CG-CD1 4.48Å; L146-L155 HydrophobicContact CD2-CB 4.11Å; L146-L155 HydrophobicContact CD2-CD1 3.76Å; L146-L155 HydrophobicContact CG-CD1 3.77Å; L155-R164 HydrophobicContact CD2-CG 4.39Å; L155-R164 WeakPolarHBondContact O-CB 3.21Å; L155-R164 PolarHBondContact O-N 3.34Å; L155-C165 HydrophobicContact CB-CB 4.19Å; L155-C165 PolarHBondContact N-O 3.44Å; L155-C165 PolarHBondContact O-N 3.09Å; L155-F180 HydrophobicContact CD1-CE1 4.4Å; L155-F180 HydrophobicContact CD1-CZ 3.83Å; L155-I188 HydrophobicContact CD1-CD1 4.31Å; L155-L205 HydrophobicContact CD2-CD2 3.78Å
156	W	92.7	Very high	88.1	Confident	9 Å²	9	35 Å²	35	3%	0.034	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	141.8	174.7	-53.4	99.1	0	0	0	110	L125 S126 Y144 G145 S147 I154 L158 T162 C163	L125-W156 HydrophobicContact CB-CD2 3.98Å; L125-W156 HydrophobicContact CB-CE3 4.02Å; L125-W156 HydrophobicContact CB-CH2 4.05Å; L125-W156 HydrophobicContact CB-CZ2 3.98Å; L125-W156 HydrophobicContact CB-CZ3 4.06Å; L125-W156 HydrophobicContact CD1-CB 4.13Å; L125-W156 HydrophobicContact CD1-CD2 3.93Å; L125-W156 HydrophobicContact CD1-CE3 4.49Å; L125-W156 HydrophobicContact CD1-CG 3.73Å; L125-W156 HydrophobicContact CD2-CD2 4.13Å; L125-W156 HydrophobicContact CD2-CE3 3.86Å; L125-W156 HydrophobicContact CD2-CG 4.45Å; L125-W156 HydrophobicContact CD2-CZ3 4.44Å; L125-W156 HydrophobicContact CG-CD2 4.24Å; L125-W156 HydrophobicContact CG-CE3 4.34Å; S126-W156 WeakPolarHBondContact O-CH2 3.31Å; Y144-W156 VanDerWaalsContact CA-O 3.32Å; Y144-W156 WeakPolarHBondContact CA-O 3.34Å; G145-W156 PolarHBondContact N-O 2.89Å; G145-W156 VanDerWaalsContact O-CD1 3.31Å; G145-W156 PolarHBondContact O-N 3.08Å; S147-W156 PolarHBondContact OG-NE1 3.13Å; I154-W156 HydrophobicContact CB-CZ2 3.99Å; I154-W156 HydrophobicContact CD1-CH2 4.1Å; I154-W156 HydrophobicContact CD1-CZ2 3.65Å; I154-W156 HydrophobicContact CG1-CZ2 4.42Å; I154-W156 HydrophobicContact CG2-CD2 3.67Å; I154-W156 HydrophobicContact CG2-CE3 4.12Å; I154-W156 HydrophobicContact CG2-CG 4.18Å; I154-W156 HydrophobicContact CG2-CH2 4.02Å; I154-W156 HydrophobicContact CG2-CZ2 3.58Å; I154-W156 HydrophobicContact CG2-CZ3 4.28Å; W156-L158 HydrophobicContact CB-CD2 4.36Å; W156-T162 WeakPolarHBondContact CA-O 3.31Å; W156-C163 HydrophobicContact CE3-CB 3.97Å; W156-C163 HydrophobicContact CH2-CB 4.39Å; W156-C163 HydrophobicContact CZ3-CB 3.7Å
157	D	90.1	Very high	87.7	Confident	11 Å²	11	37.4 Å²	37.4	6%	0.059	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	117.7	160.5	-164.1	-31	0	0	0	107.8	R143 Y144 D159 S161 T162	R143-D157 IonicContact CZ-OD2 3.85Å; R143-D157 IonicContact NE-OD1 3.68Å; R143-D157 PolarHBondContact NE-OD1 3.38Å; R143-D157 IonicContact NE-OD2 2.68Å; R143-D157 PolarHBondContact NE-OD2 3.41Å; R143-D157 IonicContact NH2-OD2 3.58Å; R143-D157 PolarHBondContact NH2-OD2 2.91Å; Y144-D157 HydrophobicContact CD1-CB 4.39Å; D157-D159 VanDerWaalsContact C-N 3.29Å; D157-D159 PolarHBondContact OD1-N 3.48Å; D157-S161 VanDerWaalsContact O-CA 3.26Å; D157-S161 WeakPolarHBondContact O-CA 3.32Å; D157-S161 PolarHBondContact O-N 3.41Å; D157-T162 PolarHBondContact N-O 3.3Å; D157-T162 PolarHBondContact O-N 2.9Å
158	L	87.6	Confident	87.1	Confident	9 Å²	9	43.1 Å²	43.1	5%	0.047	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-7.6	-173.9	-60	173.7	0	0	0	112.3	L103 I113 L125 V137 G142 R143 W156	L103-L158 HydrophobicContact CD1-CD1 4.49Å; L103-L158 HydrophobicContact CD2-CD2 4.46Å; I113-L158 HydrophobicContact CD1-CD2 4.05Å; L125-L158 HydrophobicContact CD1-CD2 4.11Å; V137-L158 HydrophobicContact CG1-CD1 4.39Å; G142-L158 WeakPolarHBondContact O-CD1 3.38Å; R143-L158 VanDerWaalsContact O-CB 3.26Å; R143-L158 WeakPolarHBondContact O-CB 3.44Å; R143-L158 PolarHBondContact O-N 3.27Å; W156-L158 HydrophobicContact CB-CD2 4.36Å
159	D	85.7	Confident	86.3	Confident	95 Å²	95	44.1 Å²	44.1	51%	0.508	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-43	168.5	-72.9	-48.3	0	0	0	111.8	R99 R143 D157	R99-D159 IonicContact CZ-OD1 2.73Å; R99-D159 IonicContact CZ-OD2 3.08Å; R99-D159 VanDerWaalsContact NH1-CG 3.3Å; R99-D159 IonicContact NH1-OD1 3.53Å; R99-D159 PolarHBondContact NH1-OD1 3.28Å; R99-D159 IonicContact NH1-OD2 2.8Å; R99-D159 IonicContact NH2-OD1 3.2Å; R99-D159 PolarHBondContact NH2-OD1 2.93Å; R99-D159 IonicContact NH2-OD2 3.47Å; R99-D159 PolarHBondContact NH2-OD2 2.94Å; R143-D159 WeakPolarHBondContact CD-OD2 3.12Å; R143-D159 WeakPolarHBondContact CG-OD2 3.37Å; R143-D159 IonicContact NE-OD2 3.37Å; R143-D159 PolarHBondContact NE-OD2 3.08Å; D157-D159 VanDerWaalsContact C-N 3.29Å; D157-D159 PolarHBondContact OD1-N 3.48Å
160	T	85.3	Confident	85.1	Confident	75 Å²	75	46.5 Å²	46.5	46%	0.46	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-11.7	-178.1	53.2	0	0	0	0	113.4	T162	T160-T162 PolarHBondContact O-N 3.15Å; T160-T162 PolarHBondContact OG1-N 3.49Å; T160-T162 PolarHBondContact OG1-OG1 3.04Å
161	S	84.4	Confident	84	Confident	31 Å²	31	51.3 Å²	51.3	22%	0.217	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	57	22.7	-167.4	69.8	0	0	0	0	114.5	L125 D157	L125-S161 WeakPolarHBondContact CD2-O 3.3Å; D157-S161 VanDerWaalsContact O-CA 3.26Å; D157-S161 WeakPolarHBondContact O-CA 3.32Å; D157-S161 PolarHBondContact O-N 3.41Å
162	T	87.3	Confident	83	Confident	79 Å²	79	60.1 Å²	60.1	49%	0.485	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	152.4	-177	59	0	0	0	0	113.3	W156 D157 T160 R164	W156-T162 WeakPolarHBondContact CA-O 3.31Å; D157-T162 PolarHBondContact N-O 3.3Å; D157-T162 PolarHBondContact O-N 2.9Å; T160-T162 PolarHBondContact O-N 3.15Å; T160-T162 PolarHBondContact OG1-N 3.49Å; T160-T162 PolarHBondContact OG1-OG1 3.04Å; T162-R164 PolarHBondContact O-N 3.36Å
163	C	86.9	Confident	82.2	Confident	60 Å²	60	62 Å²	62	41%	0.405	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	107.5	170.8	167.9	0	0	0	0	109.7	I154 W156	I154-C163 HydrophobicContact CG2-CB 4.08Å; W156-C163 HydrophobicContact CE3-CB 3.97Å; W156-C163 HydrophobicContact CH2-CB 4.39Å; W156-C163 HydrophobicContact CZ3-CB 3.7Å
164	R	86.8	Confident	81.7	Confident	88 Å²	88	65 Å²	65	33%	0.332	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	-41.1	175.5	176.1	177.6	172.7	142	-16.1	111.9	Y144 L155 T162 D203	Y144-R164 VanDerWaalsContact CE1-NH1 3.28Å; Y144-R164 VanDerWaalsContact CZ-NH1 3.26Å; Y144-R164 PolarHBondContact OH-NH1 3.2Å; L155-R164 HydrophobicContact CD2-CG 4.39Å; L155-R164 WeakPolarHBondContact O-CB 3.21Å; L155-R164 PolarHBondContact O-N 3.34Å; T162-R164 PolarHBondContact O-N 3.36Å; R164-D203 PolarHBondContact NH2-O 2.75Å; R164-D203 VanDerWaalsContact NH2-O 3.17Å; R164-D203 IonicContact NH2-OD1 3.96Å
165	C	86.9	Confident	81.2	Confident	45 Å²	45	65.4 Å²	65.4	30%	0.304	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	142.8	178.7	-170.7	0	0	0	0	111.4	I154 L155 L205	I154-C165 WeakPolarHBondContact CA-O 3.5Å; L155-C165 HydrophobicContact CB-CB 4.19Å; L155-C165 PolarHBondContact N-O 3.44Å; L155-C165 PolarHBondContact O-N 3.09Å; C165-L205 HydrophobicContact CB-CD1 3.75Å; C165-L205 HydrophobicContact CB-CD2 4.47Å
166	R	86.3	Confident	80.8	Confident	91 Å²	91	66.4 Å²	66.4	34%	0.343	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	110.2	173.7	-174.5	-174.1	-156	104.2	-4.4	109.9	G127 E152 A153 I154 H168	G127-R166 VanDerWaalsContact O-CZ 3.25Å; G127-R166 PolarHBondContact O-NH1 2.95Å; G127-R166 PolarHBondContact O-NH2 3.44Å; E152-R166 IonicContact OE1-CZ 3.93Å; E152-R166 IonicContact OE1-NE 3.95Å; E152-R166 PolarHBondContact OE1-NE 2.9Å; E152-R166 IonicContact OE1-NH2 3.17Å; E152-R166 PolarHBondContact OE1-NH2 3.44Å; E152-R166 IonicContact OE2-CZ 2.8Å; E152-R166 IonicContact OE2-NH2 3.21Å; E152-R166 PolarHBondContact OE2-NH2 3.46Å; A153-R166 CarbonylContact O-C 3.43Å; A153-R166 WeakPolarHBondContact O-CA 3.48Å; I154-R166 HydrophobicContact CG1-CG 4.18Å; R166-H168 HydrophobicContact CG-CB 4.5Å; R166-H168 PolarHBondContact O-N 3.36Å
167	L	83.7	Confident	80.3	Confident	57 Å²	57	66.3 Å²	66.3	30%	0.298	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	92.5	166.6	178.1	65	0	0	0	108	E152 A153 I169 F192	E152-L167 WeakPolarHBondContact CA-O 3.47Å; A153-L167 HydrophobicContact CB-CB 4.26Å; A153-L167 PolarHBondContact N-O 3.3Å; A153-L167 PolarHBondContact O-N 2.99Å; L167-I169 HydrophobicContact CD1-CG1 4.45Å; L167-I169 HydrophobicContact CD2-CD1 4.28Å; L167-I169 HydrophobicContact CG-CD1 4.21Å; L167-I169 HydrophobicContact CG-CG1 4.04Å; L167-F192 HydrophobicContact CD2-CZ 4.42Å
168	H	78.6	Confident	80.2	Confident	119 Å²	119	66 Å²	66	55%	0.551	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.7	126.9	172.3	-176.4	89.3	0	0	0	109.9	E152 R166	E152-H168 IonicContact OE1-CE1 3.22Å; E152-H168 IonicContact OE1-CG 3.74Å; E152-H168 IonicContact OE1-ND1 3.67Å; E152-H168 PolarHBondContact OE1-ND1 3.48Å; R166-H168 HydrophobicContact CG-CB 4.5Å; R166-H168 PolarHBondContact O-N 3.36Å
169	I	73.9	Confident	80.3	Confident	23 Å²	23	66.9 Å²	66.9	12%	0.118	35%	0.354	C	S	.	.			trans	-113.5	120.7	-172.1	-57.6	151.7	0	0	0	108.7	S151 L167 V173 L175 F192	S151-I169 WeakPolarHBondContact O-CB 3.3Å; S151-I169 PolarHBondContact O-N 3.4Å; L167-I169 HydrophobicContact CD1-CG1 4.45Å; L167-I169 HydrophobicContact CD2-CD1 4.28Å; L167-I169 HydrophobicContact CG-CD1 4.21Å; L167-I169 HydrophobicContact CG-CG1 4.04Å; I169-V173 VanDerWaalsContact CG2-O 3.22Å; I169-V173 WeakPolarHBondContact CG2-O 3.47Å; I169-L175 HydrophobicContact CD1-CB 3.73Å; I169-L175 HydrophobicContact CD1-CD1 3.76Å; I169-L175 HydrophobicContact CD1-CD2 3.82Å; I169-L175 HydrophobicContact CD1-CG 3.98Å; I169-F192 HydrophobicContact CD1-CD1 4.34Å; I169-F192 HydrophobicContact CD1-CE1 3.58Å; I169-F192 HydrophobicContact CD1-CZ 4.34Å; I169-F192 HydrophobicContact CG1-CE1 4Å; I169-F192 HydrophobicContact CG2-CE1 4.25Å
170	G	62.9	Low	80.5	Confident	49 Å²	49	62.6 Å²	62.6	51%	0.505	33%	0.331	S	S	.	.			trans	-62.2	154.7	177.8	0	0	0	0	0	112.5	K172	G170-K172 PolarHBondContact O-N 3.1Å
171	Q	59	Low	80.6	Confident	204 Å²	204	59.8 Å²	59.8	95%	0.953	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	2	-166.7	-64.7	176.2	-33.4	0	0	118.9
172	K	61.6	Low	80.5	Confident	205 Å²	205	59.5 Å²	59.5	89%	0.891	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-25.3	-176.7	-67.4	-173.2	177.3	-179.8	0	114.8	G170	G170-K172 PolarHBondContact O-N 3.1Å
173	V	71.1	Confident	79.7	Confident	41 Å²	41	58.1 Å²	58.1	25%	0.248	30%	0.303	C	S	.	.	S	Bend	trans	-143.5	128.5	-177.3	-172.6	0	0	0	0	110.1	I169 F192 D194	I169-V173 VanDerWaalsContact CG2-O 3.22Å; I169-V173 WeakPolarHBondContact CG2-O 3.47Å; V173-F192 HydrophobicContact CG1-CB 3.89Å; V173-F192 HydrophobicContact CG1-CD1 4.09Å; V173-F192 HydrophobicContact CG1-CG 4.46Å; V173-D194 HydrophobicContact CG1-CB 3.89Å; V173-D194 HydrophobicContact CG2-CB 4.29Å
174	N	80	Confident	79.2	Confident	67 Å²	67	57.8 Å²	57.8	36%	0.358	30%	0.301	S	S	.	.			trans	-80.9	150.2	175	-62.9	-24.5	0	0	0	111.3	Q193	N174-Q193 HydrophobicContact CB-CB 4.07Å; N174-Q193 PolarHBondContact ND2-OE1 3.42Å; N174-Q193 WeakPolarHBondContact O-CB 3.47Å; N174-Q193 PolarHBondContact O-N 2.77Å
175	L	81.9	Confident	78.9	Confident	10 Å²	10	53.7 Å²	53.7	5%	0.052	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	133.3	172.5	-167.7	58.7	0	0	0	110.2	T148 L150 A153 I169 V178 F192	T148-L175 HydrophobicContact CG2-CD2 4.25Å; L150-L175 PolarHBondContact O-N 2.85Å; A153-L175 HydrophobicContact CB-CD2 3.77Å; I169-L175 HydrophobicContact CD1-CB 3.73Å; I169-L175 HydrophobicContact CD1-CD1 3.76Å; I169-L175 HydrophobicContact CD1-CD2 3.82Å; I169-L175 HydrophobicContact CD1-CG 3.98Å; L175-V178 HydrophobicContact CD1-CG2 3.67Å; L175-V178 HydrophobicContact CD2-CG2 3.68Å; L175-V178 HydrophobicContact CG-CG2 3.94Å; L175-F192 HydrophobicContact CD1-CD1 4.21Å; L175-F192 HydrophobicContact CD1-CE1 4.12Å; L175-F192 HydrophobicContact CD1-CZ 4.4Å
176	V	83.4	Confident	78.7	Confident	27 Å²	27	56.9 Å²	56.9	16%	0.164	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	-51.1	-177.7	172.5	0	0	0	0	111	C191 Q193 Y221 R222	V176-C191 HydrophobicContact CB-CB 4.48Å; V176-C191 WeakPolarHBondContact CB-O 3.37Å; V176-C191 PolarHBondContact N-O 3.36Å; V176-Q193 HydrophobicContact CG2-CB 4Å; V176-Y221 WeakPolarHBondContact CG2-O 3.02Å; V176-R222 VanDerWaalsContact CG1-CA 3.44Å; V176-R222 WeakPolarHBondContact CG1-O 3.29Å
177	S	83.7	Confident	78.8	Confident	7 Å²	7	53.6 Å²	53.6	5%	0.049	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	151.6	174.5	-169.1	0	0	0	0	109.8	N134 T179 C191	N134-S177 PolarHBondContact ND2-OG 3.47Å; S177-T179 PolarHBondContact OG-OG1 2.9Å; S177-T179 VanDerWaalsContact OG-OG1 3.07Å; S177-C191 PolarHBondContact N-O 2.97Å; S177-C191 PolarHBondContact O-N 3.06Å
178	V	87.7	Confident	79.1	Confident	5 Å²	5	51.3 Å²	51.3	3%	0.03	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	125.2	166.8	-169.7	0	0	0	0	107.5	L146 T148 A153 L175 I188 V189	L146-V178 HydrophobicContact CD1-CG1 4.09Å; L146-V178 HydrophobicContact CD2-CG1 4.07Å; T148-V178 HydrophobicContact CG2-CB 3.56Å; T148-V178 HydrophobicContact CG2-CG2 3.71Å; A153-V178 HydrophobicContact CB-CB 4.26Å; A153-V178 HydrophobicContact CB-CG2 3.8Å; L175-V178 HydrophobicContact CD1-CG2 3.67Å; L175-V178 HydrophobicContact CD2-CG2 3.68Å; L175-V178 HydrophobicContact CG-CG2 3.94Å; V178-I188 HydrophobicContact CG1-CG2 3.37Å; V178-V189 VanDerWaalsContact CA-O 3.25Å; V178-V189 WeakPolarHBondContact CA-O 3.35Å
179	T	90.1	Very high	79.6	Confident	26 Å²	26	45.6 Å²	45.6	16%	0.16	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	142.8	-166.3	-45.7	0	0	0	0	109.2	S136 S177 V189	S136-T179 WeakPolarHBondContact OG-CG2 3.36Å; S177-T179 PolarHBondContact OG-OG1 2.9Å; S177-T179 VanDerWaalsContact OG-OG1 3.07Å; T179-V189 PolarHBondContact N-O 3.42Å; T179-V189 PolarHBondContact O-N 3.18Å
180	F	89.5	Confident	80.3	Confident	5 Å²	5	44.5 Å²	44.5	2%	0.022	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	144.8	169.9	-67.6	-73.7	0	0	0	111.3	S136 V137 Q138 Y144 L146 L155 P182 G185 I188 T202	S136-F180 WeakPolarHBondContact O-CE2 3.41Å; S136-F180 PolarHBondContact OG-N 3.5Å; V137-F180 WeakPolarHBondContact O-CD2 3.33Å; Q138-F180 HydrophobicContact CB-CD1 4.38Å; Q138-F180 HydrophobicContact CB-CD2 4.23Å; Q138-F180 HydrophobicContact CB-CE1 4.21Å; Q138-F180 HydrophobicContact CB-CE2 4.05Å; Q138-F180 HydrophobicContact CB-CG 4.39Å; Q138-F180 HydrophobicContact CB-CZ 4.04Å; Q138-F180 HydrophobicContact CG-CD1 4.35Å; Q138-F180 HydrophobicContact CG-CE1 4.42Å; Q138-F180 VanDerWaalsContact N-CD2 3.31Å; Q138-F180 VanDerWaalsContact N-CE2 3.27Å; Y144-F180 WeakPolarHBondContact O-CE2 3.27Å; L146-F180 HydrophobicContact CB-CD2 4.42Å; L146-F180 HydrophobicContact CB-CE2 3.88Å; L146-F180 HydrophobicContact CB-CZ 4.33Å; L146-F180 HydrophobicContact CD1-CD1 3.94Å; L146-F180 HydrophobicContact CD1-CD2 3.76Å; L146-F180 HydrophobicContact CD1-CE1 3.75Å; L146-F180 HydrophobicContact CD1-CE2 3.58Å; L146-F180 HydrophobicContact CD1-CG 3.95Å; L146-F180 HydrophobicContact CD1-CZ 3.57Å; L146-F180 HydrophobicContact CG-CD2 4.3Å; L146-F180 HydrophobicContact CG-CE1 4.24Å; L146-F180 HydrophobicContact CG-CE2 3.65Å; L146-F180 HydrophobicContact CG-CZ 3.61Å; L155-F180 HydrophobicContact CD1-CE1 4.4Å; L155-F180 HydrophobicContact CD1-CZ 3.83Å; F180-P182 WeakPolarHBondContact O-CD 3.29Å; F180-G185 WeakPolarHBondContact CD1-O 3.34Å; F180-I188 HydrophobicContact CD1-CG1 3.86Å; F180-I188 HydrophobicContact CE1-CD1 4.08Å; F180-I188 HydrophobicContact CE1-CG1 3.77Å; F180-T202 HydrophobicContact CE1-CG2 3.89Å
181	I	86.3	Confident	81.5	Confident	16 Å²	16	42.2 Å²	42.2	8%	0.082	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-78.8	120.6	171.1	-52.5	-171.4	0	0	0	109.1	G185 Q187 V189 V199 F226 L247	I181-G185 WeakPolarHBondContact O-CA 3.25Å; I181-G185 PolarHBondContact O-N 3.28Å; I181-Q187 HydrophobicContact CB-CB 4.4Å; I181-Q187 HydrophobicContact CD1-CB 3.75Å; I181-Q187 HydrophobicContact CG1-CB 4.03Å; I181-Q187 PolarHBondContact N-O 2.94Å; I181-V189 HydrophobicContact CD1-CG2 3.52Å; I181-V189 HydrophobicContact CG1-CG2 3.53Å; I181-V199 HydrophobicContact CD1-CG1 4.01Å; I181-F226 HydrophobicContact CD1-CE1 4.26Å; I181-F226 HydrophobicContact CG1-CE1 3.95Å; I181-F226 HydrophobicContact CG1-CZ 4.01Å; I181-F226 HydrophobicContact CG2-CD1 4.13Å; I181-F226 HydrophobicContact CG2-CE1 4.24Å; I181-L247 HydrophobicContact CD1-CD1 4.37Å
182	P	82.8	Confident	82.7	Confident	26 Å²	26	33.5 Å²	33.5	17%	0.169	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	153.7	172.4	31.7	-35.1	0	0	0	111	F180 F226 K229 G230	F180-P182 WeakPolarHBondContact O-CD 3.29Å; P182-F226 HydrophobicContact CG-CB 3.82Å; P182-F226 HydrophobicContact CG-CG 4.45Å; P182-K229 CarbonylContact O-C 3.59Å; P182-K229 VanDerWaalsContact O-C 3.3Å; P182-G230 WeakPolarHBondContact O-CA 3.43Å; P182-G230 PolarHBondContact O-N 3.07Å; P182-G230 VanDerWaalsContact O-N 3.07Å
183	P	71.8	Confident	83.7	Confident	49 Å²	49	27.1 Å²	27.1	32%	0.318	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	cis	-84.1	-43.8	2.6	31.2	-32.9	0	0	0	113	P139 G185 G383	P139-P183 WeakPolarHBondContact CB-O 3.45Å; P139-P183 WeakPolarHBondContact CG-O 3.32Å; P183-G185 PolarHBondContact O-N 3.47Å; P183-G383 VanDerWaalsContact CB-O 3.22Å; P183-G383 WeakPolarHBondContact CB-O 3.49Å
184	C	75.9	Confident	83.9	Confident	54 Å²	54	27.5 Å²	27.5	37%	0.365	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-28.2	-166.9	-55.7	0	0	0	0	115	Q138 E186	Q138-C184 PolarHBondContact NE2-O 2.95Å; C184-E186 HydrophobicContact CB-CG 3.9Å; C184-E186 WeakPolarHBondContact CB-OE1 3.45Å; C184-E186 PolarHBondContact O-N 3.39Å
185	G	79.5	Confident	83.9	Confident	1 Å²	1	24.7 Å²	24.7	1%	0.01	14%	0.136	C	C	.	.			trans	66.9	18.9	-175.2	0	0	0	0	0	114.9	Q138 F180 I181 P183 Q187 T202	Q138-G185 PolarHBondContact NE2-O 2.78Å; F180-G185 WeakPolarHBondContact CD1-O 3.34Å; I181-G185 WeakPolarHBondContact O-CA 3.25Å; I181-G185 PolarHBondContact O-N 3.28Å; P183-G185 PolarHBondContact O-N 3.47Å; G185-Q187 PolarHBondContact O-N 2.74Å; G185-T202 PolarHBondContact O-OG1 2.69Å
186	E	83.7	Confident	84	Confident	112 Å²	112	24.5 Å²	24.5	52%	0.523	14%	0.136	S	C	.	.			trans	-65.1	-17.4	171.6	-68.9	166.7	-154.7	0	0	113	C184 T202	C184-E186 HydrophobicContact CB-CG 3.9Å; C184-E186 WeakPolarHBondContact CB-OE1 3.45Å; C184-E186 PolarHBondContact O-N 3.39Å; E186-T202 VanDerWaalsContact C-OG1 3.22Å; E186-T202 WeakPolarHBondContact O-CB 3.45Å; E186-T202 PolarHBondContact O-N 2.68Å; E186-T202 PolarHBondContact O-OG1 2.77Å
187	Q	87.5	Confident	84.2	Confident	22 Å²	22	23.2 Å²	23.2	10%	0.103	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	142.4	177.5	-61.8	-175.8	12.3	0	0	111	I181 G185 V199 W200 L208	I181-Q187 HydrophobicContact CB-CB 4.4Å; I181-Q187 HydrophobicContact CD1-CB 3.75Å; I181-Q187 HydrophobicContact CG1-CB 4.03Å; I181-Q187 PolarHBondContact N-O 2.94Å; G185-Q187 PolarHBondContact O-N 2.74Å; Q187-V199 HydrophobicContact CB-CG1 4.17Å; Q187-W200 CarbonylContact C-O 3.53Å; Q187-W200 WeakPolarHBondContact CA-O 3.36Å; Q187-L208 HydrophobicContact CG-CD1 3.85Å
188	I	89.7	Confident	84.4	Confident	9 Å²	9	26 Å²	26	5%	0.046	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	138.1	175.6	-57	175.6	0	0	0	107.8	L146 L155 V178 F180 V199 W200 T202	L146-I188 HydrophobicContact CD1-CB 4.31Å; L146-I188 HydrophobicContact CD1-CD1 4.09Å; L146-I188 HydrophobicContact CD1-CG1 3.95Å; L146-I188 HydrophobicContact CD1-CG2 3.57Å; L146-I188 HydrophobicContact CD2-CD1 4.4Å; L146-I188 HydrophobicContact CD2-CG2 4.48Å; L155-I188 HydrophobicContact CD1-CD1 4.31Å; V178-I188 HydrophobicContact CG1-CG2 3.37Å; F180-I188 HydrophobicContact CD1-CG1 3.86Å; F180-I188 HydrophobicContact CE1-CD1 4.08Å; F180-I188 HydrophobicContact CE1-CG1 3.77Å; I188-V199 CarbonylContact O-C 3.57Å; I188-V199 WeakPolarHBondContact O-CA 3.48Å; I188-W200 HydrophobicContact CB-CB 4.35Å; I188-W200 PolarHBondContact N-O 2.9Å; I188-W200 PolarHBondContact O-N 2.94Å; I188-T202 HydrophobicContact CD1-CG2 4.46Å; I188-T202 WeakPolarHBondContact CG1-OG1 3.49Å
189	V	90.1	Very high	84.4	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	124.4	170.6	175.7	0	0	0	0	109.8	V178 T179 I181 I197 Y198 V199 I224 F226	V178-V189 VanDerWaalsContact CA-O 3.25Å; V178-V189 WeakPolarHBondContact CA-O 3.35Å; T179-V189 PolarHBondContact N-O 3.42Å; T179-V189 PolarHBondContact O-N 3.18Å; I181-V189 HydrophobicContact CD1-CG2 3.52Å; I181-V189 HydrophobicContact CG1-CG2 3.53Å; V189-I197 HydrophobicContact CG1-CG2 3.29Å; V189-Y198 WeakPolarHBondContact CA-O 3.48Å; V189-V199 HydrophobicContact CG2-CG1 4.18Å; V189-V199 HydrophobicContact CG2-CG2 4.06Å; V189-I224 HydrophobicContact CG1-CD1 4.43Å; V189-F226 HydrophobicContact CB-CZ 3.86Å; V189-F226 HydrophobicContact CG1-CZ 4.26Å; V189-F226 HydrophobicContact CG2-CE1 4.12Å; V189-F226 HydrophobicContact CG2-CZ 3.67Å
190	S	88.2	Confident	84.3	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	123.5	167.6	60.2	0	0	0	0	110.9	F192 I197 Y198 W200	S190-F192 VanDerWaalsContact OG-CE2 3.3Å; S190-F192 WeakPolarHBondContact OG-CE2 3.27Å; S190-I197 WeakPolarHBondContact O-CA 3.42Å; S190-Y198 PolarHBondContact N-O 2.92Å; S190-Y198 PolarHBondContact O-N 3.43Å; S190-W200 PolarHBondContact OG-NE1 3.3Å
191	C	87.5	Confident	84.2	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	128.1	177.4	179.4	0	0	0	0	109.2	V176 S177 I197 Y221 I224	V176-C191 HydrophobicContact CB-CB 4.48Å; V176-C191 WeakPolarHBondContact CB-O 3.37Å; V176-C191 PolarHBondContact N-O 3.36Å; S177-C191 PolarHBondContact N-O 2.97Å; S177-C191 PolarHBondContact O-N 3.06Å; C191-I197 HydrophobicContact CB-CG1 4.33Å; C191-Y221 VanDerWaalsContact SG-CB 3.56Å; C191-I224 HydrophobicContact CB-CD1 4.14Å; C191-I224 HydrophobicContact CB-CG2 4.09Å
192	F	85.2	Confident	84.1	Confident	22 Å²	22	27.9 Å²	27.9	10%	0.096	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	155.6	-175.2	-68.8	-95.2	0	0	0	111.7	L167 I169 V173 L175 S190 D194 G195 S196 Y198	L167-F192 HydrophobicContact CD2-CZ 4.42Å; I169-F192 HydrophobicContact CD1-CD1 4.34Å; I169-F192 HydrophobicContact CD1-CE1 3.58Å; I169-F192 HydrophobicContact CD1-CZ 4.34Å; I169-F192 HydrophobicContact CG1-CE1 4Å; I169-F192 HydrophobicContact CG2-CE1 4.25Å; V173-F192 HydrophobicContact CG1-CB 3.89Å; V173-F192 HydrophobicContact CG1-CD1 4.09Å; V173-F192 HydrophobicContact CG1-CG 4.46Å; L175-F192 HydrophobicContact CD1-CD1 4.21Å; L175-F192 HydrophobicContact CD1-CE1 4.12Å; L175-F192 HydrophobicContact CD1-CZ 4.4Å; S190-F192 VanDerWaalsContact OG-CE2 3.3Å; S190-F192 WeakPolarHBondContact OG-CE2 3.27Å; F192-D194 WeakPolarHBondContact CB-OD1 3.38Å; F192-D194 PolarHBondContact O-N 2.89Å; F192-G195 PolarHBondContact O-N 3.28Å; F192-G195 VanDerWaalsContact O-N 3.07Å; F192-S196 PolarHBondContact N-O 2.75Å; F192-Y198 AromaticContact CD2-CD2 3.85Å; F192-Y198 HydrophobicContact CD2-CD2 3.85Å; F192-Y198 HydrophobicContact CD2-CE2 4.28Å; F192-Y198 AromaticContact CE2-CD2 3.56Å; F192-Y198 HydrophobicContact CE2-CD2 3.56Å; F192-Y198 HydrophobicContact CE2-CE2 4.1Å; F192-Y198 HydrophobicContact CE2-CG 4.41Å
193	Q	81.2	Confident	84.1	Confident	70 Å²	70	31 Å²	31	33%	0.327	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-21.1	-177.3	-177.8	173.9	-70.3	0	0	113.3	N174 V176 G195 R238	N174-Q193 HydrophobicContact CB-CB 4.07Å; N174-Q193 PolarHBondContact ND2-OE1 3.42Å; N174-Q193 WeakPolarHBondContact O-CB 3.47Å; N174-Q193 PolarHBondContact O-N 2.77Å; V176-Q193 HydrophobicContact CG2-CB 4Å; Q193-G195 PolarHBondContact O-N 3.05Å; Q193-R238 VanDerWaalsContact CD-NH1 3.28Å
194	D	76.8	Confident	84.6	Confident	50 Å²	50	31.6 Å²	31.6	27%	0.267	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-11.1	172.4	72.6	-29.9	0	0	0	112.8	V173 F192 S196 N218	V173-D194 HydrophobicContact CG1-CB 3.89Å; V173-D194 HydrophobicContact CG2-CB 4.29Å; F192-D194 WeakPolarHBondContact CB-OD1 3.38Å; F192-D194 PolarHBondContact O-N 2.89Å; D194-S196 VanDerWaalsContact CG-OG 3.29Å; D194-S196 VanDerWaalsContact OD1-CB 3.24Å; D194-S196 WeakPolarHBondContact OD1-CB 3.46Å; D194-S196 PolarHBondContact OD1-N 3.42Å; D194-S196 PolarHBondContact OD1-OG 3.38Å; D194-S196 WeakPolarHBondContact OD2-CB 3.39Å; D194-S196 PolarHBondContact OD2-OG 2.99Å; D194-N218 WeakPolarHBondContact O-CA 3.4Å; D194-N218 WeakPolarHBondContact O-CB 3.33Å
195	G	79.8	Confident	85.1	Confident	7 Å²	7	32 Å²	32	7%	0.072	16%	0.163	C	C	.	.	S	Bend	trans	92.4	2.4	-175.4	0	0	0	0	0	114.5	F192 Q193 P219 Y221	F192-G195 PolarHBondContact O-N 3.28Å; F192-G195 VanDerWaalsContact O-N 3.07Å; Q193-G195 PolarHBondContact O-N 3.05Å; G195-P219 WeakPolarHBondContact CA-O 3.45Å; G195-Y221 VanDerWaalsContact O-CE2 3.31Å; G195-Y221 WeakPolarHBondContact O-CE2 3.42Å
196	S	83.1	Confident	85.2	Confident	6 Å²	6	38.2 Å²	38.2	4%	0.042	19%	0.192	C	C	.	.			trans	-69.7	136.1	168	-64.1	0	0	0	0	110.7	F192 D194 R210	F192-S196 PolarHBondContact N-O 2.75Å; D194-S196 VanDerWaalsContact CG-OG 3.29Å; D194-S196 VanDerWaalsContact OD1-CB 3.24Å; D194-S196 WeakPolarHBondContact OD1-CB 3.46Å; D194-S196 PolarHBondContact OD1-N 3.42Å; D194-S196 PolarHBondContact OD1-OG 3.38Å; D194-S196 WeakPolarHBondContact OD2-CB 3.39Å; D194-S196 PolarHBondContact OD2-OG 2.99Å; S196-R210 PolarHBondContact OG-NE 3.36Å; S196-R210 PolarHBondContact OG-NH2 3.47Å
197	I	87.6	Confident	85.2	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	126.1	166	-55.7	179.2	0	0	0	107.9	V189 S190 C191 R210 L211 Y221 L233 A235	V189-I197 HydrophobicContact CG1-CG2 3.29Å; S190-I197 WeakPolarHBondContact O-CA 3.42Å; C191-I197 HydrophobicContact CB-CG1 4.33Å; I197-R210 CarbonylContact O-C 3.3Å; I197-R210 WeakPolarHBondContact O-CA 3.5Å; I197-L211 HydrophobicContact CB-CB 4.17Å; I197-L211 HydrophobicContact CB-CD1 4.12Å; I197-L211 HydrophobicContact CB-CG 4.43Å; I197-L211 HydrophobicContact CD1-CD1 4.49Å; I197-L211 HydrophobicContact CG2-CD1 4.01Å; I197-L211 PolarHBondContact O-N 3.22Å; I197-Y221 HydrophobicContact CD1-CD2 3.99Å; I197-Y221 HydrophobicContact CD1-CE2 3.52Å; I197-Y221 HydrophobicContact CG1-CD2 4.05Å; I197-Y221 HydrophobicContact CG1-CE2 3.74Å; I197-L233 HydrophobicContact CD1-CD2 4.08Å; I197-L233 HydrophobicContact CG2-CD2 4.19Å; I197-A235 HydrophobicContact CD1-CB 4.14Å
198	Y	87.7	Confident	84.9	Confident	67 Å²	67	37.9 Å²	37.9	26%	0.263	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	136.5	178.4	-71.2	-101.7	0	0	0	109.9	V189 S190 F192 W200 R210	V189-Y198 WeakPolarHBondContact CA-O 3.48Å; S190-Y198 PolarHBondContact N-O 2.92Å; S190-Y198 PolarHBondContact O-N 3.43Å; F192-Y198 AromaticContact CD2-CD2 3.85Å; F192-Y198 HydrophobicContact CD2-CD2 3.85Å; F192-Y198 HydrophobicContact CD2-CE2 4.28Å; F192-Y198 AromaticContact CE2-CD2 3.56Å; F192-Y198 HydrophobicContact CE2-CD2 3.56Å; F192-Y198 HydrophobicContact CE2-CE2 4.1Å; F192-Y198 HydrophobicContact CE2-CG 4.41Å; Y198-W200 HydrophobicContact CD1-CZ2 4.23Å; Y198-W200 HydrophobicContact CG-CZ2 4.09Å; Y198-W200 PolarHBondContact O-NE1 3.46Å; Y198-R210 HydrophobicContact CD1-CB 3.91Å; Y198-R210 HydrophobicContact CD1-CG 3.99Å; Y198-R210 HydrophobicContact CD2-CG 4.24Å; Y198-R210 HydrophobicContact CE1-CB 3.98Å; Y198-R210 HydrophobicContact CE1-CG 3.84Å; Y198-R210 HydrophobicContact CE2-CG 4.11Å; Y198-R210 HydrophobicContact CG-CB 4.43Å; Y198-R210 HydrophobicContact CG-CG 4.2Å; Y198-R210 VanDerWaalsContact CZ-CD 3.48Å; Y198-R210 PolarHBondContact OH-NE 3.17Å
199	V	88.3	Confident	84.5	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	132	175.7	-168.7	0	0	0	0	108.7	I181 Q187 I188 V189 C207 L208 F209	I181-V199 HydrophobicContact CD1-CG1 4.01Å; Q187-V199 HydrophobicContact CB-CG1 4.17Å; I188-V199 CarbonylContact O-C 3.57Å; I188-V199 WeakPolarHBondContact O-CA 3.48Å; V189-V199 HydrophobicContact CG2-CG1 4.18Å; V189-V199 HydrophobicContact CG2-CG2 4.06Å; V199-C207 CarbonylContact O-C 3.56Å; V199-L208 HydrophobicContact CG1-CD1 4.47Å; V199-L208 PolarHBondContact O-N 3.25Å; V199-F209 HydrophobicContact CB-CD1 4.34Å; V199-F209 HydrophobicContact CB-CD2 4.24Å; V199-F209 HydrophobicContact CB-CE1 4.05Å; V199-F209 HydrophobicContact CB-CE2 3.96Å; V199-F209 HydrophobicContact CB-CG 4.42Å; V199-F209 HydrophobicContact CB-CZ 3.85Å; V199-F209 HydrophobicContact CG1-CE1 4.1Å; V199-F209 HydrophobicContact CG1-CZ 3.97Å; V199-F209 HydrophobicContact CG2-CD2 3.85Å; V199-F209 HydrophobicContact CG2-CE1 4.34Å; V199-F209 HydrophobicContact CG2-CE2 3.37Å; V199-F209 HydrophobicContact CG2-CZ 3.64Å; V199-F209 PolarHBondContact N-O 3.04Å; V199-F209 PolarHBondContact O-N 3.06Å
200	W	88.3	Confident	84	Confident	63 Å²	63	42.9 Å²	42.9	24%	0.239	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	149.8	-173.4	-44.3	74.6	0	0	0	110.1	Q187 I188 S190 Y198 Q206 C207	Q187-W200 CarbonylContact C-O 3.53Å; Q187-W200 WeakPolarHBondContact CA-O 3.36Å; I188-W200 HydrophobicContact CB-CB 4.35Å; I188-W200 PolarHBondContact N-O 2.9Å; I188-W200 PolarHBondContact O-N 2.94Å; S190-W200 PolarHBondContact OG-NE1 3.3Å; Y198-W200 HydrophobicContact CD1-CZ2 4.23Å; Y198-W200 HydrophobicContact CG-CZ2 4.09Å; Y198-W200 PolarHBondContact O-NE1 3.46Å; W200-Q206 CarbonylContact C-O 3.56Å; W200-Q206 VanDerWaalsContact CA-O 3.23Å; W200-Q206 WeakPolarHBondContact CA-O 3.22Å; W200-C207 HydrophobicContact CD2-CB 4.24Å; W200-C207 HydrophobicContact CE3-CB 3.75Å; W200-C207 HydrophobicContact CH2-CB 4.2Å; W200-C207 HydrophobicContact CZ3-CB 3.73Å
201	S	86.9	Confident	83.6	Confident	27 Å²	27	43 Å²	43	19%	0.189	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	135	165	173.4	0	0	0	0	110.1	S204 L205 Q206	S201-S204 WeakPolarHBondContact CB-OG 3.33Å; S201-S204 PolarHBondContact OG-OG 3.07Å; S201-L205 WeakPolarHBondContact O-CA 3.34Å; S201-L205 PolarHBondContact O-N 2.91Å; S201-Q206 PolarHBondContact N-O 3.17Å
202	T	84.8	Confident	82.8	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-40.7	177.2	-64.8	0	0	0	0	112.2	Y144 F180 G185 E186 I188	Y144-T202 HydrophobicContact CD2-CG2 3.43Å; Y144-T202 VanDerWaalsContact CD2-CG2 3.43Å; Y144-T202 HydrophobicContact CE2-CG2 3.69Å; Y144-T202 HydrophobicContact CG-CG2 4.46Å; F180-T202 HydrophobicContact CE1-CG2 3.89Å; G185-T202 PolarHBondContact O-OG1 2.69Å; E186-T202 VanDerWaalsContact C-OG1 3.22Å; E186-T202 WeakPolarHBondContact O-CB 3.45Å; E186-T202 PolarHBondContact O-N 2.68Å; E186-T202 PolarHBondContact O-OG1 2.77Å; I188-T202 HydrophobicContact CD1-CG2 4.46Å; I188-T202 WeakPolarHBondContact CG1-OG1 3.49Å
203	D	82.6	Confident	82	Confident	91 Å²	91	45.3 Å²	45.3	49%	0.487	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-46.1	-173.4	-74.7	-58.5	0	0	0	113.4	Y144 R164	Y144-D203 PolarHBondContact OH-OD1 2.98Å; Y144-D203 VanDerWaalsContact OH-OD1 3.11Å; R164-D203 PolarHBondContact NH2-O 2.75Å; R164-D203 VanDerWaalsContact NH2-O 3.17Å; R164-D203 IonicContact NH2-OD1 3.96Å
204	S	83.2	Confident	81	Confident	63 Å²	63	46.2 Å²	46.2	44%	0.441	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-15.3	179.7	76.4	0	0	0	0	113.9	S201 Q206	S201-S204 WeakPolarHBondContact CB-OG 3.33Å; S201-S204 PolarHBondContact OG-OG 3.07Å; S204-Q206 PolarHBondContact O-N 3.24Å; S204-Q206 VanDerWaalsContact O-N 3.1Å; S204-Q206 PolarHBondContact OG-N 3.42Å
205	L	84.8	Confident	80.3	Confident	61 Å²	61	48.6 Å²	48.6	32%	0.319	26%	0.257	S	S	.	.			trans	57.7	16.1	-175.2	-61.1	167.3	0	0	0	114.4	L155 C165 S201	L155-L205 HydrophobicContact CD2-CD2 3.78Å; C165-L205 HydrophobicContact CB-CD1 3.75Å; C165-L205 HydrophobicContact CB-CD2 4.47Å; S201-L205 WeakPolarHBondContact O-CA 3.34Å; S201-L205 PolarHBondContact O-N 2.91Å
206	Q	82.7	Confident	79.6	Confident	133 Å²	133	52 Å²	52	62%	0.621	27%	0.268	S	S	*	.			trans	-82.9	141	176.1	-63.7	178.7	-1.4	0	0	110.8	W200 S201 S204 L208	W200-Q206 CarbonylContact C-O 3.56Å; W200-Q206 VanDerWaalsContact CA-O 3.23Å; W200-Q206 WeakPolarHBondContact CA-O 3.22Å; S201-Q206 PolarHBondContact N-O 3.17Å; S204-Q206 PolarHBondContact O-N 3.24Å; S204-Q206 VanDerWaalsContact O-N 3.1Å; S204-Q206 PolarHBondContact OG-N 3.42Å; Q206-L208 PolarHBondContact O-N 2.85Å
207	C	82.2	Confident	78.4	Confident	57 Å²	57	55.1 Å²	55.1	39%	0.385	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	118.2	169.2	170.7	0	0	0	0	109.3	V199 W200	V199-C207 CarbonylContact O-C 3.56Å; W200-C207 HydrophobicContact CD2-CB 4.24Å; W200-C207 HydrophobicContact CE3-CB 3.75Å; W200-C207 HydrophobicContact CH2-CB 4.2Å; W200-C207 HydrophobicContact CZ3-CB 3.73Å
208	L	82	Confident	77.4	Confident	69 Å²	69	60.9 Å²	60.9	36%	0.361	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	-51.3	175.8	-61.6	173.4	0	0	0	110.4	Q187 V199 Q206	Q187-L208 HydrophobicContact CG-CD1 3.85Å; V199-L208 HydrophobicContact CG1-CD1 4.47Å; V199-L208 PolarHBondContact O-N 3.25Å; Q206-L208 PolarHBondContact O-N 2.85Å
209	F	80.9	Confident	76.6	Confident	18 Å²	18	57.9 Å²	57.9	8%	0.079	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	164.9	177.6	54.1	-86.5	0	0	0	111.8	V199 L211 L247 H250 F270	V199-F209 HydrophobicContact CB-CD1 4.34Å; V199-F209 HydrophobicContact CB-CD2 4.24Å; V199-F209 HydrophobicContact CB-CE1 4.05Å; V199-F209 HydrophobicContact CB-CE2 3.96Å; V199-F209 HydrophobicContact CB-CG 4.42Å; V199-F209 HydrophobicContact CB-CZ 3.85Å; V199-F209 HydrophobicContact CG1-CE1 4.1Å; V199-F209 HydrophobicContact CG1-CZ 3.97Å; V199-F209 HydrophobicContact CG2-CD2 3.85Å; V199-F209 HydrophobicContact CG2-CE1 4.34Å; V199-F209 HydrophobicContact CG2-CE2 3.37Å; V199-F209 HydrophobicContact CG2-CZ 3.64Å; V199-F209 PolarHBondContact N-O 3.04Å; V199-F209 PolarHBondContact O-N 3.06Å; F209-L211 HydrophobicContact CD2-CD2 4.05Å; F209-L211 HydrophobicContact CE2-CD2 3.91Å; F209-L247 HydrophobicContact CE2-CD2 4.05Å; F209-L247 HydrophobicContact CZ-CD2 4.35Å; F209-H250 HydrophobicContact CD1-CB 4.13Å; F209-H250 AromaticContact CD1-CD2 3.73Å; F209-H250 HydrophobicContact CE1-CB 3.59Å; F209-H250 AromaticContact CE1-CD2 3.82Å; F209-H250 AromaticContact CE1-CG 3.98Å; F209-H250 AromaticContact CG-CD2 3.99Å; F209-H250 HydrophobicContact CZ-CB 4.16Å; F209-F270 HydrophobicContact CD2-CZ 4.37Å
210	R	81	Confident	76	Confident	97 Å²	97	59.8 Å²	59.8	37%	0.366	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	126.2	175.6	-178.6	-170	178.4	-156.6	0.7	108.9	S196 I197 Y198 I212	S196-R210 PolarHBondContact OG-NE 3.36Å; S196-R210 PolarHBondContact OG-NH2 3.47Å; I197-R210 CarbonylContact O-C 3.3Å; I197-R210 WeakPolarHBondContact O-CA 3.5Å; Y198-R210 HydrophobicContact CD1-CB 3.91Å; Y198-R210 HydrophobicContact CD1-CG 3.99Å; Y198-R210 HydrophobicContact CD2-CG 4.24Å; Y198-R210 HydrophobicContact CE1-CB 3.98Å; Y198-R210 HydrophobicContact CE1-CG 3.84Å; Y198-R210 HydrophobicContact CE2-CG 4.11Å; Y198-R210 HydrophobicContact CG-CB 4.43Å; Y198-R210 HydrophobicContact CG-CG 4.2Å; Y198-R210 VanDerWaalsContact CZ-CD 3.48Å; Y198-R210 PolarHBondContact OH-NE 3.17Å; R210-I212 HydrophobicContact CG-CG1 3.97Å
211	L	80	Confident	75.9	Confident	3 Å²	3	56.9 Å²	56.9	2%	0.016	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	124.7	169.4	-52.4	175.2	0	0	0	108.4	I197 F209 L233 W245 L247 F270	I197-L211 HydrophobicContact CB-CB 4.17Å; I197-L211 HydrophobicContact CB-CD1 4.12Å; I197-L211 HydrophobicContact CB-CG 4.43Å; I197-L211 HydrophobicContact CD1-CD1 4.49Å; I197-L211 HydrophobicContact CG2-CD1 4.01Å; I197-L211 PolarHBondContact O-N 3.22Å; F209-L211 HydrophobicContact CD2-CD2 4.05Å; F209-L211 HydrophobicContact CE2-CD2 3.91Å; L211-L233 HydrophobicContact CD1-CD2 3.73Å; L211-W245 HydrophobicContact CB-CD2 4.43Å; L211-W245 HydrophobicContact CB-CE3 4.08Å; L211-W245 HydrophobicContact CB-CH2 4.35Å; L211-W245 HydrophobicContact CB-CZ3 4.04Å; L211-W245 HydrophobicContact CD1-CB 4.25Å; L211-W245 HydrophobicContact CD1-CD2 4.08Å; L211-W245 HydrophobicContact CD1-CE3 4.24Å; L211-W245 HydrophobicContact CD1-CG 4.09Å; L211-W245 HydrophobicContact CD2-CE3 4.14Å; L211-W245 HydrophobicContact CG-CE3 4.4Å; L211-L247 HydrophobicContact CD1-CD2 4.12Å; L211-L247 HydrophobicContact CD2-CD2 4.04Å; L211-F270 HydrophobicContact CD2-CB 3.63Å; L211-F270 HydrophobicContact CD2-CD1 4.23Å; L211-F270 HydrophobicContact CD2-CD2 3.66Å; L211-F270 HydrophobicContact CD2-CE2 4.36Å; L211-F270 HydrophobicContact CD2-CG 3.58Å
212	I	70.3	Confident	75.8	Confident	63 Å²	63	61.6 Å²	61.6	32%	0.323	32%	0.322	S	S	.	.			trans	-127.3	138.4	174.3	-52.5	178.1	0	0	0	107.3	R210	R210-I212 HydrophobicContact CG-CG1 3.97Å
213	N	68.5	Low	76	Confident	7 Å²	7	62.3 Å²	62.3	4%	0.037	33%	0.327	C	S	.	.			trans	-100.8	127	172.6	-176.2	-30.8	0	0	0	108.4	D215 Y216 Y243 W245	N213-D215 PolarHBondContact OD1-N 2.95Å; N213-Y216 VanDerWaalsContact CB-O 3.3Å; N213-Y216 WeakPolarHBondContact CB-O 3.4Å; N213-Y216 PolarHBondContact OD1-N 2.93Å; N213-Y243 WeakPolarHBondContact ND2-CD1 3.48Å; N213-Y243 WeakPolarHBondContact ND2-CE1 3.35Å; N213-W245 HydrophobicContact CB-CH2 3.76Å; N213-W245 HydrophobicContact CB-CZ2 4.08Å
214	S	60	Low	76.4	Confident	89 Å²	89	58.9 Å²	58.9	62%	0.622	31%	0.309	S	S	*	.	S	Bend	trans	-69.9	-38.1	179.5	45.1	0	0	0	0	113.1
215	D	60.7	Low	76.8	Confident	99 Å²	99	57.1 Å²	57.1	53%	0.529	30%	0.295	S	S	.	.	S	Bend	trans	-93.5	-28.5	-164.3	-47.2	-16.2	0	0	0	111	N213	N213-D215 PolarHBondContact OD1-N 2.95Å
216	Y	66.7	Low	77	Confident	80 Å²	80	55 Å²	55	31%	0.314	28%	0.283	S	S	.	.	S	Bend	trans	-127.1	87.9	173.5	-53.5	-94.2	0	0	0	106.9	N213 N218 P219 Y243 L274	N213-Y216 VanDerWaalsContact CB-O 3.3Å; N213-Y216 WeakPolarHBondContact CB-O 3.4Å; N213-Y216 PolarHBondContact OD1-N 2.93Å; Y216-N218 VanDerWaalsContact C-N 3.3Å; Y216-N218 PolarHBondContact O-N 2.83Å; Y216-P219 VanDerWaalsContact O-CD 3.31Å; Y216-P219 WeakPolarHBondContact O-CD 3.38Å; Y216-Y243 HydrophobicContact CD2-CE1 4.2Å; Y216-Y243 HydrophobicContact CG-CE1 4.27Å; Y216-L274 HydrophobicContact CD2-CD2 4.34Å; Y216-L274 HydrophobicContact CE2-CD2 3.48Å; Y216-L274 VanDerWaalsContact CE2-CD2 3.48Å
217	P	58.1	Low	77.1	Confident	71 Å²	71	48.7 Å²	48.7	46%	0.461	25%	0.254	S	S	.	.	S	Bend	trans	-67.3	-28.9	-172.4	23.2	-33.5	0	0	0	113.8	P219	P217-P219 VanDerWaalsContact C-CD 3.47Å; P217-P219 WeakPolarHBondContact O-CD 2.81Å
218	N	66	Low	77	Confident	121 Å²	121	47.7 Å²	47.7	65%	0.647	25%	0.247	S	C	*	.	S	Bend	trans	-124	66.3	-177.1	-62	19.6	0	0	0	112.6	D194 Y216 P220	D194-N218 WeakPolarHBondContact O-CA 3.4Å; D194-N218 WeakPolarHBondContact O-CB 3.33Å; Y216-N218 VanDerWaalsContact C-N 3.3Å; Y216-N218 PolarHBondContact O-N 2.83Å; N218-P220 WeakPolarHBondContact O-CD 3.46Å
219	P	71.5	Confident	76.8	Confident	3 Å²	3	50.3 Å²	50.3	2%	0.019	26%	0.256	C	S	.	.			trans	-70	119.1	177.8	29	-34.1	0	0	0	109.8	G195 Y216 P217 Y221 Y243	G195-P219 WeakPolarHBondContact CA-O 3.45Å; Y216-P219 VanDerWaalsContact O-CD 3.31Å; Y216-P219 WeakPolarHBondContact O-CD 3.38Å; P217-P219 VanDerWaalsContact C-CD 3.47Å; P217-P219 WeakPolarHBondContact O-CD 2.81Å; P219-Y221 VanDerWaalsContact C-N 3.27Å; P219-Y221 HydrophobicContact CB-CD1 4.4Å; P219-Y221 HydrophobicContact CB-CE1 3.88Å; P219-Y221 HydrophobicContact CB-CE2 4.21Å; P219-Y221 HydrophobicContact CG-CD2 4.27Å; P219-Y221 HydrophobicContact CG-CE1 4.08Å; P219-Y221 HydrophobicContact CG-CE2 3.55Å; P219-Y221 VanDerWaalsContact CG-CZ 3.44Å; P219-Y221 PolarHBondContact O-N 3.05Å; P219-Y243 HydrophobicContact CB-CE1 4.23Å; P219-Y243 HydrophobicContact CB-CE2 4.03Å
220	P	75.2	Confident	76.7	Confident	40 Å²	40	49.6 Å²	49.6	26%	0.26	25%	0.254	S	S	.	.			trans	-81.9	71.8	-169	33.9	-37.6	0	0	0	111.5	N218 G237 R238	N218-P220 WeakPolarHBondContact O-CD 3.46Å; P220-G237 CarbonylContact O-C 3.58Å; P220-G237 WeakPolarHBondContact O-CA 3.47Å; P220-R238 HydrophobicContact CB-CB 3.96Å; P220-R238 HydrophobicContact CB-CG 4.48Å; P220-R238 HydrophobicContact CG-CB 3.83Å; P220-R238 PolarHBondContact O-N 3.16Å
221	Y	85.1	Confident	76.9	Confident	2 Å²	2	47.1 Å²	47.1	1%	0.008	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	152.6	-178.1	-61	-50.7	0	0	0	113.1	V176 C191 G195 I197 P219 A235 Y243 W245	V176-Y221 WeakPolarHBondContact CG2-O 3.02Å; C191-Y221 VanDerWaalsContact SG-CB 3.56Å; G195-Y221 VanDerWaalsContact O-CE2 3.31Å; G195-Y221 WeakPolarHBondContact O-CE2 3.42Å; I197-Y221 HydrophobicContact CD1-CD2 3.99Å; I197-Y221 HydrophobicContact CD1-CE2 3.52Å; I197-Y221 HydrophobicContact CG1-CD2 4.05Å; I197-Y221 HydrophobicContact CG1-CE2 3.74Å; P219-Y221 VanDerWaalsContact C-N 3.27Å; P219-Y221 HydrophobicContact CB-CD1 4.4Å; P219-Y221 HydrophobicContact CB-CE1 3.88Å; P219-Y221 HydrophobicContact CB-CE2 4.21Å; P219-Y221 HydrophobicContact CG-CD2 4.27Å; P219-Y221 HydrophobicContact CG-CE1 4.08Å; P219-Y221 HydrophobicContact CG-CE2 3.55Å; P219-Y221 VanDerWaalsContact CG-CZ 3.44Å; P219-Y221 PolarHBondContact O-N 3.05Å; Y221-A235 HydrophobicContact CD1-CB 3.64Å; Y221-A235 HydrophobicContact CE1-CB 3.36Å; Y221-A235 HydrophobicContact CE2-CB 4.44Å; Y221-A235 HydrophobicContact CG-CB 4.3Å; Y221-Y243 AromaticContact CE1-CD2 3.67Å; Y221-Y243 HydrophobicContact CE1-CD2 3.67Å; Y221-Y243 HydrophobicContact CE1-CE2 4.24Å; Y221-Y243 HydrophobicContact CE1-CG 4.06Å; Y221-W245 WeakPolarHBondContact OH-CZ2 3.43Å; Y221-W245 PolarHBondContact OH-NE1 2.98Å
222	R	86.3	Confident	77.2	Confident	126 Å²	126	47.4 Å²	47.4	48%	0.475	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	-25.8	176.8	-172.9	179.3	172.5	151.7	7.7	112.2	V176 A236	V176-R222 VanDerWaalsContact CG1-CA 3.44Å; V176-R222 WeakPolarHBondContact CG1-O 3.29Å; R222-A236 PolarHBondContact N-O 3.34Å
223	T	88.5	Confident	78.2	Confident	15 Å²	15	44.4 Å²	44.4	9%	0.092	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	140.9	-171.8	178.4	0	0	0	0	109.4	A236 V284 R286 I287	T223-A236 HydrophobicContact CG2-CB 4.24Å; T223-A236 PolarHBondContact N-O 3.04Å; T223-A236 PolarHBondContact O-N 2.94Å; T223-A236 VanDerWaalsContact O-O 3.1Å; T223-V284 HydrophobicContact CG2-CG1 4.36Å; T223-R286 WeakPolarHBondContact OG1-CA 3.42Å; T223-I287 HydrophobicContact CG2-CB 4.48Å; T223-I287 HydrophobicContact CG2-CD1 4.39Å; T223-I287 HydrophobicContact CG2-CG1 3.9Å; T223-I287 HydrophobicContact CG2-CG2 4.23Å; T223-I287 PolarHBondContact OG1-N 2.72Å; T223-I287 VanDerWaalsContact OG1-N 3.07Å
224	I	91.1	Very high	79.2	Confident	20 Å²	20	44 Å²	44	10%	0.103	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	149	178.2	56.3	170.4	0	0	0	109.2	V189 C191 L233 F234 A235	V189-I224 HydrophobicContact CG1-CD1 4.43Å; C191-I224 HydrophobicContact CB-CD1 4.14Å; C191-I224 HydrophobicContact CB-CG2 4.09Å; I224-L233 HydrophobicContact CB-CD1 3.89Å; I224-L233 HydrophobicContact CG2-CD1 4.18Å; I224-F234 WeakPolarHBondContact CA-O 3.35Å; I224-A235 HydrophobicContact CG2-CB 3.94Å
225	T	90.4	Very high	80.6	Confident	25 Å²	25	39.8 Å²	39.8	15%	0.153	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	153	170.2	-163.4	0	0	0	0	110.2	F234 I287 W289 L315	T225-F234 HydrophobicContact CG2-CB 3.96Å; T225-F234 HydrophobicContact CG2-CD2 4.3Å; T225-F234 PolarHBondContact N-O 2.87Å; T225-F234 PolarHBondContact O-N 3.01Å; T225-I287 HydrophobicContact CG2-CB 4.27Å; T225-I287 HydrophobicContact CG2-CD1 4.08Å; T225-I287 HydrophobicContact CG2-CG1 3.82Å; T225-W289 HydrophobicContact CG2-CB 4.18Å; T225-L315 HydrophobicContact CG2-CD1 4.42Å
226	F	89.3	Confident	82	Confident	18 Å²	18	35.1 Å²	35.1	8%	0.079	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	154	-177.4	-65.1	-87.5	0	0	0	110.8	I181 P182 V189 Y232 L233 L247	I181-F226 HydrophobicContact CD1-CE1 4.26Å; I181-F226 HydrophobicContact CG1-CE1 3.95Å; I181-F226 HydrophobicContact CG1-CZ 4.01Å; I181-F226 HydrophobicContact CG2-CD1 4.13Å; I181-F226 HydrophobicContact CG2-CE1 4.24Å; P182-F226 HydrophobicContact CG-CB 3.82Å; P182-F226 HydrophobicContact CG-CG 4.45Å; V189-F226 HydrophobicContact CB-CZ 3.86Å; V189-F226 HydrophobicContact CG1-CZ 4.26Å; V189-F226 HydrophobicContact CG2-CE1 4.12Å; V189-F226 HydrophobicContact CG2-CZ 3.67Å; F226-Y232 WeakPolarHBondContact CA-O 3.46Å; F226-L233 HydrophobicContact CD1-CB 3.99Å; F226-L233 HydrophobicContact CD1-CD1 4.2Å; F226-L233 HydrophobicContact CE1-CB 3.87Å; F226-L233 HydrophobicContact CE1-CD1 3.81Å; F226-L233 HydrophobicContact CE1-CD2 4.28Å; F226-L233 HydrophobicContact CE1-CG 4.2Å; F226-L233 HydrophobicContact CE2-CD1 4.42Å; F226-L233 HydrophobicContact CZ-CD1 3.92Å; F226-L247 HydrophobicContact CD1-CD1 4.41Å; F226-L247 HydrophobicContact CE1-CD1 4.07Å
227	T	85.8	Confident	82.9	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.16	C	C	.	.			trans	-67.8	162.5	161.1	54.2	0	0	0	0	110.9	K229 G230 Y232 F234 W289 E310 L311	T227-K229 PolarHBondContact O-N 2.76Å; T227-K229 VanDerWaalsContact O-N 3.14Å; T227-G230 PolarHBondContact O-N 3.07Å; T227-Y232 HydrophobicContact CG2-CD2 4.32Å; T227-Y232 HydrophobicContact CG2-CG 4.45Å; T227-Y232 PolarHBondContact N-O 2.98Å; T227-Y232 PolarHBondContact OG1-N 2.93Å; T227-Y232 VanDerWaalsContact OG1-N 3.09Å; T227-Y232 PolarHBondContact OG1-O 3.34Å; T227-F234 HydrophobicContact CG2-CE2 3.95Å; T227-W289 HydrophobicContact CG2-CD2 4.24Å; T227-W289 HydrophobicContact CG2-CG 4.41Å; T227-W289 HydrophobicContact CG2-CZ2 4.31Å; T227-E310 WeakPolarHBondContact CB-OE1 3.23Å; T227-E310 HydrophobicContact CG2-CG 4.47Å; T227-E310 PolarHBondContact OG1-OE1 2.84Å; T227-L311 HydrophobicContact CG2-CD2 4.13Å
228	S	79.1	Confident	84.3	Confident	36 Å²	36	34.5 Å²	34.5	25%	0.252	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-18.3	-172.1	50.6	0	0	0	0	114.9	Y382	S228-Y382 WeakPolarHBondContact CB-O 3.45Å
229	K	78	Confident	85.2	Confident	124 Å²	124	29.5 Å²	29.5	54%	0.539	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	2.3	171	-49.8	-170.8	173.3	-166.1	0	114	P182 T227 H231 E310	P182-K229 CarbonylContact O-C 3.59Å; P182-K229 VanDerWaalsContact O-C 3.3Å; T227-K229 PolarHBondContact O-N 2.76Å; T227-K229 VanDerWaalsContact O-N 3.14Å; K229-H231 PolarHBondContact O-N 3.22Å; K229-H231 VanDerWaalsContact O-N 3.08Å; K229-H231 PolarHBondContact O-ND1 3.1Å; K229-E310 VanDerWaalsContact CB-OE1 3.29Å; K229-E310 WeakPolarHBondContact CB-OE1 3.26Å; K229-E310 PolarHBondContact N-OE1 3.26Å
230	G	79.3	Confident	85.8	Confident	3 Å²	3	30.5 Å²	30.5	3%	0.031	14%	0.144	C	C	.	.	S	Bend	trans	69.2	0.6	-175.8	0	0	0	0	0	115.1	P182 T227 Y232	P182-G230 WeakPolarHBondContact O-CA 3.43Å; P182-G230 PolarHBondContact O-N 3.07Å; P182-G230 VanDerWaalsContact O-N 3.07Å; T227-G230 PolarHBondContact O-N 3.07Å; G230-Y232 PolarHBondContact O-N 3.14Å
231	H	84.2	Confident	86.4	Confident	44 Å²	44	30.8 Å²	30.8	20%	0.204	14%	0.141	C	C	.	.	S	Bend	trans	-69.7	-21.3	-176.2	-67.9	-2.5	0	0	0	113.3	K229 L247 K248 E310	K229-H231 PolarHBondContact O-N 3.22Å; K229-H231 VanDerWaalsContact O-N 3.08Å; K229-H231 PolarHBondContact O-ND1 3.1Å; H231-L247 PolarHBondContact O-N 3.43Å; H231-K248 HydrophobicContact CB-CD 4.4Å; H231-K248 HydrophobicContact CB-CG 3.68Å; H231-E310 WeakPolarHBondContact CB-OE2 3.42Å; H231-E310 IonicContact CD2-OE2 2.84Å; H231-E310 PolarHBondContact CD2-OE2 2.89Å; H231-E310 IonicContact CG-OE2 2.77Å
232	Y	88.2	Confident	86.6	Confident	9 Å²	9	30.7 Å²	30.7	4%	0.035	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	142.6	175.6	-67.3	-80	0	0	0	111.9	F226 T227 G230 L244 W245 D246 K248 E310 L311	F226-Y232 WeakPolarHBondContact CA-O 3.46Å; T227-Y232 HydrophobicContact CG2-CD2 4.32Å; T227-Y232 HydrophobicContact CG2-CG 4.45Å; T227-Y232 PolarHBondContact N-O 2.98Å; T227-Y232 PolarHBondContact OG1-N 2.93Å; T227-Y232 VanDerWaalsContact OG1-N 3.09Å; T227-Y232 PolarHBondContact OG1-O 3.34Å; G230-Y232 PolarHBondContact O-N 3.14Å; Y232-L244 HydrophobicContact CD1-CD1 3.9Å; Y232-L244 HydrophobicContact CD1-CG 4.33Å; Y232-L244 HydrophobicContact CG-CD1 4.2Å; Y232-W245 VanDerWaalsContact CA-O 3.29Å; Y232-W245 WeakPolarHBondContact CA-O 3.23Å; Y232-D246 HydrophobicContact CD1-CB 4.06Å; Y232-D246 HydrophobicContact CE1-CB 3.6Å; Y232-D246 WeakPolarHBondContact CE1-OD2 3.42Å; Y232-D246 PolarHBondContact OH-OD2 3.31Å; Y232-K248 WeakPolarHBondContact OH-CE 3.39Å; Y232-K248 PolarHBondContact OH-NZ 3.47Å; Y232-E310 HydrophobicContact CE2-CB 4.42Å; Y232-L311 HydrophobicContact CD1-CD1 4.27Å; Y232-L311 HydrophobicContact CD1-CD2 4.2Å; Y232-L311 HydrophobicContact CD2-CD1 4.38Å; Y232-L311 HydrophobicContact CD2-CD2 3.83Å; Y232-L311 HydrophobicContact CD2-CG 3.93Å; Y232-L311 HydrophobicContact CE1-CD1 4.01Å; Y232-L311 HydrophobicContact CE2-CD1 4.12Å; Y232-L311 HydrophobicContact CE2-CD2 4.36Å; Y232-L311 HydrophobicContact CE2-CG 3.96Å; Y232-L311 HydrophobicContact CG-CD1 4.48Å; Y232-L311 HydrophobicContact CG-CD2 3.77Å; Y232-L311 HydrophobicContact CG-CG 4.25Å
233	L	89.4	Confident	86.7	Confident	0 Å²	0	25 Å²	25	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	118	176.3	162.4	62.8	0	0	0	109.3	I197 L211 I224 F226 W245 L247	I197-L233 HydrophobicContact CD1-CD2 4.08Å; I197-L233 HydrophobicContact CG2-CD2 4.19Å; L211-L233 HydrophobicContact CD1-CD2 3.73Å; I224-L233 HydrophobicContact CB-CD1 3.89Å; I224-L233 HydrophobicContact CG2-CD1 4.18Å; F226-L233 HydrophobicContact CD1-CB 3.99Å; F226-L233 HydrophobicContact CD1-CD1 4.2Å; F226-L233 HydrophobicContact CE1-CB 3.87Å; F226-L233 HydrophobicContact CE1-CD1 3.81Å; F226-L233 HydrophobicContact CE1-CD2 4.28Å; F226-L233 HydrophobicContact CE1-CG 4.2Å; F226-L233 HydrophobicContact CE2-CD1 4.42Å; F226-L233 HydrophobicContact CZ-CD1 3.92Å; L233-W245 HydrophobicContact CB-CB 4.18Å; L233-W245 PolarHBondContact N-O 3.08Å; L233-W245 PolarHBondContact O-N 3.03Å; L233-L247 HydrophobicContact CB-CD1 3.92Å; L233-L247 HydrophobicContact CB-CG 4.47Å
234	F	90.8	Very high	86.8	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	132.8	166.1	-63.5	-90.2	0	0	0	109.3	I224 T225 T227 V242 Y243 L244 I287 W289 L311 L315 W358	I224-F234 WeakPolarHBondContact CA-O 3.35Å; T225-F234 HydrophobicContact CG2-CB 3.96Å; T225-F234 HydrophobicContact CG2-CD2 4.3Å; T225-F234 PolarHBondContact N-O 2.87Å; T225-F234 PolarHBondContact O-N 3.01Å; T227-F234 HydrophobicContact CG2-CE2 3.95Å; F234-V242 HydrophobicContact CB-CG1 4.31Å; F234-V242 HydrophobicContact CD1-CG1 4.05Å; F234-Y243 CarbonylContact C-O 3.58Å; F234-Y243 WeakPolarHBondContact CA-O 3.48Å; F234-L244 HydrophobicContact CD1-CB 4.29Å; F234-L244 HydrophobicContact CD1-CD1 3.85Å; F234-L244 HydrophobicContact CD2-CD1 4.25Å; F234-L244 HydrophobicContact CE1-CB 4.3Å; F234-L244 HydrophobicContact CE1-CD1 3.67Å; F234-L244 HydrophobicContact CE1-CD2 4.01Å; F234-L244 HydrophobicContact CE1-CG 4.21Å; F234-L244 HydrophobicContact CE2-CD1 4.09Å; F234-L244 HydrophobicContact CG-CD1 4.14Å; F234-L244 HydrophobicContact CZ-CD1 3.79Å; F234-L244 HydrophobicContact CZ-CD2 4.3Å; F234-I287 HydrophobicContact CB-CD1 3.85Å; F234-I287 WeakPolarHBondContact O-CD1 3.42Å; F234-W289 HydrophobicContact CD2-CE3 4.4Å; F234-W289 HydrophobicContact CE2-CD2 4Å; F234-W289 AromaticContact CE2-CE3 3.54Å; F234-W289 HydrophobicContact CE2-CE3 3.54Å; F234-W289 AromaticContact CE2-CZ3 3.91Å; F234-W289 HydrophobicContact CE2-CZ3 3.91Å; F234-W289 AromaticContact CZ-CE3 3.84Å; F234-W289 HydrophobicContact CZ-CE3 3.84Å; F234-W289 HydrophobicContact CZ-CH2 4.45Å; F234-W289 AromaticContact CZ-CZ3 3.73Å; F234-W289 HydrophobicContact CZ-CZ3 3.73Å; F234-L311 HydrophobicContact CE2-CD2 4.28Å; F234-L311 HydrophobicContact CZ-CD2 3.85Å; F234-L315 HydrophobicContact CB-CD1 4.39Å; F234-L315 HydrophobicContact CD1-CD1 4.02Å; F234-L315 HydrophobicContact CD1-CD2 3.88Å; F234-L315 HydrophobicContact CD2-CD1 4.11Å; F234-L315 HydrophobicContact CE1-CD1 4.28Å; F234-L315 HydrophobicContact CE1-CD2 3.89Å; F234-L315 HydrophobicContact CE2-CD1 4.37Å; F234-L315 HydrophobicContact CG-CD1 3.93Å; F234-L315 HydrophobicContact CZ-CD1 4.45Å; F234-W358 AromaticContact CE1-CH2 3.79Å; F234-W358 HydrophobicContact CE1-CH2 3.79Å; F234-W358 AromaticContact CE1-CZ2 3.94Å; F234-W358 HydrophobicContact CE1-CZ2 3.94Å; F234-W358 AromaticContact CZ-CH2 3.77Å; F234-W358 HydrophobicContact CZ-CH2 3.77Å; F234-W358 HydrophobicContact CZ-CZ2 4.22Å
235	A	89.6	Confident	86.6	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	134.3	176	0	0	0	0	0	110.9	I197 Y221 I224 Y243	I197-A235 HydrophobicContact CD1-CB 4.14Å; Y221-A235 HydrophobicContact CD1-CB 3.64Å; Y221-A235 HydrophobicContact CE1-CB 3.36Å; Y221-A235 HydrophobicContact CE2-CB 4.44Å; Y221-A235 HydrophobicContact CG-CB 4.3Å; I224-A235 HydrophobicContact CG2-CB 3.94Å; A235-Y243 PolarHBondContact N-O 3.42Å; A235-Y243 PolarHBondContact O-N 3.38Å
236	A	89.5	Confident	86.2	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	167.1	-179.9	0	0	0	0	0	111.6	R222 T223 V242 V284 I287	R222-A236 PolarHBondContact N-O 3.34Å; T223-A236 HydrophobicContact CG2-CB 4.24Å; T223-A236 PolarHBondContact N-O 3.04Å; T223-A236 PolarHBondContact O-N 2.94Å; T223-A236 VanDerWaalsContact O-O 3.1Å; A236-V242 HydrophobicContact CB-CG1 4.42Å; A236-V242 HydrophobicContact CB-CG2 4.42Å; A236-V284 HydrophobicContact CB-CB 3.8Å; A236-V284 HydrophobicContact CB-CG1 3.98Å; A236-V284 HydrophobicContact CB-CG2 4.05Å; A236-I287 HydrophobicContact CB-CD1 4.04Å; A236-I287 HydrophobicContact CB-CG2 4.06Å
237	G	86.6	Confident	85.8	Confident	1 Å²	1	23.2 Å²	23.2	1%	0.01	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	180	-131.3	-179.9	0	0	0	0	0	115.3	P220 S239 S283 V284	P220-G237 CarbonylContact O-C 3.58Å; P220-G237 WeakPolarHBondContact O-CA 3.47Å; G237-S239 PolarHBondContact O-N 2.88Å; G237-S239 VanDerWaalsContact O-O 3.13Å; G237-S283 CarbonylContact O-C 3.58Å; G237-S283 WeakPolarHBondContact O-CA 3.46Å; G237-S283 PolarHBondContact O-OG 3.38Å; G237-V284 PolarHBondContact O-N 2.79Å
238	R	85.7	Confident	84.9	Confident	137 Å²	137	27 Å²	27	52%	0.517	13%	0.126	S	C	.	.	S	Bend	trans	-71.8	37	-175.3	-55.1	-179.4	170.7	101	-13.2	114	Q193 P220	Q193-R238 VanDerWaalsContact CD-NH1 3.28Å; P220-R238 HydrophobicContact CB-CB 3.96Å; P220-R238 HydrophobicContact CB-CG 4.48Å; P220-R238 HydrophobicContact CG-CB 3.83Å; P220-R238 PolarHBondContact O-N 3.16Å
239	S	84.7	Confident	84	Confident	16 Å²	16	27.9 Å²	27.9	11%	0.112	14%	0.141	C	C	.	.	S	Bend	trans	-150.7	161.6	175	76.4	0	0	0	0	109.7	G237 F241 K282	G237-S239 PolarHBondContact O-N 2.88Å; G237-S239 VanDerWaalsContact O-O 3.13Å; S239-F241 PolarHBondContact O-N 3.49Å; S239-F241 VanDerWaalsContact O-N 3.17Å; S239-F241 PolarHBondContact OG-N 2.97Å; S239-K282 CarbonylContact C-O 3.46Å; S239-K282 VanDerWaalsContact C-O 3.22Å; S239-K282 VanDerWaalsContact CA-O 3.31Å; S239-K282 WeakPolarHBondContact CA-O 3.29Å
240	P	85.8	Confident	82.8	Confident	25 Å²	25	24.9 Å²	24.9	16%	0.162	13%	0.129	C	C	.	.	S	Bend	trans	-78.8	15.2	176.6	34.7	-37.5	0	0	0	113.5	L277	P240-L277 VanDerWaalsContact O-CB 3.3Å; P240-L277 WeakPolarHBondContact O-CB 3.43Å; P240-L277 WeakPolarHBondContact O-CG 3.33Å; P240-L277 PolarHBondContact O-N 3.35Å
241	F	88	Confident	81.3	Confident	45 Å²	45	27.6 Å²	27.6	20%	0.197	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	140.9	-177.3	-61.8	-79.9	0	0	0	111.8	S239 Y243 L274 I275 K276	S239-F241 PolarHBondContact O-N 3.49Å; S239-F241 VanDerWaalsContact O-N 3.17Å; S239-F241 PolarHBondContact OG-N 2.97Å; F241-Y243 HydrophobicContact CB-CD2 4.34Å; F241-Y243 HydrophobicContact CB-CE2 3.64Å; F241-L274 HydrophobicContact CB-CD1 3.93Å; F241-L274 HydrophobicContact CD1-CD1 4.01Å; F241-L274 HydrophobicContact CD1-CD2 4.23Å; F241-L274 HydrophobicContact CD1-CG 4.03Å; F241-L274 HydrophobicContact CE1-CD2 4.45Å; F241-L274 HydrophobicContact CG-CD1 4.26Å; F241-I275 WeakPolarHBondContact CA-O 3.28Å; F241-K276 HydrophobicContact CD1-CB 3.9Å; F241-K276 HydrophobicContact CD1-CG 4.1Å; F241-K276 HydrophobicContact CE1-CB 3.68Å; F241-K276 HydrophobicContact CE1-CD 4.24Å; F241-K276 HydrophobicContact CE1-CG 3.64Å; F241-K276 HydrophobicContact CZ-CD 4.5Å; F241-K276 HydrophobicContact CZ-CG 4.22Å
242	V	89.3	Confident	79	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	127.5	164.6	-167.1	0	0	0	0	107.5	F234 A236 I275 L277 L315 L317	F234-V242 HydrophobicContact CB-CG1 4.31Å; F234-V242 HydrophobicContact CD1-CG1 4.05Å; A236-V242 HydrophobicContact CB-CG1 4.42Å; A236-V242 HydrophobicContact CB-CG2 4.42Å; V242-I275 HydrophobicContact CB-CB 4.16Å; V242-I275 HydrophobicContact CB-CD1 4.29Å; V242-I275 PolarHBondContact N-O 3.08Å; V242-I275 PolarHBondContact O-N 3.12Å; V242-L277 HydrophobicContact CG2-CD1 3.96Å; V242-L277 HydrophobicContact CG2-CD2 4.35Å; V242-L277 HydrophobicContact CG2-CG 4.22Å; V242-L315 HydrophobicContact CG1-CD2 4.33Å; V242-L317 HydrophobicContact CG2-CD2 3.38Å
243	Y	88.5	Confident	76.4	Confident	6 Å²	6	34.8 Å²	34.8	2%	0.024	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	121.8	179.5	-59.6	-103.3	0	0	0	107.6	N213 Y216 P219 Y221 F234 A235 F241 L271 L274	N213-Y243 WeakPolarHBondContact ND2-CD1 3.48Å; N213-Y243 WeakPolarHBondContact ND2-CE1 3.35Å; Y216-Y243 HydrophobicContact CD2-CE1 4.2Å; Y216-Y243 HydrophobicContact CG-CE1 4.27Å; P219-Y243 HydrophobicContact CB-CE1 4.23Å; P219-Y243 HydrophobicContact CB-CE2 4.03Å; Y221-Y243 AromaticContact CE1-CD2 3.67Å; Y221-Y243 HydrophobicContact CE1-CD2 3.67Å; Y221-Y243 HydrophobicContact CE1-CE2 4.24Å; Y221-Y243 HydrophobicContact CE1-CG 4.06Å; F234-Y243 CarbonylContact C-O 3.58Å; F234-Y243 WeakPolarHBondContact CA-O 3.48Å; A235-Y243 PolarHBondContact N-O 3.42Å; A235-Y243 PolarHBondContact O-N 3.38Å; F241-Y243 HydrophobicContact CB-CD2 4.34Å; F241-Y243 HydrophobicContact CB-CE2 3.64Å; Y243-L271 HydrophobicContact CD1-CD1 4.04Å; Y243-L274 HydrophobicContact CD1-CD1 3.53Å; Y243-L274 HydrophobicContact CD2-CD1 4.35Å; Y243-L274 HydrophobicContact CE1-CD1 3.49Å; Y243-L274 VanDerWaalsContact CE1-CD1 3.49Å; Y243-L274 HydrophobicContact CE2-CD1 4.32Å; Y243-L274 HydrophobicContact CG-CD1 3.97Å
244	L	89	Confident	73.7	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	122.8	175.3	176.1	55	0	0	0	108.9	Y232 F234 H272 E273 L311	Y232-L244 HydrophobicContact CD1-CD1 3.9Å; Y232-L244 HydrophobicContact CD1-CG 4.33Å; Y232-L244 HydrophobicContact CG-CD1 4.2Å; F234-L244 HydrophobicContact CD1-CB 4.29Å; F234-L244 HydrophobicContact CD1-CD1 3.85Å; F234-L244 HydrophobicContact CD2-CD1 4.25Å; F234-L244 HydrophobicContact CE1-CB 4.3Å; F234-L244 HydrophobicContact CE1-CD1 3.67Å; F234-L244 HydrophobicContact CE1-CD2 4.01Å; F234-L244 HydrophobicContact CE1-CG 4.21Å; F234-L244 HydrophobicContact CE2-CD1 4.09Å; F234-L244 HydrophobicContact CG-CD1 4.14Å; F234-L244 HydrophobicContact CZ-CD1 3.79Å; F234-L244 HydrophobicContact CZ-CD2 4.3Å; L244-H272 HydrophobicContact CG-CB 4.33Å; L244-H272 PolarHBondContact O-N 2.91Å; L244-E273 HydrophobicContact CB-CB 4.07Å; L244-E273 HydrophobicContact CD2-CB 4.12Å; L244-E273 HydrophobicContact CD2-CG 4.27Å; L244-E273 PolarHBondContact N-O 3.45Å; L244-E273 PolarHBondContact O-N 3.02Å; L244-L311 HydrophobicContact CD1-CD2 4.11Å; L244-L311 HydrophobicContact CD2-CD1 3.9Å; L244-L311 HydrophobicContact CD2-CD2 3.86Å
245	W	86.5	Confident	71.1	Confident	3 Å²	3	45.5 Å²	45.5	1%	0.011	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	133.1	-178.4	-61.8	90.2	0	0	0	110.1	L211 N213 Y221 Y232 L233 F270 L271	L211-W245 HydrophobicContact CB-CD2 4.43Å; L211-W245 HydrophobicContact CB-CE3 4.08Å; L211-W245 HydrophobicContact CB-CH2 4.35Å; L211-W245 HydrophobicContact CB-CZ3 4.04Å; L211-W245 HydrophobicContact CD1-CB 4.25Å; L211-W245 HydrophobicContact CD1-CD2 4.08Å; L211-W245 HydrophobicContact CD1-CE3 4.24Å; L211-W245 HydrophobicContact CD1-CG 4.09Å; L211-W245 HydrophobicContact CD2-CE3 4.14Å; L211-W245 HydrophobicContact CG-CE3 4.4Å; N213-W245 HydrophobicContact CB-CH2 3.76Å; N213-W245 HydrophobicContact CB-CZ2 4.08Å; Y221-W245 WeakPolarHBondContact OH-CZ2 3.43Å; Y221-W245 PolarHBondContact OH-NE1 2.98Å; Y232-W245 VanDerWaalsContact CA-O 3.29Å; Y232-W245 WeakPolarHBondContact CA-O 3.23Å; L233-W245 HydrophobicContact CB-CB 4.18Å; L233-W245 PolarHBondContact N-O 3.08Å; L233-W245 PolarHBondContact O-N 3.03Å; W245-F270 CarbonylContact C-O 3.58Å; W245-F270 VanDerWaalsContact CA-O 3.3Å; W245-F270 WeakPolarHBondContact CA-O 3.36Å; W245-F270 VanDerWaalsContact CE3-C 3.44Å; W245-F270 HydrophobicContact CE3-CB 3.54Å; W245-F270 HydrophobicContact CZ3-CB 3.84Å; W245-L271 HydrophobicContact CD2-CD1 4.14Å; W245-L271 HydrophobicContact CE3-CB 4.15Å; W245-L271 HydrophobicContact CE3-CD1 4.43Å; W245-L271 HydrophobicContact CH2-CB 4.2Å; W245-L271 HydrophobicContact CH2-CD1 4.26Å; W245-L271 HydrophobicContact CZ2-CD1 3.95Å; W245-L271 HydrophobicContact CZ3-CB 3.9Å; W245-L271 HydrophobicContact CZ3-CD1 4.49Å
246	D	83.8	Confident	68.1	Low	34 Å²	34	53.2 Å²	53.2	18%	0.182	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	128.7	171.5	-162.8	-38.5	0	0	0	109.5	Y232 K248 F270 H272	Y232-D246 HydrophobicContact CD1-CB 4.06Å; Y232-D246 HydrophobicContact CE1-CB 3.6Å; Y232-D246 WeakPolarHBondContact CE1-OD2 3.42Å; Y232-D246 PolarHBondContact OH-OD2 3.31Å; D246-K248 VanDerWaalsContact OD1-CB 3.23Å; D246-K248 WeakPolarHBondContact OD1-CB 3.42Å; D246-K248 WeakPolarHBondContact OD1-CD 3.38Å; D246-K248 WeakPolarHBondContact OD1-CG 3.15Å; D246-K248 PolarHBondContact OD1-N 2.97Å; D246-F270 PolarHBondContact N-O 3.24Å; D246-H272 HydrophobicContact CB-CB 4.18Å
