A0A3Q0KB89_SCHMA Loading...

26S proteasome non-ATPase regulatory subunit 2

Binds to the intracellular domain of tumor necrosis factor type 1 receptor. The binding domain of TRAP1 and TRAP2 resides outside the death domain of TNFR1. Component of the 26S proteasome, a multiprotein complex involved in the ATP-dependent degradation of ubiquitinated proteins. This complex plays a key role in the maintenance of protein homeostasis by removing misfolded or damaged proteins, which could impair cellular functions, and by removing proteins whose functions are no longer required. Therefore, the proteasome participates in numerous cellular processes, including cell cycle progression, apoptosis, or DNA damage repair.

AlphaFold DB , UniProt , Accession A0A3Q0KB89, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 995 aa.

						>A0A3Q0KB89_SCHMA|A0A3Q0KB89
MGTDSSMKAVEEQSGPKKEETSKDDLSEEDRQLQDELNMLVDRLEEPNQELHKPALESMCTLIKSSTTSMTSVPKPLKFLMHHYAKIKSFYNTIYNPDTKKLCADVVSVLGMTVTDQPETRYDTLTYRLLGCQSDIGAWGHEYVRHLTNQIVGTWQEKEYDSLMDNPEATKEMKKHREDCLSLVHQIIPYLMEHNAEAEAIDLCIEIEQHHLLEIYTSSLNYTRVCLYLTSCVAYLPTPDNNKVLQYATILYRKFEDLGNAMRCALRLNDMDLIREIFLESGKVKKGSRNYGPAIQRQLAYLLGRQNIVFPDEECLADEDLTEMLWNTRLSEHFLSLGRELDIMDPKLPEDIYKSHLEAVRPTLNAATLDSARANLAASYVNGLVNCGFGKEKLLQETPKEVPWLCKQKEFGKMSTVATLGWVLLWDVDTGLSQLDKYLYSVEDHTRAGGLLGCGVVNCGVKNECDPALALLGSYVDSDKDVLSRAAIIGLGVAYAGSMKAEAISTLTPVILDTNTAKLQHACLAALSAGLISVGSLDGTVTSTIIQSLLERPASHWSNVFSKFMALGLGLTCLGRQEEVEVILASLEAVSEPMKSMAHMICDFCAYAGSGNVLKIQNLLHILSEKYEEKENTDKASSNTKTKEKKEKSSEARRGGGRGRNRRGGSTRPATTNDHGNGHNTDAPTAMDTTSQANEDTITSKETGVPQPIPMDTSNAEESTPQEDSTFDFHAHQGLAVLGVAIIAMGEEIGLDMAFRMFGHLLRFGELPIKRAVPLALALCYVSNPQLKVLDTLSKFSHDSDAELSHNSIIAMGIVGAGTNNARLAAMLRQLAVYHSRDPYNLFLVRLAQGLTHLGKGTLTLSPWHSDRFLCRPVGLAGLLILLTSCLDMRMTFMSRHDYLIFYITPAIQPRLLMTFDEDLKPSLVTVRVGQAVDVVGQAGRPKTITGFQTHTTPVLLSHGERAELATDEYLPITQLPLEGFILLRKNPEYEETNK
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.1	Very low	32.6	Very low	247 Å²	247	151.3 Å²	151.3	100%	1.217	87%	0.868	S	S	*	*				0	124.4	0	-77.6	-158.1	-168.9	0	0	109
2	G	31	Very low	32.5	Very low	68 Å²	68	153.2 Å²	153.2	70%	0.701	86%	0.864	S	S	*	*			trans	79.6	95.2	168.3	0	0	0	0	0	116
3	T	36.1	Very low	32.1	Very low	144 Å²	144	156.7 Å²	156.7	88%	0.883	87%	0.869	S	S	*	*				165.6	94.9	109.1	39	0	0	0	0	111.1	S5	T3-S5 PolarHBondContact O-N 3.06Å
4	D	29.5	Very low	32.1	Very low	162 Å²	162	154 Å²	154	87%	0.866	87%	0.866	S	S	*	*			trans	-55.6	123.8	144.3	-74.3	-46.6	0	0	0	108.2
5	S	33.9	Very low	31.9	Very low	119 Å²	119	147.7 Å²	147.7	83%	0.832	85%	0.85	S	S	*	*			trans	163.2	91.2	150.9	-75.6	0	0	0	0	112.9	T3	T3-S5 PolarHBondContact O-N 3.06Å
6	S	33.7	Very low	31.8	Very low	119 Å²	119	147 Å²	147	83%	0.832	85%	0.852	S	S	*	*			trans	-170.8	65.5	149	52.9	0	0	0	0	114.6
7	M	32.9	Very low	31.7	Very low	201 Å²	201	149.5 Å²	149.5	99%	0.99	85%	0.85	S	S	*	*			trans	-131.9	71	142.4	-83.7	-168.2	169.3	0	0	108.5
8	K	34.6	Very low	31.4	Very low	205 Å²	205	151.4 Å²	151.4	89%	0.891	85%	0.847	S	S	*	*			trans	-92.4	116.2	164.7	-98.5	-176.5	177.7	176.3	0	109.2
9	A	33.6	Very low	31.5	Very low	78 Å²	78	153.7 Å²	153.7	65%	0.645	85%	0.851	S	S	*	*			trans	60	94.8	133.9	0	0	0	0	0	118.2	E11	A9-E11 HydrophobicContact CB-CG 4.49Å
10	V	33.8	Very low	31.5	Very low	139 Å²	139	155.9 Å²	155.9	84%	0.842	85%	0.854	S	S	*	*			trans	-87.3	94.8	137	178.8	0	0	0	0	106.4	E12	V10-E12 PolarHBondContact O-N 3.24Å
11	E	28.4	Very low	31.5	Very low	182 Å²	182	153.6 Å²	153.6	85%	0.85	85%	0.845	S	S	*	*			trans	-82.3	95.3	163.9	-82.3	-177.2	163.6	0	0	108.5	A9	A9-E11 HydrophobicContact CB-CG 4.49Å
12	E	31.7	Very low	31.5	Very low	174 Å²	174	144.4 Å²	144.4	81%	0.813	81%	0.805	S	S	*	*			trans	-111.2	104.1	155.5	-84.7	-169.5	163.3	0	0	109.5	V10 S14	V10-E12 PolarHBondContact O-N 3.24Å; E12-S14 PolarHBondContact O-N 2.99Å
13	Q	27.7	Very low	31.9	Very low	199 Å²	199	151 Å²	151	93%	0.93	81%	0.814	S	S	*	*			trans	-3.2	110	155.5	-60.6	172.5	4.1	0	0	116.5
14	S	31.4	Very low	32.4	Very low	119 Å²	119	151.4 Å²	151.4	83%	0.832	81%	0.811	S	S	*	*			trans	-132.1	122.1	151.1	54.9	0	0	0	0	109.6	E12	E12-S14 PolarHBondContact O-N 2.99Å
15	G	28.8	Very low	33.3	Very low	60 Å²	60	149.9 Å²	149.9	62%	0.619	80%	0.803	S	S	*	*			trans	-66.2	166.6	-177.6	0	0	0	0	0	113.2	K17	G15-K17 PolarHBondContact O-N 3.31Å
16	P	30.2	Very low	34.3	Very low	136 Å²	136	148.2 Å²	148.2	88%	0.883	79%	0.785	S	S	*	*	S	Bend	trans	-75.6	97.5	-175	31.7	-31.7	0	0	0	109.2
17	K	30	Very low	35.9	Very low	189 Å²	189	145.5 Å²	145.5	82%	0.822	77%	0.766	S	S	*	*			trans	-144.7	103.6	169.7	-77.7	-172.1	178.7	170.3	0	112	G15	G15-K17 PolarHBondContact O-N 3.31Å
18	K	27.7	Very low	37.7	Very low	185 Å²	185	143.4 Å²	143.4	80%	0.804	75%	0.753	S	S	*	*			trans	68.5	91	142.3	-62	-179	172.8	-173.2	0	119.2
19	E	32.7	Very low	39.3	Very low	195 Å²	195	140.6 Å²	140.6	91%	0.911	74%	0.743	S	S	*	*			trans	-142.2	51	140.9	-71.7	-167.2	166.8	0	0	109.9
20	E	31.1	Very low	40.9	Very low	197 Å²	197	138.4 Å²	138.4	92%	0.921	72%	0.721	S	S	*	*			trans	-110	73.5	150.7	-81.8	-171.2	164.5	0	0	106.2
21	T	30.7	Very low	42.6	Very low	108 Å²	108	139.5 Å²	139.5	66%	0.663	71%	0.71	S	S	*	*			trans	-139.8	124.2	168.1	31	0	0	0	0	108
22	S	32.8	Very low	44.9	Very low	54 Å²	54	136.1 Å²	136.1	38%	0.378	69%	0.694	S	S	.	*			trans	65	87.3	154.7	38.3	0	0	0	0	119.1	D24 D25	S22-D24 PolarHBondContact O-N 3.24Å; S22-D25 WeakPolarHBondContact CB-OD2 3.41Å; S22-D25 PolarHBondContact O-N 2.54Å; S22-D25 PolarHBondContact OG-OD2 3.29Å
23	K	39.5	Very low	46.6	Very low	206 Å²	206	129.9 Å²	129.9	90%	0.896	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.1	-3.9	140.9	-83.4	-177.9	175.2	177.5	0	113.4
24	D	45.8	Very low	48.8	Very low	152 Å²	152	123.6 Å²	123.6	81%	0.813	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.9	1.2	178.3	-79.9	-30.3	0	0	0	114.7	S22	S22-D24 PolarHBondContact O-N 3.24Å
25	D	48	Very low	51.1	Low	131 Å²	131	121.9 Å²	121.9	70%	0.701	62%	0.618	S	S	*	*			trans	-104	17.4	-179.6	-80	-19.3	0	0	0	114	S22 S27	S22-D25 WeakPolarHBondContact CB-OD2 3.41Å; S22-D25 PolarHBondContact O-N 2.54Å; S22-D25 PolarHBondContact OG-OD2 3.29Å; D25-S27 PolarHBondContact O-N 2.97Å
26	L	55.2	Low	53.3	Low	84 Å²	84	124 Å²	124	44%	0.44	61%	0.612	S	S	.	*			trans	-70.7	117.3	167.8	-83.8	144.4	0	0	0	108.8	D30	L26-D30 HydrophobicContact CD2-CB 3.94Å
27	S	67.2	Low	55.5	Low	62 Å²	62	117.7 Å²	117.7	43%	0.434	57%	0.571	S	S	.	*			trans	-47.8	141.5	172.8	-175.3	0	0	0	0	110.5	D25 E29 D30 R31	D25-S27 PolarHBondContact O-N 2.97Å; S27-E29 PolarHBondContact O-N 3.3Å; S27-D30 PolarHBondContact O-N 2.88Å; S27-R31 PolarHBondContact O-N 3.06Å; S27-R31 VanDerWaalsContact O-N 3.11Å
28	E	70.2	Confident	57.8	Low	157 Å²	157	110.9 Å²	110.9	73%	0.734	54%	0.543	S	S	*	.	H	α-helix	trans	-52.7	-32.4	178.2	-75.3	-172.7	159.5	0	0	111.9	R31 Q32	E28-R31 PolarHBondContact O-N 3.11Å; E28-Q32 WeakPolarHBondContact O-CB 3.42Å; E28-Q32 WeakPolarHBondContact O-CG 3.36Å; E28-Q32 PolarHBondContact O-N 2.91Å
29	E	68.6	Low	60.2	Low	145 Å²	145	106.9 Å²	106.9	68%	0.678	53%	0.528	S	S	*	.	H	α-helix	trans	-65.8	-40.4	174.8	-62.9	179.6	169.3	0	0	113	S27 Q32 L33	S27-E29 PolarHBondContact O-N 3.3Å; E29-Q32 PolarHBondContact O-N 2.9Å; E29-L33 WeakPolarHBondContact O-CB 3.45Å; E29-L33 PolarHBondContact O-N 2.92Å
30	D	67	Low	62.1	Low	32 Å²	32	98 Å²	98	17%	0.171	49%	0.487	C	S	.	.	H	α-helix	trans	-71.1	-34.4	179	-77.8	-25.6	0	0	0	110.8	L26 S27 Q34 K75	L26-D30 HydrophobicContact CD2-CB 3.94Å; S27-D30 PolarHBondContact O-N 2.88Å; D30-Q34 PolarHBondContact O-N 3.48Å; D30-K75 VanDerWaalsContact CG-NZ 3.27Å; D30-K75 WeakPolarHBondContact OD1-CD 3.48Å; D30-K75 IonicContact OD1-NZ 3.54Å; D30-K75 PolarHBondContact OD1-NZ 2.79Å; D30-K75 IonicContact OD2-NZ 3.72Å; D30-K75 PolarHBondContact OD2-NZ 3.27Å
31	R	71	Confident	64.1	Low	163 Å²	163	88.6 Å²	88.6	62%	0.615	44%	0.444	S	S	*	.	H	α-helix	trans	-71.1	-42.4	174.9	-166	175.2	178.7	168	1.3	111.6	S27 E28 L33 Q34 D35	S27-R31 PolarHBondContact O-N 3.06Å; S27-R31 VanDerWaalsContact O-N 3.11Å; E28-R31 PolarHBondContact O-N 3.11Å; R31-L33 VanDerWaalsContact C-N 3.31Å; R31-L33 PolarHBondContact O-N 3.48Å; R31-Q34 PolarHBondContact O-N 3.3Å; R31-D35 WeakPolarHBondContact O-CB 3.36Å; R31-D35 VanDerWaalsContact O-CG 3.29Å; R31-D35 PolarHBondContact O-N 3.45Å
32	Q	74.7	Confident	66.3	Low	110 Å²	110	87.1 Å²	87.1	51%	0.514	43%	0.432	S	S	.	.	H	α-helix	trans	-58.8	-42.9	172	-76.1	169.3	21.4	0	0	111.3	E28 E29 D35 E36	E28-Q32 WeakPolarHBondContact O-CB 3.42Å; E28-Q32 WeakPolarHBondContact O-CG 3.36Å; E28-Q32 PolarHBondContact O-N 2.91Å; E29-Q32 PolarHBondContact O-N 2.9Å; Q32-D35 PolarHBondContact O-N 3.26Å; Q32-E36 WeakPolarHBondContact O-CB 3.32Å; Q32-E36 WeakPolarHBondContact O-CG 3.17Å; Q32-E36 PolarHBondContact O-N 3.39Å
33	L	68.9	Low	68.2	Low	43 Å²	43	90.2 Å²	90.2	23%	0.225	44%	0.435	C	S	.	.	H	α-helix	trans	-66.8	-38.9	178.5	-170.5	143.8	0	0	0	112.2	E29 R31 L37 P76 F79	E29-L33 WeakPolarHBondContact O-CB 3.45Å; E29-L33 PolarHBondContact O-N 2.92Å; R31-L33 VanDerWaalsContact C-N 3.31Å; R31-L33 PolarHBondContact O-N 3.48Å; L33-L37 HydrophobicContact CD2-CD1 3.64Å; L33-L37 HydrophobicContact CD2-CG 4.36Å; L33-L37 WeakPolarHBondContact O-CB 3.33Å; L33-L37 VanDerWaalsContact O-CG 3.26Å; L33-L37 WeakPolarHBondContact O-CG 3.36Å; L33-L37 PolarHBondContact O-N 2.82Å; L33-P76 HydrophobicContact CD1-CG 4.46Å; L33-P76 HydrophobicContact CD2-CG 4.12Å; L33-F79 HydrophobicContact CD2-CD2 3.86Å; L33-F79 HydrophobicContact CD2-CE2 4.13Å
34	Q	73.5	Confident	69.4	Low	67 Å²	67	81 Å²	81	31%	0.313	40%	0.395	S	S	.	.	H	α-helix	trans	-63.6	-42.8	172.6	-174.4	178.2	8.8	0	0	111.6	D30 R31 L37 N38 F79	D30-Q34 PolarHBondContact O-N 3.48Å; R31-Q34 PolarHBondContact O-N 3.3Å; Q34-L37 PolarHBondContact O-N 2.81Å; Q34-N38 WeakPolarHBondContact O-CB 3.47Å; Q34-N38 VanDerWaalsContact O-CG 3.24Å; Q34-N38 PolarHBondContact O-N 3.44Å; Q34-N38 PolarHBondContact O-ND2 3.43Å; Q34-F79 HydrophobicContact CG-CD1 4.44Å
35	D	78.7	Confident	70.5	Confident	83 Å²	83	78.1 Å²	78.1	44%	0.444	38%	0.377	S	S	.	.	H	α-helix	trans	-67.5	-40.2	178.3	-71.1	-21.6	0	0	0	111.3	R31 Q32 N38 M39	R31-D35 WeakPolarHBondContact O-CB 3.36Å; R31-D35 VanDerWaalsContact O-CG 3.29Å; R31-D35 PolarHBondContact O-N 3.45Å; Q32-D35 PolarHBondContact O-N 3.26Å; D35-N38 PolarHBondContact O-N 2.99Å; D35-M39 VanDerWaalsContact O-CB 3.29Å; D35-M39 WeakPolarHBondContact O-CB 3.43Å; D35-M39 WeakPolarHBondContact O-CG 3.41Å; D35-M39 PolarHBondContact O-N 3.44Å
36	E	76.7	Confident	71.7	Confident	105 Å²	105	76.4 Å²	76.4	49%	0.491	37%	0.365	S	S	.	.	H	α-helix	trans	-61.7	-44.6	173.8	-78.2	-176	178.8	0	0	111.9	Q32 M39 L40	Q32-E36 WeakPolarHBondContact O-CB 3.32Å; Q32-E36 WeakPolarHBondContact O-CG 3.17Å; Q32-E36 PolarHBondContact O-N 3.39Å; E36-M39 PolarHBondContact O-N 2.78Å; E36-L40 WeakPolarHBondContact O-CB 3.14Å; E36-L40 WeakPolarHBondContact O-CG 3.29Å; E36-L40 PolarHBondContact O-N 3.39Å
37	L	75.2	Confident	71.9	Confident	4 Å²	4	78.2 Å²	78.2	2%	0.021	38%	0.381	C	S	.	.	H	α-helix	trans	-65.9	-41.8	176.8	-70.6	173.9	0	0	0	111.8	L33 Q34 L40 V41 L62 P76 F79 L80	L33-L37 HydrophobicContact CD2-CD1 3.64Å; L33-L37 HydrophobicContact CD2-CG 4.36Å; L33-L37 WeakPolarHBondContact O-CB 3.33Å; L33-L37 VanDerWaalsContact O-CG 3.26Å; L33-L37 WeakPolarHBondContact O-CG 3.36Å; L33-L37 PolarHBondContact O-N 2.82Å; Q34-L37 PolarHBondContact O-N 2.81Å; L37-L40 PolarHBondContact O-N 2.92Å; L37-V41 WeakPolarHBondContact O-CG2 3.47Å; L37-V41 PolarHBondContact O-N 3.28Å; L37-L62 HydrophobicContact CD2-CD1 4.4Å; L37-P76 HydrophobicContact CD1-CB 4.23Å; L37-F79 HydrophobicContact CD1-CB 4.07Å; L37-F79 HydrophobicContact CD1-CD2 4.5Å; L37-L80 HydrophobicContact CD1-CG 4.27Å; L37-L80 HydrophobicContact CD2-CD1 4.31Å; L37-L80 HydrophobicContact CD2-CD2 4.24Å; L37-L80 HydrophobicContact CD2-CG 4.44Å
38	N	78.5	Confident	71.7	Confident	46 Å²	46	80 Å²	80	25%	0.246	39%	0.386	C	S	.	.	H	α-helix	trans	-63.7	-43.4	174.8	-73.1	-26	0	0	0	111.3	Q34 D35 L40 V41 D42 H83	Q34-N38 WeakPolarHBondContact O-CB 3.47Å; Q34-N38 VanDerWaalsContact O-CG 3.24Å; Q34-N38 PolarHBondContact O-N 3.44Å; Q34-N38 PolarHBondContact O-ND2 3.43Å; D35-N38 PolarHBondContact O-N 2.99Å; N38-L40 VanDerWaalsContact C-N 3.28Å; N38-L40 PolarHBondContact O-N 3.16Å; N38-V41 PolarHBondContact O-N 3.36Å; N38-V41 VanDerWaalsContact O-N 3.16Å; N38-D42 WeakPolarHBondContact O-CB 3.29Å; N38-D42 PolarHBondContact O-N 3.29Å; N38-H83 PolarHBondContact OD1-NE2 3Å
39	M	78.4	Confident	71.3	Confident	100 Å²	100	77.8 Å²	77.8	49%	0.493	38%	0.376	S	S	.	.	H	α-helix	trans	-61	-36.8	175	-75.6	-66	-59.3	0	0	112.2	D35 E36 R43	D35-M39 VanDerWaalsContact O-CB 3.29Å; D35-M39 WeakPolarHBondContact O-CB 3.43Å; D35-M39 WeakPolarHBondContact O-CG 3.41Å; D35-M39 PolarHBondContact O-N 3.44Å; E36-M39 PolarHBondContact O-N 2.78Å; M39-R43 WeakPolarHBondContact O-CB 3.15Å; M39-R43 WeakPolarHBondContact O-CD 3.4Å; M39-R43 WeakPolarHBondContact O-CG 3.37Å; M39-R43 PolarHBondContact O-N 3.34Å
40	L	71.7	Confident	71	Confident	8 Å²	8	79.3 Å²	79.3	4%	0.042	38%	0.383	C	S	.	.	H	α-helix	trans	-70.2	-38.7	175.2	-70.6	170.1	0	0	0	111.8	E36 L37 N38 R43 L44 A55 M59 L62	E36-L40 WeakPolarHBondContact O-CB 3.14Å; E36-L40 WeakPolarHBondContact O-CG 3.29Å; E36-L40 PolarHBondContact O-N 3.39Å; L37-L40 PolarHBondContact O-N 2.92Å; N38-L40 VanDerWaalsContact C-N 3.28Å; N38-L40 PolarHBondContact O-N 3.16Å; L40-R43 PolarHBondContact O-N 3.12Å; L40-L44 WeakPolarHBondContact O-CG 3.34Å; L40-L44 PolarHBondContact O-N 3.15Å; L40-L44 VanDerWaalsContact O-N 3.15Å; L40-A55 HydrophobicContact CD2-CB 4.23Å; L40-M59 HydrophobicContact CB-CG 4.04Å; L40-M59 HydrophobicContact CB-SD 4.33Å; L40-M59 HydrophobicContact CD1-CG 3.83Å; L40-M59 HydrophobicContact CG-CG 4.46Å; L40-L62 HydrophobicContact CD1-CD1 3.7Å
41	V	73.5	Confident	71.1	Confident	1 Å²	1	81.3 Å²	81.3	1%	0.006	39%	0.393	C	S	.	.	H	α-helix	trans	-67.2	-42.1	174.1	173.8	0	0	0	0	111.2	L37 N38 R43 L44 E45 L80 H83	L37-V41 WeakPolarHBondContact O-CG2 3.47Å; L37-V41 PolarHBondContact O-N 3.28Å; N38-V41 PolarHBondContact O-N 3.36Å; N38-V41 VanDerWaalsContact O-N 3.16Å; V41-R43 VanDerWaalsContact C-N 3.31Å; V41-R43 PolarHBondContact O-N 3.15Å; V41-L44 CarbonylContact O-C 3.48Å; V41-L44 WeakPolarHBondContact O-CA 3.38Å; V41-L44 VanDerWaalsContact O-CB 3.29Å; V41-L44 WeakPolarHBondContact O-CB 3.46Å; V41-L44 PolarHBondContact O-N 2.94Å; V41-E45 WeakPolarHBondContact O-CG 3Å; V41-E45 PolarHBondContact O-N 2.99Å; V41-E45 VanDerWaalsContact O-N 3.12Å; V41-L80 HydrophobicContact CG2-CD2 4.5Å; V41-H83 HydrophobicContact CG1-CB 4.46Å; V41-H83 HydrophobicContact CG2-CB 4.25Å
42	D	77.7	Confident	70.9	Confident	77 Å²	77	74.5 Å²	74.5	41%	0.412	37%	0.369	S	S	.	.	H	α-helix	trans	-63.7	-38.1	176.3	-68.5	-15.9	0	0	0	111.1	N38 L44 E45 E46	N38-D42 WeakPolarHBondContact O-CB 3.29Å; N38-D42 PolarHBondContact O-N 3.29Å; D42-L44 PolarHBondContact O-N 3Å; D42-E45 WeakPolarHBondContact O-CB 3.49Å; D42-E45 PolarHBondContact O-N 2.95Å; D42-E46 PolarHBondContact O-N 2.94Å
43	R	71.9	Confident	70.9	Confident	118 Å²	118	73.6 Å²	73.6	45%	0.445	36%	0.363	S	S	.	.	H	α-helix	trans	-65	-21.3	170.5	-75.5	171.4	-176	175.8	5.2	113.6	M39 L40 V41 A55	M39-R43 WeakPolarHBondContact O-CB 3.15Å; M39-R43 WeakPolarHBondContact O-CD 3.4Å; M39-R43 WeakPolarHBondContact O-CG 3.37Å; M39-R43 PolarHBondContact O-N 3.34Å; L40-R43 PolarHBondContact O-N 3.12Å; V41-R43 VanDerWaalsContact C-N 3.31Å; V41-R43 PolarHBondContact O-N 3.15Å; R43-A55 HydrophobicContact CB-CB 4.45Å
44	L	65.5	Low	71.4	Confident	12 Å²	12	75 Å²	75	6%	0.063	37%	0.374	C	S	.	.	H	α-helix	trans	-81.5	-22.6	170.3	-65.1	170.1	0	0	0	112.1	L40 V41 D42 H52 A55 L56 M59	L40-L44 WeakPolarHBondContact O-CG 3.34Å; L40-L44 PolarHBondContact O-N 3.15Å; L40-L44 VanDerWaalsContact O-N 3.15Å; V41-L44 CarbonylContact O-C 3.48Å; V41-L44 WeakPolarHBondContact O-CA 3.38Å; V41-L44 VanDerWaalsContact O-CB 3.29Å; V41-L44 WeakPolarHBondContact O-CB 3.46Å; V41-L44 PolarHBondContact O-N 2.94Å; D42-L44 PolarHBondContact O-N 3Å; L44-H52 HydrophobicContact CD2-CB 4.2Å; L44-H52 PolarHBondContact O-CE1 3.1Å; L44-A55 HydrophobicContact CD2-CB 4.12Å; L44-A55 HydrophobicContact CG-CB 4.46Å; L44-L56 HydrophobicContact CD1-CD2 4.17Å; L44-L56 HydrophobicContact CD2-CD2 4.09Å; L44-L56 HydrophobicContact CD2-CG 3.98Å; L44-M59 HydrophobicContact CD1-SD 3.81Å
45	E	68	Low	71.6	Confident	93 Å²	93	72 Å²	72	44%	0.435	36%	0.361	S	S	.	.	H	α-helix	trans	-77.9	-21.7	173.1	-46.4	-159.3	157.5	0	0	112.3	V41 D42 K86 F90	V41-E45 WeakPolarHBondContact O-CG 3Å; V41-E45 PolarHBondContact O-N 2.99Å; V41-E45 VanDerWaalsContact O-N 3.12Å; D42-E45 WeakPolarHBondContact O-CB 3.49Å; D42-E45 PolarHBondContact O-N 2.95Å; E45-K86 IonicContact OE1-NZ 3.24Å; E45-K86 PolarHBondContact OE1-NZ 2.82Å; E45-F90 HydrophobicContact CB-CE1 4.45Å; E45-F90 HydrophobicContact CB-CZ 3.91Å; E45-F90 HydrophobicContact CG-CE1 4.5Å; E45-F90 HydrophobicContact CG-CE2 3.97Å; E45-F90 HydrophobicContact CG-CZ 3.54Å
46	E	72.8	Confident	71.4	Confident	95 Å²	95	68.1 Å²	68.1	44%	0.444	34%	0.34	S	S	.	.	S	Bend	trans	-65.8	138.5	177.7	-72.9	-171.2	173.4	0	0	112.9	D42 N48 H52	D42-E46 PolarHBondContact O-N 2.94Å; E46-N48 PolarHBondContact O-N 3.1Å; E46-H52 PolarHBondContact O-CE1 3.08Å
47	P	60	Low	71.5	Confident	121 Å²	121	67.3 Å²	67.3	79%	0.786	34%	0.337	S	S	*	.	S	Bend	trans	-68.7	-4.6	-173.5	27.5	-35.8	0	0	0	115.3	Q49	P47-Q49 PolarHBondContact O-N 2.63Å
48	N	62.4	Low	71.7	Confident	100 Å²	100	69.7 Å²	69.7	54%	0.535	35%	0.353	S	S	.	.			trans	-85.8	103.2	-174.2	-83.5	-18.7	0	0	0	111.7	E46 E50 L51	E46-N48 PolarHBondContact O-N 3.1Å; N48-E50 PolarHBondContact O-N 3.31Å; N48-E50 VanDerWaalsContact O-N 3.08Å; N48-L51 HydrophobicContact CB-CD1 3.85Å; N48-L51 HydrophobicContact CB-CG 4.42Å; N48-L51 PolarHBondContact O-N 3.25Å; N48-L51 VanDerWaalsContact O-N 3.1Å
49	Q	62.4	Low	71.6	Confident	111 Å²	111	67.6 Å²	67.6	52%	0.519	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-19.3	-176	-69.2	177.5	-5.2	0	0	115.4	P47	P47-Q49 PolarHBondContact O-N 2.63Å
50	E	63.3	Low	71.4	Confident	176 Å²	176	63.3 Å²	63.3	82%	0.822	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-27.7	177.2	-66	-173.4	167.5	0	0	113	N48 P54	N48-E50 PolarHBondContact O-N 3.31Å; N48-E50 VanDerWaalsContact O-N 3.08Å; E50-P54 WeakPolarHBondContact O-CD 3.45Å
51	L	68.2	Low	71.7	Confident	75 Å²	75	67.3 Å²	67.3	39%	0.393	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-20.5	-178	-70.1	164.7	0	0	0	112.6	N48 K53 P54 A55	N48-L51 HydrophobicContact CB-CD1 3.85Å; N48-L51 HydrophobicContact CB-CG 4.42Å; N48-L51 PolarHBondContact O-N 3.25Å; N48-L51 VanDerWaalsContact O-N 3.1Å; L51-K53 VanDerWaalsContact C-N 3.34Å; L51-K53 PolarHBondContact O-N 2.97Å; L51-P54 WeakPolarHBondContact O-CD 3.48Å; L51-A55 WeakPolarHBondContact O-CB 3.23Å; L51-A55 PolarHBondContact O-N 3.04Å; L51-A55 VanDerWaalsContact O-N 3.16Å
52	H	67.3	Low	71.8	Confident	20 Å²	20	69.2 Å²	69.2	9%	0.093	36%	0.357	C	S	.	.	H	α-helix	trans	-64.5	-36.4	178.7	-62.1	-38.4	0	0	0	112.8	L44 E46 A55 L56 T99	L44-H52 HydrophobicContact CD2-CB 4.2Å; L44-H52 PolarHBondContact O-CE1 3.1Å; E46-H52 PolarHBondContact O-CE1 3.08Å; H52-A55 PolarHBondContact O-N 3.35Å; H52-L56 WeakPolarHBondContact O-CB 3.45Å; H52-L56 VanDerWaalsContact O-CG 3.25Å; H52-L56 WeakPolarHBondContact O-CG 3.34Å; H52-L56 PolarHBondContact O-N 3.34Å; H52-T99 HydrophobicContact CB-CG2 3.76Å