247	L	79.9	Confident	65.1	Low	4 Å²	4	61.4 Å²	61.4	2%	0.021	34%	0.335	C	S	.	.			trans	-112	-5.7	-177	-57	-180	0	0	0	112.6	I181 F209 L211 F226 H231 L233 G249 H250	I181-L247 HydrophobicContact CD1-CD1 4.37Å; F209-L247 HydrophobicContact CE2-CD2 4.05Å; F209-L247 HydrophobicContact CZ-CD2 4.35Å; L211-L247 HydrophobicContact CD1-CD2 4.12Å; L211-L247 HydrophobicContact CD2-CD2 4.04Å; F226-L247 HydrophobicContact CD1-CD1 4.41Å; F226-L247 HydrophobicContact CE1-CD1 4.07Å; H231-L247 PolarHBondContact O-N 3.43Å; L233-L247 HydrophobicContact CB-CD1 3.92Å; L233-L247 HydrophobicContact CB-CG 4.47Å; L247-G249 PolarHBondContact O-N 3.29Å; L247-G249 VanDerWaalsContact O-N 3.1Å; L247-H250 PolarHBondContact O-N 3.28Å
248	K	68.2	Low	62.2	Low	79 Å²	79	66.3 Å²	66.3	34%	0.343	37%	0.369	S	S	.	.	H	α-helix	trans	-54.4	-36	-173.2	-70	170.8	174.6	172.5	0	113.4	H231 Y232 D246 H250 V251	H231-K248 HydrophobicContact CB-CD 4.4Å; H231-K248 HydrophobicContact CB-CG 3.68Å; Y232-K248 WeakPolarHBondContact OH-CE 3.39Å; Y232-K248 PolarHBondContact OH-NZ 3.47Å; D246-K248 VanDerWaalsContact OD1-CB 3.23Å; D246-K248 WeakPolarHBondContact OD1-CB 3.42Å; D246-K248 WeakPolarHBondContact OD1-CD 3.38Å; D246-K248 WeakPolarHBondContact OD1-CG 3.15Å; D246-K248 PolarHBondContact OD1-N 2.97Å; K248-H250 PolarHBondContact O-N 3.22Å; K248-H250 VanDerWaalsContact O-N 3.1Å; K248-V251 PolarHBondContact O-N 2.9Å
249	G	58.7	Low	59.7	Low	55 Å²	55	65.5 Å²	65.5	57%	0.567	38%	0.384	S	S	*	.	H	α-helix	trans	-57.5	-23.9	-176.4	0	0	0	0	0	115	L247 C253	L247-G249 PolarHBondContact O-N 3.29Å; L247-G249 VanDerWaalsContact O-N 3.1Å; G249-C253 PolarHBondContact O-SG 3Å
250	H	52.7	Low	57	Low	61 Å²	61	71.9 Å²	71.9	28%	0.282	42%	0.418	S	S	.	.	H	α-helix	trans	-115.3	-7.1	-179	-66.4	-48.1	0	0	0	115.1	F209 L247 K248 N252 F270	F209-H250 HydrophobicContact CD1-CB 4.13Å; F209-H250 AromaticContact CD1-CD2 3.73Å; F209-H250 HydrophobicContact CE1-CB 3.59Å; F209-H250 AromaticContact CE1-CD2 3.82Å; F209-H250 AromaticContact CE1-CG 3.98Å; F209-H250 AromaticContact CG-CD2 3.99Å; F209-H250 HydrophobicContact CZ-CB 4.16Å; L247-H250 PolarHBondContact O-N 3.28Å; K248-H250 PolarHBondContact O-N 3.22Å; K248-H250 VanDerWaalsContact O-N 3.1Å; H250-N252 VanDerWaalsContact C-N 3.33Å; H250-F270 AromaticContact CD2-CE1 3.54Å; H250-F270 AromaticContact CD2-CZ 3.74Å; H250-F270 AromaticContact NE2-CE1 3.46Å; H250-F270 WeakPolarHBondContact NE2-CE1 3.33Å; H250-F270 AromaticContact NE2-CZ 3.35Å; H250-F270 WeakPolarHBondContact NE2-CZ 3.26Å
251	V	47.6	Very low	54.3	Low	60 Å²	60	78.1 Å²	78.1	36%	0.364	45%	0.449	S	S	.	.	H	α-helix	trans	-67	-37.1	174.3	178.7	0	0	0	0	110.8	K248	K248-V251 PolarHBondContact O-N 2.9Å
252	N	36.4	Very low	51.4	Low	120 Å²	120	87.1 Å²	87.1	64%	0.642	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-86.4	-15	-175.5	-64.7	-1.2	0	0	0	114.3	H250 L254 S255	H250-N252 VanDerWaalsContact C-N 3.33Å; N252-L254 PolarHBondContact O-N 3.48Å; N252-S255 PolarHBondContact O-N 2.95Å; N252-S255 PolarHBondContact O-OG 2.91Å
253	C	34.3	Very low	48.6	Very low	84 Å²	84	93 Å²	93	57%	0.568	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-72.3	-8.4	-174.4	-67.8	0	0	0	0	114.5	G249	G249-C253 PolarHBondContact O-SG 3Å
254	L	32.6	Very low	46.1	Very low	125 Å²	125	97.6 Å²	97.6	65%	0.654	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-89.9	1.3	179	-68.2	171.5	0	0	0	113.7	N252	N252-L254 PolarHBondContact O-N 3.48Å
255	S	35.6	Very low	43.5	Very low	100 Å²	100	104.8 Å²	104.8	70%	0.699	59%	0.586	S	S	*	*	S	Bend	trans	-112.4	12	-178	72.6	0	0	0	0	115.1	N252	N252-S255 PolarHBondContact O-N 2.95Å; N252-S255 PolarHBondContact O-OG 2.91Å
256	Q	26.9	Very low	41.2	Very low	162 Å²	162	108.8 Å²	108.8	76%	0.757	61%	0.614	S	S	*	*			trans	-140.7	112.1	175.6	-70.5	-168.1	-37.5	0	0	112	S258	Q256-S258 PolarHBondContact O-N 2.88Å; Q256-S258 VanDerWaalsContact O-N 3.17Å
257	D	25.6	Very low	39	Very low	172 Å²	172	112 Å²	112	92%	0.92	63%	0.631	S	S	*	*			trans	-66.5	105.4	166.4	-67.2	-59.2	0	0	0	110
258	S	26.7	Very low	37.3	Very low	105 Å²	105	116.2 Å²	116.2	73%	0.734	65%	0.654	S	S	*	*			trans	-156.1	125.5	166.1	-62.2	0	0	0	0	111.1	Q256 D260	Q256-S258 PolarHBondContact O-N 2.88Å; Q256-S258 VanDerWaalsContact O-N 3.17Å; S258-D260 PolarHBondContact O-N 3.14Å
259	S	33	Very low	36.7	Very low	119 Å²	119	121.4 Å²	121.4	83%	0.832	68%	0.679	S	S	*	*			trans	-80	91	170.3	55.3	0	0	0	0	110.7
260	D	28.7	Very low	37	Very low	151 Å²	151	120 Å²	120	81%	0.807	66%	0.658	S	S	*	*			trans	-166.8	107.5	156.2	-101.1	-28.7	0	0	0	110.9	S258	S258-D260 PolarHBondContact O-N 3.14Å
261	L	27.9	Very low	37.8	Very low	156 Å²	156	119.7 Å²	119.7	82%	0.817	66%	0.658	S	S	*	*			trans	-179	56.6	155.4	-104.3	167.6	0	0	0	111.5	D263	L261-D263 HydrophobicContact CD2-CB 4.15Å; L261-D263 PolarHBondContact O-N 3.07Å
262	Y	28.8	Very low	39.2	Very low	234 Å²	234	121.2 Å²	121.2	92%	0.918	66%	0.661	S	S	*	*			trans	-77.1	49.4	168.8	-92.8	-79.8	0	0	0	112.1
263	D	28.9	Very low	41.2	Very low	123 Å²	123	115.8 Å²	115.8	66%	0.658	63%	0.632	S	S	*	*			trans	-107.5	70.8	-179.8	-145.3	-6.8	0	0	0	110.9	L261 N265	L261-D263 HydrophobicContact CD2-CB 4.15Å; L261-D263 PolarHBondContact O-N 3.07Å; D263-N265 VanDerWaalsContact C-N 3.32Å; D263-N265 PolarHBondContact O-N 2.93Å
264	S	37.4	Very low	43.6	Very low	102 Å²	102	112.8 Å²	112.8	71%	0.713	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	61.8	-162.4	48.2	0	0	0	0	114.6
265	N	33.5	Very low	46	Very low	152 Å²	152	106.8 Å²	106.8	81%	0.813	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-160.1	1.5	162.7	-98.4	-49.7	0	0	0	117.3	D263 N267	D263-N265 VanDerWaalsContact C-N 3.32Å; D263-N265 PolarHBondContact O-N 2.93Å; N265-N267 PolarHBondContact O-N 3.06Å
266	S	38	Very low	48.3	Very low	86 Å²	86	106.5 Å²	106.5	60%	0.601	57%	0.565	S	S	*	*			trans	-84.9	-1.6	-168	57.8	0	0	0	0	117.3	N268	S266-N268 PolarHBondContact O-N 3.19Å
267	N	37.6	Very low	51	Low	101 Å²	101	98.9 Å²	98.9	54%	0.54	53%	0.529	S	S	.	.			trans	-66.8	22.7	-169.1	-67.2	-5.5	0	0	0	117.4	N265 F270	N265-N267 PolarHBondContact O-N 3.06Å; N267-F270 VanDerWaalsContact O-CE2 3.25Å; N267-F270 WeakPolarHBondContact O-CE2 3.22Å
268	N	43.6	Very low	53.4	Low	93 Å²	93	93.5 Å²	93.5	50%	0.497	50%	0.503	S	S	.	.			trans	-124	32.6	-167.9	-69.4	-39	0	0	0	114.6	S266	S266-N268 PolarHBondContact O-N 3.19Å
269	Q	57	Low	55.6	Low	188 Å²	188	93 Å²	93	88%	0.879	49%	0.489	S	S	*	.			trans	-134.1	38.8	177.2	-70.2	-163.3	-27	0	0	114.4
270	F	64	Low	57.3	Low	26 Å²	26	89.9 Å²	89.9	11%	0.114	47%	0.466	C	S	.	.			trans	-85.1	-14.7	177	-59.8	-69.2	0	0	0	114.7	F209 L211 W245 D246 H250 N267 H272	F209-F270 HydrophobicContact CD2-CZ 4.37Å; L211-F270 HydrophobicContact CD2-CB 3.63Å; L211-F270 HydrophobicContact CD2-CD1 4.23Å; L211-F270 HydrophobicContact CD2-CD2 3.66Å; L211-F270 HydrophobicContact CD2-CE2 4.36Å; L211-F270 HydrophobicContact CD2-CG 3.58Å; W245-F270 CarbonylContact C-O 3.58Å; W245-F270 VanDerWaalsContact CA-O 3.3Å; W245-F270 WeakPolarHBondContact CA-O 3.36Å; W245-F270 VanDerWaalsContact CE3-C 3.44Å; W245-F270 HydrophobicContact CE3-CB 3.54Å; W245-F270 HydrophobicContact CZ3-CB 3.84Å; D246-F270 PolarHBondContact N-O 3.24Å; H250-F270 AromaticContact CD2-CE1 3.54Å; H250-F270 AromaticContact CD2-CZ 3.74Å; H250-F270 AromaticContact NE2-CE1 3.46Å; H250-F270 WeakPolarHBondContact NE2-CE1 3.33Å; H250-F270 AromaticContact NE2-CZ 3.35Å; H250-F270 WeakPolarHBondContact NE2-CZ 3.26Å; N267-F270 VanDerWaalsContact O-CE2 3.25Å; N267-F270 WeakPolarHBondContact O-CE2 3.22Å; F270-H272 PolarHBondContact O-N 3.43Å
271	L	70.9	Confident	59.8	Low	54 Å²	54	82.8 Å²	82.8	28%	0.283	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	119.1	-179.3	-173.7	74	0	0	0	109.9	Y243 W245	Y243-L271 HydrophobicContact CD1-CD1 4.04Å; W245-L271 HydrophobicContact CD2-CD1 4.14Å; W245-L271 HydrophobicContact CE3-CB 4.15Å; W245-L271 HydrophobicContact CE3-CD1 4.43Å; W245-L271 HydrophobicContact CH2-CB 4.2Å; W245-L271 HydrophobicContact CH2-CD1 4.26Å; W245-L271 HydrophobicContact CZ2-CD1 3.95Å; W245-L271 HydrophobicContact CZ3-CB 3.9Å; W245-L271 HydrophobicContact CZ3-CD1 4.49Å
272	H	76	Confident	62.4	Low	93 Å²	93	81.8 Å²	81.8	43%	0.431	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	-45.6	-172.9	-172.8	78.8	0	0	0	112.9	L244 D246 F270 L311 R329	L244-H272 HydrophobicContact CG-CB 4.33Å; L244-H272 PolarHBondContact O-N 2.91Å; D246-H272 HydrophobicContact CB-CB 4.18Å; F270-H272 PolarHBondContact O-N 3.43Å; H272-L311 WeakPolarHBondContact NE2-CD1 3.48Å; H272-R329 PolarHBondContact NE2-NH2 3.21Å
273	E	79.2	Confident	65.2	Low	6 Å²	6	71.3 Å²	71.3	3%	0.028	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	149.1	174.2	-66.9	177.1	-157.4	0	0	111.5	L244 R329 W358 V436	L244-E273 HydrophobicContact CB-CB 4.07Å; L244-E273 HydrophobicContact CD2-CB 4.12Å; L244-E273 HydrophobicContact CD2-CG 4.27Å; L244-E273 PolarHBondContact N-O 3.45Å; L244-E273 PolarHBondContact O-N 3.02Å; E273-R329 IonicContact OE1-CZ 3.97Å; E273-R329 IonicContact OE1-NE 2.8Å; E273-R329 PolarHBondContact OE1-NE 3.29Å; E273-R329 IonicContact OE1-NH2 3.02Å; E273-R329 PolarHBondContact OE1-NH2 2.8Å; E273-R329 IonicContact OE2-NE 2.9Å; E273-W358 PolarHBondContact OE2-NE1 3.17Å; E273-V436 HydrophobicContact CB-CG1 4.02Å; E273-V436 HydrophobicContact CG-CG1 4.14Å
274	L	83.4	Confident	68.1	Low	20 Å²	20	65.5 Å²	65.5	11%	0.105	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	108.3	169.6	-176.4	65.1	0	0	0	110.2	Y216 F241 Y243	Y216-L274 HydrophobicContact CD2-CD2 4.34Å; Y216-L274 HydrophobicContact CE2-CD2 3.48Å; Y216-L274 VanDerWaalsContact CE2-CD2 3.48Å; F241-L274 HydrophobicContact CB-CD1 3.93Å; F241-L274 HydrophobicContact CD1-CD1 4.01Å; F241-L274 HydrophobicContact CD1-CD2 4.23Å; F241-L274 HydrophobicContact CD1-CG 4.03Å; F241-L274 HydrophobicContact CE1-CD2 4.45Å; F241-L274 HydrophobicContact CG-CD1 4.26Å; Y243-L274 HydrophobicContact CD1-CD1 3.53Å; Y243-L274 HydrophobicContact CD2-CD1 4.35Å; Y243-L274 HydrophobicContact CE1-CD1 3.49Å; Y243-L274 VanDerWaalsContact CE1-CD1 3.49Å; Y243-L274 HydrophobicContact CE2-CD1 4.32Å; Y243-L274 HydrophobicContact CG-CD1 3.97Å
275	I	83.9	Confident	70.6	Confident	0 Å²	0	64 Å²	64	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	107.5	-177.9	-46.9	169.8	0	0	0	108.5	F241 V242 L277 L315 W358 I434	F241-I275 WeakPolarHBondContact CA-O 3.28Å; V242-I275 HydrophobicContact CB-CB 4.16Å; V242-I275 HydrophobicContact CB-CD1 4.29Å; V242-I275 PolarHBondContact N-O 3.08Å; V242-I275 PolarHBondContact O-N 3.12Å; I275-L277 HydrophobicContact CG2-CD2 4.19Å; I275-L277 PolarHBondContact O-N 2.94Å; I275-L315 HydrophobicContact CD1-CD2 4.39Å; I275-W358 HydrophobicContact CD1-CD2 3.85Å; I275-W358 VanDerWaalsContact CD1-CE2 3.45Å; I275-W358 HydrophobicContact CD1-CG 4.04Å; I275-W358 HydrophobicContact CD1-CZ2 3.89Å; I275-W358 HydrophobicContact CG1-CG 4.48Å; I275-W358 HydrophobicContact CG2-CG 4.41Å; I275-I434 HydrophobicContact CG2-CG2 4.14Å
276	K	83.1	Confident	73.3	Confident	94 Å²	94	60.3 Å²	60.3	41%	0.409	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	112.5	168.4	-171.4	-168.8	171.9	-170.7	0	109.3	F241 E279 I434	F241-K276 HydrophobicContact CD1-CB 3.9Å; F241-K276 HydrophobicContact CD1-CG 4.1Å; F241-K276 HydrophobicContact CE1-CB 3.68Å; F241-K276 HydrophobicContact CE1-CD 4.24Å; F241-K276 HydrophobicContact CE1-CG 3.64Å; F241-K276 HydrophobicContact CZ-CD 4.5Å; F241-K276 HydrophobicContact CZ-CG 4.22Å; K276-E279 IonicContact NZ-OE1 2.75Å; K276-E279 PolarHBondContact NZ-OE1 3.47Å; K276-I434 WeakPolarHBondContact O-CG2 3.26Å
277	L	84.4	Confident	75.9	Confident	2 Å²	2	56.4 Å²	56.4	1%	0.01	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-72.7	148.6	173.1	-55	172.4	0	0	0	110.8	P240 V242 I275 L281 V284 L317 L327 I434	P240-L277 VanDerWaalsContact O-CB 3.3Å; P240-L277 WeakPolarHBondContact O-CB 3.43Å; P240-L277 WeakPolarHBondContact O-CG 3.33Å; P240-L277 PolarHBondContact O-N 3.35Å; V242-L277 HydrophobicContact CG2-CD1 3.96Å; V242-L277 HydrophobicContact CG2-CD2 4.35Å; V242-L277 HydrophobicContact CG2-CG 4.22Å; I275-L277 HydrophobicContact CG2-CD2 4.19Å; I275-L277 PolarHBondContact O-N 2.94Å; L277-L281 HydrophobicContact CB-CD2 3.87Å; L277-L281 HydrophobicContact CD1-CD2 3.45Å; L277-L281 VanDerWaalsContact CD1-CD2 3.45Å; L277-L281 HydrophobicContact CG-CD2 4.3Å; L277-V284 HydrophobicContact CD1-CG2 3.74Å; L277-L317 HydrophobicContact CD1-CD2 4.02Å; L277-L327 HydrophobicContact CD2-CD1 3.81Å; L277-I434 HydrophobicContact CD2-CD1 4.14Å
278	P	75.4	Confident	78.4	Confident	58 Å²	58	52.6 Å²	52.6	38%	0.377	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-70.8	145.5	-180	28.6	-34.9	0	0	0	112.4	L281 I434	P278-L281 WeakPolarHBondContact O-CB 3.38Å; P278-L281 PolarHBondContact O-N 2.7Å; P278-I434 HydrophobicContact CG-CD1 4.49Å
279	E	72.6	Confident	80.6	Confident	94 Å²	94	49 Å²	49	44%	0.439	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	151.3	168.7	-73.6	157.7	-125	0	0	110	K276 Y783	K276-E279 IonicContact NZ-OE1 2.75Å; K276-E279 PolarHBondContact NZ-OE1 3.47Å; E279-Y783 VanDerWaalsContact C-OH 3.3Å; E279-Y783 HydrophobicContact CB-CE1 4.06Å; E279-Y783 WeakPolarHBondContact CB-OH 3.37Å; E279-Y783 PolarHBondContact O-OH 3.45Å
280	P	69.7	Low	81.9	Confident	54 Å²	54	40 Å²	40	35%	0.351	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	cis	-86	11.7	14.4	35.1	-38.4	0	0	0	116	K282	P280-K282 PolarHBondContact O-N 3.08Å
281	L	80.5	Confident	82.7	Confident	3 Å²	3	39.2 Å²	39.2	2%	0.016	19%	0.187	C	C	.	.			trans	-62.3	128.9	177	-178.5	57.9	0	0	0	111.4	L277 P278 S283 G319	L277-L281 HydrophobicContact CB-CD2 3.87Å; L277-L281 HydrophobicContact CD1-CD2 3.45Å; L277-L281 VanDerWaalsContact CD1-CD2 3.45Å; L277-L281 HydrophobicContact CG-CD2 4.3Å; P278-L281 WeakPolarHBondContact O-CB 3.38Å; P278-L281 PolarHBondContact O-N 2.7Å; L281-S283 VanDerWaalsContact CD1-O 3.27Å; L281-S283 WeakPolarHBondContact CD1-O 3.24Å; L281-G319 VanDerWaalsContact CD1-CA 3.48Å
282	K	82.3	Confident	82.9	Confident	134 Å²	134	39.9 Å²	39.9	58%	0.583	19%	0.188	S	C	*	.			trans	-109.9	-26	179.2	-62.8	-171.3	178.9	-174.7	0	114.4	S239 P280	S239-K282 CarbonylContact C-O 3.46Å; S239-K282 VanDerWaalsContact C-O 3.22Å; S239-K282 VanDerWaalsContact CA-O 3.31Å; S239-K282 WeakPolarHBondContact CA-O 3.29Å; P280-K282 PolarHBondContact O-N 3.08Å
283	S	87.1	Confident	82.4	Confident	15 Å²	15	39 Å²	39	11%	0.105	19%	0.192	C	C	.	.			trans	-160.5	141	-170.4	161.8	0	0	0	0	110.3	G237 L281 G319 T320	G237-S283 CarbonylContact O-C 3.58Å; G237-S283 WeakPolarHBondContact O-CA 3.46Å; G237-S283 PolarHBondContact O-OG 3.38Å; L281-S283 VanDerWaalsContact CD1-O 3.27Å; L281-S283 WeakPolarHBondContact CD1-O 3.24Å; S283-G319 CarbonylContact O-C 3.59Å; S283-T320 PolarHBondContact N-OG1 2.74Å; S283-T320 PolarHBondContact O-N 3.28Å; S283-T320 PolarHBondContact O-OG1 2.88Å; S283-T320 WeakPolarHBondContact OG-CG2 3.17Å
284	V	89.8	Confident	81.8	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	130.3	177.5	-172.7	0	0	0	0	109.3	T223 A236 G237 L277 I287 L317	T223-V284 HydrophobicContact CG2-CG1 4.36Å; A236-V284 HydrophobicContact CB-CB 3.8Å; A236-V284 HydrophobicContact CB-CG1 3.98Å; A236-V284 HydrophobicContact CB-CG2 4.05Å; G237-V284 PolarHBondContact O-N 2.79Å; L277-V284 HydrophobicContact CD1-CG2 3.74Å; V284-I287 HydrophobicContact CG1-CG2 3.5Å; V284-I287 VanDerWaalsContact CG1-CG2 3.5Å; V284-L317 HydrophobicContact CG1-CB 4.37Å; V284-L317 HydrophobicContact CG1-CD2 4.41Å
285	R	90.1	Very high	81	Confident	71 Å²	71	38.5 Å²	38.5	27%	0.268	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-45.3	-178.8	-67.6	-177.2	172.9	-170.9	3.6	112.7	L318 G319 T320	R285-L318 HydrophobicContact CB-CG 4.42Å; R285-L318 WeakPolarHBondContact CB-O 3.38Å; R285-L318 PolarHBondContact N-O 3.42Å; R285-G319 WeakPolarHBondContact CD-O 3.28Å; R285-T320 HydrophobicContact CG-CG2 4.1Å
286	R	91	Very high	79.7	Confident	75 Å²	75	40.6 Å²	40.6	28%	0.283	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	141.5	-178.5	-171.7	174.4	-175.3	103	-1.9	109.9	T223 E288 L318 F377	T223-R286 WeakPolarHBondContact OG1-CA 3.42Å; R286-E288 HydrophobicContact CG-CG 4.48Å; R286-E288 IonicContact CZ-OE1 3.77Å; R286-E288 IonicContact NE-OE1 3.62Å; R286-E288 PolarHBondContact NE-OE1 2.79Å; R286-E288 IonicContact NH2-OE1 2.72Å; R286-E288 PolarHBondContact NH2-OE1 3.01Å; R286-L318 PolarHBondContact N-O 3.14Å; R286-L318 PolarHBondContact O-N 2.9Å; R286-F377 HydrophobicContact CB-CD1 4.45Å; R286-F377 HydrophobicContact CB-CE1 3.88Å; R286-F377 VanDerWaalsContact CD-O 3.3Å; R286-F377 WeakPolarHBondContact CD-O 3.43Å; R286-F377 HydrophobicContact CG-CE1 3.94Å; R286-F377 HydrophobicContact CG-CZ 4.32Å; R286-F377 PolarHBondContact NE-O 3.38Å
287	I	92.8	Very high	78.3	Confident	3 Å²	3	39 Å²	39	2%	0.015	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	142.6	170.8	59	-178.5	0	0	0	110.3	T223 T225 F234 A236 V284 L316 L317	T223-I287 HydrophobicContact CG2-CB 4.48Å; T223-I287 HydrophobicContact CG2-CD1 4.39Å; T223-I287 HydrophobicContact CG2-CG1 3.9Å; T223-I287 HydrophobicContact CG2-CG2 4.23Å; T223-I287 PolarHBondContact OG1-N 2.72Å; T223-I287 VanDerWaalsContact OG1-N 3.07Å; T225-I287 HydrophobicContact CG2-CB 4.27Å; T225-I287 HydrophobicContact CG2-CD1 4.08Å; T225-I287 HydrophobicContact CG2-CG1 3.82Å; F234-I287 HydrophobicContact CB-CD1 3.85Å; F234-I287 WeakPolarHBondContact O-CD1 3.42Å; A236-I287 HydrophobicContact CB-CD1 4.04Å; A236-I287 HydrophobicContact CB-CG2 4.06Å; V284-I287 HydrophobicContact CG1-CG2 3.5Å; V284-I287 VanDerWaalsContact CG1-CG2 3.5Å; I287-L316 VanDerWaalsContact CA-O 3.28Å; I287-L316 WeakPolarHBondContact CA-O 3.22Å; I287-L317 HydrophobicContact CG2-CB 4.25Å; I287-L317 HydrophobicContact CG2-CD2 3.67Å; I287-L317 HydrophobicContact CG2-CG 3.89Å
288	E	90.5	Very high	76.7	Confident	22 Å²	22	39 Å²	39	10%	0.103	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	152.1	173.1	-60.7	-175.6	162.8	0	0	109.9	R286 L316 F377 S378 V379	R286-E288 HydrophobicContact CG-CG 4.48Å; R286-E288 IonicContact CZ-OE1 3.77Å; R286-E288 IonicContact NE-OE1 3.62Å; R286-E288 PolarHBondContact NE-OE1 2.79Å; R286-E288 IonicContact NH2-OE1 2.72Å; R286-E288 PolarHBondContact NH2-OE1 3.01Å; E288-L316 PolarHBondContact N-O 3.35Å; E288-L316 PolarHBondContact O-N 2.82Å; E288-F377 HydrophobicContact CB-CE2 3.85Å; E288-F377 HydrophobicContact CB-CZ 4.08Å; E288-F377 HydrophobicContact CG-CE2 3.8Å; E288-F377 HydrophobicContact CG-CZ 3.9Å; E288-F377 VanDerWaalsContact OE2-CE2 3.27Å; E288-F377 WeakPolarHBondContact OE2-CE2 3.4Å; E288-S378 WeakPolarHBondContact OE2-CA 3.38Å; E288-V379 VanDerWaalsContact OE2-CB 3.28Å; E288-V379 WeakPolarHBondContact OE2-CB 3.33Å; E288-V379 VanDerWaalsContact OE2-CG2 3.26Å; E288-V379 WeakPolarHBondContact OE2-CG2 3.19Å; E288-V379 PolarHBondContact OE2-N 2.86Å
289	W	89	Confident	75.5	Confident	16 Å²	16	42.3 Å²	42.3	6%	0.061	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	136.5	-177.8	177.2	-99.2	0	0	0	111.7	T225 T227 F234 E310 L311 L315 W358	T225-W289 HydrophobicContact CG2-CB 4.18Å; T227-W289 HydrophobicContact CG2-CD2 4.24Å; T227-W289 HydrophobicContact CG2-CG 4.41Å; T227-W289 HydrophobicContact CG2-CZ2 4.31Å; F234-W289 HydrophobicContact CD2-CE3 4.4Å; F234-W289 HydrophobicContact CE2-CD2 4Å; F234-W289 AromaticContact CE2-CE3 3.54Å; F234-W289 HydrophobicContact CE2-CE3 3.54Å; F234-W289 AromaticContact CE2-CZ3 3.91Å; F234-W289 HydrophobicContact CE2-CZ3 3.91Å; F234-W289 AromaticContact CZ-CE3 3.84Å; F234-W289 HydrophobicContact CZ-CE3 3.84Å; F234-W289 HydrophobicContact CZ-CH2 4.45Å; F234-W289 AromaticContact CZ-CZ3 3.73Å; F234-W289 HydrophobicContact CZ-CZ3 3.73Å; W289-E310 WeakPolarHBondContact CZ2-O 3.49Å; W289-L311 WeakPolarHBondContact CH2-O 3.46Å; W289-L315 HydrophobicContact CE3-CB 3.97Å; W289-L315 HydrophobicContact CE3-CD1 4.13Å; W289-L315 HydrophobicContact CZ3-CB 3.99Å; W289-W358 HydrophobicContact CH2-CH2 4.38Å; W289-W358 AromaticContact CZ3-CH2 3.88Å; W289-W358 HydrophobicContact CZ3-CH2 3.88Å; W289-W358 HydrophobicContact CZ3-CZ3 4.11Å
290	I	85.1	Confident	74.5	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	119.1	172.4	-52.6	-173.6	0	0	0	109.4	C294 L295 G313 L314 L316 V379 Y382 L419	I290-C294 HydrophobicContact CG2-CB 4.18Å; I290-L295 HydrophobicContact CG2-CD1 4.28Å; I290-L295 HydrophobicContact CG2-CD2 3.98Å; I290-L295 HydrophobicContact CG2-CG 4.02Å; I290-G313 CarbonylContact O-C 3.54Å; I290-G313 WeakPolarHBondContact O-CA 3.32Å; I290-L314 HydrophobicContact CB-CB 4.24Å; I290-L314 PolarHBondContact N-O 3.49Å; I290-L314 PolarHBondContact O-N 3.49Å; I290-L316 HydrophobicContact CD1-CD1 3.62Å; I290-L316 HydrophobicContact CG1-CD1 4.12Å; I290-V379 HydrophobicContact CD1-CG1 3.65Å; I290-V379 HydrophobicContact CD1-CG2 4.26Å; I290-V379 HydrophobicContact CG1-CG1 3.84Å; I290-Y382 HydrophobicContact CB-CE2 4.38Å; I290-Y382 HydrophobicContact CG1-CE2 4.15Å; I290-Y382 HydrophobicContact CG2-CE2 3.92Å; I290-L419 HydrophobicContact CD1-CD1 3.37Å
291	P	81	Confident	73.4	Confident	10 Å²	10	44.6 Å²	44.6	7%	0.065	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	144.8	173.4	31.9	-34.1	0	0	0	110.7	S293 C294 Y382	P291-S293 PolarHBondContact O-N 2.87Å; P291-C294 PolarHBondContact O-N 3.35Å; P291-C294 VanDerWaalsContact O-N 3.1Å; P291-Y382 HydrophobicContact CG-CD2 4.39Å; P291-Y382 HydrophobicContact CG-CG 4.37Å
292	K	73.9	Confident	72	Confident	68 Å²	68	47 Å²	47	30%	0.296	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-51.8	-26.2	178.1	60.9	-178.9	170.9	-167.7	0	115	C294 L295 F298 S312	K292-C294 PolarHBondContact O-N 3.29Å; K292-C294 VanDerWaalsContact O-N 3.16Å; K292-L295 PolarHBondContact O-N 3.45Å; K292-L295 VanDerWaalsContact O-N 3.08Å; K292-F298 HydrophobicContact CB-CD1 3.78Å; K292-F298 HydrophobicContact CB-CE1 3.86Å; K292-F298 HydrophobicContact CB-CG 4.37Å; K292-S312 VanDerWaalsContact CB-O 3.32Å; K292-S312 WeakPolarHBondContact CB-O 3.05Å; K292-S312 WeakPolarHBondContact CD-O 3.28Å; K292-S312 WeakPolarHBondContact CD-OG 3.47Å; K292-S312 VanDerWaalsContact CE-OG 3.3Å; K292-S312 WeakPolarHBondContact CE-OG 3.28Å; K292-S312 VanDerWaalsContact CG-O 3.3Å; K292-S312 WeakPolarHBondContact CG-O 3.35Å; K292-S312 PolarHBondContact NZ-OG 3.19Å
293	S	65.5	Low	70.1	Confident	75 Å²	75	48.2 Å²	48.2	52%	0.524	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-61	-21	179.6	51.3	0	0	0	0	114.1	P291	P291-S293 PolarHBondContact O-N 2.87Å
294	C	66.4	Low	67.9	Low	5 Å²	5	54.3 Å²	54.3	3%	0.034	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-93.5	-11.5	179.2	-60.2	0	0	0	0	113.1	I290 P291 K292 Y382 N400 H402	I290-C294 HydrophobicContact CG2-CB 4.18Å; P291-C294 PolarHBondContact O-N 3.35Å; P291-C294 VanDerWaalsContact O-N 3.1Å; K292-C294 PolarHBondContact O-N 3.29Å; K292-C294 VanDerWaalsContact O-N 3.16Å; C294-Y382 HydrophobicContact CB-CD1 4.17Å; C294-Y382 HydrophobicContact CB-CE1 3.9Å; C294-Y382 WeakPolarHBondContact SG-CD1 3.38Å; C294-Y382 VanDerWaalsContact SG-CG 3.6Å; C294-N400 PolarHBondContact O-ND2 2.86Å; C294-H402 HydrophobicContact CB-CB 4.08Å
295	L	66.9	Low	65.8	Low	9 Å²	9	56.3 Å²	56.3	5%	0.047	28%	0.28	C	S	.	.			trans	-100.3	101.3	-173.5	-59.9	173.3	0	0	0	110.1	I290 K292 F298 L314 L419 L423	I290-L295 HydrophobicContact CG2-CD1 4.28Å; I290-L295 HydrophobicContact CG2-CD2 3.98Å; I290-L295 HydrophobicContact CG2-CG 4.02Å; K292-L295 PolarHBondContact O-N 3.45Å; K292-L295 VanDerWaalsContact O-N 3.08Å; L295-F298 HydrophobicContact CB-CB 3.76Å; L295-F298 HydrophobicContact CB-CD2 3.97Å; L295-F298 HydrophobicContact CB-CG 4.16Å; L295-F298 HydrophobicContact CD1-CD2 3.45Å; L295-F298 VanDerWaalsContact CD1-CD2 3.45Å; L295-F298 HydrophobicContact CD1-CE2 3.66Å; L295-F298 HydrophobicContact CD1-CG 4.27Å; L295-F298 HydrophobicContact CG-CD2 4.35Å; L295-F298 WeakPolarHBondContact O-CB 3.32Å; L295-F298 PolarHBondContact O-N 3.14Å; L295-L314 HydrophobicContact CD1-CB 4.44Å; L295-L314 HydrophobicContact CD1-CD1 3.55Å; L295-L314 HydrophobicContact CD1-CG 3.79Å; L295-L314 HydrophobicContact CD2-CD1 4.04Å; L295-L314 HydrophobicContact CG-CD1 4.47Å; L295-L419 HydrophobicContact CD2-CB 4.45Å; L295-L423 HydrophobicContact CB-CD1 4.38Å; L295-L423 HydrophobicContact CD1-CD1 4.45Å; L295-L423 HydrophobicContact CD2-CD1 4.28Å
296	V	57.5	Low	63.3	Low	45 Å²	45	62.4 Å²	62.4	27%	0.273	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	145.3	170.7	177.3	0	0	0	0	109.1	F298 S420	V296-F298 PolarHBondContact O-N 2.96Å; V296-F298 VanDerWaalsContact O-N 3.12Å; V296-S420 PolarHBondContact N-OG 2.84Å; V296-S420 PolarHBondContact O-OG 2.83Å
297	D	53.3	Low	61.1	Low	60 Å²	60	63.7 Å²	63.7	32%	0.321	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.6	-1.5	-175.4	-59.5	-40.8	0	0	0	117.2	N299 Q300 F301 N424	D297-N299 PolarHBondContact O-N 3.31Å; D297-N299 VanDerWaalsContact O-N 3.1Å; D297-Q300 HydrophobicContact CB-CG 4.33Å; D297-Q300 VanDerWaalsContact CG-NE2 3.3Å; D297-Q300 WeakPolarHBondContact O-CB 3.2Å; D297-Q300 WeakPolarHBondContact O-CG 3.45Å; D297-Q300 PolarHBondContact O-N 2.9Å; D297-Q300 PolarHBondContact OD1-NE2 3.04Å; D297-F301 WeakPolarHBondContact O-CD2 3.18Å; D297-N424 PolarHBondContact OD2-ND2 3.23Å
298	F	51.3	Low	59	Low	3 Å²	3	68.5 Å²	68.5	1%	0.013	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-54.3	-35.4	177.9	-165.8	-91.4	0	0	0	113.6	K292 L295 V296 Q300 F301 Y302 L314 I328 L423	K292-F298 HydrophobicContact CB-CD1 3.78Å; K292-F298 HydrophobicContact CB-CE1 3.86Å; K292-F298 HydrophobicContact CB-CG 4.37Å; L295-F298 HydrophobicContact CB-CB 3.76Å; L295-F298 HydrophobicContact CB-CD2 3.97Å; L295-F298 HydrophobicContact CB-CG 4.16Å; L295-F298 HydrophobicContact CD1-CD2 3.45Å; L295-F298 VanDerWaalsContact CD1-CD2 3.45Å; L295-F298 HydrophobicContact CD1-CE2 3.66Å; L295-F298 HydrophobicContact CD1-CG 4.27Å; L295-F298 HydrophobicContact CG-CD2 4.35Å; L295-F298 WeakPolarHBondContact O-CB 3.32Å; L295-F298 PolarHBondContact O-N 3.14Å; V296-F298 PolarHBondContact O-N 2.96Å; V296-F298 VanDerWaalsContact O-N 3.12Å; F298-Q300 PolarHBondContact O-N 3.28Å; F298-F301 PolarHBondContact O-N 3.4Å; F298-F301 VanDerWaalsContact O-N 3.11Å; F298-Y302 HydrophobicContact CD1-CD2 4.12Å; F298-Y302 AromaticContact CE1-CD2 3.42Å; F298-Y302 HydrophobicContact CE1-CD2 3.42Å; F298-Y302 VanDerWaalsContact CE1-CD2 3.42Å; F298-Y302 AromaticContact CE1-CE2 3.75Å; F298-Y302 HydrophobicContact CE1-CE2 3.75Å; F298-Y302 HydrophobicContact CE1-CG 4.23Å; F298-Y302 AromaticContact CZ-CD2 3.99Å; F298-Y302 HydrophobicContact CZ-CD2 3.99Å; F298-Y302 HydrophobicContact CZ-CE2 4.03Å; F298-L314 HydrophobicContact CE2-CG 4.44Å; F298-I328 HydrophobicContact CE2-CD1 3.51Å; F298-I328 HydrophobicContact CE2-CG1 4.39Å; F298-I328 HydrophobicContact CZ-CD1 3.67Å; F298-I328 HydrophobicContact CZ-CG1 4.43Å; F298-L423 HydrophobicContact CD2-CD1 4.15Å
299	N	50.4	Low	57.7	Low	126 Å²	126	70 Å²	70	67%	0.674	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-63.3	-26	176.9	-69.1	-7.8	0	0	0	113.4	D297 F301 Y302	D297-N299 PolarHBondContact O-N 3.31Å; D297-N299 VanDerWaalsContact O-N 3.1Å; N299-F301 PolarHBondContact O-N 3.3Å; N299-Y302 PolarHBondContact O-N 3.18Å
300	Q	49.8	Very low	56.7	Low	124 Å²	124	70.8 Å²	70.8	58%	0.579	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-67.7	-25.6	175.9	-54.1	-167.9	34.4	0	0	111.9	D297 F298 H303	D297-Q300 HydrophobicContact CB-CG 4.33Å; D297-Q300 VanDerWaalsContact CG-NE2 3.3Å; D297-Q300 WeakPolarHBondContact O-CB 3.2Å; D297-Q300 WeakPolarHBondContact O-CG 3.45Å; D297-Q300 PolarHBondContact O-N 2.9Å; D297-Q300 PolarHBondContact OD1-NE2 3.04Å; F298-Q300 PolarHBondContact O-N 3.28Å; Q300-H303 PolarHBondContact O-CD2 3.26Å; Q300-H303 VanDerWaalsContact O-CD2 3.3Å
301	F	48.3	Very low	56.4	Low	73 Å²	73	70.9 Å²	70.9	32%	0.32	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-88.6	-5.8	176.3	-62	-80.9	0	0	0	113.4	D297 F298 N299 L423	D297-F301 WeakPolarHBondContact O-CD2 3.18Å; F298-F301 PolarHBondContact O-N 3.4Å; F298-F301 VanDerWaalsContact O-N 3.11Å; N299-F301 PolarHBondContact O-N 3.3Å; F301-L423 HydrophobicContact CE2-CB 4.26Å; F301-L423 WeakPolarHBondContact CZ-O 3.5Å
302	Y	49.4	Very low	56.1	Low	52 Å²	52	70.6 Å²	70.6	20%	0.204	37%	0.371	C	S	.	.			trans	-125.2	49.7	-164.5	-129.3	-79.1	0	0	0	112.5	F298 N299 D304 S305 I328 R329	F298-Y302 HydrophobicContact CD1-CD2 4.12Å; F298-Y302 AromaticContact CE1-CD2 3.42Å; F298-Y302 HydrophobicContact CE1-CD2 3.42Å; F298-Y302 VanDerWaalsContact CE1-CD2 3.42Å; F298-Y302 AromaticContact CE1-CE2 3.75Å; F298-Y302 HydrophobicContact CE1-CE2 3.75Å; F298-Y302 HydrophobicContact CE1-CG 4.23Å; F298-Y302 AromaticContact CZ-CD2 3.99Å; F298-Y302 HydrophobicContact CZ-CD2 3.99Å; F298-Y302 HydrophobicContact CZ-CE2 4.03Å; N299-Y302 PolarHBondContact O-N 3.18Å; Y302-D304 PolarHBondContact O-N 3.36Å; Y302-S305 VanDerWaalsContact CD1-OG 3.27Å; Y302-S305 WeakPolarHBondContact CD1-OG 3.14Å; Y302-S305 WeakPolarHBondContact CE1-OG 3.07Å; Y302-I328 HydrophobicContact CE2-CG2 4.04Å; Y302-R329 PolarHBondContact OH-O 2.84Å
303	H	43.1	Very low	56.4	Low	161 Å²	161	67.3 Å²	67.3	75%	0.745	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-18.4	-170.4	-95.9	-69.5	0	0	0	116.5	Q300	Q300-H303 PolarHBondContact O-CD2 3.26Å; Q300-H303 VanDerWaalsContact O-CD2 3.3Å
304	D	41.7	Very low	57.3	Low	143 Å²	143	63.8 Å²	63.8	77%	0.765	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.3	23.7	-162.1	-80.6	-49.9	0	0	0	116.4	Y302 Y333	Y302-D304 PolarHBondContact O-N 3.36Å; D304-Y333 WeakPolarHBondContact O-CE2 3.43Å
305	S	45.8	Very low	58.4	Low	42 Å²	42	63.5 Å²	63.5	29%	0.294	33%	0.33	S	S	.	.			trans	-126	105.2	176.5	73.3	0	0	0	0	114.7	Y302 I307	Y302-S305 VanDerWaalsContact CD1-OG 3.27Å; Y302-S305 WeakPolarHBondContact CD1-OG 3.14Å; Y302-S305 WeakPolarHBondContact CE1-OG 3.07Å; S305-I307 PolarHBondContact O-N 3.28Å
306	M	37	Very low	59.6	Low	198 Å²	198	63.1 Å²	63.1	98%	0.975	33%	0.328	S	S	*	.			trans	-71.2	0.2	166.8	-78.8	-70.5	178.9	0	0	114
307	I	43.7	Very low	61.2	Low	102 Å²	102	61 Å²	61	52%	0.523	32%	0.316	S	S	.	.			trans	-107.6	111.1	-179.4	-54.1	177.4	0	0	0	108.7	S305 D309	S305-I307 PolarHBondContact O-N 3.28Å; I307-D309 WeakPolarHBondContact CG2-OD1 3.39Å; I307-D309 PolarHBondContact O-N 2.86Å
308	S	49	Very low	63	Low	105 Å²	105	58.3 Å²	58.3	73%	0.734	30%	0.301	S	S	*	.			trans	-83.4	47	-176.3	50.6	0	0	0	0	113.4
309	D	63.9	Low	64.9	Low	53 Å²	53	58.3 Å²	58.3	28%	0.283	30%	0.301	S	S	.	.			trans	-50.2	136.8	-179.2	-103.2	19.8	0	0	0	112.6	I307 L311 S312 R329	I307-D309 WeakPolarHBondContact CG2-OD1 3.39Å; I307-D309 PolarHBondContact O-N 2.86Å; D309-L311 PolarHBondContact O-N 3.22Å; D309-S312 WeakPolarHBondContact O-CB 3.24Å; D309-S312 PolarHBondContact O-N 2.68Å; D309-S312 PolarHBondContact O-OG 3.16Å; D309-R329 IonicContact OD2-CZ 3.24Å; D309-R329 IonicContact OD2-NH1 3.78Å; D309-R329 PolarHBondContact OD2-NH1 2.88Å
310	E	67.6	Low	66.5	Low	33 Å²	33	54.8 Å²	54.8	15%	0.154	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-27.2	175.9	-172.2	177.5	156.7	0	0	112.5	T227 K229 H231 Y232 W289 S312	T227-E310 WeakPolarHBondContact CB-OE1 3.23Å; T227-E310 HydrophobicContact CG2-CG 4.47Å; T227-E310 PolarHBondContact OG1-OE1 2.84Å; K229-E310 VanDerWaalsContact CB-OE1 3.29Å; K229-E310 WeakPolarHBondContact CB-OE1 3.26Å; K229-E310 PolarHBondContact N-OE1 3.26Å; H231-E310 WeakPolarHBondContact CB-OE2 3.42Å; H231-E310 IonicContact CD2-OE2 2.84Å; H231-E310 PolarHBondContact CD2-OE2 2.89Å; H231-E310 IonicContact CG-OE2 2.77Å; Y232-E310 HydrophobicContact CE2-CB 4.42Å; W289-E310 WeakPolarHBondContact CZ2-O 3.49Å; E310-S312 PolarHBondContact O-N 2.97Å
311	L	78.9	Confident	68.2	Low	1 Å²	1	50.4 Å²	50.4	1%	0.005	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	7.8	174.6	-61.7	168.5	0	0	0	113.6	T227 Y232 F234 L244 H272 W289 D309 G313	T227-L311 HydrophobicContact CG2-CD2 4.13Å; Y232-L311 HydrophobicContact CD1-CD1 4.27Å; Y232-L311 HydrophobicContact CD1-CD2 4.2Å; Y232-L311 HydrophobicContact CD2-CD1 4.38Å; Y232-L311 HydrophobicContact CD2-CD2 3.83Å; Y232-L311 HydrophobicContact CD2-CG 3.93Å; Y232-L311 HydrophobicContact CE1-CD1 4.01Å; Y232-L311 HydrophobicContact CE2-CD1 4.12Å; Y232-L311 HydrophobicContact CE2-CD2 4.36Å; Y232-L311 HydrophobicContact CE2-CG 3.96Å; Y232-L311 HydrophobicContact CG-CD1 4.48Å; Y232-L311 HydrophobicContact CG-CD2 3.77Å; Y232-L311 HydrophobicContact CG-CG 4.25Å; F234-L311 HydrophobicContact CE2-CD2 4.28Å; F234-L311 HydrophobicContact CZ-CD2 3.85Å; L244-L311 HydrophobicContact CD1-CD2 4.11Å; L244-L311 HydrophobicContact CD2-CD1 3.9Å; L244-L311 HydrophobicContact CD2-CD2 3.86Å; H272-L311 WeakPolarHBondContact NE2-CD1 3.48Å; W289-L311 WeakPolarHBondContact CH2-O 3.46Å; D309-L311 PolarHBondContact O-N 3.22Å; L311-G313 PolarHBondContact O-N 2.97Å
312	S	74.5	Confident	70.2	Confident	4 Å²	4	49.5 Å²	49.5	3%	0.028	26%	0.261	C	S	.	.			trans	-87.2	92	166.2	56.6	0	0	0	0	110.1	K292 D309 E310	K292-S312 VanDerWaalsContact CB-O 3.32Å; K292-S312 WeakPolarHBondContact CB-O 3.05Å; K292-S312 WeakPolarHBondContact CD-O 3.28Å; K292-S312 WeakPolarHBondContact CD-OG 3.47Å; K292-S312 VanDerWaalsContact CE-OG 3.3Å; K292-S312 WeakPolarHBondContact CE-OG 3.28Å; K292-S312 VanDerWaalsContact CG-O 3.3Å; K292-S312 WeakPolarHBondContact CG-O 3.35Å; K292-S312 PolarHBondContact NZ-OG 3.19Å; D309-S312 WeakPolarHBondContact O-CB 3.24Å; D309-S312 PolarHBondContact O-N 2.68Å; D309-S312 PolarHBondContact O-OG 3.16Å; E310-S312 PolarHBondContact O-N 2.97Å
313	G	79.7	Confident	72	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.9	-170.6	-179.3	0	0	0	0	0	111.1	I290 L311	I290-G313 CarbonylContact O-C 3.54Å; I290-G313 WeakPolarHBondContact O-CA 3.32Å; L311-G313 PolarHBondContact O-N 2.97Å
314	L	85.6	Confident	74.3	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	127.8	174.9	-74.8	170.5	0	0	0	110.7	I290 L295 F298 L326 L327 I328 L361	I290-L314 HydrophobicContact CB-CB 4.24Å; I290-L314 PolarHBondContact N-O 3.49Å; I290-L314 PolarHBondContact O-N 3.49Å; L295-L314 HydrophobicContact CD1-CB 4.44Å; L295-L314 HydrophobicContact CD1-CD1 3.55Å; L295-L314 HydrophobicContact CD1-CG 3.79Å; L295-L314 HydrophobicContact CD2-CD1 4.04Å; L295-L314 HydrophobicContact CG-CD1 4.47Å; F298-L314 HydrophobicContact CE2-CG 4.44Å; L314-L326 HydrophobicContact CD1-CD2 4.46Å; L314-L326 HydrophobicContact CD2-CB 4.3Å; L314-L327 WeakPolarHBondContact CA-O 3.43Å; L314-I328 HydrophobicContact CD2-CD1 4.03Å; L314-I328 HydrophobicContact CD2-CG1 3.51Å; L314-I328 HydrophobicContact CG-CG1 4.42Å; L314-L361 HydrophobicContact CD2-CD1 4.18Å
315	L	89.7	Confident	76.5	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	119.6	164.1	-176	67.8	0	0	0	108.9	T225 F234 V242 I275 W289 L317 L327 W358	T225-L315 HydrophobicContact CG2-CD1 4.42Å; F234-L315 HydrophobicContact CB-CD1 4.39Å; F234-L315 HydrophobicContact CD1-CD1 4.02Å; F234-L315 HydrophobicContact CD1-CD2 3.88Å; F234-L315 HydrophobicContact CD2-CD1 4.11Å; F234-L315 HydrophobicContact CE1-CD1 4.28Å; F234-L315 HydrophobicContact CE1-CD2 3.89Å; F234-L315 HydrophobicContact CE2-CD1 4.37Å; F234-L315 HydrophobicContact CG-CD1 3.93Å; F234-L315 HydrophobicContact CZ-CD1 4.45Å; V242-L315 HydrophobicContact CG1-CD2 4.33Å; I275-L315 HydrophobicContact CD1-CD2 4.39Å; W289-L315 HydrophobicContact CE3-CB 3.97Å; W289-L315 HydrophobicContact CE3-CD1 4.13Å; W289-L315 HydrophobicContact CZ3-CB 3.99Å; L315-L317 HydrophobicContact CB-CD1 4.43Å; L315-L317 HydrophobicContact CD2-CD1 4Å; L315-L317 HydrophobicContact CD2-CD2 4.19Å; L315-L317 HydrophobicContact CD2-CG 4.35Å; L315-L317 HydrophobicContact CG-CD1 3.81Å; L315-L317 HydrophobicContact CG-CD2 4.47Å; L315-L317 HydrophobicContact CG-CG 4.12Å; L315-L327 HydrophobicContact CB-CB 4.41Å; L315-L327 PolarHBondContact N-O 3.4Å; L315-L327 PolarHBondContact O-N 3.41Å; L315-W358 HydrophobicContact CB-CH2 4.4Å; L315-W358 HydrophobicContact CB-CZ3 3.77Å; L315-W358 HydrophobicContact CD2-CZ3 4.29Å
316	L	91.2	Very high	78.6	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	128.4	176.9	-79.2	165.4	0	0	0	110.1	I287 E288 I290 L324 R325 L326 F377 V379 L405 L419	I287-L316 VanDerWaalsContact CA-O 3.28Å; I287-L316 WeakPolarHBondContact CA-O 3.22Å; E288-L316 PolarHBondContact N-O 3.35Å; E288-L316 PolarHBondContact O-N 2.82Å; I290-L316 HydrophobicContact CD1-CD1 3.62Å; I290-L316 HydrophobicContact CG1-CD1 4.12Å; L316-L324 HydrophobicContact CB-CD1 4.19Å; L316-L324 HydrophobicContact CD2-CD1 3.99Å; L316-L324 HydrophobicContact CD2-CD2 4.39Å; L316-L324 HydrophobicContact CD2-CG 4.16Å; L316-R325 WeakPolarHBondContact CA-O 3.45Å; L316-L326 HydrophobicContact CD2-CD1 3.52Å; L316-L326 HydrophobicContact CD2-CG 3.63Å; L316-F377 HydrophobicContact CB-CE2 3.71Å; L316-F377 HydrophobicContact CB-CZ 3.85Å; L316-F377 HydrophobicContact CD1-CE2 4.14Å; L316-F377 HydrophobicContact CG-CE2 4.5Å; L316-V379 HydrophobicContact CD1-CG2 3.61Å; L316-L405 HydrophobicContact CD1-CD1 4.34Å; L316-L419 HydrophobicContact CD1-CD1 4.45Å
317	L	91.6	Very high	81	Confident	2 Å²	2	25.4 Å²	25.4	1%	0.01	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	122.2	-179.4	-49.7	98.8	0	0	0	111.9	V242 L277 V284 I287 L315 L324 R325 L327	V242-L317 HydrophobicContact CG2-CD2 3.38Å; L277-L317 HydrophobicContact CD1-CD2 4.02Å; V284-L317 HydrophobicContact CG1-CB 4.37Å; V284-L317 HydrophobicContact CG1-CD2 4.41Å; I287-L317 HydrophobicContact CG2-CB 4.25Å; I287-L317 HydrophobicContact CG2-CD2 3.67Å; I287-L317 HydrophobicContact CG2-CG 3.89Å; L315-L317 HydrophobicContact CB-CD1 4.43Å; L315-L317 HydrophobicContact CD2-CD1 4Å; L315-L317 HydrophobicContact CD2-CD2 4.19Å; L315-L317 HydrophobicContact CD2-CG 4.35Å; L315-L317 HydrophobicContact CG-CD1 3.81Å; L315-L317 HydrophobicContact CG-CD2 4.47Å; L315-L317 HydrophobicContact CG-CG 4.12Å; L317-L324 CarbonylContact O-C 3.6Å; L317-L324 WeakPolarHBondContact O-CA 3.44Å; L317-R325 PolarHBondContact N-O 2.95Å; L317-R325 PolarHBondContact O-N 3.07Å; L317-L327 HydrophobicContact CD1-CB 4.45Å; L317-L327 HydrophobicContact CD1-CD1 3.53Å; L317-L327 HydrophobicContact CD1-CG 3.56Å
318	L	91.9	Very high	82.8	Confident	3 Å²	3	21.2 Å²	21.2	2%	0.016	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	118.9	168.7	176.7	61.6	0	0	0	109.9	R285 R286 R323 L324 L374 F377	R285-L318 HydrophobicContact CB-CG 4.42Å; R285-L318 WeakPolarHBondContact CB-O 3.38Å; R285-L318 PolarHBondContact N-O 3.42Å; R286-L318 PolarHBondContact N-O 3.14Å; R286-L318 PolarHBondContact O-N 2.9Å; L318-R323 WeakPolarHBondContact CA-O 3.34Å; L318-L324 HydrophobicContact CB-CD1 4.38Å; L318-L374 HydrophobicContact CD1-CB 3.99Å; L318-F377 HydrophobicContact CB-CD1 3.63Å; L318-F377 HydrophobicContact CB-CE1 3.58Å; L318-F377 HydrophobicContact CD2-CD1 4.17Å
319	G	89.9	Confident	84.4	Confident	2 Å²	2	16.4 Å²	16.4	2%	0.021	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	173.3	179.6	0	0	0	0	0	115.1	L281 S283 R285 D321 K322 R323	L281-G319 VanDerWaalsContact CD1-CA 3.48Å; S283-G319 CarbonylContact O-C 3.59Å; R285-G319 WeakPolarHBondContact CD-O 3.28Å; G319-D321 WeakPolarHBondContact CA-OD1 3.43Å; G319-D321 PolarHBondContact O-N 2.8Å; G319-K322 PolarHBondContact O-N 2.75Å; G319-K322 VanDerWaalsContact O-N 3.09Å; G319-R323 PolarHBondContact N-O 2.94Å
320	T	85.3	Confident	84.7	Confident	52 Å²	52	15.2 Å²	15.2	32%	0.319	7%	0.074	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-16.7	167.9	47.8	0	0	0	0	113.8	S283 R285 K322	S283-T320 PolarHBondContact N-OG1 2.74Å; S283-T320 PolarHBondContact O-N 3.28Å; S283-T320 PolarHBondContact O-OG1 2.88Å; S283-T320 WeakPolarHBondContact OG-CG2 3.17Å; R285-T320 HydrophobicContact CG-CG2 4.1Å; T320-K322 PolarHBondContact O-N 3.16Å
321	D	85.6	Confident	84.6	Confident	33 Å²	33	16.2 Å²	16.2	18%	0.176	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	2.2	166.5	61.5	-10.3	0	0	0	113.1	G319 R323 R325	G319-D321 WeakPolarHBondContact CA-OD1 3.43Å; G319-D321 PolarHBondContact O-N 2.8Å; D321-R323 PolarHBondContact O-N 2.7Å; D321-R323 PolarHBondContact OD1-N 3.47Å; D321-R325 IonicContact OD2-CZ 3.98Å; D321-R325 IonicContact OD2-NE 3.19Å; D321-R325 IonicContact OD2-NH2 2.82Å; D321-R325 PolarHBondContact OD2-NH2 2.93Å
322	K	88.7	Confident	83.5	Confident	53 Å²	53	21.6 Å²	21.6	23%	0.23	10%	0.104	C	C	.	.	S	Bend	trans	59	24.2	-179	-59	-168	-174.1	-172	0	113.6	G319 T320 L373 L374 D410	G319-K322 PolarHBondContact O-N 2.75Å; G319-K322 VanDerWaalsContact O-N 3.09Å; T320-K322 PolarHBondContact O-N 3.16Å; K322-L373 HydrophobicContact CB-CB 3.87Å; K322-L373 HydrophobicContact CB-CD2 4.35Å; K322-L373 HydrophobicContact CD-CB 3.86Å; K322-L373 HydrophobicContact CD-CD1 4.29Å; K322-L374 VanDerWaalsContact CB-O 3.31Å; K322-L374 WeakPolarHBondContact CB-O 3.44Å; K322-L374 WeakPolarHBondContact O-CB 3.48Å; K322-L374 PolarHBondContact O-N 2.99Å; K322-D410 VanDerWaalsContact CD-OD2 3.23Å; K322-D410 WeakPolarHBondContact CD-OD2 3.35Å; K322-D410 WeakPolarHBondContact CE-OD2 3.24Å; K322-D410 IonicContact NZ-OD1 3.13Å; K322-D410 PolarHBondContact NZ-OD1 2.94Å; K322-D410 IonicContact NZ-OD2 3.61Å; K322-D410 PolarHBondContact NZ-OD2 2.87Å
323	R	88.9	Confident	82.2	Confident	60 Å²	60	26.6 Å²	26.6	23%	0.226	12%	0.123	C	C	.	.			trans	-104.6	132.6	176.9	-77.1	166.3	-179.9	-174.5	-2.4	110.8	L318 G319 D321 T363 F364 G365 F366	L318-R323 WeakPolarHBondContact CA-O 3.34Å; G319-R323 PolarHBondContact N-O 2.94Å; D321-R323 PolarHBondContact O-N 2.7Å; D321-R323 PolarHBondContact OD1-N 3.47Å; R323-T363 HydrophobicContact CB-CG2 3.84Å; R323-T363 HydrophobicContact CG-CG2 4.08Å; R323-F364 CarbonylContact C-O 3.56Å; R323-F364 VanDerWaalsContact CA-O 3.25Å; R323-F364 WeakPolarHBondContact CA-O 3.47Å; R323-G365 WeakPolarHBondContact CG-O 3.29Å; R323-G365 PolarHBondContact NE-O 3.46Å; R323-F366 PolarHBondContact NH2-O 3.35Å
324	L	89.8	Confident	80	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	115.6	174.5	176.1	60.2	0	0	0	109.1	L316 L317 L318 T363 F364 L374 F377 L405 I407	L316-L324 HydrophobicContact CB-CD1 4.19Å; L316-L324 HydrophobicContact CD2-CD1 3.99Å; L316-L324 HydrophobicContact CD2-CD2 4.39Å; L316-L324 HydrophobicContact CD2-CG 4.16Å; L317-L324 CarbonylContact O-C 3.6Å; L317-L324 WeakPolarHBondContact O-CA 3.44Å; L318-L324 HydrophobicContact CB-CD1 4.38Å; L324-T363 CarbonylContact O-C 3.58Å; L324-T363 VanDerWaalsContact O-CA 3.3Å; L324-T363 WeakPolarHBondContact O-CA 3.44Å; L324-F364 HydrophobicContact CB-CB 4.33Å; L324-F364 PolarHBondContact N-O 2.83Å; L324-F364 PolarHBondContact O-N 2.99Å; L324-L374 HydrophobicContact CB-CD1 3.63Å; L324-F377 HydrophobicContact CD1-CD1 3.69Å; L324-F377 HydrophobicContact CD1-CD2 4.13Å; L324-F377 HydrophobicContact CD1-CE1 3.63Å; L324-F377 HydrophobicContact CD1-CE2 4.08Å; L324-F377 HydrophobicContact CD1-CG 3.94Å; L324-F377 HydrophobicContact CD1-CZ 3.83Å; L324-F377 HydrophobicContact CD2-CB 4Å; L324-F377 HydrophobicContact CD2-CD1 4.44Å; L324-F377 HydrophobicContact CD2-CD2 4.2Å; L324-F377 HydrophobicContact CD2-CG 3.97Å; L324-L405 HydrophobicContact CD2-CD1 4.1Å; L324-L405 HydrophobicContact CD2-CD2 3.94Å; L324-L405 HydrophobicContact CD2-CG 4.49Å; L324-I407 HydrophobicContact CD2-CD1 4Å; L324-I407 HydrophobicContact CD2-CG1 3.97Å
325	R	89.5	Confident	77.3	Confident	30 Å²	30	37.8 Å²	37.8	11%	0.113	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	134	-173.1	-62	171.1	-176.1	-110	7.8	110.3	L316 L317 D321 T363	L316-R325 WeakPolarHBondContact CA-O 3.45Å; L317-R325 PolarHBondContact N-O 2.95Å; L317-R325 PolarHBondContact O-N 3.07Å; D321-R325 IonicContact OD2-CZ 3.98Å; D321-R325 IonicContact OD2-NE 3.19Å; D321-R325 IonicContact OD2-NH2 2.82Å; D321-R325 PolarHBondContact OD2-NH2 2.93Å; R325-T363 HydrophobicContact CG-CG2 4.2Å
326	L	88.1	Confident	74.3	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	118	173.9	-78.4	67.8	0	0	0	108.9	L314 L316 C360 L361 F362 F364 L419	L314-L326 HydrophobicContact CD1-CD2 4.46Å; L314-L326 HydrophobicContact CD2-CB 4.3Å; L316-L326 HydrophobicContact CD2-CD1 3.52Å; L316-L326 HydrophobicContact CD2-CG 3.63Å; L326-C360 CarbonylContact O-C 3.52Å; L326-C360 WeakPolarHBondContact O-CA 3.34Å; L326-L361 HydrophobicContact CB-CB 4.41Å; L326-L361 PolarHBondContact O-N 2.84Å; L326-F362 HydrophobicContact CB-CB 4.39Å; L326-F362 HydrophobicContact CD1-CB 4.36Å; L326-F362 HydrophobicContact CD2-CB 4.12Å; L326-F362 PolarHBondContact N-O 3.33Å; L326-F364 HydrophobicContact CD1-CD2 4.09Å; L326-F364 HydrophobicContact CD1-CE2 3.98Å; L326-L419 HydrophobicContact CD2-CD2 3.85Å
327	L	87.3	Confident	71.2	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	140.8	173.2	-49.3	-174.2	0	0	0	111.7	L277 L314 L315 L317 W358 K359 C360 I434	L277-L327 HydrophobicContact CD2-CD1 3.81Å; L314-L327 WeakPolarHBondContact CA-O 3.43Å; L315-L327 HydrophobicContact CB-CB 4.41Å; L315-L327 PolarHBondContact N-O 3.4Å; L315-L327 PolarHBondContact O-N 3.41Å; L317-L327 HydrophobicContact CD1-CB 4.45Å; L317-L327 HydrophobicContact CD1-CD1 3.53Å; L317-L327 HydrophobicContact CD1-CG 3.56Å; L327-W358 HydrophobicContact CB-CE3 3.74Å; L327-W358 HydrophobicContact CB-CZ3 4.43Å; L327-W358 HydrophobicContact CD1-CB 4.46Å; L327-K359 WeakPolarHBondContact CA-O 3.45Å; L327-C360 HydrophobicContact CD2-CB 3.43Å; L327-C360 VanDerWaalsContact CD2-CB 3.43Å; L327-C360 VanDerWaalsContact CD2-SG 3.58Å; L327-I434 HydrophobicContact CD1-CD1 4.27Å; L327-I434 HydrophobicContact CD2-CD1 3.89Å
328	I	83.3	Confident	68.2	Low	13 Å²	13	60.9 Å²	60.9	7%	0.067	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	142	164.6	-70.2	-171.5	0	0	0	109.2	F298 Y302 L314 T330 W358 K359 L361	F298-I328 HydrophobicContact CE2-CD1 3.51Å; F298-I328 HydrophobicContact CE2-CG1 4.39Å; F298-I328 HydrophobicContact CZ-CD1 3.67Å; F298-I328 HydrophobicContact CZ-CG1 4.43Å; Y302-I328 HydrophobicContact CE2-CG2 4.04Å; L314-I328 HydrophobicContact CD2-CD1 4.03Å; L314-I328 HydrophobicContact CD2-CG1 3.51Å; L314-I328 HydrophobicContact CG-CG1 4.42Å; I328-T330 HydrophobicContact CG2-CG2 4.22Å; I328-W358 VanDerWaalsContact C-CE3 3.48Å; I328-W358 CarbonylContact O-C 3.3Å; I328-W358 VanDerWaalsContact O-CA 3.26Å; I328-W358 WeakPolarHBondContact O-CA 3.46Å; I328-K359 PolarHBondContact N-O 2.69Å; I328-K359 PolarHBondContact O-N 3.01Å; I328-L361 HydrophobicContact CD1-CD1 3.33Å; I328-L361 HydrophobicContact CD1-CG 4.16Å; I328-L361 HydrophobicContact CG1-CD1 3.71Å; I328-L361 HydrophobicContact CG1-CG 4.19Å
329	R	80.8	Confident	65	Low	5 Å²	5	65.3 Å²	65.3	2%	0.019	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	128.3	168	-169.7	177.5	-178.2	-119.9	19.8	110.2	H272 E273 Y302 D309 H331 I356 W358	H272-R329 PolarHBondContact NE2-NH2 3.21Å; E273-R329 IonicContact OE1-CZ 3.97Å; E273-R329 IonicContact OE1-NE 2.8Å; E273-R329 PolarHBondContact OE1-NE 3.29Å; E273-R329 IonicContact OE1-NH2 3.02Å; E273-R329 PolarHBondContact OE1-NH2 2.8Å; E273-R329 IonicContact OE2-NE 2.9Å; Y302-R329 PolarHBondContact OH-O 2.84Å; D309-R329 IonicContact OD2-CZ 3.24Å; D309-R329 IonicContact OD2-NH1 3.78Å; D309-R329 PolarHBondContact OD2-NH1 2.88Å; R329-H331 PolarHBondContact NH1-CE1 3.08Å; R329-H331 PolarHBondContact NH1-NE2 3.13Å; R329-I356 HydrophobicContact CG-CG2 3.77Å; R329-W358 HydrophobicContact CB-CD2 3.97Å; R329-W358 HydrophobicContact CB-CE3 4.03Å; R329-W358 HydrophobicContact CB-CH2 3.85Å; R329-W358 HydrophobicContact CB-CZ2 3.75Å; R329-W358 HydrophobicContact CB-CZ3 3.98Å; R329-W358 HydrophobicContact CG-CD2 4.43Å; R329-W358 HydrophobicContact CG-CZ2 3.98Å
330	T	71.9	Confident	61.8	Low	28 Å²	28	71.2 Å²	71.2	17%	0.172	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	151	-175	24.5	0	0	0	0	110.9	I328 Y357	I328-T330 HydrophobicContact CG2-CG2 4.22Å; T330-Y357 PolarHBondContact N-O 3.35Å; T330-Y357 PolarHBondContact O-N 3.45Å; T330-Y357 VanDerWaalsContact O-O 3.1Å; T330-Y357 WeakPolarHBondContact OG1-CD2 3.47Å; T330-Y357 WeakPolarHBondContact OG1-CE2 3.5Å; T330-Y357 PolarHBondContact OG1-O 2.95Å
331	H	64.9	Low	58.9	Low	54 Å²	54	75.7 Å²	75.7	25%	0.25	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	130.2	-175.8	-60.5	-96.8	0	0	0	110.2	R329	R329-H331 PolarHBondContact NH1-CE1 3.08Å; R329-H331 PolarHBondContact NH1-NE2 3.13Å
332	E	55.2	Low	55.9	Low	114 Å²	114	82.2 Å²	82.2	53%	0.533	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	109.5	175.3	-133.5	170.9	-165.3	0	0	110.2	S355 Y357	E332-S355 PolarHBondContact N-O 2.93Å; E332-Y357 HydrophobicContact CB-CD1 4.37Å; E332-Y357 HydrophobicContact CB-CE1 3.79Å; E332-Y357 HydrophobicContact CG-CE1 3.93Å
333	Y	48.1	Very low	52.9	Low	108 Å²	108	86.6 Å²	86.6	42%	0.424	48%	0.477	S	S	.	.			trans	-87.8	117.5	167.6	-68.1	-70.3	0	0	0	109.5	D304 T335 T354	D304-Y333 WeakPolarHBondContact O-CE2 3.43Å; Y333-T335 PolarHBondContact O-N 2.81Å; Y333-T354 HydrophobicContact CD1-CG2 4.38Å; Y333-T354 HydrophobicContact CE1-CG2 4.35Å
334	S	32.5	Very low	50	Low	98 Å²	98	89.3 Å²	89.3	69%	0.685	51%	0.505	S	S	*	.			trans	-76.3	84.8	-175.9	46.3	0	0	0	0	112.7	K336	S334-K336 PolarHBondContact O-N 3.11Å
335	T	29.1	Very low	47	Very low	137 Å²	137	94.9 Å²	94.9	84%	0.84	54%	0.541	S	S	*	.			trans	-72.7	46.9	-179.1	48.5	0	0	0	0	114.5	Y333	Y333-T335 PolarHBondContact O-N 2.81Å
336	K	27.9	Very low	43.9	Very low	199 Å²	199	103.4 Å²	103.4	87%	0.865	58%	0.579	S	S	*	*			trans	-142.5	74.7	179	-73.6	-168.7	175.3	179.8	0	114.4	S334	S334-K336 PolarHBondContact O-N 3.11Å
337	S	26	Very low	41	Very low	106 Å²	106	112 Å²	112	74%	0.741	62%	0.619	S	S	*	*			trans	-172.6	107.6	138.4	-173	0	0	0	0	111
338	L	28.6	Very low	38	Very low	183 Å²	183	121.4 Å²	121.4	96%	0.958	66%	0.662	S	S	*	*	S	Bend	trans	-164.3	43.4	162.7	-108.7	156.8	0	0	0	110
339	A	24.2	Very low	35.3	Very low	96 Å²	96	128.8 Å²	128.8	79%	0.793	70%	0.701	S	S	*	*			trans	-150.3	46.5	-177.5	0	0	0	0	0	111.9
340	C	23.4	Very low	32.8	Very low	126 Å²	126	133.9 Å²	133.9	85%	0.851	74%	0.738	S	S	*	*			trans	-135.7	149.5	168.2	-89.2	0	0	0	0	109.7
341	T	23.3	Very low	30.9	Very low	145 Å²	145	142.4 Å²	142.4	89%	0.89	77%	0.772	S	S	*	*			trans	-84.5	177.3	-169.3	47.8	0	0	0	0	114.1
342	E	23.5	Very low	29.4	Very low	171 Å²	171	146.1 Å²	146.1	80%	0.799	79%	0.794	S	S	*	*	S	Bend	trans	-61.5	166.8	-169.9	-51.3	176.3	140	0	0	116.1
343	N	25.1	Very low	28.6	Very low	145 Å²	145	144.7 Å²	144.7	78%	0.775	80%	0.796	S	S	*	*			trans	74.7	72.8	155.1	-57	-40.2	0	0	0	119.6
344	S	27.6	Very low	28.6	Very low	117 Å²	117	142.4 Å²	142.4	82%	0.818	79%	0.794	S	S	*	*			trans	-164.8	156.4	135.8	36.3	0	0	0	0	112
345	P	27.8	Very low	29.9	Very low	117 Å²	117	140.7 Å²	140.7	76%	0.76	78%	0.782	S	S	*	*			trans	-93.5	125.7	-158.9	33.9	-34.8	0	0	0	116.3	H347	P345-H347 PolarHBondContact O-N 2.76Å
346	K	23.7	Very low	31.8	Very low	209 Å²	209	135.3 Å²	135.3	91%	0.909	75%	0.748	S	S	*	*			trans	21.2	82.7	138.7	-60.3	179.1	-178.6	176.6	0	117.4
347	H	27.1	Very low	34.1	Very low	181 Å²	181	128.2 Å²	128.2	84%	0.838	72%	0.716	S	S	*	*			trans	-99.7	146	144.7	-102	-91.2	0	0	0	110.2	P345 L349	P345-H347 PolarHBondContact O-N 2.76Å; H347-L349 PolarHBondContact O-N 3.44Å; H347-L349 VanDerWaalsContact O-N 3.09Å
348	Q	24.6	Very low	36.7	Very low	197 Å²	197	123.1 Å²	123.1	92%	0.921	68%	0.68	S	S	*	*			trans	-76.2	96	-171.5	-66.9	163.2	-40.2	0	0	111.1
349	L	25.7	Very low	39.1	Very low	169 Å²	169	117.7 Å²	117.7	89%	0.885	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-66.9	129.1	160.4	-78.4	132.3	0	0	0	109	H347	H347-L349 PolarHBondContact O-N 3.44Å; H347-L349 VanDerWaalsContact O-N 3.09Å
350	S	29.1	Very low	41.8	Very low	112 Å²	112	113.5 Å²	113.5	78%	0.783	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-60.4	144.8	173.8	39.1	0	0	0	0	110.6	N352	S350-N352 PolarHBondContact O-N 2.99Å
351	K	32.3	Very low	44.2	Very low	207 Å²	207	108.7 Å²	108.7	90%	0.9	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-56.1	134.7	-173.8	-66.5	178.7	179.2	177.5	0	111.1	S353	K351-S353 PolarHBondContact O-N 3.23Å
352	N	32.7	Very low	46.7	Very low	132 Å²	132	104 Å²	104	71%	0.706	55%	0.547	S	S	*	.			trans	-35.2	115.5	-178.7	-56.8	-5	0	0	0	113.5	S350 T354	S350-N352 PolarHBondContact O-N 2.99Å; N352-T354 PolarHBondContact O-N 3.42Å
353	S	39.3	Very low	49.6	Very low	83 Å²	83	96.9 Å²	96.9	58%	0.58	52%	0.515	S	S	*	.			trans	-72	106.6	163.8	-175.3	0	0	0	0	108.6	K351 S355	K351-S353 PolarHBondContact O-N 3.23Å; S353-S355 PolarHBondContact O-N 2.93Å
354	T	47	Very low	52.3	Low	60 Å²	60	90.1 Å²	90.1	37%	0.368	48%	0.479	S	S	.	.			trans	-75.6	109.9	174.2	37.7	0	0	0	0	109.2	Y333 N352 I356	Y333-T354 HydrophobicContact CD1-CG2 4.38Å; Y333-T354 HydrophobicContact CE1-CG2 4.35Å; N352-T354 PolarHBondContact O-N 3.42Å; T354-I356 PolarHBondContact O-N 2.84Å
355	S	59.7	Low	54.8	Low	62 Å²	62	84.6 Å²	84.6	43%	0.434	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	118.8	179.6	-71.2	0	0	0	0	110.1	E332 S353	E332-S355 PolarHBondContact N-O 2.93Å; S353-S355 PolarHBondContact O-N 2.93Å
356	I	69.5	Low	57.2	Low	24 Å²	24	83.9 Å²	83.9	12%	0.123	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	134.5	175.5	-51.8	-177.4	0	0	0	108.5	R329 T354 N438	R329-I356 HydrophobicContact CG-CG2 3.77Å; T354-I356 PolarHBondContact O-N 2.84Å; I356-N438 VanDerWaalsContact CG1-ND2 3.33Å; I356-N438 WeakPolarHBondContact CG1-ND2 3.43Å
357	Y	76.4	Confident	59.5	Low	50 Å²	50	76.1 Å²	76.1	20%	0.196	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	147.1	176	60.8	-90.3	0	0	0	110.7	T330 E332 V433 I434	T330-Y357 PolarHBondContact N-O 3.35Å; T330-Y357 PolarHBondContact O-N 3.45Å; T330-Y357 VanDerWaalsContact O-O 3.1Å; T330-Y357 WeakPolarHBondContact OG1-CD2 3.47Å; T330-Y357 WeakPolarHBondContact OG1-CE2 3.5Å; T330-Y357 PolarHBondContact OG1-O 2.95Å; E332-Y357 HydrophobicContact CB-CD1 4.37Å; E332-Y357 HydrophobicContact CB-CE1 3.79Å; E332-Y357 HydrophobicContact CG-CE1 3.93Å; Y357-V433 HydrophobicContact CD2-CG1 3.5Å; Y357-V433 HydrophobicContact CD2-CG2 4.42Å; Y357-V433 HydrophobicContact CE2-CG1 4.14Å; Y357-V433 HydrophobicContact CE2-CG2 4.35Å; Y357-V433 HydrophobicContact CG-CG1 3.95Å; Y357-I434 WeakPolarHBondContact CA-O 3.47Å; Y357-I434 WeakPolarHBondContact CB-O 3.15Å
358	W	81	Confident	61.6	Low	0 Å²	0	68.7 Å²	68.7	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	127.3	174.1	-70.8	75.3	0	0	0	109.6	F234 E273 I275 W289 L315 L327 I328 R329 I434 V436	F234-W358 AromaticContact CE1-CH2 3.79Å; F234-W358 HydrophobicContact CE1-CH2 3.79Å; F234-W358 AromaticContact CE1-CZ2 3.94Å; F234-W358 HydrophobicContact CE1-CZ2 3.94Å; F234-W358 AromaticContact CZ-CH2 3.77Å; F234-W358 HydrophobicContact CZ-CH2 3.77Å; F234-W358 HydrophobicContact CZ-CZ2 4.22Å; E273-W358 PolarHBondContact OE2-NE1 3.17Å; I275-W358 HydrophobicContact CD1-CD2 3.85Å; I275-W358 VanDerWaalsContact CD1-CE2 3.45Å; I275-W358 HydrophobicContact CD1-CG 4.04Å; I275-W358 HydrophobicContact CD1-CZ2 3.89Å; I275-W358 HydrophobicContact CG1-CG 4.48Å; I275-W358 HydrophobicContact CG2-CG 4.41Å; W289-W358 HydrophobicContact CH2-CH2 4.38Å; W289-W358 AromaticContact CZ3-CH2 3.88Å; W289-W358 HydrophobicContact CZ3-CH2 3.88Å; W289-W358 HydrophobicContact CZ3-CZ3 4.11Å; L315-W358 HydrophobicContact CB-CH2 4.4Å; L315-W358 HydrophobicContact CB-CZ3 3.77Å; L315-W358 HydrophobicContact CD2-CZ3 4.29Å; L327-W358 HydrophobicContact CB-CE3 3.74Å; L327-W358 HydrophobicContact CB-CZ3 4.43Å; L327-W358 HydrophobicContact CD1-CB 4.46Å; I328-W358 VanDerWaalsContact C-CE3 3.48Å; I328-W358 CarbonylContact O-C 3.3Å; I328-W358 VanDerWaalsContact O-CA 3.26Å; I328-W358 WeakPolarHBondContact O-CA 3.46Å; R329-W358 HydrophobicContact CB-CD2 3.97Å; R329-W358 HydrophobicContact CB-CE3 4.03Å; R329-W358 HydrophobicContact CB-CH2 3.85Å; R329-W358 HydrophobicContact CB-CZ2 3.75Å; R329-W358 HydrophobicContact CB-CZ3 3.98Å; R329-W358 HydrophobicContact CG-CD2 4.43Å; R329-W358 HydrophobicContact CG-CZ2 3.98Å; W358-I434 PolarHBondContact N-O 2.9Å; W358-I434 WeakPolarHBondContact O-CA 3.49Å; W358-I434 VanDerWaalsContact O-CB 3.25Å; W358-I434 WeakPolarHBondContact O-CB 3.18Å; W358-I434 PolarHBondContact O-N 2.88Å; W358-V436 VanDerWaalsContact CD1-CG2 3.43Å
359	K	78.3	Confident	63.3	Low	69 Å²	69	65.3 Å²	65.3	30%	0.3	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	123.1	-179.5	-172.6	179.8	-179.5	-173.3	0	109.1	L327 I328 L361 I431 V433	L327-K359 WeakPolarHBondContact CA-O 3.45Å; I328-K359 PolarHBondContact N-O 2.69Å; I328-K359 PolarHBondContact O-N 3.01Å; K359-L361 HydrophobicContact CD-CD2 4.21Å; K359-L361 HydrophobicContact CG-CD2 4.38Å; K359-L361 PolarHBondContact O-N 3.23Å; K359-I431 HydrophobicContact CD-CG2 4.25Å; K359-I431 HydrophobicContact CG-CG2 3.75Å; K359-V433 HydrophobicContact CG-CG2 4.49Å
360	C	80.6	Confident	65.1	Low	7 Å²	7	63.8 Å²	63.8	5%	0.047	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	91.4	179.8	-171.6	0	0	0	0	109.7	L326 L327 I431 P432 I434	L326-C360 CarbonylContact O-C 3.52Å; L326-C360 WeakPolarHBondContact O-CA 3.34Å; L327-C360 HydrophobicContact CD2-CB 3.43Å; L327-C360 VanDerWaalsContact CD2-CB 3.43Å; L327-C360 VanDerWaalsContact CD2-SG 3.58Å; C360-I431 WeakPolarHBondContact O-CG2 3.38Å; C360-P432 HydrophobicContact CB-CG 4.26Å; C360-P432 PolarHBondContact N-O 3.48Å; C360-I434 HydrophobicContact CB-CD1 4.42Å
361	L	74.6	Confident	67.1	Low	25 Å²	25	58.8 Å²	58.8	13%	0.131	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	-50.6	-173.2	-72.9	-172.3	0	0	0	113.9	L314 L326 I328 K359 L423 L426 I431	L314-L361 HydrophobicContact CD2-CD1 4.18Å; L326-L361 HydrophobicContact CB-CB 4.41Å; L326-L361 PolarHBondContact O-N 2.84Å; I328-L361 HydrophobicContact CD1-CD1 3.33Å; I328-L361 HydrophobicContact CD1-CG 4.16Å; I328-L361 HydrophobicContact CG1-CD1 3.71Å; I328-L361 HydrophobicContact CG1-CG 4.19Å; K359-L361 HydrophobicContact CD-CD2 4.21Å; K359-L361 HydrophobicContact CG-CD2 4.38Å; K359-L361 PolarHBondContact O-N 3.23Å; L361-L423 HydrophobicContact CD1-CD2 3.82Å; L361-L426 HydrophobicContact CB-CD1 3.85Å; L361-L426 HydrophobicContact CD1-CD1 3.67Å; L361-L426 HydrophobicContact CD2-CD1 4.22Å; L361-L426 HydrophobicContact CG-CD1 4.13Å; L361-L426 WeakPolarHBondContact O-CD2 3.46Å; L361-I431 HydrophobicContact CD2-CD1 4.37Å
362	F	76.3	Confident	69.2	Low	47 Å²	47	49.5 Å²	49.5	21%	0.206	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	159.2	-171	-159.8	-97.2	0	0	0	110.7	R24 L326 F364 V422 L426	R24-F362 HydrophobicContact CG-CZ 4.17Å; L326-F362 HydrophobicContact CB-CB 4.39Å; L326-F362 HydrophobicContact CD1-CB 4.36Å; L326-F362 HydrophobicContact CD2-CB 4.12Å; L326-F362 PolarHBondContact N-O 3.33Å; F362-F364 AromaticContact CD1-CD2 3.8Å; F362-F364 HydrophobicContact CD1-CD2 3.8Å; F362-F364 HydrophobicContact CD1-CE1 4.42Å; F362-F364 AromaticContact CD1-CE2 3.58Å; F362-F364 HydrophobicContact CD1-CE2 3.58Å; F362-F364 HydrophobicContact CD1-CG 4.31Å; F362-F364 AromaticContact CD1-CZ 3.91Å; F362-F364 HydrophobicContact CD1-CZ 3.91Å; F362-F364 AromaticContact CE1-CD1 3.98Å; F362-F364 HydrophobicContact CE1-CD1 3.98Å; F362-F364 AromaticContact CE1-CD2 4Å; F362-F364 HydrophobicContact CE1-CD2 4Å; F362-F364 AromaticContact CE1-CE1 3.8Å; F362-F364 HydrophobicContact CE1-CE1 3.8Å; F362-F364 AromaticContact CE1-CE2 3.82Å; F362-F364 HydrophobicContact CE1-CE2 3.82Å; F362-F364 HydrophobicContact CE1-CG 4.07Å; F362-F364 AromaticContact CE1-CZ 3.72Å; F362-F364 HydrophobicContact CE1-CZ 3.72Å; F362-V422 HydrophobicContact CB-CG1 4.29Å; F362-V422 HydrophobicContact CD1-CG1 3.98Å; F362-V422 HydrophobicContact CD2-CG1 4.14Å; F362-V422 HydrophobicContact CE1-CG1 4.39Å; F362-V422 HydrophobicContact CG-CG1 3.86Å; F362-L426 HydrophobicContact CB-CD2 4.49Å; F362-L426 HydrophobicContact CD2-CD2 4.12Å
363	T	83.4	Confident	71.7	Confident	21 Å²	21	46.1 Å²	46.1	13%	0.129	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	129.8	174.8	-63.9	0	0	0	0	109.9	R323 L324 R325 F366	R323-T363 HydrophobicContact CB-CG2 3.84Å; R323-T363 HydrophobicContact CG-CG2 4.08Å; L324-T363 CarbonylContact O-C 3.58Å; L324-T363 VanDerWaalsContact O-CA 3.3Å; L324-T363 WeakPolarHBondContact O-CA 3.44Å; R325-T363 HydrophobicContact CG-CG2 4.2Å; T363-F366 HydrophobicContact CG2-CE2 4.41Å; T363-F366 HydrophobicContact CG2-CZ 4.32Å; T363-F366 WeakPolarHBondContact O-CE2 3.13Å
364	F	81.8	Confident	74.1	Confident	4 Å²	4	42.4 Å²	42.4	2%	0.018	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	160.9	165.4	-61.7	-94.7	0	0	0	109.8	R24 R323 L324 L326 F362 L374 L405 I407 N417 V422	R24-F364 HydrophobicContact CB-CE1 4.18Å; R323-F364 CarbonylContact C-O 3.56Å; R323-F364 VanDerWaalsContact CA-O 3.25Å; R323-F364 WeakPolarHBondContact CA-O 3.47Å; L324-F364 HydrophobicContact CB-CB 4.33Å; L324-F364 PolarHBondContact N-O 2.83Å; L324-F364 PolarHBondContact O-N 2.99Å; L326-F364 HydrophobicContact CD1-CD2 4.09Å; L326-F364 HydrophobicContact CD1-CE2 3.98Å; F362-F364 AromaticContact CD1-CD2 3.8Å; F362-F364 HydrophobicContact CD1-CD2 3.8Å; F362-F364 HydrophobicContact CD1-CE1 4.42Å; F362-F364 AromaticContact CD1-CE2 3.58Å; F362-F364 HydrophobicContact CD1-CE2 3.58Å; F362-F364 HydrophobicContact CD1-CG 4.31Å; F362-F364 AromaticContact CD1-CZ 3.91Å; F362-F364 HydrophobicContact CD1-CZ 3.91Å; F362-F364 AromaticContact CE1-CD1 3.98Å; F362-F364 HydrophobicContact CE1-CD1 3.98Å; F362-F364 AromaticContact CE1-CD2 4Å; F362-F364 HydrophobicContact CE1-CD2 4Å; F362-F364 AromaticContact CE1-CE1 3.8Å; F362-F364 HydrophobicContact CE1-CE1 3.8Å; F362-F364 AromaticContact CE1-CE2 3.82Å; F362-F364 HydrophobicContact CE1-CE2 3.82Å; F362-F364 HydrophobicContact CE1-CG 4.07Å; F362-F364 AromaticContact CE1-CZ 3.72Å; F362-F364 HydrophobicContact CE1-CZ 3.72Å; F364-L374 HydrophobicContact CB-CD1 3.82Å; F364-L405 HydrophobicContact CE2-CD2 4.4Å; F364-I407 HydrophobicContact CG-CD1 4.4Å; F364-N417 WeakPolarHBondContact CE1-ND2 3.33Å; F364-V422 HydrophobicContact CZ-CG1 4.42Å; F364-V422 HydrophobicContact CZ-CG2 3.88Å
365	G	79.9	Confident	75.9	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.224	C	C	.	.			trans	85	35	-179.5	0	0	0	0	0	114.3	R323 G367 D371 P372 L373	R323-G365 WeakPolarHBondContact CG-O 3.29Å; R323-G365 PolarHBondContact NE-O 3.46Å; G365-G367 PolarHBondContact O-N 2.82Å; G365-D371 VanDerWaalsContact N-CG 3.26Å; G365-D371 PolarHBondContact N-OD1 3.35Å; G365-D371 PolarHBondContact N-OD2 3.39Å; G365-D371 VanDerWaalsContact N-OD2 3.14Å; G365-P372 WeakPolarHBondContact CA-O 3.34Å; G365-L373 WeakPolarHBondContact O-CD2 3.23Å
366	F	77.7	Confident	77.3	Confident	103 Å²	103	40 Å²	40	45%	0.452	22%	0.215	S	C	.	.			trans	-60.1	-26.5	175.1	-81.2	-74.8	0	0	0	112.8	R323 T363 D371	R323-F366 PolarHBondContact NH2-O 3.35Å; T363-F366 HydrophobicContact CG2-CE2 4.41Å; T363-F366 HydrophobicContact CG2-CZ 4.32Å; T363-F366 WeakPolarHBondContact O-CE2 3.13Å; F366-D371 WeakPolarHBondContact CB-OD2 3.16Å; F366-D371 VanDerWaalsContact CD2-OD2 3.27Å; F366-D371 WeakPolarHBondContact CD2-OD2 3.48Å; F366-D371 PolarHBondContact N-OD2 3.42Å
367	G	73.5	Confident	78.4	Confident	46 Å²	46	39 Å²	39	47%	0.474	21%	0.21	S	C	.	.	S	Bend	trans	100.9	21.8	178.5	0	0	0	0	0	113.6	G365 D371	G365-G367 PolarHBondContact O-N 2.82Å; G367-D371 WeakPolarHBondContact CA-O 3.38Å; G367-D371 PolarHBondContact N-O 3.16Å
368	S	71.2	Confident	78.9	Confident	25 Å²	25	36.9 Å²	36.9	18%	0.175	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-94.9	170.7	177.7	82.1	0	0	0	0	111.3	E370 D371 P372	S368-E370 PolarHBondContact O-N 2.85Å; S368-E370 PolarHBondContact OG-N 2.96Å; S368-D371 PolarHBondContact N-O 3.39Å; S368-D371 CarbonylContact O-C 3.5Å; S368-D371 PolarHBondContact O-N 3.35Å; S368-D371 PolarHBondContact OG-N 3.43Å; S368-P372 WeakPolarHBondContact O-CA 3.23Å; S368-P372 VanDerWaalsContact O-N 3.16Å
369	L	60.1	Low	79.3	Confident	126 Å²	126	37.7 Å²	37.7	66%	0.66	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66	-18.1	177.8	-168.1	65.7	0	0	0	113.4
370	E	61.7	Low	79.4	Confident	136 Å²	136	34.6 Å²	34.6	64%	0.636	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103	-7.8	178.2	-59	-178.8	153.7	0	0	112.7	S368	S368-E370 PolarHBondContact O-N 2.85Å; S368-E370 PolarHBondContact OG-N 2.96Å
371	D	72.6	Confident	78.8	Confident	7 Å²	7	36.5 Å²	36.5	4%	0.037	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	-151.2	69.3	-178.3	-174.1	39	0	0	0	109.2	R24 G365 F366 G367 S368	R24-D371 IonicContact CZ-OD1 2.93Å; R24-D371 IonicContact CZ-OD2 2.75Å; R24-D371 VanDerWaalsContact CZ-OD2 3.24Å; R24-D371 IonicContact NH1-OD1 3.77Å; R24-D371 PolarHBondContact NH1-OD1 3.43Å; R24-D371 IonicContact NH1-OD2 3.5Å; R24-D371 PolarHBondContact NH1-OD2 3.33Å; R24-D371 VanDerWaalsContact NH2-CB 3.34Å; R24-D371 IonicContact NH2-OD2 2.83Å; R24-D371 PolarHBondContact NH2-OD2 3.03Å; G365-D371 VanDerWaalsContact N-CG 3.26Å; G365-D371 PolarHBondContact N-OD1 3.35Å; G365-D371 PolarHBondContact N-OD2 3.39Å; G365-D371 VanDerWaalsContact N-OD2 3.14Å; F366-D371 WeakPolarHBondContact CB-OD2 3.16Å; F366-D371 VanDerWaalsContact CD2-OD2 3.27Å; F366-D371 WeakPolarHBondContact CD2-OD2 3.48Å; F366-D371 PolarHBondContact N-OD2 3.42Å; G367-D371 WeakPolarHBondContact CA-O 3.38Å; G367-D371 PolarHBondContact N-O 3.16Å; S368-D371 PolarHBondContact N-O 3.39Å; S368-D371 CarbonylContact O-C 3.5Å; S368-D371 PolarHBondContact O-N 3.35Å; S368-D371 PolarHBondContact OG-N 3.43Å
372	P	75.8	Confident	78.3	Confident	13 Å²	13	37 Å²	37	8%	0.084	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-63.1	162	-175.8	27	-35.9	0	0	0	111.5	G365 S368 L374 D409	G365-P372 WeakPolarHBondContact CA-O 3.34Å; S368-P372 WeakPolarHBondContact O-CA 3.23Å; S368-P372 VanDerWaalsContact O-N 3.16Å; P372-L374 VanDerWaalsContact O-CD2 3.24Å; P372-L374 WeakPolarHBondContact O-CD2 3.4Å; P372-D409 HydrophobicContact CB-CB 4.01Å; P372-D409 HydrophobicContact CG-CB 3.58Å; P372-D409 WeakPolarHBondContact CG-OD2 3.28Å
373	L	85.7	Confident	77	Confident	61 Å²	61	35.8 Å²	35.8	32%	0.319	21%	0.211	S	C	.	.	P	Polyproline II helix	trans	-65.7	141.4	176.4	-64.4	-177.9	0	0	0	111	K322 G365 D409 D410	K322-L373 HydrophobicContact CB-CB 3.87Å; K322-L373 HydrophobicContact CB-CD2 4.35Å; K322-L373 HydrophobicContact CD-CB 3.86Å; K322-L373 HydrophobicContact CD-CD1 4.29Å; G365-L373 WeakPolarHBondContact O-CD2 3.23Å; L373-D409 CarbonylContact O-C 3.51Å; L373-D410 WeakPolarHBondContact CB-OD2 3.38Å; L373-D410 WeakPolarHBondContact O-CB 3.27Å; L373-D410 PolarHBondContact O-N 3.36Å
374	L	88.4	Confident	75.2	Confident	4 Å²	4	38.9 Å²	38.9	2%	0.021	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	130.5	-169.5	-51.6	-176.3	0	0	0	113.3	L318 K322 L324 F364 P372 I407 D409	L318-L374 HydrophobicContact CD1-CB 3.99Å; K322-L374 VanDerWaalsContact CB-O 3.31Å; K322-L374 WeakPolarHBondContact CB-O 3.44Å; K322-L374 WeakPolarHBondContact O-CB 3.48Å; K322-L374 PolarHBondContact O-N 2.99Å; L324-L374 HydrophobicContact CB-CD1 3.63Å; F364-L374 HydrophobicContact CB-CD1 3.82Å; P372-L374 VanDerWaalsContact O-CD2 3.24Å; P372-L374 WeakPolarHBondContact O-CD2 3.4Å; L374-I407 HydrophobicContact CB-CG2 4.45Å; L374-I407 HydrophobicContact CD1-CG2 3.66Å; L374-I407 HydrophobicContact CD2-CG2 3.27Å; L374-I407 HydrophobicContact CG-CG2 3.95Å; L374-D409 HydrophobicContact CD2-CB 4.42Å
375	S	85.9	Confident	73.2	Confident	37 Å²	37	43.3 Å²	43.3	26%	0.259	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	-43.3	178.4	64.8	0	0	0	0	111.4	L408 D409	S375-L408 PolarHBondContact N-O 3.23Å; S375-L408 WeakPolarHBondContact OG-CD2 3.45Å; S375-L408 WeakPolarHBondContact OG-CG 3.14Å; S375-L408 PolarHBondContact OG-O 3.11Å; S375-D409 PolarHBondContact OG-O 3.06Å
376	S	88.6	Confident	71	Confident	36 Å²	36	49.8 Å²	49.8	25%	0.252	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	168.8	-179.7	50	0	0	0	0	111.6	Y52 L408	Y52-S376 WeakPolarHBondContact OH-CB 3.39Å; Y52-S376 PolarHBondContact OH-O 3.37Å; Y52-S376 VanDerWaalsContact OH-O 3.12Å; Y52-S376 PolarHBondContact OH-OG 3.32Å; S376-L408 PolarHBondContact N-O 3.07Å; S376-L408 PolarHBondContact O-N 3.23Å; S376-L408 WeakPolarHBondContact OG-CB 3.3Å
377	F	92.6	Very high	69.1	Low	2 Å²	2	47.1 Å²	47.1	1%	0.009	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	162.7	168.3	77.5	-78.7	0	0	0	110.3	Y52 R286 E288 L316 L318 L324 V379 L405 A406 I407	Y52-F377 VanDerWaalsContact OH-CA 3.25Å; Y52-F377 WeakPolarHBondContact OH-CA 3.5Å; Y52-F377 PolarHBondContact OH-N 2.81Å; Y52-F377 VanDerWaalsContact OH-N 3.14Å; R286-F377 HydrophobicContact CB-CD1 4.45Å; R286-F377 HydrophobicContact CB-CE1 3.88Å; R286-F377 VanDerWaalsContact CD-O 3.3Å; R286-F377 WeakPolarHBondContact CD-O 3.43Å; R286-F377 HydrophobicContact CG-CE1 3.94Å; R286-F377 HydrophobicContact CG-CZ 4.32Å; R286-F377 PolarHBondContact NE-O 3.38Å; E288-F377 HydrophobicContact CB-CE2 3.85Å; E288-F377 HydrophobicContact CB-CZ 4.08Å; E288-F377 HydrophobicContact CG-CE2 3.8Å; E288-F377 HydrophobicContact CG-CZ 3.9Å; E288-F377 VanDerWaalsContact OE2-CE2 3.27Å; E288-F377 WeakPolarHBondContact OE2-CE2 3.4Å; L316-F377 HydrophobicContact CB-CE2 3.71Å; L316-F377 HydrophobicContact CB-CZ 3.85Å; L316-F377 HydrophobicContact CD1-CE2 4.14Å; L316-F377 HydrophobicContact CG-CE2 4.5Å; L318-F377 HydrophobicContact CB-CD1 3.63Å; L318-F377 HydrophobicContact CB-CE1 3.58Å; L318-F377 HydrophobicContact CD2-CD1 4.17Å; L324-F377 HydrophobicContact CD1-CD1 3.69Å; L324-F377 HydrophobicContact CD1-CD2 4.13Å; L324-F377 HydrophobicContact CD1-CE1 3.63Å; L324-F377 HydrophobicContact CD1-CE2 4.08Å; L324-F377 HydrophobicContact CD1-CG 3.94Å; L324-F377 HydrophobicContact CD1-CZ 3.83Å; L324-F377 HydrophobicContact CD2-CB 4Å; L324-F377 HydrophobicContact CD2-CD1 4.44Å; L324-F377 HydrophobicContact CD2-CD2 4.2Å; L324-F377 HydrophobicContact CD2-CG 3.97Å; F377-V379 HydrophobicContact CD2-CG2 4.22Å; F377-V379 HydrophobicContact CE2-CG2 4.24Å; F377-L405 HydrophobicContact CB-CD1 4.29Å; F377-L405 HydrophobicContact CD2-CD1 3.76Å; F377-L405 HydrophobicContact CG-CD1 4.45Å; F377-A406 CarbonylContact C-O 3.56Å; F377-A406 WeakPolarHBondContact CA-O 3.39Å; F377-A406 WeakPolarHBondContact CB-O 3.45Å; F377-I407 HydrophobicContact CB-CG1 4.19Å
378	S	87.7	Confident	67.3	Low	6 Å²	6	47.5 Å²	47.5	4%	0.042	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	156.7	165.5	66.9	0	0	0	0	112.1	Y52 F54 E288 A406	Y52-S378 WeakPolarHBondContact CD2-OG 3.45Å; Y52-S378 WeakPolarHBondContact CE2-OG 3.48Å; F54-S378 WeakPolarHBondContact CE2-O 3.43Å; E288-S378 WeakPolarHBondContact OE2-CA 3.38Å; S378-A406 PolarHBondContact N-O 2.93Å; S378-A406 PolarHBondContact O-N 3.3Å
379	V	87.9	Confident	65.2	Low	16 Å²	16	53.1 Å²	53.1	10%	0.097	30%	0.298	C	S	.	.			trans	-129.8	153.1	-178.2	177.3	0	0	0	0	109.1	E288 I290 L316 F377 Y382 L405	E288-V379 VanDerWaalsContact OE2-CB 3.28Å; E288-V379 WeakPolarHBondContact OE2-CB 3.33Å; E288-V379 VanDerWaalsContact OE2-CG2 3.26Å; E288-V379 WeakPolarHBondContact OE2-CG2 3.19Å; E288-V379 PolarHBondContact OE2-N 2.86Å; I290-V379 HydrophobicContact CD1-CG1 3.65Å; I290-V379 HydrophobicContact CD1-CG2 4.26Å; I290-V379 HydrophobicContact CG1-CG1 3.84Å; L316-V379 HydrophobicContact CD1-CG2 3.61Å; F377-V379 HydrophobicContact CD2-CG2 4.22Å; F377-V379 HydrophobicContact CE2-CG2 4.24Å; V379-Y382 HydrophobicContact CG1-CE2 3.59Å; V379-Y382 WeakPolarHBondContact CG1-OH 3.17Å; V379-L405 HydrophobicContact CG2-CD1 3.66Å
380	P	80.5	Confident	63.7	Low	4 Å²	4	51.1 Å²	51.1	3%	0.026	29%	0.294	C	S	.	.			trans	-53	146	169.5	-26.4	34.6	0	0	0	114.3	F54 Y382 L404	F54-P380 HydrophobicContact CB-CB 4.09Å; F54-P380 HydrophobicContact CB-CG 3.9Å; F54-P380 HydrophobicContact CD1-CG 3.87Å; F54-P380 HydrophobicContact CD2-CG 4.02Å; F54-P380 HydrophobicContact CE1-CG 4.33Å; F54-P380 HydrophobicContact CE2-CG 4.44Å; F54-P380 HydrophobicContact CG-CB 4.43Å; F54-P380 HydrophobicContact CG-CG 3.7Å; P380-Y382 HydrophobicContact CB-CE1 3.79Å; P380-Y382 HydrophobicContact CG-CE1 4.49Å; P380-Y382 VanDerWaalsContact O-CD2 3.26Å; P380-Y382 WeakPolarHBondContact O-CD2 3.45Å; P380-Y382 WeakPolarHBondContact O-CE2 3.12Å; P380-L404 WeakPolarHBondContact CD-O 3.22Å
381	A	68	Low	62.2	Low	48 Å²	48	52.5 Å²	52.5	40%	0.397	30%	0.3	S	S	.	.			trans	-81.6	124	174.9	0	0	0	0	0	110.9	P56 G57	P56-A381 WeakPolarHBondContact CA-O 3.32Å; G57-A381 PolarHBondContact N-O 3.46Å
382	Y	65.2	Low	60.1	Low	35 Å²	35	55.6 Å²	55.6	14%	0.137	33%	0.334	C	S	.	.			trans	-111	63.1	-177.9	-46.4	-73.4	0	0	0	112	S228 I290 P291 C294 V379 P380 H402	S228-Y382 WeakPolarHBondContact CB-O 3.45Å; I290-Y382 HydrophobicContact CB-CE2 4.38Å; I290-Y382 HydrophobicContact CG1-CE2 4.15Å; I290-Y382 HydrophobicContact CG2-CE2 3.92Å; P291-Y382 HydrophobicContact CG-CD2 4.39Å; P291-Y382 HydrophobicContact CG-CG 4.37Å; C294-Y382 HydrophobicContact CB-CD1 4.17Å; C294-Y382 HydrophobicContact CB-CE1 3.9Å; C294-Y382 WeakPolarHBondContact SG-CD1 3.38Å; C294-Y382 VanDerWaalsContact SG-CG 3.6Å; V379-Y382 HydrophobicContact CG1-CE2 3.59Å; V379-Y382 WeakPolarHBondContact CG1-OH 3.17Å; P380-Y382 HydrophobicContact CB-CE1 3.79Å; P380-Y382 HydrophobicContact CG-CE1 4.49Å; P380-Y382 VanDerWaalsContact O-CD2 3.26Å; P380-Y382 WeakPolarHBondContact O-CD2 3.45Å; P380-Y382 WeakPolarHBondContact O-CE2 3.12Å; Y382-H402 HydrophobicContact CE1-CB 4.32Å; Y382-H402 WeakPolarHBondContact CE1-O 3.24Å; Y382-H402 VanDerWaalsContact CZ-O 3.3Å; Y382-H402 PolarHBondContact OH-O 2.69Å
383	G	49.9	Very low	57.8	Low	21 Å²	21	63.8 Å²	63.8	22%	0.216	37%	0.368	C	S	.	.	S	Bend	trans	-109.2	-11.6	-175.6	0	0	0	0	0	116.9	P183	P183-G383 VanDerWaalsContact CB-O 3.22Å; P183-G383 WeakPolarHBondContact CB-O 3.49Å
384	I	45	Very low	55	Low	87 Å²	87	69.6 Å²	69.6	45%	0.446	39%	0.394	S	S	.	.	S	Bend	trans	-129.6	-29.7	-162.7	-56.8	172.3	0	0	0	113.8	P139 D386	P139-I384 HydrophobicContact CB-CD1 4.04Å; P139-I384 HydrophobicContact CB-CG1 4.12Å; P139-I384 VanDerWaalsContact O-CD1 3.24Å; P139-I384 WeakPolarHBondContact O-CD1 3.43Å; I384-D386 PolarHBondContact O-N 3.09Å; I384-D386 VanDerWaalsContact O-N 3.1Å
385	L	38.3	Very low	52.3	Low	97 Å²	97	78.5 Å²	78.5	51%	0.508	43%	0.427	S	S	.	.			trans	-76.3	101.5	-175	-73.4	167.1	0	0	0	111.8	L387	L385-L387 HydrophobicContact CB-CD2 4.47Å; L385-L387 HydrophobicContact CB-CG 4.29Å; L385-L387 PolarHBondContact O-N 3.01Å
386	D	34.1	Very low	49.5	Very low	135 Å²	135	83 Å²	83	72%	0.722	45%	0.448	S	S	*	.			trans	-74.2	100.1	165.4	-152.9	-3.6	0	0	0	109	I384 S388	I384-D386 PolarHBondContact O-N 3.09Å; I384-D386 VanDerWaalsContact O-N 3.1Å; D386-S388 PolarHBondContact O-N 2.98Å
387	L	38.2	Very low	46.9	Very low	47 Å²	47	91.8 Å²	91.8	25%	0.246	48%	0.482	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	13.7	-164.1	-77.9	160.1	0	0	0	114.3	L385 Q391	L385-L387 HydrophobicContact CB-CD2 4.47Å; L385-L387 HydrophobicContact CB-CG 4.29Å; L385-L387 PolarHBondContact O-N 3.01Å; L387-Q391 PolarHBondContact O-NE2 3.04Å
388	S	35.1	Very low	44.5	Very low	55 Å²	55	95.8 Å²	95.8	39%	0.385	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-51.4	169.8	50.6	0	0	0	0	111.5	D386 C390 Q391	D386-S388 PolarHBondContact O-N 2.98Å; S388-C390 VanDerWaalsContact C-N 3.29Å; S388-C390 PolarHBondContact O-N 3.5Å; S388-Q391 WeakPolarHBondContact O-CB 3.27Å; S388-Q391 WeakPolarHBondContact O-CG 3.45Å; S388-Q391 PolarHBondContact O-N 2.92Å; S388-Q391 VanDerWaalsContact O-N 3.09Å
389	D	27.5	Very low	42.7	Very low	142 Å²	142	98.9 Å²	98.9	76%	0.759	52%	0.523	S	S	*	.	G	3₁₀ helix	trans	-77.1	-21.2	-163	-72	26.5	0	0	0	112.1	Q391	D389-Q391 PolarHBondContact O-N 2.88Å
390	C	29.8	Very low	41.4	Very low	85 Å²	85	99.6 Å²	99.6	57%	0.574	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-72	-8.2	172.3	-61.1	0	0	0	0	114.1	S388 G392	S388-C390 VanDerWaalsContact C-N 3.29Å; S388-C390 PolarHBondContact O-N 3.5Å; C390-G392 VanDerWaalsContact C-N 3.29Å; C390-G392 PolarHBondContact O-N 2.91Å
391	Q	30.6	Very low	40.4	Very low	164 Å²	164	100 Å²	100	77%	0.766	53%	0.529	S	S	*	.	G	3₁₀ helix	trans	-76	-15.5	179.2	-60.9	-176.3	29.3	0	0	113.4	L387 S388 D389 K393	L387-Q391 PolarHBondContact O-NE2 3.04Å; S388-Q391 WeakPolarHBondContact O-CB 3.27Å; S388-Q391 WeakPolarHBondContact O-CG 3.45Å; S388-Q391 PolarHBondContact O-N 2.92Å; S388-Q391 VanDerWaalsContact O-N 3.09Å; D389-Q391 PolarHBondContact O-N 2.88Å; Q391-K393 PolarHBondContact O-N 3.47Å
392	G	26.7	Very low	40.3	Very low	72 Å²	72	100.2 Å²	100.2	74%	0.742	52%	0.521	S	S	*	.	G	3₁₀ helix	trans	-82.7	-2.4	-170.5	0	0	0	0	0	117.6	C390	C390-G392 VanDerWaalsContact C-N 3.29Å; C390-G392 PolarHBondContact O-N 2.91Å
393	K	28.4	Very low	40.7	Very low	185 Å²	185	98.5 Å²	98.5	80%	0.804	52%	0.515	S	S	*	.	S	Bend	trans	-125.5	139.2	-178.3	-70	-179.2	-177.6	172.5	0	111.7	Q391 R395	Q391-K393 PolarHBondContact O-N 3.47Å; K393-R395 PolarHBondContact O-N 3.34Å; K393-R395 VanDerWaalsContact O-N 3.13Å
394	Q	27.6	Very low	42.3	Very low	183 Å²	183	97.6 Å²	97.6	86%	0.855	51%	0.505	S	S	*	.			trans	-53.4	116.9	-175.3	-69.8	179.3	-16.4	0	0	111.6	N396	Q394-N396 VanDerWaalsContact C-N 3.26Å; Q394-N396 PolarHBondContact O-N 3.19Å
395	R	30.4	Very low	44.2	Very low	191 Å²	191	93.4 Å²	93.4	72%	0.721	48%	0.484	S	S	*	.			trans	-68.4	85.2	167.6	-82.9	-176.6	166.8	-172.5	-5.4	110	K393	K393-R395 PolarHBondContact O-N 3.34Å; K393-R395 VanDerWaalsContact O-N 3.13Å
396	N	26.8	Very low	46.6	Very low	131 Å²	131	88.8 Å²	88.8	70%	0.701	46%	0.459	S	S	*	.			trans	-50.4	159.4	143.3	-76.8	-30.8	0	0	0	109	Q394 S398	Q394-N396 VanDerWaalsContact C-N 3.26Å; Q394-N396 PolarHBondContact O-N 3.19Å; N396-S398 PolarHBondContact O-N 2.8Å
397	K	34.2	Very low	49.3	Very low	221 Å²	221	82.6 Å²	82.6	96%	0.961	43%	0.426	S	S	*	.	S	Bend	trans	-70.3	64.2	-175.6	-66	-177.5	177.6	-179.9	0	112.9
398	S	41.9	Very low	51.7	Low	87 Å²	87	81.1 Å²	81.1	61%	0.608	42%	0.418	S	S	*	.			trans	-72.3	130.2	176.3	55.5	0	0	0	0	110.7	N396 N400	N396-S398 PolarHBondContact O-N 2.8Å; S398-N400 PolarHBondContact O-N 2.9Å
399	F	50.2	Low	54	Low	71 Å²	71	78.6 Å²	78.6	31%	0.311	40%	0.401	S	S	.	.			trans	-53.8	123.1	173.7	-173.4	-107.2	0	0	0	111.1	F15 I27 F75 C401 L404	F15-F399 HydrophobicContact CE2-CZ 4.18Å; F15-F399 HydrophobicContact CZ-CZ 4.19Å; I27-F399 HydrophobicContact CD1-CE2 4.05Å; I27-F399 HydrophobicContact CD1-CZ 3.57Å; I27-F399 HydrophobicContact CG2-CE2 4.06Å; I27-F399 HydrophobicContact CG2-CZ 4.09Å; F75-F399 HydrophobicContact CB-CD1 4.18Å; F75-F399 HydrophobicContact CB-CE1 3.98Å; F75-F399 HydrophobicContact CD1-CE1 4.24Å; F75-F399 HydrophobicContact CG-CE1 4.24Å; F399-C401 VanDerWaalsContact C-N 3.33Å; F399-C401 PolarHBondContact O-N 3.21Å; F399-C401 PolarHBondContact O-SG 3.35Å; F399-L404 HydrophobicContact CE1-CD1 4.09Å; F399-L404 HydrophobicContact CE1-CD2 3.98Å; F399-L404 HydrophobicContact CZ-CD2 4.04Å
400	N	60.9	Low	56.5	Low	30 Å²	30	74.8 Å²	74.8	16%	0.16	38%	0.38	C	S	.	.			trans	-77.7	81	-174.6	-169.4	47.4	0	0	0	111.3	C294 S398 H402 S403	C294-N400 PolarHBondContact O-ND2 2.86Å; S398-N400 PolarHBondContact O-N 2.9Å; N400-H402 PolarHBondContact O-N 3.02Å; N400-S403 WeakPolarHBondContact ND2-CB 3.25Å; N400-S403 PolarHBondContact ND2-OG 3.3Å; N400-S403 PolarHBondContact O-N 3.19Å; N400-S403 VanDerWaalsContact O-N 3.16Å; N400-S403 PolarHBondContact O-OG 2.62Å
401	C	58.9	Low	58.8	Low	12 Å²	12	75.8 Å²	75.8	8%	0.081	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-57.3	-22.1	178.8	-57.4	0	0	0	0	112.8	F399 S403 L404	F399-C401 VanDerWaalsContact C-N 3.33Å; F399-C401 PolarHBondContact O-N 3.21Å; F399-C401 PolarHBondContact O-SG 3.35Å; C401-S403 VanDerWaalsContact C-N 3.32Å; C401-S403 PolarHBondContact O-N 3.06Å; C401-L404 HydrophobicContact CB-CD1 4.31Å; C401-L404 WeakPolarHBondContact O-CG 3.36Å; C401-L404 PolarHBondContact O-N 3.33Å
402	H	66.8	Low	61.1	Low	53 Å²	53	68.4 Å²	68.4	25%	0.245	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-74.9	-10.2	-179.1	-52	-37.8	0	0	0	115	G57 C294 Y382 N400	G57-H402 PolarHBondContact O-ND1 2.86Å; C294-H402 HydrophobicContact CB-CB 4.08Å; Y382-H402 HydrophobicContact CE1-CB 4.32Å; Y382-H402 WeakPolarHBondContact CE1-O 3.24Å; Y382-H402 VanDerWaalsContact CZ-O 3.3Å; Y382-H402 PolarHBondContact OH-O 2.69Å; N400-H402 PolarHBondContact O-N 3.02Å
403	S	73	Confident	63.7	Low	0 Å²	0	66.7 Å²	66.7	0%	0	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-109.5	11.9	175.5	51	0	0	0	0	113.6	N400 C401 D418 L419	N400-S403 WeakPolarHBondContact ND2-CB 3.25Å; N400-S403 PolarHBondContact ND2-OG 3.3Å; N400-S403 PolarHBondContact O-N 3.19Å; N400-S403 VanDerWaalsContact O-N 3.16Å; N400-S403 PolarHBondContact O-OG 2.62Å; C401-S403 VanDerWaalsContact C-N 3.32Å; C401-S403 PolarHBondContact O-N 3.06Å; S403-D418 WeakPolarHBondContact CB-OD1 3.48Å; S403-D418 PolarHBondContact OG-OD1 2.76Å; S403-L419 WeakPolarHBondContact O-CB 3.45Å; S403-L419 PolarHBondContact O-N 2.88Å
404	L	83	Confident	66.4	Low	1 Å²	1	57.9 Å²	57.9	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	142	178.7	-61.4	178.6	0	0	0	112.6	I27 F54 F75 P380 F399 C401 I416 N417	I27-L404 HydrophobicContact CD1-CD2 3.37Å; F54-L404 HydrophobicContact CE1-CB 3.82Å; F54-L404 HydrophobicContact CE1-CD1 4.08Å; F54-L404 HydrophobicContact CZ-CB 3.78Å; F75-L404 HydrophobicContact CD1-CD1 4.47Å; F75-L404 HydrophobicContact CD2-CD1 3.64Å; F75-L404 HydrophobicContact CE2-CD1 3.73Å; F75-L404 HydrophobicContact CG-CD1 4.05Å; F75-L404 HydrophobicContact CZ-CD1 4.19Å; P380-L404 WeakPolarHBondContact CD-O 3.22Å; F399-L404 HydrophobicContact CE1-CD1 4.09Å; F399-L404 HydrophobicContact CE1-CD2 3.98Å; F399-L404 HydrophobicContact CZ-CD2 4.04Å; C401-L404 HydrophobicContact CB-CD1 4.31Å; C401-L404 WeakPolarHBondContact O-CG 3.36Å; C401-L404 PolarHBondContact O-N 3.33Å; L404-I416 HydrophobicContact CD2-CG2 4.14Å; L404-N417 WeakPolarHBondContact CA-O 3.5Å
405	L	86.8	Confident	69.2	Low	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	121.3	178.8	165.9	60.6	0	0	0	108.5	L316 L324 F364 F377 V379 I407 I416 N417 L419	L316-L405 HydrophobicContact CD1-CD1 4.34Å; L324-L405 HydrophobicContact CD2-CD1 4.1Å; L324-L405 HydrophobicContact CD2-CD2 3.94Å; L324-L405 HydrophobicContact CD2-CG 4.49Å; F364-L405 HydrophobicContact CE2-CD2 4.4Å; F377-L405 HydrophobicContact CB-CD1 4.29Å; F377-L405 HydrophobicContact CD2-CD1 3.76Å; F377-L405 HydrophobicContact CG-CD1 4.45Å; V379-L405 HydrophobicContact CG2-CD1 3.66Å; L405-I407 HydrophobicContact CD1-CG1 4.14Å; L405-I407 HydrophobicContact CD2-CD1 3.84Å; L405-I407 HydrophobicContact CD2-CG1 4.36Å; L405-I407 HydrophobicContact CG-CD1 3.83Å; L405-I407 HydrophobicContact CG-CG1 3.92Å; L405-I416 WeakPolarHBondContact O-CA 3.45Å; L405-N417 PolarHBondContact N-O 2.8Å; L405-N417 PolarHBondContact O-N 3.22Å; L405-L419 HydrophobicContact CB-CD1 4.19Å; L405-L419 HydrophobicContact CB-CG 4.11Å; L405-L419 HydrophobicContact CD2-CD1 4.36Å; L405-L419 HydrophobicContact CD2-CD2 3.77Å; L405-L419 HydrophobicContact CD2-CG 4.16Å
406	A	88.4	Confident	71.8	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	127	178.3	0	0	0	0	0	109.7	Y52 F54 L61 F377 S378 L414 H415	Y52-A406 HydrophobicContact CD2-CB 3.99Å; Y52-A406 HydrophobicContact CE2-CB 3.98Å; F54-A406 HydrophobicContact CD2-CB 4.3Å; F54-A406 HydrophobicContact CE2-CB 3.35Å; F54-A406 HydrophobicContact CZ-CB 3.73Å; L61-A406 HydrophobicContact CD1-CB 4.35Å; L61-A406 HydrophobicContact CD2-CB 4.26Å; F377-A406 CarbonylContact C-O 3.56Å; F377-A406 WeakPolarHBondContact CA-O 3.39Å; F377-A406 WeakPolarHBondContact CB-O 3.45Å; S378-A406 PolarHBondContact N-O 2.93Å; S378-A406 PolarHBondContact O-N 3.3Å; A406-L414 HydrophobicContact CB-CD1 4.13Å; A406-H415 CarbonylContact C-O 3.55Å; A406-H415 WeakPolarHBondContact CA-O 3.38Å
407	I	89.8	Confident	74.5	Confident	4 Å²	4	34.9 Å²	34.9	2%	0.021	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	121.5	-172	-72.4	161.1	0	0	0	108.3	L324 F364 L374 F377 L405 L414 H415	L324-I407 HydrophobicContact CD2-CD1 4Å; L324-I407 HydrophobicContact CD2-CG1 3.97Å; F364-I407 HydrophobicContact CG-CD1 4.4Å; L374-I407 HydrophobicContact CB-CG2 4.45Å; L374-I407 HydrophobicContact CD1-CG2 3.66Å; L374-I407 HydrophobicContact CD2-CG2 3.27Å; L374-I407 HydrophobicContact CG-CG2 3.95Å; F377-I407 HydrophobicContact CB-CG1 4.19Å; L405-I407 HydrophobicContact CD1-CG1 4.14Å; L405-I407 HydrophobicContact CD2-CD1 3.84Å; L405-I407 HydrophobicContact CD2-CG1 4.36Å; L405-I407 HydrophobicContact CG-CD1 3.83Å; L405-I407 HydrophobicContact CG-CG1 3.92Å; I407-L414 CarbonylContact O-C 3.43Å; I407-L414 WeakPolarHBondContact O-CA 3.49Å; I407-H415 PolarHBondContact N-O 3.31Å; I407-H415 PolarHBondContact O-N 3.13Å
408	L	88.5	Confident	76.7	Confident	16 Å²	16	25.4 Å²	25.4	8%	0.084	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	126.7	171.4	-170.7	72	0	0	0	109.1	I49 Y52 S375 S376 L413 L414	I49-L408 HydrophobicContact CB-CD1 4.01Å; I49-L408 HydrophobicContact CG2-CD1 4.33Å; Y52-L408 HydrophobicContact CE1-CB 3.69Å; Y52-L408 HydrophobicContact CE1-CD2 4.01Å; Y52-L408 HydrophobicContact CE1-CG 4.35Å; Y52-L408 WeakPolarHBondContact OH-CB 3.34Å; Y52-L408 PolarHBondContact OH-N 2.9Å; S375-L408 PolarHBondContact N-O 3.23Å; S375-L408 WeakPolarHBondContact OG-CD2 3.45Å; S375-L408 WeakPolarHBondContact OG-CG 3.14Å; S375-L408 PolarHBondContact OG-O 3.11Å; S376-L408 PolarHBondContact N-O 3.07Å; S376-L408 PolarHBondContact O-N 3.23Å; S376-L408 WeakPolarHBondContact OG-CB 3.3Å; L408-L413 WeakPolarHBondContact CA-O 3.36Å; L408-L414 HydrophobicContact CB-CD1 4.26Å; L408-L414 HydrophobicContact CD1-CB 4.15Å; L408-L414 HydrophobicContact CD1-CD1 4.46Å
409	D	84.7	Confident	78.3	Confident	3 Å²	3	21.3 Å²	21.3	2%	0.016	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	178.8	176.4	82.1	-8.6	0	0	0	112.9	P372 L373 L374 S375 H411 G412 L413 H415	P372-D409 HydrophobicContact CB-CB 4.01Å; P372-D409 HydrophobicContact CG-CB 3.58Å; P372-D409 WeakPolarHBondContact CG-OD2 3.28Å; L373-D409 CarbonylContact O-C 3.51Å; L374-D409 HydrophobicContact CD2-CB 4.42Å; S375-D409 PolarHBondContact OG-O 3.06Å; D409-H411 VanDerWaalsContact C-N 3.26Å; D409-H411 WeakPolarHBondContact OD1-CA 3.19Å; D409-H411 WeakPolarHBondContact OD1-CB 3.38Å; D409-H411 PolarHBondContact OD1-N 2.89Å; D409-H411 WeakPolarHBondContact OD2-CB 3.4Å; D409-H411 IonicContact OD2-CD2 3.71Å; D409-H411 PolarHBondContact OD2-CD2 3.3Å; D409-H411 IonicContact OD2-CG 3.22Å; D409-G412 PolarHBondContact OD1-N 3.18Å; D409-L413 PolarHBondContact N-O 2.87Å; D409-L413 PolarHBondContact OD1-N 2.85Å; D409-H415 IonicContact OD2-NE2 2.65Å
410	D	79.2	Confident	79.2	Confident	61 Å²	61	18.3 Å²	18.3	33%	0.326	10%	0.096	S	C	.	.	S	Bend	trans	-72.2	-13.4	173.8	-91.8	-14.2	0	0	0	114	K322 L373	K322-D410 VanDerWaalsContact CD-OD2 3.23Å; K322-D410 WeakPolarHBondContact CD-OD2 3.35Å; K322-D410 WeakPolarHBondContact CE-OD2 3.24Å; K322-D410 IonicContact NZ-OD1 3.13Å; K322-D410 PolarHBondContact NZ-OD1 2.94Å; K322-D410 IonicContact NZ-OD2 3.61Å; K322-D410 PolarHBondContact NZ-OD2 2.87Å; L373-D410 WeakPolarHBondContact CB-OD2 3.38Å; L373-D410 WeakPolarHBondContact O-CB 3.27Å; L373-D410 PolarHBondContact O-N 3.36Å
411	H	78.3	Confident	79.5	Confident	106 Å²	106	18.5 Å²	18.5	49%	0.491	10%	0.096	S	C	.	.	S	Bend	trans	-88.6	-19.6	176.8	-56.4	-53.4	0	0	0	112.1	I45 Q48 D409 L413	I45-H411 WeakPolarHBondContact CD1-O 3.39Å; Q48-H411 PolarHBondContact NE2-O 3.29Å; D409-H411 VanDerWaalsContact C-N 3.26Å; D409-H411 WeakPolarHBondContact OD1-CA 3.19Å; D409-H411 WeakPolarHBondContact OD1-CB 3.38Å; D409-H411 PolarHBondContact OD1-N 2.89Å; D409-H411 WeakPolarHBondContact OD2-CB 3.4Å; D409-H411 IonicContact OD2-CD2 3.71Å; D409-H411 PolarHBondContact OD2-CD2 3.3Å; D409-H411 IonicContact OD2-CG 3.22Å; H411-L413 HydrophobicContact CB-CG 4.49Å
412	G	78	Confident	79.8	Confident	10 Å²	10	18 Å²	18	10%	0.103	9%	0.093	C	C	.	.	S	Bend	trans	98.1	16.5	-177.3	0	0	0	0	0	113.8	D409	D409-G412 PolarHBondContact OD1-N 3.18Å
413	L	81.4	Confident	79.8	Confident	36 Å²	36	15.6 Å²	15.6	19%	0.188	8%	0.082	C	C	.	.			trans	-86.6	132.5	173	-58.1	177.6	0	0	0	110.1	C31 L408 D409 H411	C31-L413 HydrophobicContact CB-CD2 3.64Å; C31-L413 VanDerWaalsContact SG-CD2 3.52Å; L408-L413 WeakPolarHBondContact CA-O 3.36Å; D409-L413 PolarHBondContact N-O 2.87Å; D409-L413 PolarHBondContact OD1-N 2.85Å; H411-L413 HydrophobicContact CB-CG 4.49Å
414	L	86.5	Confident	79.3	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	104.8	176	-177.9	66.1	0	0	0	109.4	I30 I49 Y52 L61 F63 A406 I407 L408	I30-L414 HydrophobicContact CB-CB 4.24Å; I30-L414 HydrophobicContact CD1-CB 4.41Å; I30-L414 HydrophobicContact CD1-CD2 4.06Å; I30-L414 HydrophobicContact CD1-CG 4.3Å; I30-L414 PolarHBondContact N-O 2.89Å; I30-L414 PolarHBondContact O-N 3.05Å; I49-L414 HydrophobicContact CD1-CB 3.42Å; I49-L414 VanDerWaalsContact CD1-CB 3.42Å; I49-L414 HydrophobicContact CD1-CD2 4.09Å; I49-L414 HydrophobicContact CD1-CG 4.4Å; I49-L414 HydrophobicContact CG2-CD2 4.48Å; Y52-L414 HydrophobicContact CD1-CD1 4.1Å; Y52-L414 HydrophobicContact CD2-CD1 3.66Å; Y52-L414 HydrophobicContact CD2-CD2 4.3Å; Y52-L414 HydrophobicContact CE1-CD1 4.1Å; Y52-L414 HydrophobicContact CE2-CD1 3.63Å; Y52-L414 HydrophobicContact CG-CD1 3.91Å; Y52-L414 HydrophobicContact CG-CD2 4.06Å; L61-L414 HydrophobicContact CD2-CD2 4.22Å; F63-L414 HydrophobicContact CB-CD2 4.12Å; F63-L414 HydrophobicContact CG-CD2 4.37Å; A406-L414 HydrophobicContact CB-CD1 4.13Å; I407-L414 CarbonylContact O-C 3.43Å; I407-L414 WeakPolarHBondContact O-CA 3.49Å; L408-L414 HydrophobicContact CB-CD1 4.26Å; L408-L414 HydrophobicContact CD1-CB 4.15Å; L408-L414 HydrophobicContact CD1-CD1 4.46Å
415	H	85.2	Confident	78.1	Confident	13 Å²	13	23.8 Å²	23.8	6%	0.06	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	139	177.2	-60	-100.9	0	0	0	110	E26 A406 I407 D409	E26-H415 IonicContact OE1-CE1 3.83Å; E26-H415 IonicContact OE1-CG 3.54Å; E26-H415 IonicContact OE1-ND1 2.67Å; E26-H415 PolarHBondContact OE1-ND1 2.98Å; A406-H415 CarbonylContact C-O 3.55Å; A406-H415 WeakPolarHBondContact CA-O 3.38Å; I407-H415 PolarHBondContact N-O 3.31Å; I407-H415 PolarHBondContact O-N 3.13Å; D409-H415 IonicContact OD2-NE2 2.65Å
416	I	86.1	Confident	76.6	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	118	175.5	-63.1	155.4	0	0	0	107.5	I27 L28 I30 L61 L73 F75 L404 L405	I27-I416 HydrophobicContact CD1-CG2 4.29Å; I27-I416 WeakPolarHBondContact CG1-O 3.45Å; I27-I416 PolarHBondContact N-O 2.99Å; L28-I416 HydrophobicContact CB-CB 4.49Å; L28-I416 HydrophobicContact CB-CD1 4.34Å; L28-I416 HydrophobicContact CD2-CD1 4.1Å; L28-I416 PolarHBondContact N-O 3.45Å; L28-I416 PolarHBondContact O-N 3.42Å; I30-I416 HydrophobicContact CD1-CD1 3.64Å; I30-I416 HydrophobicContact CD1-CG1 4.5Å; I30-I416 HydrophobicContact CG1-CD1 4.49Å; L61-I416 HydrophobicContact CD2-CD1 3.69Å; L61-I416 HydrophobicContact CD2-CG1 3.93Å; L73-I416 HydrophobicContact CD1-CD1 4.35Å; F75-I416 HydrophobicContact CE1-CD1 4.02Å; F75-I416 HydrophobicContact CE1-CG2 4.42Å; F75-I416 HydrophobicContact CZ-CD1 3.91Å; F75-I416 HydrophobicContact CZ-CG2 4.35Å; L404-I416 HydrophobicContact CD2-CG2 4.14Å; L405-I416 WeakPolarHBondContact O-CA 3.45Å
417	N	82.8	Confident	74.6	Confident	9 Å²	9	31.6 Å²	31.6	5%	0.048	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	142.9	-175.9	-61	-4.4	0	0	0	110.6	G25 E26 F364 L404 L405	G25-N417 CarbonylContact O-C 3.59Å; G25-N417 VanDerWaalsContact O-CA 3.32Å; G25-N417 WeakPolarHBondContact O-CA 3.46Å; E26-N417 VanDerWaalsContact CA-OD1 3.29Å; E26-N417 WeakPolarHBondContact CA-OD1 3.35Å; F364-N417 WeakPolarHBondContact CE1-ND2 3.33Å; L404-N417 WeakPolarHBondContact CA-O 3.5Å; L405-N417 PolarHBondContact N-O 2.8Å; L405-N417 PolarHBondContact O-N 3.22Å
418	D	79.9	Confident	72.3	Confident	22 Å²	22	35.2 Å²	35.2	12%	0.118	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	116.3	168.1	-179	7.9	0	0	0	110.7	G25 I27 S403 S420 I421 V422	G25-D418 PolarHBondContact O-N 3.34Å; I27-D418 HydrophobicContact CD1-CB 3.81Å; I27-D418 HydrophobicContact CG1-CB 4.21Å; S403-D418 WeakPolarHBondContact CB-OD1 3.48Å; S403-D418 PolarHBondContact OG-OD1 2.76Å; D418-S420 VanDerWaalsContact C-N 3.31Å; D418-S420 PolarHBondContact O-N 2.81Å; D418-S420 WeakPolarHBondContact OD1-CB 3.5Å; D418-S420 PolarHBondContact OD1-N 3.03Å; D418-I421 HydrophobicContact CB-CD1 4.1Å; D418-I421 HydrophobicContact CB-CG1 4.2Å; D418-I421 PolarHBondContact O-N 2.98Å; D418-V422 WeakPolarHBondContact O-CG2 3.46Å; D418-V422 PolarHBondContact O-N 2.96Å
419	L	76.1	Confident	69.7	Low	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-66.2	-27.3	176	-72	172.3	0	0	0	113.6	I290 L295 L316 L326 S403 L405 I421 V422 L423	I290-L419 HydrophobicContact CD1-CD1 3.37Å; L295-L419 HydrophobicContact CD2-CB 4.45Å; L316-L419 HydrophobicContact CD1-CD1 4.45Å; L326-L419 HydrophobicContact CD2-CD2 3.85Å; S403-L419 WeakPolarHBondContact O-CB 3.45Å; S403-L419 PolarHBondContact O-N 2.88Å; L405-L419 HydrophobicContact CB-CD1 4.19Å; L405-L419 HydrophobicContact CB-CG 4.11Å; L405-L419 HydrophobicContact CD2-CD1 4.36Å; L405-L419 HydrophobicContact CD2-CD2 3.77Å; L405-L419 HydrophobicContact CD2-CG 4.16Å; L419-I421 VanDerWaalsContact C-N 3.35Å; L419-V422 PolarHBondContact O-N 3.45Å; L419-L423 WeakPolarHBondContact O-CG 3.23Å; L419-L423 PolarHBondContact O-N 2.85Å
420	S	69.1	Low	67.7	Low	9 Å²	9	45.5 Å²	45.5	6%	0.063	26%	0.262	C	S	.	.	H	α-helix	trans	-66.8	-36.8	176.6	-81.6	0	0	0	0	111.7	V296 D418 N424	V296-S420 PolarHBondContact N-OG 2.84Å; V296-S420 PolarHBondContact O-OG 2.83Å; D418-S420 VanDerWaalsContact C-N 3.31Å; D418-S420 PolarHBondContact O-N 2.81Å; D418-S420 WeakPolarHBondContact OD1-CB 3.5Å; D418-S420 PolarHBondContact OD1-N 3.03Å; S420-N424 VanDerWaalsContact O-CG 3.31Å; S420-N424 PolarHBondContact O-N 3.13Å; S420-N424 PolarHBondContact O-ND2 3.36Å
421	I	67	Low	66.2	Low	33 Å²	33	44.5 Å²	44.5	17%	0.169	26%	0.256	C	S	.	.	H	α-helix	trans	-64.6	-42.8	171.8	-63.9	174.5	0	0	0	110.7	N22 D418 L419 L423 N424 F425	N22-I421 WeakPolarHBondContact O-CG2 3.41Å; D418-I421 HydrophobicContact CB-CD1 4.1Å; D418-I421 HydrophobicContact CB-CG1 4.2Å; D418-I421 PolarHBondContact O-N 2.98Å; L419-I421 VanDerWaalsContact C-N 3.35Å; I421-L423 PolarHBondContact O-N 3.03Å; I421-N424 PolarHBondContact O-N 3.12Å; I421-F425 HydrophobicContact CG2-CD2 4.36Å; I421-F425 HydrophobicContact CG2-CE2 3.89Å; I421-F425 VanDerWaalsContact O-CD2 3.28Å; I421-F425 WeakPolarHBondContact O-CD2 3.45Å
422	V	66	Low	64.8	Low	2 Å²	2	43.5 Å²	43.5	1%	0.012	26%	0.259	C	S	.	.	H	α-helix	trans	-62.3	-44	180	178.2	0	0	0	0	111.5	R24 F362 F364 D418 L419 N424 F425	R24-V422 VanDerWaalsContact O-CG2 3.28Å; R24-V422 WeakPolarHBondContact O-CG2 3.37Å; F362-V422 HydrophobicContact CB-CG1 4.29Å; F362-V422 HydrophobicContact CD1-CG1 3.98Å; F362-V422 HydrophobicContact CD2-CG1 4.14Å; F362-V422 HydrophobicContact CE1-CG1 4.39Å; F362-V422 HydrophobicContact CG-CG1 3.86Å; F364-V422 HydrophobicContact CZ-CG1 4.42Å; F364-V422 HydrophobicContact CZ-CG2 3.88Å; D418-V422 WeakPolarHBondContact O-CG2 3.46Å; D418-V422 PolarHBondContact O-N 2.96Å; L419-V422 PolarHBondContact O-N 3.45Å; V422-N424 VanDerWaalsContact C-N 3.33Å; V422-N424 PolarHBondContact O-N 2.88Å; V422-F425 PolarHBondContact O-N 3.33Å
423	L	65.9	Low	63.3	Low	3 Å²	3	46.9 Å²	46.9	2%	0.016	28%	0.278	C	S	.	.	H	α-helix	trans	-61.1	-42.1	178.6	-71.1	172.7	0	0	0	111.6	L295 F298 F301 L361 L419 I421 F425 L426	L295-L423 HydrophobicContact CB-CD1 4.38Å; L295-L423 HydrophobicContact CD1-CD1 4.45Å; L295-L423 HydrophobicContact CD2-CD1 4.28Å; F298-L423 HydrophobicContact CD2-CD1 4.15Å; F301-L423 HydrophobicContact CE2-CB 4.26Å; F301-L423 WeakPolarHBondContact CZ-O 3.5Å; L361-L423 HydrophobicContact CD1-CD2 3.82Å; L419-L423 WeakPolarHBondContact O-CG 3.23Å; L419-L423 PolarHBondContact O-N 2.85Å; I421-L423 PolarHBondContact O-N 3.03Å; L423-F425 PolarHBondContact O-N 3.19Å; L423-L426 HydrophobicContact CD2-CD1 3.83Å; L423-L426 WeakPolarHBondContact O-CB 3.15Å; L423-L426 PolarHBondContact O-N 2.84Å
424	N	63.3	Low	61.8	Low	75 Å²	75	45.9 Å²	45.9	40%	0.401	27%	0.272	S	S	.	.	H	α-helix	trans	-63.3	-12.9	-176.6	-74.5	-9.3	0	0	0	115	D297 S420 I421 V422	D297-N424 PolarHBondContact OD2-ND2 3.23Å; S420-N424 VanDerWaalsContact O-CG 3.31Å; S420-N424 PolarHBondContact O-N 3.13Å; S420-N424 PolarHBondContact O-ND2 3.36Å; I421-N424 PolarHBondContact O-N 3.12Å; V422-N424 VanDerWaalsContact C-N 3.33Å; V422-N424 PolarHBondContact O-N 2.88Å
425	F	57.4	Low	59.8	Low	97 Å²	97	54.3 Å²	54.3	43%	0.425	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-3.7	174.5	-74.2	-69.7	0	0	0	115.2	L23 I421 V422 L423 N427	L23-F425 HydrophobicContact CD2-CD1 3.64Å; L23-F425 HydrophobicContact CD2-CD2 4.26Å; L23-F425 HydrophobicContact CD2-CE1 3.55Å; L23-F425 HydrophobicContact CD2-CE2 4.19Å; L23-F425 HydrophobicContact CD2-CG 4.01Å; L23-F425 HydrophobicContact CD2-CZ 3.85Å; L23-F425 HydrophobicContact CG-CZ 4.39Å; I421-F425 HydrophobicContact CG2-CD2 4.36Å; I421-F425 HydrophobicContact CG2-CE2 3.89Å; I421-F425 VanDerWaalsContact O-CD2 3.28Å; I421-F425 WeakPolarHBondContact O-CD2 3.45Å; V422-F425 PolarHBondContact O-N 3.33Å; L423-F425 PolarHBondContact O-N 3.19Å; F425-N427 VanDerWaalsContact C-N 3.3Å; F425-N427 PolarHBondContact O-N 2.82Å; F425-N427 VanDerWaalsContact O-N 3.15Å
426	L	55.2	Low	57.7	Low	22 Å²	22	54.6 Å²	54.6	12%	0.115	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80	10.7	-166.8	-69.7	174	0	0	0	117.2	L361 F362 L423 S428	L361-L426 HydrophobicContact CB-CD1 3.85Å; L361-L426 HydrophobicContact CD1-CD1 3.67Å; L361-L426 HydrophobicContact CD2-CD1 4.22Å; L361-L426 HydrophobicContact CG-CD1 4.13Å; L361-L426 WeakPolarHBondContact O-CD2 3.46Å; F362-L426 HydrophobicContact CB-CD2 4.49Å; F362-L426 HydrophobicContact CD2-CD2 4.12Å; L423-L426 HydrophobicContact CD2-CD1 3.83Å; L423-L426 WeakPolarHBondContact O-CB 3.15Å; L423-L426 PolarHBondContact O-N 2.84Å; L426-S428 PolarHBondContact O-N 3.17Å
427	N	45.4	Very low	55.5	Low	142 Å²	142	60.6 Å²	60.6	76%	0.759	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	6.7	178.1	-76.9	-19.3	0	0	0	114.3	F425	F425-N427 VanDerWaalsContact C-N 3.3Å; F425-N427 PolarHBondContact O-N 2.82Å; F425-N427 VanDerWaalsContact O-N 3.15Å
428	S	42.8	Very low	53.1	Low	81 Å²	81	62.8 Å²	62.8	57%	0.566	35%	0.35	S	S	*	.	S	Bend	trans	-87.1	132.8	175.2	56.4	0	0	0	0	112.5	L426 S430	L426-S428 PolarHBondContact O-N 3.17Å; S428-S430 PolarHBondContact O-N 2.88Å; S428-S430 VanDerWaalsContact O-N 3.09Å
429	S	33.6	Very low	50.7	Low	126 Å²	126	69.7 Å²	69.7	88%	0.881	38%	0.381	S	S	*	.	S	Bend	trans	-89.7	69.1	-159.8	60.4	0	0	0	0	115.2
430	S	43.3	Very low	48.3	Very low	109 Å²	109	74.7 Å²	74.7	76%	0.762	41%	0.412	S	S	*	.			trans	-158.3	70.3	169.6	59.1	0	0	0	0	113.4	S428	S428-S430 PolarHBondContact O-N 2.88Å; S428-S430 VanDerWaalsContact O-N 3.09Å
431	I	46.6	Very low	46.2	Very low	39 Å²	39	79.4 Å²	79.4	20%	0.2	45%	0.445	C	S	.	.			trans	-115.8	122.7	-172.5	-52.4	178.6	0	0	0	111	K359 C360 L361	K359-I431 HydrophobicContact CD-CG2 4.25Å; K359-I431 HydrophobicContact CG-CG2 3.75Å; C360-I431 WeakPolarHBondContact O-CG2 3.38Å; L361-I431 HydrophobicContact CD2-CD1 4.37Å
432	P	48.4	Very low	44.2	Very low	85 Å²	85	84.6 Å²	84.6	55%	0.552	47%	0.473	S	S	*	.			trans	-72.9	140.2	-175.7	26.8	-31.8	0	0	0	113.7	C360	C360-P432 HydrophobicContact CB-CG 4.26Å; C360-P432 PolarHBondContact N-O 3.48Å
433	V	47	Very low	42.2	Very low	82 Å²	82	93.1 Å²	93.1	50%	0.497	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	131.1	-175.4	170.6	0	0	0	0	110.9	Y357 K359	Y357-V433 HydrophobicContact CD2-CG1 3.5Å; Y357-V433 HydrophobicContact CD2-CG2 4.42Å; Y357-V433 HydrophobicContact CE2-CG1 4.14Å; Y357-V433 HydrophobicContact CE2-CG2 4.35Å; Y357-V433 HydrophobicContact CG-CG1 3.95Å; K359-V433 HydrophobicContact CG-CG2 4.49Å
434	I	50.3	Low	40.3	Very low	14 Å²	14	103 Å²	103	7%	0.072	56%	0.556	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.8	109.6	179.5	-52.4	175	0	0	0	108.6	I275 K276 L277 P278 L327 Y357 W358 C360	I275-I434 HydrophobicContact CG2-CG2 4.14Å; K276-I434 WeakPolarHBondContact O-CG2 3.26Å; L277-I434 HydrophobicContact CD2-CD1 4.14Å; P278-I434 HydrophobicContact CG-CD1 4.49Å; L327-I434 HydrophobicContact CD1-CD1 4.27Å; L327-I434 HydrophobicContact CD2-CD1 3.89Å; Y357-I434 WeakPolarHBondContact CA-O 3.47Å; Y357-I434 WeakPolarHBondContact CB-O 3.15Å; W358-I434 PolarHBondContact N-O 2.9Å; W358-I434 WeakPolarHBondContact O-CA 3.49Å; W358-I434 VanDerWaalsContact O-CB 3.25Å; W358-I434 WeakPolarHBondContact O-CB 3.18Å; W358-I434 PolarHBondContact O-N 2.88Å; C360-I434 HydrophobicContact CB-CD1 4.42Å
435	K	43.8	Very low	38.4	Very low	177 Å²	177	103.7 Å²	103.7	77%	0.77	57%	0.566	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-72.3	131.7	176.6	-67.8	-167.8	172.6	-165.9	0	111
436	V	41.1	Very low	36.8	Very low	20 Å²	20	104.7 Å²	104.7	12%	0.121	59%	0.585	C	S	.	*			trans	-85.5	153.3	171.9	-172.6	0	0	0	0	109.5	E273 W358 N438	E273-V436 HydrophobicContact CB-CG1 4.02Å; E273-V436 HydrophobicContact CG-CG1 4.14Å; W358-V436 VanDerWaalsContact CD1-CG2 3.43Å; V436-N438 WeakPolarHBondContact CG1-OD1 3.38Å
437	K	40.3	Very low	35.4	Very low	125 Å²	125	110.8 Å²	110.8	54%	0.543	62%	0.617	S	S	.	*	B	Isolated β-bridge	trans	-90.6	103.6	158.8	-76.9	-171.1	167.7	-161.8	0	108.9
438	N	33.3	Very low	34.3	Very low	56 Å²	56	113.5 Å²	113.5	30%	0.299	62%	0.622	S	S	.	*			trans	-92.9	113.3	168.7	-69.3	11.3	0	0	0	108.3	I356 V436 T440	I356-N438 VanDerWaalsContact CG1-ND2 3.33Å; I356-N438 WeakPolarHBondContact CG1-ND2 3.43Å; V436-N438 WeakPolarHBondContact CG1-OD1 3.38Å; N438-T440 PolarHBondContact O-N 2.56Å
439	E	28.7	Very low	33.3	Very low	167 Å²	167	116.9 Å²	116.9	78%	0.78	63%	0.628	S	S	*	*			trans	-88.5	90.2	171.6	-63.1	-149.4	172	0	0	110.6
440	T	25.3	Very low	32.9	Very low	104 Å²	104	118.4 Å²	118.4	64%	0.638	63%	0.625	S	S	*	*			trans	-92	143.3	160.5	52.3	0	0	0	0	109.6	N438	N438-T440 PolarHBondContact O-N 2.56Å
441	S	25.8	Very low	31.8	Very low	108 Å²	108	120.4 Å²	120.4	76%	0.755	62%	0.623	S	S	*	*	S	Bend	trans	-61.8	148.3	-170.5	44.6	0	0	0	0	114.8
442	N	24.4	Very low	30.6	Very low	142 Å²	142	125.7 Å²	125.7	76%	0.759	65%	0.651	S	S	*	*			trans	90.7	51.9	170.3	-54.1	-31.7	0	0	0	119.9
443	E	24.5	Very low	29.3	Very low	181 Å²	181	128.4 Å²	128.4	85%	0.846	66%	0.661	S	S	*	*			trans	-129.4	85.9	141	-76.1	-154.5	147.3	0	0	111.5	S445	E443-S445 VanDerWaalsContact C-N 3.28Å; E443-S445 PolarHBondContact O-N 2.85Å
444	K	25.7	Very low	28.1	Very low	212 Å²	212	134.2 Å²	134.2	92%	0.922	68%	0.679	S	S	*	*			trans	-82.7	62.7	176.8	-76.5	-171.1	174.5	-179.4	0	112.4
445	S	24.2	Very low	26.6	Very low	89 Å²	89	144.2 Å²	144.2	62%	0.622	72%	0.716	S	S	*	*	S	Bend	trans	-155.4	143.9	169.2	51.4	0	0	0	0	113.8	E443	E443-S445 VanDerWaalsContact C-N 3.28Å; E443-S445 PolarHBondContact O-N 2.85Å
446	S	23.5	Very low	25.7	Very low	118 Å²	118	142.6 Å²	142.6	83%	0.825	72%	0.716	S	S	*	*	S	Bend	trans	66.7	36.5	160.8	62.5	0	0	0	0	120.9
447	L	24.3	Very low	24.7	Very low	150 Å²	150	149 Å²	149	79%	0.785	75%	0.749	S	S	*	*			trans	-120.7	124.5	141.7	-89.5	164.7	0	0	0	109.4
448	K	23.1	Very low	23.9	Very low	199 Å²	199	151.3 Å²	151.3	87%	0.865	76%	0.76	S	S	*	*			trans	-87.8	141.3	-171.5	-72.6	-176.3	176.5	-179.9	0	111.6
449	H	21.4	Very low	23.4	Very low	151 Å²	151	153.8 Å²	153.8	70%	0.699	78%	0.779	S	S	*	*			trans	-53.7	136.5	179	-70.8	-151	0	0	0	112.2	E451	H449-E451 HydrophobicContact CB-CG 4.21Å; H449-E451 IonicContact CE1-OE1 2.79Å; H449-E451 PolarHBondContact CE1-OE1 3.09Å; H449-E451 IonicContact CG-OE1 3.19Å; H449-E451 IonicContact ND1-OE1 2.6Å; H449-E451 PolarHBondContact ND1-OE1 2.6Å
450	I	24.7	Very low	23.1	Very low	159 Å²	159	153.5 Å²	153.5	82%	0.815	78%	0.783	S	S	*	*			trans	-114.6	85.2	147	-61	-180	0	0	0	105.5	N452	I450-N452 PolarHBondContact O-N 3.2Å
451	E	21	Very low	23	Very low	151 Å²	151	157.8 Å²	157.8	71%	0.706	79%	0.793	S	S	*	*			trans	-66.9	128.4	173.1	-80.8	167.1	-169.4	0	0	109.6	H449	H449-E451 HydrophobicContact CB-CG 4.21Å; H449-E451 IonicContact CE1-OE1 2.79Å; H449-E451 PolarHBondContact CE1-OE1 3.09Å; H449-E451 IonicContact CG-OE1 3.19Å; H449-E451 IonicContact ND1-OE1 2.6Å; H449-E451 PolarHBondContact ND1-OE1 2.6Å
452	N	22.6	Very low	22.7	Very low	149 Å²	149	162 Å²	162	80%	0.797	80%	0.798	S	S	*	*			trans	-139.6	43.5	172.4	-125.4	-15.1	0	0	0	111.5	I450	I450-N452 PolarHBondContact O-N 3.2Å
453	N	19.7	Very low	22.5	Very low	143 Å²	143	163.1 Å²	163.1	77%	0.765	80%	0.8	S	S	*	*			trans	-154.5	77.6	169.2	-119.4	-27.6	0	0	0	113.8
454	K	21.5	Very low	22.3	Very low	203 Å²	203	164.7 Å²	164.7	88%	0.883	81%	0.805	S	S	*	*			trans	-163.1	148.2	130.4	-106.1	160.5	-169.4	179	0	111.4
455	R	19.8	Very low	22	Very low	225 Å²	225	160.4 Å²	160.4	85%	0.849	80%	0.797	S	S	*	*			trans	-73.7	144.2	173.1	-68.3	171.1	170.9	159.7	-4.7	109.7	D457	R455-D457 PolarHBondContact O-N 3.15Å; R455-D457 VanDerWaalsContact O-N 3.12Å
456	N	24.5	Very low	21.9	Very low	143 Å²	143	161.9 Å²	161.9	77%	0.765	81%	0.807	S	S	*	*			trans	27	69.7	146.1	-57.3	7.2	0	0	0	117.7
457	D	21	Very low	21.7	Very low	153 Å²	153	166.1 Å²	166.1	82%	0.818	81%	0.807	S	S	*	*			trans	-113.6	110.3	152.4	-88.2	-49.4	0	0	0	108.3	R455	R455-D457 PolarHBondContact O-N 3.15Å; R455-D457 VanDerWaalsContact O-N 3.12Å
458	F	22.1	Very low	21.6	Very low	174 Å²	174	166.7 Å²	166.7	76%	0.763	81%	0.81	S	S	*	*			trans	-71.3	127.3	-178	-72.1	-102.3	0	0	0	109.7	N460	F458-N460 PolarHBondContact O-N 2.8Å; F458-N460 VanDerWaalsContact O-N 3.09Å
459	P	23.8	Very low	21.5	Very low	109 Å²	109	165.1 Å²	165.1	71%	0.708	80%	0.804	S	S	*	*			trans	-66.9	113.5	175.3	26.6	-32.9	0	0	0	109.8	F461	P459-F461 VanDerWaalsContact C-N 3.27Å; P459-F461 HydrophobicContact CB-CD2 4.48Å; P459-F461 PolarHBondContact O-N 3.06Å
460	N	21.7	Very low	21.5	Very low	161 Å²	161	164.8 Å²	164.8	86%	0.861	81%	0.807	S	S	*	*			trans	-67.8	74.6	-179.3	-86.8	-56.6	0	0	0	112.6	F458 K462	F458-N460 PolarHBondContact O-N 2.8Å; F458-N460 VanDerWaalsContact O-N 3.09Å; N460-K462 PolarHBondContact O-N 3.04Å
461	F	23.2	Very low	21.2	Very low	194 Å²	194	164.6 Å²	164.6	85%	0.851	80%	0.804	S	S	*	*			trans	-82.3	113.1	165.1	-91.6	-85.1	0	0	0	110.5	P459	P459-F461 VanDerWaalsContact C-N 3.27Å; P459-F461 HydrophobicContact CB-CD2 4.48Å; P459-F461 PolarHBondContact O-N 3.06Å
462	K	21	Very low	21.3	Very low	197 Å²	197	162.2 Å²	162.2	86%	0.857	80%	0.803	S	S	*	*			trans	-63.4	156.7	-179.5	-69.5	178	176.2	177	0	111.7	N460 F464	N460-K462 PolarHBondContact O-N 3.04Å; K462-F464 PolarHBondContact O-N 3.4Å
463	M	18.8	Very low	21.1	Very low	164 Å²	164	159.5 Å²	159.5	81%	0.808	79%	0.792	S	S	*	*			trans	-43	132.8	168.8	-73.1	172.9	156.3	0	0	112.6
464	F	21.4	Very low	21.2	Very low	214 Å²	214	157.1 Å²	157.1	94%	0.939	78%	0.783	S	S	*	*			trans	-135	111.2	132.3	-90.2	-72	0	0	0	109.9	K462	K462-F464 PolarHBondContact O-N 3.4Å
465	T	19	Very low	21.2	Very low	123 Å²	123	153.8 Å²	153.8	76%	0.755	78%	0.775	S	S	*	*			trans	-89.3	121.1	172.9	47.7	0	0	0	0	110.3
466	S	21.5	Very low	21.4	Very low	120 Å²	120	147.7 Å²	147.7	84%	0.839	77%	0.766	S	S	*	*			trans	-160.8	153	142.7	54	0	0	0	0	111.6
467	Y	19.6	Very low	21.2	Very low	207 Å²	207	143.9 Å²	143.9	81%	0.812	76%	0.761	S	S	*	*			trans	-76.8	151.3	173.7	-86	-123.4	0	0	0	110.7
468	N	22.4	Very low	21.3	Very low	161 Å²	161	145 Å²	145	86%	0.861	77%	0.766	S	S	*	*				-162.1	164.2	111.2	-108.5	-47.3	0	0	0	115.3
469	K	20	Very low	21.4	Very low	167 Å²	167	141 Å²	141	73%	0.726	76%	0.759	S	S	*	*			trans	-95.4	-178.7	-179.5	-68.8	175.5	171.1	175.7	0	111.9
470	N	21.7	Very low	21.4	Very low	143 Å²	143	145.2 Å²	145.2	77%	0.765	77%	0.769	S	S	*	*			trans	93	144.3	160	-53.2	-16.7	0	0	0	116
471	M	19.4	Very low	21.6	Very low	156 Å²	156	145 Å²	145	77%	0.768	77%	0.767	S	S	*	*			cis	-170	157.7	-26.6	-118.5	-54.1	174.9	0	0	109.2
472	C	22.1	Very low	21.6	Very low	100 Å²	100	146.5 Å²	146.5	68%	0.676	77%	0.767	S	S	*	*			trans	62.9	167.2	154.7	-65.9	0	0	0	0	119.6
473	T	20.1	Very low	21.7	Very low	92 Å²	92	144.4 Å²	144.4	56%	0.564	76%	0.76	S	S	*	*			cis	-166.5	168.7	-27.5	36.4	0	0	0	0	109.9
474	T	21	Very low	22.8	Very low	94 Å²	94	142.7 Å²	142.7	58%	0.577	76%	0.761	S	S	*	*			trans	65.6	157.5	142.7	49.6	0	0	0	0	120
475	D	22.2	Very low	23.3	Very low	132 Å²	132	139.4 Å²	139.4	71%	0.706	76%	0.759	S	S	*	*			cis	-157.7	172.2	-3.5	-134.7	-38.9	0	0	0	115.6
476	S	22.6	Very low	24.2	Very low	97 Å²	97	137.5 Å²	137.5	68%	0.678	75%	0.751	S	S	*	*			trans	65.3	166.6	154	75.1	0	0	0	0	120.4
477	G	19.9	Very low	25.2	Very low	63 Å²	63	136.2 Å²	136.2	65%	0.649	75%	0.747	S	S	*	*			cis	179.7	170	-11.1	0	0	0	0	0	113.8
478	L	23.3	Very low	26.9	Very low	177 Å²	177	133 Å²	133	93%	0.927	74%	0.738	S	S	*	*			trans	70.4	169.8	168.1	-59.5	149.3	0	0	0	119.5
479	S	24.4	Very low	29.2	Very low	89 Å²	89	128.5 Å²	128.5	62%	0.622	71%	0.713	S	S	*	*				-174.9	134.1	-76.2	54.2	0	0	0	0	113.9
480	H	23.4	Very low	32	Very low	198 Å²	198	124.5 Å²	124.5	92%	0.917	70%	0.7	S	S	*	*			trans	-176.1	179.9	154	-106.2	-65	0	0	0	113.6
481	I	26.1	Very low	34.9	Very low	157 Å²	157	120 Å²	120	81%	0.805	67%	0.672	S	S	*	*			trans	-122	140	-158.7	-61.2	160.9	0	0	0	114.1
482	R	22.9	Very low	37.9	Very low	225 Å²	225	119.3 Å²	119.3	85%	0.849	67%	0.665	S	S	*	*			trans	-170.4	148.6	148.2	-109.7	172	-163.9	-152.6	3	115.4
483	E	24.5	Very low	40.9	Very low	153 Å²	153	123 Å²	123	72%	0.715	67%	0.665	S	S	*	*			trans	44.3	122.2	161	-73.8	172	-153.9	0	0	122.3	T485	E483-T485 PolarHBondContact O-N 3.45Å
484	P	42.3	Very low	44.2	Very low	129 Å²	129	119.1 Å²	119.1	84%	0.838	64%	0.64	S	S	*	*	S	Bend	trans	-102	59.4	-168	41.7	-38.8	0	0	0	116.5
485	T	32	Very low	47.4	Very low	144 Å²	144	118.1 Å²	118.1	88%	0.883	63%	0.626	S	S	*	*			trans	-135.8	23.1	166.2	54.7	0	0	0	0	115	E483	E483-T485 PolarHBondContact O-N 3.45Å
486	S	36.8	Very low	50.5	Low	84 Å²	84	116.7 Å²	116.7	59%	0.587	62%	0.618	S	S	*	*			trans	-102	61.9	172.9	51.2	0	0	0	0	111.9	F488	S486-F488 VanDerWaalsContact C-N 3.27Å; S486-F488 WeakPolarHBondContact O-CD2 3.44Å; S486-F488 PolarHBondContact O-N 3.26Å
487	A	42.7	Very low	53.6	Low	93 Å²	93	115.2 Å²	115.2	77%	0.769	60%	0.602	S	S	*	*			trans	-65	89.7	166.9	0	0	0	0	0	109.2	L489	A487-L489 PolarHBondContact O-N 3.34Å
488	F	55.4	Low	56.8	Low	139 Å²	139	112.7 Å²	112.7	61%	0.61	57%	0.574	S	S	*	*			trans	-54.2	112.8	-176.7	-89.9	-89.7	0	0	0	110.7	S486 D490 Q518	S486-F488 VanDerWaalsContact C-N 3.27Å; S486-F488 WeakPolarHBondContact O-CD2 3.44Å; S486-F488 PolarHBondContact O-N 3.26Å; F488-D490 PolarHBondContact O-N 3.49Å; F488-Q518 HydrophobicContact CE1-CG 3.96Å
489	L	71.4	Confident	59.8	Low	66 Å²	66	114.6 Å²	114.6	35%	0.346	57%	0.568	S	S	.	*			trans	-65.7	106.1	171.7	-66.8	-175.8	0	0	0	108.3	A487 R491 L494 F511 I512	A487-L489 PolarHBondContact O-N 3.34Å; L489-R491 PolarHBondContact O-N 3.45Å; L489-R491 VanDerWaalsContact O-N 3.1Å; L489-L494 HydrophobicContact CB-CD1 3.85Å; L489-L494 HydrophobicContact CB-CD2 4.49Å; L489-L494 HydrophobicContact CB-CG 4.28Å; L489-L494 HydrophobicContact CD1-CD2 4.48Å; L489-F511 HydrophobicContact CD1-CD1 4.36Å; L489-F511 HydrophobicContact CD1-CE1 4.11Å; L489-I512 HydrophobicContact CD1-CG1 4.03Å
490	D	77	Confident	62.7	Low	83 Å²	83	116.7 Å²	116.7	44%	0.444	57%	0.568	S	S	.	*			trans	-56.6	118.6	-175.8	178.8	7.7	0	0	0	110.5	F488 K492 R493 L494	F488-D490 PolarHBondContact O-N 3.49Å; D490-K492 PolarHBondContact O-N 3.19Å; D490-K492 VanDerWaalsContact O-N 3.1Å; D490-K492 WeakPolarHBondContact OD1-CB 3.32Å; D490-K492 WeakPolarHBondContact OD1-CG 3.28Å; D490-K492 PolarHBondContact OD1-N 3.21Å; D490-K492 WeakPolarHBondContact OD2-CB 3.35Å; D490-R493 HydrophobicContact CB-CB 4.34Å; D490-R493 PolarHBondContact O-N 2.91Å; D490-L494 PolarHBondContact O-N 3.46Å
491	R	83.2	Confident	65.7	Low	49 Å²	49	114.2 Å²	114.2	19%	0.185	56%	0.555	C	S	.	*	H	α-helix	trans	-54.4	-27.4	175.7	-70.9	177.6	168.7	-108.9	7.7	111.9	L489 R495 V516 I675	L489-R491 PolarHBondContact O-N 3.45Å; L489-R491 VanDerWaalsContact O-N 3.1Å; R491-R495 WeakPolarHBondContact O-CB 3.37Å; R491-R495 VanDerWaalsContact O-CG 3.25Å; R491-R495 WeakPolarHBondContact O-CG 3.05Å; R491-R495 PolarHBondContact O-N 3.11Å; R491-R495 VanDerWaalsContact O-N 3.15Å; R491-R495 PolarHBondContact O-NE 2.96Å; R491-V516 HydrophobicContact CG-CG1 4.22Å; R491-V516 PolarHBondContact NH2-O 2.55Å; R491-I675 PolarHBondContact NH1-O 3.48Å
492	K	82.4	Confident	68.5	Low	141 Å²	141	108.5 Å²	108.5	61%	0.613	54%	0.535	S	S	*	.	H	α-helix	trans	-65.6	-51.1	171.9	-59	172.9	178.3	176.3	0	111.4	D490 L494 R495 L496	D490-K492 PolarHBondContact O-N 3.19Å; D490-K492 VanDerWaalsContact O-N 3.1Å; D490-K492 WeakPolarHBondContact OD1-CB 3.32Å; D490-K492 WeakPolarHBondContact OD1-CG 3.28Å; D490-K492 PolarHBondContact OD1-N 3.21Å; D490-K492 WeakPolarHBondContact OD2-CB 3.35Å; K492-L494 PolarHBondContact O-N 3.16Å; K492-R495 PolarHBondContact O-N 3.46Å; K492-L496 PolarHBondContact O-N 3.2Å
493	R	86.5	Confident	71.7	Confident	179 Å²	179	102.4 Å²	102.4	68%	0.675	52%	0.515	S	S	*	.	H	α-helix	trans	-63.5	-40	178.8	-174.1	176.2	179.6	176.9	0.6	112.1	D490 R495 L496 L497	D490-R493 HydrophobicContact CB-CB 4.34Å; D490-R493 PolarHBondContact O-N 2.91Å; R493-R495 VanDerWaalsContact C-N 3.34Å; R493-R495 PolarHBondContact O-N 3.08Å; R493-L496 PolarHBondContact O-N 3.23Å; R493-L497 PolarHBondContact O-N 3.44Å; R493-L497 VanDerWaalsContact O-N 3.14Å
494	L	87.8	Confident	74.8	Confident	9 Å²	9	95.5 Å²	95.5	5%	0.047	48%	0.482	C	S	.	.	H	α-helix	trans	-63.1	-38.5	175.6	-70.1	176.2	0	0	0	112.5	L489 D490 K492 L497 L498 F504 I512 V516	L489-L494 HydrophobicContact CB-CD1 3.85Å; L489-L494 HydrophobicContact CB-CD2 4.49Å; L489-L494 HydrophobicContact CB-CG 4.28Å; L489-L494 HydrophobicContact CD1-CD2 4.48Å; D490-L494 PolarHBondContact O-N 3.46Å; K492-L494 PolarHBondContact O-N 3.16Å; L494-L497 PolarHBondContact O-N 3.45Å; L494-L498 WeakPolarHBondContact O-CG 3.22Å; L494-L498 PolarHBondContact O-N 3.11Å; L494-F504 HydrophobicContact CB-CE1 4.44Å; L494-F504 HydrophobicContact CB-CZ 4.18Å; L494-F504 HydrophobicContact CD2-CE1 3.9Å; L494-F504 HydrophobicContact CD2-CZ 4.11Å; L494-I512 HydrophobicContact CD1-CG2 4.03Å; L494-I512 HydrophobicContact CD2-CG2 4.08Å; L494-V516 HydrophobicContact CD1-CG2 3.3Å
495	R	89.5	Confident	77.1	Confident	73 Å²	73	93.1 Å²	93.1	28%	0.275	47%	0.467	S	S	.	.	H	α-helix	trans	-67.2	-32.5	174.8	-74.7	-175.2	-64.1	-105	5	113.7	R491 K492 R493 R499 C676 Y677	R491-R495 WeakPolarHBondContact O-CB 3.37Å; R491-R495 VanDerWaalsContact O-CG 3.25Å; R491-R495 WeakPolarHBondContact O-CG 3.05Å; R491-R495 PolarHBondContact O-N 3.11Å; R491-R495 VanDerWaalsContact O-N 3.15Å; R491-R495 PolarHBondContact O-NE 2.96Å; K492-R495 PolarHBondContact O-N 3.46Å; R493-R495 VanDerWaalsContact C-N 3.34Å; R493-R495 PolarHBondContact O-N 3.08Å; R495-R499 PolarHBondContact O-N 3.41Å; R495-C676 HydrophobicContact CG-CB 4.13Å; R495-C676 PolarHBondContact NH1-O 3.21Å; R495-Y677 HydrophobicContact CB-CE2 4.32Å; R495-Y677 VanDerWaalsContact CD-CZ 3.45Å; R495-Y677 HydrophobicContact CG-CD1 4.49Å; R495-Y677 HydrophobicContact CG-CD2 4.04Å; R495-Y677 HydrophobicContact CG-CE1 4.09Å; R495-Y677 HydrophobicContact CG-CE2 3.57Å; R495-Y677 HydrophobicContact CG-CG 4.48Å
496	L	86	Confident	79.6	Confident	102 Å²	102	91.2 Å²	91.2	53%	0.534	45%	0.451	S	S	.	.	H	α-helix	trans	-64.1	-49.8	171.9	-66.3	172.9	0	0	0	110.4	K492 R493 L498 R499 E500	K492-L496 PolarHBondContact O-N 3.2Å; R493-L496 PolarHBondContact O-N 3.23Å; L496-L498 VanDerWaalsContact C-N 3.3Å; L496-L498 PolarHBondContact O-N 3.24Å; L496-R499 WeakPolarHBondContact O-CB 3.25Å; L496-R499 PolarHBondContact O-N 3.45Å; L496-E500 WeakPolarHBondContact O-CG 3.32Å; L496-E500 PolarHBondContact O-N 3.12Å
497	L	87.5	Confident	82	Confident	67 Å²	67	95.1 Å²	95.1	35%	0.351	46%	0.458	S	S	.	.	H	α-helix	trans	-59.9	-37	176.7	-67.6	170.9	0	0	0	112.8	R493 L494 E500 F501	R493-L497 PolarHBondContact O-N 3.44Å; R493-L497 VanDerWaalsContact O-N 3.14Å; L494-L497 PolarHBondContact O-N 3.45Å; L497-E500 PolarHBondContact O-N 2.85Å; L497-F501 HydrophobicContact CD2-CD2 4.24Å; L497-F501 HydrophobicContact CD2-CE2 4.05Å; L497-F501 WeakPolarHBondContact O-CB 3.48Å; L497-F501 WeakPolarHBondContact O-CD2 3.25Å; L497-F501 PolarHBondContact O-N 2.81Å
498	L	88.4	Confident	84.2	Confident	10 Å²	10	96.5 Å²	96.5	5%	0.052	44%	0.444	C	S	.	.	H	α-helix	trans	-68.6	-35.3	174.2	-73.5	169	0	0	0	112.8	L494 L496 E500 G502 F504 D672 C676	L494-L498 WeakPolarHBondContact O-CG 3.22Å; L494-L498 PolarHBondContact O-N 3.11Å; L496-L498 VanDerWaalsContact C-N 3.3Å; L496-L498 PolarHBondContact O-N 3.24Å; L498-E500 VanDerWaalsContact C-N 3.29Å; L498-E500 PolarHBondContact O-N 3.19Å; L498-G502 WeakPolarHBondContact O-CA 3.09Å; L498-G502 PolarHBondContact O-N 3.48Å; L498-F504 HydrophobicContact CD1-CE1 4.15Å; L498-F504 HydrophobicContact CD1-CE2 4.1Å; L498-F504 HydrophobicContact CD1-CZ 3.54Å; L498-F504 HydrophobicContact CD2-CD1 4.01Å; L498-F504 HydrophobicContact CD2-CD2 4.35Å; L498-F504 HydrophobicContact CD2-CE1 3.71Å; L498-F504 HydrophobicContact CD2-CE2 4.06Å; L498-F504 HydrophobicContact CD2-CG 4.31Å; L498-F504 HydrophobicContact CD2-CZ 3.73Å; L498-F504 HydrophobicContact CG-CD1 4.44Å; L498-F504 HydrophobicContact CG-CE1 3.67Å; L498-F504 HydrophobicContact CG-CE2 4.33Å; L498-F504 HydrophobicContact CG-CZ 3.6Å; L498-D672 WeakPolarHBondContact CD1-O 3.25Å; L498-D672 HydrophobicContact CD2-CB 4.01Å; L498-C676 HydrophobicContact CD1-CB 3.78Å
499	R	85.9	Confident	85.9	Confident	217 Å²	217	90.3 Å²	90.3	82%	0.819	42%	0.416	S	S	*	.	H	α-helix	trans	-68.2	-29.5	174.4	-170.9	178.8	-178.5	-168.7	0	112.4	R495 L496	R495-R499 PolarHBondContact O-N 3.41Å; L496-R499 WeakPolarHBondContact O-CB 3.25Å; L496-R499 PolarHBondContact O-N 3.45Å
500	E	84.2	Confident	86.8	Confident	132 Å²	132	90.8 Å²	90.8	62%	0.617	42%	0.419	S	S	*	.	H	α-helix	trans	-85.2	-42.3	179.4	-70.4	164.2	-173.3	0	0	113.1	L496 L497 L498	L496-E500 WeakPolarHBondContact O-CG 3.32Å; L496-E500 PolarHBondContact O-N 3.12Å; L497-E500 PolarHBondContact O-N 2.85Å; L498-E500 VanDerWaalsContact C-N 3.29Å; L498-E500 PolarHBondContact O-N 3.19Å
501	F	86.5	Confident	87.3	Confident	146 Å²	146	92.9 Å²	92.9	64%	0.64	42%	0.424	S	S	*	.	H	α-helix	trans	-114.3	-6.8	-170.2	-64	-82.8	0	0	0	115	L497 K503	L497-F501 HydrophobicContact CD2-CD2 4.24Å; L497-F501 HydrophobicContact CD2-CE2 4.05Å; L497-F501 WeakPolarHBondContact O-CB 3.48Å; L497-F501 WeakPolarHBondContact O-CD2 3.25Å; L497-F501 PolarHBondContact O-N 2.81Å; F501-K503 PolarHBondContact O-N 2.8Å
502	G	85.2	Confident	87.6	Confident	37 Å²	37	91.3 Å²	91.3	38%	0.381	42%	0.419	S	S	.	.	S	Bend	trans	70.4	-25.5	177.8	0	0	0	0	0	116.5	L498	L498-G502 WeakPolarHBondContact O-CA 3.09Å; L498-G502 PolarHBondContact O-N 3.48Å
503	K	89.8	Confident	88.1	Confident	98 Å²	98	84.6 Å²	84.6	43%	0.426	39%	0.39	S	S	.	.	S	Bend	trans	-152	156.9	-177.7	67	-170	-177.6	-179.9	0	113.2	F501 C669	F501-K503 PolarHBondContact O-N 2.8Å; K503-C669 HydrophobicContact CB-CB 4.26Å; K503-C669 VanDerWaalsContact CB-SG 3.56Å; K503-C669 WeakPolarHBondContact CD-SG 3.45Å
504	F	91.2	Very high	88.2	Confident	7 Å²	7	80.4 Å²	80.4	3%	0.031	37%	0.374	C	S	.	.			trans	-80.3	145.5	172.5	-64.9	-46.3	0	0	0	111.9	L494 L498 N506 R509 I512 D672 C676	L494-F504 HydrophobicContact CB-CE1 4.44Å; L494-F504 HydrophobicContact CB-CZ 4.18Å; L494-F504 HydrophobicContact CD2-CE1 3.9Å; L494-F504 HydrophobicContact CD2-CZ 4.11Å; L498-F504 HydrophobicContact CD1-CE1 4.15Å; L498-F504 HydrophobicContact CD1-CE2 4.1Å; L498-F504 HydrophobicContact CD1-CZ 3.54Å; L498-F504 HydrophobicContact CD2-CD1 4.01Å; L498-F504 HydrophobicContact CD2-CD2 4.35Å; L498-F504 HydrophobicContact CD2-CE1 3.71Å; L498-F504 HydrophobicContact CD2-CE2 4.06Å; L498-F504 HydrophobicContact CD2-CG 4.31Å; L498-F504 HydrophobicContact CD2-CZ 3.73Å; L498-F504 HydrophobicContact CG-CD1 4.44Å; L498-F504 HydrophobicContact CG-CE1 3.67Å; L498-F504 HydrophobicContact CG-CE2 4.33Å; L498-F504 HydrophobicContact CG-CZ 3.6Å; F504-N506 PolarHBondContact O-N 2.79Å; F504-R509 HydrophobicContact CB-CB 4.45Å; F504-R509 PolarHBondContact O-NH2 2.89Å; F504-I512 HydrophobicContact CB-CD1 3.91Å; F504-I512 HydrophobicContact CD1-CD1 3.83Å; F504-I512 HydrophobicContact CD1-CG2 4.46Å; F504-I512 HydrophobicContact CD2-CB 4.39Å; F504-I512 HydrophobicContact CD2-CD1 4.33Å; F504-I512 HydrophobicContact CD2-CG2 3.8Å; F504-I512 HydrophobicContact CE1-CD1 4.46Å; F504-I512 HydrophobicContact CE1-CG2 4.25Å; F504-I512 HydrophobicContact CE2-CG2 3.56Å; F504-I512 HydrophobicContact CG-CD1 3.77Å; F504-I512 HydrophobicContact CG-CG2 4.27Å; F504-I512 HydrophobicContact CZ-CG2 3.81Å; F504-D672 HydrophobicContact CD2-CB 3.67Å; F504-D672 VanDerWaalsContact CD2-CG 3.45Å; F504-D672 WeakPolarHBondContact CD2-OD1 3.28Å; F504-D672 HydrophobicContact CE2-CB 4.01Å; F504-D672 HydrophobicContact CG-CB 4.38Å; F504-D672 PolarHBondContact N-OD2 3.35Å; F504-C676 VanDerWaalsContact CZ-SG 3.6Å
505	P	89.5	Confident	88.1	Confident	79 Å²	79	81.3 Å²	81.3	51%	0.513	38%	0.381	S	S	.	.			trans	-61.6	130.2	175.3	-23.2	33.6	0	0	0	111.8	K507 Y508 R509	P505-K507 PolarHBondContact O-N 2.93Å; P505-Y508 HydrophobicContact CB-CD2 4.25Å; P505-Y508 PolarHBondContact O-N 3.24Å; P505-R509 PolarHBondContact O-N 3.27Å
506	N	85.6	Confident	88.1	Confident	104 Å²	104	78 Å²	78	56%	0.556	37%	0.369	S	S	*	.	H	α-helix	trans	-50.3	-37.5	-175	-67.6	2.3	0	0	0	113.4	F504 Y508 R509	F504-N506 PolarHBondContact O-N 2.79Å; N506-Y508 VanDerWaalsContact C-N 3.27Å; N506-Y508 PolarHBondContact O-N 3.4Å; N506-R509 PolarHBondContact OD1-NH1 3.42Å
507	K	86.6	Confident	88.2	Confident	167 Å²	167	73.1 Å²	73.1	73%	0.726	34%	0.344	S	S	*	.	H	α-helix	trans	-59.6	-32	176.6	-174.1	-178.6	177	-165.3	0	113.8	P505	P505-K507 PolarHBondContact O-N 2.93Å
508	Y	89	Confident	88.2	Confident	121 Å²	121	73.3 Å²	73.3	48%	0.475	34%	0.343	S	S	.	.	H	α-helix	trans	-112.4	-13.7	-173.8	-56.5	-57.2	0	0	0	113.7	P505 N506 L510 F511 I512	P505-Y508 HydrophobicContact CB-CD2 4.25Å; P505-Y508 PolarHBondContact O-N 3.24Å; N506-Y508 VanDerWaalsContact C-N 3.27Å; N506-Y508 PolarHBondContact O-N 3.4Å; Y508-L510 VanDerWaalsContact C-N 3.32Å; Y508-L510 PolarHBondContact O-N 2.85Å; Y508-F511 WeakPolarHBondContact O-CB 3.27Å; Y508-F511 PolarHBondContact O-N 3.13Å; Y508-I512 WeakPolarHBondContact O-CG1 3.5Å; Y508-I512 PolarHBondContact O-N 3.38Å