53	K	74.1	Confident	71.7	Confident	91 Å²	91	65.8 Å²	65.8	40%	0.396	34%	0.338	S	S	.	.	H	α-helix	trans	-67.3	-51.2	-178.4	178.9	177.6	-179.3	177.3	0	112.1	L51 A55 L56 E57 L102	L51-K53 VanDerWaalsContact C-N 3.34Å; L51-K53 PolarHBondContact O-N 2.97Å; K53-A55 VanDerWaalsContact C-N 3.31Å; K53-A55 PolarHBondContact O-N 3.09Å; K53-L56 PolarHBondContact O-N 2.73Å; K53-E57 WeakPolarHBondContact CE-OE1 3.47Å; K53-E57 WeakPolarHBondContact O-CB 3.47Å; K53-E57 WeakPolarHBondContact O-CG 3.47Å; K53-E57 PolarHBondContact O-N 3.01Å; K53-L102 HydrophobicContact CG-CD1 4.47Å
54	P	79.5	Confident	71.7	Confident	72 Å²	72	64.1 Å²	64.1	47%	0.468	33%	0.334	S	S	.	.	H	α-helix	trans	-60.6	-36.7	173.4	-24.5	33.5	0	0	0	113.7	E50 L51 S58	E50-P54 WeakPolarHBondContact O-CD 3.45Å; L51-P54 WeakPolarHBondContact O-CD 3.48Å; P54-S58 VanDerWaalsContact O-CB 3.3Å; P54-S58 WeakPolarHBondContact O-CB 3.25Å; P54-S58 PolarHBondContact O-N 3.01Å
55	A	77.8	Confident	72.1	Confident	4 Å²	4	66.7 Å²	66.7	3%	0.033	35%	0.353	C	S	.	.	H	α-helix	trans	-65.2	-46.5	178.2	0	0	0	0	0	111.6	L40 R43 L44 L51 H52 K53 S58 M59	L40-A55 HydrophobicContact CD2-CB 4.23Å; R43-A55 HydrophobicContact CB-CB 4.45Å; L44-A55 HydrophobicContact CD2-CB 4.12Å; L44-A55 HydrophobicContact CG-CB 4.46Å; L51-A55 WeakPolarHBondContact O-CB 3.23Å; L51-A55 PolarHBondContact O-N 3.04Å; L51-A55 VanDerWaalsContact O-N 3.16Å; H52-A55 PolarHBondContact O-N 3.35Å; K53-A55 VanDerWaalsContact C-N 3.31Å; K53-A55 PolarHBondContact O-N 3.09Å; A55-S58 PolarHBondContact O-N 3.4Å; A55-M59 WeakPolarHBondContact O-CG 3.43Å; A55-M59 PolarHBondContact O-N 2.97Å
56	L	74.9	Confident	72	Confident	1 Å²	1	63.7 Å²	63.7	1%	0.005	34%	0.343	C	S	.	.	H	α-helix	trans	-66.2	-39.6	176.2	-70.4	171.5	0	0	0	112.1	L44 H52 K53 M59 C60 T99 L102 C103 V106	L44-L56 HydrophobicContact CD1-CD2 4.17Å; L44-L56 HydrophobicContact CD2-CD2 4.09Å; L44-L56 HydrophobicContact CD2-CG 3.98Å; H52-L56 WeakPolarHBondContact O-CB 3.45Å; H52-L56 VanDerWaalsContact O-CG 3.25Å; H52-L56 WeakPolarHBondContact O-CG 3.34Å; H52-L56 PolarHBondContact O-N 3.34Å; K53-L56 PolarHBondContact O-N 2.73Å; L56-M59 PolarHBondContact O-N 3.42Å; L56-C60 WeakPolarHBondContact O-CB 3.26Å; L56-C60 PolarHBondContact O-N 3.48Å; L56-C60 PolarHBondContact O-SG 2.96Å; L56-T99 HydrophobicContact CD1-CG2 3.69Å; L56-L102 HydrophobicContact CD1-CB 4.44Å; L56-C103 HydrophobicContact CD1-CB 3.92Å; L56-V106 HydrophobicContact CD2-CG2 4.3Å
57	E	78.6	Confident	71.6	Confident	89 Å²	89	60.7 Å²	60.7	42%	0.416	33%	0.331	S	S	.	.	H	α-helix	trans	-63.3	-41.5	174.4	-75.6	174.1	-176.3	0	0	111.6	K53 C60 T61 L102	K53-E57 WeakPolarHBondContact CE-OE1 3.47Å; K53-E57 WeakPolarHBondContact O-CB 3.47Å; K53-E57 WeakPolarHBondContact O-CG 3.47Å; K53-E57 PolarHBondContact O-N 3.01Å; E57-C60 WeakPolarHBondContact O-CB 3.22Å; E57-C60 PolarHBondContact O-N 3.39Å; E57-T61 PolarHBondContact O-N 2.93Å; E57-T61 PolarHBondContact O-OG1 3.48Å; E57-T61 VanDerWaalsContact O-OG1 3.1Å; E57-L102 HydrophobicContact CG-CD1 4.49Å
58	S	79.6	Confident	71.7	Confident	53 Å²	53	60.5 Å²	60.5	37%	0.371	33%	0.328	S	S	.	.	H	α-helix	trans	-63.6	-42.8	174.5	-167.6	0	0	0	0	111.7	P54 A55 T61 L62	P54-S58 VanDerWaalsContact O-CB 3.3Å; P54-S58 WeakPolarHBondContact O-CB 3.25Å; P54-S58 PolarHBondContact O-N 3.01Å; A55-S58 PolarHBondContact O-N 3.4Å; S58-T61 PolarHBondContact O-N 2.91Å; S58-L62 WeakPolarHBondContact O-CB 3.35Å; S58-L62 VanDerWaalsContact O-CG 3.27Å; S58-L62 WeakPolarHBondContact O-CG 3.38Å; S58-L62 PolarHBondContact O-N 3.14Å
59	M	75.9	Confident	71.4	Confident	2 Å²	2	59.1 Å²	59.1	1%	0.01	33%	0.326	C	S	.	.	H	α-helix	trans	-61.8	-45.5	174.3	-73.7	-179.5	68.9	0	0	111.5	L40 L44 A55 L56 T61 L62 I63 L80 I87 V106	L40-M59 HydrophobicContact CB-CG 4.04Å; L40-M59 HydrophobicContact CB-SD 4.33Å; L40-M59 HydrophobicContact CD1-CG 3.83Å; L40-M59 HydrophobicContact CG-CG 4.46Å; L44-M59 HydrophobicContact CD1-SD 3.81Å; A55-M59 WeakPolarHBondContact O-CG 3.43Å; A55-M59 PolarHBondContact O-N 2.97Å; L56-M59 PolarHBondContact O-N 3.42Å; M59-T61 PolarHBondContact O-N 3.32Å; M59-L62 PolarHBondContact O-N 3.16Å; M59-I63 VanDerWaalsContact O-CG1 3.3Å; M59-I63 WeakPolarHBondContact O-CG1 3.25Å; M59-I63 PolarHBondContact O-N 3.23Å; M59-L80 HydrophobicContact CE-CD1 4.47Å; M59-L80 HydrophobicContact CE-CD2 3.87Å; M59-I87 HydrophobicContact CE-CD1 4.48Å; M59-V106 HydrophobicContact CE-CG1 4.07Å
60	C	73.8	Confident	71	Confident	10 Å²	10	61.4 Å²	61.4	7%	0.068	34%	0.338	C	S	.	.	H	α-helix	trans	-57.7	-46.6	175.3	-75.5	0	0	0	0	111.7	L56 E57 I63 K64 V106 W139	L56-C60 WeakPolarHBondContact O-CB 3.26Å; L56-C60 PolarHBondContact O-N 3.48Å; L56-C60 PolarHBondContact O-SG 2.96Å; E57-C60 WeakPolarHBondContact O-CB 3.22Å; E57-C60 PolarHBondContact O-N 3.39Å; C60-I63 PolarHBondContact O-N 3.26Å; C60-K64 WeakPolarHBondContact O-CB 3.42Å; C60-K64 WeakPolarHBondContact O-CG 3.37Å; C60-K64 PolarHBondContact O-N 2.94Å; C60-V106 WeakPolarHBondContact SG-CG2 3.22Å; C60-W139 HydrophobicContact CB-CH2 3.95Å
61	T	79	Confident	70.7	Confident	92 Å²	92	59.1 Å²	59.1	56%	0.564	34%	0.337	S	S	*	.	H	α-helix	trans	-65.7	-38.9	179.5	-62.2	0	0	0	0	111.8	E57 S58 M59 K64 S65	E57-T61 PolarHBondContact O-N 2.93Å; E57-T61 PolarHBondContact O-OG1 3.48Å; E57-T61 VanDerWaalsContact O-OG1 3.1Å; S58-T61 PolarHBondContact O-N 2.91Å; M59-T61 PolarHBondContact O-N 3.32Å; T61-K64 PolarHBondContact O-N 2.94Å; T61-S65 WeakPolarHBondContact O-CB 3.1Å; T61-S65 PolarHBondContact O-N 3.2Å; T61-S65 PolarHBondContact O-OG 2.95Å
62	L	75.6	Confident	70.1	Confident	41 Å²	41	59.3 Å²	59.3	22%	0.215	34%	0.344	C	S	.	.	H	α-helix	trans	-65.3	-38.6	175.6	-73.8	169.5	0	0	0	112.5	L37 L40 S58 M59 S65 S66	L37-L62 HydrophobicContact CD2-CD1 4.4Å; L40-L62 HydrophobicContact CD1-CD1 3.7Å; S58-L62 WeakPolarHBondContact O-CB 3.35Å; S58-L62 VanDerWaalsContact O-CG 3.27Å; S58-L62 WeakPolarHBondContact O-CG 3.38Å; S58-L62 PolarHBondContact O-N 3.14Å; M59-L62 PolarHBondContact O-N 3.16Å; L62-S65 PolarHBondContact O-OG 2.72Å; L62-S66 WeakPolarHBondContact O-CB 3.44Å; L62-S66 PolarHBondContact O-N 3.49Å; L62-S66 PolarHBondContact O-OG 3.17Å
63	I	74.5	Confident	69.6	Low	5 Å²	5	62 Å²	62	3%	0.026	36%	0.362	C	S	.	.	H	α-helix	trans	-68.6	-49.6	174.7	-64.3	163.8	0	0	0	109.6	M59 C60 S65 S66 T67 V109 W139	M59-I63 VanDerWaalsContact O-CG1 3.3Å; M59-I63 WeakPolarHBondContact O-CG1 3.25Å; M59-I63 PolarHBondContact O-N 3.23Å; C60-I63 PolarHBondContact O-N 3.26Å; I63-S65 VanDerWaalsContact C-N 3.32Å; I63-S65 PolarHBondContact O-N 3.14Å; I63-S66 PolarHBondContact O-N 3.49Å; I63-S66 VanDerWaalsContact O-N 3.1Å; I63-T67 PolarHBondContact O-N 3.3Å; I63-T67 PolarHBondContact O-OG1 3.43Å; I63-V109 HydrophobicContact CD1-CG1 4.39Å; I63-V109 HydrophobicContact CG2-CG1 3.98Å; I63-W139 HydrophobicContact CB-CZ3 3.83Å; I63-W139 HydrophobicContact CD1-CZ3 4.22Å; I63-W139 HydrophobicContact CG2-CE3 3.83Å; I63-W139 HydrophobicContact CG2-CZ3 3.59Å
64	K	72.2	Confident	69	Low	83 Å²	83	58.3 Å²	58.3	36%	0.361	35%	0.347	S	S	.	.	H	α-helix	trans	-59	-39.8	179.7	-72.6	176.6	-178.4	-175.9	0	112.9	C60 T61 S66 W139	C60-K64 WeakPolarHBondContact O-CB 3.42Å; C60-K64 WeakPolarHBondContact O-CG 3.37Å; C60-K64 PolarHBondContact O-N 2.94Å; T61-K64 PolarHBondContact O-N 2.94Å; K64-S66 VanDerWaalsContact C-N 3.34Å; K64-W139 HydrophobicContact CG-CE3 4.28Å; K64-W139 HydrophobicContact CG-CZ3 4.29Å
65	S	73.9	Confident	68.3	Low	66 Å²	66	59.9 Å²	59.9	46%	0.462	35%	0.347	S	S	.	.	H	α-helix	trans	-66.9	-38.1	176.8	64.4	0	0	0	0	111.8	T61 L62 I63 T68	T61-S65 WeakPolarHBondContact O-CB 3.1Å; T61-S65 PolarHBondContact O-N 3.2Å; T61-S65 PolarHBondContact O-OG 2.95Å; L62-S65 PolarHBondContact O-OG 2.72Å; I63-S65 VanDerWaalsContact C-N 3.32Å; I63-S65 PolarHBondContact O-N 3.14Å; S65-T68 PolarHBondContact O-OG1 3.45Å
66	S	67.3	Low	67.7	Low	31 Å²	31	60.1 Å²	60.1	22%	0.217	35%	0.348	C	S	.	.	H	α-helix	trans	-76.3	-30.2	-177.9	-57.4	0	0	0	0	113.6	L62 I63 K64 T68 S69	L62-S66 WeakPolarHBondContact O-CB 3.44Å; L62-S66 PolarHBondContact O-N 3.49Å; L62-S66 PolarHBondContact O-OG 3.17Å; I63-S66 PolarHBondContact O-N 3.49Å; I63-S66 VanDerWaalsContact O-N 3.1Å; K64-S66 VanDerWaalsContact C-N 3.34Å; S66-T68 PolarHBondContact O-N 2.92Å; S66-S69 PolarHBondContact O-OG 2.91Å
67	T	62.8	Low	67.1	Low	32 Å²	32	60.4 Å²	60.4	20%	0.196	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-7.6	-177.3	-49.3	0	0	0	0	113.8	I63 S69 W139	I63-T67 PolarHBondContact O-N 3.3Å; I63-T67 PolarHBondContact O-OG1 3.43Å; T67-S69 PolarHBondContact O-N 3.25Å; T67-S69 VanDerWaalsContact O-N 3.11Å; T67-W139 WeakPolarHBondContact CG2-O 3.23Å
68	T	61.9	Low	66.6	Low	116 Å²	116	62.5 Å²	62.5	71%	0.712	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-13.4	177.6	58	0	0	0	0	113.9	S65 S66 M70	S65-T68 PolarHBondContact O-OG1 3.45Å; S66-T68 PolarHBondContact O-N 2.92Å; T68-M70 PolarHBondContact O-N 3.45Å
69	S	56.3	Low	66	Low	71 Å²	71	62 Å²	62	50%	0.497	35%	0.349	S	S	.	.			trans	-96.8	94.2	-179.1	-11.4	0	0	0	0	111.7	S66 T67 T71	S66-S69 PolarHBondContact O-OG 2.91Å; T67-S69 PolarHBondContact O-N 3.25Å; T67-S69 VanDerWaalsContact O-N 3.11Å; S69-T71 PolarHBondContact O-N 3.26Å
70	M	55	Low	65.5	Low	159 Å²	159	62 Å²	62	78%	0.783	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	7.8	-175.3	-123	-178	-178.5	0	0	118.7	T68	T68-M70 PolarHBondContact O-N 3.45Å
71	T	56	Low	64.9	Low	129 Å²	129	66.1 Å²	66.1	79%	0.791	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.4	-7.6	-161.7	53.1	0	0	0	0	116.6	S69	S69-T71 PolarHBondContact O-N 3.26Å
72	S	57	Low	64.3	Low	78 Å²	78	68.8 Å²	68.8	55%	0.545	37%	0.374	S	S	.	.	S	Bend	trans	-154.3	129.9	178.3	58.4	0	0	0	0	111.5	P74	S72-P74 VanDerWaalsContact O-CD 3.28Å; S72-P74 WeakPolarHBondContact O-CD 3.37Å
73	V	56	Low	63.8	Low	77 Å²	77	67.9 Å²	67.9	47%	0.467	37%	0.368	S	S	.	.			trans	-44.6	115.1	173.5	178.9	0	0	0	0	109.2	K75 L77	V73-K75 PolarHBondContact O-N 3.09Å; V73-L77 HydrophobicContact CG1-CB 4.42Å; V73-L77 HydrophobicContact CG1-CD1 4.27Å
74	P	61.4	Low	63.5	Low	14 Å²	14	68.2 Å²	68.2	9%	0.091	37%	0.369	C	S	.	.			trans	-49.8	127.8	-174.4	-29.3	28.9	0	0	0	112	S72 P76 L77	S72-P74 VanDerWaalsContact O-CD 3.28Å; S72-P74 WeakPolarHBondContact O-CD 3.37Å; P74-P76 HydrophobicContact CB-CG 4.41Å; P74-P76 VanDerWaalsContact O-N 3.15Å; P74-L77 HydrophobicContact CB-CD1 3.97Å; P74-L77 HydrophobicContact CB-CG 4.41Å; P74-L77 HydrophobicContact CG-CD1 3.82Å; P74-L77 WeakPolarHBondContact O-CB 3.44Å; P74-L77 PolarHBondContact O-N 3.24Å
75	K	65	Low	63.2	Low	104 Å²	104	68 Å²	68	45%	0.452	38%	0.383	S	S	.	.	H	α-helix	trans	-49.5	-35	172.2	-62.3	-177.6	-176.4	177.8	0	113.5	D30 V73 L77 K78 F79	D30-K75 VanDerWaalsContact CG-NZ 3.27Å; D30-K75 WeakPolarHBondContact OD1-CD 3.48Å; D30-K75 IonicContact OD1-NZ 3.54Å; D30-K75 PolarHBondContact OD1-NZ 2.79Å; D30-K75 IonicContact OD2-NZ 3.72Å; D30-K75 PolarHBondContact OD2-NZ 3.27Å; V73-K75 PolarHBondContact O-N 3.09Å; K75-L77 VanDerWaalsContact C-N 3.26Å; K75-L77 PolarHBondContact O-N 2.96Å; K75-K78 WeakPolarHBondContact O-CB 3.27Å; K75-K78 PolarHBondContact O-N 3.37Å; K75-K78 VanDerWaalsContact O-N 3.09Å; K75-F79 HydrophobicContact CB-CE2 4.16Å; K75-F79 VanDerWaalsContact O-CD2 3.23Å; K75-F79 WeakPolarHBondContact O-CD2 3.3Å; K75-F79 PolarHBondContact O-N 3.5Å
76	P	64.7	Low	62.9	Low	9 Å²	9	68.9 Å²	68.9	6%	0.058	38%	0.378	C	S	.	.	H	α-helix	trans	-53.7	-37.5	171.9	-27.5	33.3	0	0	0	114.5	L33 L37 P74 K78 F79 L80	L33-P76 HydrophobicContact CD1-CG 4.46Å; L33-P76 HydrophobicContact CD2-CG 4.12Å; L37-P76 HydrophobicContact CD1-CB 4.23Å; P74-P76 HydrophobicContact CB-CG 4.41Å; P74-P76 VanDerWaalsContact O-N 3.15Å; P76-K78 PolarHBondContact O-N 2.85Å; P76-F79 PolarHBondContact O-N 3.35Å; P76-L80 WeakPolarHBondContact O-CB 3.5Å; P76-L80 WeakPolarHBondContact O-CD1 3.33Å; P76-L80 VanDerWaalsContact O-CG 3.25Å; P76-L80 WeakPolarHBondContact O-CG 3.3Å; P76-L80 PolarHBondContact O-N 3.33Å
77	L	63.3	Low	63	Low	7 Å²	7	67.5 Å²	67.5	4%	0.037	37%	0.369	C	S	.	.	H	α-helix	trans	-66.8	-37.1	178.4	-74.8	158.9	0	0	0	111.5	V73 P74 K75 F79 L80 M81 T113	V73-L77 HydrophobicContact CG1-CB 4.42Å; V73-L77 HydrophobicContact CG1-CD1 4.27Å; P74-L77 HydrophobicContact CB-CD1 3.97Å; P74-L77 HydrophobicContact CB-CG 4.41Å; P74-L77 HydrophobicContact CG-CD1 3.82Å; P74-L77 WeakPolarHBondContact O-CB 3.44Å; P74-L77 PolarHBondContact O-N 3.24Å; K75-L77 VanDerWaalsContact C-N 3.26Å; K75-L77 PolarHBondContact O-N 2.96Å; L77-F79 VanDerWaalsContact C-N 3.34Å; L77-F79 PolarHBondContact O-N 3.45Å; L77-L80 PolarHBondContact O-N 2.91Å; L77-M81 PolarHBondContact O-N 3.24Å; L77-M81 VanDerWaalsContact O-N 3.14Å; L77-T113 HydrophobicContact CB-CG2 3.81Å; L77-T113 HydrophobicContact CD2-CG2 3.79Å; L77-T113 HydrophobicContact CG-CG2 4.31Å
78	K	68.1	Low	63.3	Low	134 Å²	134	68.8 Å²	68.8	58%	0.583	37%	0.371	S	S	*	.	H	α-helix	trans	-63.7	-39.9	175.4	-64.5	-175.5	179.5	-179.8	0	111.9	K75 P76 M81	K75-K78 WeakPolarHBondContact O-CB 3.27Å; K75-K78 PolarHBondContact O-N 3.37Å; K75-K78 VanDerWaalsContact O-N 3.09Å; P76-K78 PolarHBondContact O-N 2.85Å; K78-M81 WeakPolarHBondContact O-CB 3.46Å
79	F	65.5	Low	63.6	Low	43 Å²	43	66.2 Å²	66.2	19%	0.189	36%	0.358	C	S	.	.	H	α-helix	trans	-75	-33.4	179.2	-60.9	-49.8	0	0	0	112.8	L33 Q34 L37 K75 P76 L77 M81	L33-F79 HydrophobicContact CD2-CD2 3.86Å; L33-F79 HydrophobicContact CD2-CE2 4.13Å; Q34-F79 HydrophobicContact CG-CD1 4.44Å; L37-F79 HydrophobicContact CD1-CB 4.07Å; L37-F79 HydrophobicContact CD1-CD2 4.5Å; K75-F79 HydrophobicContact CB-CE2 4.16Å; K75-F79 VanDerWaalsContact O-CD2 3.23Å; K75-F79 WeakPolarHBondContact O-CD2 3.3Å; K75-F79 PolarHBondContact O-N 3.5Å; P76-F79 PolarHBondContact O-N 3.35Å; L77-F79 VanDerWaalsContact C-N 3.34Å; L77-F79 PolarHBondContact O-N 3.45Å; F79-M81 VanDerWaalsContact C-N 3.33Å
80	L	66.2	Low	63.8	Low	1 Å²	1	64.8 Å²	64.8	1%	0.005	34%	0.343	C	S	.	.	H	α-helix	trans	-76.8	-16.5	178.1	-69.1	166.3	0	0	0	113.9	L37 V41 M59 P76 L77 H82 H83 Y84 L110	L37-L80 HydrophobicContact CD1-CG 4.27Å; L37-L80 HydrophobicContact CD2-CD1 4.31Å; L37-L80 HydrophobicContact CD2-CD2 4.24Å; L37-L80 HydrophobicContact CD2-CG 4.44Å; V41-L80 HydrophobicContact CG2-CD2 4.5Å; M59-L80 HydrophobicContact CE-CD1 4.47Å; M59-L80 HydrophobicContact CE-CD2 3.87Å; P76-L80 WeakPolarHBondContact O-CB 3.5Å; P76-L80 WeakPolarHBondContact O-CD1 3.33Å; P76-L80 VanDerWaalsContact O-CG 3.25Å; P76-L80 WeakPolarHBondContact O-CG 3.3Å; P76-L80 PolarHBondContact O-N 3.33Å; L77-L80 PolarHBondContact O-N 2.91Å; L80-H82 PolarHBondContact O-N 3.35Å; L80-H83 PolarHBondContact O-N 2.89Å; L80-Y84 PolarHBondContact O-N 3.1Å; L80-L110 HydrophobicContact CB-CD2 3.39Å; L80-L110 HydrophobicContact CD1-CD2 3.8Å; L80-L110 HydrophobicContact CG-CD2 4.13Å
81	M	61.3	Low	64.3	Low	96 Å²	96	58 Å²	58	47%	0.473	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-53.8	-39.1	176.7	-171	-179.1	72.3	0	0	112.7	L77 K78 F79 H83	L77-M81 PolarHBondContact O-N 3.24Å; L77-M81 VanDerWaalsContact O-N 3.14Å; K78-M81 WeakPolarHBondContact O-CB 3.46Å; F79-M81 VanDerWaalsContact C-N 3.33Å; M81-H83 PolarHBondContact O-N 2.9Å
82	H	66.2	Low	64.8	Low	149 Å²	149	57.7 Å²	57.7	69%	0.69	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-69.6	-20.9	178.4	-66.6	-58.3	0	0	0	113.6	L80	L80-H82 PolarHBondContact O-N 3.35Å
83	H	66	Low	65.3	Low	22 Å²	22	58.4 Å²	58.4	10%	0.102	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-99.9	-6.5	-176.1	-64.9	-62.2	0	0	0	113.5	N38 V41 L80 M81 A85 K86 I87	N38-H83 PolarHBondContact OD1-NE2 3Å; V41-H83 HydrophobicContact CG1-CB 4.46Å; V41-H83 HydrophobicContact CG2-CB 4.25Å; L80-H83 PolarHBondContact O-N 2.89Å; M81-H83 PolarHBondContact O-N 2.9Å; H83-A85 PolarHBondContact O-N 2.93Å; H83-K86 WeakPolarHBondContact O-CA 3.4Å; H83-K86 WeakPolarHBondContact O-CB 3.48Å; H83-K86 PolarHBondContact O-N 2.75Å; H83-I87 HydrophobicContact CB-CD1 4.26Å; H83-I87 WeakPolarHBondContact O-CG1 3.45Å; H83-I87 PolarHBondContact O-N 3.26Å
84	Y	66.8	Low	65.6	Low	12 Å²	12	55.8 Å²	55.8	5%	0.047	29%	0.287	C	S	.	.	H	α-helix	trans	-53.9	-47.4	-177.2	-178.6	-104.6	0	0	0	113.6	L80 K86 I87 K88 V107 L110 V114 T120 D123	L80-Y84 PolarHBondContact O-N 3.1Å; Y84-K86 VanDerWaalsContact C-N 3.25Å; Y84-K86 PolarHBondContact O-N 3.37Å; Y84-I87 PolarHBondContact O-N 3.39Å; Y84-K88 PolarHBondContact O-N 2.91Å; Y84-V107 HydrophobicContact CE2-CG1 4.29Å; Y84-L110 HydrophobicContact CD2-CB 3.79Å; Y84-L110 HydrophobicContact CE2-CB 4.13Å; Y84-V114 HydrophobicContact CD1-CB 4.06Å; Y84-V114 HydrophobicContact CD1-CG1 4.02Å; Y84-V114 HydrophobicContact CD1-CG2 3.75Å; Y84-V114 HydrophobicContact CD2-CG2 4.22Å; Y84-V114 HydrophobicContact CE1-CB 4.08Å; Y84-V114 HydrophobicContact CE1-CG1 4.08Å; Y84-V114 HydrophobicContact CE1-CG2 4.25Å; Y84-V114 HydrophobicContact CG-CB 4.44Å; Y84-V114 HydrophobicContact CG-CG2 3.72Å; Y84-T120 HydrophobicContact CE1-CG2 4.28Å; Y84-D123 WeakPolarHBondContact OH-CB 3.17Å; Y84-D123 PolarHBondContact OH-OD2 3.35Å
85	A	67.4	Low	65.7	Low	78 Å²	78	64.8 Å²	64.8	65%	0.645	32%	0.32	S	S	*	.	H	α-helix	trans	-61.9	-35.1	178.5	0	0	0	0	0	112.3	H83 S89	H83-A85 PolarHBondContact O-N 2.93Å; A85-S89 PolarHBondContact O-N 3.46Å
86	K	67.5	Low	65.8	Low	85 Å²	85	63.1 Å²	63.1	37%	0.37	32%	0.316	S	S	.	.	H	α-helix	trans	-68.3	-47.5	175.6	-61.2	-175.1	171.4	-164.1	0	110.5	E45 H83 Y84 K88 S89 F90	E45-K86 IonicContact OE1-NZ 3.24Å; E45-K86 PolarHBondContact OE1-NZ 2.82Å; H83-K86 WeakPolarHBondContact O-CA 3.4Å; H83-K86 WeakPolarHBondContact O-CB 3.48Å; H83-K86 PolarHBondContact O-N 2.75Å; Y84-K86 VanDerWaalsContact C-N 3.25Å; Y84-K86 PolarHBondContact O-N 3.37Å; K86-K88 VanDerWaalsContact C-N 3.3Å; K86-K88 PolarHBondContact O-N 3.46Å; K86-S89 WeakPolarHBondContact O-CA 3.4Å; K86-S89 WeakPolarHBondContact O-CB 3.44Å; K86-S89 PolarHBondContact O-N 2.83Å; K86-S89 PolarHBondContact O-OG 3.48Å; K86-F90 HydrophobicContact CB-CD2 4.4Å; K86-F90 HydrophobicContact CB-CE2 4.13Å; K86-F90 WeakPolarHBondContact O-CD2 3.44Å; K86-F90 PolarHBondContact O-N 3.37Å
87	I	69.3	Low	66	Low	2 Å²	2	66.5 Å²	66.5	1%	0.01	34%	0.339	C	S	.	.	H	α-helix	trans	-63.4	-36.1	-179.4	-59.8	168.3	0	0	0	111.1	M59 H83 Y84 S89 F90 Y91 V107 L110	M59-I87 HydrophobicContact CE-CD1 4.48Å; H83-I87 HydrophobicContact CB-CD1 4.26Å; H83-I87 WeakPolarHBondContact O-CG1 3.45Å; H83-I87 PolarHBondContact O-N 3.26Å; Y84-I87 PolarHBondContact O-N 3.39Å; I87-S89 VanDerWaalsContact C-N 3.34Å; I87-S89 PolarHBondContact O-N 3.42Å; I87-F90 WeakPolarHBondContact O-CB 3.33Å; I87-F90 PolarHBondContact O-N 2.94Å; I87-F90 VanDerWaalsContact O-N 3.14Å; I87-Y91 PolarHBondContact O-N 3.39Å; I87-V107 HydrophobicContact CG2-CG2 3.48Å; I87-V107 VanDerWaalsContact CG2-CG2 3.48Å; I87-L110 HydrophobicContact CD1-CD1 3.42Å; I87-L110 VanDerWaalsContact CD1-CD1 3.42Å; I87-L110 HydrophobicContact CG2-CD1 4.45Å
88	K	67.9	Low	66.2	Low	58 Å²	58	70.4 Å²	70.4	25%	0.252	36%	0.359	S	S	.	.	H	α-helix	trans	-62.2	-38.9	172.5	-168.9	168.6	-174.7	165.1	0	112.3	Y84 K86 Y91 D123	Y84-K88 PolarHBondContact O-N 2.91Å; K86-K88 VanDerWaalsContact C-N 3.3Å; K86-K88 PolarHBondContact O-N 3.46Å; K88-Y91 PolarHBondContact O-N 2.81Å; K88-D123 IonicContact NZ-OD1 2.96Å; K88-D123 PolarHBondContact NZ-OD1 3.18Å; K88-D123 IonicContact NZ-OD2 2.73Å; K88-D123 PolarHBondContact NZ-OD2 2.83Å
89	S	68.1	Low	66.2	Low	62 Å²	62	64.2 Å²	64.2	43%	0.434	33%	0.333	S	S	.	.	H	α-helix	trans	-68.4	-33.9	173.4	76.4	0	0	0	0	112.7	A85 K86 I87 N92 T93	A85-S89 PolarHBondContact O-N 3.46Å; K86-S89 WeakPolarHBondContact O-CA 3.4Å; K86-S89 WeakPolarHBondContact O-CB 3.44Å; K86-S89 PolarHBondContact O-N 2.83Å; K86-S89 PolarHBondContact O-OG 3.48Å; I87-S89 VanDerWaalsContact C-N 3.34Å; I87-S89 PolarHBondContact O-N 3.42Å; S89-N92 PolarHBondContact O-N 3.46Å; S89-T93 PolarHBondContact O-OG1 3.41Å; S89-T93 VanDerWaalsContact O-OG1 3.09Å
90	F	60.7	Low	66.6	Low	42 Å²	42	65.7 Å²	65.7	18%	0.184	34%	0.339	C	S	.	.	H	α-helix	trans	-68.5	-36.9	175.4	-75.3	-64.4	0	0	0	112.8	E45 K86 I87 N92 T93 I94	E45-F90 HydrophobicContact CB-CE1 4.45Å; E45-F90 HydrophobicContact CB-CZ 3.91Å; E45-F90 HydrophobicContact CG-CE1 4.5Å; E45-F90 HydrophobicContact CG-CE2 3.97Å; E45-F90 HydrophobicContact CG-CZ 3.54Å; K86-F90 HydrophobicContact CB-CD2 4.4Å; K86-F90 HydrophobicContact CB-CE2 4.13Å; K86-F90 WeakPolarHBondContact O-CD2 3.44Å; K86-F90 PolarHBondContact O-N 3.37Å; I87-F90 WeakPolarHBondContact O-CB 3.33Å; I87-F90 PolarHBondContact O-N 2.94Å; I87-F90 VanDerWaalsContact O-N 3.14Å; F90-N92 PolarHBondContact O-N 2.85Å; F90-T93 PolarHBondContact O-N 3.35Å; F90-I94 WeakPolarHBondContact O-CG1 3.13Å; F90-I94 PolarHBondContact O-N 3.45Å
91	Y	65.4	Low	67	Low	16 Å²	16	69.8 Å²	69.8	6%	0.063	36%	0.357	C	S	.	.	H	α-helix	trans	-55	-35.8	175.6	-178.4	-98.7	0	0	0	113	I87 K88 T93 K100 A104 Y127 L130	I87-Y91 PolarHBondContact O-N 3.39Å; K88-Y91 PolarHBondContact O-N 2.81Å; Y91-T93 VanDerWaalsContact C-N 3.33Å; Y91-K100 HydrophobicContact CD2-CG 4.18Å; Y91-K100 HydrophobicContact CE2-CD 4.32Å; Y91-K100 HydrophobicContact CE2-CG 3.5Å; Y91-K100 VanDerWaalsContact OH-CE 3.28Å; Y91-K100 WeakPolarHBondContact OH-CE 3.18Å; Y91-A104 HydrophobicContact CE2-CB 3.89Å; Y91-Y127 HydrophobicContact CD1-CD1 4.41Å; Y91-Y127 AromaticContact CD1-CE1 3.65Å; Y91-Y127 HydrophobicContact CD1-CE1 3.65Å; Y91-Y127 HydrophobicContact CD2-CE1 4.48Å; Y91-Y127 HydrophobicContact CE1-CD1 4.11Å; Y91-Y127 AromaticContact CE1-CE1 3.57Å; Y91-Y127 HydrophobicContact CE1-CE1 3.57Å; Y91-Y127 HydrophobicContact CE2-CD1 4.29Å; Y91-Y127 HydrophobicContact CE2-CE1 4.45Å; Y91-Y127 HydrophobicContact CG-CE1 4.11Å; Y91-Y127 AromaticContact CZ-CE1 3.99Å; Y91-L130 WeakPolarHBondContact OH-CD1 3.38Å
92	N	66.7	Low	67.4	Low	123 Å²	123	67 Å²	67	66%	0.658	34%	0.344	S	S	*	.	H	α-helix	trans	-76.4	-18.7	177.7	-68.1	-25.4	0	0	0	113.7	S89 F90	S89-N92 PolarHBondContact O-N 3.46Å; F90-N92 PolarHBondContact O-N 2.85Å
93	T	66.9	Low	67.5	Low	93 Å²	93	60 Å²	60	57%	0.571	31%	0.312	S	S	*	.	H	α-helix	trans	-92.5	-17.1	-175.2	-51.6	0	0	0	0	112.4	S89 F90 Y91	S89-T93 PolarHBondContact O-OG1 3.41Å; S89-T93 VanDerWaalsContact O-OG1 3.09Å; F90-T93 PolarHBondContact O-N 3.35Å; Y91-T93 VanDerWaalsContact C-N 3.33Å
94	I	63.9	Low	67.8	Low	21 Å²	21	59 Å²	59	11%	0.108	31%	0.307	C	S	.	.			trans	-87.5	121.2	-176.9	-63	165.6	0	0	0	111.4	F90 N96 T99 K100 C103	F90-I94 WeakPolarHBondContact O-CG1 3.13Å; F90-I94 PolarHBondContact O-N 3.45Å; I94-N96 HydrophobicContact CG2-CB 4.45Å; I94-T99 HydrophobicContact CD1-CG2 4.37Å; I94-T99 HydrophobicContact CG2-CG2 4.21Å; I94-K100 HydrophobicContact CG2-CB 4.23Å; I94-C103 HydrophobicContact CD1-CB 4.31Å
95	Y	63.3	Low	67.9	Low	203 Å²	203	58.9 Å²	58.9	80%	0.796	31%	0.307	S	S	*	.			trans	-91.9	-19.9	174.3	-67	-82.4	0	0	0	114
96	N	67.7	Low	68.2	Low	69 Å²	69	55.2 Å²	55.2	37%	0.369	28%	0.277	S	S	.	.			trans	-77.5	120.1	-175.3	-166.1	-13.1	0	0	0	111	I94 D98 T99 K100	I94-N96 HydrophobicContact CG2-CB 4.45Å; N96-D98 PolarHBondContact O-N 3.44Å; N96-T99 PolarHBondContact O-N 3.48Å; N96-K100 WeakPolarHBondContact O-CB 3.42Å; N96-K100 PolarHBondContact O-N 3.17Å
97	P	67.5	Low	68.4	Low	81 Å²	81	51.1 Å²	51.1	53%	0.526	26%	0.259	S	S	.	.	H	α-helix	trans	-61.8	-36.8	-172.4	23	-35.7	0	0	0	114.2	K100 K101	P97-K100 PolarHBondContact O-N 3.36Å; P97-K101 VanDerWaalsContact O-CG 3.31Å; P97-K101 WeakPolarHBondContact O-CG 2.95Å; P97-K101 PolarHBondContact O-N 3Å
98	D	67.5	Low	68.3	Low	88 Å²	88	51 Å²	51	47%	0.471	26%	0.258	S	S	.	.	H	α-helix	trans	-73.8	-44.3	-177.2	-67.5	-20.3	0	0	0	111.5	N96 K100 K101 L102	N96-D98 PolarHBondContact O-N 3.44Å; D98-K100 PolarHBondContact O-N 3.05Å; D98-K101 PolarHBondContact O-N 2.91Å; D98-L102 WeakPolarHBondContact O-CG 3.34Å; D98-L102 PolarHBondContact O-N 3.15Å
99	T	68.5	Low	68.4	Low	4 Å²	4	48.4 Å²	48.4	3%	0.025	25%	0.247	C	C	.	.	H	α-helix	trans	-63.7	-34.8	173.7	-45.8	0	0	0	0	110.9	H52 L56 I94 N96 C103	H52-T99 HydrophobicContact CB-CG2 3.76Å; L56-T99 HydrophobicContact CD1-CG2 3.69Å; I94-T99 HydrophobicContact CD1-CG2 4.37Å; I94-T99 HydrophobicContact CG2-CG2 4.21Å; N96-T99 PolarHBondContact O-N 3.48Å; T99-C103 WeakPolarHBondContact O-CB 3.28Å; T99-C103 PolarHBondContact O-N 3.35Å
100	K	73.8	Confident	68.4	Low	75 Å²	75	45.4 Å²	45.4	33%	0.326	23%	0.226	S	C	.	.	H	α-helix	trans	-68	-40.8	177	-170.6	170.6	-175.1	169.6	0	112.2	Y91 I94 N96 P97 D98 C103 A104	Y91-K100 HydrophobicContact CD2-CG 4.18Å; Y91-K100 HydrophobicContact CE2-CD 4.32Å; Y91-K100 HydrophobicContact CE2-CG 3.5Å; Y91-K100 VanDerWaalsContact OH-CE 3.28Å; Y91-K100 WeakPolarHBondContact OH-CE 3.18Å; I94-K100 HydrophobicContact CG2-CB 4.23Å; N96-K100 WeakPolarHBondContact O-CB 3.42Å; N96-K100 PolarHBondContact O-N 3.17Å; P97-K100 PolarHBondContact O-N 3.36Å; D98-K100 PolarHBondContact O-N 3.05Å; K100-C103 PolarHBondContact O-N 2.9Å; K100-A104 WeakPolarHBondContact O-CB 3.35Å; K100-A104 PolarHBondContact O-N 3.29Å
101	K	74.1	Confident	68.7	Low	86 Å²	86	43.5 Å²	43.5	37%	0.374	22%	0.218	S	C	.	.	H	α-helix	trans	-64.6	-45.8	174.4	-72.4	174.2	-175.6	-179.7	0	112.2	P97 D98 C103 A104 D105 C132	P97-K101 VanDerWaalsContact O-CG 3.31Å; P97-K101 WeakPolarHBondContact O-CG 2.95Å; P97-K101 PolarHBondContact O-N 3Å; D98-K101 PolarHBondContact O-N 2.91Å; K101-C103 VanDerWaalsContact C-N 3.34Å; K101-C103 PolarHBondContact O-N 3.41Å; K101-A104 WeakPolarHBondContact O-CB 3.39Å; K101-A104 PolarHBondContact O-N 2.73Å; K101-D105 PolarHBondContact O-N 3.1Å; K101-C132 VanDerWaalsContact CD-SG 3.59Å
102	L	70.7	Confident	68.6	Low	38 Å²	38	43.8 Å²	43.8	20%	0.199	22%	0.22	C	C	.	.	H	α-helix	trans	-65.1	-38.1	176.1	-70.2	172.5	0	0	0	112.2	K53 L56 E57 D98 A104 D105 V106	K53-L102 HydrophobicContact CG-CD1 4.47Å; L56-L102 HydrophobicContact CD1-CB 4.44Å; E57-L102 HydrophobicContact CG-CD1 4.49Å; D98-L102 WeakPolarHBondContact O-CG 3.34Å; D98-L102 PolarHBondContact O-N 3.15Å; L102-A104 VanDerWaalsContact C-N 3.34Å; L102-D105 PolarHBondContact O-N 3.13Å; L102-V106 WeakPolarHBondContact O-CG2 3.37Å; L102-V106 PolarHBondContact O-N 3.33Å
103	C	68.3	Low	68.5	Low	3 Å²	3	39.7 Å²	39.7	2%	0.02	20%	0.2	C	C	.	.	H	α-helix	trans	-65.6	-39	173.2	-171.3	0	0	0	0	110.9	L56 I94 T99 K100 K101 D105 V106 V107	L56-C103 HydrophobicContact CD1-CB 3.92Å; I94-C103 HydrophobicContact CD1-CB 4.31Å; T99-C103 WeakPolarHBondContact O-CB 3.28Å; T99-C103 PolarHBondContact O-N 3.35Å; K100-C103 PolarHBondContact O-N 2.9Å; K101-C103 VanDerWaalsContact C-N 3.34Å; K101-C103 PolarHBondContact O-N 3.41Å; C103-D105 VanDerWaalsContact C-N 3.33Å; C103-D105 PolarHBondContact O-N 2.94Å; C103-V106 PolarHBondContact O-N 2.87Å; C103-V107 WeakPolarHBondContact O-CB 3.28Å; C103-V107 WeakPolarHBondContact O-CG2 3.33Å; C103-V107 PolarHBondContact O-N 2.88Å
104	A	71.3	Confident	68.3	Low	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-62	-39.8	174.5	0	0	0	0	0	112	Y91 K100 K101 L102 V107 S108 Y127 L130	Y91-A104 HydrophobicContact CE2-CB 3.89Å; K100-A104 WeakPolarHBondContact O-CB 3.35Å; K100-A104 PolarHBondContact O-N 3.29Å; K101-A104 WeakPolarHBondContact O-CB 3.39Å; K101-A104 PolarHBondContact O-N 2.73Å; L102-A104 VanDerWaalsContact C-N 3.34Å; A104-V107 PolarHBondContact O-N 3.36Å; A104-S108 WeakPolarHBondContact O-CB 3.21Å; A104-S108 PolarHBondContact O-N 2.94Å; A104-S108 PolarHBondContact O-OG 3.3Å; A104-Y127 VanDerWaalsContact CB-O 3.31Å; A104-Y127 WeakPolarHBondContact CB-O 3.35Å; A104-L130 HydrophobicContact CB-CB 4.29Å
105	D	70.2	Confident	68	Low	10 Å²	10	38.1 Å²	38.1	5%	0.053	19%	0.191	C	C	.	.	H	α-helix	trans	-65.5	-38.3	174.7	-67.3	-24.4	0	0	0	112.3	K101 L102 C103 S108 V109 G131 C132 W139	K101-D105 PolarHBondContact O-N 3.1Å; L102-D105 PolarHBondContact O-N 3.13Å; C103-D105 VanDerWaalsContact C-N 3.33Å; C103-D105 PolarHBondContact O-N 2.94Å; D105-S108 PolarHBondContact O-OG 3.23Å; D105-V109 VanDerWaalsContact O-CG2 3.24Å; D105-V109 WeakPolarHBondContact O-CG2 3.29Å; D105-V109 PolarHBondContact O-N 3.31Å; D105-G131 VanDerWaalsContact OD1-CA 3.3Å; D105-G131 WeakPolarHBondContact OD1-CA 3.42Å; D105-C132 PolarHBondContact OD1-N 2.99Å; D105-C132 PolarHBondContact OD2-N 3.16Å; D105-W139 HydrophobicContact CB-CZ2 4.44Å
106	V	72.7	Confident	67.6	Low	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-71	-41.5	175.1	174	0	0	0	0	110.8	L56 M59 C60 L102 C103 S108 V109 L110	L56-V106 HydrophobicContact CD2-CG2 4.3Å; M59-V106 HydrophobicContact CE-CG1 4.07Å; C60-V106 WeakPolarHBondContact SG-CG2 3.22Å; L102-V106 WeakPolarHBondContact O-CG2 3.37Å; L102-V106 PolarHBondContact O-N 3.33Å; C103-V106 PolarHBondContact O-N 2.87Å; V106-S108 VanDerWaalsContact C-N 3.31Å; V106-S108 PolarHBondContact O-N 2.87Å; V106-V109 PolarHBondContact O-N 3.44Å; V106-L110 HydrophobicContact CG1-CD1 3.74Å; V106-L110 HydrophobicContact CG1-CG 4.29Å; V106-L110 WeakPolarHBondContact O-CB 3.31Å; V106-L110 WeakPolarHBondContact O-CG 3.41Å; V106-L110 PolarHBondContact O-N 3.24Å
107	V	72.6	Confident	67	Low	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-64.9	-36.5	176.9	173.5	0	0	0	0	111.2	Y84 I87 C103 A104 L110 G111 Y127	Y84-V107 HydrophobicContact CE2-CG1 4.29Å; I87-V107 HydrophobicContact CG2-CG2 3.48Å; I87-V107 VanDerWaalsContact CG2-CG2 3.48Å; C103-V107 WeakPolarHBondContact O-CB 3.28Å; C103-V107 WeakPolarHBondContact O-CG2 3.33Å; C103-V107 PolarHBondContact O-N 2.88Å; A104-V107 PolarHBondContact O-N 3.36Å; V107-L110 PolarHBondContact O-N 3.25Å; V107-G111 PolarHBondContact O-N 2.83Å; V107-Y127 HydrophobicContact CB-CD2 4.42Å; V107-Y127 HydrophobicContact CB-CG 4.33Å; V107-Y127 HydrophobicContact CG1-CD1 4.27Å; V107-Y127 HydrophobicContact CG1-CD2 3.35Å; V107-Y127 HydrophobicContact CG1-CE2 3.7Å; V107-Y127 HydrophobicContact CG1-CG 3.71Å
108	S	67.2	Low	66.4	Low	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-67.1	-39.4	177.6	69.3	0	0	0	0	111.7	A104 D105 V106 G111 T124 Y143	A104-S108 WeakPolarHBondContact O-CB 3.21Å; A104-S108 PolarHBondContact O-N 2.94Å; A104-S108 PolarHBondContact O-OG 3.3Å; D105-S108 PolarHBondContact O-OG 3.23Å; V106-S108 VanDerWaalsContact C-N 3.31Å; V106-S108 PolarHBondContact O-N 2.87Å; S108-G111 PolarHBondContact O-N 3.36Å; S108-T124 WeakPolarHBondContact CB-O 3.37Å; S108-T124 WeakPolarHBondContact O-CG2 3.31Å; S108-Y143 PolarHBondContact OG-OH 3.1Å; S108-Y143 VanDerWaalsContact OG-OH 3.11Å
109	V	69.7	Low	65.7	Low	2 Å²	2	42.6 Å²	42.6	1%	0.012	22%	0.221	C	C	.	.	H	α-helix	trans	-70	-37.8	175.7	171.7	0	0	0	0	111.1	I63 D105 V106 G111 M112 W139 Y143	I63-V109 HydrophobicContact CD1-CG1 4.39Å; I63-V109 HydrophobicContact CG2-CG1 3.98Å; D105-V109 VanDerWaalsContact O-CG2 3.24Å; D105-V109 WeakPolarHBondContact O-CG2 3.29Å; D105-V109 PolarHBondContact O-N 3.31Å; V106-V109 PolarHBondContact O-N 3.44Å; V109-G111 VanDerWaalsContact C-N 3.34Å; V109-M112 HydrophobicContact CB-CE 4.47Å; V109-M112 HydrophobicContact CG1-CE 3.76Å; V109-M112 VanDerWaalsContact O-CB 3.29Å; V109-M112 WeakPolarHBondContact O-CB 3.35Å; V109-M112 VanDerWaalsContact O-CE 3.31Å; V109-M112 WeakPolarHBondContact O-CE 3.02Å; V109-M112 WeakPolarHBondContact O-CG 3.24Å; V109-M112 PolarHBondContact O-N 2.81Å; V109-W139 HydrophobicContact CB-CE3 4.37Å; V109-W139 HydrophobicContact CB-CZ3 4.43Å; V109-W139 HydrophobicContact CG1-CE3 4.06Å; V109-W139 HydrophobicContact CG1-CZ3 4.18Å; V109-W139 HydrophobicContact CG2-CB 4.49Å; V109-W139 HydrophobicContact CG2-CD2 3.62Å; V109-W139 HydrophobicContact CG2-CE3 3.51Å; V109-W139 HydrophobicContact CG2-CG 4.08Å; V109-W139 HydrophobicContact CG2-CH2 4.29Å; V109-W139 HydrophobicContact CG2-CZ2 4.42Å; V109-W139 HydrophobicContact CG2-CZ3 3.85Å; V109-Y143 HydrophobicContact CG2-CD2 4.14Å; V109-Y143 HydrophobicContact CG2-CE2 3.95Å
110	L	68.7	Low	65.1	Low	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-69.9	-32	175.3	-70.1	169.9	0	0	0	112.9	L80 Y84 I87 V106 V107 M112 T113	L80-L110 HydrophobicContact CB-CD2 3.39Å; L80-L110 HydrophobicContact CD1-CD2 3.8Å; L80-L110 HydrophobicContact CG-CD2 4.13Å; Y84-L110 HydrophobicContact CD2-CB 3.79Å; Y84-L110 HydrophobicContact CE2-CB 4.13Å; I87-L110 HydrophobicContact CD1-CD1 3.42Å; I87-L110 VanDerWaalsContact CD1-CD1 3.42Å; I87-L110 HydrophobicContact CG2-CD1 4.45Å; V106-L110 HydrophobicContact CG1-CD1 3.74Å; V106-L110 HydrophobicContact CG1-CG 4.29Å; V106-L110 WeakPolarHBondContact O-CB 3.31Å; V106-L110 WeakPolarHBondContact O-CG 3.41Å; V106-L110 PolarHBondContact O-N 3.24Å; V107-L110 PolarHBondContact O-N 3.25Å; L110-M112 PolarHBondContact O-N 3.05Å; L110-M112 VanDerWaalsContact O-N 3.1Å; L110-T113 PolarHBondContact O-N 2.47Å; L110-T113 PolarHBondContact O-OG1 3.11Å
111	G	66.3	Low	64.1	Low	1 Å²	1	45.4 Å²	45.4	1%	0.01	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-59.3	-18.4	174.4	0	0	0	0	0	113.3	V107 S108 V109 T113 V114	V107-G111 PolarHBondContact O-N 2.83Å; S108-G111 PolarHBondContact O-N 3.36Å; V109-G111 VanDerWaalsContact C-N 3.34Å; G111-T113 PolarHBondContact O-N 3.39Å; G111-V114 PolarHBondContact O-N 2.82Å
112	M	63.5	Low	63.3	Low	22 Å²	22	44.4 Å²	44.4	11%	0.108	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-59.5	-29.2	171.3	-67.6	-164.4	-73.3	0	0	113.1	V109 L110 Y143 H146	V109-M112 HydrophobicContact CB-CE 4.47Å; V109-M112 HydrophobicContact CG1-CE 3.76Å; V109-M112 VanDerWaalsContact O-CB 3.29Å; V109-M112 WeakPolarHBondContact O-CB 3.35Å; V109-M112 VanDerWaalsContact O-CE 3.31Å; V109-M112 WeakPolarHBondContact O-CE 3.02Å; V109-M112 WeakPolarHBondContact O-CG 3.24Å; V109-M112 PolarHBondContact O-N 2.81Å; L110-M112 PolarHBondContact O-N 3.05Å; L110-M112 VanDerWaalsContact O-N 3.1Å; M112-Y143 HydrophobicContact CE-CD2 4.18Å; M112-Y143 HydrophobicContact CG-CD2 4.05Å; M112-Y143 WeakPolarHBondContact SD-CA 3.49Å; M112-Y143 HydrophobicContact SD-CD2 3.72Å; M112-Y143 HydrophobicContact SD-CG 4.23Å; M112-H146 HydrophobicContact CG-CB 4.31Å; M112-H146 HydrophobicContact SD-CB 4.48Å
113	T	63.3	Low	62.8	Low	38 Å²	38	43.3 Å²	43.3	23%	0.233	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-92	-15.1	-175.5	60.9	0	0	0	0	113.9	L77 L110 G111	L77-T113 HydrophobicContact CB-CG2 3.81Å; L77-T113 HydrophobicContact CD2-CG2 3.79Å; L77-T113 HydrophobicContact CG-CG2 4.31Å; L110-T113 PolarHBondContact O-N 2.47Å; L110-T113 PolarHBondContact O-OG1 3.11Å; G111-T113 PolarHBondContact O-N 3.39Å
114	V	63.5	Low	62.4	Low	22 Å²	22	43.2 Å²	43.2	13%	0.133	22%	0.217	C	C	.	.			trans	-117.9	57.7	-173.5	-167.5	0	0	0	0	109.4	Y84 G111 T120	Y84-V114 HydrophobicContact CD1-CB 4.06Å; Y84-V114 HydrophobicContact CD1-CG1 4.02Å; Y84-V114 HydrophobicContact CD1-CG2 3.75Å; Y84-V114 HydrophobicContact CD2-CG2 4.22Å; Y84-V114 HydrophobicContact CE1-CB 4.08Å; Y84-V114 HydrophobicContact CE1-CG1 4.08Å; Y84-V114 HydrophobicContact CE1-CG2 4.25Å; Y84-V114 HydrophobicContact CG-CB 4.44Å; Y84-V114 HydrophobicContact CG-CG2 3.72Å; G111-V114 PolarHBondContact O-N 2.82Å; V114-T120 PolarHBondContact O-OG1 3.47Å
115	T	57	Low	61.9	Low	59 Å²	59	43.6 Å²	43.6	36%	0.362	22%	0.219	S	C	.	.			trans	-85.2	-11.2	177.8	50.5	0	0	0	0	113.6	Q117	T115-Q117 PolarHBondContact O-N 3.39Å
116	D	56.1	Low	61.6	Low	151 Å²	151	46.1 Å²	46.1	81%	0.807	24%	0.235	S	C	*	.	S	Bend	trans	-77.9	-18.3	-170.2	-70.9	-9.7	0	0	0	114.1
117	Q	55.1	Low	60.9	Low	115 Å²	115	47.2 Å²	47.2	54%	0.537	24%	0.24	S	C	.	.	S	Bend	trans	-95.1	130.3	-179.3	-63.5	-178.4	-1.1	0	0	111.3	T115 E119 T120 R121	T115-Q117 PolarHBondContact O-N 3.39Å; Q117-E119 PolarHBondContact O-N 2.97Å; Q117-E119 VanDerWaalsContact O-N 3.17Å; Q117-T120 HydrophobicContact CB-CG2 4.15Å; Q117-T120 WeakPolarHBondContact CB-OG1 3.35Å; Q117-T120 PolarHBondContact O-N 3.06Å; Q117-T120 PolarHBondContact O-OG1 3.33Å; Q117-T120 VanDerWaalsContact O-OG1 3.05Å; Q117-R121 PolarHBondContact O-N 3.33Å
118	P	54.9	Low	60.2	Low	97 Å²	97	48.2 Å²	48.2	63%	0.63	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-28.6	-176.5	22.8	-32.1	0	0	0	113.1
119	E	52.8	Low	59.9	Low	172 Å²	172	50.7 Å²	50.7	80%	0.804	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-18.3	177.3	-62.1	-174.7	177.4	0	0	113.7	Q117	Q117-E119 PolarHBondContact O-N 2.97Å; Q117-E119 VanDerWaalsContact O-N 3.17Å
120	T	54.6	Low	59.6	Low	6 Å²	6	54.7 Å²	54.7	4%	0.037	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	1.6	-177	64.1	0	0	0	0	113.2	Y84 V114 Q117 Y122 D123	Y84-T120 HydrophobicContact CE1-CG2 4.28Å; V114-T120 PolarHBondContact O-OG1 3.47Å; Q117-T120 HydrophobicContact CB-CG2 4.15Å; Q117-T120 WeakPolarHBondContact CB-OG1 3.35Å; Q117-T120 PolarHBondContact O-N 3.06Å; Q117-T120 PolarHBondContact O-OG1 3.33Å; Q117-T120 VanDerWaalsContact O-OG1 3.05Å; T120-Y122 PolarHBondContact O-N 2.86Å; T120-Y122 VanDerWaalsContact O-N 3.15Å; T120-D123 WeakPolarHBondContact CA-OD2 3.36Å; T120-D123 WeakPolarHBondContact CB-OD2 3.36Å; T120-D123 WeakPolarHBondContact CG2-OD2 3.37Å; T120-D123 WeakPolarHBondContact O-CB 3.3Å; T120-D123 PolarHBondContact O-N 3.35Å; T120-D123 VanDerWaalsContact O-N 3.13Å
121	R	53	Low	59.1	Low	131 Å²	131	55.4 Å²	55.4	49%	0.494	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-33.9	-176.3	-75.9	-176.8	176.1	-176.2	-0.3	113.9	Q117 Q150	Q117-R121 PolarHBondContact O-N 3.33Å; R121-Q150 PolarHBondContact O-NE2 2.89Å
122	Y	58	Low	58.5	Low	65 Å²	65	57.7 Å²	57.7	26%	0.255	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	7.4	-177.1	-57.8	-58.5	0	0	0	113.7	T120 T124 L125 T126 T154 E157	T120-Y122 PolarHBondContact O-N 2.86Å; T120-Y122 VanDerWaalsContact O-N 3.15Å; Y122-T124 VanDerWaalsContact C-N 3.33Å; Y122-T124 PolarHBondContact O-N 3.41Å; Y122-L125 PolarHBondContact O-N 3.34Å; Y122-T126 VanDerWaalsContact O-CB 3.24Å; Y122-T126 WeakPolarHBondContact O-CB 3.11Å; Y122-T126 PolarHBondContact O-N 3.24Å; Y122-T126 PolarHBondContact O-OG1 3.24Å; Y122-T154 HydrophobicContact CD1-CG2 3.25Å; Y122-T154 HydrophobicContact CE1-CG2 3.17Å; Y122-T154 HydrophobicContact CG-CG2 4.2Å; Y122-E157 PolarHBondContact OH-OE1 3.49Å; Y122-E157 PolarHBondContact OH-OE2 3.28Å
123	D	59.8	Low	58.1	Low	15 Å²	15	65 Å²	65	8%	0.08	33%	0.333	C	S	.	.	H	α-helix	trans	-62.2	-44.2	-174.7	-82.6	-11.5	0	0	0	110.3	Y84 K88 T120 L125 T126 Y127	Y84-D123 WeakPolarHBondContact OH-CB 3.17Å; Y84-D123 PolarHBondContact OH-OD2 3.35Å; K88-D123 IonicContact NZ-OD1 2.96Å; K88-D123 PolarHBondContact NZ-OD1 3.18Å; K88-D123 IonicContact NZ-OD2 2.73Å; K88-D123 PolarHBondContact NZ-OD2 2.83Å; T120-D123 WeakPolarHBondContact CA-OD2 3.36Å; T120-D123 WeakPolarHBondContact CB-OD2 3.36Å; T120-D123 WeakPolarHBondContact CG2-OD2 3.37Å; T120-D123 WeakPolarHBondContact O-CB 3.3Å; T120-D123 PolarHBondContact O-N 3.35Å; T120-D123 VanDerWaalsContact O-N 3.13Å; D123-L125 PolarHBondContact O-N 3.05Å; D123-T126 PolarHBondContact O-N 3.46Å; D123-Y127 HydrophobicContact CB-CD2 3.75Å; D123-Y127 HydrophobicContact CB-CE2 3.7Å; D123-Y127 VanDerWaalsContact O-CB 3.24Å; D123-Y127 WeakPolarHBondContact O-CB 3.24Å; D123-Y127 WeakPolarHBondContact O-CD2 3.39Å; D123-Y127 PolarHBondContact O-N 3Å
124	T	60.9	Low	57.9	Low	1 Å²	1	65.8 Å²	65.8	1%	0.006	34%	0.34	C	S	.	.	H	α-helix	trans	-49.7	-49.4	172.4	49.4	0	0	0	0	114.2	S108 Y122 R128 Q150	S108-T124 WeakPolarHBondContact CB-O 3.37Å; S108-T124 WeakPolarHBondContact O-CG2 3.31Å; Y122-T124 VanDerWaalsContact C-N 3.33Å; Y122-T124 PolarHBondContact O-N 3.41Å; T124-R128 WeakPolarHBondContact O-CB 3.24Å; T124-R128 PolarHBondContact O-N 2.79Å; T124-Q150 PolarHBondContact OG1-NE2 3.33Å; T124-Q150 PolarHBondContact OG1-OE1 2.74Å