509	R	91.7	Very high	88.2	Confident	9 Å²	9	73.7 Å²	73.7	3%	0.034	35%	0.345	C	S	.	.	H	α-helix	trans	-45.8	-51.2	179.5	179.5	176.6	-72.7	116.8	3.5	112.9	F504 P505 N506 F511 I512 W513 D672	F504-R509 HydrophobicContact CB-CB 4.45Å; F504-R509 PolarHBondContact O-NH2 2.89Å; P505-R509 PolarHBondContact O-N 3.27Å; N506-R509 PolarHBondContact OD1-NH1 3.42Å; R509-F511 VanDerWaalsContact C-N 3.27Å; R509-F511 PolarHBondContact O-N 3.41Å; R509-I512 PolarHBondContact O-N 3.34Å; R509-W513 HydrophobicContact CG-CD2 4.37Å; R509-W513 HydrophobicContact CG-CG 4.27Å; R509-W513 HydrophobicContact CG-CZ2 4.49Å; R509-W513 WeakPolarHBondContact O-CB 3.11Å; R509-W513 VanDerWaalsContact O-CD1 3.28Å; R509-W513 PolarHBondContact O-N 2.9Å; R509-D672 WeakPolarHBondContact CD-OD1 3.49Å; R509-D672 WeakPolarHBondContact CG-OD1 3.32Å; R509-D672 IonicContact CZ-OD1 2.94Å; R509-D672 IonicContact CZ-OD2 2.76Å; R509-D672 VanDerWaalsContact CZ-OD2 3.3Å; R509-D672 VanDerWaalsContact NE-CG 3.29Å; R509-D672 IonicContact NE-OD1 3.17Å; R509-D672 PolarHBondContact NE-OD1 2.9Å; R509-D672 IonicContact NE-OD2 3.8Å; R509-D672 PolarHBondContact NE-OD2 3.31Å; R509-D672 IonicContact NH2-OD1 3.4Å; R509-D672 IonicContact NH2-OD2 3.88Å; R509-D672 PolarHBondContact NH2-OD2 3.41Å
510	L	89	Confident	88.2	Confident	76 Å²	76	65.1 Å²	65.1	40%	0.398	32%	0.317	S	S	.	.	H	α-helix	trans	-61.3	-32.7	-178.9	-56.5	-176.2	0	0	0	113.5	Y508 R514 L586	Y508-L510 VanDerWaalsContact C-N 3.32Å; Y508-L510 PolarHBondContact O-N 2.85Å; L510-R514 WeakPolarHBondContact O-CB 3.5Å; L510-R514 WeakPolarHBondContact O-CD 3.5Å; L510-R514 WeakPolarHBondContact O-CG 3.36Å; L510-R514 PolarHBondContact O-N 3.44Å; L510-L586 HydrophobicContact CD2-CD1 4.24Å; L510-L586 HydrophobicContact CD2-CD2 3.41Å; L510-L586 VanDerWaalsContact CD2-CD2 3.41Å; L510-L586 HydrophobicContact CD2-CG 3.69Å
511	F	88.5	Confident	88.4	Confident	128 Å²	128	60.8 Å²	60.8	56%	0.561	30%	0.301	S	S	*	.	H	α-helix	trans	-75.9	-44.4	176.2	177.1	-95.5	0	0	0	110.9	L489 Y508 R509 R514 S515	L489-F511 HydrophobicContact CD1-CD1 4.36Å; L489-F511 HydrophobicContact CD1-CE1 4.11Å; Y508-F511 WeakPolarHBondContact O-CB 3.27Å; Y508-F511 PolarHBondContact O-N 3.13Å; R509-F511 VanDerWaalsContact C-N 3.27Å; R509-F511 PolarHBondContact O-N 3.41Å; F511-R514 PolarHBondContact O-N 2.83Å; F511-S515 PolarHBondContact O-N 2.85Å
512	I	89.6	Confident	88.6	Confident	15 Å²	15	54.3 Å²	54.3	8%	0.077	27%	0.273	C	S	.	.	H	α-helix	trans	-60.1	-51.3	177.6	-63.1	162.9	0	0	0	109.7	L489 L494 F504 Y508 R509 R514 S515 V516	L489-I512 HydrophobicContact CD1-CG1 4.03Å; L494-I512 HydrophobicContact CD1-CG2 4.03Å; L494-I512 HydrophobicContact CD2-CG2 4.08Å; F504-I512 HydrophobicContact CB-CD1 3.91Å; F504-I512 HydrophobicContact CD1-CD1 3.83Å; F504-I512 HydrophobicContact CD1-CG2 4.46Å; F504-I512 HydrophobicContact CD2-CB 4.39Å; F504-I512 HydrophobicContact CD2-CD1 4.33Å; F504-I512 HydrophobicContact CD2-CG2 3.8Å; F504-I512 HydrophobicContact CE1-CD1 4.46Å; F504-I512 HydrophobicContact CE1-CG2 4.25Å; F504-I512 HydrophobicContact CE2-CG2 3.56Å; F504-I512 HydrophobicContact CG-CD1 3.77Å; F504-I512 HydrophobicContact CG-CG2 4.27Å; F504-I512 HydrophobicContact CZ-CG2 3.81Å; Y508-I512 WeakPolarHBondContact O-CG1 3.5Å; Y508-I512 PolarHBondContact O-N 3.38Å; R509-I512 PolarHBondContact O-N 3.34Å; I512-R514 PolarHBondContact O-N 2.88Å; I512-S515 PolarHBondContact O-N 2.92Å; I512-S515 VanDerWaalsContact O-N 3.09Å; I512-S515 PolarHBondContact O-OG 2.88Å; I512-V516 HydrophobicContact CG2-CG2 4.13Å; I512-V516 WeakPolarHBondContact O-CG2 3.36Å; I512-V516 PolarHBondContact O-N 2.91Å
513	W	91.8	Very high	88.7	Confident	1 Å²	1	57.1 Å²	57.1	0%	0.004	28%	0.283	C	S	.	.	H	α-helix	trans	-54.9	-48.1	176.8	-77.3	31.6	0	0	0	112	R509 S515 V516 L517 F583 L586 W667 L668 W671 D672 I675	R509-W513 HydrophobicContact CG-CD2 4.37Å; R509-W513 HydrophobicContact CG-CG 4.27Å; R509-W513 HydrophobicContact CG-CZ2 4.49Å; R509-W513 WeakPolarHBondContact O-CB 3.11Å; R509-W513 VanDerWaalsContact O-CD1 3.28Å; R509-W513 PolarHBondContact O-N 2.9Å; W513-S515 VanDerWaalsContact C-N 3.32Å; W513-S515 PolarHBondContact O-N 2.87Å; W513-V516 PolarHBondContact O-N 3.36Å; W513-L517 VanDerWaalsContact O-CB 3.25Å; W513-L517 WeakPolarHBondContact O-CB 3.34Å; W513-L517 WeakPolarHBondContact O-CG 3.44Å; W513-L517 PolarHBondContact O-N 3.44Å; W513-F583 HydrophobicContact CZ3-CD1 4.05Å; W513-F583 HydrophobicContact CZ3-CE1 4.28Å; W513-L586 HydrophobicContact CE3-CD2 3.93Å; W513-L586 HydrophobicContact CH2-CD1 4.17Å; W513-L586 HydrophobicContact CZ3-CD1 4.23Å; W513-L586 HydrophobicContact CZ3-CD2 3.84Å; W513-W667 HydrophobicContact CH2-CH2 4.22Å; W513-W667 HydrophobicContact CH2-CZ3 4.07Å; W513-L668 HydrophobicContact CH2-CD2 4.3Å; W513-L668 HydrophobicContact CZ2-CD2 4.32Å; W513-W671 HydrophobicContact CH2-CB 3.68Å; W513-W671 HydrophobicContact CZ2-CB 3.67Å; W513-D672 PolarHBondContact NE1-OD1 3.4Å; W513-I675 HydrophobicContact CD2-CD1 3.49Å; W513-I675 VanDerWaalsContact CD2-CD1 3.49Å; W513-I675 HydrophobicContact CE3-CD1 3.68Å; W513-I675 HydrophobicContact CG-CD1 4Å; W513-I675 HydrophobicContact CH2-CD1 4.1Å; W513-I675 HydrophobicContact CZ2-CD1 3.94Å; W513-I675 HydrophobicContact CZ3-CD1 3.98Å
514	R	88	Confident	88.7	Confident	90 Å²	90	59.3 Å²	59.3	34%	0.34	30%	0.295	S	S	.	.	H	α-helix	trans	-59.4	-39.9	176.7	-74.3	171.6	75.1	-155.3	2.4	112.9	L510 F511 I512 Q518 I519 C521 H593	L510-R514 WeakPolarHBondContact O-CB 3.5Å; L510-R514 WeakPolarHBondContact O-CD 3.5Å; L510-R514 WeakPolarHBondContact O-CG 3.36Å; L510-R514 PolarHBondContact O-N 3.44Å; F511-R514 PolarHBondContact O-N 2.83Å; I512-R514 PolarHBondContact O-N 2.88Å; R514-Q518 PolarHBondContact O-N 3.22Å; R514-Q518 VanDerWaalsContact O-N 3.12Å; R514-I519 HydrophobicContact CG-CD1 4.18Å; R514-I519 PolarHBondContact O-N 3.14Å; R514-C521 PolarHBondContact NH2-SG 3.33Å; R514-H593 VanDerWaalsContact CZ-CE1 3.44Å; R514-H593 PolarHBondContact NH2-NE2 3.2Å
515	S	87.3	Confident	88.5	Confident	28 Å²	28	59.9 Å²	59.9	20%	0.196	30%	0.301	C	S	.	.	H	α-helix	trans	-71.4	-39.1	179	73.9	0	0	0	0	113	F511 I512 W513 Q518	F511-S515 PolarHBondContact O-N 2.85Å; I512-S515 PolarHBondContact O-N 2.92Å; I512-S515 VanDerWaalsContact O-N 3.09Å; I512-S515 PolarHBondContact O-OG 2.88Å; W513-S515 VanDerWaalsContact C-N 3.32Å; W513-S515 PolarHBondContact O-N 2.87Å; S515-Q518 PolarHBondContact O-N 2.81Å
516	V	88.2	Confident	88.6	Confident	4 Å²	4	56.9 Å²	56.9	2%	0.024	28%	0.279	C	S	.	.	H	α-helix	trans	-77.2	-40.3	-178.1	179.6	0	0	0	0	111.1	R491 L494 I512 W513 Q518 I675	R491-V516 HydrophobicContact CG-CG1 4.22Å; R491-V516 PolarHBondContact NH2-O 2.55Å; L494-V516 HydrophobicContact CD1-CG2 3.3Å; I512-V516 HydrophobicContact CG2-CG2 4.13Å; I512-V516 WeakPolarHBondContact O-CG2 3.36Å; I512-V516 PolarHBondContact O-N 2.91Å; W513-V516 PolarHBondContact O-N 3.36Å; V516-Q518 PolarHBondContact O-N 3.17Å; V516-I675 HydrophobicContact CB-CG2 3.93Å; V516-I675 HydrophobicContact CG1-CG2 3.57Å; V516-I675 WeakPolarHBondContact CG1-O 3.19Å
517	L	89.2	Confident	88.8	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-6.9	174.6	-67	173.3	0	0	0	113.5	W513 I519 V597 T600 I601 W605 I675 F762	W513-L517 VanDerWaalsContact O-CB 3.25Å; W513-L517 WeakPolarHBondContact O-CB 3.34Å; W513-L517 WeakPolarHBondContact O-CG 3.44Å; W513-L517 PolarHBondContact O-N 3.44Å; L517-I519 HydrophobicContact CB-CD1 3.92Å; L517-I519 HydrophobicContact CB-CG1 3.68Å; L517-I519 HydrophobicContact CD1-CD1 4.13Å; L517-I519 PolarHBondContact O-N 3.38Å; L517-V597 HydrophobicContact CD1-CG1 4.22Å; L517-V597 HydrophobicContact CD1-CG2 4.09Å; L517-T600 HydrophobicContact CB-CG2 4.22Å; L517-T600 HydrophobicContact CD2-CG2 4Å; L517-I601 HydrophobicContact CD2-CG1 4.42Å; L517-W605 HydrophobicContact CD2-CH2 3.85Å; L517-W605 HydrophobicContact CD2-CZ3 3.95Å; L517-I675 HydrophobicContact CD1-CD1 4.2Å; L517-I675 HydrophobicContact CD2-CG1 4.34Å; L517-I675 HydrophobicContact CD2-CG2 3.92Å; L517-I675 HydrophobicContact CG-CG2 3.87Å; L517-F762 HydrophobicContact CD2-CE2 4.14Å; L517-F762 HydrophobicContact CD2-CZ 4.18Å; L517-F762 WeakPolarHBondContact O-CZ 3.42Å
518	Q	86.9	Confident	89.1	Confident	71 Å²	71	50.9 Å²	50.9	33%	0.332	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	49.6	176	-53.4	-178.7	1.8	0	0	113	F488 R514 S515 V516 F762 P764	F488-Q518 HydrophobicContact CE1-CG 3.96Å; R514-Q518 PolarHBondContact O-N 3.22Å; R514-Q518 VanDerWaalsContact O-N 3.12Å; S515-Q518 PolarHBondContact O-N 2.81Å; V516-Q518 PolarHBondContact O-N 3.17Å; Q518-F762 HydrophobicContact CB-CE1 4.38Å; Q518-F762 HydrophobicContact CG-CE1 4.2Å; Q518-P764 HydrophobicContact CB-CB 3.84Å
519	I	88.4	Confident	89.2	Confident	17 Å²	17	45.8 Å²	45.8	9%	0.087	24%	0.244	C	C	.	.			trans	-76	121.2	-166.5	-64.8	-174.6	0	0	0	111.8	R514 L517 C521 E596 V597	R514-I519 HydrophobicContact CG-CD1 4.18Å; R514-I519 PolarHBondContact O-N 3.14Å; L517-I519 HydrophobicContact CB-CD1 3.92Å; L517-I519 HydrophobicContact CB-CG1 3.68Å; L517-I519 HydrophobicContact CD1-CD1 4.13Å; L517-I519 PolarHBondContact O-N 3.38Å; I519-C521 VanDerWaalsContact C-N 3.32Å; I519-C521 PolarHBondContact O-N 3.01Å; I519-C521 PolarHBondContact O-SG 3.16Å; I519-E596 HydrophobicContact CG2-CB 3.69Å; I519-E596 HydrophobicContact CG2-CG 4.44Å; I519-E596 WeakPolarHBondContact CG2-OE2 3.49Å; I519-V597 HydrophobicContact CD1-CB 4.43Å; I519-V597 HydrophobicContact CD1-CG2 3.34Å
520	P	86.8	Confident	89.1	Confident	37 Å²	37	50 Å²	50	24%	0.24	26%	0.263	C	S	.	.			trans	-75.9	-12.5	-168	31	-38.2	0	0	0	114.8	N522 L765 Y770	P520-N522 VanDerWaalsContact C-N 3.28Å; P520-N522 HydrophobicContact CG-CB 4.42Å; P520-N522 PolarHBondContact O-N 3.29Å; P520-L765 HydrophobicContact CG-CB 3.73Å; P520-L765 WeakPolarHBondContact CG-O 3.21Å; P520-Y770 HydrophobicContact CG-CE1 4.22Å
521	C	88	Confident	89.2	Confident	41 Å²	41	54.6 Å²	54.6	28%	0.277	28%	0.28	S	S	.	.			trans	55.6	41	179.9	-56.5	0	0	0	0	112.7	R514 I519 T523 E596	R514-C521 PolarHBondContact NH2-SG 3.33Å; I519-C521 VanDerWaalsContact C-N 3.32Å; I519-C521 PolarHBondContact O-N 3.01Å; I519-C521 PolarHBondContact O-SG 3.16Å; C521-T523 VanDerWaalsContact C-N 3.34Å; C521-T523 PolarHBondContact O-N 3.32Å; C521-E596 WeakPolarHBondContact CA-OE2 3.41Å; C521-E596 PolarHBondContact N-OE1 2.77Å; C521-E596 PolarHBondContact N-OE2 3.32Å
522	N	89.5	Confident	89.3	Confident	11 Å²	11	53.7 Å²	53.7	6%	0.059	28%	0.276	C	S	.	.			trans	-79.7	76.4	-170.1	-178.3	0.4	0	0	0	112	P520 Q524 A525 F526 E596 P768 Y770	P520-N522 VanDerWaalsContact C-N 3.28Å; P520-N522 HydrophobicContact CG-CB 4.42Å; P520-N522 PolarHBondContact O-N 3.29Å; N522-Q524 PolarHBondContact O-N 3.38Å; N522-A525 VanDerWaalsContact ND2-CB 3.34Å; N522-A525 WeakPolarHBondContact ND2-CB 3.45Å; N522-A525 PolarHBondContact O-N 2.86Å; N522-A525 PolarHBondContact OD1-N 3.36Å; N522-A525 VanDerWaalsContact OD1-N 3.16Å; N522-F526 PolarHBondContact O-N 2.89Å; N522-E596 WeakPolarHBondContact CB-OE1 3.29Å; N522-E596 PolarHBondContact N-OE1 3.32Å; N522-P768 PolarHBondContact ND2-O 3.44Å; N522-Y770 HydrophobicContact CB-CE1 3.83Å; N522-Y770 PolarHBondContact O-OH 3.3Å
523	T	89.3	Confident	89.4	Confident	95 Å²	95	54.8 Å²	54.8	58%	0.583	29%	0.292	S	S	*	.	H	α-helix	trans	-52.8	-35.2	179.1	53.6	0	0	0	0	113.8	C521 S527 L592	C521-T523 VanDerWaalsContact C-N 3.34Å; C521-T523 PolarHBondContact O-N 3.32Å; T523-S527 VanDerWaalsContact O-CB 3.23Å; T523-S527 WeakPolarHBondContact O-CB 3.43Å; T523-S527 PolarHBondContact O-N 3.16Å; T523-L592 HydrophobicContact CG2-CD2 3.77Å
524	Q	88.7	Confident	89.4	Confident	145 Å²	145	58.2 Å²	58.2	68%	0.678	31%	0.309	S	S	*	.	H	α-helix	trans	-69.6	-54	-176.9	-66.3	-175.8	-6.2	0	0	111.7	N522 F526 S527 V528	N522-Q524 PolarHBondContact O-N 3.38Å; Q524-F526 PolarHBondContact O-N 3.42Å; Q524-S527 WeakPolarHBondContact O-CB 3.13Å; Q524-S527 PolarHBondContact O-N 2.92Å; Q524-V528 PolarHBondContact O-N 3.21Å; Q524-V528 VanDerWaalsContact O-N 3.11Å
525	A	87.1	Confident	89.7	Confident	19 Å²	19	55.6 Å²	55.6	16%	0.157	30%	0.301	C	S	.	.	H	α-helix	trans	-63.7	-41.2	179.7	0	0	0	0	0	111.9	N522 S527 V528 L529 Y770	N522-A525 VanDerWaalsContact ND2-CB 3.34Å; N522-A525 WeakPolarHBondContact ND2-CB 3.45Å; N522-A525 PolarHBondContact O-N 2.86Å; N522-A525 PolarHBondContact OD1-N 3.36Å; N522-A525 VanDerWaalsContact OD1-N 3.16Å; A525-S527 VanDerWaalsContact C-N 3.35Å; A525-S527 PolarHBondContact O-N 3.27Å; A525-V528 PolarHBondContact O-N 3.48Å; A525-L529 WeakPolarHBondContact O-CG 3.19Å; A525-L529 PolarHBondContact O-N 3.33Å; A525-L529 VanDerWaalsContact O-N 3.08Å; A525-Y770 HydrophobicContact CB-CD2 3.83Å; A525-Y770 HydrophobicContact CB-CE2 3.51Å
526	F	92	Very high	89.6	Confident	15 Å²	15	57.3 Å²	57.3	7%	0.066	31%	0.311	C	S	.	.	H	α-helix	trans	-64	-37.5	175.1	-174.8	-105.6	0	0	0	112.7	N522 Q524 V528 L529 Q530 A562 L591 L592 F595	N522-F526 PolarHBondContact O-N 2.89Å; Q524-F526 PolarHBondContact O-N 3.42Å; F526-V528 VanDerWaalsContact C-N 3.33Å; F526-V528 PolarHBondContact O-N 3.38Å; F526-L529 PolarHBondContact O-N 2.88Å; F526-Q530 WeakPolarHBondContact O-CB 3.37Å; F526-Q530 PolarHBondContact O-N 2.89Å; F526-A562 HydrophobicContact CE2-CB 4.04Å; F526-L591 HydrophobicContact CE1-CB 4.17Å; F526-L591 HydrophobicContact CZ-CB 3.87Å; F526-L592 HydrophobicContact CB-CD1 3.43Å; F526-L592 VanDerWaalsContact CB-CD1 3.43Å; F526-L592 HydrophobicContact CD1-CB 4.1Å; F526-L592 HydrophobicContact CD1-CD1 4.08Å; F526-L592 HydrophobicContact CD2-CD1 4.35Å; F526-L592 HydrophobicContact CE1-CB 4.39Å; F526-L592 HydrophobicContact CG-CB 4.46Å; F526-L592 HydrophobicContact CG-CD1 3.69Å; F526-F595 HydrophobicContact CD2-CB 3.91Å; F526-F595 AromaticContact CD2-CD1 3.68Å; F526-F595 HydrophobicContact CD2-CD1 3.68Å; F526-F595 HydrophobicContact CD2-CD2 4.3Å; F526-F595 HydrophobicContact CD2-CE1 4.33Å; F526-F595 AromaticContact CD2-CG 3.68Å; F526-F595 HydrophobicContact CD2-CG 3.68Å; F526-F595 HydrophobicContact CE2-CB 3.51Å; F526-F595 HydrophobicContact CE2-CD1 4.15Å; F526-F595 HydrophobicContact CE2-CD2 4.13Å; F526-F595 AromaticContact CE2-CG 3.65Å; F526-F595 HydrophobicContact CE2-CG 3.65Å; F526-F595 HydrophobicContact CZ-CB 4.42Å
527	S	90	Very high	89.5	Confident	53 Å²	53	59.1 Å²	59.1	37%	0.371	33%	0.326	S	S	.	.	H	α-helix	trans	-62	-39.2	173.9	-172.2	0	0	0	0	112.1	T523 Q524 A525 Q530 K531	T523-S527 VanDerWaalsContact O-CB 3.23Å; T523-S527 WeakPolarHBondContact O-CB 3.43Å; T523-S527 PolarHBondContact O-N 3.16Å; Q524-S527 WeakPolarHBondContact O-CB 3.13Å; Q524-S527 PolarHBondContact O-N 2.92Å; A525-S527 VanDerWaalsContact C-N 3.35Å; A525-S527 PolarHBondContact O-N 3.27Å; S527-Q530 PolarHBondContact O-N 2.89Å; S527-K531 WeakPolarHBondContact O-CB 3.48Å; S527-K531 VanDerWaalsContact O-CG 3.26Å; S527-K531 WeakPolarHBondContact O-CG 3.35Å; S527-K531 PolarHBondContact O-N 3.5Å
528	V	92	Very high	89.7	Confident	92 Å²	92	59.5 Å²	59.5	56%	0.558	33%	0.328	S	S	*	.	H	α-helix	trans	-63.8	-41.5	174.6	173.9	0	0	0	0	111.5	Q524 A525 F526	Q524-V528 PolarHBondContact O-N 3.21Å; Q524-V528 VanDerWaalsContact O-N 3.11Å; A525-V528 PolarHBondContact O-N 3.48Å; F526-V528 VanDerWaalsContact C-N 3.33Å; F526-V528 PolarHBondContact O-N 3.38Å
529	L	92.1	Very high	89.6	Confident	15 Å²	15	60.7 Å²	60.7	8%	0.079	34%	0.337	C	S	.	.	H	α-helix	trans	-65	-46.4	174.9	-66.2	170.8	0	0	0	111.7	A525 F526 K531 K532 A562 Y565 W566 F595 Y770	A525-L529 WeakPolarHBondContact O-CG 3.19Å; A525-L529 PolarHBondContact O-N 3.33Å; A525-L529 VanDerWaalsContact O-N 3.08Å; F526-L529 PolarHBondContact O-N 2.88Å; L529-K531 VanDerWaalsContact C-N 3.29Å; L529-K531 PolarHBondContact O-N 3.49Å; L529-K532 WeakPolarHBondContact O-CB 3.07Å; L529-K532 PolarHBondContact O-N 3.22Å; L529-K532 VanDerWaalsContact O-N 3.16Å; L529-A562 HydrophobicContact CB-CB 4.15Å; L529-Y565 WeakPolarHBondContact CD2-O 3.27Å; L529-W566 HydrophobicContact CD1-CB 4.01Å; L529-W566 HydrophobicContact CD2-CB 4.05Å; L529-F595 HydrophobicContact CD1-CE1 4.18Å; L529-F595 HydrophobicContact CD1-CE2 3.99Å; L529-F595 HydrophobicContact CD1-CZ 3.55Å; L529-Y770 HydrophobicContact CD1-CD2 4.27Å; L529-Y770 HydrophobicContact CD1-CE2 4.22Å
530	Q	89.2	Confident	89.5	Confident	96 Å²	96	65.9 Å²	65.9	45%	0.449	36%	0.364	S	S	.	.	H	α-helix	trans	-65.3	-30	-179.9	-172.5	178.8	-31.8	0	0	112.8	F526 S527 K532 G533	F526-Q530 WeakPolarHBondContact O-CB 3.37Å; F526-Q530 PolarHBondContact O-N 2.89Å; S527-Q530 PolarHBondContact O-N 2.89Å; Q530-K532 PolarHBondContact O-N 2.89Å; Q530-G533 PolarHBondContact O-N 2.6Å
531	K	91.3	Very high	89.6	Confident	173 Å²	173	64.4 Å²	64.4	75%	0.752	35%	0.354	S	S	*	.	H	α-helix	trans	-66.4	-20	174.9	-81.1	174.3	-179.1	-177.1	0	114.1	S527 L529 G533	S527-K531 WeakPolarHBondContact O-CB 3.48Å; S527-K531 VanDerWaalsContact O-CG 3.26Å; S527-K531 WeakPolarHBondContact O-CG 3.35Å; S527-K531 PolarHBondContact O-N 3.5Å; L529-K531 VanDerWaalsContact C-N 3.29Å; L529-K531 PolarHBondContact O-N 3.49Å; K531-G533 PolarHBondContact O-N 2.68Å
532	K	90.3	Very high	89.5	Confident	109 Å²	109	64.6 Å²	64.6	47%	0.474	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-12.7	176.6	-65.9	178.4	178	-176.5	0	113.7	L529 Q530 Y565	L529-K532 WeakPolarHBondContact O-CB 3.07Å; L529-K532 PolarHBondContact O-N 3.22Å; L529-K532 VanDerWaalsContact O-N 3.16Å; Q530-K532 PolarHBondContact O-N 2.89Å; K532-Y565 HydrophobicContact CB-CD1 4.22Å; K532-Y565 HydrophobicContact CB-CD2 3.66Å; K532-Y565 HydrophobicContact CB-CE1 4.09Å; K532-Y565 HydrophobicContact CB-CE2 3.54Å; K532-Y565 HydrophobicContact CB-CG 4.02Å; K532-Y565 HydrophobicContact CD-CD1 3.52Å; K532-Y565 HydrophobicContact CD-CD2 4Å; K532-Y565 HydrophobicContact CD-CE1 4.07Å; K532-Y565 HydrophobicContact CD-CG 3.48Å; K532-Y565 VanDerWaalsContact CD-CG 3.48Å; K532-Y565 HydrophobicContact CG-CG 4.43Å; K532-Y565 PolarHBondContact NZ-O 3.39Å; K532-Y565 VanDerWaalsContact NZ-O 3.12Å; K532-Y565 PolarHBondContact O-OH 3.05Å
533	G	91.6	Very high	89.2	Confident	39 Å²	39	71.3 Å²	71.3	40%	0.402	39%	0.389	S	S	.	.			trans	91.3	-147.2	177.8	0	0	0	0	0	113.8	Q530 K531	Q530-G533 PolarHBondContact O-N 2.6Å; K531-G533 PolarHBondContact O-N 2.68Å
534	I	92	Very high	88.9	Confident	73 Å²	73	73 Å²	73	37%	0.374	38%	0.384	S	S	.	.	S	Bend	trans	-94.4	130	175.2	-60.5	175.8	0	0	0	107.9	D539 Y565	I534-D539 HydrophobicContact CG2-CB 4.41Å; I534-Y565 PolarHBondContact O-OH 2.9Å
535	H	93.2	Very high	88.7	Confident	35 Å²	35	68.4 Å²	68.4	16%	0.162	36%	0.361	C	S	.	.			trans	-71.8	136.1	177.6	-174.8	-94.8	0	0	0	109.8	A537 Y538 D539 S561 A564 Y565	H535-A537 WeakPolarHBondContact ND1-CB 3.47Å; H535-A537 PolarHBondContact ND1-N 2.99Å; H535-A537 PolarHBondContact O-N 2.88Å; H535-Y538 HydrophobicContact CB-CD2 4.03Å; H535-Y538 HydrophobicContact CB-CE2 4.39Å; H535-Y538 PolarHBondContact O-N 3.4Å; H535-D539 PolarHBondContact O-N 2.99Å; H535-S561 PolarHBondContact N-OG 2.85Å; H535-A564 HydrophobicContact CB-CB 4.28Å; H535-Y565 HydrophobicContact CB-CD2 4.37Å; H535-Y565 HydrophobicContact CB-CE2 3.9Å; H535-Y565 AromaticContact CD2-CD1 3.88Å; H535-Y565 AromaticContact CD2-CE1 3.63Å; H535-Y565 AromaticContact CD2-CZ 3.9Å
536	P	86.8	Confident	88.5	Confident	64 Å²	64	73 Å²	73	42%	0.416	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-50.7	-37.7	-174.2	-30.9	36	0	0	0	114.7	Y538 D539	P536-Y538 PolarHBondContact O-N 3.49Å; P536-D539 PolarHBondContact O-N 3.43Å
537	A	86.2	Confident	88	Confident	41 Å²	41	74.3 Å²	74.3	34%	0.339	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-61.4	-14.7	177.8	0	0	0	0	0	115.2	H535 G571	H535-A537 WeakPolarHBondContact ND1-CB 3.47Å; H535-A537 PolarHBondContact ND1-N 2.99Å; H535-A537 PolarHBondContact O-N 2.88Å; A537-G571 VanDerWaalsContact CB-O 3.27Å; A537-G571 WeakPolarHBondContact CB-O 3.3Å
538	Y	91.7	Very high	87.6	Confident	9 Å²	9	84.7 Å²	84.7	4%	0.035	43%	0.427	C	S	.	.	G	3₁₀ helix	trans	-122.9	7.4	-179.3	-47	-55.6	0	0	0	114.1	H535 P536 L541 Q557 C560 A564 F570 L576 P577	H535-Y538 HydrophobicContact CB-CD2 4.03Å; H535-Y538 HydrophobicContact CB-CE2 4.39Å; H535-Y538 PolarHBondContact O-N 3.4Å; P536-Y538 PolarHBondContact O-N 3.49Å; Y538-L541 HydrophobicContact CD1-CD1 4.15Å; Y538-L541 WeakPolarHBondContact O-CB 3.45Å; Y538-L541 PolarHBondContact O-N 2.82Å; Y538-Q557 PolarHBondContact O-NE2 2.93Å; Y538-C560 HydrophobicContact CD1-CB 4.24Å; Y538-C560 HydrophobicContact CD2-CB 3.72Å; Y538-C560 HydrophobicContact CE1-CB 4.1Å; Y538-C560 HydrophobicContact CE2-CB 3.56Å; Y538-C560 WeakPolarHBondContact CE2-O 3.45Å; Y538-C560 HydrophobicContact CG-CB 4.05Å; Y538-A564 HydrophobicContact CE2-CB 3.79Å; Y538-F570 PolarHBondContact OH-O 2.99Å; Y538-L576 WeakPolarHBondContact OH-CD2 3.26Å; Y538-P577 HydrophobicContact CE1-CG 4.29Å
539	D	86.5	Confident	87.4	Confident	96 Å²	96	82.8 Å²	82.8	51%	0.513	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-48.1	174.2	-164.6	47	0	0	0	110	I534 H535 P536 L541 Q557	I534-D539 HydrophobicContact CG2-CB 4.41Å; H535-D539 PolarHBondContact O-N 2.99Å; P536-D539 PolarHBondContact O-N 3.43Å; D539-L541 PolarHBondContact O-N 3.19Å; D539-Q557 PolarHBondContact O-NE2 3Å; D539-Q557 VanDerWaalsContact O-NE2 3.11Å
540	L	85.8	Confident	87.2	Confident	125 Å²	125	87.2 Å²	87.2	65%	0.654	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	12.8	173.6	-59.9	178.1	0	0	0	114.7	S542 M543 R544	L540-S542 PolarHBondContact O-N 2.82Å; L540-S542 VanDerWaalsContact O-N 3.13Å; L540-M543 WeakPolarHBondContact O-CB 3.24Å; L540-M543 PolarHBondContact O-N 3.13Å; L540-R544 PolarHBondContact O-N 2.99Å
541	L	87.6	Confident	87.2	Confident	6 Å²	6	91.2 Å²	91.2	3%	0.031	45%	0.449	C	S	.	.	H	α-helix	trans	-57.5	-31.5	-178.5	-168.7	75.6	0	0	0	112.3	Y538 D539 M543 R544 Y545 L553 L556 Q557 P577	Y538-L541 HydrophobicContact CD1-CD1 4.15Å; Y538-L541 WeakPolarHBondContact O-CB 3.45Å; Y538-L541 PolarHBondContact O-N 2.82Å; D539-L541 PolarHBondContact O-N 3.19Å; L541-M543 VanDerWaalsContact C-N 3.27Å; L541-M543 PolarHBondContact O-N 3.4Å; L541-R544 PolarHBondContact O-N 3.48Å; L541-Y545 HydrophobicContact CD1-CD2 3.6Å; L541-Y545 HydrophobicContact CD1-CE2 4.02Å; L541-Y545 HydrophobicContact CG-CD2 4.21Å; L541-Y545 PolarHBondContact O-N 3.02Å; L541-L553 HydrophobicContact CD2-CD1 4.35Å; L541-L556 HydrophobicContact CD2-CB 4.42Å; L541-L556 HydrophobicContact CD2-CD2 4.08Å; L541-L556 HydrophobicContact CD2-CG 4.02Å; L541-Q557 HydrophobicContact CB-CG 3.9Å; L541-Q557 HydrophobicContact CD2-CB 4.49Å; L541-Q557 HydrophobicContact CD2-CG 3.65Å; L541-Q557 HydrophobicContact CG-CG 4.39Å; L541-P577 HydrophobicContact CD1-CB 3.98Å; L541-P577 HydrophobicContact CD1-CG 3.66Å
542	S	86	Confident	87.2	Confident	45 Å²	45	83.8 Å²	83.8	32%	0.315	42%	0.418	S	S	.	.	H	α-helix	trans	-60.1	-31.5	175.6	53.3	0	0	0	0	114.3	L540	L540-S542 PolarHBondContact O-N 2.82Å; L540-S542 VanDerWaalsContact O-N 3.13Å
543	M	83	Confident	87.3	Confident	153 Å²	153	78.8 Å²	78.8	75%	0.754	40%	0.396	S	S	*	.	H	α-helix	trans	-80.9	-32.3	177.4	-63.3	-59.7	-63.7	0	0	111.7	L540 L541	L540-M543 WeakPolarHBondContact O-CB 3.24Å; L540-M543 PolarHBondContact O-N 3.13Å; L541-M543 VanDerWaalsContact C-N 3.27Å; L541-M543 PolarHBondContact O-N 3.4Å
544	R	84.5	Confident	87.3	Confident	129 Å²	129	82.5 Å²	82.5	49%	0.487	40%	0.401	S	S	.	.	H	α-helix	trans	-81.6	-35.9	-179.6	-166.9	175.2	-175.7	160.5	7.1	112.9	L540 L541 D574	L540-R544 PolarHBondContact O-N 2.99Å; L541-R544 PolarHBondContact O-N 3.48Å; R544-D574 IonicContact CZ-OD1 3.66Å; R544-D574 IonicContact CZ-OD2 3.79Å; R544-D574 IonicContact NH1-OD1 3.72Å; R544-D574 PolarHBondContact NH1-OD1 2.99Å; R544-D574 IonicContact NH1-OD2 2.81Å; R544-D574 PolarHBondContact NH1-OD2 2.88Å; R544-D574 IonicContact NH2-OD1 2.84Å; R544-D574 IonicContact NH2-OD2 3.84Å; R544-D574 PolarHBondContact NH2-OD2 3.08Å
545	Y	84.8	Confident	87.3	Confident	50 Å²	50	79.8 Å²	79.8	20%	0.196	39%	0.39	C	S	.	.	S	Bend	trans	-132.4	83	-179.5	-58.7	-73.3	0	0	0	110.1	L541 M547 P577 L578	L541-Y545 HydrophobicContact CD1-CD2 3.6Å; L541-Y545 HydrophobicContact CD1-CE2 4.02Å; L541-Y545 HydrophobicContact CG-CD2 4.21Å; L541-Y545 PolarHBondContact O-N 3.02Å; Y545-M547 PolarHBondContact O-N 2.85Å; Y545-M547 VanDerWaalsContact O-N 3.12Å; Y545-P577 HydrophobicContact CD2-CB 4.28Å; Y545-P577 HydrophobicContact CE2-CB 4.06Å; Y545-P577 HydrophobicContact CE2-CG 4.09Å; Y545-L578 HydrophobicContact CD1-CD2 4.14Å; Y545-L578 HydrophobicContact CE1-CD1 4.37Å; Y545-L578 HydrophobicContact CE1-CD2 3.67Å; Y545-L578 HydrophobicContact CE1-CG 4.02Å
546	P	81.8	Confident	87.4	Confident	116 Å²	116	78.3 Å²	78.3	75%	0.753	38%	0.383	S	S	*	.			trans	-69.4	107.2	-178.7	27	-34.2	0	0	0	111.5
547	M	81.6	Confident	87.7	Confident	42 Å²	42	76 Å²	76	21%	0.207	37%	0.367	C	S	.	.			trans	-106.8	131.7	-176.2	-68.6	173.8	65.2	0	0	112.3	Y545 S549 L552 L553 L556 F581	Y545-M547 PolarHBondContact O-N 2.85Å; Y545-M547 VanDerWaalsContact O-N 3.12Å; M547-S549 PolarHBondContact O-N 3.16Å; M547-L552 HydrophobicContact CE-CB 3.93Å; M547-L552 HydrophobicContact CE-CD2 4.06Å; M547-L552 HydrophobicContact CE-CG 3.76Å; M547-L553 HydrophobicContact CB-CB 4.18Å; M547-L553 HydrophobicContact CB-CD1 4.32Å; M547-L553 HydrophobicContact CG-CD1 4.11Å; M547-L553 HydrophobicContact SD-CB 4.04Å; M547-L553 HydrophobicContact SD-CD1 3.54Å; M547-L553 VanDerWaalsContact SD-CD1 3.54Å; M547-L553 HydrophobicContact SD-CG 4.39Å; M547-L556 HydrophobicContact SD-CD2 3.93Å; M547-F581 HydrophobicContact CE-CD2 3.94Å; M547-F581 HydrophobicContact CE-CE2 3.41Å; M547-F581 VanDerWaalsContact CE-CE2 3.41Å; M547-F581 HydrophobicContact CE-CZ 4.24Å
548	R	80.8	Confident	88.1	Confident	270 Å²	270	78.7 Å²	78.7	100%	1.019	37%	0.371	S	S	*	.	S	Bend	trans	-58.9	-27.9	176.9	-63.7	-175.7	-178.1	177.9	2.2	114.2
549	S	88.2	Confident	88.2	Confident	53 Å²	53	78.2 Å²	78.2	37%	0.371	37%	0.369	S	S	.	.			trans	-102.7	99.8	-179.2	179.8	0	0	0	0	111.4	M547 R551 L552 L553	M547-S549 PolarHBondContact O-N 3.16Å; S549-R551 PolarHBondContact O-N 3.48Å; S549-L552 PolarHBondContact O-N 2.82Å; S549-L552 PolarHBondContact OG-N 2.88Å; S549-L553 PolarHBondContact O-N 3.24Å
550	Q	88.6	Confident	88.6	Confident	107 Å²	107	73.7 Å²	73.7	50%	0.5	35%	0.345	S	S	.	.	H	α-helix	trans	-64	-23.9	179.1	-163.6	68.1	-19.8	0	0	113.1	L553 K554	Q550-L553 VanDerWaalsContact OE1-CD2 3.25Å; Q550-K554 WeakPolarHBondContact O-CB 3.26Å; Q550-K554 WeakPolarHBondContact O-CG 2.99Å; Q550-K554 PolarHBondContact O-N 3.39Å; Q550-K554 VanDerWaalsContact O-N 3.13Å
551	R	90	Very high	89.1	Confident	180 Å²	180	67.7 Å²	67.7	68%	0.679	31%	0.313	S	S	*	.	H	α-helix	trans	-65.9	-44.4	170	176.7	176.7	169.9	177.4	-5.6	111	S549 A555	S549-R551 PolarHBondContact O-N 3.48Å; R551-A555 WeakPolarHBondContact O-CB 3.33Å; R551-A555 PolarHBondContact O-N 3.03Å; R551-A555 VanDerWaalsContact O-N 3.08Å
552	L	91.2	Very high	89.4	Confident	18 Å²	18	67.6 Å²	67.6	9%	0.094	31%	0.313	C	S	.	.	H	α-helix	trans	-75.8	-35	-177.3	-165.1	57.3	0	0	0	111.7	M547 S549 A555 L556 F581 L584 Q588	M547-L552 HydrophobicContact CE-CB 3.93Å; M547-L552 HydrophobicContact CE-CD2 4.06Å; M547-L552 HydrophobicContact CE-CG 3.76Å; S549-L552 PolarHBondContact O-N 2.82Å; S549-L552 PolarHBondContact OG-N 2.88Å; L552-A555 WeakPolarHBondContact O-CB 3.3Å; L552-A555 PolarHBondContact O-N 2.86Å; L552-L556 WeakPolarHBondContact O-CB 3.42Å; L552-L556 PolarHBondContact O-N 2.61Å; L552-F581 HydrophobicContact CD2-CE2 3.59Å; L552-F581 HydrophobicContact CD2-CZ 4.11Å; L552-F581 HydrophobicContact CG-CE2 3.95Å; L552-L584 HydrophobicContact CD1-CD2 4.22Å; L552-L584 HydrophobicContact CD1-CG 4.2Å; L552-Q588 HydrophobicContact CD1-CG 3.8Å
553	L	91.7	Very high	89.9	Confident	3 Å²	3	65.4 Å²	65.4	2%	0.016	30%	0.298	C	S	.	.	H	α-helix	trans	-62.1	-49.1	171.4	-175.3	64.6	0	0	0	111.8	L541 M547 S549 Q550 A555 L556 Q557	L541-L553 HydrophobicContact CD2-CD1 4.35Å; M547-L553 HydrophobicContact CB-CB 4.18Å; M547-L553 HydrophobicContact CB-CD1 4.32Å; M547-L553 HydrophobicContact CG-CD1 4.11Å; M547-L553 HydrophobicContact SD-CB 4.04Å; M547-L553 HydrophobicContact SD-CD1 3.54Å; M547-L553 VanDerWaalsContact SD-CD1 3.54Å; M547-L553 HydrophobicContact SD-CG 4.39Å; S549-L553 PolarHBondContact O-N 3.24Å; Q550-L553 VanDerWaalsContact OE1-CD2 3.25Å; L553-A555 PolarHBondContact O-N 2.84Å; L553-L556 PolarHBondContact O-N 2.81Å; L553-Q557 WeakPolarHBondContact O-CG 3.33Å; L553-Q557 PolarHBondContact O-N 2.83Å
554	K	91.4	Very high	90.3	Very high	117 Å²	117	58.3 Å²	58.3	51%	0.509	26%	0.263	S	S	.	.	H	α-helix	trans	-63.6	-28.2	175.8	-74.8	179.8	175.8	-176.2	0	112.8	Q550 K558	Q550-K554 WeakPolarHBondContact O-CB 3.26Å; Q550-K554 WeakPolarHBondContact O-CG 2.99Å; Q550-K554 PolarHBondContact O-N 3.39Å; Q550-K554 VanDerWaalsContact O-N 3.13Å; K554-K558 VanDerWaalsContact O-CG 3.28Å; K554-K558 WeakPolarHBondContact O-CG 3.34Å; K554-K558 PolarHBondContact O-N 2.93Å
555	A	92.6	Very high	90.7	Very high	16 Å²	16	54.9 Å²	54.9	13%	0.132	25%	0.251	C	S	.	.	H	α-helix	trans	-70.2	-43	170.9	0	0	0	0	0	111.2	R551 L552 L553 K558 T559 L584 L591	R551-A555 WeakPolarHBondContact O-CB 3.33Å; R551-A555 PolarHBondContact O-N 3.03Å; R551-A555 VanDerWaalsContact O-N 3.08Å; L552-A555 WeakPolarHBondContact O-CB 3.3Å; L552-A555 PolarHBondContact O-N 2.86Å; L553-A555 PolarHBondContact O-N 2.84Å; A555-K558 PolarHBondContact O-N 3.23Å; A555-T559 PolarHBondContact O-N 3.04Å; A555-T559 PolarHBondContact O-OG1 2.7Å; A555-L584 HydrophobicContact CB-CD1 4.15Å; A555-L584 HydrophobicContact CB-CD2 4.01Å; A555-L584 HydrophobicContact CB-CG 4.44Å; A555-L591 HydrophobicContact CB-CD2 3.76Å
556	L	94.3	Very high	91.1	Very high	4 Å²	4	53.3 Å²	53.3	2%	0.021	25%	0.245	C	C	.	.	H	α-helix	trans	-65.3	-47	178.6	-171.6	63.2	0	0	0	111.9	L541 M547 L552 L553 K558 T559 C560 P577 V580 F581 L584	L541-L556 HydrophobicContact CD2-CB 4.42Å; L541-L556 HydrophobicContact CD2-CD2 4.08Å; L541-L556 HydrophobicContact CD2-CG 4.02Å; M547-L556 HydrophobicContact SD-CD2 3.93Å; L552-L556 WeakPolarHBondContact O-CB 3.42Å; L552-L556 PolarHBondContact O-N 2.61Å; L553-L556 PolarHBondContact O-N 2.81Å; L556-K558 VanDerWaalsContact C-N 3.27Å; L556-K558 PolarHBondContact O-N 2.61Å; L556-T559 PolarHBondContact O-N 2.85Å; L556-C560 WeakPolarHBondContact O-CB 3.2Å; L556-C560 PolarHBondContact O-N 2.97Å; L556-C560 PolarHBondContact O-SG 3.49Å; L556-C560 VanDerWaalsContact O-SG 3.39Å; L556-P577 HydrophobicContact CD2-CB 4.26Å; L556-V580 HydrophobicContact CD1-CG1 4.4Å; L556-F581 HydrophobicContact CD1-CB 4.14Å; L556-F581 HydrophobicContact CD2-CB 4.36Å; L556-F581 HydrophobicContact CD2-CD2 4.31Å; L556-L584 VanDerWaalsContact CA-CD2 3.41Å; L556-L584 HydrophobicContact CB-CD2 3.65Å; L556-L584 HydrophobicContact CD1-CD2 3.83Å; L556-L584 HydrophobicContact CG-CD2 4.36Å; L556-L584 VanDerWaalsContact N-CD2 3.33Å
557	Q	94	Very high	91.5	Very high	17 Å²	17	47.8 Å²	47.8	8%	0.079	21%	0.209	C	C	.	.	H	α-helix	trans	-52.9	-45.3	172.9	-72.1	-178.3	-65.6	0	0	111.5	Y538 D539 L541 L553 S561	Y538-Q557 PolarHBondContact O-NE2 2.93Å; D539-Q557 PolarHBondContact O-NE2 3Å; D539-Q557 VanDerWaalsContact O-NE2 3.11Å; L541-Q557 HydrophobicContact CB-CG 3.9Å; L541-Q557 HydrophobicContact CD2-CB 4.49Å; L541-Q557 HydrophobicContact CD2-CG 3.65Å; L541-Q557 HydrophobicContact CG-CG 4.39Å; L553-Q557 WeakPolarHBondContact O-CG 3.33Å; L553-Q557 PolarHBondContact O-N 2.83Å; Q557-S561 WeakPolarHBondContact O-CB 3.31Å; Q557-S561 PolarHBondContact O-N 2.86Å; Q557-S561 PolarHBondContact O-OG 3.03Å
558	K	93.9	Very high	91.8	Very high	96 Å²	96	48.4 Å²	48.4	42%	0.417	22%	0.216	S	C	.	.	H	α-helix	trans	-68.3	-45.5	178.8	-74.9	177.1	179.2	-173.7	0	113.1	K554 A555 L556 S561 A562 L591	K554-K558 VanDerWaalsContact O-CG 3.28Å; K554-K558 WeakPolarHBondContact O-CG 3.34Å; K554-K558 PolarHBondContact O-N 2.93Å; A555-K558 PolarHBondContact O-N 3.23Å; L556-K558 VanDerWaalsContact C-N 3.27Å; L556-K558 PolarHBondContact O-N 2.61Å; K558-S561 PolarHBondContact O-N 2.82Å; K558-A562 WeakPolarHBondContact O-CB 3.39Å; K558-A562 PolarHBondContact O-N 2.88Å; K558-L591 HydrophobicContact CD-CD1 4.35Å
559	T	94.1	Very high	92.2	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-66.6	-45	-179.6	-60.5	0	0	0	0	111.4	A555 L556 A562 L563 V580 F595	A555-T559 PolarHBondContact O-N 3.04Å; A555-T559 PolarHBondContact O-OG1 2.7Å; L556-T559 PolarHBondContact O-N 2.85Å; T559-A562 PolarHBondContact O-N 3.2Å; T559-L563 WeakPolarHBondContact O-CG 3.36Å; T559-L563 PolarHBondContact O-N 3.3Å; T559-V580 HydrophobicContact CG2-CG1 3.85Å; T559-F595 HydrophobicContact CG2-CB 4.3Å
560	C	95.2	Very high	92.4	Very high	0 Å²	0	33 Å²	33	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.8	-41.9	174.3	-63.9	0	0	0	0	111.4	Y538 L556 A562 L563 A564	Y538-C560 HydrophobicContact CD1-CB 4.24Å; Y538-C560 HydrophobicContact CD2-CB 3.72Å; Y538-C560 HydrophobicContact CE1-CB 4.1Å; Y538-C560 HydrophobicContact CE2-CB 3.56Å; Y538-C560 WeakPolarHBondContact CE2-O 3.45Å; Y538-C560 HydrophobicContact CG-CB 4.05Å; L556-C560 WeakPolarHBondContact O-CB 3.2Å; L556-C560 PolarHBondContact O-N 2.97Å; L556-C560 PolarHBondContact O-SG 3.49Å; L556-C560 VanDerWaalsContact O-SG 3.39Å; C560-A562 VanDerWaalsContact C-N 3.34Å; C560-A562 PolarHBondContact O-N 2.88Å; C560-L563 WeakPolarHBondContact O-CB 3.48Å; C560-L563 PolarHBondContact O-N 3.11Å; C560-L563 VanDerWaalsContact O-N 3.11Å; C560-A564 PolarHBondContact O-N 3.39Å
561	S	95.6	Very high	92.5	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-59.5	-43.3	175.3	-62.7	0	0	0	0	112.3	H535 Q557 K558 L563 A564 Y565	H535-S561 PolarHBondContact N-OG 2.85Å; Q557-S561 WeakPolarHBondContact O-CB 3.31Å; Q557-S561 PolarHBondContact O-N 2.86Å; Q557-S561 PolarHBondContact O-OG 3.03Å; K558-S561 PolarHBondContact O-N 2.82Å; S561-L563 VanDerWaalsContact C-N 3.31Å; S561-L563 PolarHBondContact O-N 3.05Å; S561-A564 PolarHBondContact O-N 2.84Å; S561-Y565 WeakPolarHBondContact O-CB 3.45Å; S561-Y565 WeakPolarHBondContact O-CD2 3.26Å; S561-Y565 PolarHBondContact O-N 3.4Å
562	A	94.5	Very high	92.4	Very high	3 Å²	3	20.9 Å²	20.9	3%	0.025	10%	0.102	C	C	.	.	H	α-helix	trans	-62.5	-37.5	175.5	0	0	0	0	0	112	F526 L529 K558 T559 C560 W566 F595	F526-A562 HydrophobicContact CE2-CB 4.04Å; L529-A562 HydrophobicContact CB-CB 4.15Å; K558-A562 WeakPolarHBondContact O-CB 3.39Å; K558-A562 PolarHBondContact O-N 2.88Å; T559-A562 PolarHBondContact O-N 3.2Å; C560-A562 VanDerWaalsContact C-N 3.34Å; C560-A562 PolarHBondContact O-N 2.88Å; A562-W566 VanDerWaalsContact O-CB 3.3Å; A562-W566 WeakPolarHBondContact O-CB 3.14Å; A562-W566 PolarHBondContact O-N 2.82Å; A562-W566 VanDerWaalsContact O-N 3.12Å; A562-F595 HydrophobicContact CB-CD2 3.63Å; A562-F595 HydrophobicContact CB-CE2 3.79Å
563	L	95.2	Very high	92.3	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-65	-48.7	174.1	-68.7	167.3	0	0	0	111.5	T559 C560 S561 Y565 W566 C567 F570 L576 V580 F595 A598 A599 L602	T559-L563 WeakPolarHBondContact O-CG 3.36Å; T559-L563 PolarHBondContact O-N 3.3Å; C560-L563 WeakPolarHBondContact O-CB 3.48Å; C560-L563 PolarHBondContact O-N 3.11Å; C560-L563 VanDerWaalsContact O-N 3.11Å; S561-L563 VanDerWaalsContact C-N 3.31Å; S561-L563 PolarHBondContact O-N 3.05Å; L563-Y565 VanDerWaalsContact C-N 3.34Å; L563-Y565 PolarHBondContact O-N 3.29Å; L563-W566 HydrophobicContact CD2-CE3 3.72Å; L563-W566 HydrophobicContact CD2-CZ3 3.74Å; L563-W566 WeakPolarHBondContact O-CB 3.48Å; L563-W566 PolarHBondContact O-N 2.77Å; L563-W566 VanDerWaalsContact O-N 3.09Å; L563-C567 PolarHBondContact O-N 3.43Å; L563-F570 HydrophobicContact CB-CB 4.43Å; L563-F570 HydrophobicContact CB-CD2 4.01Å; L563-F570 HydrophobicContact CB-CG 4.4Å; L563-L576 HydrophobicContact CB-CD2 4.23Å; L563-L576 HydrophobicContact CD1-CD2 4.18Å; L563-V580 HydrophobicContact CD1-CG1 4.24Å; L563-V580 HydrophobicContact CD1-CG2 3.73Å; L563-F595 HydrophobicContact CD2-CD2 3.88Å; L563-F595 HydrophobicContact CD2-CE2 3.64Å; L563-F595 HydrophobicContact CD2-CZ 4.43Å; L563-F595 HydrophobicContact CG-CD2 3.98Å; L563-F595 HydrophobicContact CG-CE2 3.97Å; L563-A598 HydrophobicContact CD1-CB 4.28Å; L563-A599 HydrophobicContact CD2-CB 4.01Å; L563-L602 HydrophobicContact CD1-CD1 4.09Å; L563-L602 HydrophobicContact CD2-CD1 4.11Å
564	A	93.1	Very high	92.2	Very high	3 Å²	3	23.8 Å²	23.8	3%	0.025	12%	0.117	C	C	.	.	H	α-helix	trans	-61.1	-39.2	176.1	0	0	0	0	0	113.2	H535 Y538 C560 S561 W566 C567 P568 F570	H535-A564 HydrophobicContact CB-CB 4.28Å; Y538-A564 HydrophobicContact CE2-CB 3.79Å; C560-A564 PolarHBondContact O-N 3.39Å; S561-A564 PolarHBondContact O-N 2.84Å; A564-W566 PolarHBondContact O-N 3.12Å; A564-C567 CarbonylContact O-C 3.56Å; A564-C567 VanDerWaalsContact O-C 3.3Å; A564-P568 WeakPolarHBondContact O-CA 3.4Å; A564-F570 HydrophobicContact CB-CB 4.42Å
565	Y	93	Very high	92.3	Very high	58 Å²	58	19.4 Å²	19.4	23%	0.227	10%	0.098	C	C	.	.	H	α-helix	trans	-73.8	-11.2	175.6	-76.7	-49	0	0	0	115.1	L529 K532 I534 H535 S561 L563	L529-Y565 WeakPolarHBondContact CD2-O 3.27Å; K532-Y565 HydrophobicContact CB-CD1 4.22Å; K532-Y565 HydrophobicContact CB-CD2 3.66Å; K532-Y565 HydrophobicContact CB-CE1 4.09Å; K532-Y565 HydrophobicContact CB-CE2 3.54Å; K532-Y565 HydrophobicContact CB-CG 4.02Å; K532-Y565 HydrophobicContact CD-CD1 3.52Å; K532-Y565 HydrophobicContact CD-CD2 4Å; K532-Y565 HydrophobicContact CD-CE1 4.07Å; K532-Y565 HydrophobicContact CD-CG 3.48Å; K532-Y565 VanDerWaalsContact CD-CG 3.48Å; K532-Y565 HydrophobicContact CG-CG 4.43Å; K532-Y565 PolarHBondContact NZ-O 3.39Å; K532-Y565 VanDerWaalsContact NZ-O 3.12Å; K532-Y565 PolarHBondContact O-OH 3.05Å; I534-Y565 PolarHBondContact O-OH 2.9Å; H535-Y565 HydrophobicContact CB-CD2 4.37Å; H535-Y565 HydrophobicContact CB-CE2 3.9Å; H535-Y565 AromaticContact CD2-CD1 3.88Å; H535-Y565 AromaticContact CD2-CE1 3.63Å; H535-Y565 AromaticContact CD2-CZ 3.9Å; S561-Y565 WeakPolarHBondContact O-CB 3.45Å; S561-Y565 WeakPolarHBondContact O-CD2 3.26Å; S561-Y565 PolarHBondContact O-N 3.4Å; L563-Y565 VanDerWaalsContact C-N 3.34Å; L563-Y565 PolarHBondContact O-N 3.29Å
566	W	92.3	Very high	92.4	Very high	17 Å²	17	18.6 Å²	18.6	6%	0.064	9%	0.091	C	C	.	.	H	α-helix	trans	-94.8	-43.5	174.2	164	51.9	0	0	0	111.8	L529 A562 L563 A564 F570 F595 A599 I603 L765 Y770 P771	L529-W566 HydrophobicContact CD1-CB 4.01Å; L529-W566 HydrophobicContact CD2-CB 4.05Å; A562-W566 VanDerWaalsContact O-CB 3.3Å; A562-W566 WeakPolarHBondContact O-CB 3.14Å; A562-W566 PolarHBondContact O-N 2.82Å; A562-W566 VanDerWaalsContact O-N 3.12Å; L563-W566 HydrophobicContact CD2-CE3 3.72Å; L563-W566 HydrophobicContact CD2-CZ3 3.74Å; L563-W566 WeakPolarHBondContact O-CB 3.48Å; L563-W566 PolarHBondContact O-N 2.77Å; L563-W566 VanDerWaalsContact O-N 3.09Å; A564-W566 PolarHBondContact O-N 3.12Å; W566-F570 HydrophobicContact CE3-CD2 4.33Å; W566-F570 AromaticContact CE3-CE2 3.92Å; W566-F570 HydrophobicContact CE3-CE2 3.92Å; W566-F570 AromaticContact CZ3-CE2 3.7Å; W566-F570 HydrophobicContact CZ3-CE2 3.7Å; W566-F595 HydrophobicContact CB-CZ 4.31Å; W566-F595 HydrophobicContact CD2-CZ 4.26Å; W566-F595 HydrophobicContact CE3-CE2 4.46Å; W566-F595 HydrophobicContact CE3-CZ 4.25Å; W566-F595 HydrophobicContact CG-CZ 4.33Å; W566-A599 HydrophobicContact CE3-CB 4.18Å; W566-A599 HydrophobicContact CH2-CB 3.46Å; W566-A599 VanDerWaalsContact CH2-CB 3.46Å; W566-A599 HydrophobicContact CZ2-CB 4.27Å; W566-A599 HydrophobicContact CZ3-CB 3.41Å; W566-A599 VanDerWaalsContact CZ3-CB 3.41Å; W566-I603 HydrophobicContact CH2-CD1 3.93Å; W566-I603 HydrophobicContact CH2-CG1 4.05Å; W566-I603 HydrophobicContact CZ2-CD1 3.95Å; W566-I603 HydrophobicContact CZ2-CG1 4.43Å; W566-L765 HydrophobicContact CH2-CD2 4.39Å; W566-L765 HydrophobicContact CZ2-CD2 4.08Å; W566-Y770 VanDerWaalsContact NE1-CB 3.27Å; W566-Y770 PolarHBondContact NE1-O 2.72Å; W566-P771 WeakPolarHBondContact CZ2-O 3.38Å
567	C	90.1	Very high	92.4	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.092	C	C	.	.	S	Bend	trans	-133.8	108.5	174.5	-171.1	0	0	0	0	109.2	L563 A564 L569 F570 I772	L563-C567 PolarHBondContact O-N 3.43Å; A564-C567 CarbonylContact O-C 3.56Å; A564-C567 VanDerWaalsContact O-C 3.3Å; C567-L569 PolarHBondContact O-N 3.1Å; C567-L569 VanDerWaalsContact O-N 3.09Å; C567-F570 HydrophobicContact CB-CD2 3.65Å; C567-F570 HydrophobicContact CB-CE2 3.75Å; C567-F570 WeakPolarHBondContact O-CB 3.44Å; C567-F570 PolarHBondContact O-N 3.09Å; C567-I772 HydrophobicContact CB-CG2 4.08Å
568	P	87.9	Confident	92.4	Very high	55 Å²	55	21 Å²	21	36%	0.357	10%	0.104	S	C	.	.	G	3₁₀ helix	trans	-57.8	-30.2	-170.2	-27.4	34.8	0	0	0	115	A564 F570 G571 I785	A564-P568 WeakPolarHBondContact O-CA 3.4Å; P568-F570 PolarHBondContact O-N 3.12Å; P568-F570 VanDerWaalsContact O-N 3.09Å; P568-G571 PolarHBondContact O-N 3.33Å; P568-I785 HydrophobicContact CB-CD1 3.44Å; P568-I785 VanDerWaalsContact CB-CD1 3.44Å
569	L	90	Very high	92.4	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.085	C	C	.	.	G	3₁₀ helix	trans	-41.1	-40.8	167.9	168.1	69.7	0	0	0	113.6	C567 G571 E572 T573 F610 F613 Y776 V781	C567-L569 PolarHBondContact O-N 3.1Å; C567-L569 VanDerWaalsContact O-N 3.09Å; L569-G571 VanDerWaalsContact C-N 3.3Å; L569-G571 PolarHBondContact O-N 2.86Å; L569-E572 PolarHBondContact O-N 3.44Å; L569-E572 VanDerWaalsContact O-N 3.1Å; L569-T573 PolarHBondContact O-N 3.35Å; L569-T573 PolarHBondContact O-OG1 3.25Å; L569-F610 HydrophobicContact CD1-CB 4.34Å; L569-F610 HydrophobicContact CD1-CD1 3.91Å; L569-F610 HydrophobicContact CD1-CG 4.32Å; L569-F610 HydrophobicContact CD2-CB 3.87Å; L569-F610 HydrophobicContact CD2-CD1 3.67Å; L569-F610 HydrophobicContact CD2-CD2 3.83Å; L569-F610 HydrophobicContact CD2-CE1 4.1Å; L569-F610 HydrophobicContact CD2-CE2 4.27Å; L569-F610 HydrophobicContact CD2-CG 3.51Å; L569-F610 HydrophobicContact CD2-CZ 4.39Å; L569-F610 HydrophobicContact CG-CD1 4.1Å; L569-F610 HydrophobicContact CG-CE1 4.44Å; L569-F610 HydrophobicContact CG-CG 4.39Å; L569-F613 HydrophobicContact CD1-CB 4.38Å; L569-F613 HydrophobicContact CD1-CD1 3.96Å; L569-F613 HydrophobicContact CD1-CD2 3.63Å; L569-F613 HydrophobicContact CD1-CE1 4.17Å; L569-F613 HydrophobicContact CD1-CE2 3.85Å; L569-F613 HydrophobicContact CD1-CG 3.69Å; L569-F613 HydrophobicContact CD1-CZ 4.12Å; L569-Y776 HydrophobicContact CB-CD1 4.12Å; L569-Y776 HydrophobicContact CB-CD2 4.5Å; L569-Y776 HydrophobicContact CB-CE1 3.97Å; L569-Y776 HydrophobicContact CB-CE2 4.37Å; L569-Y776 HydrophobicContact CB-CG 4.37Å; L569-Y776 HydrophobicContact CD1-CG 4.27Å; L569-Y776 HydrophobicContact CD2-CD1 3.67Å; L569-Y776 HydrophobicContact CD2-CE1 4.22Å; L569-Y776 HydrophobicContact CD2-CG 4.04Å; L569-Y776 HydrophobicContact CG-CD1 4.37Å; L569-Y776 HydrophobicContact CG-CG 4.47Å; L569-V781 HydrophobicContact CB-CG1 4.42Å; L569-V781 HydrophobicContact CD1-CG2 4.02Å
570	F	92.8	Very high	92.5	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.085	C	C	.	.	G	3₁₀ helix	trans	-67.2	-29.3	-177.4	-72.3	-42.6	0	0	0	112.9	Y538 L563 A564 W566 C567 P568 E572 T573 L576 L602 F610 I773	Y538-F570 PolarHBondContact OH-O 2.99Å; L563-F570 HydrophobicContact CB-CB 4.43Å; L563-F570 HydrophobicContact CB-CD2 4.01Å; L563-F570 HydrophobicContact CB-CG 4.4Å; A564-F570 HydrophobicContact CB-CB 4.42Å; W566-F570 HydrophobicContact CE3-CD2 4.33Å; W566-F570 AromaticContact CE3-CE2 3.92Å; W566-F570 HydrophobicContact CE3-CE2 3.92Å; W566-F570 AromaticContact CZ3-CE2 3.7Å; W566-F570 HydrophobicContact CZ3-CE2 3.7Å; C567-F570 HydrophobicContact CB-CD2 3.65Å; C567-F570 HydrophobicContact CB-CE2 3.75Å; C567-F570 WeakPolarHBondContact O-CB 3.44Å; C567-F570 PolarHBondContact O-N 3.09Å; P568-F570 PolarHBondContact O-N 3.12Å; P568-F570 VanDerWaalsContact O-N 3.09Å; F570-E572 PolarHBondContact O-N 3.36Å; F570-T573 WeakPolarHBondContact O-CB 3.21Å; F570-T573 PolarHBondContact O-N 2.88Å; F570-L576 HydrophobicContact CB-CD2 3.63Å; F570-L576 HydrophobicContact CD1-CD1 3.84Å; F570-L576 HydrophobicContact CD1-CD2 3.93Å; F570-L576 HydrophobicContact CD1-CG 4.48Å; F570-L576 HydrophobicContact CE1-CD1 4.13Å; F570-L576 HydrophobicContact CG-CD2 3.89Å; F570-L602 HydrophobicContact CE1-CD1 4.08Å; F570-L602 HydrophobicContact CE1-CD2 4.1Å; F570-L602 HydrophobicContact CE1-CG 4.46Å; F570-L602 HydrophobicContact CE2-CD1 4.31Å; F570-L602 HydrophobicContact CZ-CB 3.92Å; F570-L602 HydrophobicContact CZ-CD1 3.82Å; F570-L602 HydrophobicContact CZ-CD2 4.35Å; F570-L602 HydrophobicContact CZ-CG 4.25Å; F570-F610 HydrophobicContact CE1-CE1 4.49Å; F570-F610 HydrophobicContact CE1-CE2 4.34Å; F570-F610 AromaticContact CE1-CZ 3.83Å; F570-F610 HydrophobicContact CE1-CZ 3.83Å; F570-I773 HydrophobicContact CE2-CD1 4.42Å; F570-I773 HydrophobicContact CZ-CD1 3.75Å
571	G	88.8	Confident	92.4	Very high	4 Å²	4	19.6 Å²	19.6	4%	0.041	10%	0.099	C	C	.	.	G	3₁₀ helix	trans	-65	-21.3	172.7	0	0	0	0	0	114.1	A537 P568 L569 R788	A537-G571 VanDerWaalsContact CB-O 3.27Å; A537-G571 WeakPolarHBondContact CB-O 3.3Å; P568-G571 PolarHBondContact O-N 3.33Å; L569-G571 VanDerWaalsContact C-N 3.3Å; L569-G571 PolarHBondContact O-N 2.86Å; G571-R788 PolarHBondContact O-NH1 3.1Å
572	E	87.9	Confident	92.4	Very high	27 Å²	27	20.1 Å²	20.1	13%	0.126	10%	0.102	C	C	.	.	G	3₁₀ helix	trans	-97.6	-2.8	173.3	-55.1	-53.7	118.8	0	0	112.4	L569 F570 D574 F613 H784 I785 R788	L569-E572 PolarHBondContact O-N 3.44Å; L569-E572 VanDerWaalsContact O-N 3.1Å; F570-E572 PolarHBondContact O-N 3.36Å; E572-D574 PolarHBondContact O-N 3Å; E572-F613 HydrophobicContact CB-CE1 3.99Å; E572-F613 HydrophobicContact CB-CZ 3.61Å; E572-H784 HydrophobicContact CG-CB 4.38Å; E572-I785 HydrophobicContact CG-CG1 4.26Å; E572-R788 VanDerWaalsContact OE1-CD 3.24Å; E572-R788 WeakPolarHBondContact OE1-CD 3.5Å; E572-R788 IonicContact OE1-CZ 3.3Å; E572-R788 IonicContact OE1-NE 2.72Å; E572-R788 IonicContact OE1-NH1 2.79Å; E572-R788 PolarHBondContact OE1-NH1 2.93Å; E572-R788 WeakPolarHBondContact OE2-CD 3.29Å; E572-R788 IonicContact OE2-CZ 3.04Å; E572-R788 IonicContact OE2-NE 2.79Å; E572-R788 PolarHBondContact OE2-NE 2.97Å; E572-R788 VanDerWaalsContact OE2-NE 3.11Å; E572-R788 IonicContact OE2-NH1 3.17Å; E572-R788 PolarHBondContact OE2-NH1 2.82Å; E572-R788 IonicContact OE2-NH2 3.83Å
573	T	90.4	Very high	92.3	Very high	2 Å²	2	20 Å²	20	1%	0.012	10%	0.101	C	C	.	.			trans	-94.8	91.2	-174.2	-57.1	0	0	0	0	111.6	L569 F570 W575 L576 F610	L569-T573 PolarHBondContact O-N 3.35Å; L569-T573 PolarHBondContact O-OG1 3.25Å; F570-T573 WeakPolarHBondContact O-CB 3.21Å; F570-T573 PolarHBondContact O-N 2.88Å; T573-W575 VanDerWaalsContact C-N 3.34Å; T573-W575 HydrophobicContact CG2-CD2 3.8Å; T573-W575 HydrophobicContact CG2-CE3 4.36Å; T573-W575 HydrophobicContact CG2-CG 4.24Å; T573-W575 HydrophobicContact CG2-CH2 4.2Å; T573-W575 HydrophobicContact CG2-CZ2 3.62Å; T573-W575 PolarHBondContact O-N 3.27Å; T573-L576 HydrophobicContact CG2-CB 4.02Å; T573-L576 VanDerWaalsContact O-CB 3.27Å; T573-L576 WeakPolarHBondContact O-CB 3.37Å; T573-L576 PolarHBondContact O-N 3.49Å; T573-L576 VanDerWaalsContact O-N 3.17Å; T573-F610 HydrophobicContact CG2-CE1 4.35Å
574	D	89	Confident	92.3	Very high	80 Å²	80	20 Å²	20	43%	0.428	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-37.8	-175.2	-97.2	4.3	0	0	0	115.6	R544 E572 L576 P577	R544-D574 IonicContact CZ-OD1 3.66Å; R544-D574 IonicContact CZ-OD2 3.79Å; R544-D574 IonicContact NH1-OD1 3.72Å; R544-D574 PolarHBondContact NH1-OD1 2.99Å; R544-D574 IonicContact NH1-OD2 2.81Å; R544-D574 PolarHBondContact NH1-OD2 2.88Å; R544-D574 IonicContact NH2-OD1 2.84Å; R544-D574 IonicContact NH2-OD2 3.84Å; R544-D574 PolarHBondContact NH2-OD2 3.08Å; E572-D574 PolarHBondContact O-N 3Å; D574-L576 VanDerWaalsContact C-N 3.34Å; D574-P577 VanDerWaalsContact O-CD 3.31Å; D574-P577 WeakPolarHBondContact O-CD 3.34Å
575	W	92.9	Very high	92.2	Very high	25 Å²	25	23.4 Å²	23.4	10%	0.095	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-8.2	-177.3	54	-97.1	0	0	0	113.9	T573 P577 L578 F579 W609 F610 W651 Q655	T573-W575 VanDerWaalsContact C-N 3.34Å; T573-W575 HydrophobicContact CG2-CD2 3.8Å; T573-W575 HydrophobicContact CG2-CE3 4.36Å; T573-W575 HydrophobicContact CG2-CG 4.24Å; T573-W575 HydrophobicContact CG2-CH2 4.2Å; T573-W575 HydrophobicContact CG2-CZ2 3.62Å; T573-W575 PolarHBondContact O-N 3.27Å; W575-P577 VanDerWaalsContact C-CD 3.43Å; W575-L578 WeakPolarHBondContact O-CB 3.42Å; W575-L578 PolarHBondContact O-N 3.46Å; W575-F579 HydrophobicContact CE3-CB 3.9Å; W575-F579 HydrophobicContact CE3-CG 4.45Å; W575-F579 HydrophobicContact CZ3-CB 3.89Å; W575-F579 HydrophobicContact CZ3-CD2 4.24Å; W575-F579 AromaticContact CZ3-CG 4Å; W575-F579 HydrophobicContact CZ3-CG 4Å; W575-F579 PolarHBondContact O-N 3.46Å; W575-W609 AromaticContact CH2-CE3 3.74Å; W575-W609 HydrophobicContact CH2-CE3 3.74Å; W575-W609 AromaticContact CH2-CZ3 3.89Å; W575-W609 HydrophobicContact CH2-CZ3 3.89Å; W575-W609 HydrophobicContact CZ2-CE3 4.05Å; W575-W609 HydrophobicContact CZ2-CZ3 4.47Å; W575-W609 HydrophobicContact CZ3-CE3 4.49Å; W575-W609 HydrophobicContact CZ3-CZ3 4.19Å; W575-F610 HydrophobicContact CH2-CE1 4.15Å; W575-F610 AromaticContact CH2-CZ 3.94Å; W575-F610 HydrophobicContact CH2-CZ 3.94Å; W575-F610 AromaticContact CZ2-CE1 3.7Å; W575-F610 HydrophobicContact CZ2-CE1 3.7Å; W575-F610 AromaticContact CZ2-CZ 3.98Å; W575-F610 HydrophobicContact CZ2-CZ 3.98Å; W575-W651 AromaticContact CD1-CZ2 3.79Å; W575-W651 HydrophobicContact CD2-CH2 4.3Å; W575-W651 AromaticContact CE2-CH2 3.71Å; W575-W651 HydrophobicContact CG-CZ2 4.43Å; W575-W651 AromaticContact CZ2-CH2 3.99Å; W575-W651 HydrophobicContact CZ2-CH2 3.99Å; W575-W651 AromaticContact NE1-CH2 3.61Å; W575-W651 AromaticContact NE1-CZ2 3.56Å; W575-Q655 HydrophobicContact CB-CB 4.19Å; W575-Q655 HydrophobicContact CB-CG 4.02Å; W575-Q655 HydrophobicContact CG-CG 4.06Å
576	L	94.8	Very high	92.1	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-55.2	-40.7	-176.1	-172	72.6	0	0	0	114.3	Y538 L563 F570 T573 D574 L578 F579 V580 L602	Y538-L576 WeakPolarHBondContact OH-CD2 3.26Å; L563-L576 HydrophobicContact CB-CD2 4.23Å; L563-L576 HydrophobicContact CD1-CD2 4.18Å; F570-L576 HydrophobicContact CB-CD2 3.63Å; F570-L576 HydrophobicContact CD1-CD1 3.84Å; F570-L576 HydrophobicContact CD1-CD2 3.93Å; F570-L576 HydrophobicContact CD1-CG 4.48Å; F570-L576 HydrophobicContact CE1-CD1 4.13Å; F570-L576 HydrophobicContact CG-CD2 3.89Å; T573-L576 HydrophobicContact CG2-CB 4.02Å; T573-L576 VanDerWaalsContact O-CB 3.27Å; T573-L576 WeakPolarHBondContact O-CB 3.37Å; T573-L576 PolarHBondContact O-N 3.49Å; T573-L576 VanDerWaalsContact O-N 3.17Å; D574-L576 VanDerWaalsContact C-N 3.34Å; L576-L578 VanDerWaalsContact C-N 3.26Å; L576-L578 PolarHBondContact O-N 3.29Å; L576-F579 PolarHBondContact O-N 2.94Å; L576-V580 HydrophobicContact CD1-CG2 3.73Å; L576-V580 HydrophobicContact CG-CG2 3.87Å; L576-V580 WeakPolarHBondContact O-CB 3.2Å; L576-V580 VanDerWaalsContact O-CG2 3.26Å; L576-V580 WeakPolarHBondContact O-CG2 3.3Å; L576-V580 PolarHBondContact O-N 3.41Å; L576-L602 HydrophobicContact CD1-CD1 3.79Å; L576-L602 HydrophobicContact CD1-CD2 3.93Å
577	P	94.7	Very high	91.8	Very high	5 Å²	5	21.9 Å²	21.9	3%	0.032	11%	0.112	C	C	.	.	H	α-helix	trans	-62.2	-33.5	178.5	-22.6	35.5	0	0	0	113	Y538 L541 Y545 L556 D574 W575 F581	Y538-P577 HydrophobicContact CE1-CG 4.29Å; L541-P577 HydrophobicContact CD1-CB 3.98Å; L541-P577 HydrophobicContact CD1-CG 3.66Å; Y545-P577 HydrophobicContact CD2-CB 4.28Å; Y545-P577 HydrophobicContact CE2-CB 4.06Å; Y545-P577 HydrophobicContact CE2-CG 4.09Å; L556-P577 HydrophobicContact CD2-CB 4.26Å; D574-P577 VanDerWaalsContact O-CD 3.31Å; D574-P577 WeakPolarHBondContact O-CD 3.34Å; W575-P577 VanDerWaalsContact C-CD 3.43Å; P577-F581 WeakPolarHBondContact O-CB 3.25Å; P577-F581 PolarHBondContact O-N 3.42Å; P577-F581 VanDerWaalsContact O-N 3.11Å
578	L	93.3	Very high	91.4	Very high	65 Å²	65	26.2 Å²	26.2	34%	0.34	13%	0.132	S	C	.	.	H	α-helix	trans	-68.3	-49.3	176.3	-62.9	173.1	0	0	0	110.6	Y545 W575 L576 V580 P582 T656	Y545-L578 HydrophobicContact CD1-CD2 4.14Å; Y545-L578 HydrophobicContact CE1-CD1 4.37Å; Y545-L578 HydrophobicContact CE1-CD2 3.67Å; Y545-L578 HydrophobicContact CE1-CG 4.02Å; W575-L578 WeakPolarHBondContact O-CB 3.42Å; W575-L578 PolarHBondContact O-N 3.46Å; L576-L578 VanDerWaalsContact C-N 3.26Å; L576-L578 PolarHBondContact O-N 3.29Å; L578-V580 PolarHBondContact O-N 2.64Å; L578-P582 WeakPolarHBondContact O-CD 3.32Å; L578-T656 HydrophobicContact CB-CG2 4.39Å
579	F	95.5	Very high	91.2	Very high	1 Å²	1	30.9 Å²	30.9	0%	0.004	15%	0.154	C	C	.	.	H	α-helix	trans	-63	-38.4	178.9	-167.7	-93.3	0	0	0	113.3	W575 L576 F583 I601 L602 W609 L654 Q655 W671	W575-F579 HydrophobicContact CE3-CB 3.9Å; W575-F579 HydrophobicContact CE3-CG 4.45Å; W575-F579 HydrophobicContact CZ3-CB 3.89Å; W575-F579 HydrophobicContact CZ3-CD2 4.24Å; W575-F579 AromaticContact CZ3-CG 4Å; W575-F579 HydrophobicContact CZ3-CG 4Å; W575-F579 PolarHBondContact O-N 3.46Å; L576-F579 PolarHBondContact O-N 2.94Å; F579-F583 HydrophobicContact CD1-CE2 4.2Å; F579-F583 AromaticContact CE1-CE2 3.95Å; F579-F583 HydrophobicContact CE1-CE2 3.95Å; F579-F583 HydrophobicContact CZ-CE2 4.43Å; F579-F583 VanDerWaalsContact O-CD2 3.23Å; F579-F583 WeakPolarHBondContact O-CD2 3.27Å; F579-F583 VanDerWaalsContact O-CE2 3.23Å; F579-F583 WeakPolarHBondContact O-CE2 3.43Å; F579-I601 HydrophobicContact CE1-CG2 3.87Å; F579-I601 HydrophobicContact CZ-CG2 3.94Å; F579-L602 HydrophobicContact CD1-CD2 3.95Å; F579-L602 HydrophobicContact CE1-CD2 3.97Å; F579-L602 HydrophobicContact CE1-CG 4.38Å; F579-W609 HydrophobicContact CE2-CH2 4.1Å; F579-W609 HydrophobicContact CE2-CZ3 4.45Å; F579-L654 WeakPolarHBondContact CD2-O 3.47Å; F579-Q655 WeakPolarHBondContact CB-O 3.31Å; F579-Q655 PolarHBondContact N-O 2.8Å; F579-W671 HydrophobicContact CZ-CH2 4.31Å
580	V	94.9	Very high	91.2	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.006	17%	0.169	C	C	.	.	H	α-helix	trans	-82.8	-26.3	-174.7	173.7	0	0	0	0	112.7	L556 T559 L563 L576 L578 F583 L584 A598 L602	L556-V580 HydrophobicContact CD1-CG1 4.4Å; T559-V580 HydrophobicContact CG2-CG1 3.85Å; L563-V580 HydrophobicContact CD1-CG1 4.24Å; L563-V580 HydrophobicContact CD1-CG2 3.73Å; L576-V580 HydrophobicContact CD1-CG2 3.73Å; L576-V580 HydrophobicContact CG-CG2 3.87Å; L576-V580 WeakPolarHBondContact O-CB 3.2Å; L576-V580 VanDerWaalsContact O-CG2 3.26Å; L576-V580 WeakPolarHBondContact O-CG2 3.3Å; L576-V580 PolarHBondContact O-N 3.41Å; L578-V580 PolarHBondContact O-N 2.64Å; V580-F583 PolarHBondContact O-N 3.32Å; V580-L584 PolarHBondContact O-N 2.89Å; V580-L584 VanDerWaalsContact O-N 3.1Å; V580-A598 HydrophobicContact CG1-CB 4.09Å; V580-A598 HydrophobicContact CG2-CB 4.17Å; V580-L602 HydrophobicContact CG2-CD1 4.47Å
581	F	94.7	Very high	91.2	Very high	65 Å²	65	35.6 Å²	35.6	29%	0.285	18%	0.179	S	C	.	.	H	α-helix	trans	-57.4	-43.5	-174.9	170.3	-108.2	0	0	0	115.1	M547 L552 L556 P577 F583 L584 K585	M547-F581 HydrophobicContact CE-CD2 3.94Å; M547-F581 HydrophobicContact CE-CE2 3.41Å; M547-F581 VanDerWaalsContact CE-CE2 3.41Å; M547-F581 HydrophobicContact CE-CZ 4.24Å; L552-F581 HydrophobicContact CD2-CE2 3.59Å; L552-F581 HydrophobicContact CD2-CZ 4.11Å; L552-F581 HydrophobicContact CG-CE2 3.95Å; L556-F581 HydrophobicContact CD1-CB 4.14Å; L556-F581 HydrophobicContact CD2-CB 4.36Å; L556-F581 HydrophobicContact CD2-CD2 4.31Å; P577-F581 WeakPolarHBondContact O-CB 3.25Å; P577-F581 PolarHBondContact O-N 3.42Å; P577-F581 VanDerWaalsContact O-N 3.11Å; F581-F583 PolarHBondContact O-N 2.91Å; F581-L584 WeakPolarHBondContact O-CB 3.19Å; F581-L584 PolarHBondContact O-N 3.11Å; F581-K585 PolarHBondContact O-N 2.96Å
582	P	93.8	Very high	91.4	Very high	12 Å²	12	36 Å²	36	8%	0.078	18%	0.18	C	C	.	.	H	α-helix	trans	-59.6	-45.6	176.7	-27.3	36.3	0	0	0	113.5	L578 L584 K585 L586 S659 W667	L578-P582 WeakPolarHBondContact O-CD 3.32Å; P582-L584 VanDerWaalsContact C-N 3.29Å; P582-L584 PolarHBondContact O-N 3.05Å; P582-K585 WeakPolarHBondContact O-CB 3.21Å; P582-K585 PolarHBondContact O-N 3.38Å; P582-K585 VanDerWaalsContact O-N 3.16Å; P582-L586 PolarHBondContact O-N 3.09Å; P582-S659 VanDerWaalsContact CG-OG 3.25Å; P582-S659 WeakPolarHBondContact CG-OG 3.44Å; P582-W667 HydrophobicContact CB-CD2 4.31Å; P582-W667 HydrophobicContact CB-CE3 4.39Å; P582-W667 HydrophobicContact CB-CH2 3.45Å; P582-W667 VanDerWaalsContact CB-CH2 3.45Å; P582-W667 HydrophobicContact CB-CZ2 3.31Å; P582-W667 HydrophobicContact CB-CZ3 3.99Å; P582-W667 HydrophobicContact CG-CZ2 4.16Å
583	F	94.2	Very high	91.5	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-63.2	-37	177.3	-56.2	-71.2	0	0	0	111.8	W513 F579 V580 F581 L586 H587 V597 I601 W667 W671	W513-F583 HydrophobicContact CZ3-CD1 4.05Å; W513-F583 HydrophobicContact CZ3-CE1 4.28Å; F579-F583 HydrophobicContact CD1-CE2 4.2Å; F579-F583 AromaticContact CE1-CE2 3.95Å; F579-F583 HydrophobicContact CE1-CE2 3.95Å; F579-F583 HydrophobicContact CZ-CE2 4.43Å; F579-F583 VanDerWaalsContact O-CD2 3.23Å; F579-F583 WeakPolarHBondContact O-CD2 3.27Å; F579-F583 VanDerWaalsContact O-CE2 3.23Å; F579-F583 WeakPolarHBondContact O-CE2 3.43Å; V580-F583 PolarHBondContact O-N 3.32Å; F581-F583 PolarHBondContact O-N 2.91Å; F583-L586 PolarHBondContact O-N 2.71Å; F583-H587 WeakPolarHBondContact O-CB 3.4Å; F583-H587 PolarHBondContact O-N 3.03Å; F583-V597 HydrophobicContact CB-CG1 4.09Å; F583-V597 HydrophobicContact CD1-CG1 3.69Å; F583-V597 HydrophobicContact CE1-CG1 4.5Å; F583-V597 HydrophobicContact CG-CG1 4.09Å; F583-I601 HydrophobicContact CD1-CD1 3.74Å; F583-I601 HydrophobicContact CE1-CD1 3.27Å; F583-I601 HydrophobicContact CE2-CD1 4.37Å; F583-I601 HydrophobicContact CG-CD1 4.48Å; F583-I601 HydrophobicContact CZ-CD1 3.63Å; F583-I601 HydrophobicContact CZ-CG2 4.4Å; F583-W667 AromaticContact CD1-CH2 3.76Å; F583-W667 HydrophobicContact CD1-CH2 3.76Å; F583-W667 HydrophobicContact CD1-CZ2 4.32Å; F583-W667 AromaticContact CE1-CH2 3.56Å; F583-W667 HydrophobicContact CE1-CH2 3.56Å; F583-W667 AromaticContact CE1-CZ2 3.78Å; F583-W667 HydrophobicContact CE1-CZ2 3.78Å; F583-W667 HydrophobicContact CE2-CZ2 4.28Å; F583-W667 HydrophobicContact CG-CH2 4.35Å; F583-W667 HydrophobicContact CZ-CH2 4.03Å; F583-W667 AromaticContact CZ-CZ2 3.76Å; F583-W667 HydrophobicContact CZ-CZ2 3.76Å; F583-W671 AromaticContact CE1-CD2 4Å; F583-W671 HydrophobicContact CE1-CD2 4Å; F583-W671 AromaticContact CE1-CE3 3.9Å; F583-W671 HydrophobicContact CE1-CE3 3.9Å; F583-W671 HydrophobicContact CE1-CZ3 4.21Å; F583-W671 AromaticContact CZ-CD2 3.94Å; F583-W671 HydrophobicContact CZ-CD2 3.94Å; F583-W671 AromaticContact CZ-CE2 3.87Å; F583-W671 AromaticContact CZ-CE3 3.93Å; F583-W671 HydrophobicContact CZ-CE3 3.93Å; F583-W671 AromaticContact CZ-CH2 3.83Å; F583-W671 HydrophobicContact CZ-CH2 3.83Å; F583-W671 AromaticContact CZ-CZ2 3.82Å; F583-W671 HydrophobicContact CZ-CZ2 3.82Å; F583-W671 AromaticContact CZ-CZ3 3.89Å; F583-W671 HydrophobicContact CZ-CZ3 3.89Å
584	L	93.2	Very high	91.6	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-67.8	-40.8	173.1	-178.1	69.9	0	0	0	112.7	L552 A555 L556 V580 F581 P582 L586 H587 Q588 L591 A594	L552-L584 HydrophobicContact CD1-CD2 4.22Å; L552-L584 HydrophobicContact CD1-CG 4.2Å; A555-L584 HydrophobicContact CB-CD1 4.15Å; A555-L584 HydrophobicContact CB-CD2 4.01Å; A555-L584 HydrophobicContact CB-CG 4.44Å; L556-L584 VanDerWaalsContact CA-CD2 3.41Å; L556-L584 HydrophobicContact CB-CD2 3.65Å; L556-L584 HydrophobicContact CD1-CD2 3.83Å; L556-L584 HydrophobicContact CG-CD2 4.36Å; L556-L584 VanDerWaalsContact N-CD2 3.33Å; V580-L584 PolarHBondContact O-N 2.89Å; V580-L584 VanDerWaalsContact O-N 3.1Å; F581-L584 WeakPolarHBondContact O-CB 3.19Å; F581-L584 PolarHBondContact O-N 3.11Å; P582-L584 VanDerWaalsContact C-N 3.29Å; P582-L584 PolarHBondContact O-N 3.05Å; L584-L586 VanDerWaalsContact C-N 3.26Å; L584-L586 PolarHBondContact O-N 3.04Å; L584-H587 CarbonylContact O-C 3.59Å; L584-H587 PolarHBondContact O-N 3.1Å; L584-H587 VanDerWaalsContact O-N 3.13Å; L584-Q588 PolarHBondContact O-N 3.28Å; L584-L591 HydrophobicContact CD1-CD2 4.08Å; L584-A594 HydrophobicContact CD1-CB 3.6Å
585	K	91.6	Very high	91.9	Very high	75 Å²	75	32.2 Å²	32.2	33%	0.326	16%	0.16	S	C	.	.	H	α-helix	trans	-60.3	-38.1	175.9	-167.2	-168.4	-178.1	-169.1	0	111	F581 P582 Q588 E664	F581-K585 PolarHBondContact O-N 2.96Å; P582-K585 WeakPolarHBondContact O-CB 3.21Å; P582-K585 PolarHBondContact O-N 3.38Å; P582-K585 VanDerWaalsContact O-N 3.16Å; K585-Q588 WeakPolarHBondContact O-CG 3.33Å; K585-Q588 PolarHBondContact O-NE2 3.09Å; K585-E664 WeakPolarHBondContact CE-OE2 3.45Å; K585-E664 VanDerWaalsContact NZ-CD 3.35Å; K585-E664 IonicContact NZ-OE1 2.75Å; K585-E664 IonicContact NZ-OE2 3.83Å; K585-E664 PolarHBondContact NZ-OE2 2.95Å
586	L	90.3	Very high	92	Very high	34 Å²	34	31 Å²	31	18%	0.178	16%	0.156	C	C	.	.	H	α-helix	trans	-72.4	-32.3	173.8	-179.9	130.1	0	0	0	113.2	L510 W513 P582 F583 L584 L668	L510-L586 HydrophobicContact CD2-CD1 4.24Å; L510-L586 HydrophobicContact CD2-CD2 3.41Å; L510-L586 VanDerWaalsContact CD2-CD2 3.41Å; L510-L586 HydrophobicContact CD2-CG 3.69Å; W513-L586 HydrophobicContact CE3-CD2 3.93Å; W513-L586 HydrophobicContact CH2-CD1 4.17Å; W513-L586 HydrophobicContact CZ3-CD1 4.23Å; W513-L586 HydrophobicContact CZ3-CD2 3.84Å; P582-L586 PolarHBondContact O-N 3.09Å; F583-L586 PolarHBondContact O-N 2.71Å; L584-L586 VanDerWaalsContact C-N 3.26Å; L584-L586 PolarHBondContact O-N 3.04Å; L586-L668 HydrophobicContact CD1-CD2 3.22Å
587	H	87.7	Confident	91.9	Very high	9 Å²	9	31 Å²	31	4%	0.042	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	27.3	-179.2	-75.7	-58.9	0	0	0	115.6	F583 L584 N589 N590 A594 V597	F583-H587 WeakPolarHBondContact O-CB 3.4Å; F583-H587 PolarHBondContact O-N 3.03Å; L584-H587 CarbonylContact O-C 3.59Å; L584-H587 PolarHBondContact O-N 3.1Å; L584-H587 VanDerWaalsContact O-N 3.13Å; H587-N589 PolarHBondContact O-N 3.11Å; H587-N590 CarbonylContact O-C 3.59Å; H587-N590 PolarHBondContact O-N 2.73Å; H587-A594 HydrophobicContact CB-CB 3.69Å; H587-V597 WeakPolarHBondContact NE2-CG2 3.41Å
588	Q	81.6	Confident	91.9	Very high	90 Å²	90	30.8 Å²	30.8	42%	0.421	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48	-25.6	-177.5	-83.1	177.5	79.3	0	0	116.8	L552 L584 K585	L552-Q588 HydrophobicContact CD1-CG 3.8Å; L584-Q588 PolarHBondContact O-N 3.28Å; K585-Q588 WeakPolarHBondContact O-CG 3.33Å; K585-Q588 PolarHBondContact O-NE2 3.09Å
589	N	84	Confident	91.9	Very high	153 Å²	153	27.7 Å²	27.7	82%	0.818	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-16.1	-178.7	-69	-19.2	0	0	0	114.2	H587	H587-N589 PolarHBondContact O-N 3.11Å
590	N	89.7	Confident	91.7	Very high	59 Å²	59	27.7 Å²	27.7	32%	0.316	14%	0.138	S	C	.	.			trans	-146.3	108.1	177.9	-171.4	3.1	0	0	0	112.5	H587 L592 H593 A594	H587-N590 CarbonylContact O-C 3.59Å; H587-N590 PolarHBondContact O-N 2.73Å; N590-L592 VanDerWaalsContact C-N 3.27Å; N590-L592 PolarHBondContact O-N 3.32Å; N590-L592 WeakPolarHBondContact OD1-CB 3.42Å; N590-L592 PolarHBondContact OD1-N 2.85Å; N590-H593 HydrophobicContact CB-CB 4.27Å; N590-H593 PolarHBondContact ND2-CD2 3.31Å; N590-H593 PolarHBondContact ND2-CE1 3Å; N590-H593 VanDerWaalsContact ND2-CE1 3.3Å; N590-H593 PolarHBondContact ND2-ND1 2.72Å; N590-H593 PolarHBondContact ND2-NE2 3.32Å; N590-H593 PolarHBondContact O-N 2.81Å; N590-A594 PolarHBondContact O-N 2.97Å
591	L	91.5	Very high	91.7	Very high	41 Å²	41	27.6 Å²	27.6	22%	0.215	14%	0.137	C	C	.	.	H	α-helix	trans	-62.3	-30.4	178.1	-60.2	178	0	0	0	113.1	F526 A555 K558 L584 A594 F595	F526-L591 HydrophobicContact CE1-CB 4.17Å; F526-L591 HydrophobicContact CZ-CB 3.87Å; A555-L591 HydrophobicContact CB-CD2 3.76Å; K558-L591 HydrophobicContact CD-CD1 4.35Å; L584-L591 HydrophobicContact CD1-CD2 4.08Å; L591-A594 PolarHBondContact O-N 3.4Å; L591-F595 VanDerWaalsContact O-CB 3.3Å; L591-F595 WeakPolarHBondContact O-CB 3.27Å; L591-F595 PolarHBondContact O-N 2.63Å
592	L	92.8	Very high	91.6	Very high	11 Å²	11	24.5 Å²	24.5	6%	0.058	12%	0.124	C	C	.	.	H	α-helix	trans	-62.3	-49.4	174.3	173.5	66.4	0	0	0	110.5	T523 F526 N590 A594 F595 E596	T523-L592 HydrophobicContact CG2-CD2 3.77Å; F526-L592 HydrophobicContact CB-CD1 3.43Å; F526-L592 VanDerWaalsContact CB-CD1 3.43Å; F526-L592 HydrophobicContact CD1-CB 4.1Å; F526-L592 HydrophobicContact CD1-CD1 4.08Å; F526-L592 HydrophobicContact CD2-CD1 4.35Å; F526-L592 HydrophobicContact CE1-CB 4.39Å; F526-L592 HydrophobicContact CG-CB 4.46Å; F526-L592 HydrophobicContact CG-CD1 3.69Å; N590-L592 VanDerWaalsContact C-N 3.27Å; N590-L592 PolarHBondContact O-N 3.32Å; N590-L592 WeakPolarHBondContact OD1-CB 3.42Å; N590-L592 PolarHBondContact OD1-N 2.85Å; L592-A594 PolarHBondContact O-N 2.9Å; L592-F595 PolarHBondContact O-N 3.49Å; L592-E596 HydrophobicContact CD1-CG 4Å; L592-E596 WeakPolarHBondContact O-CB 3.25Å; L592-E596 WeakPolarHBondContact O-CG 3.23Å; L592-E596 PolarHBondContact O-N 3.45Å
593	H	91.9	Very high	91.4	Very high	30 Å²	30	24.9 Å²	24.9	14%	0.139	13%	0.125	C	C	.	.	H	α-helix	trans	-64.7	-39.6	177.5	-63.2	164.7	0	0	0	111.7	R514 N590 E596 V597	R514-H593 VanDerWaalsContact CZ-CE1 3.44Å; R514-H593 PolarHBondContact NH2-NE2 3.2Å; N590-H593 HydrophobicContact CB-CB 4.27Å; N590-H593 PolarHBondContact ND2-CD2 3.31Å; N590-H593 PolarHBondContact ND2-CE1 3Å; N590-H593 VanDerWaalsContact ND2-CE1 3.3Å; N590-H593 PolarHBondContact ND2-ND1 2.72Å; N590-H593 PolarHBondContact ND2-NE2 3.32Å; N590-H593 PolarHBondContact O-N 2.81Å; H593-E596 PolarHBondContact O-N 3.03Å; H593-V597 WeakPolarHBondContact O-CB 3.26Å; H593-V597 WeakPolarHBondContact O-CG2 3.42Å; H593-V597 PolarHBondContact O-N 3.1Å
594	A	92.3	Very high	91.2	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.008	13%	0.131	C	C	.	.	H	α-helix	trans	-60.7	-45.9	176	0	0	0	0	0	112	L584 H587 N590 L591 L592 A598	L584-A594 HydrophobicContact CD1-CB 3.6Å; H587-A594 HydrophobicContact CB-CB 3.69Å; N590-A594 PolarHBondContact O-N 2.97Å; L591-A594 PolarHBondContact O-N 3.4Å; L592-A594 PolarHBondContact O-N 2.9Å; A594-A598 WeakPolarHBondContact O-CB 3.2Å; A594-A598 PolarHBondContact O-N 3.32Å; A594-A598 VanDerWaalsContact O-N 3.14Å
595	F	94.9	Very high	91.1	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-63	-50.1	175.3	169.8	-91.4	0	0	0	111.7	F526 L529 T559 A562 L563 W566 L591 L592 V597 A598 A599 Y770	F526-F595 HydrophobicContact CD2-CB 3.91Å; F526-F595 AromaticContact CD2-CD1 3.68Å; F526-F595 HydrophobicContact CD2-CD1 3.68Å; F526-F595 HydrophobicContact CD2-CD2 4.3Å; F526-F595 HydrophobicContact CD2-CE1 4.33Å; F526-F595 AromaticContact CD2-CG 3.68Å; F526-F595 HydrophobicContact CD2-CG 3.68Å; F526-F595 HydrophobicContact CE2-CB 3.51Å; F526-F595 HydrophobicContact CE2-CD1 4.15Å; F526-F595 HydrophobicContact CE2-CD2 4.13Å; F526-F595 AromaticContact CE2-CG 3.65Å; F526-F595 HydrophobicContact CE2-CG 3.65Å; F526-F595 HydrophobicContact CZ-CB 4.42Å; L529-F595 HydrophobicContact CD1-CE1 4.18Å; L529-F595 HydrophobicContact CD1-CE2 3.99Å; L529-F595 HydrophobicContact CD1-CZ 3.55Å; T559-F595 HydrophobicContact CG2-CB 4.3Å; A562-F595 HydrophobicContact CB-CD2 3.63Å; A562-F595 HydrophobicContact CB-CE2 3.79Å; L563-F595 HydrophobicContact CD2-CD2 3.88Å; L563-F595 HydrophobicContact CD2-CE2 3.64Å; L563-F595 HydrophobicContact CD2-CZ 4.43Å; L563-F595 HydrophobicContact CG-CD2 3.98Å; L563-F595 HydrophobicContact CG-CE2 3.97Å; W566-F595 HydrophobicContact CB-CZ 4.31Å; W566-F595 HydrophobicContact CD2-CZ 4.26Å; W566-F595 HydrophobicContact CE3-CE2 4.46Å; W566-F595 HydrophobicContact CE3-CZ 4.25Å; W566-F595 HydrophobicContact CG-CZ 4.33Å; L591-F595 VanDerWaalsContact O-CB 3.3Å; L591-F595 WeakPolarHBondContact O-CB 3.27Å; L591-F595 PolarHBondContact O-N 2.63Å; L592-F595 PolarHBondContact O-N 3.49Å; F595-V597 PolarHBondContact O-N 2.93Å; F595-A598 PolarHBondContact O-N 3.09Å; F595-A599 HydrophobicContact CE1-CB 4.35Å; F595-A599 HydrophobicContact CZ-CB 4.39Å; F595-A599 WeakPolarHBondContact O-CB 3.25Å; F595-A599 PolarHBondContact O-N 3.31Å; F595-Y770 HydrophobicContact CD1-CE2 4.37Å; F595-Y770 AromaticContact CE1-CD2 3.9Å; F595-Y770 HydrophobicContact CE1-CD2 3.9Å; F595-Y770 HydrophobicContact CE1-CE1 4.35Å; F595-Y770 AromaticContact CE1-CE2 3.45Å; F595-Y770 HydrophobicContact CE1-CE2 3.45Å; F595-Y770 VanDerWaalsContact CE1-CE2 3.45Å; F595-Y770 AromaticContact CE1-CZ 3.69Å; F595-Y770 HydrophobicContact CZ-CD2 4.23Å; F595-Y770 HydrophobicContact CZ-CE2 4.13Å
596	E	94.4	Very high	91	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-70.2	-33.1	-175.6	-67.9	-176.5	147.6	0	0	112.9	I519 C521 N522 L592 H593 T600 L765 Y770	I519-E596 HydrophobicContact CG2-CB 3.69Å; I519-E596 HydrophobicContact CG2-CG 4.44Å; I519-E596 WeakPolarHBondContact CG2-OE2 3.49Å; C521-E596 WeakPolarHBondContact CA-OE2 3.41Å; C521-E596 PolarHBondContact N-OE1 2.77Å; C521-E596 PolarHBondContact N-OE2 3.32Å; N522-E596 WeakPolarHBondContact CB-OE1 3.29Å; N522-E596 PolarHBondContact N-OE1 3.32Å; L592-E596 HydrophobicContact CD1-CG 4Å; L592-E596 WeakPolarHBondContact O-CB 3.25Å; L592-E596 WeakPolarHBondContact O-CG 3.23Å; L592-E596 PolarHBondContact O-N 3.45Å; H593-E596 PolarHBondContact O-N 3.03Å; E596-T600 VanDerWaalsContact O-CB 3.28Å; E596-T600 WeakPolarHBondContact O-CB 3.33Å; E596-T600 PolarHBondContact O-N 3.17Å; E596-T600 PolarHBondContact O-OG1 3.27Å; E596-L765 HydrophobicContact CB-CD1 3.92Å; E596-L765 HydrophobicContact CG-CD1 4.21Å; E596-L765 VanDerWaalsContact O-CD1 3.3Å; E596-L765 WeakPolarHBondContact O-CD1 3.28Å; E596-Y770 HydrophobicContact CG-CE1 4.04Å; E596-Y770 WeakPolarHBondContact CG-OH 3.45Å; E596-Y770 VanDerWaalsContact OE1-CE1 3.27Å; E596-Y770 WeakPolarHBondContact OE1-CE1 3.23Å; E596-Y770 PolarHBondContact OE1-OH 3.14Å
597	V	93.8	Very high	90.7	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-61.8	-53.5	169.4	166.3	0	0	0	0	110.3	L517 I519 F583 H587 H593 F595 A599 T600 I601	L517-V597 HydrophobicContact CD1-CG1 4.22Å; L517-V597 HydrophobicContact CD1-CG2 4.09Å; I519-V597 HydrophobicContact CD1-CB 4.43Å; I519-V597 HydrophobicContact CD1-CG2 3.34Å; F583-V597 HydrophobicContact CB-CG1 4.09Å; F583-V597 HydrophobicContact CD1-CG1 3.69Å; F583-V597 HydrophobicContact CE1-CG1 4.5Å; F583-V597 HydrophobicContact CG-CG1 4.09Å; H587-V597 WeakPolarHBondContact NE2-CG2 3.41Å; H593-V597 WeakPolarHBondContact O-CB 3.26Å; H593-V597 WeakPolarHBondContact O-CG2 3.42Å; H593-V597 PolarHBondContact O-N 3.1Å; F595-V597 PolarHBondContact O-N 2.93Å; V597-A599 PolarHBondContact O-N 3.43Å; V597-T600 PolarHBondContact O-N 3.07Å; V597-I601 HydrophobicContact CG1-CD1 3.66Å; V597-I601 WeakPolarHBondContact O-CB 3.27Å; V597-I601 VanDerWaalsContact O-CG1 3.31Å; V597-I601 WeakPolarHBondContact O-CG1 3.06Å; V597-I601 PolarHBondContact O-N 2.71Å
598	A	93.8	Very high	90.6	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-58.6	-47.2	-179.9	0	0	0	0	0	111.5	L563 V580 A594 F595 I601 L602	L563-A598 HydrophobicContact CD1-CB 4.28Å; V580-A598 HydrophobicContact CG1-CB 4.09Å; V580-A598 HydrophobicContact CG2-CB 4.17Å; A594-A598 WeakPolarHBondContact O-CB 3.2Å; A594-A598 PolarHBondContact O-N 3.32Å; A594-A598 VanDerWaalsContact O-N 3.14Å; F595-A598 PolarHBondContact O-N 3.09Å; A598-I601 PolarHBondContact O-N 3.28Å; A598-L602 WeakPolarHBondContact O-CB 3.06Å; A598-L602 WeakPolarHBondContact O-CD1 3.35Å; A598-L602 WeakPolarHBondContact O-CG 3.44Å; A598-L602 PolarHBondContact O-N 3.23Å
599	A	93.1	Very high	91	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-61.7	-43	177.6	0	0	0	0	0	112.9	L563 W566 F595 V597 I601 L602 I603 L765	L563-A599 HydrophobicContact CD2-CB 4.01Å; W566-A599 HydrophobicContact CE3-CB 4.18Å; W566-A599 HydrophobicContact CH2-CB 3.46Å; W566-A599 VanDerWaalsContact CH2-CB 3.46Å; W566-A599 HydrophobicContact CZ2-CB 4.27Å; W566-A599 HydrophobicContact CZ3-CB 3.41Å; W566-A599 VanDerWaalsContact CZ3-CB 3.41Å; F595-A599 HydrophobicContact CE1-CB 4.35Å; F595-A599 HydrophobicContact CZ-CB 4.39Å; F595-A599 WeakPolarHBondContact O-CB 3.25Å; F595-A599 PolarHBondContact O-N 3.31Å; V597-A599 PolarHBondContact O-N 3.43Å; A599-I601 VanDerWaalsContact C-N 3.32Å; A599-I601 PolarHBondContact O-N 2.75Å; A599-L602 PolarHBondContact O-N 3.14Å; A599-I603 WeakPolarHBondContact O-CG1 3.11Å; A599-I603 PolarHBondContact O-N 3.33Å; A599-I603 VanDerWaalsContact O-N 3.14Å; A599-L765 HydrophobicContact CB-CD1 3.82Å; A599-L765 HydrophobicContact CB-CD2 4.26Å
600	T	92.4	Very high	91.3	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-63	-40.9	175.6	-53.8	0	0	0	0	111.1	L517 E596 V597 N604 F762 L765	L517-T600 HydrophobicContact CB-CG2 4.22Å; L517-T600 HydrophobicContact CD2-CG2 4Å; E596-T600 VanDerWaalsContact O-CB 3.28Å; E596-T600 WeakPolarHBondContact O-CB 3.33Å; E596-T600 PolarHBondContact O-N 3.17Å; E596-T600 PolarHBondContact O-OG1 3.27Å; V597-T600 PolarHBondContact O-N 3.07Å; T600-N604 PolarHBondContact O-N 3.25Å; T600-N604 VanDerWaalsContact O-N 3.13Å; T600-N604 PolarHBondContact O-ND2 2.9Å; T600-F762 HydrophobicContact CG2-CE2 4.08Å; T600-F762 HydrophobicContact CG2-CZ 3.62Å; T600-L765 WeakPolarHBondContact OG1-CD1 3.1Å; T600-L765 WeakPolarHBondContact OG1-CG 3.27Å
601	I	93.3	Very high	91.2	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-70.1	-44	-179.4	-68.7	171.8	0	0	0	111	L517 F579 F583 V597 A598 A599 I603 N604 W605 W671	L517-I601 HydrophobicContact CD2-CG1 4.42Å; F579-I601 HydrophobicContact CE1-CG2 3.87Å; F579-I601 HydrophobicContact CZ-CG2 3.94Å; F583-I601 HydrophobicContact CD1-CD1 3.74Å; F583-I601 HydrophobicContact CE1-CD1 3.27Å; F583-I601 HydrophobicContact CE2-CD1 4.37Å; F583-I601 HydrophobicContact CG-CD1 4.48Å; F583-I601 HydrophobicContact CZ-CD1 3.63Å; F583-I601 HydrophobicContact CZ-CG2 4.4Å; V597-I601 HydrophobicContact CG1-CD1 3.66Å; V597-I601 WeakPolarHBondContact O-CB 3.27Å; V597-I601 VanDerWaalsContact O-CG1 3.31Å; V597-I601 WeakPolarHBondContact O-CG1 3.06Å; V597-I601 PolarHBondContact O-N 2.71Å; A598-I601 PolarHBondContact O-N 3.28Å; A599-I601 VanDerWaalsContact C-N 3.32Å; A599-I601 PolarHBondContact O-N 2.75Å; I601-I603 VanDerWaalsContact C-N 3.28Å; I601-I603 PolarHBondContact O-N 2.92Å; I601-N604 PolarHBondContact O-N 2.92Å; I601-W605 HydrophobicContact CB-CE3 4.16Å; I601-W605 HydrophobicContact CB-CZ3 4.49Å; I601-W605 HydrophobicContact CG1-CE3 4.16Å; I601-W605 HydrophobicContact CG1-CZ3 4.04Å; I601-W605 HydrophobicContact CG2-CB 4.43Å; I601-W605 HydrophobicContact CG2-CD2 4.43Å; I601-W605 HydrophobicContact CG2-CE3 4.08Å; I601-W605 PolarHBondContact O-N 2.84Å; I601-W671 HydrophobicContact CD1-CE3 4.2Å; I601-W671 HydrophobicContact CD1-CZ3 3.86Å; I601-W671 HydrophobicContact CG1-CZ3 4.31Å; I601-W671 HydrophobicContact CG2-CH2 3.75Å; I601-W671 HydrophobicContact CG2-CZ3 3.75Å
602	L	92.9	Very high	90.9	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-62.8	-31.6	178.7	-71.4	162	0	0	0	112.8	L563 F570 L576 F579 V580 A598 A599 C606 G607	L563-L602 HydrophobicContact CD1-CD1 4.09Å; L563-L602 HydrophobicContact CD2-CD1 4.11Å; F570-L602 HydrophobicContact CE1-CD1 4.08Å; F570-L602 HydrophobicContact CE1-CD2 4.1Å; F570-L602 HydrophobicContact CE1-CG 4.46Å; F570-L602 HydrophobicContact CE2-CD1 4.31Å; F570-L602 HydrophobicContact CZ-CB 3.92Å; F570-L602 HydrophobicContact CZ-CD1 3.82Å; F570-L602 HydrophobicContact CZ-CD2 4.35Å; F570-L602 HydrophobicContact CZ-CG 4.25Å; L576-L602 HydrophobicContact CD1-CD1 3.79Å; L576-L602 HydrophobicContact CD1-CD2 3.93Å; F579-L602 HydrophobicContact CD1-CD2 3.95Å; F579-L602 HydrophobicContact CE1-CD2 3.97Å; F579-L602 HydrophobicContact CE1-CG 4.38Å; V580-L602 HydrophobicContact CG2-CD1 4.47Å; A598-L602 WeakPolarHBondContact O-CB 3.06Å; A598-L602 WeakPolarHBondContact O-CD1 3.35Å; A598-L602 WeakPolarHBondContact O-CG 3.44Å; A598-L602 PolarHBondContact O-N 3.23Å; A599-L602 PolarHBondContact O-N 3.14Å; L602-C606 HydrophobicContact CD2-CB 4.23Å; L602-C606 CarbonylContact O-C 3.47Å; L602-C606 WeakPolarHBondContact O-CA 3.37Å; L602-C606 VanDerWaalsContact O-CB 3.28Å; L602-C606 WeakPolarHBondContact O-CB 3.12Å; L602-C606 PolarHBondContact O-N 3.12Å; L602-G607 PolarHBondContact O-N 2.81Å
603	I	89.9	Confident	90.6	Very high	20 Å²	20	14.8 Å²	14.8	10%	0.103	7%	0.072	C	C	.	.	H	α-helix	trans	-70.1	-56.1	170.1	-67.1	166.6	0	0	0	110.7	W566 A599 I601 G607 Q763 L765 P771 I773	W566-I603 HydrophobicContact CH2-CD1 3.93Å; W566-I603 HydrophobicContact CH2-CG1 4.05Å; W566-I603 HydrophobicContact CZ2-CD1 3.95Å; W566-I603 HydrophobicContact CZ2-CG1 4.43Å; A599-I603 WeakPolarHBondContact O-CG1 3.11Å; A599-I603 PolarHBondContact O-N 3.33Å; A599-I603 VanDerWaalsContact O-N 3.14Å; I601-I603 VanDerWaalsContact C-N 3.28Å; I601-I603 PolarHBondContact O-N 2.92Å; I603-G607 VanDerWaalsContact O-CA 3.24Å; I603-G607 WeakPolarHBondContact O-CA 3.5Å; I603-G607 PolarHBondContact O-N 3.36Å; I603-Q763 HydrophobicContact CG2-CB 4.46Å; I603-L765 HydrophobicContact CD1-CD2 3.5Å; I603-P771 HydrophobicContact CD1-CG 3.97Å; I603-I773 HydrophobicContact CG1-CG1 4.08Å
604	N	89.5	Confident	90.3	Very high	25 Å²	25	16.4 Å²	16.4	13%	0.134	9%	0.085	C	C	.	.	H	α-helix	trans	-81.3	-29.1	-163.7	-75	-87.4	0	0	0	114.2	T600 I601 P679 F762 Q763	T600-N604 PolarHBondContact O-N 3.25Å; T600-N604 VanDerWaalsContact O-N 3.13Å; T600-N604 PolarHBondContact O-ND2 2.9Å; I601-N604 PolarHBondContact O-N 2.92Å; N604-P679 WeakPolarHBondContact O-CB 3.27Å; N604-P679 WeakPolarHBondContact O-CG 3.28Å; N604-F762 HydrophobicContact CB-CD2 4.18Å; N604-F762 HydrophobicContact CB-CE2 4.17Å; N604-F762 WeakPolarHBondContact OD1-CA 3.44Å; N604-F762 VanDerWaalsContact OD1-CD2 3.31Å; N604-F762 WeakPolarHBondContact OD1-CD2 3.41Å; N604-Q763 PolarHBondContact ND2-O 3.21Å; N604-Q763 PolarHBondContact OD1-N 2.81Å; N604-Q763 PolarHBondContact OD1-O 2.92Å
605	W	91	Very high	90.1	Very high	12 Å²	12	21 Å²	21	5%	0.045	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-31.7	177.7	-70.8	-104	0	0	0	112.4	L517 I601 W609 L674 P679 L682 F762	L517-W605 HydrophobicContact CD2-CH2 3.85Å; L517-W605 HydrophobicContact CD2-CZ3 3.95Å; I601-W605 HydrophobicContact CB-CE3 4.16Å; I601-W605 HydrophobicContact CB-CZ3 4.49Å; I601-W605 HydrophobicContact CG1-CE3 4.16Å; I601-W605 HydrophobicContact CG1-CZ3 4.04Å; I601-W605 HydrophobicContact CG2-CB 4.43Å; I601-W605 HydrophobicContact CG2-CD2 4.43Å; I601-W605 HydrophobicContact CG2-CE3 4.08Å; I601-W605 PolarHBondContact O-N 2.84Å; W605-W609 PolarHBondContact O-NE1 3.27Å; W605-L674 WeakPolarHBondContact CZ2-O 3.47Å; W605-P679 HydrophobicContact CD2-CG 4.45Å; W605-P679 HydrophobicContact CG-CB 4.1Å; W605-P679 HydrophobicContact CG-CG 4.48Å; W605-L682 HydrophobicContact CB-CD2 4.31Å; W605-F762 HydrophobicContact CH2-CE2 4.07Å; W605-F762 HydrophobicContact CZ3-CE2 4.04Å
606	C	90.4	Very high	89.9	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-1.6	-176.6	-48	0	0	0	0	114.9	L602 T608 W609 F610	L602-C606 HydrophobicContact CD2-CB 4.23Å; L602-C606 CarbonylContact O-C 3.47Å; L602-C606 WeakPolarHBondContact O-CA 3.37Å; L602-C606 VanDerWaalsContact O-CB 3.28Å; L602-C606 WeakPolarHBondContact O-CB 3.12Å; L602-C606 PolarHBondContact O-N 3.12Å; C606-T608 PolarHBondContact O-N 3.41Å; C606-W609 HydrophobicContact CB-CD2 3.73Å; C606-W609 HydrophobicContact CB-CE3 3.96Å; C606-W609 HydrophobicContact CB-CG 4Å; C606-W609 HydrophobicContact CB-CZ2 4.43Å; C606-W609 HydrophobicContact CB-CZ3 4.41Å; C606-W609 VanDerWaalsContact O-CB 3.29Å; C606-W609 WeakPolarHBondContact O-CB 3.26Å; C606-W609 PolarHBondContact O-N 2.95Å; C606-W609 VanDerWaalsContact SG-CH2 3.55Å; C606-F610 HydrophobicContact CB-CE2 4.11Å; C606-F610 HydrophobicContact CB-CZ 4.42Å; C606-F610 WeakPolarHBondContact O-CD2 3.27Å; C606-F610 WeakPolarHBondContact O-CE2 3.21Å
607	G	84.9	Confident	89.8	Confident	10 Å²	10	22.4 Å²	22.4	10%	0.103	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-19	-171.3	0	0	0	0	0	116.1	L602 I603	L602-G607 PolarHBondContact O-N 2.81Å; I603-G607 VanDerWaalsContact O-CA 3.24Å; I603-G607 WeakPolarHBondContact O-CA 3.5Å; I603-G607 PolarHBondContact O-N 3.36Å
608	T	85	Confident	89.6	Confident	12 Å²	12	25.8 Å²	25.8	7%	0.074	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98	-5.3	173.9	46.4	0	0	0	0	113.8	C606 F610 L745 M746	C606-T608 PolarHBondContact O-N 3.41Å; T608-F610 PolarHBondContact O-N 3.2Å; T608-L745 HydrophobicContact CG2-CB 4.3Å; T608-M746 HydrophobicContact CG2-CE 3.82Å
609	W	90.8	Very high	89.4	Confident	7 Å²	7	28 Å²	28	3%	0.027	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-20.9	-173.5	-66.3	17.5	0	0	0	112.8	W575 F579 W605 C606 P617 W651 L654 L682	W575-W609 AromaticContact CH2-CE3 3.74Å; W575-W609 HydrophobicContact CH2-CE3 3.74Å; W575-W609 AromaticContact CH2-CZ3 3.89Å; W575-W609 HydrophobicContact CH2-CZ3 3.89Å; W575-W609 HydrophobicContact CZ2-CE3 4.05Å; W575-W609 HydrophobicContact CZ2-CZ3 4.47Å; W575-W609 HydrophobicContact CZ3-CE3 4.49Å; W575-W609 HydrophobicContact CZ3-CZ3 4.19Å; F579-W609 HydrophobicContact CE2-CH2 4.1Å; F579-W609 HydrophobicContact CE2-CZ3 4.45Å; W605-W609 PolarHBondContact O-NE1 3.27Å; C606-W609 HydrophobicContact CB-CD2 3.73Å; C606-W609 HydrophobicContact CB-CE3 3.96Å; C606-W609 HydrophobicContact CB-CG 4Å; C606-W609 HydrophobicContact CB-CZ2 4.43Å; C606-W609 HydrophobicContact CB-CZ3 4.41Å; C606-W609 VanDerWaalsContact O-CB 3.29Å; C606-W609 WeakPolarHBondContact O-CB 3.26Å; C606-W609 PolarHBondContact O-N 2.95Å; C606-W609 VanDerWaalsContact SG-CH2 3.55Å; W609-P617 HydrophobicContact CB-CB 3.76Å; W609-P617 HydrophobicContact CB-CG 4.37Å; W609-P617 HydrophobicContact CD2-CG 4.42Å; W609-P617 HydrophobicContact CG-CB 3.99Å; W609-P617 HydrophobicContact CG-CG 4.28Å; W609-W651 HydrophobicContact CE3-CH2 4.22Å; W609-W651 AromaticContact CE3-CZ3 3.87Å; W609-W651 HydrophobicContact CE3-CZ3 3.87Å; W609-W651 HydrophobicContact CZ3-CH2 4.48Å; W609-W651 AromaticContact CZ3-CZ3 3.96Å; W609-W651 HydrophobicContact CZ3-CZ3 3.96Å; W609-L654 HydrophobicContact CH2-CB 3.83Å; W609-L654 HydrophobicContact CH2-CD2 3.99Å; W609-L654 HydrophobicContact CH2-CG 4.41Å; W609-L654 HydrophobicContact CZ2-CB 4.43Å; W609-L654 HydrophobicContact CZ2-CD2 3.87Å; W609-L654 HydrophobicContact CZ3-CB 4.21Å; W609-L682 HydrophobicContact CZ2-CD2 4.11Å
610	F	90.1	Very high	89.4	Confident	3 Å²	3	28 Å²	28	1%	0.013	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	5.5	-169.3	-51	-76.5	0	0	0	114.1	L569 F570 T573 W575 C606 T608 F612 F613 I773 R775 Y776 P777	L569-F610 HydrophobicContact CD1-CB 4.34Å; L569-F610 HydrophobicContact CD1-CD1 3.91Å; L569-F610 HydrophobicContact CD1-CG 4.32Å; L569-F610 HydrophobicContact CD2-CB 3.87Å; L569-F610 HydrophobicContact CD2-CD1 3.67Å; L569-F610 HydrophobicContact CD2-CD2 3.83Å; L569-F610 HydrophobicContact CD2-CE1 4.1Å; L569-F610 HydrophobicContact CD2-CE2 4.27Å; L569-F610 HydrophobicContact CD2-CG 3.51Å; L569-F610 HydrophobicContact CD2-CZ 4.39Å; L569-F610 HydrophobicContact CG-CD1 4.1Å; L569-F610 HydrophobicContact CG-CE1 4.44Å; L569-F610 HydrophobicContact CG-CG 4.39Å; F570-F610 HydrophobicContact CE1-CE1 4.49Å; F570-F610 HydrophobicContact CE1-CE2 4.34Å; F570-F610 AromaticContact CE1-CZ 3.83Å; F570-F610 HydrophobicContact CE1-CZ 3.83Å; T573-F610 HydrophobicContact CG2-CE1 4.35Å; W575-F610 HydrophobicContact CH2-CE1 4.15Å; W575-F610 AromaticContact CH2-CZ 3.94Å; W575-F610 HydrophobicContact CH2-CZ 3.94Å; W575-F610 AromaticContact CZ2-CE1 3.7Å; W575-F610 HydrophobicContact CZ2-CE1 3.7Å; W575-F610 AromaticContact CZ2-CZ 3.98Å; W575-F610 HydrophobicContact CZ2-CZ 3.98Å; C606-F610 HydrophobicContact CB-CE2 4.11Å; C606-F610 HydrophobicContact CB-CZ 4.42Å; C606-F610 WeakPolarHBondContact O-CD2 3.27Å; C606-F610 WeakPolarHBondContact O-CE2 3.21Å; T608-F610 PolarHBondContact O-N 3.2Å; F610-F612 VanDerWaalsContact C-N 3.27Å; F610-F612 PolarHBondContact O-N 2.96Å; F610-F613 HydrophobicContact CB-CB 4.38Å; F610-F613 HydrophobicContact CD1-CD2 4.13Å; F610-F613 VanDerWaalsContact O-CB 3.29Å; F610-F613 WeakPolarHBondContact O-CB 3.39Å; F610-F613 PolarHBondContact O-N 2.95Å; F610-F613 VanDerWaalsContact O-N 3.15Å; F610-I773 HydrophobicContact CD2-CD1 4.47Å; F610-I773 HydrophobicContact CD2-CG2 4.46Å; F610-I773 HydrophobicContact CE2-CD1 4.12Å; F610-R775 CarbonylContact C-O 3.51Å; F610-Y776 WeakPolarHBondContact O-CA 3.15Å; F610-P777 VanDerWaalsContact O-CD 3.23Å; F610-P777 WeakPolarHBondContact O-CD 3.47Å
611	E	86.4	Confident	89.6	Confident	84 Å²	84	28.1 Å²	28.1	39%	0.393	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-38.4	-178.8	-168.9	175.2	168.6	0	0	112.5	N619	E611-N619 PolarHBondContact OE1-ND2 3.11Å; E611-N619 PolarHBondContact OE2-ND2 3.35Å
612	F	85.9	Confident	89.6	Confident	90 Å²	90	30.4 Å²	30.4	40%	0.395	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.5	24	176.7	-58	-62.9	0	0	0	113.5	F610 N615 I618	F610-F612 VanDerWaalsContact C-N 3.27Å; F610-F612 PolarHBondContact O-N 2.96Å; F612-N615 WeakPolarHBondContact O-CB 3.14Å; F612-N615 PolarHBondContact O-N 3.43Å; F612-I618 HydrophobicContact CB-CD1 4.49Å; F612-I618 HydrophobicContact CD2-CB 4.05Å; F612-I618 HydrophobicContact CD2-CD1 4.22Å; F612-I618 HydrophobicContact CD2-CG1 4.25Å; F612-I618 HydrophobicContact CE2-CB 4.39Å; F612-I618 HydrophobicContact CG-CD1 4.42Å
613	F	87.2	Confident	89.6	Confident	17 Å²	17	30.9 Å²	30.9	8%	0.075	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	132.8	179.1	-176.4	-87.2	0	0	0	111.2	L569 E572 F610 P777 V781	L569-F613 HydrophobicContact CD1-CB 4.38Å; L569-F613 HydrophobicContact CD1-CD1 3.96Å; L569-F613 HydrophobicContact CD1-CD2 3.63Å; L569-F613 HydrophobicContact CD1-CE1 4.17Å; L569-F613 HydrophobicContact CD1-CE2 3.85Å; L569-F613 HydrophobicContact CD1-CG 3.69Å; L569-F613 HydrophobicContact CD1-CZ 4.12Å; E572-F613 HydrophobicContact CB-CE1 3.99Å; E572-F613 HydrophobicContact CB-CZ 3.61Å; F610-F613 HydrophobicContact CB-CB 4.38Å; F610-F613 HydrophobicContact CD1-CD2 4.13Å; F610-F613 VanDerWaalsContact O-CB 3.29Å; F610-F613 WeakPolarHBondContact O-CB 3.39Å; F610-F613 PolarHBondContact O-N 2.95Å; F610-F613 VanDerWaalsContact O-N 3.15Å; F613-P777 HydrophobicContact CB-CG 4.36Å; F613-P777 VanDerWaalsContact O-CG 3.32Å; F613-P777 WeakPolarHBondContact O-CG 3.26Å; F613-V781 HydrophobicContact CD1-CG2 3.59Å; F613-V781 HydrophobicContact CE1-CG2 3.85Å
614	P	84.5	Confident	89.9	Confident	64 Å²	64	29.9 Å²	29.9	42%	0.416	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	cis	-91.8	7.3	17.6	36.9	-38.5	0	0	0	116.6
615	N	87.8	Confident	90.1	Very high	96 Å²	96	31.2 Å²	31.2	51%	0.513	17%	0.166	S	C	.	.	S	Bend	trans	-70.9	161.4	-179.6	-61.3	-11.6	0	0	0	111.7	F612	F612-N615 WeakPolarHBondContact O-CB 3.14Å; F612-N615 PolarHBondContact O-N 3.43Å
616	P	90.9	Very high	90.3	Very high	26 Å²	26	34.4 Å²	34.4	17%	0.169	18%	0.184	C	C	.	.			trans	-54.1	158.8	166	-26.1	37.6	0	0	0	112.1	I618 L621 E647 W651	P616-I618 VanDerWaalsContact C-N 3.31Å; P616-I618 WeakPolarHBondContact O-CG1 3.44Å; P616-I618 PolarHBondContact O-N 3.03Å; P616-L621 HydrophobicContact CB-CD1 3.75Å; P616-E647 HydrophobicContact CB-CG 4.44Å; P616-E647 HydrophobicContact CG-CG 4.32Å; P616-E647 WeakPolarHBondContact CG-OE1 3.33Å; P616-W651 HydrophobicContact CB-CD2 4.14Å; P616-W651 HydrophobicContact CB-CG 4.18Å
617	P	91.7	Very high	90.5	Very high	5 Å²	5	34.4 Å²	34.4	3%	0.032	18%	0.184	C	C	.	.			trans	-77.1	77	-170	32.4	-37.2	0	0	0	111.9	W609 N619 I620 L621 W651	W609-P617 HydrophobicContact CB-CB 3.76Å; W609-P617 HydrophobicContact CB-CG 4.37Å; W609-P617 HydrophobicContact CD2-CG 4.42Å; W609-P617 HydrophobicContact CG-CB 3.99Å; W609-P617 HydrophobicContact CG-CG 4.28Å; P617-N619 VanDerWaalsContact C-N 3.3Å; P617-N619 PolarHBondContact O-N 3.13Å; P617-N619 VanDerWaalsContact O-N 3.16Å; P617-I620 HydrophobicContact CB-CB 4.05Å; P617-I620 HydrophobicContact CB-CG1 4.07Å; P617-I620 HydrophobicContact CG-CB 4.28Å; P617-I620 WeakPolarHBondContact O-CA 3.48Å; P617-I620 WeakPolarHBondContact O-CB 3.34Å; P617-I620 PolarHBondContact O-N 3.31Å; P617-L621 HydrophobicContact CG-CG 4.33Å; P617-L621 PolarHBondContact O-N 2.84Å; P617-W651 VanDerWaalsContact CD-CE3 3.45Å; P617-W651 HydrophobicContact CG-CE3 3.79Å; P617-W651 HydrophobicContact CG-CH2 4.2Å; P617-W651 HydrophobicContact CG-CZ3 3.55Å
618	I	90.4	Very high	90.9	Very high	71 Å²	71	34 Å²	34	36%	0.364	18%	0.179	S	C	.	.	H	α-helix	trans	-47	-49.7	-172.8	-51.8	178.6	0	0	0	112.1	F612 P616 I620 L621 C622	F612-I618 HydrophobicContact CB-CD1 4.49Å; F612-I618 HydrophobicContact CD2-CB 4.05Å; F612-I618 HydrophobicContact CD2-CD1 4.22Å; F612-I618 HydrophobicContact CD2-CG1 4.25Å; F612-I618 HydrophobicContact CE2-CB 4.39Å; F612-I618 HydrophobicContact CG-CD1 4.42Å; P616-I618 VanDerWaalsContact C-N 3.31Å; P616-I618 WeakPolarHBondContact O-CG1 3.44Å; P616-I618 PolarHBondContact O-N 3.03Å; I618-I620 PolarHBondContact O-N 3.42Å; I618-I620 VanDerWaalsContact O-N 3.12Å; I618-L621 PolarHBondContact O-N 3.37Å; I618-C622 WeakPolarHBondContact O-CB 3.32Å; I618-C622 PolarHBondContact O-N 2.78Å; I618-C622 PolarHBondContact O-SG 3.07Å
619	N	90.4	Very high	91.4	Very high	46 Å²	46	34.8 Å²	34.8	25%	0.246	19%	0.188	C	C	.	.	H	α-helix	trans	-56.5	-30.3	178.6	-78.7	-13.9	0	0	0	113.6	E611 P617 M623 L745	E611-N619 PolarHBondContact OE1-ND2 3.11Å; E611-N619 PolarHBondContact OE2-ND2 3.35Å; P617-N619 VanDerWaalsContact C-N 3.3Å; P617-N619 PolarHBondContact O-N 3.13Å; P617-N619 VanDerWaalsContact O-N 3.16Å; N619-M623 WeakPolarHBondContact O-CE 3.38Å; N619-M623 VanDerWaalsContact O-CG 3.31Å; N619-M623 WeakPolarHBondContact O-CG 3.35Å; N619-L745 HydrophobicContact CB-CD1 4.16Å
620	I	93	Very high	91.5	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-87.7	-41.4	179.9	-57.7	-60.1	0	0	0	111.3	P617 I618 M623 I624 L654 L683 L742	P617-I620 HydrophobicContact CB-CB 4.05Å; P617-I620 HydrophobicContact CB-CG1 4.07Å; P617-I620 HydrophobicContact CG-CB 4.28Å; P617-I620 WeakPolarHBondContact O-CA 3.48Å; P617-I620 WeakPolarHBondContact O-CB 3.34Å; P617-I620 PolarHBondContact O-N 3.31Å; I618-I620 PolarHBondContact O-N 3.42Å; I618-I620 VanDerWaalsContact O-N 3.12Å; I620-M623 HydrophobicContact CD1-CE 4.29Å; I620-M623 WeakPolarHBondContact O-CB 3.21Å; I620-M623 PolarHBondContact O-N 2.9Å; I620-M623 VanDerWaalsContact O-N 3.14Å; I620-I624 HydrophobicContact CG2-CD1 4.45Å; I620-I624 PolarHBondContact O-N 3.05Å; I620-I624 VanDerWaalsContact O-N 3.14Å; I620-L654 HydrophobicContact CG2-CD1 4.13Å; I620-L683 HydrophobicContact CD1-CD1 4.35Å; I620-L683 HydrophobicContact CG2-CD1 4.01Å; I620-L683 HydrophobicContact CG2-CD2 3.39Å; I620-L683 HydrophobicContact CG2-CG 4.35Å; I620-L742 HydrophobicContact CD1-CD2 3.65Å
621	L	95.3	Very high	91.6	Very high	2 Å²	2	41 Å²	41	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-60.3	-46	175.8	-68	-177	0	0	0	111	P616 P617 I618 M623 I624 E625 T646 E647 A650 W651 L654	P616-L621 HydrophobicContact CB-CD1 3.75Å; P617-L621 HydrophobicContact CG-CG 4.33Å; P617-L621 PolarHBondContact O-N 2.84Å; I618-L621 PolarHBondContact O-N 3.37Å; L621-M623 VanDerWaalsContact C-N 3.31Å; L621-M623 PolarHBondContact O-N 3.07Å; L621-I624 PolarHBondContact O-N 2.81Å; L621-I624 VanDerWaalsContact O-N 3.16Å; L621-E625 PolarHBondContact O-N 2.77Å; L621-T646 HydrophobicContact CB-CG2 4.26Å; L621-T646 WeakPolarHBondContact O-CG2 3.32Å; L621-E647 HydrophobicContact CD1-CG 3.99Å; L621-A650 HydrophobicContact CD2-CB 4Å; L621-W651 HydrophobicContact CD1-CB 4.49Å; L621-W651 HydrophobicContact CD2-CB 4.04Å; L621-L654 HydrophobicContact CD2-CD1 4.12Å
622	C	93.4	Very high	92	Very high	47 Å²	47	37.8 Å²	37.8	32%	0.318	20%	0.203	S	C	.	.	H	α-helix	trans	-66.1	-27.3	174.6	-65.9	0	0	0	0	113.2	I618 N626	I618-C622 WeakPolarHBondContact O-CB 3.32Å; I618-C622 PolarHBondContact O-N 2.78Å; I618-C622 PolarHBondContact O-SG 3.07Å; C622-N626 WeakPolarHBondContact O-CB 3.25Å; C622-N626 PolarHBondContact O-N 3.22Å; C622-N626 PolarHBondContact O-ND2 2.65Å
623	M	93.9	Very high	92.4	Very high	10 Å²	10	36.5 Å²	36.5	5%	0.049	20%	0.204	C	C	.	.	H	α-helix	trans	-65.7	-43.2	170.8	-75.6	-178.6	-145.1	0	0	111.4	N619 I620 L621 N626 I627 L683 P738 L741 L742 L745	N619-M623 WeakPolarHBondContact O-CE 3.38Å; N619-M623 VanDerWaalsContact O-CG 3.31Å; N619-M623 WeakPolarHBondContact O-CG 3.35Å; I620-M623 HydrophobicContact CD1-CE 4.29Å; I620-M623 WeakPolarHBondContact O-CB 3.21Å; I620-M623 PolarHBondContact O-N 2.9Å; I620-M623 VanDerWaalsContact O-N 3.14Å; L621-M623 VanDerWaalsContact C-N 3.31Å; L621-M623 PolarHBondContact O-N 3.07Å; M623-N626 PolarHBondContact O-N 2.81Å; M623-I627 WeakPolarHBondContact O-CD1 3.28Å; M623-I627 VanDerWaalsContact O-CG1 3.23Å; M623-I627 WeakPolarHBondContact O-CG1 3.3Å; M623-I627 PolarHBondContact O-N 2.53Å; M623-I627 VanDerWaalsContact O-N 3.16Å; M623-L683 HydrophobicContact CB-CD1 4.24Å; M623-L683 HydrophobicContact SD-CD1 4.02Å; M623-P738 HydrophobicContact SD-CB 4.34Å; M623-L741 HydrophobicContact CE-CB 3.64Å; M623-L741 HydrophobicContact CG-CB 4.31Å; M623-L741 HydrophobicContact CG-CD1 3.83Å; M623-L741 HydrophobicContact SD-CB 3.72Å; M623-L741 HydrophobicContact SD-CD1 4.3Å; M623-L742 HydrophobicContact CE-CD2 4.32Å; M623-L742 HydrophobicContact CE-CG 4.48Å; M623-L742 HydrophobicContact SD-CD2 4.35Å; M623-L742 HydrophobicContact SD-CG 4.13Å; M623-L745 HydrophobicContact CE-CD1 3.58Å
624	I	95.4	Very high	92.8	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-63.9	-44.7	177.3	-65.7	165.8	0	0	0	110.2	I620 L621 N626 I627 I628 Y649 A650 L654 L683 V686 A687	I620-I624 HydrophobicContact CG2-CD1 4.45Å; I620-I624 PolarHBondContact O-N 3.05Å; I620-I624 VanDerWaalsContact O-N 3.14Å; L621-I624 PolarHBondContact O-N 2.81Å; L621-I624 VanDerWaalsContact O-N 3.16Å; I624-N626 PolarHBondContact O-N 3.36Å; I624-I627 PolarHBondContact O-N 3.13Å; I624-I627 VanDerWaalsContact O-N 3.17Å; I624-I628 HydrophobicContact CG2-CD1 4.13Å; I624-I628 WeakPolarHBondContact O-CG1 3.43Å; I624-I628 PolarHBondContact O-N 3.4Å; I624-Y649 HydrophobicContact CG2-CE2 4.16Å; I624-A650 HydrophobicContact CD1-CB 4.05Å; I624-A650 HydrophobicContact CG2-CB 3.96Å; I624-L654 HydrophobicContact CD1-CD1 3.88Å; I624-L683 HydrophobicContact CD1-CD2 4.24Å; I624-L683 HydrophobicContact CG1-CB 3.98Å; I624-L683 HydrophobicContact CG1-CD2 4.49Å; I624-V686 HydrophobicContact CD1-CB 4.11Å; I624-V686 HydrophobicContact CD1-CG1 3.88Å; I624-V686 HydrophobicContact CG2-CG1 4.13Å; I624-A687 HydrophobicContact CG2-CB 4.2Å
625	E	94.9	Very high	93.3	Very high	53 Å²	53	36.1 Å²	36.1	25%	0.248	20%	0.202	C	C	.	.	H	α-helix	trans	-56.3	-49.1	176.4	-166.7	170.1	-160.7	0	0	112.5	L621 I627 I628 A629 Y636 T646	L621-E625 PolarHBondContact O-N 2.77Å; E625-I627 VanDerWaalsContact C-N 3.3Å; E625-I627 PolarHBondContact O-N 3.2Å; E625-I628 PolarHBondContact O-N 3.22Å; E625-A629 VanDerWaalsContact O-CB 3.31Å; E625-A629 WeakPolarHBondContact O-CB 3.48Å; E625-A629 PolarHBondContact O-N 3.43Å; E625-Y636 HydrophobicContact CG-CD2 4.48Å; E625-Y636 HydrophobicContact CG-CE2 3.77Å; E625-T646 HydrophobicContact CB-CG2 3.69Å; E625-T646 HydrophobicContact CG-CG2 4.05Å
626	N	93.8	Very high	93.7	Very high	78 Å²	78	35 Å²	35	42%	0.417	19%	0.191	S	C	.	.	H	α-helix	trans	-64.4	-31.8	177.9	-78.1	-68.1	0	0	0	112.8	C622 M623 I624 Y630 I736	C622-N626 WeakPolarHBondContact O-CB 3.25Å; C622-N626 PolarHBondContact O-N 3.22Å; C622-N626 PolarHBondContact O-ND2 2.65Å; M623-N626 PolarHBondContact O-N 2.81Å; I624-N626 PolarHBondContact O-N 3.36Å; N626-Y630 VanDerWaalsContact O-CB 3.31Å; N626-Y630 WeakPolarHBondContact O-CB 3.44Å; N626-Y630 PolarHBondContact O-N 2.67Å; N626-Y630 VanDerWaalsContact O-N 3.1Å; N626-I736 HydrophobicContact CB-CG2 3.74Å
627	I	94.3	Very high	93.9	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-68.1	-44.7	174.2	-65.2	159.3	0	0	0	110.4	M623 I624 E625 Y630 A631 A687 L728 P738	M623-I627 WeakPolarHBondContact O-CD1 3.28Å; M623-I627 VanDerWaalsContact O-CG1 3.23Å; M623-I627 WeakPolarHBondContact O-CG1 3.3Å; M623-I627 PolarHBondContact O-N 2.53Å; M623-I627 VanDerWaalsContact O-N 3.16Å; I624-I627 PolarHBondContact O-N 3.13Å; I624-I627 VanDerWaalsContact O-N 3.17Å; E625-I627 VanDerWaalsContact C-N 3.3Å; E625-I627 PolarHBondContact O-N 3.2Å; I627-Y630 PolarHBondContact O-N 3.05Å; I627-A631 WeakPolarHBondContact O-CB 3.25Å; I627-A631 PolarHBondContact O-N 3.02Å; I627-A687 HydrophobicContact CB-CB 4.12Å; I627-A687 HydrophobicContact CG2-CB 3.66Å; I627-L728 HydrophobicContact CG2-CD1 4.37Å; I627-P738 HydrophobicContact CD1-CB 4.14Å; I627-P738 HydrophobicContact CD1-CG 3.69Å
628	I	95	Very high	94.1	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-67.9	-44.9	178.3	-61.2	174.3	0	0	0	110.7	I624 E625 Y630 A631 D632 L635 F639 Y649 A687 I691	I624-I628 HydrophobicContact CG2-CD1 4.13Å; I624-I628 WeakPolarHBondContact O-CG1 3.43Å; I624-I628 PolarHBondContact O-N 3.4Å; E625-I628 PolarHBondContact O-N 3.22Å; I628-Y630 PolarHBondContact O-N 3.36Å; I628-A631 PolarHBondContact O-N 2.69Å; I628-D632 CarbonylContact O-C 3.35Å; I628-D632 PolarHBondContact O-N 3.31Å; I628-L635 HydrophobicContact CG2-CD2 4.47Å; I628-F639 HydrophobicContact CD1-CE2 4.36Å; I628-F639 HydrophobicContact CG2-CE2 4.42Å; I628-Y649 HydrophobicContact CD1-CD2 4.19Å; I628-Y649 HydrophobicContact CD1-CE2 3.4Å; I628-A687 HydrophobicContact CD1-CB 4.4Å; I628-A687 HydrophobicContact CG1-CB 3.81Å; I628-I691 HydrophobicContact CG1-CD1 4.27Å; I628-I691 HydrophobicContact CG1-CG1 4.46Å; I628-I691 HydrophobicContact CG2-CG1 4.47Å
629	A	93.8	Very high	94.3	Very high	30 Å²	30	39.8 Å²	39.8	25%	0.248	20%	0.201	C	C	.	.	H	α-helix	trans	-59.2	-33.6	177.2	0	0	0	0	0	113	E625 Y636	E625-A629 VanDerWaalsContact O-CB 3.31Å; E625-A629 WeakPolarHBondContact O-CB 3.48Å; E625-A629 PolarHBondContact O-N 3.43Å; A629-Y636 HydrophobicContact CB-CD1 3.65Å; A629-Y636 HydrophobicContact CB-CD2 3.91Å; A629-Y636 HydrophobicContact CB-CE1 3.9Å; A629-Y636 HydrophobicContact CB-CE2 4.15Å; A629-Y636 HydrophobicContact CB-CG 3.65Å
630	Y	93.7	Very high	94.5	Very high	113 Å²	113	41.5 Å²	41.5	44%	0.443	21%	0.213	S	C	.	.	H	α-helix	trans	-77	-42.3	173.6	-179.9	-105.2	0	0	0	113.1	N626 I627 I628 S731 P733	N626-Y630 VanDerWaalsContact O-CB 3.31Å; N626-Y630 WeakPolarHBondContact O-CB 3.44Å; N626-Y630 PolarHBondContact O-N 2.67Å; N626-Y630 VanDerWaalsContact O-N 3.1Å; I627-Y630 PolarHBondContact O-N 3.05Å; I628-Y630 PolarHBondContact O-N 3.36Å; Y630-S731 WeakPolarHBondContact CE1-O 3.46Å; Y630-P733 HydrophobicContact CD2-CG 4.42Å; Y630-P733 VanDerWaalsContact CE1-CD 3.47Å; Y630-P733 HydrophobicContact CE2-CG 4.11Å
631	A	93.3	Very high	94.5	Very high	28 Å²	28	47.8 Å²	47.8	23%	0.231	24%	0.242	C	C	.	.	H	α-helix	trans	-91.8	-26.5	-168.9	0	0	0	0	0	115.5	I627 I628 I691 L728	I627-A631 WeakPolarHBondContact O-CB 3.25Å; I627-A631 PolarHBondContact O-N 3.02Å; I628-A631 PolarHBondContact O-N 2.69Å; A631-I691 HydrophobicContact CB-CD1 3.88Å; A631-L728 HydrophobicContact CB-CD2 3.28Å
632	D	94.2	Very high	94.3	Very high	15 Å²	15	50.3 Å²	50.3	8%	0.08	25%	0.252	C	S	.	.			trans	-144.6	83.4	168.8	-169.3	-17.2	0	0	0	110.4	I628 V634 L635 Y636 I691 R694	I628-D632 CarbonylContact O-C 3.35Å; I628-D632 PolarHBondContact O-N 3.31Å; D632-V634 PolarHBondContact O-N 3.24Å; D632-V634 VanDerWaalsContact O-N 3.11Å; D632-V634 WeakPolarHBondContact OD1-CA 3.35Å; D632-V634 WeakPolarHBondContact OD1-CB 3.31Å; D632-V634 PolarHBondContact OD1-N 3.33Å; D632-L635 HydrophobicContact CB-CB 4Å; D632-L635 PolarHBondContact O-N 2.87Å; D632-L635 PolarHBondContact OD1-N 2.96Å; D632-Y636 PolarHBondContact O-N 3.4Å; D632-I691 HydrophobicContact CB-CG1 4.38Å; D632-R694 IonicContact OD1-NE 2.74Å; D632-R694 IonicContact OD1-NH2 3.47Å; D632-R694 WeakPolarHBondContact OD2-CD 3.47Å; D632-R694 IonicContact OD2-CZ 3.84Å; D632-R694 IonicContact OD2-NE 3.85Å; D632-R694 PolarHBondContact OD2-NE 3.48Å; D632-R694 IonicContact OD2-NH2 3.88Å
633	P	94.4	Very high	94.2	Very high	64 Å²	64	54.6 Å²	54.6	42%	0.416	27%	0.272	S	S	.	.	H	α-helix	trans	-66.1	-10.1	177.7	27.3	-35.5	0	0	0	113.5	R637	P633-R637 WeakPolarHBondContact O-CB 3.17Å; P633-R637 VanDerWaalsContact O-CD 3.28Å; P633-R637 WeakPolarHBondContact O-CD 3.4Å; P633-R637 WeakPolarHBondContact O-CG 3.19Å; P633-R637 PolarHBondContact O-N 2.9Å
634	V	95.3	Very high	94.1	Very high	73 Å²	73	54.6 Å²	54.6	44%	0.442	27%	0.272	S	S	.	.	H	α-helix	trans	-82.3	-47.2	173.9	-178.7	0	0	0	0	110	D632 Y636 R637 H638	D632-V634 PolarHBondContact O-N 3.24Å; D632-V634 VanDerWaalsContact O-N 3.11Å; D632-V634 WeakPolarHBondContact OD1-CA 3.35Å; D632-V634 WeakPolarHBondContact OD1-CB 3.31Å; D632-V634 PolarHBondContact OD1-N 3.33Å; V634-Y636 VanDerWaalsContact C-N 3.34Å; V634-Y636 PolarHBondContact O-N 2.89Å; V634-R637 PolarHBondContact O-N 2.9Å; V634-H638 PolarHBondContact O-N 2.98Å
635	L	95.6	Very high	94	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-62	-42	173.7	-177	62.7	0	0	0	111.6	I628 D632 H638 F639 S690 I691 R694 L697 L698	I628-L635 HydrophobicContact CG2-CD2 4.47Å; D632-L635 HydrophobicContact CB-CB 4Å; D632-L635 PolarHBondContact O-N 2.87Å; D632-L635 PolarHBondContact OD1-N 2.96Å; L635-H638 WeakPolarHBondContact O-CB 3.27Å; L635-H638 PolarHBondContact O-N 3.16Å; L635-F639 HydrophobicContact CD1-CD1 4.44Å; L635-F639 HydrophobicContact CD1-CE1 3.81Å; L635-F639 HydrophobicContact CD1-CZ 3.9Å; L635-F639 HydrophobicContact CD2-CE2 4.43Å; L635-F639 HydrophobicContact CD2-CZ 4.14Å; L635-F639 HydrophobicContact CG-CE1 4.2Å; L635-F639 HydrophobicContact CG-CE2 4.11Å; L635-F639 HydrophobicContact CG-CZ 3.85Å; L635-F639 PolarHBondContact O-N 2.8Å; L635-S690 WeakPolarHBondContact CD2-O 3.41Å; L635-I691 HydrophobicContact CD2-CG1 4.4Å; L635-R694 HydrophobicContact CD2-CB 4.36Å; L635-L697 HydrophobicContact CD1-CB 3.84Å; L635-L697 HydrophobicContact CD1-CD1 3.96Å; L635-L697 HydrophobicContact CD2-CD1 4.24Å; L635-L698 HydrophobicContact CD1-CD2 4.08Å; L635-L698 HydrophobicContact CD1-CG 4.33Å
636	Y	95.8	Very high	93.9	Very high	72 Å²	72	55.9 Å²	55.9	28%	0.282	28%	0.284	S	S	.	.	H	α-helix	trans	-62.4	-42.8	175	176.9	-110.2	0	0	0	112.7	E625 A629 D632 V634 H638 F639 V640	E625-Y636 HydrophobicContact CG-CD2 4.48Å; E625-Y636 HydrophobicContact CG-CE2 3.77Å; A629-Y636 HydrophobicContact CB-CD1 3.65Å; A629-Y636 HydrophobicContact CB-CD2 3.91Å; A629-Y636 HydrophobicContact CB-CE1 3.9Å; A629-Y636 HydrophobicContact CB-CE2 4.15Å; A629-Y636 HydrophobicContact CB-CG 3.65Å; D632-Y636 PolarHBondContact O-N 3.4Å; V634-Y636 VanDerWaalsContact C-N 3.34Å; V634-Y636 PolarHBondContact O-N 2.89Å; Y636-H638 VanDerWaalsContact C-N 3.28Å; Y636-H638 PolarHBondContact O-N 3.33Å; Y636-F639 PolarHBondContact O-N 3.44Å; Y636-V640 HydrophobicContact CD1-CG2 4.44Å; Y636-V640 HydrophobicContact CD2-CG2 4.4Å; Y636-V640 HydrophobicContact CE1-CG2 3.97Å; Y636-V640 HydrophobicContact CE2-CG2 3.91Å; Y636-V640 WeakPolarHBondContact O-CG2 3.37Å; Y636-V640 PolarHBondContact O-N 2.93Å
637	R	95	Very high	93.9	Very high	179 Å²	179	56.8 Å²	56.8	68%	0.675	29%	0.285	S	S	*	.	H	α-helix	trans	-61.7	-36.2	174.1	-79.7	170.4	-175.8	178.1	1.7	112.4	P633 V634 V640 Q641	P633-R637 WeakPolarHBondContact O-CB 3.17Å; P633-R637 VanDerWaalsContact O-CD 3.28Å; P633-R637 WeakPolarHBondContact O-CD 3.4Å; P633-R637 WeakPolarHBondContact O-CG 3.19Å; P633-R637 PolarHBondContact O-N 2.9Å; V634-R637 PolarHBondContact O-N 2.9Å; R637-V640 PolarHBondContact O-N 3.38Å; R637-Q641 VanDerWaalsContact O-CB 3.26Å; R637-Q641 WeakPolarHBondContact O-CB 3.44Å; R637-Q641 PolarHBondContact O-N 2.87Å
638	H	95.1	Very high	93.9	Very high	21 Å²	21	57.8 Å²	57.8	10%	0.097	29%	0.291	C	S	.	.	H	α-helix	trans	-63.7	-45.8	174	-167	94	0	0	0	111.3	V634 L635 Y636 V640 Q641 Y642 L697 L698 V700 F706	V634-H638 PolarHBondContact O-N 2.98Å; L635-H638 WeakPolarHBondContact O-CB 3.27Å; L635-H638 PolarHBondContact O-N 3.16Å; Y636-H638 VanDerWaalsContact C-N 3.28Å; Y636-H638 PolarHBondContact O-N 3.33Å; H638-V640 PolarHBondContact O-N 3Å; H638-Q641 PolarHBondContact O-N 3.1Å; H638-Y642 AromaticContact CD2-CD2 3.87Å; H638-Y642 AromaticContact CE1-CD2 3.87Å; H638-Y642 AromaticContact CE1-CE2 3.45Å; H638-Y642 VanDerWaalsContact CE1-CE2 3.45Å; H638-Y642 WeakPolarHBondContact CE1-CE2 3.28Å; H638-Y642 AromaticContact ND1-CE2 3.77Å; H638-Y642 AromaticContact NE2-CD2 3.7Å; H638-Y642 AromaticContact NE2-CE2 3.73Å; H638-Y642 WeakPolarHBondContact O-CD2 3.27Å; H638-Y642 PolarHBondContact O-N 3.09Å; H638-Y642 VanDerWaalsContact O-N 3.15Å; H638-L697 PolarHBondContact NE2-O 3.44Å; H638-L698 HydrophobicContact CB-CD2 3.54Å; H638-L698 PolarHBondContact CE1-O 3.02Å; H638-V700 PolarHBondContact NE2-O 3.46Å; H638-F706 AromaticContact CD2-CZ 3.87Å; H638-F706 AromaticContact NE2-CZ 3.76Å
639	F	95.7	Very high	93.8	Very high	2 Å²	2	57.9 Å²	57.9	1%	0.009	29%	0.291	C	S	.	.	H	α-helix	trans	-57.7	-47.2	173.8	-65.9	-18.7	0	0	0	112.3	I628 L635 Y636 Q641 Y642 N643 I644 Y649 L697 F706	I628-F639 HydrophobicContact CD1-CE2 4.36Å; I628-F639 HydrophobicContact CG2-CE2 4.42Å; L635-F639 HydrophobicContact CD1-CD1 4.44Å; L635-F639 HydrophobicContact CD1-CE1 3.81Å; L635-F639 HydrophobicContact CD1-CZ 3.9Å; L635-F639 HydrophobicContact CD2-CE2 4.43Å; L635-F639 HydrophobicContact CD2-CZ 4.14Å; L635-F639 HydrophobicContact CG-CE1 4.2Å; L635-F639 HydrophobicContact CG-CE2 4.11Å; L635-F639 HydrophobicContact CG-CZ 3.85Å; L635-F639 PolarHBondContact O-N 2.8Å; Y636-F639 PolarHBondContact O-N 3.44Å; F639-Q641 PolarHBondContact O-N 3.25Å; F639-Y642 PolarHBondContact O-N 3.47Å; F639-N643 PolarHBondContact O-N 3.31Å; F639-N643 VanDerWaalsContact O-N 3.13Å; F639-I644 HydrophobicContact CB-CB 4.2Å; F639-I644 HydrophobicContact CD1-CB 4.36Å; F639-I644 HydrophobicContact CD1-CD1 4.1Å; F639-I644 HydrophobicContact CD1-CG2 4.31Å; F639-I644 PolarHBondContact O-N 3.21Å; F639-Y649 AromaticContact CD2-CD1 3.97Å; F639-Y649 HydrophobicContact CD2-CD1 3.97Å; F639-Y649 AromaticContact CD2-CE1 3.66Å; F639-Y649 HydrophobicContact CD2-CE1 3.66Å; F639-Y649 AromaticContact CE2-CD1 3.95Å; F639-Y649 HydrophobicContact CE2-CD1 3.95Å; F639-Y649 HydrophobicContact CE2-CD2 4.21Å; F639-Y649 AromaticContact CE2-CE1 3.91Å; F639-Y649 HydrophobicContact CE2-CE1 3.91Å; F639-Y649 HydrophobicContact CE2-CE2 4.21Å; F639-Y649 HydrophobicContact CE2-CG 4.1Å; F639-Y649 HydrophobicContact CG-CE1 4.41Å; F639-Y649 HydrophobicContact CZ-CD1 4.48Å; F639-Y649 HydrophobicContact CZ-CG 4.42Å; F639-L697 HydrophobicContact CE1-CD1 4.09Å; F639-L697 HydrophobicContact CZ-CD1 3.89Å; F639-F706 HydrophobicContact CD1-CE1 4.45Å; F639-F706 HydrophobicContact CE1-CE1 4.08Å
640	V	93.7	Very high	93.9	Very high	83 Å²	83	56.4 Å²	56.4	50%	0.503	28%	0.279	S	S	.	.	H	α-helix	trans	-63.3	-40.1	176.9	174.3	0	0	0	0	112.1	Y636 R637 H638 Y642 N643	Y636-V640 HydrophobicContact CD1-CG2 4.44Å; Y636-V640 HydrophobicContact CD2-CG2 4.4Å; Y636-V640 HydrophobicContact CE1-CG2 3.97Å; Y636-V640 HydrophobicContact CE2-CG2 3.91Å; Y636-V640 WeakPolarHBondContact O-CG2 3.37Å; Y636-V640 PolarHBondContact O-N 2.93Å; R637-V640 PolarHBondContact O-N 3.38Å; H638-V640 PolarHBondContact O-N 3Å; V640-Y642 VanDerWaalsContact C-N 3.31Å; V640-Y642 PolarHBondContact O-N 2.9Å; V640-N643 PolarHBondContact O-N 3.3Å
641	Q	92.5	Very high	94	Very high	132 Å²	132	52.3 Å²	52.3	62%	0.617	26%	0.263	S	S	*	.	H	α-helix	trans	-62.8	-35.4	179.6	175.8	174.8	-26.4	0	0	112.9	R637 H638 F639	R637-Q641 VanDerWaalsContact O-CB 3.26Å; R637-Q641 WeakPolarHBondContact O-CB 3.44Å; R637-Q641 PolarHBondContact O-N 2.87Å; H638-Q641 PolarHBondContact O-N 3.1Å; F639-Q641 PolarHBondContact O-N 3.25Å
642	Y	91.3	Very high	94.1	Very high	56 Å²	56	51.4 Å²	51.4	22%	0.22	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	15.2	-179.7	-66	-77.4	0	0	0	113.4	H638 F639 V640 I644 Q701	H638-Y642 AromaticContact CD2-CD2 3.87Å; H638-Y642 AromaticContact CE1-CD2 3.87Å; H638-Y642 AromaticContact CE1-CE2 3.45Å; H638-Y642 VanDerWaalsContact CE1-CE2 3.45Å; H638-Y642 WeakPolarHBondContact CE1-CE2 3.28Å; H638-Y642 AromaticContact ND1-CE2 3.77Å; H638-Y642 AromaticContact NE2-CD2 3.7Å; H638-Y642 AromaticContact NE2-CE2 3.73Å; H638-Y642 WeakPolarHBondContact O-CD2 3.27Å; H638-Y642 PolarHBondContact O-N 3.09Å; H638-Y642 VanDerWaalsContact O-N 3.15Å; F639-Y642 PolarHBondContact O-N 3.47Å; V640-Y642 VanDerWaalsContact C-N 3.31Å; V640-Y642 PolarHBondContact O-N 2.9Å; Y642-I644 VanDerWaalsContact C-N 3.27Å; Y642-I644 PolarHBondContact O-N 3.12Å; Y642-Q701 HydrophobicContact CD1-CB 4.29Å; Y642-Q701 WeakPolarHBondContact CD1-O 3.49Å; Y642-Q701 HydrophobicContact CE1-CB 3.7Å; Y642-Q701 HydrophobicContact CE1-CG 4.04Å; Y642-Q701 HydrophobicContact CE2-CG 4.45Å
643	N	90.8	Very high	94.2	Very high	137 Å²	137	50.7 Å²	50.7	73%	0.733	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	29.8	-179.8	-59	-60.3	0	0	0	115.3	F639 V640 T645	F639-N643 PolarHBondContact O-N 3.31Å; F639-N643 VanDerWaalsContact O-N 3.13Å; V640-N643 PolarHBondContact O-N 3.3Å; N643-T645 PolarHBondContact O-N 3.45Å
644	I	92.1	Very high	94.3	Very high	9 Å²	9	47.7 Å²	47.7	5%	0.046	23%	0.231	C	C	.	.			trans	-83.4	104.9	-175.2	-57.6	155.7	0	0	0	109.2	F639 Y642 I648 Y649 F706	F639-I644 HydrophobicContact CB-CB 4.2Å; F639-I644 HydrophobicContact CD1-CB 4.36Å; F639-I644 HydrophobicContact CD1-CD1 4.1Å; F639-I644 HydrophobicContact CD1-CG2 4.31Å; F639-I644 PolarHBondContact O-N 3.21Å; Y642-I644 VanDerWaalsContact C-N 3.27Å; Y642-I644 PolarHBondContact O-N 3.12Å; I644-I648 HydrophobicContact CG2-CB 4.19Å; I644-I648 HydrophobicContact CG2-CD1 4.49Å; I644-I648 HydrophobicContact CG2-CG2 4Å; I644-Y649 HydrophobicContact CG2-CD1 4.16Å; I644-F706 HydrophobicContact CD1-CD1 3.98Å; I644-F706 HydrophobicContact CD1-CD2 3.33Å; I644-F706 HydrophobicContact CD1-CE1 3.82Å; I644-F706 HydrophobicContact CD1-CE2 3.16Å; I644-F706 HydrophobicContact CD1-CG 3.75Å; I644-F706 HydrophobicContact CD1-CZ 3.41Å; I644-F706 VanDerWaalsContact CD1-CZ 3.41Å; I644-F706 HydrophobicContact CG1-CD2 4.02Å; I644-F706 HydrophobicContact CG1-CE2 4.27Å; I644-F706 HydrophobicContact CG1-CG 4.32Å; I644-F706 HydrophobicContact CG2-CG 4.48Å
645	T	93.4	Very high	94.3	Very high	65 Å²	65	46.4 Å²	46.4	40%	0.399	22%	0.22	S	C	.	.			trans	-78.6	161.8	-178.4	64.3	0	0	0	0	112.3	N643 E647 I648 Y649	N643-T645 PolarHBondContact O-N 3.45Å; T645-E647 PolarHBondContact O-N 3.45Å; T645-E647 PolarHBondContact OG1-N 3.49Å; T645-I648 WeakPolarHBondContact O-CB 3.09Å; T645-I648 PolarHBondContact O-N 2.95Å; T645-Y649 WeakPolarHBondContact O-CD1 3.28Å; T645-Y649 PolarHBondContact O-N 3.25Å
646	T	94.3	Very high	94.2	Very high	15 Å²	15	46.8 Å²	46.8	9%	0.092	22%	0.222	C	C	.	.	H	α-helix	trans	-56	-26.4	168.8	44.8	0	0	0	0	113.6	L621 E625 I648 Y649 A650 W651	L621-T646 HydrophobicContact CB-CG2 4.26Å; L621-T646 WeakPolarHBondContact O-CG2 3.32Å; E625-T646 HydrophobicContact CB-CG2 3.69Å; E625-T646 HydrophobicContact CG-CG2 4.05Å; T646-I648 PolarHBondContact O-N 3.46Å; T646-Y649 HydrophobicContact CG2-CE1 4.02Å; T646-Y649 HydrophobicContact CG2-CE2 4.41Å; T646-Y649 WeakPolarHBondContact CG2-OH 3.33Å; T646-A650 WeakPolarHBondContact O-CA 3.42Å; T646-A650 WeakPolarHBondContact O-CB 3.46Å; T646-A650 PolarHBondContact O-N 2.64Å; T646-W651 PolarHBondContact O-N 3.29Å; T646-W651 VanDerWaalsContact O-N 3.07Å
647	E	93.6	Very high	94.1	Very high	97 Å²	97	43.4 Å²	43.4	45%	0.453	21%	0.21	S	C	.	.	H	α-helix	trans	-67.7	-23.3	175	-58.6	-175.3	151.1	0	0	112.7	P616 L621 T645	P616-E647 HydrophobicContact CB-CG 4.44Å; P616-E647 HydrophobicContact CG-CG 4.32Å; P616-E647 WeakPolarHBondContact CG-OE1 3.33Å; L621-E647 HydrophobicContact CD1-CG 3.99Å; T645-E647 PolarHBondContact O-N 3.45Å; T645-E647 PolarHBondContact OG1-N 3.49Å
648	I	93.6	Very high	94.1	Very high	23 Å²	23	34.9 Å²	34.9	12%	0.118	18%	0.178	C	C	.	.	H	α-helix	trans	-85.5	-50.4	174.3	-67.8	166.8	0	0	0	111	I644 T645 T646 P652 F706 E707	I644-I648 HydrophobicContact CG2-CB 4.19Å; I644-I648 HydrophobicContact CG2-CD1 4.49Å; I644-I648 HydrophobicContact CG2-CG2 4Å; T645-I648 WeakPolarHBondContact O-CB 3.09Å; T645-I648 PolarHBondContact O-N 2.95Å; T646-I648 PolarHBondContact O-N 3.46Å; I648-P652 WeakPolarHBondContact O-CD 3.49Å; I648-P652 WeakPolarHBondContact O-CG 3.39Å; I648-F706 HydrophobicContact CG2-CB 4.17Å; I648-E707 HydrophobicContact CG1-CG 4.29Å; I648-E707 HydrophobicContact CG2-CG 3.75Å
649	Y	93.5	Very high	94	Very high	1 Å²	1	35.7 Å²	35.7	0%	0.004	19%	0.186	C	C	.	.	H	α-helix	trans	-94.8	-26.7	-168.6	72	-103.9	0	0	0	115.9	I624 I628 F639 I644 T645 T646 L653 Y710	I624-Y649 HydrophobicContact CG2-CE2 4.16Å; I628-Y649 HydrophobicContact CD1-CD2 4.19Å; I628-Y649 HydrophobicContact CD1-CE2 3.4Å; F639-Y649 AromaticContact CD2-CD1 3.97Å; F639-Y649 HydrophobicContact CD2-CD1 3.97Å; F639-Y649 AromaticContact CD2-CE1 3.66Å; F639-Y649 HydrophobicContact CD2-CE1 3.66Å; F639-Y649 AromaticContact CE2-CD1 3.95Å; F639-Y649 HydrophobicContact CE2-CD1 3.95Å; F639-Y649 HydrophobicContact CE2-CD2 4.21Å; F639-Y649 AromaticContact CE2-CE1 3.91Å; F639-Y649 HydrophobicContact CE2-CE1 3.91Å; F639-Y649 HydrophobicContact CE2-CE2 4.21Å; F639-Y649 HydrophobicContact CE2-CG 4.1Å; F639-Y649 HydrophobicContact CG-CE1 4.41Å; F639-Y649 HydrophobicContact CZ-CD1 4.48Å; F639-Y649 HydrophobicContact CZ-CG 4.42Å; I644-Y649 HydrophobicContact CG2-CD1 4.16Å; T645-Y649 WeakPolarHBondContact O-CD1 3.28Å; T645-Y649 PolarHBondContact O-N 3.25Å; T646-Y649 HydrophobicContact CG2-CE1 4.02Å; T646-Y649 HydrophobicContact CG2-CE2 4.41Å; T646-Y649 WeakPolarHBondContact CG2-OH 3.33Å; Y649-L653 WeakPolarHBondContact O-CD1 3.26Å; Y649-Y710 VanDerWaalsContact CB-CZ 3.49Å
650	A	95.7	Very high	94	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-33.1	-174.4	0	0	0	0	0	112.8	L621 I624 T646 L654 V686	L621-A650 HydrophobicContact CD2-CB 4Å; I624-A650 HydrophobicContact CD1-CB 4.05Å; I624-A650 HydrophobicContact CG2-CB 3.96Å; T646-A650 WeakPolarHBondContact O-CA 3.42Å; T646-A650 WeakPolarHBondContact O-CB 3.46Å; T646-A650 PolarHBondContact O-N 2.64Å; A650-L654 WeakPolarHBondContact O-CG 3.47Å; A650-L654 PolarHBondContact O-N 3.42Å; A650-V686 HydrophobicContact CB-CG1 3.78Å
651	W	95.8	Very high	94	Very high	27 Å²	27	35.2 Å²	35.2	10%	0.102	18%	0.178	C	C	.	.	H	α-helix	trans	-70.3	-43.1	-175.4	-175.2	-135.4	0	0	0	114.5	W575 W609 P616 P617 L621 T646 L653 L654 Q655	W575-W651 AromaticContact CD1-CZ2 3.79Å; W575-W651 HydrophobicContact CD2-CH2 4.3Å; W575-W651 AromaticContact CE2-CH2 3.71Å; W575-W651 HydrophobicContact CG-CZ2 4.43Å; W575-W651 AromaticContact CZ2-CH2 3.99Å; W575-W651 HydrophobicContact CZ2-CH2 3.99Å; W575-W651 AromaticContact NE1-CH2 3.61Å; W575-W651 AromaticContact NE1-CZ2 3.56Å; W609-W651 HydrophobicContact CE3-CH2 4.22Å; W609-W651 AromaticContact CE3-CZ3 3.87Å; W609-W651 HydrophobicContact CE3-CZ3 3.87Å; W609-W651 HydrophobicContact CZ3-CH2 4.48Å; W609-W651 AromaticContact CZ3-CZ3 3.96Å; W609-W651 HydrophobicContact CZ3-CZ3 3.96Å; P616-W651 HydrophobicContact CB-CD2 4.14Å; P616-W651 HydrophobicContact CB-CG 4.18Å; P617-W651 VanDerWaalsContact CD-CE3 3.45Å; P617-W651 HydrophobicContact CG-CE3 3.79Å; P617-W651 HydrophobicContact CG-CH2 4.2Å; P617-W651 HydrophobicContact CG-CZ3 3.55Å; L621-W651 HydrophobicContact CD1-CB 4.49Å; L621-W651 HydrophobicContact CD2-CB 4.04Å; T646-W651 PolarHBondContact O-N 3.29Å; T646-W651 VanDerWaalsContact O-N 3.07Å; W651-L653 VanDerWaalsContact C-N 3.31Å; W651-L653 PolarHBondContact O-N 2.9Å; W651-L654 HydrophobicContact CE3-CB 3.83Å; W651-L654 HydrophobicContact CE3-CD1 4.25Å; W651-L654 HydrophobicContact CZ3-CB 4.05Å; W651-L654 PolarHBondContact O-N 3.49Å; W651-Q655 HydrophobicContact CD2-CG 3.7Å; W651-Q655 VanDerWaalsContact CE2-CG 3.45Å; W651-Q655 HydrophobicContact CE3-CG 4.01Å; W651-Q655 HydrophobicContact CG-CG 4.29Å; W651-Q655 HydrophobicContact CH2-CG 3.85Å; W651-Q655 HydrophobicContact CZ2-CG 3.56Å; W651-Q655 HydrophobicContact CZ3-CG 4.06Å; W651-Q655 VanDerWaalsContact NE1-NE2 3.19Å; W651-Q655 WeakPolarHBondContact O-CG 3.42Å; W651-Q655 PolarHBondContact O-N 3.14Å
652	P	95	Very high	94	Very high	9 Å²	9	29.4 Å²	29.4	6%	0.058	15%	0.151	C	C	.	.	H	α-helix	trans	-60.6	-40.4	177.2	-25.2	36.2	0	0	0	112.6	I648 L654 Q655 T656	I648-P652 WeakPolarHBondContact O-CD 3.49Å; I648-P652 WeakPolarHBondContact O-CG 3.39Å; P652-L654 VanDerWaalsContact C-N 3.29Å; P652-L654 PolarHBondContact O-N 2.84Å; P652-Q655 PolarHBondContact O-N 3.38Å; P652-T656 PolarHBondContact O-N 3.46Å; P652-T656 VanDerWaalsContact O-N 3.15Å; P652-T656 PolarHBondContact O-OG1 3.4Å
653	L	96.1	Very high	94.1	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-59.2	-38.3	174.4	-63.3	-178.4	0	0	0	112.2	Y649 W651 G657 L658 V661 V686 Y689 Y710	Y649-L653 WeakPolarHBondContact O-CD1 3.26Å; W651-L653 VanDerWaalsContact C-N 3.31Å; W651-L653 PolarHBondContact O-N 2.9Å; L653-G657 PolarHBondContact O-N 2.84Å; L653-L658 HydrophobicContact CB-CD2 4.46Å; L653-L658 HydrophobicContact CB-CG 4.13Å; L653-L658 WeakPolarHBondContact O-CD1 3.37Å; L653-L658 PolarHBondContact O-N 2.95Å; L653-V661 HydrophobicContact CD2-CB 4.21Å; L653-V661 HydrophobicContact CD2-CG1 4.46Å; L653-V661 HydrophobicContact CD2-CG2 3.58Å; L653-V686 HydrophobicContact CB-CG1 4.29Å; L653-V686 HydrophobicContact CB-CG2 4.21Å; L653-V686 HydrophobicContact CD1-CG1 3.98Å; L653-Y689 HydrophobicContact CD1-CD1 3.75Å; L653-Y689 HydrophobicContact CD1-CE1 4.46Å; L653-Y689 HydrophobicContact CD1-CG 4.28Å; L653-Y710 HydrophobicContact CD1-CD1 3.97Å; L653-Y710 HydrophobicContact CD1-CE1 4.3Å; L653-Y710 HydrophobicContact CD2-CD1 4.43Å; L653-Y710 HydrophobicContact CG-CD1 4.29Å
654	L	96	Very high	94.1	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-75.1	-41.3	175.4	-70.4	173.6	0	0	0	112.5	F579 W609 I620 L621 I624 A650 W651 P652 T656 G657 L682 L683 V686	F579-L654 WeakPolarHBondContact CD2-O 3.47Å; W609-L654 HydrophobicContact CH2-CB 3.83Å; W609-L654 HydrophobicContact CH2-CD2 3.99Å; W609-L654 HydrophobicContact CH2-CG 4.41Å; W609-L654 HydrophobicContact CZ2-CB 4.43Å; W609-L654 HydrophobicContact CZ2-CD2 3.87Å; W609-L654 HydrophobicContact CZ3-CB 4.21Å; I620-L654 HydrophobicContact CG2-CD1 4.13Å; L621-L654 HydrophobicContact CD2-CD1 4.12Å; I624-L654 HydrophobicContact CD1-CD1 3.88Å; A650-L654 WeakPolarHBondContact O-CG 3.47Å; A650-L654 PolarHBondContact O-N 3.42Å; W651-L654 HydrophobicContact CE3-CB 3.83Å; W651-L654 HydrophobicContact CE3-CD1 4.25Å; W651-L654 HydrophobicContact CZ3-CB 4.05Å; W651-L654 PolarHBondContact O-N 3.49Å; P652-L654 VanDerWaalsContact C-N 3.29Å; P652-L654 PolarHBondContact O-N 2.84Å; L654-T656 VanDerWaalsContact C-N 3.28Å; L654-T656 PolarHBondContact O-N 3.24Å; L654-G657 PolarHBondContact O-N 2.79Å; L654-G657 VanDerWaalsContact O-N 3.17Å; L654-L682 HydrophobicContact CD2-CD1 4.48Å; L654-L682 HydrophobicContact CD2-CD2 4.13Å; L654-L682 HydrophobicContact CD2-CG 4.05Å; L654-L683 HydrophobicContact CD2-CD2 4.41Å; L654-V686 HydrophobicContact CD2-CG2 3.93Å; L654-V686 HydrophobicContact CG-CG2 4.29Å
655	Q	94.8	Very high	94.1	Very high	46 Å²	46	32 Å²	32	22%	0.215	17%	0.165	C	C	.	.	H	α-helix	trans	-59.9	-34.9	179.7	-76	-176.2	-44	0	0	113.2	W575 F579 W651 P652	W575-Q655 HydrophobicContact CB-CB 4.19Å; W575-Q655 HydrophobicContact CB-CG 4.02Å; W575-Q655 HydrophobicContact CG-CG 4.06Å; F579-Q655 WeakPolarHBondContact CB-O 3.31Å; F579-Q655 PolarHBondContact N-O 2.8Å; W651-Q655 HydrophobicContact CD2-CG 3.7Å; W651-Q655 VanDerWaalsContact CE2-CG 3.45Å; W651-Q655 HydrophobicContact CE3-CG 4.01Å; W651-Q655 HydrophobicContact CG-CG 4.29Å; W651-Q655 HydrophobicContact CH2-CG 3.85Å; W651-Q655 HydrophobicContact CZ2-CG 3.56Å; W651-Q655 HydrophobicContact CZ3-CG 4.06Å; W651-Q655 VanDerWaalsContact NE1-NE2 3.19Å; W651-Q655 WeakPolarHBondContact O-CG 3.42Å; W651-Q655 PolarHBondContact O-N 3.14Å; P652-Q655 PolarHBondContact O-N 3.38Å
656	T	94	Very high	94.1	Very high	7 Å²	7	30.8 Å²	30.8	4%	0.043	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	0.8	178.9	64.8	0	0	0	0	113.4	L578 P652 L654 L658 S659 E660	L578-T656 HydrophobicContact CB-CG2 4.39Å; P652-T656 PolarHBondContact O-N 3.46Å; P652-T656 VanDerWaalsContact O-N 3.15Å; P652-T656 PolarHBondContact O-OG1 3.4Å; L654-T656 VanDerWaalsContact C-N 3.28Å; L654-T656 PolarHBondContact O-N 3.24Å; T656-L658 PolarHBondContact O-N 3.03Å; T656-S659 WeakPolarHBondContact O-CB 3.36Å; T656-S659 PolarHBondContact O-N 2.99Å; T656-S659 PolarHBondContact O-OG 3.38Å; T656-S659 VanDerWaalsContact O-OG 3.07Å; T656-E660 HydrophobicContact CG2-CB 3.96Å; T656-E660 WeakPolarHBondContact CG2-OE2 3.43Å
657	G	93.6	Very high	94.1	Very high	2 Å²	2	30.7 Å²	30.7	2%	0.021	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	32.2	-171.8	0	0	0	0	0	112.5	L653 L654 S659 W667 W671	L653-G657 PolarHBondContact O-N 2.84Å; L654-G657 PolarHBondContact O-N 2.79Å; L654-G657 VanDerWaalsContact O-N 3.17Å; G657-S659 VanDerWaalsContact C-N 3.27Å; G657-S659 PolarHBondContact O-N 3.45Å; G657-W667 PolarHBondContact O-NE1 3.17Å; G657-W671 PolarHBondContact O-NE1 2.82Å
658	L	95.3	Very high	94.2	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.9	18.2	-172.4	-55.4	88.8	0	0	0	115.6	L653 T656 E660 V661 F662 L670 L682 V685 V686	L653-L658 HydrophobicContact CB-CD2 4.46Å; L653-L658 HydrophobicContact CB-CG 4.13Å; L653-L658 WeakPolarHBondContact O-CD1 3.37Å; L653-L658 PolarHBondContact O-N 2.95Å; T656-L658 PolarHBondContact O-N 3.03Å; L658-E660 VanDerWaalsContact C-N 3.33Å; L658-E660 PolarHBondContact O-N 3.37Å; L658-V661 PolarHBondContact O-N 2.73Å; L658-F662 HydrophobicContact CB-CD2 3.78Å; L658-F662 HydrophobicContact CB-CE2 3.94Å; L658-F662 HydrophobicContact CD2-CD2 4.45Å; L658-F662 HydrophobicContact CD2-CE2 3.74Å; L658-F662 HydrophobicContact CG-CE2 4.49Å; L658-F662 PolarHBondContact O-N 3.09Å; L658-L670 HydrophobicContact CB-CD2 4.09Å; L658-L670 HydrophobicContact CD1-CD2 4.41Å; L658-L670 HydrophobicContact CD2-CD2 4.35Å; L658-L682 HydrophobicContact CD1-CD1 3.74Å; L658-V685 HydrophobicContact CD2-CG1 3.94Å; L658-V686 HydrophobicContact CD1-CG2 4.09Å; L658-V686 HydrophobicContact CD2-CG2 4.37Å