125	L	60.7	Low	57.8	Low	8 Å²	8	71.3 Å²	71.3	4%	0.042	37%	0.37	C	S	.	.	H	α-helix	trans	-75	-41.4	-178.1	-175.1	137.6	0	0	0	110.8	Y122 D123 R128 L129 I151 T154	Y122-L125 PolarHBondContact O-N 3.34Å; D123-L125 PolarHBondContact O-N 3.05Å; L125-R128 PolarHBondContact O-N 2.75Å; L125-L129 HydrophobicContact CD2-CD1 3.88Å; L125-L129 WeakPolarHBondContact O-CG 3.34Å; L125-L129 PolarHBondContact O-N 3.47Å; L125-I151 HydrophobicContact CD1-CB 4.41Å; L125-I151 HydrophobicContact CD1-CG1 3.55Å; L125-T154 HydrophobicContact CD1-CG2 4.42Å; L125-T154 HydrophobicContact CD2-CG2 4.47Å
126	T	62.4	Low	58.1	Low	64 Å²	64	68.9 Å²	68.9	39%	0.393	35%	0.354	S	S	.	.	H	α-helix	trans	-66.2	-44.4	-179.3	-55.3	0	0	0	0	111.1	Y122 D123 L129 L130	Y122-T126 VanDerWaalsContact O-CB 3.24Å; Y122-T126 WeakPolarHBondContact O-CB 3.11Å; Y122-T126 PolarHBondContact O-N 3.24Å; Y122-T126 PolarHBondContact O-OG1 3.24Å; D123-T126 PolarHBondContact O-N 3.46Å; T126-L129 PolarHBondContact O-N 3.32Å; T126-L130 HydrophobicContact CG2-CD1 4.36Å; T126-L130 WeakPolarHBondContact O-CD1 3.31Å; T126-L130 VanDerWaalsContact O-CG 3.31Å; T126-L130 WeakPolarHBondContact O-CG 3.31Å; T126-L130 PolarHBondContact O-N 3.09Å
127	Y	60	Low	58.3	Low	22 Å²	22	62.4 Å²	62.4	9%	0.086	32%	0.323	C	S	.	.	H	α-helix	trans	-75	-28.1	177.1	-67.7	-62.6	0	0	0	112.2	Y91 A104 V107 D123 L130 G131	Y91-Y127 HydrophobicContact CD1-CD1 4.41Å; Y91-Y127 AromaticContact CD1-CE1 3.65Å; Y91-Y127 HydrophobicContact CD1-CE1 3.65Å; Y91-Y127 HydrophobicContact CD2-CE1 4.48Å; Y91-Y127 HydrophobicContact CE1-CD1 4.11Å; Y91-Y127 AromaticContact CE1-CE1 3.57Å; Y91-Y127 HydrophobicContact CE1-CE1 3.57Å; Y91-Y127 HydrophobicContact CE2-CD1 4.29Å; Y91-Y127 HydrophobicContact CE2-CE1 4.45Å; Y91-Y127 HydrophobicContact CG-CE1 4.11Å; Y91-Y127 AromaticContact CZ-CE1 3.99Å; A104-Y127 VanDerWaalsContact CB-O 3.31Å; A104-Y127 WeakPolarHBondContact CB-O 3.35Å; V107-Y127 HydrophobicContact CB-CD2 4.42Å; V107-Y127 HydrophobicContact CB-CG 4.33Å; V107-Y127 HydrophobicContact CG1-CD1 4.27Å; V107-Y127 HydrophobicContact CG1-CD2 3.35Å; V107-Y127 HydrophobicContact CG1-CE2 3.7Å; V107-Y127 HydrophobicContact CG1-CG 3.71Å; D123-Y127 HydrophobicContact CB-CD2 3.75Å; D123-Y127 HydrophobicContact CB-CE2 3.7Å; D123-Y127 VanDerWaalsContact O-CB 3.24Å; D123-Y127 WeakPolarHBondContact O-CB 3.24Å; D123-Y127 WeakPolarHBondContact O-CD2 3.39Å; D123-Y127 PolarHBondContact O-N 3Å; Y127-L130 HydrophobicContact CD1-CD1 4.24Å; Y127-L130 CarbonylContact O-C 3.6Å; Y127-L130 PolarHBondContact O-N 3.29Å; Y127-G131 PolarHBondContact O-N 3Å
128	R	56.7	Low	58.8	Low	22 Å²	22	59.1 Å²	59.1	8%	0.083	32%	0.316	C	S	.	.	H	α-helix	trans	-67.5	-39.1	170.5	-172.4	-178.2	-163.8	176.3	24.1	113	T124 L125 L130 G131 Y143 L183	T124-R128 WeakPolarHBondContact O-CB 3.24Å; T124-R128 PolarHBondContact O-N 2.79Å; L125-R128 PolarHBondContact O-N 2.75Å; R128-L130 PolarHBondContact O-N 3.11Å; R128-G131 PolarHBondContact O-N 3.5Å; R128-G131 VanDerWaalsContact O-N 3.09Å; R128-Y143 WeakPolarHBondContact CD-OH 3.45Å; R128-L183 HydrophobicContact CG-CD2 4.32Å
129	L	61.3	Low	59.3	Low	52 Å²	52	55.1 Å²	55.1	27%	0.272	29%	0.288	S	S	.	.	H	α-helix	trans	-65.1	-22.5	173.9	-72.1	179.2	0	0	0	112.8	L125 T126 D179 L183	L125-L129 HydrophobicContact CD2-CD1 3.88Å; L125-L129 WeakPolarHBondContact O-CG 3.34Å; L125-L129 PolarHBondContact O-N 3.47Å; T126-L129 PolarHBondContact O-N 3.32Å; L129-D179 HydrophobicContact CD1-CB 4.17Å; L129-D179 HydrophobicContact CD2-CB 3.69Å; L129-L183 HydrophobicContact CD2-CD1 3.49Å; L129-L183 VanDerWaalsContact CD2-CD1 3.49Å; L129-L183 HydrophobicContact CD2-CG 4.08Å; L129-L183 HydrophobicContact CG-CD1 4.17Å
130	L	63.6	Low	59.9	Low	86 Å²	86	47.6 Å²	47.6	45%	0.45	26%	0.256	S	S	.	.	H	α-helix	trans	-90.8	-10.6	175.1	-65.9	163.1	0	0	0	112.9	Y91 A104 T126 Y127 R128	Y91-L130 WeakPolarHBondContact OH-CD1 3.38Å; A104-L130 HydrophobicContact CB-CB 4.29Å; T126-L130 HydrophobicContact CG2-CD1 4.36Å; T126-L130 WeakPolarHBondContact O-CD1 3.31Å; T126-L130 VanDerWaalsContact O-CG 3.31Å; T126-L130 WeakPolarHBondContact O-CG 3.31Å; T126-L130 PolarHBondContact O-N 3.09Å; Y127-L130 HydrophobicContact CD1-CD1 4.24Å; Y127-L130 CarbonylContact O-C 3.6Å; Y127-L130 PolarHBondContact O-N 3.29Å; R128-L130 PolarHBondContact O-N 3.11Å
131	G	58.1	Low	60.6	Low	14 Å²	14	49.9 Å²	49.9	14%	0.144	27%	0.267	C	S	.	.	S	Bend	trans	-84.3	179.1	-175.3	0	0	0	0	0	115.3	D105 Y127 R128	D105-G131 VanDerWaalsContact OD1-CA 3.3Å; D105-G131 WeakPolarHBondContact OD1-CA 3.42Å; Y127-G131 PolarHBondContact O-N 3Å; R128-G131 PolarHBondContact O-N 3.5Å; R128-G131 VanDerWaalsContact O-N 3.09Å
132	C	52.8	Low	61.3	Low	49 Å²	49	47.3 Å²	47.3	33%	0.331	26%	0.26	S	S	.	.			trans	-76.7	140.8	174.7	-90.9	0	0	0	0	109.8	K101 D105 S134	K101-C132 VanDerWaalsContact CD-SG 3.59Å; D105-C132 PolarHBondContact OD1-N 2.99Å; D105-C132 PolarHBondContact OD2-N 3.16Å; C132-S134 WeakPolarHBondContact CB-OG 3.49Å; C132-S134 PolarHBondContact O-N 2.77Å; C132-S134 PolarHBondContact O-OG 3.37Å
133	Q	56.5	Low	62	Low	175 Å²	175	44.4 Å²	44.4	82%	0.818	25%	0.249	S	C	*	.			trans	-63.8	34.4	175.6	-65.5	176.8	-24.5	0	0	114.2
134	S	58.3	Low	62.7	Low	55 Å²	55	43.7 Å²	43.7	39%	0.385	25%	0.245	S	C	.	.			trans	-69.6	145.9	-178.9	-32.4	0	0	0	0	110.8	C132 I136	C132-S134 WeakPolarHBondContact CB-OG 3.49Å; C132-S134 PolarHBondContact O-N 2.77Å; C132-S134 PolarHBondContact O-OG 3.37Å; S134-I136 PolarHBondContact O-N 3.27Å; S134-I136 VanDerWaalsContact O-N 3.13Å
135	D	61.2	Low	63.2	Low	139 Å²	139	50.7 Å²	50.7	74%	0.743	27%	0.271	S	S	*	.			trans	-50.6	119.1	-178.2	-68.4	-31.7	0	0	0	112.5	G137 A138	D135-G137 PolarHBondContact O-N 3.14Å; D135-G137 VanDerWaalsContact O-N 3.15Å; D135-A138 WeakPolarHBondContact O-CB 3.13Å; D135-A138 PolarHBondContact O-N 3.45Å; D135-A138 VanDerWaalsContact O-N 3.15Å
136	I	62.9	Low	63.8	Low	7 Å²	7	53.4 Å²	53.4	4%	0.036	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-54.7	-34.2	-176.4	-56.9	-166.7	0	0	0	111.7	S134 A138 W139 V144 Q186 I187	S134-I136 PolarHBondContact O-N 3.27Å; S134-I136 VanDerWaalsContact O-N 3.13Å; I136-A138 VanDerWaalsContact C-N 3.25Å; I136-A138 PolarHBondContact O-N 3.1Å; I136-W139 PolarHBondContact O-N 2.92Å; I136-V144 HydrophobicContact CG2-CG1 4.49Å; I136-V144 HydrophobicContact CG2-CG2 3.52Å; I136-Q186 HydrophobicContact CD1-CB 3.5Å; I136-Q186 VanDerWaalsContact CD1-CB 3.5Å; I136-Q186 HydrophobicContact CG1-CB 4.3Å; I136-I187 HydrophobicContact CD1-CD1 4.47Å; I136-I187 HydrophobicContact CD1-CG1 3.55Å; I136-I187 HydrophobicContact CG2-CG1 4.45Å
137	G	61.7	Low	64.4	Low	16 Å²	16	50.4 Å²	50.4	17%	0.165	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-65	-22.4	-177.9	0	0	0	0	0	115.8	D135 W139 G140 Y190	D135-G137 PolarHBondContact O-N 3.14Å; D135-G137 VanDerWaalsContact O-N 3.15Å; G137-W139 PolarHBondContact O-N 3.33Å; G137-W139 VanDerWaalsContact O-N 3.14Å; G137-G140 PolarHBondContact O-N 3.32Å; G137-Y190 WeakPolarHBondContact CA-OH 3.48Å; G137-Y190 PolarHBondContact O-OH 3.23Å
138	A	64.8	Low	65.1	Low	46 Å²	46	49.8 Å²	49.8	38%	0.38	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-66.2	-19.2	-177.5	0	0	0	0	0	113.2	D135 I136	D135-A138 WeakPolarHBondContact O-CB 3.13Å; D135-A138 PolarHBondContact O-N 3.45Å; D135-A138 VanDerWaalsContact O-N 3.15Å; I136-A138 VanDerWaalsContact C-N 3.25Å; I136-A138 PolarHBondContact O-N 3.1Å
139	W	64.6	Low	66.1	Low	13 Å²	13	53.1 Å²	53.1	5%	0.049	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-99.5	5.9	-176.5	-63.2	106.9	0	0	0	113.9	C60 I63 K64 T67 D105 V109 I136 G137 Y143	C60-W139 HydrophobicContact CB-CH2 3.95Å; I63-W139 HydrophobicContact CB-CZ3 3.83Å; I63-W139 HydrophobicContact CD1-CZ3 4.22Å; I63-W139 HydrophobicContact CG2-CE3 3.83Å; I63-W139 HydrophobicContact CG2-CZ3 3.59Å; K64-W139 HydrophobicContact CG-CE3 4.28Å; K64-W139 HydrophobicContact CG-CZ3 4.29Å; T67-W139 WeakPolarHBondContact CG2-O 3.23Å; D105-W139 HydrophobicContact CB-CZ2 4.44Å; V109-W139 HydrophobicContact CB-CE3 4.37Å; V109-W139 HydrophobicContact CB-CZ3 4.43Å; V109-W139 HydrophobicContact CG1-CE3 4.06Å; V109-W139 HydrophobicContact CG1-CZ3 4.18Å; V109-W139 HydrophobicContact CG2-CB 4.49Å; V109-W139 HydrophobicContact CG2-CD2 3.62Å; V109-W139 HydrophobicContact CG2-CE3 3.51Å; V109-W139 HydrophobicContact CG2-CG 4.08Å; V109-W139 HydrophobicContact CG2-CH2 4.29Å; V109-W139 HydrophobicContact CG2-CZ2 4.42Å; V109-W139 HydrophobicContact CG2-CZ3 3.85Å; I136-W139 PolarHBondContact O-N 2.92Å; G137-W139 PolarHBondContact O-N 3.33Å; G137-W139 VanDerWaalsContact O-N 3.14Å; W139-Y143 HydrophobicContact CB-CD1 3.47Å; W139-Y143 VanDerWaalsContact CB-CD1 3.47Å; W139-Y143 HydrophobicContact CB-CE1 4.09Å; W139-Y143 HydrophobicContact CB-CG 3.84Å; W139-Y143 HydrophobicContact CG-CD1 4.16Å; W139-Y143 HydrophobicContact CG-CE1 4.3Å
140	G	66.7	Low	66.7	Low	13 Å²	13	51.6 Å²	51.6	13%	0.134	28%	0.275	C	S	.	.			trans	84	161.3	176	0	0	0	0	0	114.9	G137 E142 Y143 V144	G137-G140 PolarHBondContact O-N 3.32Å; G140-E142 VanDerWaalsContact C-N 3.31Å; G140-E142 PolarHBondContact O-N 3.36Å; G140-Y143 PolarHBondContact O-N 3.39Å; G140-V144 PolarHBondContact O-N 2.97Å
141	H	68.1	Low	67.3	Low	54 Å²	54	47.5 Å²	47.5	25%	0.25	25%	0.253	C	S	.	.	H	α-helix	trans	-62.9	-32	-178.2	-75.4	-73.6	0	0	0	113.5	Y143 V144 R145 Y190 H194	H141-Y143 VanDerWaalsContact C-N 3.31Å; H141-Y143 PolarHBondContact O-N 3.23Å; H141-V144 PolarHBondContact O-N 3.41Å; H141-R145 WeakPolarHBondContact O-CB 3.47Å; H141-R145 PolarHBondContact O-N 3.48Å; H141-Y190 AromaticContact CE1-CE1 3.74Å; H141-Y190 AromaticContact ND1-CE1 3.97Å; H141-H194 AromaticContact CE1-CG 3.77Å; H141-H194 AromaticContact NE2-CG 3.88Å; H141-H194 AromaticContact NE2-ND1 3.7Å
142	E	68.6	Low	68	Low	77 Å²	77	47.2 Å²	47.2	36%	0.36	25%	0.249	S	C	.	.	H	α-helix	trans	-61.3	-40.7	177.1	-69.1	-172.2	165	0	0	111.7	G140 R145 H146	G140-E142 VanDerWaalsContact C-N 3.31Å; G140-E142 PolarHBondContact O-N 3.36Å; E142-R145 PolarHBondContact O-N 3.47Å; E142-H146 PolarHBondContact O-CD2 3.17Å; E142-H146 PolarHBondContact O-N 3.02Å
143	Y	72.7	Confident	69	Low	4 Å²	4	45.9 Å²	45.9	2%	0.016	24%	0.243	C	C	.	.	H	α-helix	trans	-63.2	-46.6	175.3	179.2	-113.9	0	0	0	111.6	S108 V109 M112 R128 W139 G140 H141 R145 H146 L147	S108-Y143 PolarHBondContact OG-OH 3.1Å; S108-Y143 VanDerWaalsContact OG-OH 3.11Å; V109-Y143 HydrophobicContact CG2-CD2 4.14Å; V109-Y143 HydrophobicContact CG2-CE2 3.95Å; M112-Y143 HydrophobicContact CE-CD2 4.18Å; M112-Y143 HydrophobicContact CG-CD2 4.05Å; M112-Y143 WeakPolarHBondContact SD-CA 3.49Å; M112-Y143 HydrophobicContact SD-CD2 3.72Å; M112-Y143 HydrophobicContact SD-CG 4.23Å; R128-Y143 WeakPolarHBondContact CD-OH 3.45Å; W139-Y143 HydrophobicContact CB-CD1 3.47Å; W139-Y143 VanDerWaalsContact CB-CD1 3.47Å; W139-Y143 HydrophobicContact CB-CE1 4.09Å; W139-Y143 HydrophobicContact CB-CG 3.84Å; W139-Y143 HydrophobicContact CG-CD1 4.16Å; W139-Y143 HydrophobicContact CG-CE1 4.3Å; G140-Y143 PolarHBondContact O-N 3.39Å; H141-Y143 VanDerWaalsContact C-N 3.31Å; H141-Y143 PolarHBondContact O-N 3.23Å; Y143-R145 VanDerWaalsContact C-N 3.3Å; Y143-R145 PolarHBondContact O-N 3.43Å; Y143-H146 PolarHBondContact O-N 2.7Å; Y143-L147 HydrophobicContact CD1-CD1 3.35Å; Y143-L147 HydrophobicContact CD2-CD1 3.74Å; Y143-L147 HydrophobicContact CD2-CG 4.37Å; Y143-L147 HydrophobicContact CE1-CD1 3.12Å; Y143-L147 HydrophobicContact CE1-CG 4.44Å; Y143-L147 HydrophobicContact CE2-CD1 3.5Å; Y143-L147 HydrophobicContact CE2-CD2 4.37Å; Y143-L147 HydrophobicContact CE2-CG 4.09Å; Y143-L147 HydrophobicContact CG-CD1 3.67Å; Y143-L147 WeakPolarHBondContact O-CB 3.44Å; Y143-L147 WeakPolarHBondContact O-CD1 3.23Å; Y143-L147 VanDerWaalsContact O-CG 3.23Å; Y143-L147 WeakPolarHBondContact O-CG 3.46Å; Y143-L147 PolarHBondContact O-N 3.23Å
144	V	73.7	Confident	69.5	Low	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-58.7	-44.4	176.3	-172.3	0	0	0	0	110.8	I136 G140 H141 L147 T148 I187 Y190 L191	I136-V144 HydrophobicContact CG2-CG1 4.49Å; I136-V144 HydrophobicContact CG2-CG2 3.52Å; G140-V144 PolarHBondContact O-N 2.97Å; H141-V144 PolarHBondContact O-N 3.41Å; V144-L147 WeakPolarHBondContact O-CB 3.47Å; V144-L147 PolarHBondContact O-N 2.79Å; V144-T148 WeakPolarHBondContact O-CB 3.45Å; V144-T148 PolarHBondContact O-N 3.15Å; V144-T148 PolarHBondContact O-OG1 3.48Å; V144-I187 HydrophobicContact CG1-CG2 3.84Å; V144-Y190 HydrophobicContact CG2-CD1 4.19Å; V144-Y190 HydrophobicContact CG2-CE1 4Å; V144-L191 HydrophobicContact CG1-CD2 3.97Å; V144-L191 HydrophobicContact CG1-CG 4.35Å
145	R	71.9	Confident	70	Confident	148 Å²	148	37.3 Å²	37.3	56%	0.558	20%	0.195	S	C	*	.	H	α-helix	trans	-63.5	-44.6	178.9	-172.6	175.5	-179.2	179.4	2.9	112.9	H141 E142 Y143 L147 T148 N149	H141-R145 WeakPolarHBondContact O-CB 3.47Å; H141-R145 PolarHBondContact O-N 3.48Å; E142-R145 PolarHBondContact O-N 3.47Å; Y143-R145 VanDerWaalsContact C-N 3.3Å; Y143-R145 PolarHBondContact O-N 3.43Å; R145-L147 VanDerWaalsContact C-N 3.28Å; R145-L147 PolarHBondContact O-N 3.39Å; R145-T148 PolarHBondContact O-N 3.08Å; R145-N149 VanDerWaalsContact O-CG 3.23Å; R145-N149 PolarHBondContact O-N 2.72Å; R145-N149 PolarHBondContact O-OD1 3.39Å
146	H	73.3	Confident	70.3	Confident	66 Å²	66	35.5 Å²	35.5	31%	0.306	18%	0.182	S	C	.	.	H	α-helix	trans	-62.4	-38.1	175.5	-80.1	-66.4	0	0	0	111.9	M112 E142 Y143 N149 Q150	M112-H146 HydrophobicContact CG-CB 4.31Å; M112-H146 HydrophobicContact SD-CB 4.48Å; E142-H146 PolarHBondContact O-CD2 3.17Å; E142-H146 PolarHBondContact O-N 3.02Å; Y143-H146 PolarHBondContact O-N 2.7Å; H146-N149 PolarHBondContact O-N 2.9Å; H146-Q150 WeakPolarHBondContact O-CB 3.38Å; H146-Q150 VanDerWaalsContact O-CG 3.23Å; H146-Q150 WeakPolarHBondContact O-CG 3.31Å; H146-Q150 PolarHBondContact O-N 3.48Å; H146-Q150 PolarHBondContact O-OE1 3.22Å
147	L	74.5	Confident	70.3	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-68.7	-43.6	176.5	-72.7	154.1	0	0	0	112.3	Y143 V144 R145 N149 Q150 I151	Y143-L147 HydrophobicContact CD1-CD1 3.35Å; Y143-L147 HydrophobicContact CD2-CD1 3.74Å; Y143-L147 HydrophobicContact CD2-CG 4.37Å; Y143-L147 HydrophobicContact CE1-CD1 3.12Å; Y143-L147 HydrophobicContact CE1-CG 4.44Å; Y143-L147 HydrophobicContact CE2-CD1 3.5Å; Y143-L147 HydrophobicContact CE2-CD2 4.37Å; Y143-L147 HydrophobicContact CE2-CG 4.09Å; Y143-L147 HydrophobicContact CG-CD1 3.67Å; Y143-L147 WeakPolarHBondContact O-CB 3.44Å; Y143-L147 WeakPolarHBondContact O-CD1 3.23Å; Y143-L147 VanDerWaalsContact O-CG 3.23Å; Y143-L147 WeakPolarHBondContact O-CG 3.46Å; Y143-L147 PolarHBondContact O-N 3.23Å; V144-L147 WeakPolarHBondContact O-CB 3.47Å; V144-L147 PolarHBondContact O-N 2.79Å; R145-L147 VanDerWaalsContact C-N 3.28Å; R145-L147 PolarHBondContact O-N 3.39Å; L147-N149 VanDerWaalsContact C-N 3.35Å; L147-Q150 PolarHBondContact O-N 3.19Å; L147-I151 WeakPolarHBondContact O-CB 3.32Å; L147-I151 VanDerWaalsContact O-CG1 3.22Å; L147-I151 WeakPolarHBondContact O-CG1 3.46Å; L147-I151 PolarHBondContact O-N 2.95Å
148	T	75.1	Confident	69.9	Low	9 Å²	9	41.8 Å²	41.8	6%	0.055	21%	0.206	C	C	.	.	H	α-helix	trans	-54.9	-52.7	172.8	-59.5	0	0	0	0	109.5	V144 R145 Q150 I151 V152 L203	V144-T148 WeakPolarHBondContact O-CB 3.45Å; V144-T148 PolarHBondContact O-N 3.15Å; V144-T148 PolarHBondContact O-OG1 3.48Å; R145-T148 PolarHBondContact O-N 3.08Å; T148-Q150 PolarHBondContact O-N 3.41Å; T148-I151 PolarHBondContact O-N 2.99Å; T148-I151 VanDerWaalsContact O-N 3.17Å; T148-V152 WeakPolarHBondContact O-CB 3.38Å; T148-V152 WeakPolarHBondContact O-CG2 3.49Å; T148-V152 PolarHBondContact O-N 3.49Å; T148-L203 HydrophobicContact CG2-CB 3.99Å; T148-L203 HydrophobicContact CG2-CD1 3.7Å; T148-L203 HydrophobicContact CG2-CD2 4.23Å; T148-L203 HydrophobicContact CG2-CG 4.17Å
149	N	77.1	Confident	69.3	Low	91 Å²	91	44.5 Å²	44.5	49%	0.487	21%	0.211	S	C	.	.	H	α-helix	trans	-57.9	-35.3	178.4	-69	-10.2	0	0	0	113.1	R145 H146 L147 G153	R145-N149 VanDerWaalsContact O-CG 3.23Å; R145-N149 PolarHBondContact O-N 2.72Å; R145-N149 PolarHBondContact O-OD1 3.39Å; H146-N149 PolarHBondContact O-N 2.9Å; L147-N149 VanDerWaalsContact C-N 3.35Å; N149-G153 PolarHBondContact O-N 3.26Å
150	Q	74.9	Confident	68.7	Low	20 Å²	20	52.8 Å²	52.8	9%	0.093	24%	0.244	C	C	.	.	H	α-helix	trans	-80.2	-34.9	179.3	-73.3	163.3	-20.9	0	0	112.9	R121 T124 H146 L147 T148 V152 G153 T154	R121-Q150 PolarHBondContact O-NE2 2.89Å; T124-Q150 PolarHBondContact OG1-NE2 3.33Å; T124-Q150 PolarHBondContact OG1-OE1 2.74Å; H146-Q150 WeakPolarHBondContact O-CB 3.38Å; H146-Q150 VanDerWaalsContact O-CG 3.23Å; H146-Q150 WeakPolarHBondContact O-CG 3.31Å; H146-Q150 PolarHBondContact O-N 3.48Å; H146-Q150 PolarHBondContact O-OE1 3.22Å; L147-Q150 PolarHBondContact O-N 3.19Å; T148-Q150 PolarHBondContact O-N 3.41Å; Q150-V152 VanDerWaalsContact C-N 3.25Å; Q150-V152 PolarHBondContact O-N 3.29Å; Q150-G153 PolarHBondContact O-N 3.37Å; Q150-T154 WeakPolarHBondContact O-CB 3.38Å; Q150-T154 VanDerWaalsContact O-CG2 3.31Å; Q150-T154 WeakPolarHBondContact O-CG2 3.07Å; Q150-T154 PolarHBondContact O-N 3.09Å; Q150-T154 PolarHBondContact O-OG1 3.14Å
151	I	75.8	Confident	67.8	Low	1 Å²	1	56.5 Å²	56.5	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-58.2	-47.2	170.5	-70.5	164.2	0	0	0	108.3	L125 L147 T148 T154 W155 V184 I187 L203 I207	L125-I151 HydrophobicContact CD1-CB 4.41Å; L125-I151 HydrophobicContact CD1-CG1 3.55Å; L147-I151 WeakPolarHBondContact O-CB 3.32Å; L147-I151 VanDerWaalsContact O-CG1 3.22Å; L147-I151 WeakPolarHBondContact O-CG1 3.46Å; L147-I151 PolarHBondContact O-N 2.95Å; T148-I151 PolarHBondContact O-N 2.99Å; T148-I151 VanDerWaalsContact O-N 3.17Å; I151-T154 WeakPolarHBondContact CA-OG1 3.2Å; I151-T154 PolarHBondContact O-N 2.92Å; I151-T154 PolarHBondContact O-OG1 2.96Å; I151-W155 WeakPolarHBondContact O-CB 3.46Å; I151-W155 PolarHBondContact O-N 3.27Å; I151-V184 HydrophobicContact CD1-CG2 4.34Å; I151-V184 HydrophobicContact CG2-CG2 4.35Å; I151-I187 HydrophobicContact CD1-CD1 3.67Å; I151-L203 HydrophobicContact CG2-CD1 4.27Å; I151-I207 HydrophobicContact CG2-CD1 3.88Å; I151-I207 HydrophobicContact CG2-CG1 4.35Å
152	V	73.8	Confident	66.8	Low	8 Å²	8	57.3 Å²	57.3	5%	0.048	27%	0.272	C	S	.	.	H	α-helix	trans	-62.2	-48.6	178.2	173.1	0	0	0	0	111	T148 Q150 T154 W155 Q156 L203 E206	T148-V152 WeakPolarHBondContact O-CB 3.38Å; T148-V152 WeakPolarHBondContact O-CG2 3.49Å; T148-V152 PolarHBondContact O-N 3.49Å; Q150-V152 VanDerWaalsContact C-N 3.25Å; Q150-V152 PolarHBondContact O-N 3.29Å; V152-T154 VanDerWaalsContact C-N 3.34Å; V152-T154 PolarHBondContact O-N 3.18Å; V152-W155 WeakPolarHBondContact O-CB 3.42Å; V152-W155 PolarHBondContact O-N 3.43Å; V152-W155 VanDerWaalsContact O-N 3.07Å; V152-Q156 WeakPolarHBondContact O-CG 3.47Å; V152-Q156 PolarHBondContact O-N 3.26Å; V152-L203 HydrophobicContact CG2-CD1 3.93Å; V152-E206 HydrophobicContact CG1-CB 4.14Å; V152-E206 VanDerWaalsContact CG1-CD 3.4Å; V152-E206 HydrophobicContact CG1-CG 4.2Å; V152-E206 VanDerWaalsContact CG1-OE2 3.27Å; V152-E206 WeakPolarHBondContact CG1-OE2 3.49Å; V152-E206 HydrophobicContact CG2-CB 4.03Å; V152-E206 WeakPolarHBondContact CG2-OE2 3.22Å
153	G	72.6	Confident	65.9	Low	20 Å²	20	60.4 Å²	60.4	21%	0.206	29%	0.291	C	S	.	.	H	α-helix	trans	-59.9	-40.6	175.3	0	0	0	0	0	113.1	N149 Q150 W155 E157	N149-G153 PolarHBondContact O-N 3.26Å; Q150-G153 PolarHBondContact O-N 3.37Å; G153-W155 VanDerWaalsContact C-N 3.31Å; G153-W155 PolarHBondContact O-N 3.46Å; G153-E157 WeakPolarHBondContact O-CB 2.86Å; G153-E157 WeakPolarHBondContact O-CG 3.43Å; G153-E157 PolarHBondContact O-N 3Å; G153-E157 VanDerWaalsContact O-N 3.08Å
154	T	66.3	Low	64.4	Low	5 Å²	5	67.3 Å²	67.3	3%	0.031	33%	0.325	C	S	.	.	H	α-helix	trans	-68.4	-30.3	174.5	57.6	0	0	0	0	112.9	Y122 L125 Q150 I151 V152 K158	Y122-T154 HydrophobicContact CD1-CG2 3.25Å; Y122-T154 HydrophobicContact CE1-CG2 3.17Å; Y122-T154 HydrophobicContact CG-CG2 4.2Å; L125-T154 HydrophobicContact CD1-CG2 4.42Å; L125-T154 HydrophobicContact CD2-CG2 4.47Å; Q150-T154 WeakPolarHBondContact O-CB 3.38Å; Q150-T154 VanDerWaalsContact O-CG2 3.31Å; Q150-T154 WeakPolarHBondContact O-CG2 3.07Å; Q150-T154 PolarHBondContact O-N 3.09Å; Q150-T154 PolarHBondContact O-OG1 3.14Å; I151-T154 WeakPolarHBondContact CA-OG1 3.2Å; I151-T154 PolarHBondContact O-N 2.92Å; I151-T154 PolarHBondContact O-OG1 2.96Å; V152-T154 VanDerWaalsContact C-N 3.34Å; V152-T154 PolarHBondContact O-N 3.18Å; T154-K158 VanDerWaalsContact O-CB 3.24Å; T154-K158 WeakPolarHBondContact O-CB 3.11Å; T154-K158 VanDerWaalsContact O-CD 3.32Å; T154-K158 WeakPolarHBondContact O-CD 3.49Å; T154-K158 WeakPolarHBondContact O-CG 3.27Å; T154-K158 PolarHBondContact O-N 3.41Å
155	W	69.6	Low	62.5	Low	45 Å²	45	74.7 Å²	74.7	17%	0.17	36%	0.364	C	S	.	.	H	α-helix	trans	-72.9	-48.8	179.6	-163.8	-96.2	0	0	0	110.2	I151 V152 G153 K158 E159 R177 I207	I151-W155 WeakPolarHBondContact O-CB 3.46Å; I151-W155 PolarHBondContact O-N 3.27Å; V152-W155 WeakPolarHBondContact O-CB 3.42Å; V152-W155 PolarHBondContact O-N 3.43Å; V152-W155 VanDerWaalsContact O-N 3.07Å; G153-W155 VanDerWaalsContact C-N 3.31Å; G153-W155 PolarHBondContact O-N 3.46Å; W155-K158 PolarHBondContact O-N 3.15Å; W155-E159 PolarHBondContact O-N 3.13Å; W155-R177 HydrophobicContact CZ3-CG 4.08Å; W155-I207 HydrophobicContact CH2-CG2 4.31Å; W155-I207 HydrophobicContact CZ2-CG2 4.29Å; W155-I207 WeakPolarHBondContact CZ2-O 3.42Å; W155-I207 HydrophobicContact CZ3-CG2 4.48Å
156	Q	67.1	Low	61	Low	101 Å²	101	73.8 Å²	73.8	47%	0.472	37%	0.37	S	S	.	.	H	α-helix	trans	-63.2	-45.4	178.8	-69.5	176.4	-2.5	0	0	112.9	V152 K158 E159 Y160	V152-Q156 WeakPolarHBondContact O-CG 3.47Å; V152-Q156 PolarHBondContact O-N 3.26Å; Q156-K158 VanDerWaalsContact C-N 3.29Å; Q156-K158 PolarHBondContact O-N 2.88Å; Q156-E159 PolarHBondContact O-N 3.47Å; Q156-Y160 PolarHBondContact O-N 2.96Å
157	E	64.1	Low	59.8	Low	95 Å²	95	75.9 Å²	75.9	44%	0.444	39%	0.39	S	S	.	.	H	α-helix	trans	-65.7	-34.6	178.2	-73.7	-170.4	-153.2	0	0	111.7	Y122 G153 Y160 D161	Y122-E157 PolarHBondContact OH-OE1 3.49Å; Y122-E157 PolarHBondContact OH-OE2 3.28Å; G153-E157 WeakPolarHBondContact O-CB 2.86Å; G153-E157 WeakPolarHBondContact O-CG 3.43Å; G153-E157 PolarHBondContact O-N 3Å; G153-E157 VanDerWaalsContact O-N 3.08Å; E157-Y160 WeakPolarHBondContact O-CB 3.39Å; E157-Y160 PolarHBondContact O-N 3.4Å; E157-D161 PolarHBondContact O-N 3.27Å; E157-D161 VanDerWaalsContact O-N 3.09Å
158	K	52.8	Low	58.2	Low	61 Å²	61	84.3 Å²	84.3	27%	0.265	43%	0.429	S	S	.	.	H	α-helix	trans	-80.2	-20	179	-70.3	176.4	-174.6	172.9	0	113.8	T154 W155 Q156 D161 S162	T154-K158 VanDerWaalsContact O-CB 3.24Å; T154-K158 WeakPolarHBondContact O-CB 3.11Å; T154-K158 VanDerWaalsContact O-CD 3.32Å; T154-K158 WeakPolarHBondContact O-CD 3.49Å; T154-K158 WeakPolarHBondContact O-CG 3.27Å; T154-K158 PolarHBondContact O-N 3.41Å; W155-K158 PolarHBondContact O-N 3.15Å; Q156-K158 VanDerWaalsContact C-N 3.29Å; Q156-K158 PolarHBondContact O-N 2.88Å; K158-D161 PolarHBondContact O-N 3.25Å; K158-S162 WeakPolarHBondContact O-CB 3.49Å; K158-S162 PolarHBondContact O-N 3.15Å
159	E	52.7	Low	56.4	Low	102 Å²	102	85.6 Å²	85.6	48%	0.477	44%	0.441	S	S	.	.	H	α-helix	trans	-67.2	-41.8	167.9	-159.9	179.7	176	0	0	110.1	W155 Q156 D161 S162	W155-E159 PolarHBondContact O-N 3.13Å; Q156-E159 PolarHBondContact O-N 3.47Å; E159-D161 PolarHBondContact O-N 2.84Å; E159-S162 PolarHBondContact O-N 2.96Å; E159-S162 PolarHBondContact O-OG 3.17Å
160	Y	51.4	Low	54.6	Low	188 Å²	188	84.5 Å²	84.5	74%	0.737	44%	0.437	S	S	*	.	H	α-helix	trans	-60.8	-41.6	170	-99.7	-84.3	0	0	0	113	Q156 E157 S162 L163	Q156-Y160 PolarHBondContact O-N 2.96Å; E157-Y160 WeakPolarHBondContact O-CB 3.39Å; E157-Y160 PolarHBondContact O-N 3.4Å; Y160-S162 VanDerWaalsContact C-N 3.31Å; Y160-S162 PolarHBondContact O-N 2.92Å; Y160-L163 PolarHBondContact O-N 3.38Å
161	D	46.8	Very low	53.3	Low	91 Å²	91	91.8 Å²	91.8	49%	0.487	47%	0.469	S	S	.	.	H	α-helix	trans	-71	-24.6	177	-79.9	-19.1	0	0	0	113.3	E157 K158 E159 L163 M164	E157-D161 PolarHBondContact O-N 3.27Å; E157-D161 VanDerWaalsContact O-N 3.09Å; K158-D161 PolarHBondContact O-N 3.25Å; E159-D161 PolarHBondContact O-N 2.84Å; D161-L163 PolarHBondContact O-N 2.8Å; D161-M164 PolarHBondContact O-N 3.19Å
162	S	48	Very low	51.5	Low	71 Å²	71	98.5 Å²	98.5	50%	0.497	50%	0.5	S	S	.	.	H	α-helix	trans	-68.3	-14.8	178	74.2	0	0	0	0	114	K158 E159 Y160	K158-S162 WeakPolarHBondContact O-CB 3.49Å; K158-S162 PolarHBondContact O-N 3.15Å; E159-S162 PolarHBondContact O-N 2.96Å; E159-S162 PolarHBondContact O-OG 3.17Å; Y160-S162 VanDerWaalsContact C-N 3.31Å; Y160-S162 PolarHBondContact O-N 2.92Å
163	L	48.8	Very low	49.8	Very low	142 Å²	142	100.5 Å²	100.5	74%	0.743	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-11.2	170.6	-75.4	155.4	0	0	0	113.3	Y160 D161	Y160-L163 PolarHBondContact O-N 3.38Å; D161-L163 PolarHBondContact O-N 2.8Å
164	M	42.1	Very low	48.9	Very low	148 Å²	148	105.7 Å²	105.7	73%	0.729	53%	0.526	S	S	*	.	S	Bend	trans	-106.7	91.5	178.9	-75.1	-75.3	-123.9	0	0	110.3	D161 N166	D161-M164 PolarHBondContact O-N 3.19Å; M164-N166 PolarHBondContact O-N 2.7Å
165	D	33.6	Very low	48.4	Very low	156 Å²	156	112.2 Å²	112.2	83%	0.834	55%	0.554	S	S	*	*			trans	-45.6	95.7	-178	-80.7	-43.2	0	0	0	115.2
166	N	40	Very low	47.5	Very low	128 Å²	128	113.9 Å²	113.9	68%	0.684	56%	0.564	S	S	*	*			trans	-131.3	107.9	162.3	-97.2	-25.1	0	0	0	111.5	M164 E168	M164-N166 PolarHBondContact O-N 2.7Å; N166-E168 VanDerWaalsContact C-N 3.33Å; N166-E168 PolarHBondContact O-N 2.93Å
167	P	47.9	Very low	46.9	Very low	110 Å²	110	113.8 Å²	113.8	71%	0.714	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	-6.8	-170.6	26.1	-33.2	0	0	0	116.3	T170	P167-T170 VanDerWaalsContact C-OG1 3.29Å; P167-T170 PolarHBondContact O-OG1 3.07Å
168	E	41.7	Very low	46.9	Very low	179 Å²	179	115.3 Å²	115.3	84%	0.836	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-28.8	177.8	-68.3	-173.3	159.1	0	0	112.9	N166 T170	N166-E168 VanDerWaalsContact C-N 3.33Å; N166-E168 PolarHBondContact O-N 2.93Å; E168-T170 PolarHBondContact O-N 3.05Å
169	A	37.4	Very low	47.4	Very low	36 Å²	36	115.5 Å²	115.5	30%	0.298	57%	0.57	S	S	.	*	H	α-helix	trans	-66.4	-22.2	175.5	0	0	0	0	0	112.4	K171 E172 M173	A169-K171 VanDerWaalsContact C-N 3.28Å; A169-K171 PolarHBondContact O-N 2.87Å; A169-E172 PolarHBondContact O-N 3.29Å; A169-M173 HydrophobicContact CB-CE 3.83Å; A169-M173 HydrophobicContact CB-SD 3.93Å; A169-M173 WeakPolarHBondContact O-CB 3.24Å; A169-M173 WeakPolarHBondContact O-CG 3.13Å; A169-M173 PolarHBondContact O-N 3.31Å
170	T	39.8	Very low	47.7	Very low	67 Å²	67	110.9 Å²	110.9	41%	0.411	55%	0.549	S	S	.	.	H	α-helix	trans	-66.1	-23	-171.8	-7.4	0	0	0	0	114.1	P167 E168 K174	P167-T170 VanDerWaalsContact C-OG1 3.29Å; P167-T170 PolarHBondContact O-OG1 3.07Å; E168-T170 PolarHBondContact O-N 3.05Å; T170-K174 WeakPolarHBondContact O-CB 3.32Å; T170-K174 VanDerWaalsContact O-CG 3.26Å; T170-K174 WeakPolarHBondContact O-CG 3.29Å; T170-K174 PolarHBondContact O-N 3.45Å; T170-K174 VanDerWaalsContact O-N 3.16Å
171	K	45.9	Very low	48.5	Very low	174 Å²	174	104.1 Å²	104.1	76%	0.757	53%	0.526	S	S	*	.	H	α-helix	trans	-83.1	-43.1	178.3	-76.8	-179.3	-179	171.6	0	113.1	A169 M173 K174 K175	A169-K171 VanDerWaalsContact C-N 3.28Å; A169-K171 PolarHBondContact O-N 2.87Å; K171-M173 VanDerWaalsContact C-N 3.31Å; K171-K174 PolarHBondContact O-N 3.3Å; K171-K175 PolarHBondContact O-N 3.34Å
172	E	40	Very low	49.6	Very low	142 Å²	142	102.3 Å²	102.3	66%	0.664	52%	0.52	S	S	*	.	H	α-helix	trans	-69.1	-35.7	174	-64.8	-174.4	163.5	0	0	110.3	A169 K175 H176	A169-E172 PolarHBondContact O-N 3.29Å; E172-K175 PolarHBondContact O-N 2.92Å; E172-H176 PolarHBondContact O-CD2 3.01Å; E172-H176 PolarHBondContact O-N 3.32Å
173	M	36.6	Very low	50.5	Low	50 Å²	50	99.5 Å²	99.5	25%	0.246	50%	0.499	C	S	.	.	H	α-helix	trans	-62.6	-40.2	172.1	-74.3	175.4	171.2	0	0	113	A169 K171 H176 R177	A169-M173 HydrophobicContact CB-CE 3.83Å; A169-M173 HydrophobicContact CB-SD 3.93Å; A169-M173 WeakPolarHBondContact O-CB 3.24Å; A169-M173 WeakPolarHBondContact O-CG 3.13Å; A169-M173 PolarHBondContact O-N 3.31Å; K171-M173 VanDerWaalsContact C-N 3.31Å; M173-H176 PolarHBondContact O-N 2.8Å; M173-R177 WeakPolarHBondContact O-CB 3.48Å; M173-R177 VanDerWaalsContact O-CG 3.23Å; M173-R177 WeakPolarHBondContact O-CG 3.49Å; M173-R177 PolarHBondContact O-N 3.48Å
174	K	53.3	Low	51.5	Low	128 Å²	128	92.8 Å²	92.8	56%	0.557	46%	0.464	S	S	*	.	H	α-helix	trans	-65.1	-41.5	174.9	-82	179	-178.5	-171.7	0	112.4	T170 K171 R177 E178	T170-K174 WeakPolarHBondContact O-CB 3.32Å; T170-K174 VanDerWaalsContact O-CG 3.26Å; T170-K174 WeakPolarHBondContact O-CG 3.29Å; T170-K174 PolarHBondContact O-N 3.45Å; T170-K174 VanDerWaalsContact O-N 3.16Å; K171-K174 PolarHBondContact O-N 3.3Å; K174-R177 WeakPolarHBondContact O-CB 3.23Å; K174-R177 PolarHBondContact O-N 2.88Å; K174-E178 WeakPolarHBondContact O-CG 3.36Å; K174-E178 PolarHBondContact O-N 3.26Å
175	K	57.3	Low	52.9	Low	142 Å²	142	89.2 Å²	89.2	62%	0.617	45%	0.445	S	S	*	.	H	α-helix	trans	-62.3	-47.3	173.6	-78.7	-172.9	172.5	-174.8	0	111.8	K171 E172 R177 E178 D179	K171-K175 PolarHBondContact O-N 3.34Å; E172-K175 PolarHBondContact O-N 2.92Å; K175-R177 VanDerWaalsContact C-N 3.26Å; K175-R177 PolarHBondContact O-N 3.3Å; K175-E178 PolarHBondContact O-N 3.44Å; K175-D179 VanDerWaalsContact O-CB 3.29Å; K175-D179 WeakPolarHBondContact O-CB 3.41Å; K175-D179 PolarHBondContact O-N 3.18Å
176	H	50.4	Low	54.7	Low	81 Å²	81	85.2 Å²	85.2	38%	0.375	42%	0.422	S	S	.	.	H	α-helix	trans	-62.8	-32.1	175.8	-73.9	-51.1	0	0	0	113	E172 M173 C180	E172-H176 PolarHBondContact O-CD2 3.01Å; E172-H176 PolarHBondContact O-N 3.32Å; M173-H176 PolarHBondContact O-N 2.8Å; H176-C180 WeakPolarHBondContact O-CB 3.26Å; H176-C180 PolarHBondContact O-N 2.95Å; H176-C180 PolarHBondContact O-SG 3.4Å
177	R	55.2	Low	56.3	Low	99 Å²	99	79.1 Å²	79.1	37%	0.374	39%	0.389	S	S	.	.	H	α-helix	trans	-67.4	-47.1	172.2	-76.5	174.5	-177.6	-176	1	111.6	W155 M173 K174 K175 D179 C180 L181	W155-R177 HydrophobicContact CZ3-CG 4.08Å; M173-R177 WeakPolarHBondContact O-CB 3.48Å; M173-R177 VanDerWaalsContact O-CG 3.23Å; M173-R177 WeakPolarHBondContact O-CG 3.49Å; M173-R177 PolarHBondContact O-N 3.48Å; K174-R177 WeakPolarHBondContact O-CB 3.23Å; K174-R177 PolarHBondContact O-N 2.88Å; K175-R177 VanDerWaalsContact C-N 3.26Å; K175-R177 PolarHBondContact O-N 3.3Å; R177-D179 VanDerWaalsContact C-N 3.3Å; R177-D179 PolarHBondContact O-N 2.89Å; R177-C180 PolarHBondContact O-N 2.68Å; R177-L181 WeakPolarHBondContact O-CB 3.41Å; R177-L181 VanDerWaalsContact O-CG 3.23Å; R177-L181 WeakPolarHBondContact O-CG 3.49Å; R177-L181 PolarHBondContact O-N 3.29Å
178	E	62.2	Low	57.4	Low	126 Å²	126	73.9 Å²	73.9	59%	0.589	36%	0.355	S	S	*	.	H	α-helix	trans	-61.4	-40.6	175.7	-73.6	171.7	-174.2	0	0	111.6	K174 K175 L181 S182	K174-E178 WeakPolarHBondContact O-CG 3.36Å; K174-E178 PolarHBondContact O-N 3.26Å; K175-E178 PolarHBondContact O-N 3.44Å; E178-L181 PolarHBondContact O-N 2.91Å; E178-S182 PolarHBondContact O-N 3.47Å
179	D	63.7	Low	59	Low	65 Å²	65	67.1 Å²	67.1	35%	0.348	33%	0.327	S	S	.	.	H	α-helix	trans	-65.6	-43.1	177	-70.1	-21.6	0	0	0	111.4	L129 K175 R177 S182 L183	L129-D179 HydrophobicContact CD1-CB 4.17Å; L129-D179 HydrophobicContact CD2-CB 3.69Å; K175-D179 VanDerWaalsContact O-CB 3.29Å; K175-D179 WeakPolarHBondContact O-CB 3.41Å; K175-D179 PolarHBondContact O-N 3.18Å; R177-D179 VanDerWaalsContact C-N 3.3Å; R177-D179 PolarHBondContact O-N 2.89Å; D179-S182 PolarHBondContact O-N 3.19Å; D179-S182 PolarHBondContact O-OG 3.19Å; D179-L183 PolarHBondContact O-N 3.41Å; D179-L183 VanDerWaalsContact O-N 3.09Å
180	C	60.5	Low	60.6	Low	6 Å²	6	67.1 Å²	67.1	4%	0.041	32%	0.319	C	S	.	.	H	α-helix	trans	-64.2	-40.8	173.4	-69	0	0	0	0	111.6	H176 R177 S182 L183 V184	H176-C180 WeakPolarHBondContact O-CB 3.26Å; H176-C180 PolarHBondContact O-N 2.95Å; H176-C180 PolarHBondContact O-SG 3.4Å; R177-C180 PolarHBondContact O-N 2.68Å; C180-S182 VanDerWaalsContact C-N 3.32Å; C180-S182 PolarHBondContact O-N 3.24Å; C180-L183 WeakPolarHBondContact O-CB 3.47Å; C180-L183 PolarHBondContact O-N 3.16Å; C180-V184 WeakPolarHBondContact O-CG2 3.18Å; C180-V184 PolarHBondContact O-N 3.13Å
181	L	67.4	Low	62.1	Low	46 Å²	46	63.9 Å²	63.9	24%	0.241	30%	0.3	C	S	.	.	H	α-helix	trans	-63.3	-39.6	175.5	-70.7	169	0	0	0	111.5	R177 E178 L183 V184 H185 I207 Q209	R177-L181 WeakPolarHBondContact O-CB 3.41Å; R177-L181 VanDerWaalsContact O-CG 3.23Å; R177-L181 WeakPolarHBondContact O-CG 3.49Å; R177-L181 PolarHBondContact O-N 3.29Å; E178-L181 PolarHBondContact O-N 2.91Å; L181-L183 VanDerWaalsContact C-N 3.31Å; L181-L183 PolarHBondContact O-N 3.09Å; L181-V184 PolarHBondContact O-N 3.2Å; L181-H185 PolarHBondContact O-CD2 3.32Å; L181-H185 PolarHBondContact O-N 3.44Å; L181-I207 HydrophobicContact CD2-CG2 4.4Å; L181-Q209 HydrophobicContact CD2-CB 4.48Å; L181-Q209 HydrophobicContact CD2-CG 4.04Å
182	S	68.8	Low	63.1	Low	52 Å²	52	56 Å²	56	36%	0.364	27%	0.266	S	S	.	.	H	α-helix	trans	-62.8	-37.8	175.6	81.2	0	0	0	0	112.5	E178 D179 C180 Q186	E178-S182 PolarHBondContact O-N 3.47Å; D179-S182 PolarHBondContact O-N 3.19Å; D179-S182 PolarHBondContact O-OG 3.19Å; C180-S182 VanDerWaalsContact C-N 3.32Å; C180-S182 PolarHBondContact O-N 3.24Å; S182-Q186 PolarHBondContact O-N 2.89Å
183	L	67.5	Low	64.8	Low	12 Å²	12	56.6 Å²	56.6	6%	0.063	27%	0.269	C	S	.	.	H	α-helix	trans	-67.3	-42.1	173.2	-75.5	172.7	0	0	0	111.4	R128 L129 D179 C180 L181 H185 Q186 I187	R128-L183 HydrophobicContact CG-CD2 4.32Å; L129-L183 HydrophobicContact CD2-CD1 3.49Å; L129-L183 VanDerWaalsContact CD2-CD1 3.49Å; L129-L183 HydrophobicContact CD2-CG 4.08Å; L129-L183 HydrophobicContact CG-CD1 4.17Å; D179-L183 PolarHBondContact O-N 3.41Å; D179-L183 VanDerWaalsContact O-N 3.09Å; C180-L183 WeakPolarHBondContact O-CB 3.47Å; C180-L183 PolarHBondContact O-N 3.16Å; L181-L183 VanDerWaalsContact C-N 3.31Å; L181-L183 PolarHBondContact O-N 3.09Å; L183-H185 VanDerWaalsContact C-N 3.31Å; L183-H185 PolarHBondContact O-N 2.93Å; L183-Q186 WeakPolarHBondContact O-CB 3.41Å; L183-Q186 PolarHBondContact O-N 3.2Å; L183-I187 VanDerWaalsContact O-CG1 3.25Å; L183-I187 WeakPolarHBondContact O-CG1 3.34Å; L183-I187 PolarHBondContact O-N 3.31Å
184	V	71.1	Confident	66.3	Low	1 Å²	1	58.5 Å²	58.5	1%	0.006	28%	0.276	C	S	.	.	H	α-helix	trans	-63.5	-39.3	178.8	174.2	0	0	0	0	110.8	I151 C180 L181 Q186 I187 I188 L203 I207 L212	I151-V184 HydrophobicContact CD1-CG2 4.34Å; I151-V184 HydrophobicContact CG2-CG2 4.35Å; C180-V184 WeakPolarHBondContact O-CG2 3.18Å; C180-V184 PolarHBondContact O-N 3.13Å; L181-V184 PolarHBondContact O-N 3.2Å; V184-Q186 PolarHBondContact O-N 2.93Å; V184-I187 PolarHBondContact O-N 3.03Å; V184-I187 VanDerWaalsContact O-N 3.13Å; V184-I188 HydrophobicContact CG1-CD1 3.45Å; V184-I188 VanDerWaalsContact CG1-CD1 3.45Å; V184-I188 HydrophobicContact CG1-CG1 3.94Å; V184-I188 WeakPolarHBondContact O-CG1 3.06Å; V184-I188 PolarHBondContact O-N 2.91Å; V184-L203 HydrophobicContact CG1-CD2 4.27Å; V184-L203 HydrophobicContact CG2-CD2 4.48Å; V184-I207 HydrophobicContact CB-CD1 4.35Å; V184-I207 HydrophobicContact CG1-CD1 4.03Å; V184-I207 HydrophobicContact CG2-CD1 3.39Å; V184-L212 HydrophobicContact CG1-CD1 3.72Å
185	H	70.6	Confident	67.1	Low	73 Å²	73	57.5 Å²	57.5	34%	0.338	28%	0.277	S	S	.	.	H	α-helix	trans	-59.6	-25.4	172.2	-80.2	-66.6	0	0	0	114.1	L181 L183 P189 L212 Y216	L181-H185 PolarHBondContact O-CD2 3.32Å; L181-H185 PolarHBondContact O-N 3.44Å; L183-H185 VanDerWaalsContact C-N 3.31Å; L183-H185 PolarHBondContact O-N 2.93Å; H185-P189 WeakPolarHBondContact O-CD 3.36Å; H185-P189 WeakPolarHBondContact O-CG 3.25Å; H185-L212 WeakPolarHBondContact CE1-CD2 3.5Å; H185-Y216 AromaticContact ND1-CE2 3.89Å; H185-Y216 AromaticContact ND1-CZ 3.83Å; H185-Y216 PolarHBondContact ND1-OH 3.34Å; H185-Y216 PolarHBondContact O-OH 3.44Å
186	Q	71.3	Confident	67.8	Low	73 Å²	73	51.7 Å²	51.7	34%	0.341	26%	0.256	S	S	.	.	H	α-helix	trans	-90.1	-30.2	175.3	-65.9	175.2	4.6	0	0	112.2	I136 S182 L183 V184	I136-Q186 HydrophobicContact CD1-CB 3.5Å; I136-Q186 VanDerWaalsContact CD1-CB 3.5Å; I136-Q186 HydrophobicContact CG1-CB 4.3Å; S182-Q186 PolarHBondContact O-N 2.89Å; L183-Q186 WeakPolarHBondContact O-CB 3.41Å; L183-Q186 PolarHBondContact O-N 3.2Å; V184-Q186 PolarHBondContact O-N 2.93Å
187	I	74.3	Confident	68.8	Low	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-75.9	-44.5	-179.2	-68.3	165.3	0	0	0	111.3	I136 V144 I151 L183 V184 Y190 L191 L203	I136-I187 HydrophobicContact CD1-CD1 4.47Å; I136-I187 HydrophobicContact CD1-CG1 3.55Å; I136-I187 HydrophobicContact CG2-CG1 4.45Å; V144-I187 HydrophobicContact CG1-CG2 3.84Å; I151-I187 HydrophobicContact CD1-CD1 3.67Å; L183-I187 VanDerWaalsContact O-CG1 3.25Å; L183-I187 WeakPolarHBondContact O-CG1 3.34Å; L183-I187 PolarHBondContact O-N 3.31Å; V184-I187 PolarHBondContact O-N 3.03Å; V184-I187 VanDerWaalsContact O-N 3.13Å; I187-Y190 WeakPolarHBondContact O-CB 3.48Å; I187-Y190 PolarHBondContact O-N 3Å; I187-L191 HydrophobicContact CG2-CD1 3.45Å; I187-L191 VanDerWaalsContact CG2-CD1 3.45Å; I187-L191 HydrophobicContact CG2-CG 3.92Å; I187-L191 WeakPolarHBondContact O-CG 3.37Å; I187-L191 PolarHBondContact O-N 2.9Å; I187-L203 HydrophobicContact CG2-CD2 4.06Å
188	I	71.1	Confident	69.8	Low	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-60.6	-46.9	-175.4	-65.1	169.7	0	0	0	112.3	V184 Y190 L191 M192 L212 Y216	V184-I188 HydrophobicContact CG1-CD1 3.45Å; V184-I188 VanDerWaalsContact CG1-CD1 3.45Å; V184-I188 HydrophobicContact CG1-CG1 3.94Å; V184-I188 WeakPolarHBondContact O-CG1 3.06Å; V184-I188 PolarHBondContact O-N 2.91Å; I188-Y190 VanDerWaalsContact C-N 3.28Å; I188-Y190 PolarHBondContact O-N 3.2Å; I188-L191 PolarHBondContact O-N 3.43Å; I188-M192 HydrophobicContact CG2-CE 4.46Å; I188-M192 HydrophobicContact CG2-CG 4.15Å; I188-M192 WeakPolarHBondContact O-CB 3.47Å; I188-M192 VanDerWaalsContact O-CG 3.22Å; I188-M192 WeakPolarHBondContact O-CG 3.18Å; I188-M192 PolarHBondContact O-N 3.09Å; I188-L212 HydrophobicContact CD1-CB 3.69Å; I188-L212 HydrophobicContact CD1-CD1 3.96Å; I188-L212 HydrophobicContact CD1-CG 4.39Å; I188-Y216 HydrophobicContact CB-CD2 4Å; I188-Y216 HydrophobicContact CB-CE2 4.37Å; I188-Y216 HydrophobicContact CG2-CD2 3.52Å; I188-Y216 HydrophobicContact CG2-CE2 4.36Å; I188-Y216 HydrophobicContact CG2-CG 3.84Å
189	P	75.7	Confident	70.4	Confident	37 Å²	37	42.5 Å²	42.5	24%	0.24	22%	0.224	C	C	.	.	H	α-helix	trans	-57.7	-42.9	175.6	-22.9	31.5	0	0	0	112.4	H185 M192 E193 Y216	H185-P189 WeakPolarHBondContact O-CD 3.36Å; H185-P189 WeakPolarHBondContact O-CG 3.25Å; P189-M192 PolarHBondContact O-N 3.02Å; P189-E193 WeakPolarHBondContact O-CB 3.35Å; P189-E193 WeakPolarHBondContact O-CG 3.1Å; P189-E193 PolarHBondContact O-N 3.39Å; P189-Y216 HydrophobicContact CB-CD1 4.43Å; P189-Y216 HydrophobicContact CG-CD1 3.72Å; P189-Y216 HydrophobicContact CG-CE1 3.5Å; P189-Y216 HydrophobicContact CG-CG 4.41Å