659	S	94.1	Very high	94.2	Very high	37 Å²	37	26.4 Å²	26.4	26%	0.259	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-10	-179.5	80.2	0	0	0	0	115.3	P582 T656 G657	P582-S659 VanDerWaalsContact CG-OG 3.25Å; P582-S659 WeakPolarHBondContact CG-OG 3.44Å; T656-S659 WeakPolarHBondContact O-CB 3.36Å; T656-S659 PolarHBondContact O-N 2.99Å; T656-S659 PolarHBondContact O-OG 3.38Å; T656-S659 VanDerWaalsContact O-OG 3.07Å; G657-S659 VanDerWaalsContact C-N 3.27Å; G657-S659 PolarHBondContact O-N 3.45Å
660	E	93.9	Very high	94.3	Very high	76 Å²	76	26.4 Å²	26.4	36%	0.355	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-28.6	173	-179.4	169.8	-153.3	0	0	111.6	T656 L658 H711	T656-E660 HydrophobicContact CG2-CB 3.96Å; T656-E660 WeakPolarHBondContact CG2-OE2 3.43Å; L658-E660 VanDerWaalsContact C-N 3.33Å; L658-E660 PolarHBondContact O-N 3.37Å; E660-H711 IonicContact OE1-CE1 2.7Å; E660-H711 IonicContact OE1-CG 2.77Å; E660-H711 IonicContact OE1-ND1 3.75Å; E660-H711 PolarHBondContact OE1-ND1 3.34Å; E660-H711 IonicContact OE2-CE1 3.36Å; E660-H711 IonicContact OE2-ND1 2.87Å; E660-H711 PolarHBondContact OE2-ND1 2.84Å
661	V	93.7	Very high	94.2	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-26.9	-170.2	171.3	0	0	0	0	112.7	L653 L658 Y689 Y710 S714	L653-V661 HydrophobicContact CD2-CB 4.21Å; L653-V661 HydrophobicContact CD2-CG1 4.46Å; L653-V661 HydrophobicContact CD2-CG2 3.58Å; L658-V661 PolarHBondContact O-N 2.73Å; V661-Y689 HydrophobicContact CG1-CD2 4.48Å; V661-Y689 HydrophobicContact CG1-CE1 4.26Å; V661-Y689 HydrophobicContact CG1-CE2 3.55Å; V661-Y689 VanDerWaalsContact CG1-CZ 3.44Å; V661-Y689 VanDerWaalsContact CG1-OH 3.28Å; V661-Y689 WeakPolarHBondContact CG1-OH 3.45Å; V661-Y710 WeakPolarHBondContact CG2-O 3.4Å; V661-S714 PolarHBondContact O-N 2.91Å
662	F	94.4	Very high	94.1	Very high	9 Å²	9	25.1 Å²	25.1	4%	0.039	13%	0.129	C	C	.	.	S	Bend	trans	-110	145.1	177.3	-66.9	-57.9	0	0	0	113	L658 E666 W667 L670 Y689 I718 I721	L658-F662 HydrophobicContact CB-CD2 3.78Å; L658-F662 HydrophobicContact CB-CE2 3.94Å; L658-F662 HydrophobicContact CD2-CD2 4.45Å; L658-F662 HydrophobicContact CD2-CE2 3.74Å; L658-F662 HydrophobicContact CG-CE2 4.49Å; L658-F662 PolarHBondContact O-N 3.09Å; F662-E666 HydrophobicContact CB-CB 3.98Å; F662-E666 HydrophobicContact CD1-CB 4.25Å; F662-E666 HydrophobicContact CG-CB 4.39Å; F662-W667 HydrophobicContact CB-CB 4.13Å; F662-L670 HydrophobicContact CD2-CD2 3.94Å; F662-L670 HydrophobicContact CE2-CD2 3.92Å; F662-Y689 HydrophobicContact CE1-CE2 4.3Å; F662-Y689 AromaticContact CZ-CD2 3.82Å; F662-Y689 HydrophobicContact CZ-CD2 3.82Å; F662-Y689 AromaticContact CZ-CE2 3.97Å; F662-Y689 HydrophobicContact CZ-CE2 3.97Å; F662-I718 HydrophobicContact CD1-CD1 4.37Å; F662-I718 HydrophobicContact CD2-CD1 4.46Å; F662-I718 HydrophobicContact CE1-CD1 3.94Å; F662-I718 HydrophobicContact CE2-CD1 4.03Å; F662-I718 HydrophobicContact CZ-CD1 3.77Å; F662-I721 HydrophobicContact CE1-CD1 3.89Å; F662-I721 HydrophobicContact CZ-CD1 3.81Å
663	N	92.2	Very high	94	Very high	68 Å²	68	25 Å²	25	36%	0.364	13%	0.129	S	C	.	.			trans	-67.8	166	171.2	-64	-77.3	0	0	0	111.5	D665 E666 W667 Q713	N663-D665 PolarHBondContact O-N 2.68Å; N663-E666 HydrophobicContact CB-CG 4.42Å; N663-E666 VanDerWaalsContact CB-OE2 3.27Å; N663-E666 WeakPolarHBondContact CB-OE2 3.41Å; N663-E666 PolarHBondContact N-OE2 2.89Å; N663-E666 PolarHBondContact ND2-OE2 3.34Å; N663-E666 PolarHBondContact O-N 3.22Å; N663-E666 VanDerWaalsContact O-N 3.1Å; N663-W667 VanDerWaalsContact O-CB 3.31Å; N663-W667 WeakPolarHBondContact O-CB 3.37Å; N663-W667 PolarHBondContact O-N 3.2Å; N663-Q713 PolarHBondContact ND2-NE2 3.06Å
664	E	91.2	Very high	93.9	Very high	103 Å²	103	25 Å²	25	48%	0.481	13%	0.129	S	C	.	.	H	α-helix	trans	-55.2	-49.4	-176	-176.6	161.1	-166.5	0	0	113.1	K585 E666 L668	K585-E664 WeakPolarHBondContact CE-OE2 3.45Å; K585-E664 VanDerWaalsContact NZ-CD 3.35Å; K585-E664 IonicContact NZ-OE1 2.75Å; K585-E664 IonicContact NZ-OE2 3.83Å; K585-E664 PolarHBondContact NZ-OE2 2.95Å; E664-E666 PolarHBondContact O-N 2.75Å; E664-L668 HydrophobicContact CG-CD1 3.95Å; E664-L668 WeakPolarHBondContact O-CB 3.31Å; E664-L668 WeakPolarHBondContact O-CD1 3.45Å; E664-L668 WeakPolarHBondContact O-CG 3.48Å; E664-L668 PolarHBondContact O-N 3.34Å
665	D	91.5	Very high	93.6	Very high	86 Å²	86	25 Å²	25	46%	0.46	13%	0.129	S	C	.	.	H	α-helix	trans	-62.8	-38.4	176.9	-88	-65.5	0	0	0	113.2	N663 L668 C669	N663-D665 PolarHBondContact O-N 2.68Å; D665-L668 PolarHBondContact O-N 3.33Å; D665-C669 PolarHBondContact O-N 2.96Å; D665-C669 PolarHBondContact O-SG 2.82Å
666	E	93.7	Very high	93.4	Very high	40 Å²	40	22.8 Å²	22.8	19%	0.187	12%	0.118	C	C	.	.	H	α-helix	trans	-70.8	-46.7	-178.5	-63.1	172.3	133.4	0	0	111.5	F662 N663 E664 L668 C669 L670 I718	F662-E666 HydrophobicContact CB-CB 3.98Å; F662-E666 HydrophobicContact CD1-CB 4.25Å; F662-E666 HydrophobicContact CG-CB 4.39Å; N663-E666 HydrophobicContact CB-CG 4.42Å; N663-E666 VanDerWaalsContact CB-OE2 3.27Å; N663-E666 WeakPolarHBondContact CB-OE2 3.41Å; N663-E666 PolarHBondContact N-OE2 2.89Å; N663-E666 PolarHBondContact ND2-OE2 3.34Å; N663-E666 PolarHBondContact O-N 3.22Å; N663-E666 VanDerWaalsContact O-N 3.1Å; E664-E666 PolarHBondContact O-N 2.75Å; E666-L668 PolarHBondContact O-N 3.15Å; E666-C669 WeakPolarHBondContact O-CB 3.24Å; E666-C669 PolarHBondContact O-N 3.05Å; E666-C669 VanDerWaalsContact O-N 3.11Å; E666-L670 PolarHBondContact O-N 2.72Å; E666-I718 HydrophobicContact CB-CB 4.35Å; E666-I718 HydrophobicContact CB-CG2 4.23Å; E666-I718 HydrophobicContact CG-CG2 4.25Å
667	W	95.3	Very high	93.2	Very high	12 Å²	12	25.4 Å²	25.4	5%	0.045	13%	0.128	C	C	.	.	H	α-helix	trans	-58.2	-35.6	173.2	-175.5	86.6	0	0	0	111.5	W513 P582 F583 G657 F662 N663 L670 W671	W513-W667 HydrophobicContact CH2-CH2 4.22Å; W513-W667 HydrophobicContact CH2-CZ3 4.07Å; P582-W667 HydrophobicContact CB-CD2 4.31Å; P582-W667 HydrophobicContact CB-CE3 4.39Å; P582-W667 HydrophobicContact CB-CH2 3.45Å; P582-W667 VanDerWaalsContact CB-CH2 3.45Å; P582-W667 HydrophobicContact CB-CZ2 3.31Å; P582-W667 HydrophobicContact CB-CZ3 3.99Å; P582-W667 HydrophobicContact CG-CZ2 4.16Å; F583-W667 AromaticContact CD1-CH2 3.76Å; F583-W667 HydrophobicContact CD1-CH2 3.76Å; F583-W667 HydrophobicContact CD1-CZ2 4.32Å; F583-W667 AromaticContact CE1-CH2 3.56Å; F583-W667 HydrophobicContact CE1-CH2 3.56Å; F583-W667 AromaticContact CE1-CZ2 3.78Å; F583-W667 HydrophobicContact CE1-CZ2 3.78Å; F583-W667 HydrophobicContact CE2-CZ2 4.28Å; F583-W667 HydrophobicContact CG-CH2 4.35Å; F583-W667 HydrophobicContact CZ-CH2 4.03Å; F583-W667 AromaticContact CZ-CZ2 3.76Å; F583-W667 HydrophobicContact CZ-CZ2 3.76Å; G657-W667 PolarHBondContact O-NE1 3.17Å; F662-W667 HydrophobicContact CB-CB 4.13Å; N663-W667 VanDerWaalsContact O-CB 3.31Å; N663-W667 WeakPolarHBondContact O-CB 3.37Å; N663-W667 PolarHBondContact O-N 3.2Å; W667-L670 WeakPolarHBondContact O-CB 3.47Å; W667-L670 PolarHBondContact O-N 2.76Å; W667-W671 AromaticContact CD1-CD1 3.87Å; W667-W671 AromaticContact CD1-NE1 3.99Å; W667-W671 AromaticContact CD2-CD1 3.71Å; W667-W671 AromaticContact CE2-CD1 3.2Å; W667-W671 AromaticContact CE2-NE1 3.41Å; W667-W671 HydrophobicContact CH2-CG 4.25Å; W667-W671 AromaticContact CZ2-CD1 3.43Å; W667-W671 VanDerWaalsContact CZ2-CD1 3.43Å; W667-W671 HydrophobicContact CZ2-CD2 4.3Å; W667-W671 AromaticContact CZ2-CG 3.91Å; W667-W671 HydrophobicContact CZ2-CG 3.91Å; W667-W671 AromaticContact CZ2-NE1 3.55Å; W667-W671 AromaticContact NE1-CD1 3.36Å; W667-W671 AromaticContact NE1-NE1 3.21Å; W667-W671 PolarHBondContact O-N 3.06Å
668	L	94.4	Very high	92.8	Very high	14 Å²	14	26.9 Å²	26.9	7%	0.073	14%	0.138	C	C	.	.	H	α-helix	trans	-70.9	-37.8	174.8	-69.5	169	0	0	0	113	W513 L586 E664 D665 E666 L670 D672	W513-L668 HydrophobicContact CH2-CD2 4.3Å; W513-L668 HydrophobicContact CZ2-CD2 4.32Å; L586-L668 HydrophobicContact CD1-CD2 3.22Å; E664-L668 HydrophobicContact CG-CD1 3.95Å; E664-L668 WeakPolarHBondContact O-CB 3.31Å; E664-L668 WeakPolarHBondContact O-CD1 3.45Å; E664-L668 WeakPolarHBondContact O-CG 3.48Å; E664-L668 PolarHBondContact O-N 3.34Å; D665-L668 PolarHBondContact O-N 3.33Å; E666-L668 PolarHBondContact O-N 3.15Å; L668-L670 VanDerWaalsContact C-N 3.31Å; L668-D672 VanDerWaalsContact O-CB 3.24Å; L668-D672 WeakPolarHBondContact O-CB 3.36Å; L668-D672 PolarHBondContact O-N 3.09Å
669	C	93.8	Very high	92.4	Very high	16 Å²	16	28 Å²	28	11%	0.108	15%	0.146	C	C	.	.	H	α-helix	trans	-63.9	-39	171.7	-58.9	0	0	0	0	111.5	K503 D665 E666 S673 I718	K503-C669 HydrophobicContact CB-CB 4.26Å; K503-C669 VanDerWaalsContact CB-SG 3.56Å; K503-C669 WeakPolarHBondContact CD-SG 3.45Å; D665-C669 PolarHBondContact O-N 2.96Å; D665-C669 PolarHBondContact O-SG 2.82Å; E666-C669 WeakPolarHBondContact O-CB 3.24Å; E666-C669 PolarHBondContact O-N 3.05Å; E666-C669 VanDerWaalsContact O-N 3.11Å; C669-S673 PolarHBondContact O-N 3.03Å; C669-S673 PolarHBondContact O-OG 3.42Å; C669-S673 VanDerWaalsContact O-OG 3.1Å; C669-I718 HydrophobicContact CB-CG2 4.47Å
670	L	95	Very high	92.3	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-61.9	-53.7	174.5	176.4	56.4	0	0	0	111.5	L658 F662 E666 W667 L668 S673 L674 V685 I718 I722	L658-L670 HydrophobicContact CB-CD2 4.09Å; L658-L670 HydrophobicContact CD1-CD2 4.41Å; L658-L670 HydrophobicContact CD2-CD2 4.35Å; F662-L670 HydrophobicContact CD2-CD2 3.94Å; F662-L670 HydrophobicContact CE2-CD2 3.92Å; E666-L670 PolarHBondContact O-N 2.72Å; W667-L670 WeakPolarHBondContact O-CB 3.47Å; W667-L670 PolarHBondContact O-N 2.76Å; L668-L670 VanDerWaalsContact C-N 3.31Å; L670-S673 CarbonylContact O-C 3.55Å; L670-S673 WeakPolarHBondContact O-CA 3.26Å; L670-S673 WeakPolarHBondContact O-CB 3.18Å; L670-S673 PolarHBondContact O-N 2.91Å; L670-S673 VanDerWaalsContact O-N 3.1Å; L670-L674 HydrophobicContact CD1-CD1 3.88Å; L670-L674 HydrophobicContact CD1-CD2 4.28Å; L670-L674 HydrophobicContact CD1-CG 3.86Å; L670-L674 HydrophobicContact CD2-CD1 4.4Å; L670-L674 HydrophobicContact CG-CD1 3.79Å; L670-L674 HydrophobicContact CG-CG 4.2Å; L670-L674 WeakPolarHBondContact O-CG 3.48Å; L670-L674 PolarHBondContact O-N 2.89Å; L670-V685 HydrophobicContact CD1-CB 4.41Å; L670-V685 HydrophobicContact CD1-CG1 3.82Å; L670-V685 HydrophobicContact CD1-CG2 3.88Å; L670-V685 HydrophobicContact CD2-CG1 4.34Å; L670-I718 HydrophobicContact CB-CD1 4.08Å; L670-I718 HydrophobicContact CB-CG1 4.44Å; L670-I722 HydrophobicContact CD1-CG1 4.28Å
671	W	95.2	Very high	92.3	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-74.8	-28.1	-176.1	-80.9	88	0	0	0	114	W513 F579 F583 I601 G657 W667 S673 L674 I675	W513-W671 HydrophobicContact CH2-CB 3.68Å; W513-W671 HydrophobicContact CZ2-CB 3.67Å; F579-W671 HydrophobicContact CZ-CH2 4.31Å; F583-W671 AromaticContact CE1-CD2 4Å; F583-W671 HydrophobicContact CE1-CD2 4Å; F583-W671 AromaticContact CE1-CE3 3.9Å; F583-W671 HydrophobicContact CE1-CE3 3.9Å; F583-W671 HydrophobicContact CE1-CZ3 4.21Å; F583-W671 AromaticContact CZ-CD2 3.94Å; F583-W671 HydrophobicContact CZ-CD2 3.94Å; F583-W671 AromaticContact CZ-CE2 3.87Å; F583-W671 AromaticContact CZ-CE3 3.93Å; F583-W671 HydrophobicContact CZ-CE3 3.93Å; F583-W671 AromaticContact CZ-CH2 3.83Å; F583-W671 HydrophobicContact CZ-CH2 3.83Å; F583-W671 AromaticContact CZ-CZ2 3.82Å; F583-W671 HydrophobicContact CZ-CZ2 3.82Å; F583-W671 AromaticContact CZ-CZ3 3.89Å; F583-W671 HydrophobicContact CZ-CZ3 3.89Å; I601-W671 HydrophobicContact CD1-CE3 4.2Å; I601-W671 HydrophobicContact CD1-CZ3 3.86Å; I601-W671 HydrophobicContact CG1-CZ3 4.31Å; I601-W671 HydrophobicContact CG2-CH2 3.75Å; I601-W671 HydrophobicContact CG2-CZ3 3.75Å; G657-W671 PolarHBondContact O-NE1 2.82Å; W667-W671 AromaticContact CD1-CD1 3.87Å; W667-W671 AromaticContact CD1-NE1 3.99Å; W667-W671 AromaticContact CD2-CD1 3.71Å; W667-W671 AromaticContact CE2-CD1 3.2Å; W667-W671 AromaticContact CE2-NE1 3.41Å; W667-W671 HydrophobicContact CH2-CG 4.25Å; W667-W671 AromaticContact CZ2-CD1 3.43Å; W667-W671 VanDerWaalsContact CZ2-CD1 3.43Å; W667-W671 HydrophobicContact CZ2-CD2 4.3Å; W667-W671 AromaticContact CZ2-CG 3.91Å; W667-W671 HydrophobicContact CZ2-CG 3.91Å; W667-W671 AromaticContact CZ2-NE1 3.55Å; W667-W671 AromaticContact NE1-CD1 3.36Å; W667-W671 AromaticContact NE1-NE1 3.21Å; W667-W671 PolarHBondContact O-N 3.06Å; W671-S673 PolarHBondContact O-N 3.04Å; W671-L674 HydrophobicContact CD2-CB 4.42Å; W671-L674 HydrophobicContact CD2-CD1 3.74Å; W671-L674 HydrophobicContact CE3-CB 4.14Å; W671-L674 HydrophobicContact CE3-CD1 4.11Å; W671-L674 HydrophobicContact CG-CD1 4.14Å; W671-L674 HydrophobicContact CH2-CD1 4.3Å; W671-L674 HydrophobicContact CZ2-CD1 3.94Å; W671-L674 HydrophobicContact CZ3-CD1 4.38Å; W671-L674 PolarHBondContact O-N 3.37Å; W671-I675 HydrophobicContact CE3-CD1 4.31Å; W671-I675 HydrophobicContact CE3-CG1 4.11Å; W671-I675 WeakPolarHBondContact O-CB 3.4Å; W671-I675 WeakPolarHBondContact O-CD1 3.48Å; W671-I675 VanDerWaalsContact O-CG1 3.3Å; W671-I675 WeakPolarHBondContact O-CG1 3.15Å; W671-I675 PolarHBondContact O-N 3.49Å; W671-I675 VanDerWaalsContact O-N 3.11Å
672	D	93.7	Very high	92.3	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-52.3	-42.4	164.4	-77.8	-16.6	0	0	0	111	L498 F504 R509 W513 L668 C676	L498-D672 WeakPolarHBondContact CD1-O 3.25Å; L498-D672 HydrophobicContact CD2-CB 4.01Å; F504-D672 HydrophobicContact CD2-CB 3.67Å; F504-D672 VanDerWaalsContact CD2-CG 3.45Å; F504-D672 WeakPolarHBondContact CD2-OD1 3.28Å; F504-D672 HydrophobicContact CE2-CB 4.01Å; F504-D672 HydrophobicContact CG-CB 4.38Å; F504-D672 PolarHBondContact N-OD2 3.35Å; R509-D672 WeakPolarHBondContact CD-OD1 3.49Å; R509-D672 WeakPolarHBondContact CG-OD1 3.32Å; R509-D672 IonicContact CZ-OD1 2.94Å; R509-D672 IonicContact CZ-OD2 2.76Å; R509-D672 VanDerWaalsContact CZ-OD2 3.3Å; R509-D672 VanDerWaalsContact NE-CG 3.29Å; R509-D672 IonicContact NE-OD1 3.17Å; R509-D672 PolarHBondContact NE-OD1 2.9Å; R509-D672 IonicContact NE-OD2 3.8Å; R509-D672 PolarHBondContact NE-OD2 3.31Å; R509-D672 IonicContact NH2-OD1 3.4Å; R509-D672 IonicContact NH2-OD2 3.88Å; R509-D672 PolarHBondContact NH2-OD2 3.41Å; W513-D672 PolarHBondContact NE1-OD1 3.4Å; L668-D672 VanDerWaalsContact O-CB 3.24Å; L668-D672 WeakPolarHBondContact O-CB 3.36Å; L668-D672 PolarHBondContact O-N 3.09Å; D672-C676 PolarHBondContact O-SG 2.87Å
673	S	92.3	Very high	92.3	Very high	6 Å²	6	22.9 Å²	22.9	4%	0.042	12%	0.118	C	C	.	.	H	α-helix	trans	-73.1	-55.6	175.9	-57.9	0	0	0	0	112.2	C669 L670 W671 I675 C676 Y677	C669-S673 PolarHBondContact O-N 3.03Å; C669-S673 PolarHBondContact O-OG 3.42Å; C669-S673 VanDerWaalsContact O-OG 3.1Å; L670-S673 CarbonylContact O-C 3.55Å; L670-S673 WeakPolarHBondContact O-CA 3.26Å; L670-S673 WeakPolarHBondContact O-CB 3.18Å; L670-S673 PolarHBondContact O-N 2.91Å; L670-S673 VanDerWaalsContact O-N 3.1Å; W671-S673 PolarHBondContact O-N 3.04Å; S673-I675 PolarHBondContact O-N 3.01Å; S673-I675 VanDerWaalsContact O-N 3.13Å; S673-C676 PolarHBondContact O-N 3.21Å; S673-Y677 WeakPolarHBondContact O-CD2 3.37Å; S673-Y677 PolarHBondContact O-N 3.23Å
674	L	93.3	Very high	92.5	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-52.7	-40.7	-175.4	-69.5	174.4	0	0	0	113	W605 L670 W671 C676 L681 L682 V685	W605-L674 WeakPolarHBondContact CZ2-O 3.47Å; L670-L674 HydrophobicContact CD1-CD1 3.88Å; L670-L674 HydrophobicContact CD1-CD2 4.28Å; L670-L674 HydrophobicContact CD1-CG 3.86Å; L670-L674 HydrophobicContact CD2-CD1 4.4Å; L670-L674 HydrophobicContact CG-CD1 3.79Å; L670-L674 HydrophobicContact CG-CG 4.2Å; L670-L674 WeakPolarHBondContact O-CG 3.48Å; L670-L674 PolarHBondContact O-N 2.89Å; W671-L674 HydrophobicContact CD2-CB 4.42Å; W671-L674 HydrophobicContact CD2-CD1 3.74Å; W671-L674 HydrophobicContact CE3-CB 4.14Å; W671-L674 HydrophobicContact CE3-CD1 4.11Å; W671-L674 HydrophobicContact CG-CD1 4.14Å; W671-L674 HydrophobicContact CH2-CD1 4.3Å; W671-L674 HydrophobicContact CZ2-CD1 3.94Å; W671-L674 HydrophobicContact CZ3-CD1 4.38Å; W671-L674 PolarHBondContact O-N 3.37Å; L674-C676 VanDerWaalsContact C-N 3.29Å; L674-C676 PolarHBondContact O-N 3.21Å; L674-L681 HydrophobicContact CD2-CB 4.16Å; L674-L681 HydrophobicContact CD2-CD2 4.21Å; L674-L681 HydrophobicContact CD2-CG 3.96Å; L674-L682 HydrophobicContact CD1-CD1 3.95Å; L674-L682 HydrophobicContact CD2-CB 4.02Å; L674-L682 HydrophobicContact CD2-CD1 4.47Å; L674-V685 HydrophobicContact CD2-CG2 4.32Å
675	I	90.9	Very high	92.7	Very high	1 Å²	1	14.8 Å²	14.8	1%	0.005	8%	0.079	C	C	.	.	H	α-helix	trans	-66.8	-28.1	-179	-70.6	168.2	0	0	0	112.5	R491 W513 V516 L517 W671 S673	R491-I675 PolarHBondContact NH1-O 3.48Å; W513-I675 HydrophobicContact CD2-CD1 3.49Å; W513-I675 VanDerWaalsContact CD2-CD1 3.49Å; W513-I675 HydrophobicContact CE3-CD1 3.68Å; W513-I675 HydrophobicContact CG-CD1 4Å; W513-I675 HydrophobicContact CH2-CD1 4.1Å; W513-I675 HydrophobicContact CZ2-CD1 3.94Å; W513-I675 HydrophobicContact CZ3-CD1 3.98Å; V516-I675 HydrophobicContact CB-CG2 3.93Å; V516-I675 HydrophobicContact CG1-CG2 3.57Å; V516-I675 WeakPolarHBondContact CG1-O 3.19Å; L517-I675 HydrophobicContact CD1-CD1 4.2Å; L517-I675 HydrophobicContact CD2-CG1 4.34Å; L517-I675 HydrophobicContact CD2-CG2 3.92Å; L517-I675 HydrophobicContact CG-CG2 3.87Å; W671-I675 HydrophobicContact CE3-CD1 4.31Å; W671-I675 HydrophobicContact CE3-CG1 4.11Å; W671-I675 WeakPolarHBondContact O-CB 3.4Å; W671-I675 WeakPolarHBondContact O-CD1 3.48Å; W671-I675 VanDerWaalsContact O-CG1 3.3Å; W671-I675 WeakPolarHBondContact O-CG1 3.15Å; W671-I675 PolarHBondContact O-N 3.49Å; W671-I675 VanDerWaalsContact O-N 3.11Å; S673-I675 PolarHBondContact O-N 3.01Å; S673-I675 VanDerWaalsContact O-N 3.13Å
676	C	89.6	Confident	93	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-89.4	-14.7	-175.9	-66.2	0	0	0	0	114.8	R495 L498 F504 D672 S673 L674	R495-C676 HydrophobicContact CG-CB 4.13Å; R495-C676 PolarHBondContact NH1-O 3.21Å; L498-C676 HydrophobicContact CD1-CB 3.78Å; F504-C676 VanDerWaalsContact CZ-SG 3.6Å; D672-C676 PolarHBondContact O-SG 2.87Å; S673-C676 PolarHBondContact O-N 3.21Å; L674-C676 VanDerWaalsContact C-N 3.29Å; L674-C676 PolarHBondContact O-N 3.21Å
677	Y	89.5	Confident	93.1	Very high	63 Å²	63	8.8 Å²	8.8	25%	0.247	5%	0.048	C	C	.	.	S	Bend	trans	-109.7	-173.2	-179.8	-74.3	-95.3	0	0	0	111.9	R495 S673 L681 H726	R495-Y677 HydrophobicContact CB-CE2 4.32Å; R495-Y677 VanDerWaalsContact CD-CZ 3.45Å; R495-Y677 HydrophobicContact CG-CD1 4.49Å; R495-Y677 HydrophobicContact CG-CD2 4.04Å; R495-Y677 HydrophobicContact CG-CE1 4.09Å; R495-Y677 HydrophobicContact CG-CE2 3.57Å; R495-Y677 HydrophobicContact CG-CG 4.48Å; S673-Y677 WeakPolarHBondContact O-CD2 3.37Å; S673-Y677 PolarHBondContact O-N 3.23Å; Y677-L681 HydrophobicContact CD2-CD2 3.92Å; Y677-L681 HydrophobicContact CG-CD2 3.87Å; Y677-H726 AromaticContact CD1-CE1 3.53Å; Y677-H726 AromaticContact CD2-CE1 3.97Å; Y677-H726 AromaticContact CE1-CE1 3.27Å; Y677-H726 WeakPolarHBondContact CE1-CE1 3.25Å; Y677-H726 AromaticContact CE1-ND1 3.95Å; Y677-H726 AromaticContact CE1-NE2 3.99Å; Y677-H726 AromaticContact CE2-CE1 3.76Å; Y677-H726 AromaticContact CE2-NE2 3.79Å; Y677-H726 AromaticContact CG-CE1 3.87Å; Y677-H726 AromaticContact CZ-CE1 3.41Å; Y677-H726 VanDerWaalsContact CZ-CE1 3.41Å; Y677-H726 AromaticContact CZ-NE2 3.64Å
678	S	86.2	Confident	93.1	Very high	32 Å²	32	8.2 Å²	8.2	22%	0.224	5%	0.046	C	C	.	.			trans	-70.9	147.9	172.1	163.2	0	0	0	0	110.8	S680 L681	S678-S680 WeakPolarHBondContact CB-OG 3.21Å; S678-S680 PolarHBondContact O-N 3.19Å; S678-S680 PolarHBondContact OG-N 2.82Å; S678-S680 PolarHBondContact OG-OG 2.91Å; S678-L681 WeakPolarHBondContact O-CB 3.39Å; S678-L681 PolarHBondContact O-N 3.19Å
679	P	87.2	Confident	93.2	Very high	25 Å²	25	7.6 Å²	7.6	16%	0.162	4%	0.042	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-25.5	172.2	-28.1	35.9	0	0	0	114.8	N604 W605 L681 L682	N604-P679 WeakPolarHBondContact O-CB 3.27Å; N604-P679 WeakPolarHBondContact O-CG 3.28Å; W605-P679 HydrophobicContact CD2-CG 4.45Å; W605-P679 HydrophobicContact CG-CB 4.1Å; W605-P679 HydrophobicContact CG-CG 4.48Å; P679-L681 PolarHBondContact O-N 2.83Å; P679-L681 VanDerWaalsContact O-N 3.11Å; P679-L682 WeakPolarHBondContact O-CB 3.47Å; P679-L682 PolarHBondContact O-N 2.89Å
680	S	90.2	Very high	93.3	Very high	5 Å²	5	6.8 Å²	6.8	4%	0.035	4%	0.037	C	C	.	.	H	α-helix	trans	-57.3	-20.8	172.4	63.2	0	0	0	0	114.7	S678 L682 L683 A684	S678-S680 WeakPolarHBondContact CB-OG 3.21Å; S678-S680 PolarHBondContact O-N 3.19Å; S678-S680 PolarHBondContact OG-N 2.82Å; S678-S680 PolarHBondContact OG-OG 2.91Å; S680-L682 VanDerWaalsContact C-N 3.34Å; S680-L683 PolarHBondContact O-N 3.08Å; S680-A684 PolarHBondContact O-N 3.14Å; S680-A684 VanDerWaalsContact O-N 3.17Å
681	L	93.9	Very high	93.3	Very high	1 Å²	1	7.5 Å²	7.5	1%	0.005	4%	0.04	C	C	.	.	H	α-helix	trans	-67.7	-31.9	173.7	-174.1	63.4	0	0	0	112.3	L674 Y677 S678 P679 L683 A684 V685 A725 L729	L674-L681 HydrophobicContact CD2-CB 4.16Å; L674-L681 HydrophobicContact CD2-CD2 4.21Å; L674-L681 HydrophobicContact CD2-CG 3.96Å; Y677-L681 HydrophobicContact CD2-CD2 3.92Å; Y677-L681 HydrophobicContact CG-CD2 3.87Å; S678-L681 WeakPolarHBondContact O-CB 3.39Å; S678-L681 PolarHBondContact O-N 3.19Å; P679-L681 PolarHBondContact O-N 2.83Å; P679-L681 VanDerWaalsContact O-N 3.11Å; L681-L683 VanDerWaalsContact C-N 3.31Å; L681-L683 PolarHBondContact O-N 3.11Å; L681-A684 PolarHBondContact O-N 2.97Å; L681-V685 HydrophobicContact CD1-CG2 4.41Å; L681-V685 HydrophobicContact CG-CG2 4.29Å; L681-V685 WeakPolarHBondContact O-CB 3.16Å; L681-V685 VanDerWaalsContact O-CG2 3.29Å; L681-V685 WeakPolarHBondContact O-CG2 3.27Å; L681-V685 PolarHBondContact O-N 3.1Å; L681-A725 HydrophobicContact CD1-CB 3.89Å; L681-L729 HydrophobicContact CB-CD1 4.3Å; L681-L729 HydrophobicContact CD1-CD1 3.8Å
682	L	95	Very high	93.3	Very high	3 Å²	3	9.5 Å²	9.5	2%	0.016	5%	0.054	C	C	.	.	H	α-helix	trans	-61.7	-42.6	175.9	177.4	59.4	0	0	0	110.9	W605 W609 L654 L658 L674 P679 S680 V685 V686	W605-L682 HydrophobicContact CB-CD2 4.31Å; W609-L682 HydrophobicContact CZ2-CD2 4.11Å; L654-L682 HydrophobicContact CD2-CD1 4.48Å; L654-L682 HydrophobicContact CD2-CD2 4.13Å; L654-L682 HydrophobicContact CD2-CG 4.05Å; L658-L682 HydrophobicContact CD1-CD1 3.74Å; L674-L682 HydrophobicContact CD1-CD1 3.95Å; L674-L682 HydrophobicContact CD2-CB 4.02Å; L674-L682 HydrophobicContact CD2-CD1 4.47Å; P679-L682 WeakPolarHBondContact O-CB 3.47Å; P679-L682 PolarHBondContact O-N 2.89Å; S680-L682 VanDerWaalsContact C-N 3.34Å; L682-V685 PolarHBondContact O-N 2.93Å; L682-V686 WeakPolarHBondContact O-CG2 3.29Å; L682-V686 PolarHBondContact O-N 3.02Å
683	L	94.9	Very high	93.2	Very high	4 Å²	4	9.6 Å²	9.6	2%	0.021	6%	0.055	C	C	.	.	H	α-helix	trans	-69.2	-40.2	179.7	-47.6	-169.3	0	0	0	111.3	I620 M623 I624 L654 S680 L681 V685 V686 A687 P738 L742	I620-L683 HydrophobicContact CD1-CD1 4.35Å; I620-L683 HydrophobicContact CG2-CD1 4.01Å; I620-L683 HydrophobicContact CG2-CD2 3.39Å; I620-L683 HydrophobicContact CG2-CG 4.35Å; M623-L683 HydrophobicContact CB-CD1 4.24Å; M623-L683 HydrophobicContact SD-CD1 4.02Å; I624-L683 HydrophobicContact CD1-CD2 4.24Å; I624-L683 HydrophobicContact CG1-CB 3.98Å; I624-L683 HydrophobicContact CG1-CD2 4.49Å; L654-L683 HydrophobicContact CD2-CD2 4.41Å; S680-L683 PolarHBondContact O-N 3.08Å; L681-L683 VanDerWaalsContact C-N 3.31Å; L681-L683 PolarHBondContact O-N 3.11Å; L683-V685 VanDerWaalsContact C-N 3.34Å; L683-V686 PolarHBondContact O-N 3.1Å; L683-A687 PolarHBondContact O-N 2.81Å; L683-P738 HydrophobicContact CD1-CB 4.15Å; L683-L742 HydrophobicContact CD1-CD1 4.11Å
684	A	95.4	Very high	93.3	Very high	1 Å²	1	13.7 Å²	13.7	1%	0.008	7%	0.069	C	C	.	.	H	α-helix	trans	-67.2	-32.3	173.8	0	0	0	0	0	112.8	S680 L681 S688 A725 L729	S680-A684 PolarHBondContact O-N 3.14Å; S680-A684 VanDerWaalsContact O-N 3.17Å; L681-A684 PolarHBondContact O-N 2.97Å; A684-S688 WeakPolarHBondContact O-CB 3.4Å; A684-S688 PolarHBondContact O-N 3.05Å; A684-S688 PolarHBondContact O-OG 2.83Å; A684-A725 HydrophobicContact CB-CB 4.14Å; A684-L729 HydrophobicContact CB-CD1 4.17Å; A684-L729 HydrophobicContact CB-CD2 3.83Å; A684-L729 HydrophobicContact CB-CG 3.67Å
685	V	96.6	Very high	93.1	Very high	1 Å²	1	16.4 Å²	16.4	1%	0.006	10%	0.097	C	C	.	.	H	α-helix	trans	-65.4	-49.4	172.6	164	0	0	0	0	110.5	L658 L670 L674 L681 L682 L683 A687 S688 Y689 I721 A725	L658-V685 HydrophobicContact CD2-CG1 3.94Å; L670-V685 HydrophobicContact CD1-CB 4.41Å; L670-V685 HydrophobicContact CD1-CG1 3.82Å; L670-V685 HydrophobicContact CD1-CG2 3.88Å; L670-V685 HydrophobicContact CD2-CG1 4.34Å; L674-V685 HydrophobicContact CD2-CG2 4.32Å; L681-V685 HydrophobicContact CD1-CG2 4.41Å; L681-V685 HydrophobicContact CG-CG2 4.29Å; L681-V685 WeakPolarHBondContact O-CB 3.16Å; L681-V685 VanDerWaalsContact O-CG2 3.29Å; L681-V685 WeakPolarHBondContact O-CG2 3.27Å; L681-V685 PolarHBondContact O-N 3.1Å; L682-V685 PolarHBondContact O-N 2.93Å; L683-V685 VanDerWaalsContact C-N 3.34Å; V685-A687 VanDerWaalsContact C-N 3.33Å; V685-A687 PolarHBondContact O-N 3.23Å; V685-S688 WeakPolarHBondContact CA-OG 3.01Å; V685-S688 CarbonylContact O-C 3.6Å; V685-S688 PolarHBondContact O-N 2.82Å; V685-S688 VanDerWaalsContact O-N 3.11Å; V685-S688 PolarHBondContact O-OG 3.25Å; V685-Y689 PolarHBondContact O-N 3.46Å; V685-I721 HydrophobicContact CG1-CG2 4.21Å; V685-A725 HydrophobicContact CB-CB 4.41Å; V685-A725 HydrophobicContact CG2-CB 3.66Å
686	V	96.6	Very high	93.1	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-59.5	-43.7	177.6	174.5	0	0	0	0	111.3	I624 A650 L653 L654 L658 L682 L683 Y689 S690	I624-V686 HydrophobicContact CD1-CB 4.11Å; I624-V686 HydrophobicContact CD1-CG1 3.88Å; I624-V686 HydrophobicContact CG2-CG1 4.13Å; A650-V686 HydrophobicContact CB-CG1 3.78Å; L653-V686 HydrophobicContact CB-CG1 4.29Å; L653-V686 HydrophobicContact CB-CG2 4.21Å; L653-V686 HydrophobicContact CD1-CG1 3.98Å; L654-V686 HydrophobicContact CD2-CG2 3.93Å; L654-V686 HydrophobicContact CG-CG2 4.29Å; L658-V686 HydrophobicContact CD1-CG2 4.09Å; L658-V686 HydrophobicContact CD2-CG2 4.37Å; L682-V686 WeakPolarHBondContact O-CG2 3.29Å; L682-V686 PolarHBondContact O-N 3.02Å; L683-V686 PolarHBondContact O-N 3.1Å; V686-Y689 PolarHBondContact O-N 2.91Å; V686-S690 PolarHBondContact O-N 2.83Å
687	A	96.2	Very high	93.2	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-61.9	-44.6	172.5	0	0	0	0	0	112.7	I624 I627 I628 L683 V685 Y689 S690 I691 L728	I624-A687 HydrophobicContact CG2-CB 4.2Å; I627-A687 HydrophobicContact CB-CB 4.12Å; I627-A687 HydrophobicContact CG2-CB 3.66Å; I628-A687 HydrophobicContact CD1-CB 4.4Å; I628-A687 HydrophobicContact CG1-CB 3.81Å; L683-A687 PolarHBondContact O-N 2.81Å; V685-A687 VanDerWaalsContact C-N 3.33Å; V685-A687 PolarHBondContact O-N 3.23Å; A687-Y689 VanDerWaalsContact C-N 3.3Å; A687-Y689 PolarHBondContact O-N 2.91Å; A687-S690 PolarHBondContact O-N 2.88Å; A687-I691 WeakPolarHBondContact O-CD1 3.22Å; A687-I691 VanDerWaalsContact O-CG1 3.28Å; A687-I691 WeakPolarHBondContact O-CG1 3.26Å; A687-I691 PolarHBondContact O-N 3.46Å; A687-I691 VanDerWaalsContact O-N 3.08Å; A687-L728 HydrophobicContact CB-CD1 4.48Å
688	S	95.9	Very high	93.4	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-65.9	-31.1	179.6	73.3	0	0	0	0	113	A684 V685 I691 C692 I721	A684-S688 WeakPolarHBondContact O-CB 3.4Å; A684-S688 PolarHBondContact O-N 3.05Å; A684-S688 PolarHBondContact O-OG 2.83Å; V685-S688 WeakPolarHBondContact CA-OG 3.01Å; V685-S688 CarbonylContact O-C 3.6Å; V685-S688 PolarHBondContact O-N 2.82Å; V685-S688 VanDerWaalsContact O-N 3.11Å; V685-S688 PolarHBondContact O-OG 3.25Å; S688-I691 PolarHBondContact O-N 2.7Å; S688-C692 VanDerWaalsContact O-CB 3.31Å; S688-C692 WeakPolarHBondContact O-CB 3.45Å; S688-C692 PolarHBondContact O-N 2.86Å; S688-C692 PolarHBondContact O-SG 3.17Å; S688-C692 VanDerWaalsContact O-SG 3.34Å; S688-I721 WeakPolarHBondContact OG-CG2 3.36Å; S688-I721 PolarHBondContact OG-O 3.07Å
689	Y	96.6	Very high	93.6	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-59.8	-57	175.7	-175.8	-95.4	0	0	0	109.8	L653 V661 F662 V685 V686 A687 I691 C692 S693 Y709 Y710 S714 L716 I721	L653-Y689 HydrophobicContact CD1-CD1 3.75Å; L653-Y689 HydrophobicContact CD1-CE1 4.46Å; L653-Y689 HydrophobicContact CD1-CG 4.28Å; V661-Y689 HydrophobicContact CG1-CD2 4.48Å; V661-Y689 HydrophobicContact CG1-CE1 4.26Å; V661-Y689 HydrophobicContact CG1-CE2 3.55Å; V661-Y689 VanDerWaalsContact CG1-CZ 3.44Å; V661-Y689 VanDerWaalsContact CG1-OH 3.28Å; V661-Y689 WeakPolarHBondContact CG1-OH 3.45Å; F662-Y689 HydrophobicContact CE1-CE2 4.3Å; F662-Y689 AromaticContact CZ-CD2 3.82Å; F662-Y689 HydrophobicContact CZ-CD2 3.82Å; F662-Y689 AromaticContact CZ-CE2 3.97Å; F662-Y689 HydrophobicContact CZ-CE2 3.97Å; V685-Y689 PolarHBondContact O-N 3.46Å; V686-Y689 PolarHBondContact O-N 2.91Å; A687-Y689 VanDerWaalsContact C-N 3.3Å; A687-Y689 PolarHBondContact O-N 2.91Å; Y689-I691 VanDerWaalsContact C-N 3.31Å; Y689-I691 PolarHBondContact O-N 3.11Å; Y689-C692 PolarHBondContact O-N 2.88Å; Y689-C692 VanDerWaalsContact O-N 3.12Å; Y689-S693 PolarHBondContact O-N 3.1Å; Y689-S693 PolarHBondContact O-OG 2.84Å; Y689-Y709 HydrophobicContact CE1-CE1 4.08Å; Y689-Y710 HydrophobicContact CD1-CD1 4.19Å; Y689-Y710 AromaticContact CD1-CE1 3.92Å; Y689-Y710 HydrophobicContact CD1-CE1 3.92Å; Y689-Y710 AromaticContact CE1-CD1 3.92Å; Y689-Y710 HydrophobicContact CE1-CD1 3.92Å; Y689-Y710 AromaticContact CE1-CE1 3.89Å; Y689-Y710 HydrophobicContact CE1-CE1 3.89Å; Y689-S714 VanDerWaalsContact CE2-OG 3.27Å; Y689-S714 WeakPolarHBondContact CE2-OG 3.49Å; Y689-S714 WeakPolarHBondContact OH-CB 3.29Å; Y689-S714 PolarHBondContact OH-OG 3.36Å; Y689-L716 HydrophobicContact CD2-CD1 4.21Å; Y689-L716 HydrophobicContact CE2-CD1 3.94Å; Y689-I721 HydrophobicContact CD2-CD1 4.08Å; Y689-I721 HydrophobicContact CE2-CD1 4.48Å
690	S	94.9	Very high	93.8	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-53.7	-46.4	175.4	-59.8	0	0	0	0	111.9	L635 V686 A687 C692 S693 R694 L697 Y710	L635-S690 WeakPolarHBondContact CD2-O 3.41Å; V686-S690 PolarHBondContact O-N 2.83Å; A687-S690 PolarHBondContact O-N 2.88Å; S690-C692 PolarHBondContact O-N 3.23Å; S690-S693 VanDerWaalsContact CA-OG 3.24Å; S690-S693 WeakPolarHBondContact CA-OG 3.25Å; S690-S693 CarbonylContact O-C 3.53Å; S690-S693 PolarHBondContact O-N 3.1Å; S690-S693 PolarHBondContact O-OG 2.78Å; S690-R694 PolarHBondContact O-N 3.47Å; S690-R694 VanDerWaalsContact O-N 3.08Å; S690-L697 WeakPolarHBondContact O-CD1 3.13Å; S690-Y710 PolarHBondContact OG-OH 3.05Å
691	I	95.1	Very high	93.7	Very high	15 Å²	15	30.3 Å²	30.3	8%	0.077	17%	0.169	C	C	.	.	H	α-helix	trans	-66	-34.7	179.7	-67.5	163.9	0	0	0	112.6	I628 A631 D632 L635 A687 S688 Y689 R694 L728	I628-I691 HydrophobicContact CG1-CD1 4.27Å; I628-I691 HydrophobicContact CG1-CG1 4.46Å; I628-I691 HydrophobicContact CG2-CG1 4.47Å; A631-I691 HydrophobicContact CB-CD1 3.88Å; D632-I691 HydrophobicContact CB-CG1 4.38Å; L635-I691 HydrophobicContact CD2-CG1 4.4Å; A687-I691 WeakPolarHBondContact O-CD1 3.22Å; A687-I691 VanDerWaalsContact O-CG1 3.28Å; A687-I691 WeakPolarHBondContact O-CG1 3.26Å; A687-I691 PolarHBondContact O-N 3.46Å; A687-I691 VanDerWaalsContact O-N 3.08Å; S688-I691 PolarHBondContact O-N 2.7Å; Y689-I691 VanDerWaalsContact C-N 3.31Å; Y689-I691 PolarHBondContact O-N 3.11Å; I691-R694 WeakPolarHBondContact O-CB 3.41Å; I691-R694 PolarHBondContact O-N 2.82Å; I691-L728 HydrophobicContact CD1-CD1 3.87Å; I691-L728 HydrophobicContact CD1-CD2 4.15Å
692	C	94.4	Very high	93.5	Very high	42 Å²	42	33.5 Å²	33.5	28%	0.284	19%	0.186	S	C	.	.	H	α-helix	trans	-73.6	-35.6	173.9	-75.5	0	0	0	0	111.9	S688 Y689 S690 R694 L716 I721	S688-C692 VanDerWaalsContact O-CB 3.31Å; S688-C692 WeakPolarHBondContact O-CB 3.45Å; S688-C692 PolarHBondContact O-N 2.86Å; S688-C692 PolarHBondContact O-SG 3.17Å; S688-C692 VanDerWaalsContact O-SG 3.34Å; Y689-C692 PolarHBondContact O-N 2.88Å; Y689-C692 VanDerWaalsContact O-N 3.12Å; S690-C692 PolarHBondContact O-N 3.23Å; C692-R694 PolarHBondContact O-N 2.58Å; C692-L716 HydrophobicContact CB-CD1 3.8Å; C692-L716 HydrophobicContact CB-CD2 4.36Å; C692-I721 HydrophobicContact CB-CG1 4.23Å
693	S	93.1	Very high	93.3	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.014	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-2.6	173.7	53.1	0	0	0	0	114.9	Y689 S690 G695 S696 L697 Y709	Y689-S693 PolarHBondContact O-N 3.1Å; Y689-S693 PolarHBondContact O-OG 2.84Å; S690-S693 VanDerWaalsContact CA-OG 3.24Å; S690-S693 WeakPolarHBondContact CA-OG 3.25Å; S690-S693 CarbonylContact O-C 3.53Å; S690-S693 PolarHBondContact O-N 3.1Å; S690-S693 PolarHBondContact O-OG 2.78Å; S693-G695 PolarHBondContact O-N 2.94Å; S693-S696 PolarHBondContact O-N 3.23Å; S693-L697 WeakPolarHBondContact O-CG 3.39Å; S693-L697 PolarHBondContact O-N 2.82Å; S693-L697 WeakPolarHBondContact OG-CD1 3.3Å; S693-Y709 WeakPolarHBondContact CB-OH 3.38Å
694	R	93.2	Very high	93.1	Very high	93 Å²	93	40.2 Å²	40.2	35%	0.351	22%	0.224	S	C	.	.	H	α-helix	trans	-39.5	-44.4	-178.1	178.7	-161.6	-161.8	-86.7	-6.3	114.5	D632 L635 S690 I691 C692 S696 L697 L698	D632-R694 IonicContact OD1-NE 2.74Å; D632-R694 IonicContact OD1-NH2 3.47Å; D632-R694 WeakPolarHBondContact OD2-CD 3.47Å; D632-R694 IonicContact OD2-CZ 3.84Å; D632-R694 IonicContact OD2-NE 3.85Å; D632-R694 PolarHBondContact OD2-NE 3.48Å; D632-R694 IonicContact OD2-NH2 3.88Å; L635-R694 HydrophobicContact CD2-CB 4.36Å; S690-R694 PolarHBondContact O-N 3.47Å; S690-R694 VanDerWaalsContact O-N 3.08Å; I691-R694 WeakPolarHBondContact O-CB 3.41Å; I691-R694 PolarHBondContact O-N 2.82Å; C692-R694 PolarHBondContact O-N 2.58Å; R694-S696 VanDerWaalsContact C-N 3.33Å; R694-S696 PolarHBondContact O-N 2.93Å; R694-L697 PolarHBondContact O-N 2.83Å; R694-L698 HydrophobicContact CG-CD1 3.76Å; R694-L698 HydrophobicContact CG-CG 4.17Å; R694-L698 WeakPolarHBondContact O-CB 3.44Å; R694-L698 WeakPolarHBondContact O-CG 3.06Å; R694-L698 PolarHBondContact O-N 3.33Å
695	G	89.7	Confident	92.9	Very high	56 Å²	56	44.5 Å²	44.5	58%	0.577	25%	0.246	S	C	*	.	H	α-helix	trans	-59.7	-40.8	-178.8	0	0	0	0	0	113.3	S693	S693-G695 PolarHBondContact O-N 2.94Å
696	S	90.9	Very high	92.6	Very high	62 Å²	62	44.5 Å²	44.5	43%	0.434	25%	0.246	S	C	.	.	H	α-helix	trans	-74.8	-48	173.6	-55.1	0	0	0	0	111.2	S693 R694 L698 M699	S693-S696 PolarHBondContact O-N 3.23Å; R694-S696 VanDerWaalsContact C-N 3.33Å; R694-S696 PolarHBondContact O-N 2.93Å; S696-L698 PolarHBondContact O-N 2.81Å; S696-M699 PolarHBondContact O-N 2.82Å
697	L	92.6	Very high	92.4	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-60.4	-39.4	-173.5	-65.7	179	0	0	0	113.6	L635 H638 F639 S690 S693 R694 M699 V700 F706 Y709 Y710	L635-L697 HydrophobicContact CD1-CB 3.84Å; L635-L697 HydrophobicContact CD1-CD1 3.96Å; L635-L697 HydrophobicContact CD2-CD1 4.24Å; H638-L697 PolarHBondContact NE2-O 3.44Å; F639-L697 HydrophobicContact CE1-CD1 4.09Å; F639-L697 HydrophobicContact CZ-CD1 3.89Å; S690-L697 WeakPolarHBondContact O-CD1 3.13Å; S693-L697 WeakPolarHBondContact O-CG 3.39Å; S693-L697 PolarHBondContact O-N 2.82Å; S693-L697 WeakPolarHBondContact OG-CD1 3.3Å; R694-L697 PolarHBondContact O-N 2.83Å; L697-M699 PolarHBondContact O-N 2.57Å; L697-V700 PolarHBondContact O-N 2.78Å; L697-V700 VanDerWaalsContact O-N 3.12Å; L697-F706 HydrophobicContact CB-CE1 4.07Å; L697-F706 HydrophobicContact CD2-CD1 3.84Å; L697-F706 HydrophobicContact CD2-CE1 3.77Å; L697-F706 HydrophobicContact CG-CE1 4.48Å; L697-F706 VanDerWaalsContact O-CZ 3.31Å; L697-F706 WeakPolarHBondContact O-CZ 3.46Å; L697-Y709 HydrophobicContact CD2-CD1 3.7Å; L697-Y709 HydrophobicContact CD2-CE1 3.94Å; L697-Y709 HydrophobicContact CD2-CG 4.28Å; L697-Y710 VanDerWaalsContact CD1-OH 3.23Å; L697-Y710 WeakPolarHBondContact CD1-OH 3.28Å; L697-Y710 HydrophobicContact CD2-CE2 4.25Å
698	L	93	Very high	92.2	Very high	46 Å²	46	51.7 Å²	51.7	24%	0.241	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-15.1	178.6	-69.8	178.9	0	0	0	113.7	L635 H638 R694 S696	L635-L698 HydrophobicContact CD1-CD2 4.08Å; L635-L698 HydrophobicContact CD1-CG 4.33Å; H638-L698 HydrophobicContact CB-CD2 3.54Å; H638-L698 PolarHBondContact CE1-O 3.02Å; R694-L698 HydrophobicContact CG-CD1 3.76Å; R694-L698 HydrophobicContact CG-CG 4.17Å; R694-L698 WeakPolarHBondContact O-CB 3.44Å; R694-L698 WeakPolarHBondContact O-CG 3.06Å; R694-L698 PolarHBondContact O-N 3.33Å; S696-L698 PolarHBondContact O-N 2.81Å
699	M	91.1	Very high	92.1	Very high	160 Å²	160	53.5 Å²	53.5	79%	0.788	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-16.3	173.3	-60.4	-164.4	74.7	0	0	112.9	S696 L697	S696-M699 PolarHBondContact O-N 2.82Å; L697-M699 PolarHBondContact O-N 2.57Å
700	V	90.3	Very high	91.9	Very high	22 Å²	22	53.5 Å²	53.5	13%	0.133	30%	0.297	C	S	.	.			trans	-85.7	135.9	179.5	-175.5	0	0	0	0	110.1	H638 L697 I705 F706	H638-V700 PolarHBondContact NE2-O 3.46Å; L697-V700 PolarHBondContact O-N 2.78Å; L697-V700 VanDerWaalsContact O-N 3.12Å; V700-I705 HydrophobicContact CB-CG2 4.41Å; V700-I705 HydrophobicContact CG1-CB 3.53Å; V700-I705 HydrophobicContact CG1-CG2 3.49Å; V700-I705 VanDerWaalsContact CG1-CG2 3.49Å; V700-I705 HydrophobicContact CG2-CG2 3.93Å; V700-F706 HydrophobicContact CB-CD2 4.2Å; V700-F706 HydrophobicContact CB-CE1 4.09Å; V700-F706 HydrophobicContact CB-CE2 3.63Å; V700-F706 HydrophobicContact CB-CZ 3.58Å; V700-F706 HydrophobicContact CG1-CD2 3.53Å; V700-F706 HydrophobicContact CG1-CE1 4.4Å; V700-F706 HydrophobicContact CG1-CE2 3.37Å; V700-F706 HydrophobicContact CG1-CG 4.11Å; V700-F706 HydrophobicContact CG1-CZ 3.86Å; V700-F706 VanDerWaalsContact O-CE2 3.3Å; V700-F706 WeakPolarHBondContact O-CE2 3.41Å; V700-F706 VanDerWaalsContact O-CZ 3.26Å; V700-F706 WeakPolarHBondContact O-CZ 3.32Å
701	Q	89	Confident	91.9	Very high	129 Å²	129	57.9 Å²	57.9	60%	0.603	32%	0.317	S	S	*	.			trans	-125	-13.4	-179.2	-59.4	-175.3	1.3	0	0	113.6	Y642	Y642-Q701 HydrophobicContact CD1-CB 4.29Å; Y642-Q701 WeakPolarHBondContact CD1-O 3.49Å; Y642-Q701 HydrophobicContact CE1-CB 3.7Å; Y642-Q701 HydrophobicContact CE1-CG 4.04Å; Y642-Q701 HydrophobicContact CE2-CG 4.45Å
702	N	89.3	Confident	91.7	Very high	67 Å²	67	59.2 Å²	59.2	36%	0.358	33%	0.328	S	S	.	.			trans	-102.4	133.6	178.3	-175.6	21.6	0	0	0	110.9	D704 I705 F706	N702-D704 VanDerWaalsContact C-N 3.29Å; N702-D704 PolarHBondContact ND2-OD2 2.79Å; N702-D704 PolarHBondContact O-N 3.12Å; N702-I705 HydrophobicContact CB-CD1 4.07Å; N702-I705 HydrophobicContact CB-CG1 4.18Å; N702-I705 PolarHBondContact O-N 2.99Å; N702-I705 VanDerWaalsContact O-N 3.16Å; N702-F706 VanDerWaalsContact O-CD2 3.29Å; N702-F706 WeakPolarHBondContact O-CD2 3.41Å; N702-F706 PolarHBondContact O-N 2.84Å
703	T	90.6	Very high	91.6	Very high	50 Å²	50	62.9 Å²	62.9	31%	0.307	34%	0.341	S	S	.	.	H	α-helix	trans	-54.8	-42	178.4	41.5	0	0	0	0	112.7	I705 F706 E707	T703-I705 PolarHBondContact O-N 3.14Å; T703-F706 WeakPolarHBondContact O-CA 3.34Å; T703-F706 WeakPolarHBondContact O-CB 3.44Å; T703-F706 PolarHBondContact O-N 3.08Å; T703-E707 PolarHBondContact O-N 3.37Å
704	D	90.3	Very high	91.3	Very high	98 Å²	98	63.1 Å²	63.1	52%	0.524	34%	0.342	S	S	.	.	H	α-helix	trans	-63	-30.8	-176.8	-36.1	-29.6	0	0	0	111.7	N702 A708	N702-D704 VanDerWaalsContact C-N 3.29Å; N702-D704 PolarHBondContact ND2-OD2 2.79Å; N702-D704 PolarHBondContact O-N 3.12Å; D704-A708 VanDerWaalsContact O-CB 3.25Å; D704-A708 WeakPolarHBondContact O-CB 3.38Å; D704-A708 PolarHBondContact O-N 2.99Å
705	I	90.7	Very high	91.1	Very high	92 Å²	92	64.7 Å²	64.7	47%	0.472	36%	0.362	S	S	.	.	H	α-helix	trans	-79.4	-28.9	177.8	-56.7	175.9	0	0	0	110.5	V700 N702 T703 Y709	V700-I705 HydrophobicContact CB-CG2 4.41Å; V700-I705 HydrophobicContact CG1-CB 3.53Å; V700-I705 HydrophobicContact CG1-CG2 3.49Å; V700-I705 VanDerWaalsContact CG1-CG2 3.49Å; V700-I705 HydrophobicContact CG2-CG2 3.93Å; N702-I705 HydrophobicContact CB-CD1 4.07Å; N702-I705 HydrophobicContact CB-CG1 4.18Å; N702-I705 PolarHBondContact O-N 2.99Å; N702-I705 VanDerWaalsContact O-N 3.16Å; T703-I705 PolarHBondContact O-N 3.14Å; I705-Y709 VanDerWaalsContact O-CB 3.29Å; I705-Y709 WeakPolarHBondContact O-CB 3.3Å; I705-Y709 PolarHBondContact O-N 3.48Å
706	F	91.2	Very high	91.1	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-67.4	-47.9	168.7	-77	-80.3	0	0	0	111.3	H638 F639 I644 I648 L697 V700 N702 T703 A708 Y709 Y710	H638-F706 AromaticContact CD2-CZ 3.87Å; H638-F706 AromaticContact NE2-CZ 3.76Å; F639-F706 HydrophobicContact CD1-CE1 4.45Å; F639-F706 HydrophobicContact CE1-CE1 4.08Å; I644-F706 HydrophobicContact CD1-CD1 3.98Å; I644-F706 HydrophobicContact CD1-CD2 3.33Å; I644-F706 HydrophobicContact CD1-CE1 3.82Å; I644-F706 HydrophobicContact CD1-CE2 3.16Å; I644-F706 HydrophobicContact CD1-CG 3.75Å; I644-F706 HydrophobicContact CD1-CZ 3.41Å; I644-F706 VanDerWaalsContact CD1-CZ 3.41Å; I644-F706 HydrophobicContact CG1-CD2 4.02Å; I644-F706 HydrophobicContact CG1-CE2 4.27Å; I644-F706 HydrophobicContact CG1-CG 4.32Å; I644-F706 HydrophobicContact CG2-CG 4.48Å; I648-F706 HydrophobicContact CG2-CB 4.17Å; L697-F706 HydrophobicContact CB-CE1 4.07Å; L697-F706 HydrophobicContact CD2-CD1 3.84Å; L697-F706 HydrophobicContact CD2-CE1 3.77Å; L697-F706 HydrophobicContact CG-CE1 4.48Å; L697-F706 VanDerWaalsContact O-CZ 3.31Å; L697-F706 WeakPolarHBondContact O-CZ 3.46Å; V700-F706 HydrophobicContact CB-CD2 4.2Å; V700-F706 HydrophobicContact CB-CE1 4.09Å; V700-F706 HydrophobicContact CB-CE2 3.63Å; V700-F706 HydrophobicContact CB-CZ 3.58Å; V700-F706 HydrophobicContact CG1-CD2 3.53Å; V700-F706 HydrophobicContact CG1-CE1 4.4Å; V700-F706 HydrophobicContact CG1-CE2 3.37Å; V700-F706 HydrophobicContact CG1-CG 4.11Å; V700-F706 HydrophobicContact CG1-CZ 3.86Å; V700-F706 VanDerWaalsContact O-CE2 3.3Å; V700-F706 WeakPolarHBondContact O-CE2 3.41Å; V700-F706 VanDerWaalsContact O-CZ 3.26Å; V700-F706 WeakPolarHBondContact O-CZ 3.32Å; N702-F706 VanDerWaalsContact O-CD2 3.29Å; N702-F706 WeakPolarHBondContact O-CD2 3.41Å; N702-F706 PolarHBondContact O-N 2.84Å; T703-F706 WeakPolarHBondContact O-CA 3.34Å; T703-F706 WeakPolarHBondContact O-CB 3.44Å; T703-F706 PolarHBondContact O-N 3.08Å; F706-A708 PolarHBondContact O-N 2.88Å; F706-Y709 WeakPolarHBondContact O-CB 3.3Å; F706-Y709 PolarHBondContact O-N 3.49Å; F706-Y709 VanDerWaalsContact O-N 3.17Å; F706-Y710 HydrophobicContact CD1-CE2 4.43Å; F706-Y710 WeakPolarHBondContact O-CD2 3.24Å; F706-Y710 PolarHBondContact O-N 2.8Å
707	E	92.1	Very high	91	Very high	92 Å²	92	66.4 Å²	66.4	43%	0.43	35%	0.349	S	S	.	.	H	α-helix	trans	-56.7	-51.5	174.3	-72.2	-178.9	-170.8	0	0	110.9	I648 T703 Y709 Y710 H711	I648-E707 HydrophobicContact CG1-CG 4.29Å; I648-E707 HydrophobicContact CG2-CG 3.75Å; T703-E707 PolarHBondContact O-N 3.37Å; E707-Y709 PolarHBondContact O-N 3.24Å; E707-Y710 PolarHBondContact O-N 3.17Å; E707-H711 PolarHBondContact O-CD2 2.76Å; E707-H711 VanDerWaalsContact O-CD2 3.23Å; E707-H711 PolarHBondContact O-N 2.82Å; E707-H711 VanDerWaalsContact O-N 3.1Å
708	A	91.8	Very high	91	Very high	59 Å²	59	67.2 Å²	67.2	49%	0.488	35%	0.354	S	S	.	.	H	α-helix	trans	-59.4	-32.4	177.3	0	0	0	0	0	113.4	D704 F706 H711 S712	D704-A708 VanDerWaalsContact O-CB 3.25Å; D704-A708 WeakPolarHBondContact O-CB 3.38Å; D704-A708 PolarHBondContact O-N 2.99Å; F706-A708 PolarHBondContact O-N 2.88Å; A708-H711 CarbonylContact O-C 3.56Å; A708-S712 WeakPolarHBondContact O-CB 3.36Å; A708-S712 PolarHBondContact O-N 2.88Å
709	Y	93.2	Very high	90.9	Very high	38 Å²	38	68.2 Å²	68.2	15%	0.149	36%	0.364	C	S	.	.	H	α-helix	trans	-66	-44.8	176.2	-174.8	-96.6	0	0	0	112	Y689 S693 L697 I705 F706 E707 H711 S712	Y689-Y709 HydrophobicContact CE1-CE1 4.08Å; S693-Y709 WeakPolarHBondContact CB-OH 3.38Å; L697-Y709 HydrophobicContact CD2-CD1 3.7Å; L697-Y709 HydrophobicContact CD2-CE1 3.94Å; L697-Y709 HydrophobicContact CD2-CG 4.28Å; I705-Y709 VanDerWaalsContact O-CB 3.29Å; I705-Y709 WeakPolarHBondContact O-CB 3.3Å; I705-Y709 PolarHBondContact O-N 3.48Å; F706-Y709 WeakPolarHBondContact O-CB 3.3Å; F706-Y709 PolarHBondContact O-N 3.49Å; F706-Y709 VanDerWaalsContact O-N 3.17Å; E707-Y709 PolarHBondContact O-N 3.24Å; Y709-H711 VanDerWaalsContact C-N 3.29Å; Y709-H711 PolarHBondContact O-N 3.06Å; Y709-S712 WeakPolarHBondContact O-CB 3.16Å; Y709-S712 PolarHBondContact O-N 3.13Å; Y709-S712 VanDerWaalsContact O-N 3.11Å; Y709-S712 PolarHBondContact O-OG 3.23Å
710	Y	93.9	Very high	91	Very high	1 Å²	1	65 Å²	65	0%	0.004	35%	0.351	C	S	.	.	H	α-helix	trans	-77	-14	179.7	-65.6	-69.1	0	0	0	114.1	Y649 L653 V661 Y689 S690 L697 F706 E707	Y649-Y710 VanDerWaalsContact CB-CZ 3.49Å; L653-Y710 HydrophobicContact CD1-CD1 3.97Å; L653-Y710 HydrophobicContact CD1-CE1 4.3Å; L653-Y710 HydrophobicContact CD2-CD1 4.43Å; L653-Y710 HydrophobicContact CG-CD1 4.29Å; V661-Y710 WeakPolarHBondContact CG2-O 3.4Å; Y689-Y710 HydrophobicContact CD1-CD1 4.19Å; Y689-Y710 AromaticContact CD1-CE1 3.92Å; Y689-Y710 HydrophobicContact CD1-CE1 3.92Å; Y689-Y710 AromaticContact CE1-CD1 3.92Å; Y689-Y710 HydrophobicContact CE1-CD1 3.92Å; Y689-Y710 AromaticContact CE1-CE1 3.89Å; Y689-Y710 HydrophobicContact CE1-CE1 3.89Å; S690-Y710 PolarHBondContact OG-OH 3.05Å; L697-Y710 VanDerWaalsContact CD1-OH 3.23Å; L697-Y710 WeakPolarHBondContact CD1-OH 3.28Å; L697-Y710 HydrophobicContact CD2-CE2 4.25Å; F706-Y710 HydrophobicContact CD1-CE2 4.43Å; F706-Y710 WeakPolarHBondContact O-CD2 3.24Å; F706-Y710 PolarHBondContact O-N 2.8Å; E707-Y710 PolarHBondContact O-N 3.17Å
711	H	93.7	Very high	91.2	Very high	91 Å²	91	64 Å²	64	42%	0.421	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	9.5	166	-70.3	-67.7	0	0	0	113.5	E660 E707 A708 Y709	E660-H711 IonicContact OE1-CE1 2.7Å; E660-H711 IonicContact OE1-CG 2.77Å; E660-H711 IonicContact OE1-ND1 3.75Å; E660-H711 PolarHBondContact OE1-ND1 3.34Å; E660-H711 IonicContact OE2-CE1 3.36Å; E660-H711 IonicContact OE2-ND1 2.87Å; E660-H711 PolarHBondContact OE2-ND1 2.84Å; E707-H711 PolarHBondContact O-CD2 2.76Å; E707-H711 VanDerWaalsContact O-CD2 3.23Å; E707-H711 PolarHBondContact O-N 2.82Å; E707-H711 VanDerWaalsContact O-N 3.1Å; A708-H711 CarbonylContact O-C 3.56Å; Y709-H711 VanDerWaalsContact C-N 3.29Å; Y709-H711 PolarHBondContact O-N 3.06Å
712	S	91.9	Very high	91.4	Very high	43 Å²	43	58.9 Å²	58.9	30%	0.301	32%	0.321	S	S	.	.	S	Bend	trans	-106.9	149.8	179.4	77.1	0	0	0	0	113	A708 Y709 S714	A708-S712 WeakPolarHBondContact O-CB 3.36Å; A708-S712 PolarHBondContact O-N 2.88Å; Y709-S712 WeakPolarHBondContact O-CB 3.16Å; Y709-S712 PolarHBondContact O-N 3.13Å; Y709-S712 VanDerWaalsContact O-N 3.11Å; Y709-S712 PolarHBondContact O-OG 3.23Å; S712-S714 PolarHBondContact O-N 3.32Å
713	Q	91.7	Very high	91.7	Very high	120 Å²	120	61.1 Å²	61.1	56%	0.561	33%	0.329	S	S	*	.			trans	-64.8	131.2	175.1	-166.5	-153.5	-60.5	0	0	110.4	N663	N663-Q713 PolarHBondContact ND2-NE2 3.06Å
714	S	87.9	Confident	91.9	Very high	6 Å²	6	62.3 Å²	62.3	4%	0.042	33%	0.328	C	S	.	.			trans	-71.4	153.5	-177.7	-152	0	0	0	0	113.7	V661 Y689 S712 L716	V661-S714 PolarHBondContact O-N 2.91Å; Y689-S714 VanDerWaalsContact CE2-OG 3.27Å; Y689-S714 WeakPolarHBondContact CE2-OG 3.49Å; Y689-S714 WeakPolarHBondContact OH-CB 3.29Å; Y689-S714 PolarHBondContact OH-OG 3.36Å; S712-S714 PolarHBondContact O-N 3.32Å; S714-L716 WeakPolarHBondContact OG-CB 3.34Å; S714-L716 PolarHBondContact OG-N 3.06Å
715	T	87	Confident	92.1	Very high	127 Å²	127	57.6 Å²	57.6	78%	0.779	30%	0.303	S	S	*	.			trans	-105.4	-0.2	166.8	55.4	0	0	0	0	112.4
716	L	90.1	Very high	92.3	Very high	34 Å²	34	55.4 Å²	55.4	18%	0.178	29%	0.291	C	S	.	.	S	Bend	trans	-82.8	131.9	-176.4	-62.7	174.6	0	0	0	111.7	Y689 C692 S714 I718 I721	Y689-L716 HydrophobicContact CD2-CD1 4.21Å; Y689-L716 HydrophobicContact CE2-CD1 3.94Å; C692-L716 HydrophobicContact CB-CD1 3.8Å; C692-L716 HydrophobicContact CB-CD2 4.36Å; S714-L716 WeakPolarHBondContact OG-CB 3.34Å; S714-L716 PolarHBondContact OG-N 3.06Å; L716-I718 PolarHBondContact O-N 2.86Å; L716-I721 HydrophobicContact CB-CD1 3.53Å; L716-I721 HydrophobicContact CB-CG1 4.33Å; L716-I721 HydrophobicContact CD1-CD1 4.17Å
717	Q	90.3	Very high	92.4	Very high	120 Å²	120	58.9 Å²	58.9	56%	0.561	31%	0.307	S	S	*	.			trans	-63.5	118.9	176.1	-66.8	-62.1	-49.8	0	0	111.3	S719 N720 I721	Q717-S719 PolarHBondContact O-N 2.97Å; Q717-N720 HydrophobicContact CB-CB 4.49Å; Q717-N720 WeakPolarHBondContact O-CB 3.31Å; Q717-N720 PolarHBondContact O-N 2.8Å; Q717-I721 PolarHBondContact O-N 2.78Å
718	I	92	Very high	92.4	Very high	17 Å²	17	54.6 Å²	54.6	9%	0.087	29%	0.287	C	S	.	.	H	α-helix	trans	-59.2	-31.5	-175.5	-174.9	58.3	0	0	0	113.5	F662 E666 C669 L670 L716 N720 I721 I722	F662-I718 HydrophobicContact CD1-CD1 4.37Å; F662-I718 HydrophobicContact CD2-CD1 4.46Å; F662-I718 HydrophobicContact CE1-CD1 3.94Å; F662-I718 HydrophobicContact CE2-CD1 4.03Å; F662-I718 HydrophobicContact CZ-CD1 3.77Å; E666-I718 HydrophobicContact CB-CB 4.35Å; E666-I718 HydrophobicContact CB-CG2 4.23Å; E666-I718 HydrophobicContact CG-CG2 4.25Å; C669-I718 HydrophobicContact CB-CG2 4.47Å; L670-I718 HydrophobicContact CB-CD1 4.08Å; L670-I718 HydrophobicContact CB-CG1 4.44Å; L716-I718 PolarHBondContact O-N 2.86Å; I718-N720 VanDerWaalsContact C-N 3.3Å; I718-N720 PolarHBondContact O-N 2.89Å; I718-I721 HydrophobicContact CD1-CB 4.45Å; I718-I721 PolarHBondContact O-N 3.04Å; I718-I722 HydrophobicContact CD1-CD1 4.17Å; I718-I722 HydrophobicContact CD1-CG1 4.16Å; I718-I722 HydrophobicContact CG1-CD1 3.83Å; I718-I722 HydrophobicContact CG1-CG1 4.3Å; I718-I722 WeakPolarHBondContact O-CG1 3.38Å; I718-I722 PolarHBondContact O-N 3Å
719	S	91.2	Very high	92.4	Very high	67 Å²	67	53.1 Å²	53.1	47%	0.469	27%	0.27	S	S	.	.	H	α-helix	trans	-54.8	-45.7	172.1	48.5	0	0	0	0	112.2	Q717 I721 I722 E723	Q717-S719 PolarHBondContact O-N 2.97Å; S719-I721 VanDerWaalsContact C-N 3.33Å; S719-I721 PolarHBondContact O-N 3.23Å; S719-I722 PolarHBondContact O-N 2.84Å; S719-E723 WeakPolarHBondContact O-CB 3.41Å; S719-E723 PolarHBondContact O-N 3.28Å
720	N	92.6	Very high	92.3	Very high	93 Å²	93	57.3 Å²	57.3	50%	0.497	30%	0.3	S	S	.	.	H	α-helix	trans	-71.1	-35.1	-174.4	-56.7	12.1	0	0	0	110.2	Q717 I718 R724	Q717-N720 HydrophobicContact CB-CB 4.49Å; Q717-N720 WeakPolarHBondContact O-CB 3.31Å; Q717-N720 PolarHBondContact O-N 2.8Å; I718-N720 VanDerWaalsContact C-N 3.3Å; I718-N720 PolarHBondContact O-N 2.89Å; N720-R724 WeakPolarHBondContact O-CB 3.44Å; N720-R724 PolarHBondContact O-N 3.11Å
721	I	95	Very high	92.1	Very high	1 Å²	1	60 Å²	60	1%	0.005	32%	0.319	C	S	.	.	H	α-helix	trans	-68	-47.7	175.7	-66.9	157.4	0	0	0	110.3	F662 V685 S688 Y689 C692 L716 Q717 I718 S719 R724 A725	F662-I721 HydrophobicContact CE1-CD1 3.89Å; F662-I721 HydrophobicContact CZ-CD1 3.81Å; V685-I721 HydrophobicContact CG1-CG2 4.21Å; S688-I721 WeakPolarHBondContact OG-CG2 3.36Å; S688-I721 PolarHBondContact OG-O 3.07Å; Y689-I721 HydrophobicContact CD2-CD1 4.08Å; Y689-I721 HydrophobicContact CE2-CD1 4.48Å; C692-I721 HydrophobicContact CB-CG1 4.23Å; L716-I721 HydrophobicContact CB-CD1 3.53Å; L716-I721 HydrophobicContact CB-CG1 4.33Å; L716-I721 HydrophobicContact CD1-CD1 4.17Å; Q717-I721 PolarHBondContact O-N 2.78Å; I718-I721 HydrophobicContact CD1-CB 4.45Å; I718-I721 PolarHBondContact O-N 3.04Å; S719-I721 VanDerWaalsContact C-N 3.33Å; S719-I721 PolarHBondContact O-N 3.23Å; I721-R724 PolarHBondContact O-N 3.1Å; I721-A725 WeakPolarHBondContact O-CB 3.38Å; I721-A725 PolarHBondContact O-N 3.1Å
722	I	94	Very high	91.9	Very high	20 Å²	20	56.1 Å²	56.1	10%	0.103	30%	0.302	C	S	.	.	H	α-helix	trans	-63.5	-43.6	177.6	-66.3	168.5	0	0	0	111	L670 I718 S719 A725 H726	L670-I722 HydrophobicContact CD1-CG1 4.28Å; I718-I722 HydrophobicContact CD1-CD1 4.17Å; I718-I722 HydrophobicContact CD1-CG1 4.16Å; I718-I722 HydrophobicContact CG1-CD1 3.83Å; I718-I722 HydrophobicContact CG1-CG1 4.3Å; I718-I722 WeakPolarHBondContact O-CG1 3.38Å; I718-I722 PolarHBondContact O-N 3Å; S719-I722 PolarHBondContact O-N 2.84Å; I722-A725 PolarHBondContact O-N 2.85Å; I722-H726 PolarHBondContact O-CD2 3.35Å; I722-H726 PolarHBondContact O-N 3.36Å
723	E	94	Very high	91.7	Very high	115 Å²	115	56.3 Å²	56.3	54%	0.537	30%	0.302	S	S	.	.	H	α-helix	trans	-63.3	-46.2	175.9	-160.5	-159.6	140.8	0	0	111.1	S719 A725 H726 Q727	S719-E723 WeakPolarHBondContact O-CB 3.41Å; S719-E723 PolarHBondContact O-N 3.28Å; E723-A725 VanDerWaalsContact C-N 3.32Å; E723-A725 PolarHBondContact O-N 3.31Å; E723-H726 PolarHBondContact O-N 3.06Å; E723-H726 VanDerWaalsContact O-N 3.11Å; E723-Q727 WeakPolarHBondContact O-CG 3.36Å; E723-Q727 PolarHBondContact O-N 2.96Å; E723-Q727 PolarHBondContact OE1-NE2 3.38Å
724	R	95.2	Very high	91.1	Very high	74 Å²	74	54.3 Å²	54.3	28%	0.279	30%	0.302	S	S	.	.	H	α-helix	trans	-59.6	-41.6	176.3	-171.2	71.8	-174.8	130	3.7	111.4	N720 I721 H726 Q727 L728	N720-R724 WeakPolarHBondContact O-CB 3.44Å; N720-R724 PolarHBondContact O-N 3.11Å; I721-R724 PolarHBondContact O-N 3.1Å; R724-H726 VanDerWaalsContact C-N 3.34Å; R724-H726 PolarHBondContact O-N 2.86Å; R724-Q727 WeakPolarHBondContact O-CB 3.44Å; R724-Q727 PolarHBondContact O-N 3.13Å; R724-L728 HydrophobicContact CG-CD1 4.45Å; R724-L728 WeakPolarHBondContact O-CB 3.45Å; R724-L728 VanDerWaalsContact O-CG 3.22Å; R724-L728 WeakPolarHBondContact O-CG 3.24Å; R724-L728 PolarHBondContact O-N 3.42Å
725	A	95.2	Very high	90.9	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-60.8	-40.1	174.9	0	0	0	0	0	112.4	L681 A684 V685 I721 I722 E723 L729	L681-A725 HydrophobicContact CD1-CB 3.89Å; A684-A725 HydrophobicContact CB-CB 4.14Å; V685-A725 HydrophobicContact CB-CB 4.41Å; V685-A725 HydrophobicContact CG2-CB 3.66Å; I721-A725 WeakPolarHBondContact O-CB 3.38Å; I721-A725 PolarHBondContact O-N 3.1Å; I722-A725 PolarHBondContact O-N 2.85Å; E723-A725 VanDerWaalsContact C-N 3.32Å; E723-A725 PolarHBondContact O-N 3.31Å; A725-L729 WeakPolarHBondContact O-CG 3.41Å; A725-L729 PolarHBondContact O-N 3.23Å
726	H	93.8	Very high	90.8	Very high	46 Å²	46	55.8 Å²	55.8	21%	0.213	30%	0.304	C	S	.	.	H	α-helix	trans	-67.3	-43.9	173.1	-75.9	-55.4	0	0	0	112.6	Y677 I722 E723 R724 L728 L729 T730	Y677-H726 AromaticContact CD1-CE1 3.53Å; Y677-H726 AromaticContact CD2-CE1 3.97Å; Y677-H726 AromaticContact CE1-CE1 3.27Å; Y677-H726 WeakPolarHBondContact CE1-CE1 3.25Å; Y677-H726 AromaticContact CE1-ND1 3.95Å; Y677-H726 AromaticContact CE1-NE2 3.99Å; Y677-H726 AromaticContact CE2-CE1 3.76Å; Y677-H726 AromaticContact CE2-NE2 3.79Å; Y677-H726 AromaticContact CG-CE1 3.87Å; Y677-H726 AromaticContact CZ-CE1 3.41Å; Y677-H726 VanDerWaalsContact CZ-CE1 3.41Å; Y677-H726 AromaticContact CZ-NE2 3.64Å; I722-H726 PolarHBondContact O-CD2 3.35Å; I722-H726 PolarHBondContact O-N 3.36Å; E723-H726 PolarHBondContact O-N 3.06Å; E723-H726 VanDerWaalsContact O-N 3.11Å; R724-H726 VanDerWaalsContact C-N 3.34Å; R724-H726 PolarHBondContact O-N 2.86Å; H726-L728 VanDerWaalsContact C-N 3.32Å; H726-L728 PolarHBondContact O-N 3.26Å; H726-L729 PolarHBondContact O-N 2.93Å; H726-T730 PolarHBondContact O-N 3.07Å; H726-T730 PolarHBondContact O-OG1 2.96Å
727	Q	93.2	Very high	90.8	Very high	73 Å²	73	56.6 Å²	56.6	34%	0.341	31%	0.307	S	S	.	.	H	α-helix	trans	-56.3	-46.9	173.7	-67.2	170.6	9.4	0	0	110.9	E723 R724 L729 T730 S731	E723-Q727 WeakPolarHBondContact O-CG 3.36Å; E723-Q727 PolarHBondContact O-N 2.96Å; E723-Q727 PolarHBondContact OE1-NE2 3.38Å; R724-Q727 WeakPolarHBondContact O-CB 3.44Å; R724-Q727 PolarHBondContact O-N 3.13Å; Q727-L729 PolarHBondContact O-N 3.37Å; Q727-T730 WeakPolarHBondContact CA-OG1 3.34Å; Q727-T730 CarbonylContact O-C 3.59Å; Q727-T730 PolarHBondContact O-N 3.09Å; Q727-T730 VanDerWaalsContact O-N 3.11Å; Q727-T730 PolarHBondContact O-OG1 3.33Å; Q727-S731 PolarHBondContact O-N 2.89Å; Q727-S731 PolarHBondContact O-OG 2.95Å
728	L	92.5	Very high	90.6	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-59.7	-44	177.4	-71.1	174.6	0	0	0	112.4	I627 A631 A687 I691 R724 H726 T730 S731 T732	I627-L728 HydrophobicContact CG2-CD1 4.37Å; A631-L728 HydrophobicContact CB-CD2 3.28Å; A687-L728 HydrophobicContact CB-CD1 4.48Å; I691-L728 HydrophobicContact CD1-CD1 3.87Å; I691-L728 HydrophobicContact CD1-CD2 4.15Å; R724-L728 HydrophobicContact CG-CD1 4.45Å; R724-L728 WeakPolarHBondContact O-CB 3.45Å; R724-L728 VanDerWaalsContact O-CG 3.22Å; R724-L728 WeakPolarHBondContact O-CG 3.24Å; R724-L728 PolarHBondContact O-N 3.42Å; H726-L728 VanDerWaalsContact C-N 3.32Å; H726-L728 PolarHBondContact O-N 3.26Å; L728-T730 VanDerWaalsContact C-N 3.28Å; L728-T730 PolarHBondContact O-N 3.47Å; L728-S731 PolarHBondContact O-N 3.1Å; L728-S731 PolarHBondContact O-OG 3.31Å; L728-T732 VanDerWaalsContact O-CB 3.31Å; L728-T732 WeakPolarHBondContact O-CB 3.3Å; L728-T732 PolarHBondContact O-N 3.1Å; L728-T732 PolarHBondContact O-OG1 3.11Å
729	L	91.5	Very high	90.2	Very high	28 Å²	28	50.6 Å²	50.6	15%	0.147	28%	0.281	C	S	.	.	H	α-helix	trans	-63.1	-34.4	175	-72.5	175.5	0	0	0	112.3	L681 A684 A725 H726 Q727 H737 P738	L681-L729 HydrophobicContact CB-CD1 4.3Å; L681-L729 HydrophobicContact CD1-CD1 3.8Å; A684-L729 HydrophobicContact CB-CD1 4.17Å; A684-L729 HydrophobicContact CB-CD2 3.83Å; A684-L729 HydrophobicContact CB-CG 3.67Å; A725-L729 WeakPolarHBondContact O-CG 3.41Å; A725-L729 PolarHBondContact O-N 3.23Å; H726-L729 PolarHBondContact O-N 2.93Å; Q727-L729 PolarHBondContact O-N 3.37Å; L729-H737 PolarHBondContact O-CD2 3.17Å; L729-P738 HydrophobicContact CD2-CG 3.68Å
730	T	90.8	Very high	89.9	Confident	126 Å²	126	53.6 Å²	53.6	77%	0.773	28%	0.282	S	S	*	.	H	α-helix	trans	-77.9	-25.5	176.4	54.7	0	0	0	0	114.4	H726 Q727 L728	H726-T730 PolarHBondContact O-N 3.07Å; H726-T730 PolarHBondContact O-OG1 2.96Å; Q727-T730 WeakPolarHBondContact CA-OG1 3.34Å; Q727-T730 CarbonylContact O-C 3.59Å; Q727-T730 PolarHBondContact O-N 3.09Å; Q727-T730 VanDerWaalsContact O-N 3.11Å; Q727-T730 PolarHBondContact O-OG1 3.33Å; L728-T730 VanDerWaalsContact C-N 3.28Å; L728-T730 PolarHBondContact O-N 3.47Å
731	S	89.9	Confident	89.5	Confident	57 Å²	57	51.8 Å²	51.8	40%	0.399	27%	0.272	S	S	.	.	H	α-helix	trans	-93.4	-23.2	179.2	66.8	0	0	0	0	114.1	Y630 Q727 L728	Y630-S731 WeakPolarHBondContact CE1-O 3.46Å; Q727-S731 PolarHBondContact O-N 2.89Å; Q727-S731 PolarHBondContact O-OG 2.95Å; L728-S731 PolarHBondContact O-N 3.1Å; L728-S731 PolarHBondContact O-OG 3.31Å
732	T	89.7	Confident	88.9	Confident	10 Å²	10	52.6 Å²	52.6	6%	0.061	28%	0.277	C	S	.	.	S	Bend	trans	-68.6	125.8	-177	-60.4	0	0	0	0	110.8	L728 I736 H737	L728-T732 VanDerWaalsContact O-CB 3.31Å; L728-T732 WeakPolarHBondContact O-CB 3.3Å; L728-T732 PolarHBondContact O-N 3.1Å; L728-T732 PolarHBondContact O-OG1 3.11Å; T732-I736 HydrophobicContact CG2-CB 3.84Å; T732-I736 HydrophobicContact CG2-CG2 3.76Å; T732-H737 HydrophobicContact CG2-CB 4.39Å
733	P	87.8	Confident	88.1	Confident	47 Å²	47	53 Å²	53	31%	0.305	28%	0.281	S	S	.	.			trans	-64.5	150.5	-177.7	26.3	-35.6	0	0	0	111.7	Y630 N735 I736 H737	Y630-P733 HydrophobicContact CD2-CG 4.42Å; Y630-P733 VanDerWaalsContact CE1-CD 3.47Å; Y630-P733 HydrophobicContact CE2-CG 4.11Å; P733-N735 PolarHBondContact O-N 2.87Å; P733-I736 HydrophobicContact CG-CB 4.37Å; P733-I736 HydrophobicContact CG-CD1 4.11Å; P733-I736 HydrophobicContact CG-CG1 4.36Å; P733-I736 PolarHBondContact O-N 2.89Å; P733-H737 PolarHBondContact O-N 3.38Å
734	S	80.6	Confident	87.3	Confident	79 Å²	79	51.2 Å²	51.2	55%	0.552	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-13.7	-172.7	61.5	0	0	0	0	115.3	R740	S734-R740 WeakPolarHBondContact O-CD 3.39Å; S734-R740 PolarHBondContact O-NH1 2.87Å
735	N	83.1	Confident	86.2	Confident	120 Å²	120	49.7 Å²	49.7	64%	0.642	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-25.2	173.9	-66.2	-17.8	0	0	0	113.3	P733 R740	P733-N735 PolarHBondContact O-N 2.87Å; N735-R740 PolarHBondContact OD1-NH1 3.5Å
736	I	85.5	Confident	84.8	Confident	44 Å²	44	53.4 Å²	53.4	23%	0.226	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104	-21.2	179	-60.5	174.7	0	0	0	111	N626 T732 P733 P738 L741	N626-I736 HydrophobicContact CB-CG2 3.74Å; T732-I736 HydrophobicContact CG2-CB 3.84Å; T732-I736 HydrophobicContact CG2-CG2 3.76Å; P733-I736 HydrophobicContact CG-CB 4.37Å; P733-I736 HydrophobicContact CG-CD1 4.11Å; P733-I736 HydrophobicContact CG-CG1 4.36Å; P733-I736 PolarHBondContact O-N 2.89Å; I736-P738 VanDerWaalsContact O-N 3.12Å; I736-L741 WeakPolarHBondContact O-CD1 3.45Å
737	H	88.7	Confident	83	Confident	51 Å²	51	58.8 Å²	58.8	24%	0.236	32%	0.322	C	S	.	.			trans	-52.6	116.4	-172.4	178.5	-95.8	0	0	0	112.7	L729 T732 P733 G739 R740 L741	L729-H737 PolarHBondContact O-CD2 3.17Å; T732-H737 HydrophobicContact CG2-CB 4.39Å; P733-H737 PolarHBondContact O-N 3.38Å; H737-G739 PolarHBondContact ND1-N 3.23Å; H737-G739 PolarHBondContact O-N 3.19Å; H737-G739 VanDerWaalsContact O-N 3.1Å; H737-R740 PolarHBondContact O-N 2.95Å; H737-L741 PolarHBondContact O-N 3.2Å