190	Y	69.7	Low	70.9	Confident	35 Å²	35	39.4 Å²	39.4	14%	0.137	21%	0.208	C	C	.	.	H	α-helix	trans	-64.5	-44.6	-179.6	-178.3	-98	0	0	0	111.9	G137 H141 V144 I187 I188 M192 E193 H194	G137-Y190 WeakPolarHBondContact CA-OH 3.48Å; G137-Y190 PolarHBondContact O-OH 3.23Å; H141-Y190 AromaticContact CE1-CE1 3.74Å; H141-Y190 AromaticContact ND1-CE1 3.97Å; V144-Y190 HydrophobicContact CG2-CD1 4.19Å; V144-Y190 HydrophobicContact CG2-CE1 4Å; I187-Y190 WeakPolarHBondContact O-CB 3.48Å; I187-Y190 PolarHBondContact O-N 3Å; I188-Y190 VanDerWaalsContact C-N 3.28Å; I188-Y190 PolarHBondContact O-N 3.2Å; Y190-M192 VanDerWaalsContact C-N 3.32Å; Y190-M192 PolarHBondContact O-N 3.46Å; Y190-E193 PolarHBondContact O-N 2.88Å; Y190-H194 AromaticContact CD2-CD2 3.59Å; Y190-H194 AromaticContact CD2-NE2 3.8Å; Y190-H194 AromaticContact CE1-CD2 3.99Å; Y190-H194 AromaticContact CE2-CD2 3.18Å; Y190-H194 WeakPolarHBondContact CE2-CD2 3.48Å; Y190-H194 AromaticContact CE2-NE2 3.06Å; Y190-H194 WeakPolarHBondContact CE2-NE2 3.42Å; Y190-H194 AromaticContact CZ-CD2 3.4Å; Y190-H194 VanDerWaalsContact CZ-CD2 3.4Å; Y190-H194 AromaticContact CZ-NE2 3.47Å; Y190-H194 WeakPolarHBondContact O-CB 3.23Å; Y190-H194 PolarHBondContact O-CD2 2.87Å; Y190-H194 VanDerWaalsContact O-CD2 3.29Å; Y190-H194 PolarHBondContact O-N 3.31Å; Y190-H194 VanDerWaalsContact O-N 3.1Å
191	L	71.1	Confident	71.6	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-64.7	-38	176.6	-69.8	174.8	0	0	0	111.6	V144 I187 I188 N195 A196 E199 A200	V144-L191 HydrophobicContact CG1-CD2 3.97Å; V144-L191 HydrophobicContact CG1-CG 4.35Å; I187-L191 HydrophobicContact CG2-CD1 3.45Å; I187-L191 VanDerWaalsContact CG2-CD1 3.45Å; I187-L191 HydrophobicContact CG2-CG 3.92Å; I187-L191 WeakPolarHBondContact O-CG 3.37Å; I187-L191 PolarHBondContact O-N 2.9Å; I188-L191 PolarHBondContact O-N 3.43Å; L191-N195 PolarHBondContact O-N 3.11Å; L191-A196 HydrophobicContact CB-CB 4.4Å; L191-A196 HydrophobicContact CD2-CB 3.88Å; L191-A196 CarbonylContact O-C 3.42Å; L191-A196 WeakPolarHBondContact O-CA 3.39Å; L191-A196 PolarHBondContact O-N 2.88Å; L191-E199 HydrophobicContact CD1-CB 4.41Å; L191-E199 HydrophobicContact CD2-CB 4.47Å; L191-A200 HydrophobicContact CB-CB 3.83Å; L191-A200 HydrophobicContact CD1-CB 3.96Å
192	M	68.3	Low	72.2	Confident	9 Å²	9	39.7 Å²	39.7	4%	0.044	21%	0.209	C	C	.	.	H	α-helix	trans	-70.3	-37.6	177.7	-69.1	-64.2	-179.8	0	0	112.9	I188 P189 Y190 E197 A200 L213 N221 V225	I188-M192 HydrophobicContact CG2-CE 4.46Å; I188-M192 HydrophobicContact CG2-CG 4.15Å; I188-M192 WeakPolarHBondContact O-CB 3.47Å; I188-M192 VanDerWaalsContact O-CG 3.22Å; I188-M192 WeakPolarHBondContact O-CG 3.18Å; I188-M192 PolarHBondContact O-N 3.09Å; P189-M192 PolarHBondContact O-N 3.02Å; Y190-M192 VanDerWaalsContact C-N 3.32Å; Y190-M192 PolarHBondContact O-N 3.46Å; M192-E197 HydrophobicContact SD-CB 4.19Å; M192-E197 HydrophobicContact SD-CG 3.84Å; M192-A200 HydrophobicContact CE-CB 3.73Å; M192-A200 HydrophobicContact SD-CB 4.44Å; M192-L213 HydrophobicContact CE-CD2 4.09Å; M192-N221 PolarHBondContact O-ND2 2.73Å; M192-V225 HydrophobicContact CE-CG2 4.39Å; M192-V225 HydrophobicContact SD-CG2 4.48Å
193	E	73.9	Confident	72.5	Confident	154 Å²	154	37.2 Å²	37.2	72%	0.72	19%	0.192	S	C	*	.	H	α-helix	trans	-69.3	-35.7	176.5	-76.7	-178.1	177.7	0	0	112.4	P189 Y190 N195	P189-E193 WeakPolarHBondContact O-CB 3.35Å; P189-E193 WeakPolarHBondContact O-CG 3.1Å; P189-E193 PolarHBondContact O-N 3.39Å; Y190-E193 PolarHBondContact O-N 2.88Å; E193-N195 VanDerWaalsContact C-N 3.28Å; E193-N195 PolarHBondContact O-N 2.85Å
194	H	69.4	Low	72.9	Confident	89 Å²	89	36.6 Å²	36.6	41%	0.412	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	14.3	-179.5	-76.8	-88.6	0	0	0	114.4	H141 Y190 A196	H141-H194 AromaticContact CE1-CG 3.77Å; H141-H194 AromaticContact NE2-CG 3.88Å; H141-H194 AromaticContact NE2-ND1 3.7Å; Y190-H194 AromaticContact CD2-CD2 3.59Å; Y190-H194 AromaticContact CD2-NE2 3.8Å; Y190-H194 AromaticContact CE1-CD2 3.99Å; Y190-H194 AromaticContact CE2-CD2 3.18Å; Y190-H194 WeakPolarHBondContact CE2-CD2 3.48Å; Y190-H194 AromaticContact CE2-NE2 3.06Å; Y190-H194 WeakPolarHBondContact CE2-NE2 3.42Å; Y190-H194 AromaticContact CZ-CD2 3.4Å; Y190-H194 VanDerWaalsContact CZ-CD2 3.4Å; Y190-H194 AromaticContact CZ-NE2 3.47Å; Y190-H194 WeakPolarHBondContact O-CB 3.23Å; Y190-H194 PolarHBondContact O-CD2 2.87Å; Y190-H194 VanDerWaalsContact O-CD2 3.29Å; Y190-H194 PolarHBondContact O-N 3.31Å; Y190-H194 VanDerWaalsContact O-N 3.1Å; H194-A196 PolarHBondContact O-N 3.06Å
195	N	69.1	Low	73.1	Confident	108 Å²	108	38 Å²	38	58%	0.578	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	61	17.4	-177.3	-58	-60.6	0	0	0	115.1	L191 E193 E197	L191-N195 PolarHBondContact O-N 3.11Å; E193-N195 VanDerWaalsContact C-N 3.28Å; E193-N195 PolarHBondContact O-N 2.85Å; N195-E197 PolarHBondContact O-N 2.79Å
196	A	72.6	Confident	73.3	Confident	20 Å²	20	38.3 Å²	38.3	17%	0.165	20%	0.197	C	C	.	.			trans	-90.1	52	175.2	0	0	0	0	0	110.9	L191 H194 A198 A200	L191-A196 HydrophobicContact CB-CB 4.4Å; L191-A196 HydrophobicContact CD2-CB 3.88Å; L191-A196 CarbonylContact O-C 3.42Å; L191-A196 WeakPolarHBondContact O-CA 3.39Å; L191-A196 PolarHBondContact O-N 2.88Å; H194-A196 PolarHBondContact O-N 3.06Å; A196-A198 VanDerWaalsContact C-N 3.33Å; A196-A198 PolarHBondContact O-N 3.38Å; A196-A200 PolarHBondContact O-N 2.88Å
197	E	71	Confident	73.2	Confident	11 Å²	11	35 Å²	35	5%	0.051	18%	0.182	C	C	.	.	H	α-helix	trans	-65.5	-34.4	-174.5	-60.3	171.8	-169.8	0	0	112.4	M192 N195 A200 I201 N221 R224 V225	M192-E197 HydrophobicContact SD-CB 4.19Å; M192-E197 HydrophobicContact SD-CG 3.84Å; N195-E197 PolarHBondContact O-N 2.79Å; E197-A200 WeakPolarHBondContact O-CB 3.48Å; E197-A200 PolarHBondContact O-N 3.36Å; E197-I201 WeakPolarHBondContact O-CD1 3.49Å; E197-I201 WeakPolarHBondContact O-CG1 3.49Å; E197-I201 PolarHBondContact O-N 2.85Å; E197-N221 WeakPolarHBondContact OE1-CB 3.49Å; E197-N221 PolarHBondContact OE1-ND2 3.25Å; E197-N221 PolarHBondContact OE1-OD1 3.21Å; E197-R224 WeakPolarHBondContact OE2-CB 3.49Å; E197-V225 HydrophobicContact CB-CG2 4.26Å; E197-V225 HydrophobicContact CG-CG2 4.37Å
198	A	76.7	Confident	72.9	Confident	41 Å²	41	38.8 Å²	38.8	34%	0.339	20%	0.2	S	C	.	.	H	α-helix	trans	-62.2	-48.7	179.6	0	0	0	0	0	111.9	A196 A200 I201 D202 Y228	A196-A198 VanDerWaalsContact C-N 3.33Å; A196-A198 PolarHBondContact O-N 3.38Å; A198-A200 PolarHBondContact O-N 3.47Å; A198-I201 PolarHBondContact O-N 3.1Å; A198-I201 VanDerWaalsContact O-N 3.14Å; A198-D202 VanDerWaalsContact O-CG 3.24Å; A198-D202 PolarHBondContact O-N 3.44Å; A198-Y228 HydrophobicContact CB-CD2 4.31Å; A198-Y228 HydrophobicContact CB-CE1 4.28Å; A198-Y228 HydrophobicContact CB-CE2 3.85Å
199	E	73.7	Confident	72.5	Confident	60 Å²	60	42.5 Å²	42.5	28%	0.28	22%	0.217	S	C	.	.	H	α-helix	trans	-63.1	-33.1	177.9	-62.8	-173.5	168.5	0	0	111.9	L191 L203	L191-E199 HydrophobicContact CD1-CB 4.41Å; L191-E199 HydrophobicContact CD2-CB 4.47Å; E199-L203 WeakPolarHBondContact O-CB 3.2Å; E199-L203 PolarHBondContact O-N 3.14Å; E199-L203 VanDerWaalsContact O-N 3.09Å
200	A	74.5	Confident	71.8	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-69.3	-39.9	176	0	0	0	0	0	112	L191 M192 A196 E197 A198 C204	L191-A200 HydrophobicContact CB-CB 3.83Å; L191-A200 HydrophobicContact CD1-CB 3.96Å; M192-A200 HydrophobicContact CE-CB 3.73Å; M192-A200 HydrophobicContact SD-CB 4.44Å; A196-A200 PolarHBondContact O-N 2.88Å; E197-A200 WeakPolarHBondContact O-CB 3.48Å; E197-A200 PolarHBondContact O-N 3.36Å; A198-A200 PolarHBondContact O-N 3.47Å; A200-C204 PolarHBondContact O-N 3.34Å; A200-C204 VanDerWaalsContact O-N 3.09Å; A200-C204 PolarHBondContact O-SG 3.34Å
201	I	75.9	Confident	71.5	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-70.2	-44	178.4	-64.7	159	0	0	0	110.3	E197 A198 L203 C204 I205 L213 V225 Y228 L229	E197-I201 WeakPolarHBondContact O-CD1 3.49Å; E197-I201 WeakPolarHBondContact O-CG1 3.49Å; E197-I201 PolarHBondContact O-N 2.85Å; A198-I201 PolarHBondContact O-N 3.1Å; A198-I201 VanDerWaalsContact O-N 3.14Å; I201-L203 VanDerWaalsContact C-N 3.3Å; I201-L203 PolarHBondContact O-N 3.3Å; I201-C204 WeakPolarHBondContact O-CA 3.31Å; I201-C204 WeakPolarHBondContact O-CB 3.3Å; I201-C204 PolarHBondContact O-N 2.97Å; I201-I205 HydrophobicContact CG2-CD1 3.75Å; I201-I205 HydrophobicContact CG2-CG1 4.25Å; I201-I205 WeakPolarHBondContact O-CG1 3.41Å; I201-I205 PolarHBondContact O-N 3.2Å; I201-L213 HydrophobicContact CG1-CD2 4.18Å; I201-V225 HydrophobicContact CD1-CB 4.11Å; I201-V225 HydrophobicContact CD1-CG1 3.76Å; I201-V225 HydrophobicContact CD1-CG2 4.18Å; I201-V225 HydrophobicContact CG1-CG1 4.15Å; I201-Y228 HydrophobicContact CB-CD1 3.81Å; I201-Y228 HydrophobicContact CB-CE1 3.92Å; I201-Y228 HydrophobicContact CD1-CD1 3.48Å; I201-Y228 VanDerWaalsContact CD1-CD1 3.48Å; I201-Y228 HydrophobicContact CD1-CE1 4.35Å; I201-Y228 HydrophobicContact CD1-CG 4.04Å; I201-Y228 HydrophobicContact CG1-CD1 4.26Å; I201-Y228 HydrophobicContact CG2-CD1 3.67Å; I201-Y228 HydrophobicContact CG2-CE1 3.86Å; I201-L229 HydrophobicContact CG2-CD2 3.53Å; I201-L229 HydrophobicContact CG2-CG 4.25Å
202	D	80.7	Confident	71	Confident	58 Å²	58	45.8 Å²	45.8	31%	0.31	23%	0.23	S	C	.	.	H	α-helix	trans	-57.6	-46.3	176.5	-66.7	-16.8	0	0	0	110.5	A198 C204 I205 E206 Y228	A198-D202 VanDerWaalsContact O-CG 3.24Å; A198-D202 PolarHBondContact O-N 3.44Å; D202-C204 VanDerWaalsContact C-N 3.28Å; D202-C204 PolarHBondContact O-N 2.69Å; D202-I205 PolarHBondContact O-N 3.16Å; D202-E206 WeakPolarHBondContact O-CB 3.36Å; D202-E206 WeakPolarHBondContact O-CG 3.22Å; D202-E206 PolarHBondContact O-N 2.89Å; D202-Y228 VanDerWaalsContact CG-OH 3.29Å; D202-Y228 VanDerWaalsContact OD1-CE1 3.3Å; D202-Y228 WeakPolarHBondContact OD1-CE1 3.15Å; D202-Y228 PolarHBondContact OD1-OH 3.5Å; D202-Y228 PolarHBondContact OD2-OH 2.89Å
203	L	75.3	Confident	70.9	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-58.3	-39.8	174.1	-177.6	60	0	0	0	112.5	T148 I151 V152 V184 I187 E199 I201 I207	T148-L203 HydrophobicContact CG2-CB 3.99Å; T148-L203 HydrophobicContact CG2-CD1 3.7Å; T148-L203 HydrophobicContact CG2-CD2 4.23Å; T148-L203 HydrophobicContact CG2-CG 4.17Å; I151-L203 HydrophobicContact CG2-CD1 4.27Å; V152-L203 HydrophobicContact CG2-CD1 3.93Å; V184-L203 HydrophobicContact CG1-CD2 4.27Å; V184-L203 HydrophobicContact CG2-CD2 4.48Å; I187-L203 HydrophobicContact CG2-CD2 4.06Å; E199-L203 WeakPolarHBondContact O-CB 3.2Å; E199-L203 PolarHBondContact O-N 3.14Å; E199-L203 VanDerWaalsContact O-N 3.09Å; I201-L203 VanDerWaalsContact C-N 3.3Å; I201-L203 PolarHBondContact O-N 3.3Å; L203-I207 HydrophobicContact CD1-CD1 3.42Å; L203-I207 VanDerWaalsContact CD1-CD1 3.42Å; L203-I207 HydrophobicContact CD1-CG1 3.97Å; L203-I207 HydrophobicContact CD2-CD1 4.47Å; L203-I207 HydrophobicContact CG-CD1 3.7Å; L203-I207 HydrophobicContact CG-CG1 4.46Å; L203-I207 WeakPolarHBondContact O-CB 3.48Å; L203-I207 WeakPolarHBondContact O-CG1 3.46Å; L203-I207 PolarHBondContact O-N 3.41Å
204	C	75.3	Confident	70.5	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-71.1	-36.1	179.4	-68.9	0	0	0	0	112.5	A200 I201 D202 E208 L213	A200-C204 PolarHBondContact O-N 3.34Å; A200-C204 VanDerWaalsContact O-N 3.09Å; A200-C204 PolarHBondContact O-SG 3.34Å; I201-C204 WeakPolarHBondContact O-CA 3.31Å; I201-C204 WeakPolarHBondContact O-CB 3.3Å; I201-C204 PolarHBondContact O-N 2.97Å; D202-C204 VanDerWaalsContact C-N 3.28Å; D202-C204 PolarHBondContact O-N 2.69Å; C204-E208 PolarHBondContact O-N 3.28Å; C204-L213 HydrophobicContact CB-CD1 3.92Å; C204-L213 HydrophobicContact CB-CD2 4.08Å; C204-L213 HydrophobicContact CB-CG 3.86Å
205	I	75.5	Confident	70.7	Confident	31 Å²	31	42 Å²	42	16%	0.159	22%	0.215	C	C	.	.	H	α-helix	trans	-65.1	-46.3	174.4	-69.3	168.8	0	0	0	109.2	I201 D202 E208 C232 L236 V244	I201-I205 HydrophobicContact CG2-CD1 3.75Å; I201-I205 HydrophobicContact CG2-CG1 4.25Å; I201-I205 WeakPolarHBondContact O-CG1 3.41Å; I201-I205 PolarHBondContact O-N 3.2Å; D202-I205 PolarHBondContact O-N 3.16Å; I205-E208 PolarHBondContact O-N 3.39Å; I205-C232 HydrophobicContact CD1-CB 4.42Å; I205-L236 HydrophobicContact CG2-CD2 3.88Å; I205-V244 HydrophobicContact CG1-CG2 4.43Å
206	E	74.4	Confident	70.4	Confident	79 Å²	79	39.7 Å²	39.7	37%	0.369	20%	0.199	S	C	.	.	H	α-helix	trans	-72	-30.2	-177	-70.8	177.8	143.4	0	0	113.8	V152 D202 E208	V152-E206 HydrophobicContact CG1-CB 4.14Å; V152-E206 VanDerWaalsContact CG1-CD 3.4Å; V152-E206 HydrophobicContact CG1-CG 4.2Å; V152-E206 VanDerWaalsContact CG1-OE2 3.27Å; V152-E206 WeakPolarHBondContact CG1-OE2 3.49Å; V152-E206 HydrophobicContact CG2-CB 4.03Å; V152-E206 WeakPolarHBondContact CG2-OE2 3.22Å; D202-E206 WeakPolarHBondContact O-CB 3.36Å; D202-E206 WeakPolarHBondContact O-CG 3.22Å; D202-E206 PolarHBondContact O-N 2.89Å; E206-E208 VanDerWaalsContact C-N 3.27Å
207	I	69.7	Low	70	Confident	3 Å²	3	39.6 Å²	39.6	2%	0.015	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-11	175	-65.3	175.6	0	0	0	111.5	I151 W155 L181 V184 L203 Q209	I151-I207 HydrophobicContact CG2-CD1 3.88Å; I151-I207 HydrophobicContact CG2-CG1 4.35Å; W155-I207 HydrophobicContact CH2-CG2 4.31Å; W155-I207 HydrophobicContact CZ2-CG2 4.29Å; W155-I207 WeakPolarHBondContact CZ2-O 3.42Å; W155-I207 HydrophobicContact CZ3-CG2 4.48Å; L181-I207 HydrophobicContact CD2-CG2 4.4Å; V184-I207 HydrophobicContact CB-CD1 4.35Å; V184-I207 HydrophobicContact CG1-CD1 4.03Å; V184-I207 HydrophobicContact CG2-CD1 3.39Å; L203-I207 HydrophobicContact CD1-CD1 3.42Å; L203-I207 VanDerWaalsContact CD1-CD1 3.42Å; L203-I207 HydrophobicContact CD1-CG1 3.97Å; L203-I207 HydrophobicContact CD2-CD1 4.47Å; L203-I207 HydrophobicContact CG-CD1 3.7Å; L203-I207 HydrophobicContact CG-CG1 4.46Å; L203-I207 WeakPolarHBondContact O-CB 3.48Å; L203-I207 WeakPolarHBondContact O-CG1 3.46Å; L203-I207 PolarHBondContact O-N 3.41Å; I207-Q209 HydrophobicContact CG2-CB 3.77Å; I207-Q209 HydrophobicContact CG2-CG 3.66Å; I207-Q209 PolarHBondContact O-N 3.36Å
208	E	68	Low	69.9	Low	79 Å²	79	41.3 Å²	41.3	37%	0.369	21%	0.209	S	C	.	.			trans	55.3	11.3	-170.5	-55.6	-169.1	119.2	0	0	114.7	C204 I205 E206 H210 K243	C204-E208 PolarHBondContact O-N 3.28Å; I205-E208 PolarHBondContact O-N 3.39Å; E206-E208 VanDerWaalsContact C-N 3.27Å; E208-H210 VanDerWaalsContact C-ND1 3.35Å; E208-H210 PolarHBondContact O-CE1 3.3Å; E208-H210 PolarHBondContact O-N 2.97Å; E208-H210 PolarHBondContact O-ND1 2.94Å; E208-K243 IonicContact OE1-NZ 3.6Å
209	Q	61.8	Low	69.4	Low	78 Å²	78	43.4 Å²	43.4	36%	0.364	22%	0.222	S	C	.	.			trans	-99.1	71.6	-179.8	-67.1	-65.9	-34.8	0	0	110.9	L181 I207 H211 L212	L181-Q209 HydrophobicContact CD2-CB 4.48Å; L181-Q209 HydrophobicContact CD2-CG 4.04Å; I207-Q209 HydrophobicContact CG2-CB 3.77Å; I207-Q209 HydrophobicContact CG2-CG 3.66Å; I207-Q209 PolarHBondContact O-N 3.36Å; Q209-H211 VanDerWaalsContact C-N 3.26Å; Q209-H211 PolarHBondContact O-N 3.09Å; Q209-L212 HydrophobicContact CB-CD1 4Å; Q209-L212 HydrophobicContact CB-CG 4.47Å; Q209-L212 WeakPolarHBondContact O-CG 3.44Å; Q209-L212 PolarHBondContact O-N 3.01Å
210	H	60.3	Low	69.2	Low	10 Å²	10	47.3 Å²	47.3	5%	0.046	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-71.3	-17.7	-174.3	-53.1	90.6	0	0	0	114.1	E208 L212 L213 Y247	E208-H210 VanDerWaalsContact C-ND1 3.35Å; E208-H210 PolarHBondContact O-CE1 3.3Å; E208-H210 PolarHBondContact O-N 2.97Å; E208-H210 PolarHBondContact O-ND1 2.94Å; H210-L212 PolarHBondContact O-N 3.31Å; H210-L213 PolarHBondContact O-N 2.87Å; H210-Y247 HydrophobicContact CB-CD1 3.61Å; H210-Y247 HydrophobicContact CB-CD2 3.33Å; H210-Y247 HydrophobicContact CB-CE1 3.51Å; H210-Y247 HydrophobicContact CB-CE2 3.23Å; H210-Y247 HydrophobicContact CB-CG 3.55Å; H210-Y247 AromaticContact CD2-CD2 3.38Å; H210-Y247 WeakPolarHBondContact CD2-CD2 3.47Å; H210-Y247 AromaticContact CD2-CE2 3.46Å; H210-Y247 VanDerWaalsContact CD2-CE2 3.46Å; H210-Y247 WeakPolarHBondContact CD2-CE2 3.35Å; H210-Y247 AromaticContact CE1-CE2 3.64Å; H210-Y247 AromaticContact CG-CD2 3.28Å; H210-Y247 AromaticContact CG-CE2 2.99Å; H210-Y247 AromaticContact CG-CZ 3.52Å; H210-Y247 AromaticContact ND1-CD2 3.9Å; H210-Y247 AromaticContact ND1-CE2 3.13Å; H210-Y247 WeakPolarHBondContact ND1-CE2 3.29Å; H210-Y247 AromaticContact ND1-CZ 3.56Å; H210-Y247 AromaticContact NE2-CE2 3.83Å
211	H	63.7	Low	69.1	Low	118 Å²	118	48.3 Å²	48.3	55%	0.546	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-61.1	-16.2	175.9	-66.8	4.5	0	0	0	113.3	Q209 E214	Q209-H211 VanDerWaalsContact C-N 3.26Å; Q209-H211 PolarHBondContact O-N 3.09Å; H211-E214 WeakPolarHBondContact O-CB 3.46Å
212	L	62.2	Low	69	Low	13 Å²	13	49.8 Å²	49.8	7%	0.068	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-74.5	-36	179	-62.3	172	0	0	0	112.1	V184 H185 I188 Q209 H210 E214 I215 Y216	V184-L212 HydrophobicContact CG1-CD1 3.72Å; H185-L212 WeakPolarHBondContact CE1-CD2 3.5Å; I188-L212 HydrophobicContact CD1-CB 3.69Å; I188-L212 HydrophobicContact CD1-CD1 3.96Å; I188-L212 HydrophobicContact CD1-CG 4.39Å; Q209-L212 HydrophobicContact CB-CD1 4Å; Q209-L212 HydrophobicContact CB-CG 4.47Å; Q209-L212 WeakPolarHBondContact O-CG 3.44Å; Q209-L212 PolarHBondContact O-N 3.01Å; H210-L212 PolarHBondContact O-N 3.31Å; L212-E214 PolarHBondContact O-N 3.33Å; L212-I215 PolarHBondContact O-N 3.24Å; L212-Y216 WeakPolarHBondContact O-CD2 3.28Å
213	L	64.8	Low	68.7	Low	7 Å²	7	49.6 Å²	49.6	4%	0.037	26%	0.256	C	S	.	.	H	α-helix	trans	-60.1	-38.2	178.8	-69.6	170.5	0	0	0	111.5	M192 I201 C204 H210 I215 Y216 T217	M192-L213 HydrophobicContact CE-CD2 4.09Å; I201-L213 HydrophobicContact CG1-CD2 4.18Å; C204-L213 HydrophobicContact CB-CD1 3.92Å; C204-L213 HydrophobicContact CB-CD2 4.08Å; C204-L213 HydrophobicContact CB-CG 3.86Å; H210-L213 PolarHBondContact O-N 2.87Å; L213-I215 PolarHBondContact O-N 3.02Å; L213-I215 VanDerWaalsContact O-N 3.14Å; L213-Y216 PolarHBondContact O-N 3.1Å; L213-T217 WeakPolarHBondContact O-CG2 3.01Å; L213-T217 PolarHBondContact O-N 2.83Å; L213-T217 PolarHBondContact O-OG1 3.09Å
214	E	66	Low	68.6	Low	51 Å²	51	56.1 Å²	56.1	24%	0.238	28%	0.281	C	S	.	.	H	α-helix	trans	-57.8	-24.3	178.6	-97.1	-167.3	-131.9	0	0	115.4	H211 L212 I250 K254	H211-E214 WeakPolarHBondContact O-CB 3.46Å; L212-E214 PolarHBondContact O-N 3.33Å; E214-I250 HydrophobicContact CG-CG2 4Å; E214-I250 WeakPolarHBondContact OE1-CG2 3.48Å; E214-K254 HydrophobicContact CG-CD 4.22Å; E214-K254 VanDerWaalsContact CG-CE 3.49Å; E214-K254 VanDerWaalsContact CG-NZ 3.26Å; E214-K254 PolarHBondContact O-NZ 3.41Å; E214-K254 WeakPolarHBondContact OE2-CE 3.15Å; E214-K254 IonicContact OE2-NZ 3.87Å; E214-K254 PolarHBondContact OE2-NZ 3.01Å
215	I	72.7	Confident	68.6	Low	114 Å²	114	56.1 Å²	56.1	59%	0.585	28%	0.281	S	S	*	.	H	α-helix	trans	-95.3	-35.5	-175.9	-62	172.1	0	0	0	110.9	L212 L213	L212-I215 PolarHBondContact O-N 3.24Å; L213-I215 PolarHBondContact O-N 3.02Å; L213-I215 VanDerWaalsContact O-N 3.14Å
216	Y	63.7	Low	68.6	Low	61 Å²	61	54.6 Å²	54.6	24%	0.239	27%	0.273	C	S	.	.	H	α-helix	trans	-102	-7.5	-167.1	-61.2	-63.3	0	0	0	114.6	H185 I188 P189 L212 L213	H185-Y216 AromaticContact ND1-CE2 3.89Å; H185-Y216 AromaticContact ND1-CZ 3.83Å; H185-Y216 PolarHBondContact ND1-OH 3.34Å; H185-Y216 PolarHBondContact O-OH 3.44Å; I188-Y216 HydrophobicContact CB-CD2 4Å; I188-Y216 HydrophobicContact CB-CE2 4.37Å; I188-Y216 HydrophobicContact CG2-CD2 3.52Å; I188-Y216 HydrophobicContact CG2-CE2 4.36Å; I188-Y216 HydrophobicContact CG2-CG 3.84Å; P189-Y216 HydrophobicContact CB-CD1 4.43Å; P189-Y216 HydrophobicContact CG-CD1 3.72Å; P189-Y216 HydrophobicContact CG-CE1 3.5Å; P189-Y216 HydrophobicContact CG-CG 4.41Å; L212-Y216 WeakPolarHBondContact O-CD2 3.28Å; L213-Y216 PolarHBondContact O-N 3.1Å