738	P	85.7	Confident	80.7	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-59.7	-32.4	-168.6	20.7	-34.2	0	0	0	113.2	M623 I627 L683 L729 I736 R740 L741 L742	M623-P738 HydrophobicContact SD-CB 4.34Å; I627-P738 HydrophobicContact CD1-CB 4.14Å; I627-P738 HydrophobicContact CD1-CG 3.69Å; L683-P738 HydrophobicContact CD1-CB 4.15Å; L729-P738 HydrophobicContact CD2-CG 3.68Å; I736-P738 VanDerWaalsContact O-N 3.12Å; P738-R740 VanDerWaalsContact C-N 3.27Å; P738-R740 PolarHBondContact O-N 3.17Å; P738-L741 PolarHBondContact O-N 2.97Å; P738-L742 WeakPolarHBondContact O-CB 3.33Å; P738-L742 VanDerWaalsContact O-CG 3.27Å; P738-L742 WeakPolarHBondContact O-CG 3.47Å; P738-L742 PolarHBondContact O-N 2.84Å
739	G	84.5	Confident	78.2	Confident	11 Å²	11	66 Å²	66	11%	0.113	37%	0.366	C	S	.	.	H	α-helix	trans	-64.1	-28.6	176.8	0	0	0	0	0	114.1	H737 S743	H737-G739 PolarHBondContact ND1-N 3.23Å; H737-G739 PolarHBondContact O-N 3.19Å; H737-G739 VanDerWaalsContact O-N 3.1Å; G739-S743 PolarHBondContact O-N 2.68Å; G739-S743 PolarHBondContact O-OG 2.94Å
740	R	83.8	Confident	76	Confident	129 Å²	129	70.4 Å²	70.4	49%	0.487	40%	0.399	S	S	.	.	H	α-helix	trans	-81.2	-39.1	176.5	-170.6	-167.6	-179.4	-167	-1.9	111	S734 N735 H737 P738 S743 S744	S734-R740 WeakPolarHBondContact O-CD 3.39Å; S734-R740 PolarHBondContact O-NH1 2.87Å; N735-R740 PolarHBondContact OD1-NH1 3.5Å; H737-R740 PolarHBondContact O-N 2.95Å; P738-R740 VanDerWaalsContact C-N 3.27Å; P738-R740 PolarHBondContact O-N 3.17Å; R740-S743 WeakPolarHBondContact CA-OG 3.33Å; R740-S743 PolarHBondContact O-N 3.19Å; R740-S743 PolarHBondContact O-OG 3.25Å; R740-S744 WeakPolarHBondContact O-CB 3.31Å; R740-S744 PolarHBondContact O-N 2.95Å
741	L	84.6	Confident	73.4	Confident	56 Å²	56	72.9 Å²	72.9	29%	0.293	40%	0.402	S	S	.	.	H	α-helix	trans	-65.7	-44.8	176.4	-62.2	176.5	0	0	0	110.8	M623 I736 H737 P738 S743 S744 L745	M623-L741 HydrophobicContact CE-CB 3.64Å; M623-L741 HydrophobicContact CG-CB 4.31Å; M623-L741 HydrophobicContact CG-CD1 3.83Å; M623-L741 HydrophobicContact SD-CB 3.72Å; M623-L741 HydrophobicContact SD-CD1 4.3Å; I736-L741 WeakPolarHBondContact O-CD1 3.45Å; H737-L741 PolarHBondContact O-N 3.2Å; P738-L741 PolarHBondContact O-N 2.97Å; L741-S743 PolarHBondContact O-N 3.22Å; L741-S744 PolarHBondContact O-N 2.94Å; L741-L745 WeakPolarHBondContact O-CG 3.4Å; L741-L745 PolarHBondContact O-N 3.32Å
742	L	83.8	Confident	70.7	Confident	18 Å²	18	76.8 Å²	76.8	9%	0.094	42%	0.419	C	S	.	.	H	α-helix	trans	-58.2	-47	171	-72.6	171.1	0	0	0	112.1	I620 M623 L683 P738 S744 L745 M746	I620-L742 HydrophobicContact CD1-CD2 3.65Å; M623-L742 HydrophobicContact CE-CD2 4.32Å; M623-L742 HydrophobicContact CE-CG 4.48Å; M623-L742 HydrophobicContact SD-CD2 4.35Å; M623-L742 HydrophobicContact SD-CG 4.13Å; L683-L742 HydrophobicContact CD1-CD1 4.11Å; P738-L742 WeakPolarHBondContact O-CB 3.33Å; P738-L742 VanDerWaalsContact O-CG 3.27Å; P738-L742 WeakPolarHBondContact O-CG 3.47Å; P738-L742 PolarHBondContact O-N 2.84Å; L742-S744 VanDerWaalsContact C-N 3.29Å; L742-S744 PolarHBondContact O-N 3.45Å; L742-L745 PolarHBondContact O-N 3.38Å; L742-M746 WeakPolarHBondContact O-CG 3.43Å; L742-M746 PolarHBondContact O-N 3.16Å
743	S	77.1	Confident	68.3	Low	28 Å²	28	85.8 Å²	85.8	20%	0.196	46%	0.457	C	S	.	.	H	α-helix	trans	-64.4	-33.7	176.2	61.6	0	0	0	0	112.8	G739 R740 L741 M746 Q747	G739-S743 PolarHBondContact O-N 2.68Å; G739-S743 PolarHBondContact O-OG 2.94Å; R740-S743 WeakPolarHBondContact CA-OG 3.33Å; R740-S743 PolarHBondContact O-N 3.19Å; R740-S743 PolarHBondContact O-OG 3.25Å; L741-S743 PolarHBondContact O-N 3.22Å; S743-M746 PolarHBondContact O-N 3.33Å; S743-Q747 WeakPolarHBondContact O-CB 3.42Å; S743-Q747 VanDerWaalsContact O-CG 3.3Å; S743-Q747 WeakPolarHBondContact O-CG 3.32Å; S743-Q747 PolarHBondContact O-N 2.78Å
744	S	77.3	Confident	65.6	Low	78 Å²	78	88.9 Å²	88.9	55%	0.545	47%	0.471	S	S	.	.	H	α-helix	trans	-70.3	-34.8	176.9	-166	0	0	0	0	112.6	R740 L741 L742	R740-S744 WeakPolarHBondContact O-CB 3.31Å; R740-S744 PolarHBondContact O-N 2.95Å; L741-S744 PolarHBondContact O-N 2.94Å; L742-S744 VanDerWaalsContact C-N 3.29Å; L742-S744 PolarHBondContact O-N 3.45Å
745	L	71.1	Confident	63.4	Low	41 Å²	41	92.6 Å²	92.6	22%	0.215	48%	0.477	C	S	.	.	H	α-helix	trans	-68.1	-39.8	170.1	-69.4	174.7	0	0	0	110.7	T608 N619 M623 L741 L742 R775	T608-L745 HydrophobicContact CG2-CB 4.3Å; N619-L745 HydrophobicContact CB-CD1 4.16Å; M623-L745 HydrophobicContact CE-CD1 3.58Å; L741-L745 WeakPolarHBondContact O-CG 3.4Å; L741-L745 PolarHBondContact O-N 3.32Å; L742-L745 PolarHBondContact O-N 3.38Å; L745-R775 PolarHBondContact O-NH1 2.93Å
746	M	64.8	Low	60.9	Low	78 Å²	78	95.3 Å²	95.3	38%	0.384	49%	0.486	S	S	.	.	H	α-helix	trans	-68.2	-35.9	-180	-64.2	-92.4	74.3	0	0	113.1	T608 L742 S743 T748 R775	T608-M746 HydrophobicContact CG2-CE 3.82Å; L742-M746 WeakPolarHBondContact O-CG 3.43Å; L742-M746 PolarHBondContact O-N 3.16Å; S743-M746 PolarHBondContact O-N 3.33Å; M746-T748 PolarHBondContact O-N 3.03Å; M746-R775 PolarHBondContact O-NH2 2.82Å
747	Q	57.3	Low	58.3	Low	159 Å²	159	101.5 Å²	101.5	74%	0.743	52%	0.519	S	S	*	.			trans	-85.3	83	-176.3	-70.9	176.3	3.8	0	0	113.5	S743	S743-Q747 WeakPolarHBondContact O-CB 3.42Å; S743-Q747 VanDerWaalsContact O-CG 3.3Å; S743-Q747 WeakPolarHBondContact O-CG 3.32Å; S743-Q747 PolarHBondContact O-N 2.78Å
748	T	44	Very low	55.5	Low	90 Å²	90	104.8 Å²	104.8	55%	0.552	54%	0.543	S	S	*	.			trans	-128.4	6	178.8	47.2	0	0	0	0	115.8	M746 R775	M746-T748 PolarHBondContact O-N 3.03Å; T748-R775 PolarHBondContact OG1-NH2 3.22Å
749	D	40.4	Very low	53.1	Low	137 Å²	137	110 Å²	110	73%	0.733	58%	0.578	S	S	*	*			trans	-93.2	110.1	171.8	-70.2	-53.8	0	0	0	111.4	Q751	D749-Q751 PolarHBondContact O-N 3.13Å
750	S	44.4	Very low	51.4	Low	120 Å²	120	111.7 Å²	111.7	84%	0.839	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	24	-169.4	-57.1	0	0	0	0	116.8
751	Q	36.5	Very low	50.3	Low	178 Å²	178	110.7 Å²	110.7	83%	0.832	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.2	-4.9	-170.9	-78.1	-85.3	-38.3	0	0	114.9	D749	D749-Q751 PolarHBondContact O-N 3.13Å
752	N	33.9	Very low	50.1	Low	139 Å²	139	110.2 Å²	110.2	74%	0.743	60%	0.597	S	S	*	*			trans	-133.9	88.6	179.6	-89.8	-65.7	0	0	0	112.6
753	K	38.4	Very low	49.9	Very low	199 Å²	199	114.1 Å²	114.1	87%	0.865	62%	0.615	S	S	*	*			trans	-97.8	-8.3	173.9	-76.1	-165.3	173.5	-174.6	0	115.3
754	N	33	Very low	50.1	Low	111 Å²	111	114.7 Å²	114.7	59%	0.594	62%	0.618	S	S	*	*			trans	-109.2	37.7	-166.2	-69.1	25.1	0	0	0	114.7
755	K	33.3	Very low	50.5	Low	157 Å²	157	111.2 Å²	111.2	68%	0.683	59%	0.593	S	S	*	*			trans	-129.1	117.7	168.8	-72.2	-172.7	175.8	175	0	111.1
756	E	29.8	Very low	51.1	Low	177 Å²	177	112.6 Å²	112.6	83%	0.827	60%	0.603	S	S	*	*			trans	-72.3	127.8	-171.7	-56	177.1	127.3	0	0	112.1	T758	E756-T758 PolarHBondContact O-N 3.46Å
757	N	32.7	Very low	51.7	Low	174 Å²	174	112.7 Å²	112.7	93%	0.93	61%	0.611	S	S	*	*			trans	42.1	16.2	148.3	-71.6	-19.8	0	0	0	120.8	C759	N757-C759 PolarHBondContact O-N 2.91Å
758	T	28.4	Very low	52.7	Low	121 Å²	121	108.5 Å²	108.5	74%	0.742	60%	0.598	S	S	*	*			trans	-68.8	118.5	171.6	52.4	0	0	0	0	109.5	E756	E756-T758 PolarHBondContact O-N 3.46Å
759	C	35.1	Very low	54.5	Low	109 Å²	109	113.1 Å²	113.1	74%	0.736	61%	0.607	S	S	*	*			trans	-44.4	135.8	-178.7	-171.1	0	0	0	0	112.8	N757 S761	N757-C759 PolarHBondContact O-N 2.91Å; C759-S761 PolarHBondContact O-N 2.94Å
760	S	49.7	Very low	56.8	Low	47 Å²	47	107.4 Å²	107.4	33%	0.329	58%	0.575	S	S	.	*			trans	-22.9	109.1	-175.2	-168.3	0	0	0	0	114.2	F762	S760-F762 PolarHBondContact O-N 3.29Å; S760-F762 VanDerWaalsContact O-N 3.11Å
761	S	61.1	Low	58.7	Low	107 Å²	107	103.1 Å²	103.1	75%	0.748	54%	0.544	S	S	*	.			trans	-62.9	111.2	-171.2	53.6	0	0	0	0	112.3	C759 Q763	C759-S761 PolarHBondContact O-N 2.94Å; S761-Q763 PolarHBondContact O-N 2.97Å
762	F	79.2	Confident	60.8	Low	46 Å²	46	99 Å²	99	20%	0.202	53%	0.527	C	S	.	.			trans	-59.9	124.1	165.4	174.6	-93.5	0	0	0	109.7	L517 Q518 T600 N604 W605 S760 P764	L517-F762 HydrophobicContact CD2-CE2 4.14Å; L517-F762 HydrophobicContact CD2-CZ 4.18Å; L517-F762 WeakPolarHBondContact O-CZ 3.42Å; Q518-F762 HydrophobicContact CB-CE1 4.38Å; Q518-F762 HydrophobicContact CG-CE1 4.2Å; T600-F762 HydrophobicContact CG2-CE2 4.08Å; T600-F762 HydrophobicContact CG2-CZ 3.62Å; N604-F762 HydrophobicContact CB-CD2 4.18Å; N604-F762 HydrophobicContact CB-CE2 4.17Å; N604-F762 WeakPolarHBondContact OD1-CA 3.44Å; N604-F762 VanDerWaalsContact OD1-CD2 3.31Å; N604-F762 WeakPolarHBondContact OD1-CD2 3.41Å; W605-F762 HydrophobicContact CH2-CE2 4.07Å; W605-F762 HydrophobicContact CZ3-CE2 4.04Å; S760-F762 PolarHBondContact O-N 3.29Å; S760-F762 VanDerWaalsContact O-N 3.11Å; F762-P764 HydrophobicContact CE1-CB 4.19Å; F762-P764 WeakPolarHBondContact O-CD 3.43Å
763	Q	81.3	Confident	63	Low	101 Å²	101	93 Å²	93	47%	0.472	50%	0.495	S	S	.	.			trans	-98.7	107.2	179	-176.6	176.1	0.1	0	0	109.8	I603 N604 S761	I603-Q763 HydrophobicContact CG2-CB 4.46Å; N604-Q763 PolarHBondContact ND2-O 3.21Å; N604-Q763 PolarHBondContact OD1-N 2.81Å; N604-Q763 PolarHBondContact OD1-O 2.92Å; S761-Q763 PolarHBondContact O-N 2.97Å
764	P	81.4	Confident	64.7	Low	39 Å²	39	87.9 Å²	87.9	25%	0.253	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-68.3	156.9	174.3	31.3	-37	0	0	0	111.5	Q518 F762 T766	Q518-P764 HydrophobicContact CB-CB 3.84Å; F762-P764 HydrophobicContact CE1-CB 4.19Å; F762-P764 WeakPolarHBondContact O-CD 3.43Å; P764-T766 PolarHBondContact O-N 2.95Å
765	L	84.9	Confident	66.7	Low	5 Å²	5	86.3 Å²	86.3	3%	0.026	47%	0.466	C	S	.	.	P	Polyproline II helix	trans	-67.1	127.9	164.7	-72.4	176.2	0	0	0	109.5	P520 W566 E596 A599 T600 I603 Y770 P771	P520-L765 HydrophobicContact CG-CB 3.73Å; P520-L765 WeakPolarHBondContact CG-O 3.21Å; W566-L765 HydrophobicContact CH2-CD2 4.39Å; W566-L765 HydrophobicContact CZ2-CD2 4.08Å; E596-L765 HydrophobicContact CB-CD1 3.92Å; E596-L765 HydrophobicContact CG-CD1 4.21Å; E596-L765 VanDerWaalsContact O-CD1 3.3Å; E596-L765 WeakPolarHBondContact O-CD1 3.28Å; A599-L765 HydrophobicContact CB-CD1 3.82Å; A599-L765 HydrophobicContact CB-CD2 4.26Å; T600-L765 WeakPolarHBondContact OG1-CD1 3.1Å; T600-L765 WeakPolarHBondContact OG1-CG 3.27Å; I603-L765 HydrophobicContact CD1-CD2 3.5Å; L765-Y770 HydrophobicContact CB-CD1 4.26Å; L765-Y770 HydrophobicContact CD1-CD1 4.27Å; L765-Y770 HydrophobicContact CD1-CE1 4.33Å; L765-Y770 HydrophobicContact CD2-CD1 4.23Å; L765-P771 HydrophobicContact CD2-CG 4.26Å
766	T	84.3	Confident	69.1	Low	70 Å²	70	80 Å²	80	43%	0.429	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-83.4	159.9	176.6	45.9	0	0	0	0	112.6	P764 Y769 P771	P764-T766 PolarHBondContact O-N 2.95Å; T766-Y769 CarbonylContact C-O 3.2Å; T766-Y769 CarbonylContact O-C 3.22Å; T766-Y769 PolarHBondContact OG1-O 3.5Å; T766-P771 WeakPolarHBondContact OG1-CD 3.45Å
767	S	76.6	Confident	71.7	Confident	80 Å²	80	73.3 Å²	73.3	56%	0.559	41%	0.41	S	S	*	.	S	Bend	trans	-118.4	153.7	160.7	67.2	0	0	0	0	109.3	Y769	S767-Y769 VanDerWaalsContact C-N 3.35Å
768	P	77.7	Confident	74.1	Confident	72 Å²	72	70.2 Å²	70.2	47%	0.468	39%	0.388	S	S	.	.	S	Bend	cis	-80.7	-1.7	-1.2	34.2	-35.5	0	0	0	114.5	N522	N522-P768 PolarHBondContact ND2-O 3.44Å
769	Y	83.3	Confident	76.7	Confident	187 Å²	187	72.2 Å²	72.2	73%	0.733	39%	0.387	S	S	*	.	S	Bend	trans	-117.8	136.8	-179.4	-52	-67.4	0	0	0	112.2	T766 S767	T766-Y769 CarbonylContact C-O 3.2Å; T766-Y769 CarbonylContact O-C 3.22Å; T766-Y769 PolarHBondContact OG1-O 3.5Å; S767-Y769 VanDerWaalsContact C-N 3.35Å
770	Y	88.6	Confident	78.9	Confident	17 Å²	17	70.1 Å²	70.1	7%	0.067	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-81.6	128.6	176	-61.1	-56.6	0	0	0	111.4	P520 N522 A525 L529 W566 F595 E596 L765 I772	P520-Y770 HydrophobicContact CG-CE1 4.22Å; N522-Y770 HydrophobicContact CB-CE1 3.83Å; N522-Y770 PolarHBondContact O-OH 3.3Å; A525-Y770 HydrophobicContact CB-CD2 3.83Å; A525-Y770 HydrophobicContact CB-CE2 3.51Å; L529-Y770 HydrophobicContact CD1-CD2 4.27Å; L529-Y770 HydrophobicContact CD1-CE2 4.22Å; W566-Y770 VanDerWaalsContact NE1-CB 3.27Å; W566-Y770 PolarHBondContact NE1-O 2.72Å; F595-Y770 HydrophobicContact CD1-CE2 4.37Å; F595-Y770 AromaticContact CE1-CD2 3.9Å; F595-Y770 HydrophobicContact CE1-CD2 3.9Å; F595-Y770 HydrophobicContact CE1-CE1 4.35Å; F595-Y770 AromaticContact CE1-CE2 3.45Å; F595-Y770 HydrophobicContact CE1-CE2 3.45Å; F595-Y770 VanDerWaalsContact CE1-CE2 3.45Å; F595-Y770 AromaticContact CE1-CZ 3.69Å; F595-Y770 HydrophobicContact CZ-CD2 4.23Å; F595-Y770 HydrophobicContact CZ-CE2 4.13Å; E596-Y770 HydrophobicContact CG-CE1 4.04Å; E596-Y770 WeakPolarHBondContact CG-OH 3.45Å; E596-Y770 VanDerWaalsContact OE1-CE1 3.27Å; E596-Y770 WeakPolarHBondContact OE1-CE1 3.23Å; E596-Y770 PolarHBondContact OE1-OH 3.14Å; L765-Y770 HydrophobicContact CB-CD1 4.26Å; L765-Y770 HydrophobicContact CD1-CD1 4.27Å; L765-Y770 HydrophobicContact CD1-CE1 4.33Å; L765-Y770 HydrophobicContact CD2-CD1 4.23Å; Y770-I772 PolarHBondContact O-N 2.76Å
771	P	83.7	Confident	80.5	Confident	29 Å²	29	67.9 Å²	67.9	19%	0.188	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-72.1	121.5	-176.3	28.5	-32.5	0	0	0	111.4	W566 I603 L765 T766	W566-P771 WeakPolarHBondContact CZ2-O 3.38Å; I603-P771 HydrophobicContact CD1-CG 3.97Å; L765-P771 HydrophobicContact CD2-CG 4.26Å; T766-P771 WeakPolarHBondContact OG1-CD 3.45Å
772	I	80.3	Confident	81.8	Confident	93 Å²	93	66.4 Å²	66.4	48%	0.477	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-79	137.8	-177.5	-55.7	175.1	0	0	0	109.9	C567 Y770 T774	C567-I772 HydrophobicContact CB-CG2 4.08Å; Y770-I772 PolarHBondContact O-N 2.76Å; I772-T774 PolarHBondContact O-N 3.02Å; I772-T774 VanDerWaalsContact O-N 3.14Å
773	I	80.5	Confident	82.1	Confident	11 Å²	11	66.6 Å²	66.6	6%	0.056	34%	0.336	C	S	.	.			trans	-60.6	115.4	171.8	-60.4	178	0	0	0	108.7	F570 I603 F610 Y776	F570-I773 HydrophobicContact CE2-CD1 4.42Å; F570-I773 HydrophobicContact CZ-CD1 3.75Å; I603-I773 HydrophobicContact CG1-CG1 4.08Å; F610-I773 HydrophobicContact CD2-CD1 4.47Å; F610-I773 HydrophobicContact CD2-CG2 4.46Å; F610-I773 HydrophobicContact CE2-CD1 4.12Å; I773-Y776 WeakPolarHBondContact O-CD1 3.21Å; I773-Y776 WeakPolarHBondContact O-CE1 3.39Å
774	T	74.2	Confident	82.2	Confident	93 Å²	93	64.1 Å²	64.1	57%	0.571	32%	0.324	S	S	*	.			trans	-90.4	-16	-177.6	51.8	0	0	0	0	114	I772 Y776	I772-T774 PolarHBondContact O-N 3.02Å; I772-T774 VanDerWaalsContact O-N 3.14Å; T774-Y776 PolarHBondContact O-N 3.26Å
775	R	74.2	Confident	82.4	Confident	77 Å²	77	63.8 Å²	63.8	29%	0.291	32%	0.32	S	S	.	.			trans	-96.2	63.4	-166.9	-61.8	-175.9	178.3	-146.5	2.5	112.7	F610 L745 M746 T748	F610-R775 CarbonylContact C-O 3.51Å; L745-R775 PolarHBondContact O-NH1 2.93Å; M746-R775 PolarHBondContact O-NH2 2.82Å; T748-R775 PolarHBondContact OG1-NH2 3.22Å
776	Y	83.8	Confident	82.5	Confident	26 Å²	26	69.5 Å²	69.5	10%	0.102	35%	0.346	C	S	.	.	S	Bend	trans	-140.7	156.3	167.8	64.5	-98.7	0	0	0	109.3	L569 F610 I773 T774 K778 V781	L569-Y776 HydrophobicContact CB-CD1 4.12Å; L569-Y776 HydrophobicContact CB-CD2 4.5Å; L569-Y776 HydrophobicContact CB-CE1 3.97Å; L569-Y776 HydrophobicContact CB-CE2 4.37Å; L569-Y776 HydrophobicContact CB-CG 4.37Å; L569-Y776 HydrophobicContact CD1-CG 4.27Å; L569-Y776 HydrophobicContact CD2-CD1 3.67Å; L569-Y776 HydrophobicContact CD2-CE1 4.22Å; L569-Y776 HydrophobicContact CD2-CG 4.04Å; L569-Y776 HydrophobicContact CG-CD1 4.37Å; L569-Y776 HydrophobicContact CG-CG 4.47Å; F610-Y776 WeakPolarHBondContact O-CA 3.15Å; I773-Y776 WeakPolarHBondContact O-CD1 3.21Å; I773-Y776 WeakPolarHBondContact O-CE1 3.39Å; T774-Y776 PolarHBondContact O-N 3.26Å; Y776-K778 VanDerWaalsContact C-N 3.31Å; Y776-K778 HydrophobicContact CD2-CG 4.13Å; Y776-K778 HydrophobicContact CE2-CB 4.31Å; Y776-K778 HydrophobicContact CE2-CG 3.79Å; Y776-K778 PolarHBondContact O-N 2.81Å; Y776-V781 HydrophobicContact CD2-CB 3.85Å; Y776-V781 HydrophobicContact CD2-CG1 4.28Å; Y776-V781 HydrophobicContact CD2-CG2 3.51Å; Y776-V781 HydrophobicContact CE2-CB 3.69Å; Y776-V781 HydrophobicContact CE2-CG1 3.75Å; Y776-V781 HydrophobicContact CE2-CG2 3.86Å; Y776-V781 HydrophobicContact CG-CG2 4.47Å
777	P	84.5	Confident	82.5	Confident	35 Å²	35	67.6 Å²	67.6	23%	0.227	33%	0.332	C	S	.	.			trans	-68.3	87.5	177.5	26.9	-34.1	0	0	0	110.6	F610 F613 F779 I780 V781	F610-P777 VanDerWaalsContact O-CD 3.23Å; F610-P777 WeakPolarHBondContact O-CD 3.47Å; F613-P777 HydrophobicContact CB-CG 4.36Å; F613-P777 VanDerWaalsContact O-CG 3.32Å; F613-P777 WeakPolarHBondContact O-CG 3.26Å; P777-F779 PolarHBondContact O-N 3.15Å; P777-F779 VanDerWaalsContact O-N 3.12Å; P777-I780 HydrophobicContact CB-CB 4.17Å; P777-I780 HydrophobicContact CB-CD1 3.93Å; P777-I780 HydrophobicContact CB-CG1 4.14Å; P777-I780 HydrophobicContact CG-CB 4.23Å; P777-I780 HydrophobicContact CG-CD1 4.08Å; P777-I780 PolarHBondContact O-N 3.37Å; P777-V781 PolarHBondContact O-N 3.47Å; P777-V781 VanDerWaalsContact O-N 3.08Å
778	K	82.7	Confident	82.9	Confident	109 Å²	109	68.5 Å²	68.5	47%	0.474	32%	0.323	S	S	.	.	H	α-helix	trans	-53.2	-35.1	-176.1	-67.3	-178.3	-179	178.1	0	113.2	Y776 N782	Y776-K778 VanDerWaalsContact C-N 3.31Å; Y776-K778 HydrophobicContact CD2-CG 4.13Å; Y776-K778 HydrophobicContact CE2-CB 4.31Å; Y776-K778 HydrophobicContact CE2-CG 3.79Å; Y776-K778 PolarHBondContact O-N 2.81Å; K778-N782 WeakPolarHBondContact O-CB 3.26Å; K778-N782 PolarHBondContact O-N 2.88Å; K778-N782 PolarHBondContact O-OD1 2.57Å
779	F	84.4	Confident	83.2	Confident	163 Å²	163	69.5 Å²	69.5	72%	0.715	32%	0.322	S	S	*	.	H	α-helix	trans	-60.9	-49.1	175.2	-178.8	-96.1	0	0	0	112.1	P777 Y783	P777-F779 PolarHBondContact O-N 3.15Å; P777-F779 VanDerWaalsContact O-N 3.12Å; F779-Y783 VanDerWaalsContact O-CB 3.26Å; F779-Y783 WeakPolarHBondContact O-CB 3.48Å; F779-Y783 PolarHBondContact O-N 3.29Å
780	I	81.1	Confident	83.5	Confident	65 Å²	65	66.5 Å²	66.5	33%	0.333	31%	0.309	S	S	.	.	H	α-helix	trans	-65.5	-45.6	-179.3	-63.6	177.7	0	0	0	110.7	P777 Y783 H784	P777-I780 HydrophobicContact CB-CB 4.17Å; P777-I780 HydrophobicContact CB-CD1 3.93Å; P777-I780 HydrophobicContact CB-CG1 4.14Å; P777-I780 HydrophobicContact CG-CB 4.23Å; P777-I780 HydrophobicContact CG-CD1 4.08Å; P777-I780 PolarHBondContact O-N 3.37Å; I780-Y783 PolarHBondContact O-N 3.09Å; I780-H784 PolarHBondContact O-CD2 3.31Å; I780-H784 PolarHBondContact O-N 3.11Å
781	V	83.4	Confident	83.4	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-65.8	-44.6	178.8	172	0	0	0	0	111.4	L569 F613 Y776 P777 Y783 H784 I785	L569-V781 HydrophobicContact CB-CG1 4.42Å; L569-V781 HydrophobicContact CD1-CG2 4.02Å; F613-V781 HydrophobicContact CD1-CG2 3.59Å; F613-V781 HydrophobicContact CE1-CG2 3.85Å; Y776-V781 HydrophobicContact CD2-CB 3.85Å; Y776-V781 HydrophobicContact CD2-CG1 4.28Å; Y776-V781 HydrophobicContact CD2-CG2 3.51Å; Y776-V781 HydrophobicContact CE2-CB 3.69Å; Y776-V781 HydrophobicContact CE2-CG1 3.75Å; Y776-V781 HydrophobicContact CE2-CG2 3.86Å; Y776-V781 HydrophobicContact CG-CG2 4.47Å; P777-V781 PolarHBondContact O-N 3.47Å; P777-V781 VanDerWaalsContact O-N 3.08Å; V781-Y783 VanDerWaalsContact C-N 3.34Å; V781-Y783 PolarHBondContact O-N 3.17Å; V781-H784 PolarHBondContact O-N 2.98Å; V781-I785 HydrophobicContact CG1-CD1 3.8Å; V781-I785 WeakPolarHBondContact O-CD1 3.29Å; V781-I785 VanDerWaalsContact O-CG1 3.29Å; V781-I785 WeakPolarHBondContact O-CG1 3.07Å; V781-I785 PolarHBondContact O-N 3.32Å
782	N	86.6	Confident	83.3	Confident	76 Å²	76	72.3 Å²	72.3	41%	0.406	33%	0.332	S	S	.	.	H	α-helix	trans	-65.2	-38	177.1	-69.1	3.9	0	0	0	111.7	K778 I785 Q786	K778-N782 WeakPolarHBondContact O-CB 3.26Å; K778-N782 PolarHBondContact O-N 2.88Å; K778-N782 PolarHBondContact O-OD1 2.57Å; N782-I785 PolarHBondContact O-N 2.99Å; N782-Q786 WeakPolarHBondContact O-CB 3.37Å; N782-Q786 VanDerWaalsContact O-CG 3.27Å; N782-Q786 WeakPolarHBondContact O-CG 3.45Å; N782-Q786 PolarHBondContact O-N 2.85Å
783	Y	85.9	Confident	83.7	Confident	51 Å²	51	74.7 Å²	74.7	20%	0.2	34%	0.341	C	S	.	.	H	α-helix	trans	-63.5	-44.1	174.6	174.5	-111.5	0	0	0	111.9	E279 F779 I780 V781 I785 Q786 E787	E279-Y783 VanDerWaalsContact C-OH 3.3Å; E279-Y783 HydrophobicContact CB-CE1 4.06Å; E279-Y783 WeakPolarHBondContact CB-OH 3.37Å; E279-Y783 PolarHBondContact O-OH 3.45Å; F779-Y783 VanDerWaalsContact O-CB 3.26Å; F779-Y783 WeakPolarHBondContact O-CB 3.48Å; F779-Y783 PolarHBondContact O-N 3.29Å; I780-Y783 PolarHBondContact O-N 3.09Å; V781-Y783 VanDerWaalsContact C-N 3.34Å; V781-Y783 PolarHBondContact O-N 3.17Å; Y783-I785 VanDerWaalsContact C-N 3.34Å; Y783-I785 PolarHBondContact O-N 2.95Å; Y783-Q786 PolarHBondContact O-N 2.98Å; Y783-E787 WeakPolarHBondContact O-CB 3.2Å; Y783-E787 PolarHBondContact O-N 2.9Å
784	H	84.9	Confident	84.2	Confident	48 Å²	48	78.3 Å²	78.3	22%	0.222	36%	0.357	C	S	.	.	H	α-helix	trans	-61.6	-39.7	174.4	-77.9	-43.9	0	0	0	112.9	E572 I780 V781 R788	E572-H784 HydrophobicContact CG-CB 4.38Å; I780-H784 PolarHBondContact O-CD2 3.31Å; I780-H784 PolarHBondContact O-N 3.11Å; V781-H784 PolarHBondContact O-N 2.98Å; H784-R788 VanDerWaalsContact O-CB 3.26Å; H784-R788 WeakPolarHBondContact O-CB 3.23Å; H784-R788 WeakPolarHBondContact O-CG 3.1Å; H784-R788 PolarHBondContact O-N 3.14Å
785	I	84.2	Confident	84.8	Confident	33 Å²	33	79 Å²	79	17%	0.169	35%	0.354	C	S	.	.	H	α-helix	trans	-65.8	-47.3	175	-67.3	160.9	0	0	0	110.9	P568 E572 V781 N782 Y783 R788 E789	P568-I785 HydrophobicContact CB-CD1 3.44Å; P568-I785 VanDerWaalsContact CB-CD1 3.44Å; E572-I785 HydrophobicContact CG-CG1 4.26Å; V781-I785 HydrophobicContact CG1-CD1 3.8Å; V781-I785 WeakPolarHBondContact O-CD1 3.29Å; V781-I785 VanDerWaalsContact O-CG1 3.29Å; V781-I785 WeakPolarHBondContact O-CG1 3.07Å; V781-I785 PolarHBondContact O-N 3.32Å; N782-I785 PolarHBondContact O-N 2.99Å; Y783-I785 VanDerWaalsContact C-N 3.34Å; Y783-I785 PolarHBondContact O-N 2.95Å; I785-R788 CarbonylContact O-C 3.41Å; I785-R788 PolarHBondContact O-N 2.82Å; I785-E789 WeakPolarHBondContact O-CG 3.31Å; I785-E789 PolarHBondContact O-N 3.16Å
786	Q	87.6	Confident	85.4	Confident	124 Å²	124	81.4 Å²	81.4	58%	0.579	37%	0.367	S	S	*	.	H	α-helix	trans	-62.6	-44.2	179.7	-76.9	174.8	-16.7	0	0	112.3	N782 Y783 E789 R790	N782-Q786 WeakPolarHBondContact O-CB 3.37Å; N782-Q786 VanDerWaalsContact O-CG 3.27Å; N782-Q786 WeakPolarHBondContact O-CG 3.45Å; N782-Q786 PolarHBondContact O-N 2.85Å; Y783-Q786 PolarHBondContact O-N 2.98Å; Q786-E789 PolarHBondContact O-N 2.96Å; Q786-R790 WeakPolarHBondContact O-CB 3.48Å; Q786-R790 PolarHBondContact O-N 2.81Å
787	E	85.3	Confident	85.7	Confident	30 Å²	30	83.5 Å²	83.5	14%	0.14	38%	0.378	C	S	.	.	H	α-helix	trans	-68.1	-36	176.5	-169.2	75.9	161.1	0	0	110.7	Y783 E789 R790 I791	Y783-E787 WeakPolarHBondContact O-CB 3.2Å; Y783-E787 PolarHBondContact O-N 2.9Å; E787-E789 VanDerWaalsContact C-N 3.33Å; E787-E789 PolarHBondContact O-N 2.8Å; E787-R790 IonicContact OE1-NH1 2.7Å; E787-R790 IonicContact OE2-NH1 2.68Å; E787-R790 PolarHBondContact OE2-NH1 3.07Å; E787-I791 HydrophobicContact CG-CD1 4.04Å; E787-I791 WeakPolarHBondContact O-CB 3.39Å; E787-I791 WeakPolarHBondContact O-CD1 3.29Å; E787-I791 WeakPolarHBondContact O-CG1 3.48Å; E787-I791 PolarHBondContact O-N 3.49Å
788	R	83.1	Confident	85.9	Confident	99 Å²	99	85.4 Å²	85.4	37%	0.374	38%	0.381	S	S	.	.	H	α-helix	trans	-68.2	-25.9	170.6	-81.7	177.2	164	-164.9	1.4	113.9	G571 E572 H784 I785 R792	G571-R788 PolarHBondContact O-NH1 3.1Å; E572-R788 VanDerWaalsContact OE1-CD 3.24Å; E572-R788 WeakPolarHBondContact OE1-CD 3.5Å; E572-R788 IonicContact OE1-CZ 3.3Å; E572-R788 IonicContact OE1-NE 2.72Å; E572-R788 IonicContact OE1-NH1 2.79Å; E572-R788 PolarHBondContact OE1-NH1 2.93Å; E572-R788 WeakPolarHBondContact OE2-CD 3.29Å; E572-R788 IonicContact OE2-CZ 3.04Å; E572-R788 IonicContact OE2-NE 2.79Å; E572-R788 PolarHBondContact OE2-NE 2.97Å; E572-R788 VanDerWaalsContact OE2-NE 3.11Å; E572-R788 IonicContact OE2-NH1 3.17Å; E572-R788 PolarHBondContact OE2-NH1 2.82Å; E572-R788 IonicContact OE2-NH2 3.83Å; H784-R788 VanDerWaalsContact O-CB 3.26Å; H784-R788 WeakPolarHBondContact O-CB 3.23Å; H784-R788 WeakPolarHBondContact O-CG 3.1Å; H784-R788 PolarHBondContact O-N 3.14Å; I785-R788 CarbonylContact O-C 3.41Å; I785-R788 PolarHBondContact O-N 2.82Å; R788-R792 WeakPolarHBondContact O-CG 3.39Å; R788-R792 PolarHBondContact O-NE 2.96Å; R788-R792 PolarHBondContact O-NH2 3.27Å
789	E	85.6	Confident	86.3	Confident	94 Å²	94	85.5 Å²	85.5	44%	0.439	39%	0.386	S	S	.	.	H	α-helix	trans	-76.8	-49.8	173	-79.6	180	157.7	0	0	110.4	I785 Q786 E787 I791 R792 E793	I785-E789 WeakPolarHBondContact O-CG 3.31Å; I785-E789 PolarHBondContact O-N 3.16Å; Q786-E789 PolarHBondContact O-N 2.96Å; E787-E789 VanDerWaalsContact C-N 3.33Å; E787-E789 PolarHBondContact O-N 2.8Å; E789-I791 PolarHBondContact O-N 2.81Å; E789-R792 WeakPolarHBondContact O-CB 3.34Å; E789-R792 PolarHBondContact O-N 3.02Å; E789-R792 VanDerWaalsContact O-N 3.11Å; E789-E793 PolarHBondContact O-N 3.48Å
790	R	89.8	Confident	86.7	Confident	124 Å²	124	84.4 Å²	84.4	47%	0.468	38%	0.377	S	S	.	.	H	α-helix	trans	-54.1	-49.3	174.3	-178.8	-173.3	165.4	-150.2	-8.7	112.6	Q786 E787 R792 E793 E794	Q786-R790 WeakPolarHBondContact O-CB 3.48Å; Q786-R790 PolarHBondContact O-N 2.81Å; E787-R790 IonicContact OE1-NH1 2.7Å; E787-R790 IonicContact OE2-NH1 2.68Å; E787-R790 PolarHBondContact OE2-NH1 3.07Å; R790-R792 VanDerWaalsContact C-N 3.28Å; R790-R792 PolarHBondContact O-N 3.14Å; R790-E793 PolarHBondContact O-N 3.18Å; R790-E793 VanDerWaalsContact O-N 3.09Å; R790-E794 HydrophobicContact CG-CG 4.45Å; R790-E794 IonicContact CZ-OE1 3.75Å; R790-E794 IonicContact NE-OE1 3.17Å; R790-E794 PolarHBondContact NE-OE1 3.34Å; R790-E794 IonicContact NH2-OE1 3.55Å; R790-E794 PolarHBondContact NH2-OE1 3.42Å; R790-E794 IonicContact NH2-OE2 3.84Å; R790-E794 WeakPolarHBondContact O-CG 3.47Å; R790-E794 PolarHBondContact O-N 3.15Å
791	I	85.3	Confident	87.2	Confident	67 Å²	67	86.4 Å²	86.4	34%	0.344	39%	0.385	S	S	.	.	H	α-helix	trans	-59.2	-40.4	178.5	-72.1	165.6	0	0	0	110.9	E787 E789 E793 E794 E795	E787-I791 HydrophobicContact CG-CD1 4.04Å; E787-I791 WeakPolarHBondContact O-CB 3.39Å; E787-I791 WeakPolarHBondContact O-CD1 3.29Å; E787-I791 WeakPolarHBondContact O-CG1 3.48Å; E787-I791 PolarHBondContact O-N 3.49Å; E789-I791 PolarHBondContact O-N 2.81Å; I791-E793 VanDerWaalsContact C-N 3.34Å; I791-E793 PolarHBondContact O-N 3.26Å; I791-E794 PolarHBondContact O-N 3.33Å; I791-E795 HydrophobicContact CG2-CG 4.3Å; I791-E795 WeakPolarHBondContact O-CB 3.13Å; I791-E795 VanDerWaalsContact O-CG 3.24Å; I791-E795 WeakPolarHBondContact O-CG 3.36Å; I791-E795 PolarHBondContact O-N 2.91Å
792	R	82.4	Confident	87.4	Confident	101 Å²	101	89.6 Å²	89.6	38%	0.381	40%	0.399	S	S	.	.	H	α-helix	trans	-67.8	-31	176.3	-79.4	179.4	-75.6	131.1	-13.2	113.4	R788 E789 R790 K796	R788-R792 WeakPolarHBondContact O-CG 3.39Å; R788-R792 PolarHBondContact O-NE 2.96Å; R788-R792 PolarHBondContact O-NH2 3.27Å; E789-R792 WeakPolarHBondContact O-CB 3.34Å; E789-R792 PolarHBondContact O-N 3.02Å; E789-R792 VanDerWaalsContact O-N 3.11Å; R790-R792 VanDerWaalsContact C-N 3.28Å; R790-R792 PolarHBondContact O-N 3.14Å; R792-K796 WeakPolarHBondContact O-CB 3.22Å; R792-K796 PolarHBondContact O-N 3.02Å; R792-K796 VanDerWaalsContact O-N 3.07Å
793	E	88.6	Confident	87.7	Confident	142 Å²	142	88.4 Å²	88.4	66%	0.664	40%	0.4	S	S	*	.	H	α-helix	trans	-74.5	-42	173.9	-67.8	-171.1	155.8	0	0	111.4	E789 R790 I791 K796 E797	E789-E793 PolarHBondContact O-N 3.48Å; R790-E793 PolarHBondContact O-N 3.18Å; R790-E793 VanDerWaalsContact O-N 3.09Å; I791-E793 VanDerWaalsContact C-N 3.34Å; I791-E793 PolarHBondContact O-N 3.26Å; E793-K796 PolarHBondContact O-N 3.11Å; E793-E797 WeakPolarHBondContact O-CB 3.08Å; E793-E797 PolarHBondContact O-N 3.49Å
794	E	90.2	Very high	87.9	Confident	87 Å²	87	89.9 Å²	89.9	41%	0.407	41%	0.414	S	S	.	.	H	α-helix	trans	-61	-43.4	171.9	-71.1	179.1	-179.1	0	0	111.5	R790 I791 E797 Y798	R790-E794 HydrophobicContact CG-CG 4.45Å; R790-E794 IonicContact CZ-OE1 3.75Å; R790-E794 IonicContact NE-OE1 3.17Å; R790-E794 PolarHBondContact NE-OE1 3.34Å; R790-E794 IonicContact NH2-OE1 3.55Å; R790-E794 PolarHBondContact NH2-OE1 3.42Å; R790-E794 IonicContact NH2-OE2 3.84Å; R790-E794 WeakPolarHBondContact O-CG 3.47Å; R790-E794 PolarHBondContact O-N 3.15Å; I791-E794 PolarHBondContact O-N 3.33Å; E794-E797 PolarHBondContact O-N 2.89Å; E794-Y798 VanDerWaalsContact O-CB 3.26Å; E794-Y798 WeakPolarHBondContact O-CB 3.45Å; E794-Y798 PolarHBondContact O-N 3.38Å
795	E	86.9	Confident	88.2	Confident	107 Å²	107	90.2 Å²	90.2	50%	0.5	42%	0.42	S	S	.	.	H	α-helix	trans	-60.7	-47	173.5	-78.2	170.9	172.1	0	0	112.3	I791 E797 Y798 L799	I791-E795 HydrophobicContact CG2-CG 4.3Å; I791-E795 WeakPolarHBondContact O-CB 3.13Å; I791-E795 VanDerWaalsContact O-CG 3.24Å; I791-E795 WeakPolarHBondContact O-CG 3.36Å; I791-E795 PolarHBondContact O-N 2.91Å; E795-E797 VanDerWaalsContact C-N 3.33Å; E795-E797 PolarHBondContact O-N 3.07Å; E795-Y798 PolarHBondContact O-N 3.45Å; E795-L799 WeakPolarHBondContact O-CG 3.34Å; E795-L799 PolarHBondContact O-N 3.43Å
796	K	87.8	Confident	88.5	Confident	128 Å²	128	92.8 Å²	92.8	56%	0.557	43%	0.431	S	S	*	.	H	α-helix	trans	-65.3	-36.9	-179.6	-178.9	-179.6	178.3	-176.5	0	112.1	R792 E793 R800	R792-K796 WeakPolarHBondContact O-CB 3.22Å; R792-K796 PolarHBondContact O-N 3.02Å; R792-K796 VanDerWaalsContact O-N 3.07Å; E793-K796 PolarHBondContact O-N 3.11Å; K796-R800 WeakPolarHBondContact O-CG 3.37Å; K796-R800 PolarHBondContact O-N 3.26Å
797	E	90.1	Very high	88.8	Confident	71 Å²	71	89 Å²	89	33%	0.332	42%	0.415	S	S	.	.	H	α-helix	trans	-77.2	-37.6	176.9	-167.1	54.7	-144.4	0	0	111.8	E793 E794 E795 L799 R800 Q801	E793-E797 WeakPolarHBondContact O-CB 3.08Å; E793-E797 PolarHBondContact O-N 3.49Å; E794-E797 PolarHBondContact O-N 2.89Å; E795-E797 VanDerWaalsContact C-N 3.33Å; E795-E797 PolarHBondContact O-N 3.07Å; E797-L799 VanDerWaalsContact C-N 3.32Å; E797-L799 PolarHBondContact O-N 3.03Å; E797-R800 WeakPolarHBondContact O-CB 3.46Å; E797-R800 PolarHBondContact O-N 3.08Å; E797-R800 VanDerWaalsContact O-N 3.14Å; E797-R800 WeakPolarHBondContact OE2-CD 3.42Å; E797-R800 IonicContact OE2-CZ 2.77Å; E797-R800 IonicContact OE2-NE 2.69Å; E797-R800 IonicContact OE2-NH1 3.87Å; E797-R800 PolarHBondContact OE2-NH1 3.38Å; E797-Q801 WeakPolarHBondContact O-CG 3.44Å; E797-Q801 PolarHBondContact O-N 3.02Å
798	Y	89	Confident	89	Confident	74 Å²	74	93 Å²	93	29%	0.29	43%	0.434	S	S	.	.	H	α-helix	trans	-56.8	-43.7	169.1	172.1	-105.4	0	0	0	111.8	E794 E795 R800 Q801 K802	E794-Y798 VanDerWaalsContact O-CB 3.26Å; E794-Y798 WeakPolarHBondContact O-CB 3.45Å; E794-Y798 PolarHBondContact O-N 3.38Å; E795-Y798 PolarHBondContact O-N 3.45Å; Y798-R800 VanDerWaalsContact C-N 3.33Å; Y798-R800 PolarHBondContact O-N 3.35Å; Y798-Q801 PolarHBondContact O-N 3.05Å; Y798-K802 HydrophobicContact CE1-CD 4.43Å; Y798-K802 VanDerWaalsContact O-CB 3.26Å; Y798-K802 WeakPolarHBondContact O-CB 3.5Å; Y798-K802 PolarHBondContact O-N 3.31Å
799	L	91.3	Very high	89.3	Confident	112 Å²	112	93.2 Å²	93.2	59%	0.586	44%	0.44	S	S	*	.	H	α-helix	trans	-63.4	-35.4	176.4	-73.6	169.8	0	0	0	112.9	E795 E797 A803	E795-L799 WeakPolarHBondContact O-CG 3.34Å; E795-L799 PolarHBondContact O-N 3.43Å; E797-L799 VanDerWaalsContact C-N 3.32Å; E797-L799 PolarHBondContact O-N 3.03Å; L799-A803 PolarHBondContact O-N 2.94Å; L799-A803 VanDerWaalsContact O-N 3.16Å
800	R	92.8	Very high	89.7	Confident	139 Å²	139	94.8 Å²	94.8	53%	0.525	44%	0.442	S	S	.	.	H	α-helix	trans	-67.6	-48.7	173.3	-73	161.7	159.1	-176.7	-7.6	111.8	K796 E797 Y798 K802 A803 T804	K796-R800 WeakPolarHBondContact O-CG 3.37Å; K796-R800 PolarHBondContact O-N 3.26Å; E797-R800 WeakPolarHBondContact O-CB 3.46Å; E797-R800 PolarHBondContact O-N 3.08Å; E797-R800 VanDerWaalsContact O-N 3.14Å; E797-R800 WeakPolarHBondContact OE2-CD 3.42Å; E797-R800 IonicContact OE2-CZ 2.77Å; E797-R800 IonicContact OE2-NE 2.69Å; E797-R800 IonicContact OE2-NH1 3.87Å; E797-R800 PolarHBondContact OE2-NH1 3.38Å; Y798-R800 VanDerWaalsContact C-N 3.33Å; Y798-R800 PolarHBondContact O-N 3.35Å; R800-K802 VanDerWaalsContact C-N 3.33Å; R800-K802 PolarHBondContact O-N 3.04Å; R800-A803 PolarHBondContact O-N 3.3Å; R800-T804 PolarHBondContact O-N 3.35Å
801	Q	89.9	Confident	89.9	Confident	108 Å²	108	96.6 Å²	96.6	51%	0.505	45%	0.449	S	S	.	.	H	α-helix	trans	-64.7	-38.7	-179.8	-69	177.4	13.3	0	0	111.5	E797 Y798 A803 T804 V805	E797-Q801 WeakPolarHBondContact O-CG 3.44Å; E797-Q801 PolarHBondContact O-N 3.02Å; Y798-Q801 PolarHBondContact O-N 3.05Å; Q801-A803 PolarHBondContact O-N 2.8Å; Q801-T804 PolarHBondContact O-N 3.43Å; Q801-T804 PolarHBondContact O-OG1 3.41Å; Q801-V805 WeakPolarHBondContact O-CB 3.39Å; Q801-V805 VanDerWaalsContact O-CG2 3.29Å; Q801-V805 WeakPolarHBondContact O-CG2 3.49Å; Q801-V805 PolarHBondContact O-N 2.99Å
802	K	88.7	Confident	90.1	Very high	66 Å²	66	96.3 Å²	96.3	29%	0.287	46%	0.456	S	S	.	.	H	α-helix	trans	-58.8	-46.8	171.4	178.4	168.4	174.1	171.3	0	111.5	Y798 R800 T804 V805 E806	Y798-K802 HydrophobicContact CE1-CD 4.43Å; Y798-K802 VanDerWaalsContact O-CB 3.26Å; Y798-K802 WeakPolarHBondContact O-CB 3.5Å; Y798-K802 PolarHBondContact O-N 3.31Å; R800-K802 VanDerWaalsContact C-N 3.33Å; R800-K802 PolarHBondContact O-N 3.04Å; K802-T804 VanDerWaalsContact C-N 3.33Å; K802-T804 PolarHBondContact O-N 3.07Å; K802-V805 PolarHBondContact O-N 3.2Å; K802-E806 WeakPolarHBondContact CE-OE1 3.38Å; K802-E806 HydrophobicContact CG-CG 4.42Å; K802-E806 IonicContact NZ-OE1 3.63Å; K802-E806 WeakPolarHBondContact O-CB 3.41Å; K802-E806 WeakPolarHBondContact O-CG 3.47Å; K802-E806 PolarHBondContact O-N 2.75Å
803	A	91.4	Very high	90.5	Very high	52 Å²	52	97.2 Å²	97.2	43%	0.43	46%	0.464	S	S	.	.	H	α-helix	trans	-63.3	-35	178.1	0	0	0	0	0	113.2	L799 R800 Q801 D807	L799-A803 PolarHBondContact O-N 2.94Å; L799-A803 VanDerWaalsContact O-N 3.16Å; R800-A803 PolarHBondContact O-N 3.3Å; Q801-A803 PolarHBondContact O-N 2.8Å; A803-D807 PolarHBondContact O-N 3.02Å
804	T	91.9	Very high	90.8	Very high	81 Å²	81	95.5 Å²	95.5	50%	0.497	46%	0.459	S	S	.	.	H	α-helix	trans	-74.6	-35.7	174.4	59.8	0	0	0	0	112.6	R800 Q801 K802 D807 M808	R800-T804 PolarHBondContact O-N 3.35Å; Q801-T804 PolarHBondContact O-N 3.43Å; Q801-T804 PolarHBondContact O-OG1 3.41Å; K802-T804 VanDerWaalsContact C-N 3.33Å; K802-T804 PolarHBondContact O-N 3.07Å; T804-D807 PolarHBondContact O-N 2.94Å; T804-M808 WeakPolarHBondContact O-CG 3.49Å; T804-M808 PolarHBondContact O-N 3.33Å
805	V	89.6	Confident	90.8	Very high	56 Å²	56	97.1 Å²	97.1	34%	0.339	47%	0.468	S	S	.	.	H	α-helix	trans	-64.7	-43.2	172.8	169.8	0	0	0	0	111.3	Q801 K802 D807 M808 Q809	Q801-V805 WeakPolarHBondContact O-CB 3.39Å; Q801-V805 VanDerWaalsContact O-CG2 3.29Å; Q801-V805 WeakPolarHBondContact O-CG2 3.49Å; Q801-V805 PolarHBondContact O-N 2.99Å; K802-V805 PolarHBondContact O-N 3.2Å; V805-D807 VanDerWaalsContact C-N 3.26Å; V805-D807 PolarHBondContact O-N 3Å; V805-M808 HydrophobicContact CG2-CE 3.95Å; V805-M808 PolarHBondContact O-N 3.48Å; V805-Q809 HydrophobicContact CG1-CG 4.38Å; V805-Q809 WeakPolarHBondContact O-CB 3.38Å; V805-Q809 WeakPolarHBondContact O-CG 3.25Å; V805-Q809 PolarHBondContact O-N 3.48Å
806	E	90.5	Very high	91.1	Very high	87 Å²	87	98.2 Å²	98.2	41%	0.407	48%	0.475	S	S	.	.	H	α-helix	trans	-61.8	-33.2	174.1	-74.1	173.6	178.2	0	0	112.2	K802 R810	K802-E806 WeakPolarHBondContact CE-OE1 3.38Å; K802-E806 HydrophobicContact CG-CG 4.42Å; K802-E806 IonicContact NZ-OE1 3.63Å; K802-E806 WeakPolarHBondContact O-CB 3.41Å; K802-E806 WeakPolarHBondContact O-CG 3.47Å; K802-E806 PolarHBondContact O-N 2.75Å; E806-R810 WeakPolarHBondContact O-CG 3.37Å; E806-R810 PolarHBondContact O-N 3.4Å; E806-R810 VanDerWaalsContact O-N 3.14Å; E806-R810 PolarHBondContact O-NE 3.02Å
807	D	93.7	Very high	91.4	Very high	44 Å²	44	96.5 Å²	96.5	24%	0.235	47%	0.472	C	S	.	.	H	α-helix	trans	-73.2	-42.1	173.8	-155.3	75	0	0	0	112.8	A803 T804 V805 R810 R811	A803-D807 PolarHBondContact O-N 3.02Å; T804-D807 PolarHBondContact O-N 2.94Å; V805-D807 VanDerWaalsContact C-N 3.26Å; V805-D807 PolarHBondContact O-N 3Å; D807-R810 VanDerWaalsContact CA-NH2 3.28Å; D807-R810 PolarHBondContact O-N 2.98Å; D807-R810 IonicContact OD1-CZ 3.27Å; D807-R810 IonicContact OD1-NH1 3.66Å; D807-R810 PolarHBondContact OD1-NH1 2.83Å; D807-R810 IonicContact OD1-NH2 3.98Å; D807-R810 PolarHBondContact OD1-NH2 3.34Å; D807-R811 WeakPolarHBondContact O-CG 3.35Å; D807-R811 PolarHBondContact O-N 2.68Å; D807-R811 IonicContact OD2-CZ 2.75Å; D807-R811 IonicContact OD2-NE 2.77Å; D807-R811 PolarHBondContact OD2-NE 3.11Å; D807-R811 IonicContact OD2-NH2 3.09Å; D807-R811 PolarHBondContact OD2-NH2 2.82Å
808	M	89.8	Confident	91.5	Very high	113 Å²	113	98.9 Å²	98.9	56%	0.557	48%	0.483	S	S	*	.	H	α-helix	trans	-63.5	-39.9	173.6	-71.4	-173.3	-65.1	0	0	112.1	T804 V805 R811 A812	T804-M808 WeakPolarHBondContact O-CG 3.49Å; T804-M808 PolarHBondContact O-N 3.33Å; V805-M808 HydrophobicContact CG2-CE 3.95Å; V805-M808 PolarHBondContact O-N 3.48Å; M808-R811 PolarHBondContact O-N 3.18Å; M808-A812 WeakPolarHBondContact O-CB 3.43Å; M808-A812 PolarHBondContact O-N 3.46Å
809	Q	90.5	Very high	91.6	Very high	104 Å²	104	100.4 Å²	100.4	49%	0.486	49%	0.493	S	S	.	.	H	α-helix	trans	-63.8	-43.2	175.2	-74.3	179.1	10.4	0	0	111.8	V805 R811 A812 Q813	V805-Q809 HydrophobicContact CG1-CG 4.38Å; V805-Q809 WeakPolarHBondContact O-CB 3.38Å; V805-Q809 WeakPolarHBondContact O-CG 3.25Å; V805-Q809 PolarHBondContact O-N 3.48Å; Q809-R811 VanDerWaalsContact C-N 3.34Å; Q809-R811 PolarHBondContact O-N 3.33Å; Q809-A812 PolarHBondContact O-N 3.45Å; Q809-Q813 WeakPolarHBondContact O-CG 3.37Å; Q809-Q813 PolarHBondContact O-N 2.98Å
810	R	93	Very high	91.7	Very high	128 Å²	128	99.5 Å²	99.5	48%	0.483	49%	0.485	S	S	.	.	H	α-helix	trans	-60.6	-41.2	174	-78.7	-177.6	-76.8	101.5	-1.6	112	E806 D807 L814	E806-R810 WeakPolarHBondContact O-CG 3.37Å; E806-R810 PolarHBondContact O-N 3.4Å; E806-R810 VanDerWaalsContact O-N 3.14Å; E806-R810 PolarHBondContact O-NE 3.02Å; D807-R810 VanDerWaalsContact CA-NH2 3.28Å; D807-R810 PolarHBondContact O-N 2.98Å; D807-R810 IonicContact OD1-CZ 3.27Å; D807-R810 IonicContact OD1-NH1 3.66Å; D807-R810 PolarHBondContact OD1-NH1 2.83Å; D807-R810 IonicContact OD1-NH2 3.98Å; D807-R810 PolarHBondContact OD1-NH2 3.34Å; R810-L814 WeakPolarHBondContact O-CG 3.49Å; R810-L814 PolarHBondContact O-N 3.41Å
811	R	93.7	Very high	91.7	Very high	162 Å²	162	96.8 Å²	96.8	61%	0.611	48%	0.482	S	S	*	.	H	α-helix	trans	-64.6	-45.1	174.2	-66.4	171	-163.3	-140.3	5.3	112.2	D807 M808 Q809 Q813 L814 M815	D807-R811 WeakPolarHBondContact O-CG 3.35Å; D807-R811 PolarHBondContact O-N 2.68Å; D807-R811 IonicContact OD2-CZ 2.75Å; D807-R811 IonicContact OD2-NE 2.77Å; D807-R811 PolarHBondContact OD2-NE 3.11Å; D807-R811 IonicContact OD2-NH2 3.09Å; D807-R811 PolarHBondContact OD2-NH2 2.82Å; M808-R811 PolarHBondContact O-N 3.18Å; Q809-R811 VanDerWaalsContact C-N 3.34Å; Q809-R811 PolarHBondContact O-N 3.33Å; R811-Q813 VanDerWaalsContact C-N 3.33Å; R811-Q813 PolarHBondContact O-N 3.39Å; R811-L814 PolarHBondContact O-N 3.3Å; R811-M815 WeakPolarHBondContact O-CG 3.35Å; R811-M815 PolarHBondContact O-N 2.73Å
812	A	90	Very high	91.9	Very high	60 Å²	60	98.4 Å²	98.4	50%	0.496	48%	0.483	S	S	.	.	H	α-helix	trans	-63.3	-37.2	179.4	0	0	0	0	0	112.6	M808 Q809 M815 M816	M808-A812 WeakPolarHBondContact O-CB 3.43Å; M808-A812 PolarHBondContact O-N 3.46Å; Q809-A812 PolarHBondContact O-N 3.45Å; A812-M815 PolarHBondContact O-N 3.01Å; A812-M816 WeakPolarHBondContact O-CB 3.48Å; A812-M816 PolarHBondContact O-N 2.83Å
813	Q	90.8	Very high	92.1	Very high	120 Å²	120	101.6 Å²	101.6	56%	0.561	49%	0.494	S	S	*	.	H	α-helix	trans	-64.3	-39.3	173.6	-73.6	172.5	0.7	0	0	112.4	Q809 R811 N817	Q809-Q813 WeakPolarHBondContact O-CG 3.37Å; Q809-Q813 PolarHBondContact O-N 2.98Å; R811-Q813 VanDerWaalsContact C-N 3.33Å; R811-Q813 PolarHBondContact O-N 3.39Å; Q813-N817 WeakPolarHBondContact O-CB 3.44Å; Q813-N817 PolarHBondContact O-N 3.18Å; Q813-N817 VanDerWaalsContact O-N 3.08Å; Q813-N817 PolarHBondContact O-ND2 3.4Å; Q813-N817 VanDerWaalsContact O-ND2 3.08Å
814	L	94.6	Very high	92.2	Very high	107 Å²	107	105.3 Å²	105.3	56%	0.56	50%	0.497	S	S	*	.	H	α-helix	trans	-63.7	-50.4	174.4	-68.2	169	0	0	0	111.1	R810 R811 M816 N817 E818	R810-L814 WeakPolarHBondContact O-CG 3.49Å; R810-L814 PolarHBondContact O-N 3.41Å; R811-L814 PolarHBondContact O-N 3.3Å; L814-M816 VanDerWaalsContact C-N 3.33Å; L814-M816 PolarHBondContact O-N 3.18Å; L814-N817 WeakPolarHBondContact O-CB 3.25Å; L814-N817 PolarHBondContact O-N 3.01Å; L814-N817 VanDerWaalsContact O-N 3.12Å; L814-E818 WeakPolarHBondContact O-CG 3.44Å; L814-E818 PolarHBondContact O-N 2.81Å
815	M	91.3	Very high	92.2	Very high	120 Å²	120	108.1 Å²	108.1	59%	0.591	50%	0.504	S	S	*	.	H	α-helix	trans	-56.7	-43.9	176.7	-66	-57.6	-48.6	0	0	112.5	R811 A812 N817 E818 E819	R811-M815 WeakPolarHBondContact O-CG 3.35Å; R811-M815 PolarHBondContact O-N 2.73Å; A812-M815 PolarHBondContact O-N 3.01Å; M815-N817 VanDerWaalsContact C-N 3.33Å; M815-N817 PolarHBondContact O-N 2.85Å; M815-E818 PolarHBondContact O-N 3.41Å; M815-E819 WeakPolarHBondContact O-CB 3.47Å; M815-E819 PolarHBondContact O-N 2.93Å
816	M	92.8	Very high	92.5	Very high	130 Å²	130	110 Å²	110	64%	0.64	51%	0.51	S	S	*	.	H	α-helix	trans	-64.5	-36.2	178.3	-176.6	-177.8	176.7	0	0	112.3	A812 L814 H820	A812-M816 WeakPolarHBondContact O-CB 3.48Å; A812-M816 PolarHBondContact O-N 2.83Å; L814-M816 VanDerWaalsContact C-N 3.33Å; L814-M816 PolarHBondContact O-N 3.18Å; M816-H820 VanDerWaalsContact O-CB 3.22Å; M816-H820 WeakPolarHBondContact O-CB 3.42Å; M816-H820 PolarHBondContact O-N 2.83Å
817	N	93.3	Very high	92.5	Very high	92 Å²	92	111.6 Å²	111.6	49%	0.492	52%	0.517	S	S	.	.	H	α-helix	trans	-69.4	-39.5	175.5	-72.2	-31	0	0	0	111.7	Q813 L814 M815 N821	Q813-N817 WeakPolarHBondContact O-CB 3.44Å; Q813-N817 PolarHBondContact O-N 3.18Å; Q813-N817 VanDerWaalsContact O-N 3.08Å; Q813-N817 PolarHBondContact O-ND2 3.4Å; Q813-N817 VanDerWaalsContact O-ND2 3.08Å; L814-N817 WeakPolarHBondContact O-CB 3.25Å; L814-N817 PolarHBondContact O-N 3.01Å; L814-N817 VanDerWaalsContact O-N 3.12Å; M815-N817 VanDerWaalsContact C-N 3.33Å; M815-N817 PolarHBondContact O-N 2.85Å; N817-N821 WeakPolarHBondContact O-CB 3.45Å; N817-N821 PolarHBondContact O-N 2.98Å; N817-N821 PolarHBondContact O-ND2 3.19Å; N817-N821 VanDerWaalsContact O-ND2 3.08Å
818	E	93.4	Very high	92.6	Very high	121 Å²	121	115.3 Å²	115.3	57%	0.565	54%	0.536	S	S	*	.	H	α-helix	trans	-64	-49	174.5	-71.2	173.6	-176.3	0	0	111.4	L814 M815 H820 N821 W822	L814-E818 WeakPolarHBondContact O-CG 3.44Å; L814-E818 PolarHBondContact O-N 2.81Å; M815-E818 PolarHBondContact O-N 3.41Å; E818-H820 PolarHBondContact O-N 2.96Å; E818-N821 PolarHBondContact O-N 2.94Å; E818-W822 WeakPolarHBondContact O-CB 3.39Å; E818-W822 PolarHBondContact O-N 3.48Å
819	E	91.5	Very high	92.8	Very high	106 Å²	106	115 Å²	115	50%	0.495	54%	0.536	S	S	.	.	H	α-helix	trans	-59	-46.2	176	179.4	178	-157.2	0	0	111.8	M815 N821 W822 Y823	M815-E819 WeakPolarHBondContact O-CB 3.47Å; M815-E819 PolarHBondContact O-N 2.93Å; E819-N821 PolarHBondContact O-N 3.4Å; E819-W822 WeakPolarHBondContact O-CB 3.47Å; E819-W822 PolarHBondContact O-N 3.38Å; E819-Y823 HydrophobicContact CG-CD2 3.79Å; E819-Y823 HydrophobicContact CG-CE2 3.54Å; E819-Y823 VanDerWaalsContact O-CD2 3.27Å; E819-Y823 WeakPolarHBondContact O-CD2 3.29Å; E819-Y823 PolarHBondContact O-N 2.82Å
820	H	91.5	Very high	92.9	Very high	93 Å²	93	114.4 Å²	114.4	43%	0.431	54%	0.536	S	S	.	.	H	α-helix	trans	-66.3	-36.8	178.8	179.1	66	0	0	0	112.6	M816 E818 R824	M816-H820 VanDerWaalsContact O-CB 3.22Å; M816-H820 WeakPolarHBondContact O-CB 3.42Å; M816-H820 PolarHBondContact O-N 2.83Å; E818-H820 PolarHBondContact O-N 2.96Å; H820-R824 PolarHBondContact CD2-NH2 2.61Å; H820-R824 PolarHBondContact NE2-NE 3.25Å; H820-R824 PolarHBondContact NE2-NH2 3.2Å; H820-R824 WeakPolarHBondContact O-CG 3.33Å; H820-R824 PolarHBondContact O-N 2.97Å; H820-R824 VanDerWaalsContact O-N 3.14Å
821	N	93.3	Very high	93	Very high	83 Å²	83	112.3 Å²	112.3	44%	0.444	54%	0.535	S	S	.	.	H	α-helix	trans	-65.8	-40.3	172.4	-74.1	-31.3	0	0	0	111.6	N817 E818 E819 R824 Q825	N817-N821 WeakPolarHBondContact O-CB 3.45Å; N817-N821 PolarHBondContact O-N 2.98Å; N817-N821 PolarHBondContact O-ND2 3.19Å; N817-N821 VanDerWaalsContact O-ND2 3.08Å; E818-N821 PolarHBondContact O-N 2.94Å; E819-N821 PolarHBondContact O-N 3.4Å; N821-R824 PolarHBondContact O-N 2.87Å; N821-R824 PolarHBondContact OD1-NH1 3.12Å; N821-Q825 PolarHBondContact O-N 3.36Å
822	W	93.6	Very high	93	Very high	141 Å²	141	107.5 Å²	107.5	53%	0.534	53%	0.529	S	S	.	.	H	α-helix	trans	-61	-46.4	175	-176.7	87.6	0	0	0	111.8	E818 E819 R824 Q825 Q826	E818-W822 WeakPolarHBondContact O-CB 3.39Å; E818-W822 PolarHBondContact O-N 3.48Å; E819-W822 WeakPolarHBondContact O-CB 3.47Å; E819-W822 PolarHBondContact O-N 3.38Å; W822-R824 PolarHBondContact O-N 2.97Å; W822-Q825 PolarHBondContact O-N 2.77Å; W822-Q825 VanDerWaalsContact O-N 3.16Å; W822-Q826 HydrophobicContact CH2-CG 4.32Å; W822-Q826 WeakPolarHBondContact O-CB 3.48Å; W822-Q826 PolarHBondContact O-N 2.85Å
823	Y	93.8	Very high	93.1	Very high	134 Å²	134	107.5 Å²	107.5	53%	0.525	52%	0.519	S	S	.	.	H	α-helix	trans	-60	-41.7	175.5	-83.6	-65.1	0	0	0	112.9	E819 Q825 Q826 Q827	E819-Y823 HydrophobicContact CG-CD2 3.79Å; E819-Y823 HydrophobicContact CG-CE2 3.54Å; E819-Y823 VanDerWaalsContact O-CD2 3.27Å; E819-Y823 WeakPolarHBondContact O-CD2 3.29Å; E819-Y823 PolarHBondContact O-N 2.82Å; Y823-Q825 VanDerWaalsContact C-N 3.35Å; Y823-Q825 PolarHBondContact O-N 2.73Å; Y823-Q826 PolarHBondContact O-N 3.22Å; Y823-Q827 WeakPolarHBondContact O-CB 3.1Å; Y823-Q827 PolarHBondContact O-N 3.46Å
824	R	93.5	Very high	93.2	Very high	129 Å²	129	105.2 Å²	105.2	49%	0.487	51%	0.511	S	S	.	.	H	α-helix	trans	-60.8	-44.4	174.1	-68.9	-170.1	-147.1	138.2	-1.5	111.8	H820 N821 W822 Q826 Q827 L828	H820-R824 PolarHBondContact CD2-NH2 2.61Å; H820-R824 PolarHBondContact NE2-NE 3.25Å; H820-R824 PolarHBondContact NE2-NH2 3.2Å; H820-R824 WeakPolarHBondContact O-CG 3.33Å; H820-R824 PolarHBondContact O-N 2.97Å; H820-R824 VanDerWaalsContact O-N 3.14Å; N821-R824 PolarHBondContact O-N 2.87Å; N821-R824 PolarHBondContact OD1-NH1 3.12Å; W822-R824 PolarHBondContact O-N 2.97Å; R824-Q826 VanDerWaalsContact C-N 3.34Å; R824-Q827 PolarHBondContact O-N 2.81Å; R824-L828 WeakPolarHBondContact O-CB 3.46Å; R824-L828 VanDerWaalsContact O-CG 3.32Å; R824-L828 WeakPolarHBondContact O-CG 3.34Å; R824-L828 PolarHBondContact O-N 2.9Å
825	Q	92.8	Very high	93.1	Very high	140 Å²	140	106 Å²	106	65%	0.654	51%	0.511	S	S	*	.	H	α-helix	trans	-64.9	-39.5	179.8	-174.4	171.1	-6.8	0	0	111.5	N821 W822 Y823 L829	N821-Q825 PolarHBondContact O-N 3.36Å; W822-Q825 PolarHBondContact O-N 2.77Å; W822-Q825 VanDerWaalsContact O-N 3.16Å; Y823-Q825 VanDerWaalsContact C-N 3.35Å; Y823-Q825 PolarHBondContact O-N 2.73Å; Q825-L829 WeakPolarHBondContact O-CB 3.43Å; Q825-L829 PolarHBondContact O-N 3.28Å; Q825-L829 VanDerWaalsContact O-N 3.1Å
826	Q	94.2	Very high	93.2	Very high	96 Å²	96	106 Å²	106	45%	0.449	50%	0.504	S	S	.	.	H	α-helix	trans	-67.7	-39.2	176.3	-167.7	66.1	11	0	0	112.2	W822 Y823 R824 L829 L830	W822-Q826 HydrophobicContact CH2-CG 4.32Å; W822-Q826 WeakPolarHBondContact O-CB 3.48Å; W822-Q826 PolarHBondContact O-N 2.85Å; Y823-Q826 PolarHBondContact O-N 3.22Å; R824-Q826 VanDerWaalsContact C-N 3.34Å; Q826-L829 PolarHBondContact O-N 2.89Å; Q826-L830 PolarHBondContact O-N 3.35Å
827	Q	91.8	Very high	93.2	Very high	121 Å²	121	105.5 Å²	105.5	57%	0.565	50%	0.496	S	S	*	.	H	α-helix	trans	-64.8	-48.9	174.9	-176.9	176.8	-8	0	0	111.5	Y823 R824 L829 L830 D831	Y823-Q827 WeakPolarHBondContact O-CB 3.1Å; Y823-Q827 PolarHBondContact O-N 3.46Å; R824-Q827 PolarHBondContact O-N 2.81Å; Q827-L829 PolarHBondContact O-N 2.73Å; Q827-L830 PolarHBondContact O-N 2.91Å; Q827-L830 VanDerWaalsContact O-N 3.07Å; Q827-D831 PolarHBondContact O-N 2.98Å
828	L	94.6	Very high	93.2	Very high	121 Å²	121	104.8 Å²	104.8	63%	0.634	50%	0.495	S	S	*	.	H	α-helix	trans	-58.4	-33.6	177.1	-72.6	168.3	0	0	0	112.7	R824 A832	R824-L828 WeakPolarHBondContact O-CB 3.46Å; R824-L828 VanDerWaalsContact O-CG 3.32Å; R824-L828 WeakPolarHBondContact O-CG 3.34Å; R824-L828 PolarHBondContact O-N 2.9Å; L828-A832 VanDerWaalsContact O-CB 3.29Å; L828-A832 WeakPolarHBondContact O-CB 3.45Å; L828-A832 PolarHBondContact O-N 3.36Å; L828-A832 VanDerWaalsContact O-N 3.14Å
829	L	94.3	Very high	93.2	Very high	107 Å²	107	103 Å²	103	56%	0.56	49%	0.489	S	S	*	.	H	α-helix	trans	-72	-38.9	176.3	-167.8	152.1	0	0	0	111.9	Q825 Q826 Q827 E833	Q825-L829 WeakPolarHBondContact O-CB 3.43Å; Q825-L829 PolarHBondContact O-N 3.28Å; Q825-L829 VanDerWaalsContact O-N 3.1Å; Q826-L829 PolarHBondContact O-N 2.89Å; Q827-L829 PolarHBondContact O-N 2.73Å; L829-E833 PolarHBondContact O-N 3.04Å
830	L	93.9	Very high	93.3	Very high	91 Å²	91	102 Å²	102	48%	0.476	49%	0.486	S	S	.	.	H	α-helix	trans	-66.9	-48.2	174.6	-178.6	64.1	0	0	0	111.8	Q826 Q827 A832 E833 D834	Q826-L830 PolarHBondContact O-N 3.35Å; Q827-L830 PolarHBondContact O-N 2.91Å; Q827-L830 VanDerWaalsContact O-N 3.07Å; L830-A832 PolarHBondContact O-N 3.06Å; L830-E833 PolarHBondContact O-N 3.19Å; L830-D834 PolarHBondContact O-N 3.43Å
831	D	94.1	Very high	93.4	Very high	85 Å²	85	99.8 Å²	99.8	46%	0.455	48%	0.484	S	S	.	.	H	α-helix	trans	-57.5	-40.2	177.8	-67.5	-23.7	0	0	0	110.9	Q827 H835	Q827-D831 PolarHBondContact O-N 2.98Å; D831-H835 WeakPolarHBondContact O-CB 3.5Å; D831-H835 PolarHBondContact O-N 3.12Å
832	A	94.3	Very high	93.4	Very high	61 Å²	61	100.7 Å²	100.7	50%	0.504	49%	0.486	S	S	.	.	H	α-helix	trans	-67.9	-34.9	174.1	0	0	0	0	0	113.2	L828 L830 R836	L828-A832 VanDerWaalsContact O-CB 3.29Å; L828-A832 WeakPolarHBondContact O-CB 3.45Å; L828-A832 PolarHBondContact O-N 3.36Å; L828-A832 VanDerWaalsContact O-N 3.14Å; L830-A832 PolarHBondContact O-N 3.06Å; A832-R836 WeakPolarHBondContact O-CB 3.37Å; A832-R836 PolarHBondContact O-N 3.33Å
833	E	91.7	Very high	93.3	Very high	60 Å²	60	99 Å²	99	28%	0.28	48%	0.484	S	S	.	.	H	α-helix	trans	-71.9	-40.9	177.5	-141.8	-132.2	129.2	0	0	112.2	L829 L830 R836 R837	L829-E833 PolarHBondContact O-N 3.04Å; L830-E833 PolarHBondContact O-N 3.19Å; E833-R836 WeakPolarHBondContact O-CB 3.32Å; E833-R836 PolarHBondContact O-N 3.32Å; E833-R836 IonicContact OE1-CZ 2.65Å; E833-R836 IonicContact OE1-NH2 3.29Å; E833-R836 PolarHBondContact OE1-NH2 2.8Å; E833-R837 VanDerWaalsContact O-CG 3.25Å; E833-R837 WeakPolarHBondContact O-CG 3.24Å; E833-R837 PolarHBondContact O-N 2.65Å; E833-R837 IonicContact OE1-CZ 2.89Å; E833-R837 VanDerWaalsContact OE1-CZ 3.22Å; E833-R837 IonicContact OE1-NE 3.83Å; E833-R837 PolarHBondContact OE1-NE 2.81Å; E833-R837 IonicContact OE1-NH2 3.24Å; E833-R837 PolarHBondContact OE1-NH2 2.69Å; E833-R837 IonicContact OE2-CZ 3.28Å; E833-R837 IonicContact OE2-NE 3.6Å; E833-R837 IonicContact OE2-NH2 3.84Å; E833-R837 PolarHBondContact OE2-NH2 3.3Å
834	D	93	Very high	93.2	Very high	72 Å²	72	97.1 Å²	97.1	39%	0.385	48%	0.48	S	S	.	.	H	α-helix	trans	-71.1	-35.9	176.7	-80.9	-21.2	0	0	0	112	L830 R836 R837 T838	L830-D834 PolarHBondContact O-N 3.43Å; D834-R836 VanDerWaalsContact C-N 3.34Å; D834-R836 PolarHBondContact O-N 3.24Å; D834-R837 PolarHBondContact O-N 3.29Å; D834-R837 VanDerWaalsContact O-N 3.17Å; D834-R837 VanDerWaalsContact OD1-CD 3.27Å; D834-R837 WeakPolarHBondContact OD1-CD 3.23Å; D834-R837 IonicContact OD1-CZ 3.19Å; D834-R837 IonicContact OD1-NE 2.66Å; D834-R837 IonicContact OD1-NH1 3.89Å; D834-R837 PolarHBondContact OD1-NH1 2.65Å; D834-T838 PolarHBondContact O-N 2.96Å; D834-T838 PolarHBondContact O-OG1 3.34Å
835	H	92	Very high	93.1	Very high	122 Å²	122	94.6 Å²	94.6	57%	0.565	48%	0.476	S	S	*	.	H	α-helix	trans	-62.7	-38.7	170.2	-172.1	68.2	0	0	0	112.5	D831 T838 L839	D831-H835 WeakPolarHBondContact O-CB 3.5Å; D831-H835 PolarHBondContact O-N 3.12Å; H835-T838 PolarHBondContact O-OG1 2.93Å; H835-L839 WeakPolarHBondContact O-CG 3.49Å; H835-L839 PolarHBondContact O-N 2.75Å
836	R	94.1	Very high	93.2	Very high	120 Å²	120	93 Å²	93	45%	0.453	47%	0.467	S	S	.	.	H	α-helix	trans	-64	-39.1	172	-178.2	-166.3	68.5	82.3	-0.8	111.8	A832 E833 D834 L840	A832-R836 WeakPolarHBondContact O-CB 3.37Å; A832-R836 PolarHBondContact O-N 3.33Å; E833-R836 WeakPolarHBondContact O-CB 3.32Å; E833-R836 PolarHBondContact O-N 3.32Å; E833-R836 IonicContact OE1-CZ 2.65Å; E833-R836 IonicContact OE1-NH2 3.29Å; E833-R836 PolarHBondContact OE1-NH2 2.8Å; D834-R836 VanDerWaalsContact C-N 3.34Å; D834-R836 PolarHBondContact O-N 3.24Å; R836-L840 HydrophobicContact CG-CD1 4.15Å; R836-L840 VanDerWaalsContact O-CG 3.31Å; R836-L840 WeakPolarHBondContact O-CG 3.5Å; R836-L840 PolarHBondContact O-N 2.86Å
837	R	91.9	Very high	93.1	Very high	120 Å²	120	92.5 Å²	92.5	45%	0.453	47%	0.467	S	S	.	.	H	α-helix	trans	-67.8	-41.2	178.5	-73.3	163.5	178.1	-172.8	2.1	112.5	E833 D834 A841	E833-R837 VanDerWaalsContact O-CG 3.25Å; E833-R837 WeakPolarHBondContact O-CG 3.24Å; E833-R837 PolarHBondContact O-N 2.65Å; E833-R837 IonicContact OE1-CZ 2.89Å; E833-R837 VanDerWaalsContact OE1-CZ 3.22Å; E833-R837 IonicContact OE1-NE 3.83Å; E833-R837 PolarHBondContact OE1-NE 2.81Å; E833-R837 IonicContact OE1-NH2 3.24Å; E833-R837 PolarHBondContact OE1-NH2 2.69Å; E833-R837 IonicContact OE2-CZ 3.28Å; E833-R837 IonicContact OE2-NE 3.6Å; E833-R837 IonicContact OE2-NH2 3.84Å; E833-R837 PolarHBondContact OE2-NH2 3.3Å; D834-R837 PolarHBondContact O-N 3.29Å; D834-R837 VanDerWaalsContact O-N 3.17Å; D834-R837 VanDerWaalsContact OD1-CD 3.27Å; D834-R837 WeakPolarHBondContact OD1-CD 3.23Å; D834-R837 IonicContact OD1-CZ 3.19Å; D834-R837 IonicContact OD1-NE 2.66Å; D834-R837 IonicContact OD1-NH1 3.89Å; D834-R837 PolarHBondContact OD1-NH1 2.65Å; R837-A841 WeakPolarHBondContact O-CB 3.34Å; R837-A841 PolarHBondContact O-N 3.08Å
838	T	94.2	Very high	93.1	Very high	78 Å²	78	92.1 Å²	92.1	48%	0.479	46%	0.46	S	S	.	.	H	α-helix	trans	-67.1	-44.2	178.4	53.2	0	0	0	0	111.9	D834 H835 L840 A841 E842	D834-T838 PolarHBondContact O-N 2.96Å; D834-T838 PolarHBondContact O-OG1 3.34Å; H835-T838 PolarHBondContact O-OG1 2.93Å; T838-L840 PolarHBondContact O-N 2.79Å; T838-A841 PolarHBondContact O-N 3.34Å; T838-E842 PolarHBondContact O-N 3.2Å
839	L	94	Very high	93	Very high	83 Å²	83	91.2 Å²	91.2	44%	0.435	45%	0.453	S	S	.	.	H	α-helix	trans	-55.2	-50.5	173.5	-78.4	167.5	0	0	0	112.1	H835 A841 E842 E843	H835-L839 WeakPolarHBondContact O-CG 3.49Å; H835-L839 PolarHBondContact O-N 2.75Å; L839-A841 VanDerWaalsContact C-N 3.34Å; L839-A841 PolarHBondContact O-N 2.84Å; L839-E842 WeakPolarHBondContact O-CB 3.4Å; L839-E842 PolarHBondContact O-N 3.39Å; L839-E843 WeakPolarHBondContact O-CG 3.41Å; L839-E843 PolarHBondContact O-N 2.79Å
840	L	93.1	Very high	92.9	Very high	84 Å²	84	92 Å²	92	44%	0.44	45%	0.453	S	S	.	.	H	α-helix	trans	-63.7	-37.4	178.6	-71.6	170.5	0	0	0	112.6	R836 T838 E843 E844	R836-L840 HydrophobicContact CG-CD1 4.15Å; R836-L840 VanDerWaalsContact O-CG 3.31Å; R836-L840 WeakPolarHBondContact O-CG 3.5Å; R836-L840 PolarHBondContact O-N 2.86Å; T838-L840 PolarHBondContact O-N 2.79Å; L840-E843 PolarHBondContact O-N 2.87Å; L840-E844 WeakPolarHBondContact O-CB 3.32Å; L840-E844 PolarHBondContact O-N 2.97Å
841	A	92.5	Very high	92.8	Very high	47 Å²	47	96.3 Å²	96.3	39%	0.388	46%	0.463	S	S	.	.	H	α-helix	trans	-67.7	-36.2	176.5	0	0	0	0	0	112.4	R837 T838 L839 N845	R837-A841 WeakPolarHBondContact O-CB 3.34Å; R837-A841 PolarHBondContact O-N 3.08Å; T838-A841 PolarHBondContact O-N 3.34Å; L839-A841 VanDerWaalsContact C-N 3.34Å; L839-A841 PolarHBondContact O-N 2.84Å; A841-N845 WeakPolarHBondContact O-CB 3.49Å; A841-N845 VanDerWaalsContact O-CG 3.25Å; A841-N845 PolarHBondContact O-N 3.26Å; A841-N845 PolarHBondContact O-ND2 3.06Å; A841-N845 VanDerWaalsContact O-ND2 3.07Å
842	E	93.2	Very high	92.6	Very high	102 Å²	102	99.4 Å²	99.4	48%	0.477	47%	0.473	S	S	.	.	H	α-helix	trans	-64.6	-47.4	171.3	-81.9	-166.2	-149.6	0	0	112.2	T838 L839 N845 K846	T838-E842 PolarHBondContact O-N 3.2Å; L839-E842 WeakPolarHBondContact O-CB 3.4Å; L839-E842 PolarHBondContact O-N 3.39Å; E842-N845 PolarHBondContact O-N 3.01Å; E842-K846 WeakPolarHBondContact O-CD 3.37Å; E842-K846 WeakPolarHBondContact O-CG 3.31Å; E842-K846 PolarHBondContact O-N 2.9Å; E842-K846 IonicContact OE2-NZ 2.71Å; E842-K846 PolarHBondContact OE2-NZ 3.31Å
843	E	91.9	Very high	92.5	Very high	107 Å²	107	104.5 Å²	104.5	50%	0.5	48%	0.479	S	S	.	.	H	α-helix	trans	-61.1	-44.4	177.6	-72	-174.6	154.4	0	0	111.7	L839 L840 N845 K846 L847	L839-E843 WeakPolarHBondContact O-CG 3.41Å; L839-E843 PolarHBondContact O-N 2.79Å; L840-E843 PolarHBondContact O-N 2.87Å; E843-N845 VanDerWaalsContact C-N 3.32Å; E843-N845 PolarHBondContact O-N 3.12Å; E843-K846 PolarHBondContact O-N 3.21Å; E843-L847 WeakPolarHBondContact O-CB 3.26Å; E843-L847 WeakPolarHBondContact O-CG 3.3Å; E843-L847 PolarHBondContact O-N 3.22Å
844	E	91.2	Very high	92.5	Very high	94 Å²	94	106.8 Å²	106.8	44%	0.439	49%	0.492	S	S	.	.	H	α-helix	trans	-63.8	-38.5	176.9	-151.1	-151.7	149.1	0	0	111.5	L840 L847 R848	L840-E844 WeakPolarHBondContact O-CB 3.32Å; L840-E844 PolarHBondContact O-N 2.97Å; E844-L847 PolarHBondContact O-N 3.08Å; E844-R848 WeakPolarHBondContact O-CB 3.42Å; E844-R848 WeakPolarHBondContact O-CD 3.33Å; E844-R848 WeakPolarHBondContact O-CG 3.18Å; E844-R848 PolarHBondContact O-N 3.33Å; E844-R848 IonicContact OE1-CZ 3.11Å; E844-R848 IonicContact OE1-NE 2.99Å; E844-R848 PolarHBondContact OE1-NE 2.89Å; E844-R848 IonicContact OE1-NH2 3.65Å; E844-R848 PolarHBondContact OE1-NH2 2.77Å; E844-R848 IonicContact OE2-CZ 3.65Å; E844-R848 VanDerWaalsContact OE2-CZ 3.27Å; E844-R848 IonicContact OE2-NE 2.73Å; E844-R848 IonicContact OE2-NH1 3.57Å; E844-R848 IonicContact OE2-NH2 2.79Å; E844-R848 PolarHBondContact OE2-NH2 3.17Å
845	N	93	Very high	92.4	Very high	75 Å²	75	106.7 Å²	106.7	40%	0.401	50%	0.498	S	S	.	.	H	α-helix	trans	-67	-41.8	175.4	-75.2	-31.8	0	0	0	112.6	A841 E842 E843 L847 R848 E849	A841-N845 WeakPolarHBondContact O-CB 3.49Å; A841-N845 VanDerWaalsContact O-CG 3.25Å; A841-N845 PolarHBondContact O-N 3.26Å; A841-N845 PolarHBondContact O-ND2 3.06Å; A841-N845 VanDerWaalsContact O-ND2 3.07Å; E842-N845 PolarHBondContact O-N 3.01Å; E843-N845 VanDerWaalsContact C-N 3.32Å; E843-N845 PolarHBondContact O-N 3.12Å; N845-L847 VanDerWaalsContact C-N 3.32Å; N845-L847 PolarHBondContact O-N 3.46Å; N845-R848 PolarHBondContact O-N 3.07Å; N845-R848 WeakPolarHBondContact OD1-CD 3.22Å; N845-R848 PolarHBondContact OD1-NH1 2.97Å; N845-E849 PolarHBondContact O-N 3.16Å
846	K	93.7	Very high	92.4	Very high	108 Å²	108	102.9 Å²	102.9	47%	0.47	49%	0.487	S	S	.	.	H	α-helix	trans	-57.9	-44.7	172.6	-68.5	157.9	-167	166.3	0	110.7	E842 E843 E849 Q850	E842-K846 WeakPolarHBondContact O-CD 3.37Å; E842-K846 WeakPolarHBondContact O-CG 3.31Å; E842-K846 PolarHBondContact O-N 2.9Å; E842-K846 IonicContact OE2-NZ 2.71Å; E842-K846 PolarHBondContact OE2-NZ 3.31Å; E843-K846 PolarHBondContact O-N 3.21Å; K846-E849 PolarHBondContact O-N 3.14Å; K846-Q850 WeakPolarHBondContact O-CG 3.45Å; K846-Q850 PolarHBondContact O-N 2.95Å
847	L	92	Very high	92.3	Very high	85 Å²	85	102 Å²	102	45%	0.445	49%	0.491	S	S	.	.	H	α-helix	trans	-67.8	-40.2	176.1	-71.1	168.6	0	0	0	113.2	E843 E844 N845 E849 Q850 R851	E843-L847 WeakPolarHBondContact O-CB 3.26Å; E843-L847 WeakPolarHBondContact O-CG 3.3Å; E843-L847 PolarHBondContact O-N 3.22Å; E844-L847 PolarHBondContact O-N 3.08Å; N845-L847 VanDerWaalsContact C-N 3.32Å; N845-L847 PolarHBondContact O-N 3.46Å; L847-E849 VanDerWaalsContact C-N 3.34Å; L847-E849 PolarHBondContact O-N 3.37Å; L847-Q850 PolarHBondContact O-N 2.81Å; L847-R851 WeakPolarHBondContact O-CB 3.45Å; L847-R851 VanDerWaalsContact O-CG 3.3Å; L847-R851 WeakPolarHBondContact O-CG 3.26Å; L847-R851 PolarHBondContact O-N 2.95Å
848	R	91.6	Very high	92.3	Very high	113 Å²	113	100 Å²	100	43%	0.426	49%	0.488	S	S	.	.	H	α-helix	trans	-61.2	-41.5	174.8	-75.6	160.7	176.5	179.7	-1.4	111.2	E844 N845 K852	E844-R848 WeakPolarHBondContact O-CB 3.42Å; E844-R848 WeakPolarHBondContact O-CD 3.33Å; E844-R848 WeakPolarHBondContact O-CG 3.18Å; E844-R848 PolarHBondContact O-N 3.33Å; E844-R848 IonicContact OE1-CZ 3.11Å; E844-R848 IonicContact OE1-NE 2.99Å; E844-R848 PolarHBondContact OE1-NE 2.89Å; E844-R848 IonicContact OE1-NH2 3.65Å; E844-R848 PolarHBondContact OE1-NH2 2.77Å; E844-R848 IonicContact OE2-CZ 3.65Å; E844-R848 VanDerWaalsContact OE2-CZ 3.27Å; E844-R848 IonicContact OE2-NE 2.73Å; E844-R848 IonicContact OE2-NH1 3.57Å; E844-R848 IonicContact OE2-NH2 2.79Å; E844-R848 PolarHBondContact OE2-NH2 3.17Å; N845-R848 PolarHBondContact O-N 3.07Å; N845-R848 WeakPolarHBondContact OD1-CD 3.22Å; N845-R848 PolarHBondContact OD1-NH1 2.97Å; R848-K852 WeakPolarHBondContact O-CG 3.29Å; R848-K852 PolarHBondContact O-N 2.9Å