217	T	64.9	Low	68.8	Low	18 Å²	18	55.9 Å²	55.9	11%	0.11	28%	0.282	C	S	.	.			trans	-73.9	134.6	176.3	51	0	0	0	0	111.5	L213 V225 L251 F255	L213-T217 WeakPolarHBondContact O-CG2 3.01Å; L213-T217 PolarHBondContact O-N 2.83Å; L213-T217 PolarHBondContact O-OG1 3.09Å; T217-V225 HydrophobicContact CG2-CG1 4.22Å; T217-V225 HydrophobicContact CG2-CG2 4.4Å; T217-L251 HydrophobicContact CG2-CD1 3.78Å; T217-L251 HydrophobicContact CG2-CD2 4.32Å; T217-L251 VanDerWaalsContact OG1-CD1 3.23Å; T217-L251 WeakPolarHBondContact OG1-CD1 3.46Å; T217-F255 WeakPolarHBondContact O-CZ 3.23Å; T217-F255 WeakPolarHBondContact OG1-CE2 3.43Å
218	S	67.6	Low	69.3	Low	46 Å²	46	59 Å²	59	32%	0.322	29%	0.294	S	S	.	.			trans	-106.1	164.4	176	72.9	0	0	0	0	111.7	L220 N221 Y222	S218-L220 PolarHBondContact O-N 3.18Å; S218-L220 VanDerWaalsContact O-N 3.13Å; S218-N221 PolarHBondContact O-N 3.49Å; S218-Y222 PolarHBondContact O-N 2.92Å; S218-Y222 VanDerWaalsContact O-N 3.1Å
219	S	66.8	Low	69.8	Low	86 Å²	86	55.5 Å²	55.5	60%	0.601	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-11.5	178.3	58.7	0	0	0	0	114.7	Y222	S219-Y222 WeakPolarHBondContact O-CD1 3.35Å; S219-Y222 WeakPolarHBondContact O-CE1 3.5Å
220	L	70.2	Confident	70.5	Confident	141 Å²	141	53.1 Å²	53.1	74%	0.738	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-32.8	175.3	-69.5	164.6	0	0	0	111.6	S218	S218-L220 PolarHBondContact O-N 3.18Å; S218-L220 VanDerWaalsContact O-N 3.13Å
221	N	71.9	Confident	71.3	Confident	22 Å²	22	55.3 Å²	55.3	12%	0.118	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-18.8	-170.8	-64.7	7.7	0	0	0	112.6	M192 E197 S218 T223 R224 V225	M192-N221 PolarHBondContact O-ND2 2.73Å; E197-N221 WeakPolarHBondContact OE1-CB 3.49Å; E197-N221 PolarHBondContact OE1-ND2 3.25Å; E197-N221 PolarHBondContact OE1-OD1 3.21Å; S218-N221 PolarHBondContact O-N 3.49Å; N221-T223 VanDerWaalsContact C-N 3.26Å; N221-T223 PolarHBondContact O-N 3.27Å; N221-T223 VanDerWaalsContact O-N 3.14Å; N221-R224 PolarHBondContact O-N 2.98Å; N221-R224 VanDerWaalsContact O-N 3.12Å; N221-V225 WeakPolarHBondContact O-CG2 3.27Å; N221-V225 PolarHBondContact O-N 2.89Å
222	Y	73.1	Confident	71.8	Confident	30 Å²	30	50.2 Å²	50.2	12%	0.118	26%	0.262	C	S	.	.	H	α-helix	trans	-54.6	-38.9	-175.5	82.1	-86.3	0	0	0	113.5	S218 S219 R224 V225 C226 F255 Q975	S218-Y222 PolarHBondContact O-N 2.92Å; S218-Y222 VanDerWaalsContact O-N 3.1Å; S219-Y222 WeakPolarHBondContact O-CD1 3.35Å; S219-Y222 WeakPolarHBondContact O-CE1 3.5Å; Y222-R224 PolarHBondContact O-N 3.41Å; Y222-V225 PolarHBondContact O-N 2.85Å; Y222-C226 VanDerWaalsContact O-CB 3.32Å; Y222-C226 WeakPolarHBondContact O-CB 3.33Å; Y222-C226 PolarHBondContact O-N 3.39Å; Y222-C226 PolarHBondContact O-SG 3.38Å; Y222-F255 VanDerWaalsContact CB-CE2 3.43Å; Y222-F255 HydrophobicContact CD1-CD1 4.35Å; Y222-F255 HydrophobicContact CD1-CG 4.26Å; Y222-F255 HydrophobicContact CD2-CB 4.19Å; Y222-F255 HydrophobicContact CD2-CD2 4.3Å; Y222-F255 HydrophobicContact CD2-CG 4.31Å; Y222-F255 HydrophobicContact CG-CB 4.21Å; Y222-F255 HydrophobicContact CG-CD1 4.38Å; Y222-F255 AromaticContact CG-CD2 3.87Å; Y222-F255 HydrophobicContact CG-CD2 3.87Å; Y222-F255 HydrophobicContact CG-CE2 4.36Å; Y222-F255 AromaticContact CG-CG 3.89Å; Y222-F255 HydrophobicContact CG-CG 3.89Å; Y222-Q975 PolarHBondContact OH-NE2 3.04Å; Y222-Q975 PolarHBondContact OH-OE1 3.44Å
223	T	74.8	Confident	72.4	Confident	55 Å²	55	49.8 Å²	49.8	34%	0.337	26%	0.26	S	S	.	.	H	α-helix	trans	-62.3	-44.4	-178.9	54.7	0	0	0	0	111.9	N221 L227	N221-T223 VanDerWaalsContact C-N 3.26Å; N221-T223 PolarHBondContact O-N 3.27Å; N221-T223 VanDerWaalsContact O-N 3.14Å; T223-L227 WeakPolarHBondContact O-CB 3.48Å; T223-L227 WeakPolarHBondContact O-CD1 3.38Å; T223-L227 WeakPolarHBondContact O-CG 3.4Å; T223-L227 PolarHBondContact O-N 3.02Å
224	R	73.9	Confident	72.6	Confident	136 Å²	136	50.9 Å²	50.9	51%	0.513	27%	0.27	S	S	.	.	H	α-helix	trans	-71.1	-45.2	179.6	-71.2	-179.8	-176.1	171	1.6	111.5	E197 N221 Y222 C226 L227 Y228	E197-R224 WeakPolarHBondContact OE2-CB 3.49Å; N221-R224 PolarHBondContact O-N 2.98Å; N221-R224 VanDerWaalsContact O-N 3.12Å; Y222-R224 PolarHBondContact O-N 3.41Å; R224-C226 VanDerWaalsContact C-N 3.34Å; R224-C226 PolarHBondContact O-N 3.3Å; R224-L227 PolarHBondContact O-N 3.26Å; R224-Y228 WeakPolarHBondContact O-CB 3.02Å; R224-Y228 PolarHBondContact O-N 2.88Å
225	V	75.7	Confident	72.9	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-57.5	-48.4	176	173.4	0	0	0	0	110.5	M192 E197 I201 T217 N221 Y222 Y228 L229 L251	M192-V225 HydrophobicContact CE-CG2 4.39Å; M192-V225 HydrophobicContact SD-CG2 4.48Å; E197-V225 HydrophobicContact CB-CG2 4.26Å; E197-V225 HydrophobicContact CG-CG2 4.37Å; I201-V225 HydrophobicContact CD1-CB 4.11Å; I201-V225 HydrophobicContact CD1-CG1 3.76Å; I201-V225 HydrophobicContact CD1-CG2 4.18Å; I201-V225 HydrophobicContact CG1-CG1 4.15Å; T217-V225 HydrophobicContact CG2-CG1 4.22Å; T217-V225 HydrophobicContact CG2-CG2 4.4Å; N221-V225 WeakPolarHBondContact O-CG2 3.27Å; N221-V225 PolarHBondContact O-N 2.89Å; Y222-V225 PolarHBondContact O-N 2.85Å; V225-Y228 PolarHBondContact O-N 3.21Å; V225-L229 HydrophobicContact CG1-CD1 4.04Å; V225-L229 HydrophobicContact CG1-CG 4.5Å; V225-L229 WeakPolarHBondContact O-CG 3.01Å; V225-L229 PolarHBondContact O-N 3.13Å; V225-L251 HydrophobicContact CB-CD2 4.36Å; V225-L251 HydrophobicContact CG1-CD2 3.61Å
226	C	74.6	Confident	72.7	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-68.8	-37.5	179.8	-61.9	0	0	0	0	112.8	Y222 R224 Y228 L229 T230 L251 Y252	Y222-C226 VanDerWaalsContact O-CB 3.32Å; Y222-C226 WeakPolarHBondContact O-CB 3.33Å; Y222-C226 PolarHBondContact O-N 3.39Å; Y222-C226 PolarHBondContact O-SG 3.38Å; R224-C226 VanDerWaalsContact C-N 3.34Å; R224-C226 PolarHBondContact O-N 3.3Å; C226-Y228 VanDerWaalsContact C-N 3.3Å; C226-Y228 PolarHBondContact O-N 3.06Å; C226-L229 PolarHBondContact O-N 3.22Å; C226-T230 VanDerWaalsContact O-CB 3.26Å; C226-T230 WeakPolarHBondContact O-CB 3.24Å; C226-T230 PolarHBondContact O-N 3.05Å; C226-T230 PolarHBondContact O-OG1 3.08Å; C226-L251 WeakPolarHBondContact SG-CD2 3.38Å; C226-Y252 HydrophobicContact CB-CD1 4.49Å; C226-Y252 HydrophobicContact CB-CE1 3.6Å; C226-Y252 HydrophobicContact CB-CE2 3.83Å; C226-Y252 WeakPolarHBondContact CB-OH 3.38Å; C226-Y252 VanDerWaalsContact SG-CE1 3.51Å
227	L	77.5	Confident	72.9	Confident	105 Å²	105	53.4 Å²	53.4	55%	0.55	28%	0.284	S	S	.	.	H	α-helix	trans	-60.8	-42.6	173.5	-78.3	168.9	0	0	0	111	T223 R224 T230 S231	T223-L227 WeakPolarHBondContact O-CB 3.48Å; T223-L227 WeakPolarHBondContact O-CD1 3.38Å; T223-L227 WeakPolarHBondContact O-CG 3.4Å; T223-L227 PolarHBondContact O-N 3.02Å; R224-L227 PolarHBondContact O-N 3.26Å; L227-T230 PolarHBondContact O-N 2.86Å; L227-S231 PolarHBondContact O-N 3.39Å
228	Y	81	Confident	72.7	Confident	70 Å²	70	54.3 Å²	54.3	28%	0.275	29%	0.29	S	S	.	.	H	α-helix	trans	-63.9	-50.8	176.8	-170.4	-102.1	0	0	0	111.2	A198 I201 D202 R224 V225 C226 T230 S231 C232	A198-Y228 HydrophobicContact CB-CD2 4.31Å; A198-Y228 HydrophobicContact CB-CE1 4.28Å; A198-Y228 HydrophobicContact CB-CE2 3.85Å; I201-Y228 HydrophobicContact CB-CD1 3.81Å; I201-Y228 HydrophobicContact CB-CE1 3.92Å; I201-Y228 HydrophobicContact CD1-CD1 3.48Å; I201-Y228 VanDerWaalsContact CD1-CD1 3.48Å; I201-Y228 HydrophobicContact CD1-CE1 4.35Å; I201-Y228 HydrophobicContact CD1-CG 4.04Å; I201-Y228 HydrophobicContact CG1-CD1 4.26Å; I201-Y228 HydrophobicContact CG2-CD1 3.67Å; I201-Y228 HydrophobicContact CG2-CE1 3.86Å; D202-Y228 VanDerWaalsContact CG-OH 3.29Å; D202-Y228 VanDerWaalsContact OD1-CE1 3.3Å; D202-Y228 WeakPolarHBondContact OD1-CE1 3.15Å; D202-Y228 PolarHBondContact OD1-OH 3.5Å; D202-Y228 PolarHBondContact OD2-OH 2.89Å; R224-Y228 WeakPolarHBondContact O-CB 3.02Å; R224-Y228 PolarHBondContact O-N 2.88Å; V225-Y228 PolarHBondContact O-N 3.21Å; C226-Y228 VanDerWaalsContact C-N 3.3Å; C226-Y228 PolarHBondContact O-N 3.06Å; Y228-T230 VanDerWaalsContact C-N 3.26Å; Y228-T230 PolarHBondContact O-N 3.35Å; Y228-S231 CarbonylContact O-C 3.59Å; Y228-S231 WeakPolarHBondContact O-CA 3.5Å; Y228-S231 PolarHBondContact O-N 3.22Å; Y228-S231 PolarHBondContact O-OG 2.85Å; Y228-C232 WeakPolarHBondContact CE1-SG 3.35Å; Y228-C232 PolarHBondContact O-N 3.2Å; Y228-C232 PolarHBondContact O-SG 3.34Å
229	L	78.8	Confident	72.6	Confident	4 Å²	4	54.9 Å²	54.9	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-53.9	-44.5	175	-71.1	169.7	0	0	0	111.7	I201 V225 C226 S231 C232 V233 V244 A248 L251	I201-L229 HydrophobicContact CG2-CD2 3.53Å; I201-L229 HydrophobicContact CG2-CG 4.25Å; V225-L229 HydrophobicContact CG1-CD1 4.04Å; V225-L229 HydrophobicContact CG1-CG 4.5Å; V225-L229 WeakPolarHBondContact O-CG 3.01Å; V225-L229 PolarHBondContact O-N 3.13Å; C226-L229 PolarHBondContact O-N 3.22Å; L229-S231 VanDerWaalsContact C-N 3.31Å; L229-S231 PolarHBondContact O-N 3.34Å; L229-C232 PolarHBondContact O-N 3Å; L229-V233 VanDerWaalsContact O-CG2 3.28Å; L229-V233 WeakPolarHBondContact O-CG2 3.47Å; L229-V233 PolarHBondContact O-N 3.49Å; L229-V233 VanDerWaalsContact O-N 3.15Å; L229-V244 HydrophobicContact CB-CG1 4.36Å; L229-V244 HydrophobicContact CD2-CG1 3.95Å; L229-A248 HydrophobicContact CD1-CB 4.39Å; L229-L251 HydrophobicContact CD1-CD2 4.08Å
230	T	77	Confident	72.8	Confident	28 Å²	28	52.7 Å²	52.7	17%	0.172	27%	0.274	C	S	.	.	H	α-helix	trans	-61.8	-39.6	178.4	-58.3	0	0	0	0	111.9	C226 L227 Y228 F869	C226-T230 VanDerWaalsContact O-CB 3.26Å; C226-T230 WeakPolarHBondContact O-CB 3.24Å; C226-T230 PolarHBondContact O-N 3.05Å; C226-T230 PolarHBondContact O-OG1 3.08Å; L227-T230 PolarHBondContact O-N 2.86Å; Y228-T230 VanDerWaalsContact C-N 3.26Å; Y228-T230 PolarHBondContact O-N 3.35Å; T230-F869 HydrophobicContact CG2-CD2 3.83Å; T230-F869 HydrophobicContact CG2-CE2 3.12Å; T230-F869 HydrophobicContact CG2-CZ 3.67Å
231	S	75.5	Confident	72.9	Confident	56 Å²	56	46.6 Å²	46.6	39%	0.392	24%	0.242	S	C	.	.	H	α-helix	trans	-71	-34.7	175.5	73	0	0	0	0	112.6	L227 Y228 L229 V233 A234 Y235	L227-S231 PolarHBondContact O-N 3.39Å; Y228-S231 CarbonylContact O-C 3.59Å; Y228-S231 WeakPolarHBondContact O-CA 3.5Å; Y228-S231 PolarHBondContact O-N 3.22Å; Y228-S231 PolarHBondContact O-OG 2.85Å; L229-S231 VanDerWaalsContact C-N 3.31Å; L229-S231 PolarHBondContact O-N 3.34Å; S231-V233 VanDerWaalsContact C-N 3.31Å; S231-V233 PolarHBondContact O-N 3Å; S231-A234 PolarHBondContact O-N 3.36Å; S231-Y235 VanDerWaalsContact O-CD2 3.29Å; S231-Y235 WeakPolarHBondContact O-CD2 3.33Å
232	C	75.8	Confident	73.1	Confident	11 Å²	11	47.8 Å²	47.8	7%	0.074	25%	0.248	C	C	.	.	H	α-helix	trans	-65.4	-33.9	177.6	-65.5	0	0	0	0	111.9	I205 Y228 L229 A234 Y235 L236	I205-C232 HydrophobicContact CD1-CB 4.42Å; Y228-C232 WeakPolarHBondContact CE1-SG 3.35Å; Y228-C232 PolarHBondContact O-N 3.2Å; Y228-C232 PolarHBondContact O-SG 3.34Å; L229-C232 PolarHBondContact O-N 3Å; C232-A234 PolarHBondContact O-N 3.41Å; C232-Y235 PolarHBondContact O-N 3.24Å; C232-L236 HydrophobicContact CB-CD1 3.66Å; C232-L236 WeakPolarHBondContact O-CD1 3.44Å; C232-L236 PolarHBondContact O-N 2.92Å; C232-L236 VanDerWaalsContact O-N 3.09Å
233	V	73.2	Confident	73.3	Confident	5 Å²	5	49.5 Å²	49.5	3%	0.03	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-22.2	179.7	174.6	0	0	0	0	113.2	L229 S231 Y235 N241 V244 L245 R267	L229-V233 VanDerWaalsContact O-CG2 3.28Å; L229-V233 WeakPolarHBondContact O-CG2 3.47Å; L229-V233 PolarHBondContact O-N 3.49Å; L229-V233 VanDerWaalsContact O-N 3.15Å; S231-V233 VanDerWaalsContact C-N 3.31Å; S231-V233 PolarHBondContact O-N 3Å; V233-Y235 VanDerWaalsContact C-N 3.32Å; V233-N241 HydrophobicContact CG1-CB 4.36Å; V233-N241 PolarHBondContact O-OD1 3.37Å; V233-N241 VanDerWaalsContact O-OD1 3.06Å; V233-V244 HydrophobicContact CG2-CB 4.31Å; V233-V244 HydrophobicContact CG2-CG1 3.73Å; V233-L245 HydrophobicContact CB-CD2 4.39Å; V233-L245 HydrophobicContact CB-CG 4.42Å; V233-L245 HydrophobicContact CG1-CD1 3.8Å; V233-L245 HydrophobicContact CG1-CD2 4.03Å; V233-L245 HydrophobicContact CG1-CG 3.79Å; V233-L245 HydrophobicContact CG2-CD2 3.73Å; V233-L245 HydrophobicContact CG2-CG 3.69Å; V233-R267 VanDerWaalsContact CG1-CZ 3.49Å
234	A	69.3	Low	73.5	Confident	29 Å²	29	47 Å²	47	24%	0.24	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-27.2	173.8	0	0	0	0	0	112.8	S231 C232	S231-A234 PolarHBondContact O-N 3.36Å; C232-A234 PolarHBondContact O-N 3.41Å
235	Y	72	Confident	73.7	Confident	166 Å²	166	40.7 Å²	40.7	65%	0.651	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.2	-20.7	-170.6	-59.7	-74.3	0	0	0	114.2	S231 C232 V233	S231-Y235 VanDerWaalsContact O-CD2 3.29Å; S231-Y235 WeakPolarHBondContact O-CD2 3.33Å; C232-Y235 PolarHBondContact O-N 3.24Å; V233-Y235 VanDerWaalsContact C-N 3.32Å
236	L	69.7	Low	73.9	Confident	30 Å²	30	44.7 Å²	44.7	16%	0.157	24%	0.236	C	C	.	.	S	Bend	trans	-72.8	146.5	179.9	-89.5	83.7	0	0	0	110.8	I205 C232 D240 N241 V244	I205-L236 HydrophobicContact CG2-CD2 3.88Å; C232-L236 HydrophobicContact CB-CD1 3.66Å; C232-L236 WeakPolarHBondContact O-CD1 3.44Å; C232-L236 PolarHBondContact O-N 2.92Å; C232-L236 VanDerWaalsContact O-N 3.09Å; L236-D240 HydrophobicContact CD2-CB 3.87Å; L236-N241 WeakPolarHBondContact CB-OD1 3.24Å; L236-N241 VanDerWaalsContact O-CG 3.27Å; L236-N241 PolarHBondContact O-ND2 2.95Å; L236-N241 PolarHBondContact O-OD1 3.38Å; L236-N241 VanDerWaalsContact O-OD1 3.08Å; L236-V244 HydrophobicContact CD2-CG2 3.75Å
237	P	68.1	Low	73.9	Confident	84 Å²	84	46.8 Å²	46.8	55%	0.545	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-70.7	154.5	170.5	29.3	-32.6	0	0	0	111.4	D240 N241	P237-D240 PolarHBondContact O-N 3.34Å; P237-D240 VanDerWaalsContact O-N 3.11Å; P237-N241 PolarHBondContact O-N 3.05Å
238	T	60.8	Low	73.9	Confident	37 Å²	37	41.8 Å²	41.8	23%	0.227	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	116.8	169	57.3	0	0	0	0	107.1	Q577	T238-Q577 HydrophobicContact CG2-CB 4.46Å; T238-Q577 HydrophobicContact CG2-CG 4.46Å
239	P	65.8	Low	73.8	Confident	57 Å²	57	38.6 Å²	38.6	37%	0.37	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	cis	-108.5	-4.8	39.6	39.1	-37.6	0	0	0	116.6	N241 N242 E578	P239-N241 VanDerWaalsContact C-N 3.26Å; P239-N241 PolarHBondContact O-N 3.3Å; P239-N242 PolarHBondContact O-N 3.18Å; P239-E578 WeakPolarHBondContact CA-OE1 3.39Å; P239-E578 WeakPolarHBondContact CB-OE1 3.18Å
240	D	70	Confident	73.9	Confident	41 Å²	41	40.9 Å²	40.9	22%	0.219	22%	0.218	C	C	.	.	H	α-helix	trans	-71.3	-25.2	-171.4	-59.8	-38.8	0	0	0	112.3	L236 P237 N242 K243 V244	L236-D240 HydrophobicContact CD2-CB 3.87Å; P237-D240 PolarHBondContact O-N 3.34Å; P237-D240 VanDerWaalsContact O-N 3.11Å; D240-N242 VanDerWaalsContact C-N 3.31Å; D240-N242 PolarHBondContact O-N 3.15Å; D240-K243 PolarHBondContact O-N 2.95Å; D240-K243 IonicContact OD1-NZ 3.1Å; D240-K243 PolarHBondContact OD1-NZ 3.09Å; D240-V244 WeakPolarHBondContact O-CB 3.2Å; D240-V244 WeakPolarHBondContact O-CG2 3.4Å; D240-V244 PolarHBondContact O-N 3.34Å
241	N	73.4	Confident	74	Confident	12 Å²	12	39.8 Å²	39.8	6%	0.064	21%	0.21	C	C	.	.	H	α-helix	trans	-52	-47	169.6	-76	-23.8	0	0	0	113.3	V233 L236 P237 P239 V244 L245	V233-N241 HydrophobicContact CG1-CB 4.36Å; V233-N241 PolarHBondContact O-OD1 3.37Å; V233-N241 VanDerWaalsContact O-OD1 3.06Å; L236-N241 WeakPolarHBondContact CB-OD1 3.24Å; L236-N241 VanDerWaalsContact O-CG 3.27Å; L236-N241 PolarHBondContact O-ND2 2.95Å; L236-N241 PolarHBondContact O-OD1 3.38Å; L236-N241 VanDerWaalsContact O-OD1 3.08Å; P237-N241 PolarHBondContact O-N 3.05Å; P239-N241 VanDerWaalsContact C-N 3.26Å; P239-N241 PolarHBondContact O-N 3.3Å; N241-V244 PolarHBondContact O-N 3.49Å; N241-L245 WeakPolarHBondContact O-CB 3.21Å; N241-L245 WeakPolarHBondContact O-CG 3.44Å; N241-L245 PolarHBondContact O-N 3.09Å
242	N	75.5	Confident	74.1	Confident	47 Å²	47	37.9 Å²	37.9	25%	0.251	20%	0.195	S	C	.	.	H	α-helix	trans	-67.6	-42.6	-177.5	-68.1	-27.9	0	0	0	110	P239 D240 L245 Q246 L268 E578	P239-N242 PolarHBondContact O-N 3.18Å; D240-N242 VanDerWaalsContact C-N 3.31Å; D240-N242 PolarHBondContact O-N 3.15Å; N242-L245 PolarHBondContact O-N 3.3Å; N242-Q246 VanDerWaalsContact O-CG 3.26Å; N242-Q246 WeakPolarHBondContact O-CG 3.5Å; N242-Q246 PolarHBondContact O-N 2.94Å; N242-L268 HydrophobicContact CB-CD2 4.08Å; N242-E578 PolarHBondContact ND2-OE1 3.13Å
243	K	77.1	Confident	74.3	Confident	67 Å²	67	40.5 Å²	40.5	29%	0.291	20%	0.203	S	C	.	.	H	α-helix	trans	-60.4	-51.2	175.2	-59	179.1	-167.6	153.6	0	111	E208 D240 L245 Q246 Y247	E208-K243 IonicContact OE1-NZ 3.6Å; D240-K243 PolarHBondContact O-N 2.95Å; D240-K243 IonicContact OD1-NZ 3.1Å; D240-K243 PolarHBondContact OD1-NZ 3.09Å; K243-L245 VanDerWaalsContact C-N 3.32Å; K243-L245 PolarHBondContact O-N 3.31Å; K243-Q246 WeakPolarHBondContact O-CB 3.06Å; K243-Q246 PolarHBondContact O-N 3.47Å; K243-Y247 VanDerWaalsContact C-CD2 3.46Å; K243-Y247 HydrophobicContact CB-CD2 4.44Å; K243-Y247 HydrophobicContact CB-CE2 3.85Å; K243-Y247 WeakPolarHBondContact O-CD2 3.26Å; K243-Y247 WeakPolarHBondContact O-CE2 3.05Å; K243-Y247 PolarHBondContact O-N 2.68Å
244	V	79.8	Confident	74.4	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.006	22%	0.222	C	C	.	.	H	α-helix	trans	-58.7	-41.6	179.6	170.7	0	0	0	0	111.9	I205 L229 V233 L236 D240 N241 Y247 A248	I205-V244 HydrophobicContact CG1-CG2 4.43Å; L229-V244 HydrophobicContact CB-CG1 4.36Å; L229-V244 HydrophobicContact CD2-CG1 3.95Å; V233-V244 HydrophobicContact CG2-CB 4.31Å; V233-V244 HydrophobicContact CG2-CG1 3.73Å; L236-V244 HydrophobicContact CD2-CG2 3.75Å; D240-V244 WeakPolarHBondContact O-CB 3.2Å; D240-V244 WeakPolarHBondContact O-CG2 3.4Å; D240-V244 PolarHBondContact O-N 3.34Å; N241-V244 PolarHBondContact O-N 3.49Å; V244-Y247 PolarHBondContact O-N 3.31Å; V244-A248 PolarHBondContact O-N 3.28Å
245	L	77.6	Confident	74.4	Confident	5 Å²	5	45.7 Å²	45.7	3%	0.026	22%	0.22	C	C	.	.	H	α-helix	trans	-66.3	-37.5	174.5	-77.6	173.4	0	0	0	112.9	V233 N241 N242 K243 Y247 A248 T249 R267 L268	V233-L245 HydrophobicContact CB-CD2 4.39Å; V233-L245 HydrophobicContact CB-CG 4.42Å; V233-L245 HydrophobicContact CG1-CD1 3.8Å; V233-L245 HydrophobicContact CG1-CD2 4.03Å; V233-L245 HydrophobicContact CG1-CG 3.79Å; V233-L245 HydrophobicContact CG2-CD2 3.73Å; V233-L245 HydrophobicContact CG2-CG 3.69Å; N241-L245 WeakPolarHBondContact O-CB 3.21Å; N241-L245 WeakPolarHBondContact O-CG 3.44Å; N241-L245 PolarHBondContact O-N 3.09Å; N242-L245 PolarHBondContact O-N 3.3Å; K243-L245 VanDerWaalsContact C-N 3.32Å; K243-L245 PolarHBondContact O-N 3.31Å; L245-Y247 VanDerWaalsContact C-N 3.33Å; L245-A248 PolarHBondContact O-N 3.45Å; L245-T249 PolarHBondContact O-N 2.78Å; L245-T249 PolarHBondContact O-OG1 2.9Å; L245-R267 HydrophobicContact CD1-CB 4.47Å; L245-R267 HydrophobicContact CD1-CG 3.99Å; L245-L268 HydrophobicContact CB-CD1 3.96Å; L245-L268 HydrophobicContact CB-CD2 3.66Å; L245-L268 HydrophobicContact CB-CG 3.79Å; L245-L268 HydrophobicContact CD1-CD2 3.93Å; L245-L268 HydrophobicContact CD1-CG 4.21Å; L245-L268 HydrophobicContact CG-CD2 4.48Å
246	Q	79.1	Confident	74.3	Confident	83 Å²	83	42.2 Å²	42.2	39%	0.388	21%	0.21	S	C	.	.	H	α-helix	trans	-62.6	-43	174.1	-74.4	172.2	1.9	0	0	110.4	N242 K243 T249 I250 L268	N242-Q246 VanDerWaalsContact O-CG 3.26Å; N242-Q246 WeakPolarHBondContact O-CG 3.5Å; N242-Q246 PolarHBondContact O-N 2.94Å; K243-Q246 WeakPolarHBondContact O-CB 3.06Å; K243-Q246 PolarHBondContact O-N 3.47Å; Q246-T249 VanDerWaalsContact O-CB 3.31Å; Q246-T249 WeakPolarHBondContact O-CB 3.48Å; Q246-T249 PolarHBondContact O-N 3.29Å; Q246-I250 WeakPolarHBondContact O-CG1 3.23Å; Q246-I250 PolarHBondContact O-N 3.41Å; Q246-L268 HydrophobicContact CB-CD1 4.38Å; Q246-L268 HydrophobicContact CG-CD1 3.61Å; Q246-L268 HydrophobicContact CG-CD2 4.4Å