849	E	92.6	Very high	92.2	Very high	102 Å²	102	104.9 Å²	104.9	48%	0.477	50%	0.498	S	S	.	.	H	α-helix	trans	-65.9	-46.6	174.8	-79.7	-164.8	-145.2	0	0	112.6	N845 K846 L847 R851 K852 R853	N845-E849 PolarHBondContact O-N 3.16Å; K846-E849 PolarHBondContact O-N 3.14Å; L847-E849 VanDerWaalsContact C-N 3.34Å; L847-E849 PolarHBondContact O-N 3.37Å; E849-R851 VanDerWaalsContact C-N 3.32Å; E849-R851 PolarHBondContact O-N 2.88Å; E849-K852 PolarHBondContact O-N 2.91Å; E849-R853 VanDerWaalsContact O-CG 3.31Å; E849-R853 WeakPolarHBondContact O-CG 3.21Å; E849-R853 PolarHBondContact O-N 2.89Å; E849-R853 IonicContact OE2-CZ 3.56Å; E849-R853 IonicContact OE2-NE 2.72Å; E849-R853 IonicContact OE2-NH2 3.44Å; E849-R853 PolarHBondContact OE2-NH2 3.14Å
850	Q	92.1	Very high	92	Very high	122 Å²	122	107 Å²	107	57%	0.57	51%	0.506	S	S	*	.	H	α-helix	trans	-57.2	-45.9	175.1	-73.1	173	-4.4	0	0	111.4	K846 L847 K852 R853 L854	K846-Q850 WeakPolarHBondContact O-CG 3.45Å; K846-Q850 PolarHBondContact O-N 2.95Å; L847-Q850 PolarHBondContact O-N 2.81Å; Q850-K852 PolarHBondContact O-N 3.32Å; Q850-R853 PolarHBondContact O-N 2.9Å; Q850-L854 WeakPolarHBondContact O-CB 3.33Å; Q850-L854 PolarHBondContact O-N 2.84Å
851	R	91.9	Very high	91.9	Very high	183 Å²	183	106.5 Å²	106.5	69%	0.691	51%	0.506	S	S	*	.	H	α-helix	trans	-61	-41.9	175	-73.4	174.9	179.8	-174.9	1.2	112.5	L847 E849 S855	L847-R851 WeakPolarHBondContact O-CB 3.45Å; L847-R851 VanDerWaalsContact O-CG 3.3Å; L847-R851 WeakPolarHBondContact O-CG 3.26Å; L847-R851 PolarHBondContact O-N 2.95Å; E849-R851 VanDerWaalsContact C-N 3.32Å; E849-R851 PolarHBondContact O-N 2.88Å; R851-S855 WeakPolarHBondContact O-CB 3.49Å; R851-S855 PolarHBondContact O-N 3.33Å; R851-S855 PolarHBondContact O-OG 2.94Å
852	K	90.9	Very high	91.8	Very high	149 Å²	149	110.1 Å²	110.1	65%	0.648	51%	0.513	S	S	*	.	H	α-helix	trans	-60.6	-51.8	174.4	-78.6	176	-179.5	178.9	0	111.4	R848 E849 Q850 L854 S855 A856	R848-K852 WeakPolarHBondContact O-CG 3.29Å; R848-K852 PolarHBondContact O-N 2.9Å; E849-K852 PolarHBondContact O-N 2.91Å; Q850-K852 PolarHBondContact O-N 3.32Å; K852-L854 PolarHBondContact O-N 2.76Å; K852-S855 PolarHBondContact O-N 3.5Å; K852-S855 VanDerWaalsContact O-N 3.15Å; K852-S855 PolarHBondContact O-OG 3.19Å; K852-A856 PolarHBondContact O-N 3.44Å
853	R	92.6	Very high	91.6	Very high	168 Å²	168	110.4 Å²	110.4	63%	0.634	52%	0.517	S	S	*	.	H	α-helix	trans	-58.3	-45.7	178.9	-65.1	172.5	-161.3	-164.8	6.8	111.5	E849 Q850 S855 A856 L857	E849-R853 VanDerWaalsContact O-CG 3.31Å; E849-R853 WeakPolarHBondContact O-CG 3.21Å; E849-R853 PolarHBondContact O-N 2.89Å; E849-R853 IonicContact OE2-CZ 3.56Å; E849-R853 IonicContact OE2-NE 2.72Å; E849-R853 IonicContact OE2-NH2 3.44Å; E849-R853 PolarHBondContact OE2-NH2 3.14Å; Q850-R853 PolarHBondContact O-N 2.9Å; R853-S855 PolarHBondContact O-N 3.05Å; R853-A856 PolarHBondContact O-N 3.11Å; R853-L857 PolarHBondContact O-N 3.06Å; R853-L857 VanDerWaalsContact O-N 3.1Å
854	L	91	Very high	91.4	Very high	108 Å²	108	111 Å²	111	57%	0.565	52%	0.52	S	S	*	.	H	α-helix	trans	-59.9	-45.1	174.5	-169.9	79.9	0	0	0	111.9	Q850 K852 A856 L857 I858	Q850-L854 WeakPolarHBondContact O-CB 3.33Å; Q850-L854 PolarHBondContact O-N 2.84Å; K852-L854 PolarHBondContact O-N 2.76Å; L854-A856 VanDerWaalsContact C-N 3.33Å; L854-A856 PolarHBondContact O-N 3.18Å; L854-L857 PolarHBondContact O-N 3.29Å; L854-I858 HydrophobicContact CD2-CD1 4.19Å; L854-I858 HydrophobicContact CG-CD1 3.86Å; L854-I858 WeakPolarHBondContact O-CB 3.49Å; L854-I858 VanDerWaalsContact O-CG1 3.3Å; L854-I858 WeakPolarHBondContact O-CG1 3.29Å; L854-I858 PolarHBondContact O-N 3.01Å
855	S	91.8	Very high	91.3	Very high	71 Å²	71	112.1 Å²	112.1	50%	0.497	53%	0.525	S	S	.	.	H	α-helix	trans	-67.1	-31.4	-179.5	72.6	0	0	0	0	113.6	R851 K852 R853 R859	R851-S855 WeakPolarHBondContact O-CB 3.49Å; R851-S855 PolarHBondContact O-N 3.33Å; R851-S855 PolarHBondContact O-OG 2.94Å; K852-S855 PolarHBondContact O-N 3.5Å; K852-S855 VanDerWaalsContact O-N 3.15Å; K852-S855 PolarHBondContact O-OG 3.19Å; R853-S855 PolarHBondContact O-N 3.05Å; S855-R859 WeakPolarHBondContact O-CB 3.38Å; S855-R859 PolarHBondContact O-N 3.02Å; S855-R859 VanDerWaalsContact O-N 3.08Å
856	A	91.5	Very high	90.9	Very high	41 Å²	41	114 Å²	114	34%	0.339	53%	0.534	S	S	.	.	H	α-helix	trans	-67.9	-50	172.8	0	0	0	0	0	110.8	K852 R853 L854 I858 R859 E860	K852-A856 PolarHBondContact O-N 3.44Å; R853-A856 PolarHBondContact O-N 3.11Å; L854-A856 VanDerWaalsContact C-N 3.33Å; L854-A856 PolarHBondContact O-N 3.18Å; A856-I858 PolarHBondContact O-N 3.41Å; A856-R859 CarbonylContact O-C 3.59Å; A856-R859 WeakPolarHBondContact O-CA 3.36Å; A856-R859 WeakPolarHBondContact O-CB 3.13Å; A856-R859 PolarHBondContact O-N 3.17Å; A856-E860 WeakPolarHBondContact O-CG 3.41Å; A856-E860 PolarHBondContact O-N 3.05Å
857	L	92	Very high	90.6	Very high	101 Å²	101	111.4 Å²	111.4	53%	0.529	53%	0.53	S	S	.	.	H	α-helix	trans	-59.9	-43.7	177.9	-164.2	161.2	0	0	0	111.7	R853 L854 R859 E860 V861	R853-L857 PolarHBondContact O-N 3.06Å; R853-L857 VanDerWaalsContact O-N 3.1Å; L854-L857 PolarHBondContact O-N 3.29Å; L857-R859 VanDerWaalsContact C-N 3.31Å; L857-R859 PolarHBondContact O-N 3.28Å; L857-E860 PolarHBondContact O-N 3.23Å; L857-V861 HydrophobicContact CD2-CG2 3.98Å; L857-V861 WeakPolarHBondContact O-CG2 3.33Å; L857-V861 PolarHBondContact O-N 2.82Å
858	I	92.2	Very high	90.5	Very high	79 Å²	79	111.5 Å²	111.5	41%	0.405	53%	0.53	S	S	.	.	H	α-helix	trans	-62.3	-37.4	174.3	-69.4	168.1	0	0	0	111.6	L854 A856 K862	L854-I858 HydrophobicContact CD2-CD1 4.19Å; L854-I858 HydrophobicContact CG-CD1 3.86Å; L854-I858 WeakPolarHBondContact O-CB 3.49Å; L854-I858 VanDerWaalsContact O-CG1 3.3Å; L854-I858 WeakPolarHBondContact O-CG1 3.29Å; L854-I858 PolarHBondContact O-N 3.01Å; A856-I858 PolarHBondContact O-N 3.41Å; I858-K862 HydrophobicContact CG2-CD 4.3Å; I858-K862 WeakPolarHBondContact O-CB 3.3Å; I858-K862 WeakPolarHBondContact O-CG 3.41Å; I858-K862 PolarHBondContact O-N 3.47Å; I858-K862 VanDerWaalsContact O-N 3.08Å
859	R	91.6	Very high	90	Very high	181 Å²	181	108.3 Å²	108.3	68%	0.683	53%	0.528	S	S	*	.	H	α-helix	trans	-66.9	-44.3	174.9	171.3	-178.5	-77.3	178.8	-5.3	111.3	S855 A856 L857 K862 L863	S855-R859 WeakPolarHBondContact O-CB 3.38Å; S855-R859 PolarHBondContact O-N 3.02Å; S855-R859 VanDerWaalsContact O-N 3.08Å; A856-R859 CarbonylContact O-C 3.59Å; A856-R859 WeakPolarHBondContact O-CA 3.36Å; A856-R859 WeakPolarHBondContact O-CB 3.13Å; A856-R859 PolarHBondContact O-N 3.17Å; L857-R859 VanDerWaalsContact C-N 3.31Å; L857-R859 PolarHBondContact O-N 3.28Å; R859-K862 PolarHBondContact O-N 3.27Å; R859-L863 HydrophobicContact CG-CD1 3.83Å; R859-L863 HydrophobicContact CG-CG 4.34Å; R859-L863 WeakPolarHBondContact O-CB 3.4Å; R859-L863 VanDerWaalsContact O-CG 3.28Å; R859-L863 WeakPolarHBondContact O-CG 3.38Å; R859-L863 PolarHBondContact O-N 2.86Å
860	E	90	Very high	89.5	Confident	128 Å²	128	108.1 Å²	108.1	60%	0.598	53%	0.527	S	S	*	.	H	α-helix	trans	-62.3	-46.8	178.9	-73.6	164	-170.4	0	0	111.3	A856 L857 K862 L863 H864	A856-E860 WeakPolarHBondContact O-CG 3.41Å; A856-E860 PolarHBondContact O-N 3.05Å; L857-E860 PolarHBondContact O-N 3.23Å; E860-K862 PolarHBondContact O-N 2.88Å; E860-L863 PolarHBondContact O-N 2.89Å; E860-H864 WeakPolarHBondContact O-CB 3.48Å; E860-H864 PolarHBondContact O-N 2.97Å
861	V	90.7	Very high	89.1	Confident	73 Å²	73	107.7 Å²	107.7	44%	0.442	53%	0.525	S	S	.	.	H	α-helix	trans	-58.6	-48.3	174.3	171.6	0	0	0	0	111.2	L857 L863 H864 E865	L857-V861 HydrophobicContact CD2-CG2 3.98Å; L857-V861 WeakPolarHBondContact O-CG2 3.33Å; L857-V861 PolarHBondContact O-N 2.82Å; V861-L863 PolarHBondContact O-N 3.39Å; V861-H864 WeakPolarHBondContact O-CB 3.27Å; V861-H864 PolarHBondContact O-N 3.36Å; V861-H864 VanDerWaalsContact O-N 3.13Å; V861-E865 HydrophobicContact CG1-CG 4.47Å; V861-E865 WeakPolarHBondContact O-CG 3.31Å; V861-E865 PolarHBondContact O-N 2.85Å
862	K	90.7	Very high	88.6	Confident	123 Å²	123	102.4 Å²	102.4	54%	0.535	52%	0.516	S	S	.	.	H	α-helix	trans	-64.7	-35.4	178.7	-76.3	-176	174.7	-169.8	0	113.7	I858 R859 E860 H864 L866	I858-K862 HydrophobicContact CG2-CD 4.3Å; I858-K862 WeakPolarHBondContact O-CB 3.3Å; I858-K862 WeakPolarHBondContact O-CG 3.41Å; I858-K862 PolarHBondContact O-N 3.47Å; I858-K862 VanDerWaalsContact O-N 3.08Å; R859-K862 PolarHBondContact O-N 3.27Å; E860-K862 PolarHBondContact O-N 2.88Å; K862-H864 VanDerWaalsContact C-N 3.33Å; K862-L866 WeakPolarHBondContact O-CB 3.38Å; K862-L866 VanDerWaalsContact O-CG 3.24Å; K862-L866 WeakPolarHBondContact O-CG 3.22Å; K862-L866 PolarHBondContact O-N 2.8Å
863	L	89.2	Confident	88.2	Confident	108 Å²	108	102.6 Å²	102.6	57%	0.565	51%	0.513	S	S	*	.	H	α-helix	trans	-68	-35.7	173.8	-73.6	171.3	0	0	0	111.3	R859 E860 V861 S867	R859-L863 HydrophobicContact CG-CD1 3.83Å; R859-L863 HydrophobicContact CG-CG 4.34Å; R859-L863 WeakPolarHBondContact O-CB 3.4Å; R859-L863 VanDerWaalsContact O-CG 3.28Å; R859-L863 WeakPolarHBondContact O-CG 3.38Å; R859-L863 PolarHBondContact O-N 2.86Å; E860-L863 PolarHBondContact O-N 2.89Å; V861-L863 PolarHBondContact O-N 3.39Å; L863-S867 WeakPolarHBondContact O-CB 3.31Å; L863-S867 PolarHBondContact O-N 3.3Å
864	H	88	Confident	87.6	Confident	120 Å²	120	97.5 Å²	97.5	56%	0.556	50%	0.502	S	S	*	.	H	α-helix	trans	-69.5	-44.6	175.3	-168.5	52.8	0	0	0	112.2	E860 V861 K862 L866 S867 L868	E860-H864 WeakPolarHBondContact O-CB 3.48Å; E860-H864 PolarHBondContact O-N 2.97Å; V861-H864 WeakPolarHBondContact O-CB 3.27Å; V861-H864 PolarHBondContact O-N 3.36Å; V861-H864 VanDerWaalsContact O-N 3.13Å; K862-H864 VanDerWaalsContact C-N 3.33Å; H864-L866 VanDerWaalsContact C-N 3.31Å; H864-L866 PolarHBondContact O-N 3.34Å; H864-S867 WeakPolarHBondContact O-CB 3.39Å; H864-S867 PolarHBondContact O-N 2.85Å; H864-L868 WeakPolarHBondContact O-CG 3.07Å; H864-L868 PolarHBondContact O-N 3.37Å
865	E	87.8	Confident	87.1	Confident	117 Å²	117	97.6 Å²	97.6	55%	0.547	50%	0.5	S	S	.	.	H	α-helix	trans	-55.1	-45.8	171.5	-72.1	178.5	139.8	0	0	111.7	V861 L868 A869	V861-E865 HydrophobicContact CG1-CG 4.47Å; V861-E865 WeakPolarHBondContact O-CG 3.31Å; V861-E865 PolarHBondContact O-N 2.85Å; E865-L868 PolarHBondContact O-N 3.08Å; E865-A869 WeakPolarHBondContact O-CB 3.44Å; E865-A869 PolarHBondContact O-N 3.32Å
866	L	84.6	Confident	86.6	Confident	115 Å²	115	101.2 Å²	101.2	60%	0.602	51%	0.506	S	S	*	.	H	α-helix	trans	-65.9	-38.5	176.9	-73.1	169.7	0	0	0	112.5	K862 H864 A869 E870	K862-L866 WeakPolarHBondContact O-CB 3.38Å; K862-L866 VanDerWaalsContact O-CG 3.24Å; K862-L866 WeakPolarHBondContact O-CG 3.22Å; K862-L866 PolarHBondContact O-N 2.8Å; H864-L866 VanDerWaalsContact C-N 3.31Å; H864-L866 PolarHBondContact O-N 3.34Å; L866-A869 PolarHBondContact O-N 3.13Å; L866-E870 WeakPolarHBondContact O-CB 3.47Å; L866-E870 PolarHBondContact O-N 3.38Å
867	S	88.3	Confident	86.2	Confident	53 Å²	53	107.9 Å²	107.9	37%	0.371	52%	0.523	S	S	.	.	H	α-helix	trans	-61	-48.6	175	-161.6	0	0	0	0	111.1	L863 H864 A869 E870 E871	L863-S867 WeakPolarHBondContact O-CB 3.31Å; L863-S867 PolarHBondContact O-N 3.3Å; H864-S867 WeakPolarHBondContact O-CB 3.39Å; H864-S867 PolarHBondContact O-N 2.85Å; S867-A869 VanDerWaalsContact C-N 3.31Å; S867-A869 PolarHBondContact O-N 3.32Å; S867-E870 PolarHBondContact O-N 2.93Å; S867-E871 WeakPolarHBondContact O-CB 3.46Å; S867-E871 WeakPolarHBondContact O-CG 3.43Å; S867-E871 PolarHBondContact O-N 2.97Å; S867-E871 PolarHBondContact OG-OE1 2.89Å; S867-E871 VanDerWaalsContact OG-OE1 3.09Å
868	L	89.2	Confident	85.7	Confident	86 Å²	86	108 Å²	108	45%	0.45	52%	0.521	S	S	.	.	H	α-helix	trans	-63.8	-35.2	178.1	-65.5	169.5	0	0	0	112.1	H864 E865 S872	H864-L868 WeakPolarHBondContact O-CG 3.07Å; H864-L868 PolarHBondContact O-N 3.37Å; E865-L868 PolarHBondContact O-N 3.08Å; L868-S872 WeakPolarHBondContact O-CB 3.06Å; L868-S872 PolarHBondContact O-N 2.84Å; L868-S872 PolarHBondContact O-OG 2.86Å
869	A	81.5	Confident	85.4	Confident	46 Å²	46	108.3 Å²	108.3	38%	0.38	52%	0.523	S	S	.	.	H	α-helix	trans	-70.4	-36.1	174.1	0	0	0	0	0	113.2	E865 L866 S867 S872 R873	E865-A869 WeakPolarHBondContact O-CB 3.44Å; E865-A869 PolarHBondContact O-N 3.32Å; L866-A869 PolarHBondContact O-N 3.13Å; S867-A869 VanDerWaalsContact C-N 3.31Å; S867-A869 PolarHBondContact O-N 3.32Å; A869-S872 WeakPolarHBondContact CA-OG 3.27Å; A869-S872 PolarHBondContact O-OG 3.47Å; A869-S872 VanDerWaalsContact O-OG 3.13Å; A869-R873 WeakPolarHBondContact O-CB 3.39Å; A869-R873 PolarHBondContact O-N 2.73Å
870	E	83.1	Confident	85	Confident	98 Å²	98	102 Å²	102	46%	0.458	50%	0.503	S	S	.	.	H	α-helix	trans	-72.8	-42.3	174.6	-163.9	89.4	-110.6	0	0	111.1	L866 S867 R873 C874	L866-E870 WeakPolarHBondContact O-CB 3.47Å; L866-E870 PolarHBondContact O-N 3.38Å; S867-E870 PolarHBondContact O-N 2.93Å; E870-R873 PolarHBondContact O-N 3.2Å; E870-R873 IonicContact OE1-CZ 2.61Å; E870-R873 IonicContact OE1-NH1 3.14Å; E870-R873 PolarHBondContact OE1-NH1 2.81Å; E870-R873 IonicContact OE1-NH2 3.84Å; E870-R873 PolarHBondContact OE1-NH2 3.5Å; E870-R873 IonicContact OE2-NH1 3.85Å; E870-C874 WeakPolarHBondContact O-CB 3.32Å; E870-C874 PolarHBondContact O-N 3.08Å; E870-C874 PolarHBondContact O-SG 3.46Å; E870-C874 VanDerWaalsContact O-SG 3.38Å
871	E	83.3	Confident	84.7	Confident	114 Å²	114	99.9 Å²	99.9	53%	0.533	49%	0.494	S	S	.	.	H	α-helix	trans	-60.4	-47.9	175.6	-78.2	169.8	-144.4	0	0	111.7	S867 C874 H875	S867-E871 WeakPolarHBondContact O-CB 3.46Å; S867-E871 WeakPolarHBondContact O-CG 3.43Å; S867-E871 PolarHBondContact O-N 2.97Å; S867-E871 PolarHBondContact OG-OE1 2.89Å; S867-E871 VanDerWaalsContact OG-OE1 3.09Å; E871-C874 PolarHBondContact O-N 3.35Å; E871-H875 WeakPolarHBondContact O-CB 3.36Å; E871-H875 PolarHBondContact O-N 2.99Å
872	S	80.5	Confident	84.4	Confident	72 Å²	72	103.4 Å²	103.4	50%	0.503	50%	0.5	S	S	.	.	H	α-helix	trans	-64.4	-39.9	177.1	54.5	0	0	0	0	112.5	L868 A869 H875 F876	L868-S872 WeakPolarHBondContact O-CB 3.06Å; L868-S872 PolarHBondContact O-N 2.84Å; L868-S872 PolarHBondContact O-OG 2.86Å; A869-S872 WeakPolarHBondContact CA-OG 3.27Å; A869-S872 PolarHBondContact O-OG 3.47Å; A869-S872 VanDerWaalsContact O-OG 3.13Å; S872-H875 PolarHBondContact O-N 3.2Å; S872-F876 WeakPolarHBondContact O-CB 3.33Å; S872-F876 PolarHBondContact O-N 3.24Å
873	R	82.9	Confident	84	Confident	152 Å²	152	104.7 Å²	104.7	57%	0.574	50%	0.501	S	S	*	.	H	α-helix	trans	-61.8	-43.2	170.7	-94.4	175.8	49.4	-108.3	-10.8	112.5	A869 E870 R877	A869-R873 WeakPolarHBondContact O-CB 3.39Å; A869-R873 PolarHBondContact O-N 2.73Å; E870-R873 PolarHBondContact O-N 3.2Å; E870-R873 IonicContact OE1-CZ 2.61Å; E870-R873 IonicContact OE1-NH1 3.14Å; E870-R873 PolarHBondContact OE1-NH1 2.81Å; E870-R873 IonicContact OE1-NH2 3.84Å; E870-R873 PolarHBondContact OE1-NH2 3.5Å; E870-R873 IonicContact OE2-NH1 3.85Å; R873-R877 WeakPolarHBondContact O-CB 3.36Å; R873-R877 PolarHBondContact O-N 2.81Å
874	C	79.7	Confident	83.7	Confident	61 Å²	61	106.5 Å²	106.5	41%	0.412	50%	0.501	S	S	.	.	H	α-helix	trans	-65.7	-42.7	177.5	-79.4	0	0	0	0	112	E870 E871 R877 Q878	E870-C874 WeakPolarHBondContact O-CB 3.32Å; E870-C874 PolarHBondContact O-N 3.08Å; E870-C874 PolarHBondContact O-SG 3.46Å; E870-C874 VanDerWaalsContact O-SG 3.38Å; E871-C874 PolarHBondContact O-N 3.35Å; C874-R877 PolarHBondContact O-N 3.15Å; C874-Q878 WeakPolarHBondContact O-CG 3.47Å; C874-Q878 PolarHBondContact O-N 2.84Å
875	H	80.9	Confident	83.5	Confident	111 Å²	111	105.9 Å²	105.9	51%	0.514	50%	0.498	S	S	.	.	H	α-helix	trans	-64.2	-45.8	176.6	-171.7	-100.5	0	0	0	111.6	E871 S872 R877 Q878 L879	E871-H875 WeakPolarHBondContact O-CB 3.36Å; E871-H875 PolarHBondContact O-N 2.99Å; S872-H875 PolarHBondContact O-N 3.2Å; H875-R877 VanDerWaalsContact C-N 3.33Å; H875-R877 PolarHBondContact O-N 2.8Å; H875-Q878 PolarHBondContact O-N 2.77Å; H875-L879 WeakPolarHBondContact O-CG 3.19Å; H875-L879 PolarHBondContact O-N 3Å
876	F	81.8	Confident	83.4	Confident	146 Å²	146	104 Å²	104	64%	0.64	50%	0.497	S	S	*	.	H	α-helix	trans	-58.1	-44.7	173.9	-175.1	-93.6	0	0	0	111.7	S872 Q878 L879 D880	S872-F876 WeakPolarHBondContact O-CB 3.33Å; S872-F876 PolarHBondContact O-N 3.24Å; F876-Q878 PolarHBondContact O-N 2.82Å; F876-L879 PolarHBondContact O-N 3.25Å; F876-D880 PolarHBondContact O-N 3.19Å
877	R	83	Confident	83.4	Confident	181 Å²	181	102.2 Å²	102.2	68%	0.683	49%	0.486	S	S	*	.	H	α-helix	trans	-63	-37.7	176.6	-168.3	178.1	-172.8	179.4	3	112.7	R873 C874 H875 I881	R873-R877 WeakPolarHBondContact O-CB 3.36Å; R873-R877 PolarHBondContact O-N 2.81Å; C874-R877 PolarHBondContact O-N 3.15Å; H875-R877 VanDerWaalsContact C-N 3.33Å; H875-R877 PolarHBondContact O-N 2.8Å; R877-I881 HydrophobicContact CG-CD1 4.15Å; R877-I881 WeakPolarHBondContact O-CB 3.49Å; R877-I881 WeakPolarHBondContact O-CD1 3.35Å; R877-I881 VanDerWaalsContact O-CG1 3.24Å; R877-I881 WeakPolarHBondContact O-CG1 3.22Å; R877-I881 PolarHBondContact O-N 3.22Å
878	Q	81.6	Confident	83.1	Confident	105 Å²	105	105 Å²	105	49%	0.491	50%	0.495	S	S	.	.	H	α-helix	trans	-68.3	-39.7	174.7	-75.1	-176	13.4	0	0	112.5	C874 H875 F876 I881 R882	C874-Q878 WeakPolarHBondContact O-CG 3.47Å; C874-Q878 PolarHBondContact O-N 2.84Å; H875-Q878 PolarHBondContact O-N 2.77Å; F876-Q878 PolarHBondContact O-N 2.82Å; Q878-I881 PolarHBondContact O-N 2.82Å; Q878-R882 WeakPolarHBondContact O-CB 3.41Å; Q878-R882 WeakPolarHBondContact O-CG 3.22Å; Q878-R882 PolarHBondContact O-N 3.3Å
879	L	85.8	Confident	82.8	Confident	85 Å²	85	105 Å²	105	45%	0.445	50%	0.496	S	S	.	.	H	α-helix	trans	-62.1	-44.3	174.4	-71	175.9	0	0	0	111.5	H875 F876 R882 R883	H875-L879 WeakPolarHBondContact O-CG 3.19Å; H875-L879 PolarHBondContact O-N 3Å; F876-L879 PolarHBondContact O-N 3.25Å; L879-R882 PolarHBondContact O-N 3.18Å; L879-R883 WeakPolarHBondContact O-CB 3.09Å; L879-R883 PolarHBondContact O-N 2.94Å
880	D	83.6	Confident	83	Confident	49 Å²	49	109.3 Å²	109.3	26%	0.262	51%	0.506	S	S	.	.	H	α-helix	trans	-69.4	-35.2	-179.6	-164.7	46	0	0	0	112.4	F876 R884	F876-D880 PolarHBondContact O-N 3.19Å; D880-R884 VanDerWaalsContact O-CG 3.27Å; D880-R884 WeakPolarHBondContact O-CG 3.31Å; D880-R884 PolarHBondContact O-N 2.95Å; D880-R884 VanDerWaalsContact O-N 3.17Å; D880-R884 IonicContact OD1-NE 3.44Å; D880-R884 IonicContact OD2-CZ 3.98Å; D880-R884 VanDerWaalsContact OD2-CZ 3.29Å; D880-R884 IonicContact OD2-NE 3.03Å; D880-R884 PolarHBondContact OD2-NE 3.41Å; D880-R884 IonicContact OD2-NH2 3.76Å; D880-R884 PolarHBondContact OD2-NH2 3.1Å
881	I	82.4	Confident	83.1	Confident	82 Å²	82	109.3 Å²	109.3	42%	0.421	51%	0.509	S	S	.	.	H	α-helix	trans	-64.2	-48.3	169.5	-70.6	165.7	0	0	0	111.1	R877 Q878 R883 R884 Q885	R877-I881 HydrophobicContact CG-CD1 4.15Å; R877-I881 WeakPolarHBondContact O-CB 3.49Å; R877-I881 WeakPolarHBondContact O-CD1 3.35Å; R877-I881 VanDerWaalsContact O-CG1 3.24Å; R877-I881 WeakPolarHBondContact O-CG1 3.22Å; R877-I881 PolarHBondContact O-N 3.22Å; Q878-I881 PolarHBondContact O-N 2.82Å; I881-R883 VanDerWaalsContact C-N 3.31Å; I881-R883 PolarHBondContact O-N 3.05Å; I881-R884 PolarHBondContact O-N 3.1Å; I881-Q885 HydrophobicContact CG2-CG 4.49Å; I881-Q885 WeakPolarHBondContact O-CG 3.48Å; I881-Q885 PolarHBondContact O-N 3.33Å
882	R	84.1	Confident	83	Confident	147 Å²	147	109.7 Å²	109.7	56%	0.555	51%	0.511	S	S	*	.	H	α-helix	trans	-59.9	-40.9	177.4	-81	-176.9	-179.2	153.9	2.9	112	Q878 L879 Q885 C886	Q878-R882 WeakPolarHBondContact O-CB 3.41Å; Q878-R882 WeakPolarHBondContact O-CG 3.22Å; Q878-R882 PolarHBondContact O-N 3.3Å; L879-R882 PolarHBondContact O-N 3.18Å; R882-Q885 PolarHBondContact O-N 2.9Å; R882-C886 PolarHBondContact O-N 2.85Å; R882-C886 PolarHBondContact O-SG 3.18Å; R882-C886 VanDerWaalsContact O-SG 3.39Å
883	R	83.8	Confident	83	Confident	151 Å²	151	112.7 Å²	112.7	57%	0.57	52%	0.517	S	S	*	.	H	α-helix	trans	-59	-50.1	177.3	-178.8	177.7	170.5	-137.7	-14.9	110.8	L879 I881 Q885 C886 E887	L879-R883 WeakPolarHBondContact O-CB 3.09Å; L879-R883 PolarHBondContact O-N 2.94Å; I881-R883 VanDerWaalsContact C-N 3.31Å; I881-R883 PolarHBondContact O-N 3.05Å; R883-Q885 VanDerWaalsContact C-N 3.32Å; R883-Q885 PolarHBondContact O-N 2.93Å; R883-C886 PolarHBondContact O-N 3.45Å; R883-E887 IonicContact CZ-OE1 3.27Å; R883-E887 IonicContact NE-OE1 2.71Å; R883-E887 PolarHBondContact NE-OE1 3.18Å; R883-E887 IonicContact NE-OE2 2.77Å; R883-E887 IonicContact NH2-OE1 3.66Å; R883-E887 PolarHBondContact NH2-OE1 3.5Å; R883-E887 IonicContact NH2-OE2 2.61Å; R883-E887 WeakPolarHBondContact O-CG 3.41Å; R883-E887 PolarHBondContact O-N 2.88Å
884	R	83.1	Confident	83.1	Confident	146 Å²	146	111.2 Å²	111.2	55%	0.551	52%	0.516	S	S	*	.	H	α-helix	trans	-62.3	-37.3	177.2	-64.7	168.5	-163.1	-147.3	4.9	112.1	D880 I881 E887 L888	D880-R884 VanDerWaalsContact O-CG 3.27Å; D880-R884 WeakPolarHBondContact O-CG 3.31Å; D880-R884 PolarHBondContact O-N 2.95Å; D880-R884 VanDerWaalsContact O-N 3.17Å; D880-R884 IonicContact OD1-NE 3.44Å; D880-R884 IonicContact OD2-CZ 3.98Å; D880-R884 VanDerWaalsContact OD2-CZ 3.29Å; D880-R884 IonicContact OD2-NE 3.03Å; D880-R884 PolarHBondContact OD2-NE 3.41Å; D880-R884 IonicContact OD2-NH2 3.76Å; D880-R884 PolarHBondContact OD2-NH2 3.1Å; I881-R884 PolarHBondContact O-N 3.1Å; R884-E887 PolarHBondContact O-N 3.2Å; R884-L888 WeakPolarHBondContact O-CB 3.28Å; R884-L888 VanDerWaalsContact O-CG 3.29Å; R884-L888 WeakPolarHBondContact O-CG 3.44Å; R884-L888 PolarHBondContact O-N 2.91Å
885	Q	82.9	Confident	82.9	Confident	106 Å²	106	113.7 Å²	113.7	50%	0.495	53%	0.525	S	S	.	.	H	α-helix	trans	-64.1	-44.8	172.8	-73.5	175.4	-36.8	0	0	111.9	I881 R882 R883 E887 L888 N889	I881-Q885 HydrophobicContact CG2-CG 4.49Å; I881-Q885 WeakPolarHBondContact O-CG 3.48Å; I881-Q885 PolarHBondContact O-N 3.33Å; R882-Q885 PolarHBondContact O-N 2.9Å; R883-Q885 VanDerWaalsContact C-N 3.32Å; R883-Q885 PolarHBondContact O-N 2.93Å; Q885-E887 VanDerWaalsContact C-N 3.29Å; Q885-E887 PolarHBondContact O-N 3.38Å; Q885-L888 PolarHBondContact O-N 3.33Å; Q885-N889 WeakPolarHBondContact O-CB 3.37Å; Q885-N889 VanDerWaalsContact O-CG 3.22Å; Q885-N889 PolarHBondContact O-N 2.86Å; Q885-N889 PolarHBondContact O-OD1 3.23Å
886	C	86	Confident	82.9	Confident	78 Å²	78	111.8 Å²	111.8	53%	0.527	52%	0.521	S	S	.	.	H	α-helix	trans	-65.4	-31.4	175.4	-68.9	0	0	0	0	113.1	R882 R883 K890	R882-C886 PolarHBondContact O-N 2.85Å; R882-C886 PolarHBondContact O-SG 3.18Å; R882-C886 VanDerWaalsContact O-SG 3.39Å; R883-C886 PolarHBondContact O-N 3.45Å; C886-K890 VanDerWaalsContact O-CG 3.32Å; C886-K890 WeakPolarHBondContact O-CG 3.49Å; C886-K890 PolarHBondContact O-N 3.33Å
887	E	84.8	Confident	82.8	Confident	78 Å²	78	114.3 Å²	114.3	36%	0.364	53%	0.527	S	S	.	.	H	α-helix	trans	-73.2	-41.3	174.6	-72.7	166.9	171	0	0	111.5	R883 R884 Q885 K890 L891	R883-E887 IonicContact CZ-OE1 3.27Å; R883-E887 IonicContact NE-OE1 2.71Å; R883-E887 PolarHBondContact NE-OE1 3.18Å; R883-E887 IonicContact NE-OE2 2.77Å; R883-E887 IonicContact NH2-OE1 3.66Å; R883-E887 PolarHBondContact NH2-OE1 3.5Å; R883-E887 IonicContact NH2-OE2 2.61Å; R883-E887 WeakPolarHBondContact O-CG 3.41Å; R883-E887 PolarHBondContact O-N 2.88Å; R884-E887 PolarHBondContact O-N 3.2Å; Q885-E887 VanDerWaalsContact C-N 3.29Å; Q885-E887 PolarHBondContact O-N 3.38Å; E887-K890 PolarHBondContact O-N 3.33Å; E887-L891 WeakPolarHBondContact O-CG 3.16Å; E887-L891 PolarHBondContact O-N 2.82Å; E887-L891 VanDerWaalsContact O-N 3.1Å
888	L	80.7	Confident	82.7	Confident	110 Å²	110	111.1 Å²	111.1	58%	0.576	52%	0.522	S	S	*	.	H	α-helix	trans	-62.5	-47.9	171.9	-74.9	167.9	0	0	0	112.3	R884 Q885 K890 L891 E892	R884-L888 WeakPolarHBondContact O-CB 3.28Å; R884-L888 VanDerWaalsContact O-CG 3.29Å; R884-L888 WeakPolarHBondContact O-CG 3.44Å; R884-L888 PolarHBondContact O-N 2.91Å; Q885-L888 PolarHBondContact O-N 3.33Å; L888-K890 PolarHBondContact O-N 2.92Å; L888-L891 PolarHBondContact O-N 3.49Å; L888-L891 VanDerWaalsContact O-N 3.09Å; L888-E892 WeakPolarHBondContact O-CB 3.46Å; L888-E892 PolarHBondContact O-N 3.22Å
889	N	84.4	Confident	82.5	Confident	86 Å²	86	109.6 Å²	109.6	46%	0.46	52%	0.52	S	S	.	.	H	α-helix	trans	-62.3	-30.2	179	-69.8	24.5	0	0	0	112.2	Q885 Q893	Q885-N889 WeakPolarHBondContact O-CB 3.37Å; Q885-N889 VanDerWaalsContact O-CG 3.22Å; Q885-N889 PolarHBondContact O-N 2.86Å; Q885-N889 PolarHBondContact O-OD1 3.23Å; N889-Q893 WeakPolarHBondContact O-CB 3.45Å; N889-Q893 VanDerWaalsContact O-CG 3.25Å; N889-Q893 WeakPolarHBondContact O-CG 3.43Å; N889-Q893 PolarHBondContact O-N 3.34Å
890	K	85.4	Confident	82.2	Confident	138 Å²	138	109.9 Å²	109.9	60%	0.6	52%	0.522	S	S	*	.	H	α-helix	trans	-68.9	-46.9	171.6	-79.8	176.4	177.3	-173.7	0	111.7	C886 E887 L888 E892 Q893 E894	C886-K890 VanDerWaalsContact O-CG 3.32Å; C886-K890 WeakPolarHBondContact O-CG 3.49Å; C886-K890 PolarHBondContact O-N 3.33Å; E887-K890 PolarHBondContact O-N 3.33Å; L888-K890 PolarHBondContact O-N 2.92Å; K890-E892 VanDerWaalsContact C-N 3.26Å; K890-E892 PolarHBondContact O-N 3.1Å; K890-Q893 PolarHBondContact O-N 3.39Å; K890-Q893 VanDerWaalsContact O-N 3.16Å; K890-E894 PolarHBondContact O-N 2.9Å
891	L	83.8	Confident	82	Confident	98 Å²	98	110.5 Å²	110.5	51%	0.513	53%	0.53	S	S	.	.	H	α-helix	trans	-62.9	-34.3	176.6	-69.9	166.7	0	0	0	111.8	E887 L888 E894 L895	E887-L891 WeakPolarHBondContact O-CG 3.16Å; E887-L891 PolarHBondContact O-N 2.82Å; E887-L891 VanDerWaalsContact O-N 3.1Å; L888-L891 PolarHBondContact O-N 3.49Å; L888-L891 VanDerWaalsContact O-N 3.09Å; L891-E894 PolarHBondContact O-N 3.16Å; L891-L895 VanDerWaalsContact O-CB 3.28Å; L891-L895 WeakPolarHBondContact O-CB 3.5Å; L891-L895 VanDerWaalsContact O-CG 3.3Å; L891-L895 WeakPolarHBondContact O-CG 3.3Å; L891-L895 PolarHBondContact O-N 3.35Å
892	E	82.1	Confident	81.7	Confident	121 Å²	121	114.3 Å²	114.3	57%	0.565	54%	0.539	S	S	*	.	H	α-helix	trans	-68.8	-38.2	173.2	-172.2	173.3	-140.6	0	0	112.1	L888 K890 T896	L888-E892 WeakPolarHBondContact O-CB 3.46Å; L888-E892 PolarHBondContact O-N 3.22Å; K890-E892 VanDerWaalsContact C-N 3.26Å; K890-E892 PolarHBondContact O-N 3.1Å; E892-T896 WeakPolarHBondContact O-CB 3.4Å; E892-T896 WeakPolarHBondContact O-CG2 3.45Å; E892-T896 PolarHBondContact O-N 3.48Å; E892-T896 PolarHBondContact O-OG1 2.75Å
893	Q	80.6	Confident	81.4	Confident	135 Å²	135	111.4 Å²	111.4	63%	0.631	53%	0.533	S	S	*	.	H	α-helix	trans	-68.4	-36.7	171.9	-75.8	173.7	6.1	0	0	112.7	N889 K890 T896 R897	N889-Q893 WeakPolarHBondContact O-CB 3.45Å; N889-Q893 VanDerWaalsContact O-CG 3.25Å; N889-Q893 WeakPolarHBondContact O-CG 3.43Å; N889-Q893 PolarHBondContact O-N 3.34Å; K890-Q893 PolarHBondContact O-N 3.39Å; K890-Q893 VanDerWaalsContact O-N 3.16Å; Q893-T896 WeakPolarHBondContact CA-OG1 3.34Å; Q893-T896 PolarHBondContact O-OG1 3.03Å; Q893-R897 WeakPolarHBondContact O-CB 3.35Å; Q893-R897 PolarHBondContact O-N 2.62Å
894	E	84.1	Confident	81	Confident	122 Å²	122	109.2 Å²	109.2	57%	0.57	53%	0.533	S	S	*	.	H	α-helix	trans	-70	-41.1	173.5	-73.2	-176.8	154.3	0	0	111.6	K890 L891 R897 L898	K890-E894 PolarHBondContact O-N 2.9Å; L891-E894 PolarHBondContact O-N 3.16Å; E894-R897 PolarHBondContact O-N 3.32Å; E894-L898 VanDerWaalsContact O-CB 3.3Å; E894-L898 WeakPolarHBondContact O-CB 3.47Å; E894-L898 WeakPolarHBondContact O-CG 3.05Å; E894-L898 PolarHBondContact O-N 2.85Å
895	L	76.4	Confident	80.7	Confident	113 Å²	113	106.9 Å²	106.9	59%	0.592	53%	0.528	S	S	*	.	H	α-helix	trans	-62.3	-49.4	173.9	-82.7	166.5	0	0	0	111.8	L891 R897 L898 T899	L891-L895 VanDerWaalsContact O-CB 3.28Å; L891-L895 WeakPolarHBondContact O-CB 3.5Å; L891-L895 VanDerWaalsContact O-CG 3.3Å; L891-L895 WeakPolarHBondContact O-CG 3.3Å; L891-L895 PolarHBondContact O-N 3.35Å; L895-R897 VanDerWaalsContact C-N 3.34Å; L895-R897 PolarHBondContact O-N 2.81Å; L895-L898 CarbonylContact O-C 3.59Å; L895-L898 PolarHBondContact O-N 3.06Å; L895-L898 VanDerWaalsContact O-N 3.15Å; L895-T899 WeakPolarHBondContact O-CG2 3.23Å; L895-T899 PolarHBondContact O-N 3.11Å; L895-T899 PolarHBondContact O-OG1 2.96Å
896	T	80.7	Confident	80.4	Confident	71 Å²	71	106.9 Å²	106.9	44%	0.436	53%	0.531	S	S	.	.	H	α-helix	trans	-65.3	-36.5	178.6	47.3	0	0	0	0	112.3	E892 Q893 T899 N900	E892-T896 WeakPolarHBondContact O-CB 3.4Å; E892-T896 WeakPolarHBondContact O-CG2 3.45Å; E892-T896 PolarHBondContact O-N 3.48Å; E892-T896 PolarHBondContact O-OG1 2.75Å; Q893-T896 WeakPolarHBondContact CA-OG1 3.34Å; Q893-T896 PolarHBondContact O-OG1 3.03Å; T896-T899 WeakPolarHBondContact CA-OG1 3.38Å; T896-T899 PolarHBondContact O-OG1 3.27Å; T896-N900 WeakPolarHBondContact O-CB 3.41Å; T896-N900 PolarHBondContact O-N 2.86Å; T896-N900 PolarHBondContact O-OD1 3.48Å
897	R	79.7	Confident	79.9	Confident	199 Å²	199	107.4 Å²	107.4	75%	0.751	53%	0.528	S	S	*	.	H	α-helix	trans	-63.2	-43.2	170.2	179.9	178.8	171.3	-179.5	-3.3	112	Q893 E894 L895 N900 C901	Q893-R897 WeakPolarHBondContact O-CB 3.35Å; Q893-R897 PolarHBondContact O-N 2.62Å; E894-R897 PolarHBondContact O-N 3.32Å; L895-R897 VanDerWaalsContact C-N 3.34Å; L895-R897 PolarHBondContact O-N 2.81Å; R897-N900 PolarHBondContact O-N 3.29Å; R897-C901 VanDerWaalsContact O-CB 3.31Å; R897-C901 WeakPolarHBondContact O-CB 3.33Å; R897-C901 PolarHBondContact O-N 2.75Å
898	L	81.4	Confident	79.4	Confident	114 Å²	114	107.1 Å²	107.1	60%	0.597	53%	0.534	S	S	*	.	H	α-helix	trans	-66.1	-40.9	177.7	-83.7	163.1	0	0	0	112	E894 L895 R902	E894-L898 VanDerWaalsContact O-CB 3.3Å; E894-L898 WeakPolarHBondContact O-CB 3.47Å; E894-L898 WeakPolarHBondContact O-CG 3.05Å; E894-L898 PolarHBondContact O-N 2.85Å; L895-L898 CarbonylContact O-C 3.59Å; L895-L898 PolarHBondContact O-N 3.06Å; L895-L898 VanDerWaalsContact O-N 3.15Å; L898-R902 WeakPolarHBondContact O-CB 3.31Å; L898-R902 PolarHBondContact O-N 3.43Å
899	T	76.9	Confident	79	Confident	72 Å²	72	104.7 Å²	104.7	44%	0.442	53%	0.53	S	S	.	.	H	α-helix	trans	-66.4	-40.4	175.9	53.2	0	0	0	0	111.9	L895 T896 R902 I903	L895-T899 WeakPolarHBondContact O-CG2 3.23Å; L895-T899 PolarHBondContact O-N 3.11Å; L895-T899 PolarHBondContact O-OG1 2.96Å; T896-T899 WeakPolarHBondContact CA-OG1 3.38Å; T896-T899 PolarHBondContact O-OG1 3.27Å; T899-R902 WeakPolarHBondContact O-CB 3.3Å; T899-R902 PolarHBondContact O-N 2.65Å; T899-I903 VanDerWaalsContact O-CG1 3.32Å; T899-I903 WeakPolarHBondContact O-CG1 3.21Å; T899-I903 PolarHBondContact O-N 3.4Å
900	N	79	Confident	78.4	Confident	91 Å²	91	103 Å²	103	49%	0.487	53%	0.528	S	S	.	.	H	α-helix	trans	-65	-47	177.3	-68.2	7.8	0	0	0	110.7	T896 R897 R902 I903 D904	T896-N900 WeakPolarHBondContact O-CB 3.41Å; T896-N900 PolarHBondContact O-N 2.86Å; T896-N900 PolarHBondContact O-OD1 3.48Å; R897-N900 PolarHBondContact O-N 3.29Å; N900-R902 PolarHBondContact O-N 2.91Å; N900-I903 CarbonylContact O-C 3.47Å; N900-I903 WeakPolarHBondContact O-CA 3.35Å; N900-I903 WeakPolarHBondContact O-CB 3.44Å; N900-I903 PolarHBondContact O-N 3.35Å; N900-D904 VanDerWaalsContact O-CG 3.28Å; N900-D904 PolarHBondContact O-N 3.22Å
901	C	79.1	Confident	77.9	Confident	62 Å²	62	104.1 Å²	104.1	42%	0.419	53%	0.53	S	S	.	.	H	α-helix	trans	-56.9	-35.7	173.3	-164.6	0	0	0	0	112	R897 E905	R897-C901 VanDerWaalsContact O-CB 3.31Å; R897-C901 WeakPolarHBondContact O-CB 3.33Å; R897-C901 PolarHBondContact O-N 2.75Å; C901-E905 WeakPolarHBondContact O-CB 3.48Å; C901-E905 VanDerWaalsContact O-CG 3.25Å; C901-E905 WeakPolarHBondContact O-CG 3.36Å; C901-E905 PolarHBondContact O-N 3.48Å
902	R	77.3	Confident	77.3	Confident	163 Å²	163	102.2 Å²	102.2	62%	0.615	53%	0.529	S	S	*	.	H	α-helix	trans	-68.5	-33.5	174.4	-145.3	71.6	167.8	-172.5	-3.9	113.4	L898 T899 N900 E905 I906	L898-R902 WeakPolarHBondContact O-CB 3.31Å; L898-R902 PolarHBondContact O-N 3.43Å; T899-R902 WeakPolarHBondContact O-CB 3.3Å; T899-R902 PolarHBondContact O-N 2.65Å; N900-R902 PolarHBondContact O-N 2.91Å; R902-E905 WeakPolarHBondContact CD-OE2 3.4Å; R902-E905 IonicContact NE-OE2 2.61Å; R902-E905 IonicContact NH1-OE2 3.66Å; R902-I906 WeakPolarHBondContact O-CD1 3.44Å; R902-I906 VanDerWaalsContact O-CG1 3.22Å; R902-I906 WeakPolarHBondContact O-CG1 3.47Å; R902-I906 PolarHBondContact O-N 2.82Å
903	I	77.1	Confident	76.6	Confident	86 Å²	86	99.4 Å²	99.4	44%	0.441	53%	0.526	S	S	.	.	H	α-helix	trans	-73.2	-45.3	175.4	-67.6	161	0	0	0	109.1	T899 N900 E905 I906 D907	T899-I903 VanDerWaalsContact O-CG1 3.32Å; T899-I903 WeakPolarHBondContact O-CG1 3.21Å; T899-I903 PolarHBondContact O-N 3.4Å; N900-I903 CarbonylContact O-C 3.47Å; N900-I903 WeakPolarHBondContact O-CA 3.35Å; N900-I903 WeakPolarHBondContact O-CB 3.44Å; N900-I903 PolarHBondContact O-N 3.35Å; I903-E905 VanDerWaalsContact C-N 3.29Å; I903-E905 PolarHBondContact O-N 3.44Å; I903-I906 WeakPolarHBondContact O-CA 3.35Å; I903-I906 PolarHBondContact O-N 3.04Å; I903-D907 PolarHBondContact O-N 3.31Å
904	D	76.5	Confident	76.4	Confident	104 Å²	104	99.6 Å²	99.6	56%	0.556	53%	0.526	S	S	*	.	H	α-helix	trans	-58.2	-39.8	174.2	-59.4	-39.6	0	0	0	111.6	N900 S908	N900-D904 VanDerWaalsContact O-CG 3.28Å; N900-D904 PolarHBondContact O-N 3.22Å; D904-S908 VanDerWaalsContact O-CB 3.25Å; D904-S908 WeakPolarHBondContact O-CB 3.46Å; D904-S908 PolarHBondContact O-N 2.93Å; D904-S908 PolarHBondContact O-OG 3.29Å
905	E	76.2	Confident	75.8	Confident	97 Å²	97	98.7 Å²	98.7	45%	0.453	53%	0.525	S	S	.	.	H	α-helix	trans	-62.1	-38.4	171.9	-79.4	170.2	-173.4	0	0	112.7	C901 R902 I903 S908 A909	C901-E905 WeakPolarHBondContact O-CB 3.48Å; C901-E905 VanDerWaalsContact O-CG 3.25Å; C901-E905 WeakPolarHBondContact O-CG 3.36Å; C901-E905 PolarHBondContact O-N 3.48Å; R902-E905 WeakPolarHBondContact CD-OE2 3.4Å; R902-E905 IonicContact NE-OE2 2.61Å; R902-E905 IonicContact NH1-OE2 3.66Å; I903-E905 VanDerWaalsContact C-N 3.29Å; I903-E905 PolarHBondContact O-N 3.44Å; E905-S908 PolarHBondContact O-OG 3.37Å; E905-A909 VanDerWaalsContact O-CB 3.24Å; E905-A909 WeakPolarHBondContact O-CB 3.2Å; E905-A909 PolarHBondContact O-N 3.1Å; E905-A909 VanDerWaalsContact O-N 3.11Å
906	I	75.5	Confident	75.6	Confident	107 Å²	107	96.2 Å²	96.2	55%	0.549	52%	0.521	S	S	.	.	H	α-helix	trans	-74.6	-45.4	179	-72.1	164.1	0	0	0	111.1	R902 I903 A909 A910	R902-I906 WeakPolarHBondContact O-CD1 3.44Å; R902-I906 VanDerWaalsContact O-CG1 3.22Å; R902-I906 WeakPolarHBondContact O-CG1 3.47Å; R902-I906 PolarHBondContact O-N 2.82Å; I903-I906 WeakPolarHBondContact O-CA 3.35Å; I903-I906 PolarHBondContact O-N 3.04Å; I906-A909 PolarHBondContact O-N 2.82Å; I906-A910 WeakPolarHBondContact O-CB 3.23Å; I906-A910 PolarHBondContact O-N 3.5Å
907	D	76.6	Confident	75.3	Confident	89 Å²	89	96.7 Å²	96.7	48%	0.476	52%	0.521	S	S	.	.	H	α-helix	trans	-67.6	-38.8	-179.3	-73.7	-10.1	0	0	0	111.2	I903 A910 Y911	I903-D907 PolarHBondContact O-N 3.31Å; D907-A910 PolarHBondContact O-N 3.11Å; D907-Y911 PolarHBondContact O-N 3.17Å
908	S	73.9	Confident	75.1	Confident	71 Å²	71	92.1 Å²	92.1	50%	0.497	51%	0.511	S	S	.	.	H	α-helix	trans	-69.8	-34.4	173.3	58.8	0	0	0	0	112.9	D904 E905 A912	D904-S908 VanDerWaalsContact O-CB 3.25Å; D904-S908 WeakPolarHBondContact O-CB 3.46Å; D904-S908 PolarHBondContact O-N 2.93Å; D904-S908 PolarHBondContact O-OG 3.29Å; E905-S908 PolarHBondContact O-OG 3.37Å; S908-A912 VanDerWaalsContact O-CB 3.31Å; S908-A912 WeakPolarHBondContact O-CB 3.24Å; S908-A912 PolarHBondContact O-N 3.11Å
909	A	72.3	Confident	74.8	Confident	59 Å²	59	89.7 Å²	89.7	49%	0.488	50%	0.503	S	S	.	.	H	α-helix	trans	-66.1	-37.7	170.8	0	0	0	0	0	112.4	E905 I906 A912 A913	E905-A909 VanDerWaalsContact O-CB 3.24Å; E905-A909 WeakPolarHBondContact O-CB 3.2Å; E905-A909 PolarHBondContact O-N 3.1Å; E905-A909 VanDerWaalsContact O-N 3.11Å; I906-A909 PolarHBondContact O-N 2.82Å; A909-A912 PolarHBondContact O-N 3.01Å; A909-A913 PolarHBondContact O-N 3.3Å
910	A	71.3	Confident	74.7	Confident	51 Å²	51	92 Å²	92	42%	0.421	51%	0.509	S	S	.	.	H	α-helix	trans	-64.3	-49.7	174.1	0	0	0	0	0	111.6	I906 D907 A912 A913 E914	I906-A910 WeakPolarHBondContact O-CB 3.23Å; I906-A910 PolarHBondContact O-N 3.5Å; D907-A910 PolarHBondContact O-N 3.11Å; A910-A912 VanDerWaalsContact C-N 3.3Å; A910-A912 PolarHBondContact O-N 3.27Å; A910-A913 WeakPolarHBondContact O-CB 3.42Å; A910-A913 PolarHBondContact O-N 3.39Å; A910-A913 VanDerWaalsContact O-N 3.14Å; A910-E914 PolarHBondContact O-N 3.18Å
911	Y	74.6	Confident	74.6	Confident	162 Å²	162	92.8 Å²	92.8	64%	0.635	51%	0.508	S	S	*	.	H	α-helix	trans	-58.4	-39.2	174.4	-99.3	-76	0	0	0	112.9	D907 E914 L915	D907-Y911 PolarHBondContact O-N 3.17Å; Y911-E914 PolarHBondContact O-N 3.22Å; Y911-L915 WeakPolarHBondContact O-CB 3.23Å; Y911-L915 VanDerWaalsContact O-CG 3.31Å; Y911-L915 WeakPolarHBondContact O-CG 3.4Å; Y911-L915 PolarHBondContact O-N 2.97Å
912	A	71.3	Confident	74.5	Confident	58 Å²	58	93.9 Å²	93.9	48%	0.479	51%	0.509	S	S	.	.	H	α-helix	trans	-65.9	-37.5	176.6	0	0	0	0	0	112.3	S908 A909 A910 A916	S908-A912 VanDerWaalsContact O-CB 3.31Å; S908-A912 WeakPolarHBondContact O-CB 3.24Å; S908-A912 PolarHBondContact O-N 3.11Å; A909-A912 PolarHBondContact O-N 3.01Å; A910-A912 VanDerWaalsContact C-N 3.3Å; A910-A912 PolarHBondContact O-N 3.27Å; A912-A916 WeakPolarHBondContact O-CB 3.3Å; A912-A916 PolarHBondContact O-N 3.23Å
913	A	68.9	Low	74.4	Confident	61 Å²	61	91.8 Å²	91.8	50%	0.504	51%	0.506	S	S	.	.	H	α-helix	trans	-67.1	-44.1	175.7	0	0	0	0	0	112.2	A909 A910 A916 D917	A909-A913 PolarHBondContact O-N 3.3Å; A910-A913 WeakPolarHBondContact O-CB 3.42Å; A910-A913 PolarHBondContact O-N 3.39Å; A910-A913 VanDerWaalsContact O-N 3.14Å; A913-A916 PolarHBondContact O-N 3.43Å; A913-D917 PolarHBondContact O-N 2.68Å
914	E	76.3	Confident	74	Confident	139 Å²	139	93 Å²	93	65%	0.65	51%	0.509	S	S	*	.	H	α-helix	trans	-62.3	-44	175	-69.7	-167.8	163	0	0	112	A910 Y911 A916 L918	A910-E914 PolarHBondContact O-N 3.18Å; Y911-E914 PolarHBondContact O-N 3.22Å; E914-A916 PolarHBondContact O-N 3.45Å; E914-L918 WeakPolarHBondContact O-CB 3.22Å; E914-L918 PolarHBondContact O-N 2.99Å
915	L	70.4	Confident	73.9	Confident	104 Å²	104	96.3 Å²	96.3	55%	0.545	51%	0.514	S	S	.	.	H	α-helix	trans	-65	-36.8	177.9	-75.4	170.2	0	0	0	112.5	Y911 L918 C919	Y911-L915 WeakPolarHBondContact O-CB 3.23Å; Y911-L915 VanDerWaalsContact O-CG 3.31Å; Y911-L915 WeakPolarHBondContact O-CG 3.4Å; Y911-L915 PolarHBondContact O-N 2.97Å; L915-L918 PolarHBondContact O-N 2.85Å; L915-C919 VanDerWaalsContact O-CB 3.23Å; L915-C919 WeakPolarHBondContact O-CB 3.2Å; L915-C919 PolarHBondContact O-N 3.25Å; L915-C919 PolarHBondContact O-SG 3.39Å; L915-C919 VanDerWaalsContact O-SG 3.35Å
916	A	72.3	Confident	73.7	Confident	61 Å²	61	99.2 Å²	99.2	50%	0.504	52%	0.521	S	S	.	.	H	α-helix	trans	-63.2	-50.4	177	0	0	0	0	0	111.9	A912 A913 E914 L918 C919 E920	A912-A916 WeakPolarHBondContact O-CB 3.3Å; A912-A916 PolarHBondContact O-N 3.23Å; A913-A916 PolarHBondContact O-N 3.43Å; E914-A916 PolarHBondContact O-N 3.45Å; A916-L918 VanDerWaalsContact C-N 3.33Å; A916-L918 PolarHBondContact O-N 2.68Å; A916-C919 PolarHBondContact O-N 3.23Å; A916-E920 PolarHBondContact O-N 3Å
917	D	75.6	Confident	73.3	Confident	80 Å²	80	97 Å²	97	43%	0.428	52%	0.519	S	S	.	.	H	α-helix	trans	-61.5	-38.6	177.6	170.2	77.4	0	0	0	112.1	A913 K921	A913-D917 PolarHBondContact O-N 2.68Å; D917-K921 WeakPolarHBondContact O-CD 3.31Å; D917-K921 WeakPolarHBondContact O-CG 3.44Å; D917-K921 PolarHBondContact O-N 3.09Å; D917-K921 WeakPolarHBondContact OD1-CE 3.46Å; D917-K921 IonicContact OD1-NZ 2.68Å; D917-K921 PolarHBondContact OD1-NZ 2.96Å; D917-K921 WeakPolarHBondContact OD2-CE 3.31Å; D917-K921 IonicContact OD2-NZ 2.72Å; D917-K921 PolarHBondContact OD2-NZ 3.05Å
918	L	75.4	Confident	72.9	Confident	103 Å²	103	98.8 Å²	98.8	54%	0.539	52%	0.524	S	S	.	.	H	α-helix	trans	-68.5	-39.8	174.4	-151.5	92.3	0	0	0	112.3	E914 L915 A916 L922	E914-L918 WeakPolarHBondContact O-CB 3.22Å; E914-L918 PolarHBondContact O-N 2.99Å; L915-L918 PolarHBondContact O-N 2.85Å; A916-L918 VanDerWaalsContact C-N 3.33Å; A916-L918 PolarHBondContact O-N 2.68Å; L918-L922 PolarHBondContact O-N 2.67Å; L918-L922 VanDerWaalsContact O-N 3.08Å
919	C	74.9	Confident	72.7	Confident	63 Å²	63	99 Å²	99	43%	0.426	52%	0.523	S	S	.	.	H	α-helix	trans	-67.2	-37.9	177.4	-82.8	0	0	0	0	112.5	L915 A916 L922 H923	L915-C919 VanDerWaalsContact O-CB 3.23Å; L915-C919 WeakPolarHBondContact O-CB 3.2Å; L915-C919 PolarHBondContact O-N 3.25Å; L915-C919 PolarHBondContact O-SG 3.39Å; L915-C919 VanDerWaalsContact O-SG 3.35Å; A916-C919 PolarHBondContact O-N 3.23Å; C919-L922 PolarHBondContact O-N 3.21Å; C919-H923 PolarHBondContact O-N 3.46Å; C919-H923 PolarHBondContact O-ND1 3.2Å
920	E	73.5	Confident	72.1	Confident	122 Å²	122	100.6 Å²	100.6	57%	0.57	52%	0.523	S	S	*	.	H	α-helix	trans	-65.2	-45.1	177	-170.7	169.2	-170.6	0	0	111.2	A916 L922 H923 Q924	A916-E920 PolarHBondContact O-N 3Å; E920-L922 VanDerWaalsContact C-N 3.27Å; E920-L922 PolarHBondContact O-N 3.23Å; E920-H923 PolarHBondContact O-N 3.27Å; E920-Q924 WeakPolarHBondContact O-CG 3.42Å; E920-Q924 PolarHBondContact O-N 3.23Å
921	K	77.4	Confident	71.6	Confident	107 Å²	107	101.2 Å²	101.2	47%	0.465	53%	0.528	S	S	.	.	H	α-helix	trans	-60.2	-34.5	173.9	-70.5	165.3	-171.8	167.1	0	112.8	D917 R925	D917-K921 WeakPolarHBondContact O-CD 3.31Å; D917-K921 WeakPolarHBondContact O-CG 3.44Å; D917-K921 PolarHBondContact O-N 3.09Å; D917-K921 WeakPolarHBondContact OD1-CE 3.46Å; D917-K921 IonicContact OD1-NZ 2.68Å; D917-K921 PolarHBondContact OD1-NZ 2.96Å; D917-K921 WeakPolarHBondContact OD2-CE 3.31Å; D917-K921 IonicContact OD2-NZ 2.72Å; D917-K921 PolarHBondContact OD2-NZ 3.05Å; K921-R925 PolarHBondContact O-N 2.77Å
922	L	77.3	Confident	71	Confident	84 Å²	84	98.6 Å²	98.6	44%	0.44	52%	0.523	S	S	.	.	H	α-helix	trans	-73.4	-34.3	172.6	-81.7	168.7	0	0	0	113.2	L918 C919 E920 R926	L918-L922 PolarHBondContact O-N 2.67Å; L918-L922 VanDerWaalsContact O-N 3.08Å; C919-L922 PolarHBondContact O-N 3.21Å; E920-L922 VanDerWaalsContact C-N 3.27Å; E920-L922 PolarHBondContact O-N 3.23Å; L922-R926 WeakPolarHBondContact O-CB 3.47Å; L922-R926 WeakPolarHBondContact O-CG 3.31Å; L922-R926 PolarHBondContact O-N 3.45Å
923	H	74.2	Confident	70.3	Confident	120 Å²	120	99.9 Å²	99.9	56%	0.556	52%	0.521	S	S	*	.	H	α-helix	trans	-69.7	-39.1	176.5	-82.2	80.5	0	0	0	112.2	C919 E920 R926 A927	C919-H923 PolarHBondContact O-N 3.46Å; C919-H923 PolarHBondContact O-ND1 3.2Å; E920-H923 PolarHBondContact O-N 3.27Å; H923-R926 PolarHBondContact O-N 3.41Å; H923-A927 WeakPolarHBondContact O-CB 3.37Å; H923-A927 PolarHBondContact O-N 2.88Å
924	Q	70.6	Confident	69.2	Low	110 Å²	110	100.2 Å²	100.2	51%	0.514	52%	0.515	S	S	.	.	H	α-helix	trans	-57.9	-52.2	173.5	-68.8	171.6	4.8	0	0	110.8	E920 R926 A927 E928	E920-Q924 WeakPolarHBondContact O-CG 3.42Å; E920-Q924 PolarHBondContact O-N 3.23Å; Q924-R926 VanDerWaalsContact C-N 3.32Å; Q924-R926 PolarHBondContact O-N 3.42Å; Q924-A927 WeakPolarHBondContact O-CB 3.38Å; Q924-A927 PolarHBondContact O-N 2.83Å; Q924-A927 VanDerWaalsContact O-N 3.1Å; Q924-E928 WeakPolarHBondContact O-CG 3.22Å; Q924-E928 PolarHBondContact O-N 2.91Å
925	R	73.5	Confident	68.1	Low	175 Å²	175	102 Å²	102	66%	0.66	52%	0.523	S	S	*	.	H	α-helix	trans	-61.9	-33	175.8	-72.7	178.7	171.5	176.7	-1.7	114.4	K921 E928 T929	K921-R925 PolarHBondContact O-N 2.77Å; R925-E928 WeakPolarHBondContact CA-OE2 3.25Å; R925-T929 PolarHBondContact O-N 2.92Å; R925-T929 VanDerWaalsContact O-N 3.1Å; R925-T929 PolarHBondContact O-OG1 3.33Å
926	R	71.5	Confident	66.9	Low	157 Å²	157	104.1 Å²	104.1	59%	0.592	53%	0.53	S	S	*	.	H	α-helix	trans	-72.3	-35.1	173.6	-80.3	-179.7	171.8	-179	-1.2	112.4	L922 H923 Q924 T929 L930	L922-R926 WeakPolarHBondContact O-CB 3.47Å; L922-R926 WeakPolarHBondContact O-CG 3.31Å; L922-R926 PolarHBondContact O-N 3.45Å; H923-R926 PolarHBondContact O-N 3.41Å; Q924-R926 VanDerWaalsContact C-N 3.32Å; Q924-R926 PolarHBondContact O-N 3.42Å; R926-T929 WeakPolarHBondContact CA-OG1 3.09Å; R926-T929 PolarHBondContact O-OG1 2.9Å; R926-L930 WeakPolarHBondContact O-CB 2.93Å; R926-L930 WeakPolarHBondContact O-CG 3.33Å; R926-L930 PolarHBondContact O-N 3.27Å
927	A	68.3	Low	65.5	Low	62 Å²	62	107 Å²	107	51%	0.512	54%	0.536	S	S	.	.	H	α-helix	trans	-67.1	-43.9	174	0	0	0	0	0	111.2	H923 Q924 L930 A931	H923-A927 WeakPolarHBondContact O-CB 3.37Å; H923-A927 PolarHBondContact O-N 2.88Å; Q924-A927 WeakPolarHBondContact O-CB 3.38Å; Q924-A927 PolarHBondContact O-N 2.83Å; Q924-A927 VanDerWaalsContact O-N 3.1Å; A927-L930 PolarHBondContact O-N 3.46Å; A927-A931 WeakPolarHBondContact O-CB 3.42Å; A927-A931 PolarHBondContact O-N 3.1Å
928	E	67.9	Low	63.9	Low	125 Å²	125	110.4 Å²	110.4	58%	0.584	55%	0.55	S	S	*	.	H	α-helix	trans	-57.3	-50.9	174.2	-68.9	168.9	160.7	0	0	111.8	Q924 R925 A931 I932	Q924-E928 WeakPolarHBondContact O-CG 3.22Å; Q924-E928 PolarHBondContact O-N 2.91Å; R925-E928 WeakPolarHBondContact CA-OE2 3.25Å; E928-A931 PolarHBondContact O-N 3.4Å; E928-I932 WeakPolarHBondContact O-CG1 3.26Å; E928-I932 PolarHBondContact O-N 2.78Å
929	T	68.4	Low	62.2	Low	75 Å²	75	110.6 Å²	110.6	46%	0.46	56%	0.56	S	S	.	*	H	α-helix	trans	-70.1	-36.2	-179.9	45.5	0	0	0	0	113.2	R925 R926 I932 I933	R925-T929 PolarHBondContact O-N 2.92Å; R925-T929 VanDerWaalsContact O-N 3.1Å; R925-T929 PolarHBondContact O-OG1 3.33Å; R926-T929 WeakPolarHBondContact CA-OG1 3.09Å; R926-T929 PolarHBondContact O-OG1 2.9Å; T929-I932 PolarHBondContact O-N 2.89Å; T929-I933 WeakPolarHBondContact O-CD1 3.46Å; T929-I933 VanDerWaalsContact O-CG1 3.27Å; T929-I933 WeakPolarHBondContact O-CG1 3.35Å; T929-I933 PolarHBondContact O-N 2.78Å
930	L	61.2	Low	60.3	Low	94 Å²	94	118.7 Å²	118.7	49%	0.492	58%	0.582	S	S	.	*	H	α-helix	trans	-72.2	-26.6	174.2	-72.7	172.3	0	0	0	113.1	R926 A927 N934	R926-L930 WeakPolarHBondContact O-CB 2.93Å; R926-L930 WeakPolarHBondContact O-CG 3.33Å; R926-L930 PolarHBondContact O-N 3.27Å; A927-L930 PolarHBondContact O-N 3.46Å; L930-N934 VanDerWaalsContact O-CB 3.22Å; L930-N934 WeakPolarHBondContact O-CB 3.28Å; L930-N934 PolarHBondContact O-N 3.45Å; L930-N934 PolarHBondContact O-ND2 2.96Å
931	A	60.3	Low	58.7	Low	64 Å²	64	118.5 Å²	118.5	53%	0.529	59%	0.585	S	S	.	*	H	α-helix	trans	-62.6	-49.4	171.1	0	0	0	0	0	110.5	A927 E928 I933 N934 E935	A927-A931 WeakPolarHBondContact O-CB 3.42Å; A927-A931 PolarHBondContact O-N 3.1Å; E928-A931 PolarHBondContact O-N 3.4Å; A931-I933 PolarHBondContact O-N 3.47Å; A931-N934 PolarHBondContact O-N 2.74Å; A931-E935 PolarHBondContact O-N 3.2Å
932	I	60.9	Low	56.7	Low	106 Å²	106	123 Å²	123	54%	0.544	60%	0.599	S	S	.	*	H	α-helix	trans	-61.7	-40.8	177.7	-61.7	164.6	0	0	0	111.5	E928 T929	E928-I932 WeakPolarHBondContact O-CG1 3.26Å; E928-I932 PolarHBondContact O-N 2.78Å; T929-I932 PolarHBondContact O-N 2.89Å
933	I	56.7	Low	54.8	Low	85 Å²	85	125.6 Å²	125.6	44%	0.436	61%	0.613	S	S	.	*	H	α-helix	trans	-74	-34.5	179.5	-67.4	165.6	0	0	0	112.1	T929 A931 E935 Q936 L937	T929-I933 WeakPolarHBondContact O-CD1 3.46Å; T929-I933 VanDerWaalsContact O-CG1 3.27Å; T929-I933 WeakPolarHBondContact O-CG1 3.35Å; T929-I933 PolarHBondContact O-N 2.78Å; A931-I933 PolarHBondContact O-N 3.47Å; I933-E935 VanDerWaalsContact C-N 3.32Å; I933-E935 PolarHBondContact O-N 3.12Å; I933-Q936 PolarHBondContact O-N 3.09Å; I933-Q936 VanDerWaalsContact O-N 3.12Å; I933-L937 HydrophobicContact CG2-CD1 4.36Å; I933-L937 PolarHBondContact O-N 3.43Å
934	N	47.4	Very low	53.1	Low	69 Å²	69	128.4 Å²	128.4	37%	0.369	63%	0.626	S	S	.	*	H	α-helix	trans	-67.2	-33	176.4	-85.7	-60.6	0	0	0	112.5	L930 A931 Q936 L937 Q938	L930-N934 VanDerWaalsContact O-CB 3.22Å; L930-N934 WeakPolarHBondContact O-CB 3.28Å; L930-N934 PolarHBondContact O-N 3.45Å; L930-N934 PolarHBondContact O-ND2 2.96Å; A931-N934 PolarHBondContact O-N 2.74Å; N934-Q936 PolarHBondContact O-N 3.17Å; N934-L937 PolarHBondContact O-N 3Å; N934-Q938 HydrophobicContact CB-CG 4.3Å; N934-Q938 WeakPolarHBondContact O-CB 3.12Å; N934-Q938 WeakPolarHBondContact O-CG 3.35Å; N934-Q938 PolarHBondContact O-N 2.9Å
935	E	52.3	Low	52	Low	175 Å²	175	128.6 Å²	128.6	82%	0.818	64%	0.637	S	S	*	*	H	α-helix	trans	-58.3	-27.1	172.3	-154.9	173.5	-130.2	0	0	112	A931 I933	A931-E935 PolarHBondContact O-N 3.2Å; I933-E935 VanDerWaalsContact C-N 3.32Å; I933-E935 PolarHBondContact O-N 3.12Å
936	Q	45.8	Very low	50.3	Low	150 Å²	150	125.4 Å²	125.4	70%	0.701	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	-9.3	176.9	-59.1	-169.2	-1.2	0	0	114.8	I933 N934	I933-Q936 PolarHBondContact O-N 3.09Å; I933-Q936 VanDerWaalsContact O-N 3.12Å; N934-Q936 PolarHBondContact O-N 3.17Å
937	L	42.6	Very low	48.6	Very low	120 Å²	120	124.6 Å²	124.6	63%	0.628	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.4	-8.3	-173.2	-72.5	175.3	0	0	0	116.1	I933 N934 S939 R940	I933-L937 HydrophobicContact CG2-CD1 4.36Å; I933-L937 PolarHBondContact O-N 3.43Å; N934-L937 PolarHBondContact O-N 3Å; L937-S939 PolarHBondContact O-N 3.49Å; L937-R940 PolarHBondContact O-N 2.79Å
938	Q	41.2	Very low	47.2	Very low	152 Å²	152	129.5 Å²	129.5	71%	0.71	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	26.1	176.2	-73.3	-170.9	7.5	0	0	115.2	N934	N934-Q938 HydrophobicContact CB-CG 4.3Å; N934-Q938 WeakPolarHBondContact O-CB 3.12Å; N934-Q938 WeakPolarHBondContact O-CG 3.35Å; N934-Q938 PolarHBondContact O-N 2.9Å
939	S	39.2	Very low	45.8	Very low	108 Å²	108	130.7 Å²	130.7	76%	0.755	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	9.3	162.9	58.8	0	0	0	0	113.5	L937	L937-S939 PolarHBondContact O-N 3.49Å
940	R	36.8	Very low	44.3	Very low	232 Å²	232	132.6 Å²	132.6	88%	0.875	68%	0.68	S	S	*	*	S	Bend	trans	-137.3	102	166.9	-71.4	-171.4	169.6	177.7	-3.7	112.7	L937	L937-R940 PolarHBondContact O-N 2.79Å
941	D	39.3	Very low	43.1	Very low	119 Å²	119	134.4 Å²	134.4	64%	0.636	69%	0.689	S	S	*	*			trans	-58.2	163.9	172.1	-63.3	-73.3	0	0	0	114.5
942	R	34.3	Very low	42	Very low	201 Å²	201	139.7 Å²	139.7	76%	0.758	70%	0.7	S	S	*	*			cis	-172.8	170.6	-6.6	-107.5	174.6	-149.8	-161.6	8.5	112.3
943	N	37.5	Very low	40.9	Very low	139 Å²	139	141.6 Å²	141.6	74%	0.743	71%	0.711	S	S	*	*			trans	84	147.9	158.8	-51	-38.3	0	0	0	120.4
944	Q	40.4	Very low	40	Very low	178 Å²	178	143.9 Å²	143.9	83%	0.832	73%	0.729	S	S	*	*			cis	-167.5	173.7	-14.2	-103.8	-175	-4.8	0	0	114.4
945	P	46.8	Very low	39.5	Very low	115 Å²	115	148.1 Å²	148.1	75%	0.747	75%	0.75	S	S	*	*			trans	-132.8	177.3	-165.1	45.4	-32.7	0	0	0	120.8
946	S	36.8	Very low	38.9	Very low	107 Å²	107	145.4 Å²	145.4	75%	0.748	75%	0.75	S	S	*	*			trans	164.6	155.8	147.1	51.4	0	0	0	0	123.3
947	N	37.5	Very low	38.7	Very low	140 Å²	140	143.6 Å²	143.6	75%	0.749	75%	0.751	S	S	*	*			trans	81.7	163	151.9	-64.2	-36.6	0	0	0	126.2
948	K	38.6	Very low	38.5	Very low	165 Å²	165	148 Å²	148	72%	0.717	76%	0.761	S	S	*	*			cis	-178.6	150.3	-44.3	-111.4	-176.7	159.2	-152.4	0	119.8
949	E	37.6	Very low	38.4	Very low	151 Å²	151	147.6 Å²	147.6	71%	0.706	77%	0.769	S	S	*	*			trans	83.7	0	141.7	-69.7	172	-166.5	0	0	131.9
950	C	37.3	Very low	38.3	Very low	115 Å²	115	149.2 Å²	149.2	78%	0.777	77%	0.769	S	S	*	*				0	0	0	-66.1	0	0	0	0	129
951	L	36	Very low	38.4	Very low	131 Å²	131	144.7 Å²	144.7	69%	0.686	76%	0.763	S	S	*	*				0	0	0	-93.1	174.2	0	0	0	120.2
952	F	36.4	Very low	38.3	Very low	176 Å²	176	143.9 Å²	143.9	77%	0.772	77%	0.766	S	S	*	*				0	0	0	-59.1	-40.2	0	0	0	127.6
953	L	37.9	Very low	38.5	Very low	145 Å²	145	142.1 Å²	142.1	76%	0.759	77%	0.77	S	S	*	*				0	0	0	-96.2	171.2	0	0	0	119.9
954	T	38	Very low	38.5	Very low	133 Å²	133	141.5 Å²	141.5	82%	0.816	77%	0.771	S	S	*	*				0	0	0	54	0	0	0	0	130.8
955	I	37.2	Very low	38.4	Very low	159 Å²	159	142.6 Å²	142.6	82%	0.815	78%	0.777	S	S	*	*				0	0	0	-59.4	149.4	0	0	0	121.1
956	S	39.7	Very low	37.8	Very low	118 Å²	118	140.8 Å²	140.8	83%	0.825	78%	0.778	S	S	*	*				0	0	0	53.1	0	0	0	0	124.6
957	P	42.1	Very low	37.6	Very low	111 Å²	111	148 Å²	148	72%	0.721	79%	0.789	S	S	*	*				0	-179.8	0	42.3	-21.5	0	0	0	124
958	Y	37.9	Very low	37.6	Very low	214 Å²	214	152 Å²	152	84%	0.839	80%	0.796	S	S	*	*			trans	117.8	144.9	153.8	-79.2	-72.3	0	0	0	126.5
959	T	39.3	Very low	37.9	Very low	143 Å²	143	151.9 Å²	151.9	88%	0.877	80%	0.802	S	S	*	*			trans	169.1	177.2	141	31.9	0	0	0	0	118.9
960	N	36.7	Very low	37.6	Very low	141 Å²	141	153.1 Å²	153.1	75%	0.754	81%	0.808	S	S	*	*			trans	-120.8	-160.5	-164	-54.5	20.6	0	0	0	116.4
961	D	39.2	Very low	37.3	Very low	138 Å²	138	159.1 Å²	159.1	74%	0.738	81%	0.814	S	S	*	*			cis	-162.2	-162.1	5.2	-140.4	-66.8	0	0	0	115.3
962	S	37	Very low	36.9	Very low	101 Å²	101	160 Å²	160	71%	0.706	82%	0.82	S	S	*	*			trans	-147.9	161.3	-168.9	71.5	0	0	0	0	120.9
963	I	38.3	Very low	36.5	Very low	164 Å²	164	157.9 Å²	157.9	84%	0.841	82%	0.821	S	S	*	*			trans	-178.2	163.9	176.1	-113	150.5	0	0	0	112.6
964	T	39	Very low	36	Very low	126 Å²	126	156.4 Å²	156.4	77%	0.773	81%	0.813	S	S	*	*			cis	-159.9	-176.1	-40.5	43.5	0	0	0	0	111.3
965	Q	36.4	Very low	35.5	Very low	202 Å²	202	158 Å²	158	94%	0.944	81%	0.811	S	S	*	*			trans	-147.7	158	177.1	-71.5	-174.9	-14.1	0	0	115.3
966	G	34.2	Very low	34.9	Very low	76 Å²	76	153.4 Å²	153.4	78%	0.784	80%	0.803	S	S	*	*			trans	149	150.3	145.8	0	0	0	0	0	123.8
967	R	34.4	Very low	34.5	Very low	258 Å²	258	159.3 Å²	159.3	97%	0.974	81%	0.809	S	S	*	*			trans	90.6	160.5	144.1	-74	-170	174.6	-166.6	-0.9	125.5
968	Y	37	Very low	33.8	Very low	225 Å²	225	158.6 Å²	158.6	88%	0.882	81%	0.807	S	S	*	*			trans	-85.4	164	-168.9	-91.3	-114.5	0	0	0	115.8
969	L	44.9	Very low	33.4	Very low	163 Å²	163	155.8 Å²	155.8	85%	0.853	81%	0.807	S	S	*	*			trans	-146.6	137.4	154.6	-90.2	175.3	0	0	0	113.4
970	E	30.4	Very low	32.8	Very low	176 Å²	176	154 Å²	154	82%	0.822	80%	0.8	S	S	*	*			trans	-127.8	151.1	159.4	-72.2	-175.4	138.8	0	0	108.4
971	R	32.5	Very low	32.4	Very low	242 Å²	242	155.9 Å²	155.9	91%	0.913	81%	0.809	S	S	*	*			trans	-166.5	156.6	160.7	-111.8	165.1	-165.7	-161.2	2.2	113
972	N	26.9	Very low	31.9	Very low	150 Å²	150	156 Å²	156	80%	0.802	81%	0.81	S	S	*	*			trans	-102.6	-175.9	-170.9	-67.9	-32	0	0	0	113.4
973	V	26.7	Very low	31.3	Very low	131 Å²	131	160.8 Å²	160.8	79%	0.794	81%	0.814	S	S	*	*			trans	83.2	128.9	162.2	-169.4	0	0	0	0	112.6
974	N	27.5	Very low	30.9	Very low	113 Å²	113	160 Å²	160	60%	0.604	82%	0.816	S	S	*	*			cis	-155.3	171.6	38.3	-145.8	2.8	0	0	0	115.3
975	E	27.6	Very low	30.2	Very low	166 Å²	166	162.4 Å²	162.4	78%	0.776	82%	0.816	S	S	*	*			trans	37.9	145.2	150.3	-73.8	149.4	-156.9	0	0	122.5
976	G	25.4	Very low	29.9	Very low	63 Å²	63	157.8 Å²	157.8	65%	0.649	81%	0.806	S	S	*	*			cis	136.5	85.1	-3	0	0	0	0	0	114.3
977	Y	30.8	Very low	30.2	Very low	242 Å²	242	159.6 Å²	159.6	95%	0.949	80%	0.804	S	S	*	*			trans	-145.2	139.6	166.1	-98.8	-81.4	0	0	0	111.5
978	S	27.1	Very low	29.8	Very low	97 Å²	97	152.7 Å²	152.7	68%	0.678	79%	0.79	S	S	*	*			trans	-96	159.8	172.7	57.5	0	0	0	0	110.3
979	D	29.8	Very low	29.3	Very low	154 Å²	154	148.6 Å²	148.6	82%	0.824	78%	0.783	S	S	*	*				-159.7	165.5	78.2	-89	-8.1	0	0	0	113.5
980	S	26.9	Very low	28.3	Very low	105 Å²	105	145.4 Å²	145.4	73%	0.734	78%	0.775	S	S	*	*			trans	-100.2	147	-173.4	53	0	0	0	0	113.9
981	L	29.5	Very low	28.2	Very low	181 Å²	181	144.4 Å²	144.4	95%	0.948	78%	0.775	S	S	*	*			trans	-143.2	147.1	158.8	-108	163.3	0	0	0	109.9
982	D	27.5	Very low	27.9	Very low	141 Å²	141	138.6 Å²	138.6	75%	0.754	77%	0.766	S	S	*	*			trans	-98.3	166	-144.8	-108.9	-50.8	0	0	0	117.9
983	Y	25.2	Very low	27.8	Very low	202 Å²	202	135.4 Å²	135.4	79%	0.792	76%	0.761	S	S	*	*			trans	-46.7	137.4	173.8	-94.2	-99.6	0	0	0	115.8
984	V	29.3	Very low	28	Very low	146 Å²	146	139 Å²	139	89%	0.885	77%	0.766	S	S	*	*			trans	-127.1	147.5	143.7	-179.2	0	0	0	0	108.5
985	K	24.6	Very low	28	Very low	178 Å²	178	138.1 Å²	138.1	77%	0.774	77%	0.768	S	S	*	*			trans	-96.5	159.1	-169	-67.3	177.9	179.1	173.7	0	114
986	S	30.9	Very low	27.9	Very low	105 Å²	105	137.2 Å²	137.2	73%	0.734	77%	0.769	S	S	*	*			trans	-45.2	169.2	156	59.9	0	0	0	0	114.1
987	P	39.5	Very low	28.1	Very low	113 Å²	113	142.4 Å²	142.4	73%	0.734	78%	0.781	S	S	*	*			cis	-147.8	-150.9	26.9	39.8	-15.7	0	0	0	115.8
988	V	25.9	Very low	27.7	Very low	113 Å²	113	140.4 Å²	140.4	69%	0.685	78%	0.777	S	S	*	*			trans	105.2	110.7	160.8	-173.5	0	0	0	0	116.9
989	D	26.5	Very low	27.7	Very low	139 Å²	139	146.7 Å²	146.7	74%	0.743	79%	0.786	S	S	*	*			trans	45.3	143.3	143.6	-47.7	-5.6	0	0	0	120.8
990	S	24.6	Very low	27.5	Very low	97 Å²	97	146 Å²	146	68%	0.678	78%	0.782	S	S	*	*			cis	72.1	79.9	19.8	87.7	0	0	0	0	117.6
991	D	27	Very low	27.3	Very low	154 Å²	154	146.4 Å²	146.4	82%	0.824	79%	0.785	S	S	*	*				-173.4	154.8	111.3	-108.9	-14.2	0	0	0	119.1
992	V	26.7	Very low	27.2	Very low	120 Å²	120	143.4 Å²	143.4	73%	0.727	78%	0.779	S	S	*	*			trans	52.9	99.2	141.4	-179.4	0	0	0	0	121.8
993	A	26.1	Very low	27	Very low	83 Å²	83	144.2 Å²	144.2	69%	0.686	78%	0.784	S	S	*	*				58.6	116.4	125	0	0	0	0	0	123.6
994	K	29.2	Very low	27.2	Very low	207 Å²	207	142.5 Å²	142.5	90%	0.9	79%	0.788	S	S	*	*				179.1	144.9	115	-90.5	148.8	-171.8	171.6	0	108.7
995	S	27.6	Very low	26.9	Very low	94 Å²	94	144.4 Å²	144.4	66%	0.657	78%	0.784	S	S	*	*			cis	-165.4	152.3	-10.3	50.4	0	0	0	0	109.8
996	N	26.4	Very low	26.9	Very low	148 Å²	148	144.7 Å²	144.7	79%	0.791	79%	0.786	S	S	*	*			trans	31.2	131.7	146.3	-52.2	-19.1	0	0	0	119.4
997	L	28.4	Very low	26.6	Very low	171 Å²	171	145.7 Å²	145.7	90%	0.895	78%	0.783	S	S	*	*			cis	-141.5	151.5	37.6	-69.5	102.2	0	0	0	114.3
998	K	23.9	Very low	25.8	Very low	201 Å²	201	145.2 Å²	145.2	87%	0.874	78%	0.782	S	S	*	*			trans	-116.6	126.1	150.7	-80.8	-177	175.9	177.9	0	109
999	R	26.1	Very low	26	Very low	229 Å²	229	146.9 Å²	146.9	86%	0.864	79%	0.793	S	S	*	*				175.6	126.1	128.5	-99.5	170.1	-178.9	-174.8	0.9	113.7
1000	N	24.8	Very low	25.8	Very low	138 Å²	138	146.1 Å²	146.1	74%	0.738	79%	0.793	S	S	*	*			trans	46.6	100.7	131.6	-58.7	27.1	0	0	0	119.8
1001	S	23.9	Very low	26	Very low	114 Å²	114	150.9 Å²	150.9	80%	0.797	81%	0.807	S	S	*	*				30.7	114.7	114.2	64.1	0	0	0	0	119.4
1002	S	27.9	Very low	25.9	Very low	119 Å²	119	152.9 Å²	152.9	83%	0.832	81%	0.809	S	S	*	*			trans	-145.5	143	138.7	58	0	0	0	0	109.9
1003	N	23.4	Very low	26.5	Very low	158 Å²	158	151.7 Å²	151.7	85%	0.845	80%	0.803	S	S	*	*			trans	-71.3	141.4	171.4	-73.1	-45.8	0	0	0	109.5
1004	N	27.7	Very low	26.8	Very low	165 Å²	165	157.7 Å²	157.7	88%	0.882	81%	0.814	S	S	*	*			trans	-152.6	145.9	134.8	-112.9	-29.1	0	0	0	112.8
1005	K	23.2	Very low	26.6	Very low	186 Å²	186	153.9 Å²	153.9	81%	0.809	81%	0.808	S	S	*	*			trans	-75.7	150	169.3	-58.6	166.6	179.1	174.8	0	108.3
1006	F	25.7	Very low	26.8	Very low	185 Å²	185	154.6 Å²	154.6	81%	0.811	81%	0.814	S	S	*	*				-175.5	133.6	119	-108.6	-76.1	0	0	0	112.7
1007	N	24.1	Very low	27	Very low	126 Å²	126	153.8 Å²	153.8	67%	0.674	81%	0.814	S	S	*	*			trans	31.4	109.1	151.7	-67.3	13.4	0	0	0	122.3
1008	S	23.5	Very low	27	Very low	102 Å²	102	155.5 Å²	155.5	71%	0.713	81%	0.814	S	S	*	*				34.8	115.9	119.3	64.3	0	0	0	0	120.9
1009	V	29.7	Very low	27.4	Very low	149 Å²	149	154.1 Å²	154.1	90%	0.903	82%	0.816	S	S	*	*			trans	-133.5	143.9	138.6	179.1	0	0	0	0	108.8
1010	T	22.8	Very low	27.3	Very low	123 Å²	123	146.1 Å²	146.1	76%	0.755	80%	0.804	S	S	*	*			trans	-95.5	148.5	-178.3	49.6	0	0	0	0	113.1
1011	M	28.3	Very low	28.1	Very low	197 Å²	197	145.2 Å²	145.2	97%	0.97	81%	0.806	S	S	*	*			trans	-158.6	130	138.8	-111.1	-175.8	-168.7	0	0	113.8
1012	F	25.4	Very low	28.4	Very low	196 Å²	196	148.6 Å²	148.6	86%	0.86	81%	0.809	S	S	*	*			trans	-92.9	-179.4	153.3	-80.2	-96.1	0	0	0	108.1
1013	P	39	Very low	28.2	Very low	94 Å²	94	149.4 Å²	149.4	61%	0.61	81%	0.809	S	S	*	*			cis	-125.5	-176.9	-41.6	35.7	-21.1	0	0	0	111.1
1014	F	31.4	Very low	28.9	Very low	210 Å²	210	148 Å²	148	92%	0.921	81%	0.806	S	S	*	*			trans	-119.5	118.9	154	-100.6	-84	0	0	0	110.7
1015	T	25.8	Very low	29.4	Very low	126 Å²	126	151.3 Å²	151.3	77%	0.773	82%	0.824	S	S	*	*			trans	-139.9	109.7	174.6	50.5	0	0	0	0	109.9
1016	S	31.6	Very low	29.7	Very low	110 Å²	110	149.6 Å²	149.6	77%	0.769	83%	0.825	S	S	*	*			trans	-170	120.2	178	-179.7	0	0	0	0	107.7
1017	T	30.8	Very low	29.9	Very low	130 Å²	130	147.7 Å²	147.7	80%	0.798	83%	0.825	S	S	*	*			cis	-171.7	162.6	-16.2	3.4	0	0	0	0	104.1
1018	K	27.2	Very low	30.2	Very low	207 Å²	207	148.9 Å²	148.9	90%	0.9	83%	0.834	S	S	*	*			trans	-68.9	139.8	178.5	-61.7	172.2	179.4	176.6	0	111.4
1019	L	33.2	Very low	30.6	Very low	173 Å²	173	151.7 Å²	151.7	91%	0.906	84%	0.841	S	S	*	*			trans	-148.3	118.6	149.9	-101.9	165.4	0	0	0	109.5
1020	G	24.5	Very low	30.7	Very low	60 Å²	60	151.9 Å²	151.9	62%	0.619	84%	0.837	S	S	*	*			trans	-111.9	-162	147.2	0	0	0	0	0	107.6
1021	P	40.2	Very low	31.2	Very low	119 Å²	119	153.8 Å²	153.8	77%	0.773	84%	0.842	S	S	*	*			cis	-122.9	179.8	0.4	38.7	-23.6	0	0	0	112.4
1022	Q	30.8	Very low	31.4	Very low	185 Å²	185	150.7 Å²	150.7	86%	0.864	83%	0.833	S	S	*	*				177.2	144.4	118.5	-97.2	174.1	-6.2	0	0	111.7
1023	T	24.5	Very low	31.9	Very low	136 Å²	136	147.2 Å²	147.2	83%	0.834	83%	0.831	S	S	*	*			trans	-92.3	149.9	166	46	0	0	0	0	109.7
1024	V	36.6	Very low	31.3	Very low	129 Å²	129	151.7 Å²	151.7	78%	0.782	85%	0.85	S	S	*	*			trans	-134.5	119.5	158.7	-178	0	0	0	0	107.1
1025	D	38.7	Very low	31.3	Very low	235 Å²	235	146.4 Å²	146.4	100%	1.257	84%	0.843	S	S	*	*			trans	25.9	0	164.5	-51.4	-7.3	0	0	0	118.9

Retrieved 1,025 of 1,025 residues in 1501.3 ms (Link to these results)

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