247	Y	75.1	Confident	74.4	Confident	44 Å²	44	41.3 Å²	41.3	17%	0.173	21%	0.205	C	C	.	.	H	α-helix	trans	-67.3	-39.1	176.1	-61	-58.7	0	0	0	112.9	H210 K243 V244 L245 T249 I250 L251	H210-Y247 HydrophobicContact CB-CD1 3.61Å; H210-Y247 HydrophobicContact CB-CD2 3.33Å; H210-Y247 HydrophobicContact CB-CE1 3.51Å; H210-Y247 HydrophobicContact CB-CE2 3.23Å; H210-Y247 HydrophobicContact CB-CG 3.55Å; H210-Y247 AromaticContact CD2-CD2 3.38Å; H210-Y247 WeakPolarHBondContact CD2-CD2 3.47Å; H210-Y247 AromaticContact CD2-CE2 3.46Å; H210-Y247 VanDerWaalsContact CD2-CE2 3.46Å; H210-Y247 WeakPolarHBondContact CD2-CE2 3.35Å; H210-Y247 AromaticContact CE1-CE2 3.64Å; H210-Y247 AromaticContact CG-CD2 3.28Å; H210-Y247 AromaticContact CG-CE2 2.99Å; H210-Y247 AromaticContact CG-CZ 3.52Å; H210-Y247 AromaticContact ND1-CD2 3.9Å; H210-Y247 AromaticContact ND1-CE2 3.13Å; H210-Y247 WeakPolarHBondContact ND1-CE2 3.29Å; H210-Y247 AromaticContact ND1-CZ 3.56Å; H210-Y247 AromaticContact NE2-CE2 3.83Å; K243-Y247 VanDerWaalsContact C-CD2 3.46Å; K243-Y247 HydrophobicContact CB-CD2 4.44Å; K243-Y247 HydrophobicContact CB-CE2 3.85Å; K243-Y247 WeakPolarHBondContact O-CD2 3.26Å; K243-Y247 WeakPolarHBondContact O-CE2 3.05Å; K243-Y247 PolarHBondContact O-N 2.68Å; V244-Y247 PolarHBondContact O-N 3.31Å; L245-Y247 VanDerWaalsContact C-N 3.33Å; Y247-T249 PolarHBondContact O-N 2.88Å; Y247-I250 HydrophobicContact CD1-CD1 4.15Å; Y247-I250 PolarHBondContact O-N 3.49Å; Y247-L251 WeakPolarHBondContact O-CB 2.95Å; Y247-L251 PolarHBondContact O-N 2.9Å
248	A	77.5	Confident	74.6	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.008	18%	0.181	C	C	.	.	H	α-helix	trans	-58.3	-41.9	171.7	0	0	0	0	0	110.7	L229 V244 L245 L251 Y252	L229-A248 HydrophobicContact CD1-CB 4.39Å; V244-A248 PolarHBondContact O-N 3.28Å; L245-A248 PolarHBondContact O-N 3.45Å; A248-L251 WeakPolarHBondContact O-CB 3.47Å; A248-L251 PolarHBondContact O-N 3.39Å; A248-Y252 HydrophobicContact CB-CE2 4.49Å; A248-Y252 WeakPolarHBondContact O-CD2 3.37Å; A248-Y252 PolarHBondContact O-N 2.89Å
249	T	78.3	Confident	75.2	Confident	2 Å²	2	36 Å²	36	1%	0.012	17%	0.171	C	C	.	.	H	α-helix	trans	-61.6	-44.8	175.9	-54.3	0	0	0	0	111.7	L245 Q246 Y247 L251 Y252 R253 A261 C264 A265 I277	L245-T249 PolarHBondContact O-N 2.78Å; L245-T249 PolarHBondContact O-OG1 2.9Å; Q246-T249 VanDerWaalsContact O-CB 3.31Å; Q246-T249 WeakPolarHBondContact O-CB 3.48Å; Q246-T249 PolarHBondContact O-N 3.29Å; Y247-T249 PolarHBondContact O-N 2.88Å; T249-L251 VanDerWaalsContact C-N 3.34Å; T249-Y252 PolarHBondContact O-N 2.86Å; T249-R253 WeakPolarHBondContact O-CG 3.28Å; T249-R253 PolarHBondContact O-N 3.09Å; T249-A261 HydrophobicContact CG2-CB 4.44Å; T249-C264 VanDerWaalsContact OG1-CB 3.23Å; T249-C264 WeakPolarHBondContact OG1-CB 3.1Å; T249-A265 HydrophobicContact CG2-CB 4.42Å; T249-I277 HydrophobicContact CG2-CD1 3.65Å
250	I	81.5	Confident	75.6	Confident	53 Å²	53	34.3 Å²	34.3	27%	0.272	16%	0.159	S	C	.	.	H	α-helix	trans	-63.8	-41.7	176.4	-64.7	162	0	0	0	110.9	E214 Q246 Y247 Y252 R253 K254	E214-I250 HydrophobicContact CG-CG2 4Å; E214-I250 WeakPolarHBondContact OE1-CG2 3.48Å; Q246-I250 WeakPolarHBondContact O-CG1 3.23Å; Q246-I250 PolarHBondContact O-N 3.41Å; Y247-I250 HydrophobicContact CD1-CD1 4.15Å; Y247-I250 PolarHBondContact O-N 3.49Å; I250-Y252 PolarHBondContact O-N 3.06Å; I250-R253 WeakPolarHBondContact O-CB 3.17Å; I250-R253 PolarHBondContact O-N 3.42Å; I250-K254 WeakPolarHBondContact O-CG 3.12Å; I250-K254 PolarHBondContact O-N 3.19Å
251	L	78.4	Confident	76	Confident	4 Å²	4	32.4 Å²	32.4	2%	0.021	15%	0.149	C	C	.	.	H	α-helix	trans	-61.7	-44.9	177.9	-171.8	60.9	0	0	0	111.2	T217 V225 C226 L229 Y247 A248 T249 R253 K254 F255	T217-L251 HydrophobicContact CG2-CD1 3.78Å; T217-L251 HydrophobicContact CG2-CD2 4.32Å; T217-L251 VanDerWaalsContact OG1-CD1 3.23Å; T217-L251 WeakPolarHBondContact OG1-CD1 3.46Å; V225-L251 HydrophobicContact CB-CD2 4.36Å; V225-L251 HydrophobicContact CG1-CD2 3.61Å; C226-L251 WeakPolarHBondContact SG-CD2 3.38Å; L229-L251 HydrophobicContact CD1-CD2 4.08Å; Y247-L251 WeakPolarHBondContact O-CB 2.95Å; Y247-L251 PolarHBondContact O-N 2.9Å; A248-L251 WeakPolarHBondContact O-CB 3.47Å; A248-L251 PolarHBondContact O-N 3.39Å; T249-L251 VanDerWaalsContact C-N 3.34Å; L251-R253 PolarHBondContact O-N 3.15Å; L251-K254 PolarHBondContact O-N 2.82Å; L251-F255 HydrophobicContact CD1-CD2 4.11Å; L251-F255 HydrophobicContact CD1-CE2 3.58Å; L251-F255 HydrophobicContact CG-CD2 4.33Å; L251-F255 HydrophobicContact CG-CE2 4.21Å; L251-F255 VanDerWaalsContact O-CD2 3.23Å; L251-F255 WeakPolarHBondContact O-CD2 3.34Å; L251-F255 PolarHBondContact O-N 2.83Å
252	Y	79.2	Confident	76.1	Confident	17 Å²	17	31.8 Å²	31.8	7%	0.067	15%	0.146	C	C	.	.	H	α-helix	trans	-65.1	-35.7	174.5	-73.7	-60	0	0	0	113	C226 A248 T249 I250 K254 F255 E256 D257 N260 C264	C226-Y252 HydrophobicContact CB-CD1 4.49Å; C226-Y252 HydrophobicContact CB-CE1 3.6Å; C226-Y252 HydrophobicContact CB-CE2 3.83Å; C226-Y252 WeakPolarHBondContact CB-OH 3.38Å; C226-Y252 VanDerWaalsContact SG-CE1 3.51Å; A248-Y252 HydrophobicContact CB-CE2 4.49Å; A248-Y252 WeakPolarHBondContact O-CD2 3.37Å; A248-Y252 PolarHBondContact O-N 2.89Å; T249-Y252 PolarHBondContact O-N 2.86Å; I250-Y252 PolarHBondContact O-N 3.06Å; Y252-K254 VanDerWaalsContact C-N 3.32Å; Y252-K254 PolarHBondContact O-N 2.86Å; Y252-F255 PolarHBondContact O-N 3.25Å; Y252-E256 PolarHBondContact O-N 3.35Å; Y252-D257 HydrophobicContact CD1-CB 4.25Å; Y252-D257 PolarHBondContact O-N 3.14Å; Y252-N260 HydrophobicContact CD1-CB 3.84Å; Y252-N260 HydrophobicContact CD2-CB 4.27Å; Y252-N260 HydrophobicContact CE1-CB 3.54Å; Y252-N260 HydrophobicContact CE2-CB 4.03Å; Y252-N260 HydrophobicContact CG-CB 4.19Å; Y252-C264 VanDerWaalsContact CE2-SG 3.6Å
253	R	79.4	Confident	76	Confident	65 Å²	65	30.9 Å²	30.9	25%	0.245	14%	0.138	C	C	.	.	H	α-helix	trans	-60	-41	172.6	-75.4	171	77.6	175.1	2.5	111.4	T249 I250 L251 F255 E256 E276 E280	T249-R253 WeakPolarHBondContact O-CG 3.28Å; T249-R253 PolarHBondContact O-N 3.09Å; I250-R253 WeakPolarHBondContact O-CB 3.17Å; I250-R253 PolarHBondContact O-N 3.42Å; L251-R253 PolarHBondContact O-N 3.15Å; R253-F255 PolarHBondContact O-N 3.45Å; R253-E256 PolarHBondContact O-N 3.15Å; R253-E276 IonicContact CZ-OE2 2.74Å; R253-E276 IonicContact NH1-OE2 3.05Å; R253-E276 PolarHBondContact NH1-OE2 3.17Å; R253-E276 VanDerWaalsContact NH1-OE2 3.13Å; R253-E276 IonicContact NH2-OE2 3.86Å; R253-E276 PolarHBondContact NH2-OE2 3.13Å; R253-E280 IonicContact CZ-OE1 3.06Å; R253-E280 IonicContact CZ-OE2 3.29Å; R253-E280 IonicContact NE-OE1 2.69Å; R253-E280 IonicContact NE-OE2 2.91Å; R253-E280 PolarHBondContact NE-OE2 3.02Å; R253-E280 VanDerWaalsContact NH2-CD 3.28Å; R253-E280 IonicContact NH2-OE1 2.75Å; R253-E280 PolarHBondContact NH2-OE1 3.18Å; R253-E280 IonicContact NH2-OE2 3.67Å; R253-E280 PolarHBondContact NH2-OE2 3.14Å
254	K	75.7	Confident	75.8	Confident	96 Å²	96	27.8 Å²	27.8	42%	0.417	13%	0.125	S	C	.	.	H	α-helix	trans	-64.8	-35.8	178.8	-71.2	-170.4	179.8	-161.1	0	113.8	E214 I250 L251 Y252 E256	E214-K254 HydrophobicContact CG-CD 4.22Å; E214-K254 VanDerWaalsContact CG-CE 3.49Å; E214-K254 VanDerWaalsContact CG-NZ 3.26Å; E214-K254 PolarHBondContact O-NZ 3.41Å; E214-K254 WeakPolarHBondContact OE2-CE 3.15Å; E214-K254 IonicContact OE2-NZ 3.87Å; E214-K254 PolarHBondContact OE2-NZ 3.01Å; I250-K254 WeakPolarHBondContact O-CG 3.12Å; I250-K254 PolarHBondContact O-N 3.19Å; L251-K254 PolarHBondContact O-N 2.82Å; Y252-K254 VanDerWaalsContact C-N 3.32Å; Y252-K254 PolarHBondContact O-N 2.86Å; K254-E256 VanDerWaalsContact C-N 3.34Å
255	F	68.8	Low	75.7	Confident	48 Å²	48	27.7 Å²	27.7	21%	0.211	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	9.5	-179.2	-67.7	-68.3	0	0	0	114.2	T217 Y222 L251 Y252 R253 D257	T217-F255 WeakPolarHBondContact O-CZ 3.23Å; T217-F255 WeakPolarHBondContact OG1-CE2 3.43Å; Y222-F255 VanDerWaalsContact CB-CE2 3.43Å; Y222-F255 HydrophobicContact CD1-CD1 4.35Å; Y222-F255 HydrophobicContact CD1-CG 4.26Å; Y222-F255 HydrophobicContact CD2-CB 4.19Å; Y222-F255 HydrophobicContact CD2-CD2 4.3Å; Y222-F255 HydrophobicContact CD2-CG 4.31Å; Y222-F255 HydrophobicContact CG-CB 4.21Å; Y222-F255 HydrophobicContact CG-CD1 4.38Å; Y222-F255 AromaticContact CG-CD2 3.87Å; Y222-F255 HydrophobicContact CG-CD2 3.87Å; Y222-F255 HydrophobicContact CG-CE2 4.36Å; Y222-F255 AromaticContact CG-CG 3.89Å; Y222-F255 HydrophobicContact CG-CG 3.89Å; L251-F255 HydrophobicContact CD1-CD2 4.11Å; L251-F255 HydrophobicContact CD1-CE2 3.58Å; L251-F255 HydrophobicContact CG-CD2 4.33Å; L251-F255 HydrophobicContact CG-CE2 4.21Å; L251-F255 VanDerWaalsContact O-CD2 3.23Å; L251-F255 WeakPolarHBondContact O-CD2 3.34Å; L251-F255 PolarHBondContact O-N 2.83Å; Y252-F255 PolarHBondContact O-N 3.25Å; R253-F255 PolarHBondContact O-N 3.45Å; F255-D257 PolarHBondContact O-N 3.24Å; F255-D257 VanDerWaalsContact O-N 3.13Å
256	E	69.1	Low	75.6	Confident	92 Å²	92	28.1 Å²	28.1	43%	0.43	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	20.2	179.4	-55.1	-179.7	144.9	0	0	114.1	Y252 R253 K254 L258 K286	Y252-E256 PolarHBondContact O-N 3.35Å; R253-E256 PolarHBondContact O-N 3.15Å; K254-E256 VanDerWaalsContact C-N 3.34Å; E256-L258 VanDerWaalsContact C-N 3.29Å; E256-L258 PolarHBondContact O-N 2.99Å; E256-K286 WeakPolarHBondContact OE2-CE 3.45Å; E256-K286 IonicContact OE2-NZ 2.63Å
257	D	72.9	Confident	75.2	Confident	11 Å²	11	27.8 Å²	27.8	6%	0.059	12%	0.122	C	C	.	.			trans	-90	70.7	171.3	-171.9	10.9	0	0	0	110	Y252 F255 G259 N260 A261 Q975	Y252-D257 HydrophobicContact CD1-CB 4.25Å; Y252-D257 PolarHBondContact O-N 3.14Å; F255-D257 PolarHBondContact O-N 3.24Å; F255-D257 VanDerWaalsContact O-N 3.13Å; D257-G259 PolarHBondContact O-N 3.36Å; D257-N260 PolarHBondContact O-N 3.21Å; D257-N260 PolarHBondContact OD2-ND2 3.06Å; D257-A261 PolarHBondContact O-N 2.76Å; D257-A261 VanDerWaalsContact O-N 3.12Å; D257-Q975 PolarHBondContact OD2-OE1 3.43Å
258	L	72.3	Confident	75.1	Confident	9 Å²	9	27 Å²	27	5%	0.047	12%	0.121	C	C	.	.	H	α-helix	trans	-64.4	-23.6	-176.1	-61.9	176.5	0	0	0	113	E256 M262 I277 S281 V284 I295	E256-L258 VanDerWaalsContact C-N 3.29Å; E256-L258 PolarHBondContact O-N 2.99Å; L258-M262 WeakPolarHBondContact O-CB 3.29Å; L258-M262 PolarHBondContact O-N 3.16Å; L258-I277 HydrophobicContact CD2-CG2 4.42Å; L258-S281 VanDerWaalsContact CD1-CA 3.48Å; L258-V284 HydrophobicContact CD1-CG2 3.64Å; L258-I295 HydrophobicContact CB-CG2 4.46Å; L258-I295 HydrophobicContact CD1-CG2 4.22Å
259	G	73.8	Confident	74.7	Confident	2 Å²	2	28 Å²	28	2%	0.021	13%	0.126	C	C	.	.	H	α-helix	trans	-63.8	-52.1	177.3	0	0	0	0	0	111.4	D257 M262 R263	D257-G259 PolarHBondContact O-N 3.36Å; G259-M262 WeakPolarHBondContact O-CB 3.37Å; G259-M262 PolarHBondContact O-N 3.31Å; G259-R263 WeakPolarHBondContact O-CG 3.22Å; G259-R263 PolarHBondContact O-N 3.21Å
260	N	73.6	Confident	74.3	Confident	21 Å²	21	30.6 Å²	30.6	11%	0.112	14%	0.14	C	C	.	.	H	α-helix	trans	-74.9	-30.4	178.4	-70.6	-41.5	0	0	0	112.8	Y252 D257 M262 R263 C264	Y252-N260 HydrophobicContact CD1-CB 3.84Å; Y252-N260 HydrophobicContact CD2-CB 4.27Å; Y252-N260 HydrophobicContact CE1-CB 3.54Å; Y252-N260 HydrophobicContact CE2-CB 4.03Å; Y252-N260 HydrophobicContact CG-CB 4.19Å; D257-N260 PolarHBondContact O-N 3.21Å; D257-N260 PolarHBondContact OD2-ND2 3.06Å; N260-M262 VanDerWaalsContact C-N 3.27Å; N260-M262 PolarHBondContact O-N 3.09Å; N260-R263 PolarHBondContact O-N 3.07Å; N260-R263 WeakPolarHBondContact OD1-CD 3.13Å; N260-R263 PolarHBondContact OD1-NH1 3.28Å; N260-C264 PolarHBondContact O-N 3.08Å; N260-C264 VanDerWaalsContact O-N 3.13Å; N260-C264 PolarHBondContact O-SG 3.36Å; N260-C264 VanDerWaalsContact O-SG 3.34Å
261	A	77	Confident	73.7	Confident	0 Å²	0	31 Å²	31	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-55.4	-46.3	168.8	0	0	0	0	0	111	T249 D257 R263 C264 A265 I277	T249-A261 HydrophobicContact CG2-CB 4.44Å; D257-A261 PolarHBondContact O-N 2.76Å; D257-A261 VanDerWaalsContact O-N 3.12Å; A261-R263 PolarHBondContact O-N 3.17Å; A261-C264 PolarHBondContact O-N 3.4Å; A261-A265 PolarHBondContact O-N 2.85Å; A261-I277 HydrophobicContact CB-CD1 4.32Å
262	M	75.9	Confident	73.5	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-63.1	-42.3	178	-170.7	72.6	-178	0	0	112.2	L258 G259 N260 C264 A265 L266 I274 I277 L299 L302 L303	L258-M262 WeakPolarHBondContact O-CB 3.29Å; L258-M262 PolarHBondContact O-N 3.16Å; G259-M262 WeakPolarHBondContact O-CB 3.37Å; G259-M262 PolarHBondContact O-N 3.31Å; N260-M262 VanDerWaalsContact C-N 3.27Å; N260-M262 PolarHBondContact O-N 3.09Å; M262-C264 PolarHBondContact O-N 3.43Å; M262-A265 PolarHBondContact O-N 3.22Å; M262-A265 VanDerWaalsContact O-N 3.17Å; M262-L266 HydrophobicContact CE-CD1 3.87Å; M262-L266 HydrophobicContact CE-CD2 3.57Å; M262-L266 HydrophobicContact CE-CG 3.68Å; M262-L266 HydrophobicContact CG-CD1 3.6Å; M262-L266 HydrophobicContact CG-CG 3.99Å; M262-L266 WeakPolarHBondContact O-CB 3.19Å; M262-L266 WeakPolarHBondContact O-CD1 3.07Å; M262-L266 WeakPolarHBondContact O-CG 2.85Å; M262-L266 PolarHBondContact O-N 3.46Å; M262-L266 HydrophobicContact SD-CG 4.45Å; M262-I274 HydrophobicContact CE-CB 3.96Å; M262-I274 HydrophobicContact CE-CG1 3.87Å; M262-I274 HydrophobicContact CE-CG2 3.23Å; M262-I274 HydrophobicContact SD-CB 4.49Å; M262-I274 HydrophobicContact SD-CG1 4.41Å; M262-I274 HydrophobicContact SD-CG2 4.2Å; M262-I277 HydrophobicContact CB-CG2 4.43Å; M262-I277 HydrophobicContact SD-CB 4.47Å; M262-I277 HydrophobicContact SD-CG2 4.19Å; M262-L299 HydrophobicContact CB-CD1 3.56Å; M262-L299 HydrophobicContact CE-CD1 4.49Å; M262-L299 HydrophobicContact CG-CD1 3.34Å; M262-L299 HydrophobicContact SD-CD1 3.9Å; M262-L302 HydrophobicContact CB-CD2 4.42Å; M262-L302 HydrophobicContact CG-CD2 4.13Å; M262-L303 HydrophobicContact CE-CD1 4.11Å; M262-L303 HydrophobicContact CE-CD2 3.3Å; M262-L303 HydrophobicContact CE-CG 3.76Å
263	R	74.6	Confident	73.2	Confident	27 Å²	27	36.7 Å²	36.7	10%	0.102	17%	0.173	C	C	.	.	H	α-helix	trans	-58.2	-38.7	177.1	-64.6	176.3	69.2	-172.7	3.5	111.6	G259 N260 A261 R267 S866 F869 L870 L976 P977	G259-R263 WeakPolarHBondContact O-CG 3.22Å; G259-R263 PolarHBondContact O-N 3.21Å; N260-R263 PolarHBondContact O-N 3.07Å; N260-R263 WeakPolarHBondContact OD1-CD 3.13Å; N260-R263 PolarHBondContact OD1-NH1 3.28Å; A261-R263 PolarHBondContact O-N 3.17Å; R263-R267 PolarHBondContact O-N 2.75Å; R263-S866 PolarHBondContact NH2-O 3.24Å; R263-F869 HydrophobicContact CB-CD1 4.16Å; R263-F869 HydrophobicContact CB-CE1 4.21Å; R263-L870 HydrophobicContact CB-CD1 4.1Å; R263-L870 HydrophobicContact CB-CG 4.48Å; R263-L870 HydrophobicContact CG-CD1 3.75Å; R263-L870 WeakPolarHBondContact O-CD2 3.23Å; R263-L976 HydrophobicContact CG-CD2 3.88Å; R263-P977 VanDerWaalsContact NH1-CD 3.31Å
264	C	73.2	Confident	72.9	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.014	16%	0.161	C	C	.	.	H	α-helix	trans	-69.4	-43.4	176.2	-61.2	0	0	0	0	111.7	T249 Y252 N260 A261 M262 L266 R267 L268	T249-C264 VanDerWaalsContact OG1-CB 3.23Å; T249-C264 WeakPolarHBondContact OG1-CB 3.1Å; Y252-C264 VanDerWaalsContact CE2-SG 3.6Å; N260-C264 PolarHBondContact O-N 3.08Å; N260-C264 VanDerWaalsContact O-N 3.13Å; N260-C264 PolarHBondContact O-SG 3.36Å; N260-C264 VanDerWaalsContact O-SG 3.34Å; A261-C264 PolarHBondContact O-N 3.4Å; M262-C264 PolarHBondContact O-N 3.43Å; C264-L266 VanDerWaalsContact C-N 3.34Å; C264-L266 PolarHBondContact O-N 3.11Å; C264-R267 WeakPolarHBondContact O-CB 3.47Å; C264-R267 PolarHBondContact O-N 3.33Å; C264-R267 VanDerWaalsContact O-N 3.15Å; C264-L268 PolarHBondContact O-N 3.25Å
265	A	77.6	Confident	72.9	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.9	-39.4	176.7	0	0	0	0	0	112.7	T249 A261 M262 R267 L268 N269 L273 I274 I277	T249-A265 HydrophobicContact CG2-CB 4.42Å; A261-A265 PolarHBondContact O-N 2.85Å; M262-A265 PolarHBondContact O-N 3.22Å; M262-A265 VanDerWaalsContact O-N 3.17Å; A265-R267 VanDerWaalsContact C-N 3.29Å; A265-R267 PolarHBondContact O-N 2.93Å; A265-L268 CarbonylContact O-C 3.49Å; A265-L268 WeakPolarHBondContact O-CB 3.23Å; A265-L268 PolarHBondContact O-N 2.86Å; A265-N269 PolarHBondContact O-N 3.19Å; A265-L273 HydrophobicContact CB-CB 4.46Å; A265-I274 HydrophobicContact CB-CG1 4.01Å; A265-I277 HydrophobicContact CB-CD1 3.58Å
266	L	75.7	Confident	73.3	Confident	13 Å²	13	35.3 Å²	35.3	7%	0.068	17%	0.168	C	C	.	.	H	α-helix	trans	-65.2	-33.1	175.1	-70.7	167.3	0	0	0	112	M262 C264 N269 I274 L302 L303 I308 L870	M262-L266 HydrophobicContact CE-CD1 3.87Å; M262-L266 HydrophobicContact CE-CD2 3.57Å; M262-L266 HydrophobicContact CE-CG 3.68Å; M262-L266 HydrophobicContact CG-CD1 3.6Å; M262-L266 HydrophobicContact CG-CG 3.99Å; M262-L266 WeakPolarHBondContact O-CB 3.19Å; M262-L266 WeakPolarHBondContact O-CD1 3.07Å; M262-L266 WeakPolarHBondContact O-CG 2.85Å; M262-L266 PolarHBondContact O-N 3.46Å; M262-L266 HydrophobicContact SD-CG 4.45Å; C264-L266 VanDerWaalsContact C-N 3.34Å; C264-L266 PolarHBondContact O-N 3.11Å; L266-N269 PolarHBondContact O-N 3.44Å; L266-I274 HydrophobicContact CD2-CD1 3.71Å; L266-I274 HydrophobicContact CD2-CG1 4.16Å; L266-L302 HydrophobicContact CD1-CD2 4.03Å; L266-L302 HydrophobicContact CD1-CG 4.24Å; L266-L303 HydrophobicContact CD2-CD2 4.22Å; L266-I308 HydrophobicContact CD2-CD1 3.46Å; L266-I308 VanDerWaalsContact CD2-CD1 3.46Å; L266-L870 HydrophobicContact CB-CD2 3.66Å
267	R	70.6	Confident	73.6	Confident	76 Å²	76	31 Å²	31	29%	0.287	15%	0.147	S	C	.	.	H	α-helix	trans	-70.4	-34	173.2	-171.2	174.1	-177.8	-174.5	2.5	112.4	V233 L245 R263 C264 A265 N269 F869	V233-R267 VanDerWaalsContact CG1-CZ 3.49Å; L245-R267 HydrophobicContact CD1-CB 4.47Å; L245-R267 HydrophobicContact CD1-CG 3.99Å; R263-R267 PolarHBondContact O-N 2.75Å; C264-R267 WeakPolarHBondContact O-CB 3.47Å; C264-R267 PolarHBondContact O-N 3.33Å; C264-R267 VanDerWaalsContact O-N 3.15Å; A265-R267 VanDerWaalsContact C-N 3.29Å; A265-R267 PolarHBondContact O-N 2.93Å; R267-N269 VanDerWaalsContact C-N 3.25Å; R267-F869 HydrophobicContact CB-CE1 4.42Å
268	L	71.5	Confident	73.6	Confident	27 Å²	27	30.8 Å²	30.8	14%	0.141	15%	0.146	C	C	.	.	H	α-helix	trans	-73.2	-18.6	172.9	-72.9	169	0	0	0	113	N242 L245 Q246 C264 A265 D270 L273	N242-L268 HydrophobicContact CB-CD2 4.08Å; L245-L268 HydrophobicContact CB-CD1 3.96Å; L245-L268 HydrophobicContact CB-CD2 3.66Å; L245-L268 HydrophobicContact CB-CG 3.79Å; L245-L268 HydrophobicContact CD1-CD2 3.93Å; L245-L268 HydrophobicContact CD1-CG 4.21Å; L245-L268 HydrophobicContact CG-CD2 4.48Å; Q246-L268 HydrophobicContact CB-CD1 4.38Å; Q246-L268 HydrophobicContact CG-CD1 3.61Å; Q246-L268 HydrophobicContact CG-CD2 4.4Å; C264-L268 PolarHBondContact O-N 3.25Å; A265-L268 CarbonylContact O-C 3.49Å; A265-L268 WeakPolarHBondContact O-CB 3.23Å; A265-L268 PolarHBondContact O-N 2.86Å; L268-D270 PolarHBondContact O-N 2.84Å; L268-L273 HydrophobicContact CD1-CD1 4.31Å
269	N	69.8	Low	73.6	Confident	24 Å²	24	33.9 Å²	33.9	13%	0.128	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.9	35.5	-179.6	-164	20.1	0	0	0	113.6	A265 L266 R267 M271 G535	A265-N269 PolarHBondContact O-N 3.19Å; L266-N269 PolarHBondContact O-N 3.44Å; R267-N269 VanDerWaalsContact C-N 3.25Å; N269-M271 WeakPolarHBondContact OD1-CE 3.35Å; N269-G535 PolarHBondContact ND2-O 3.15Å
270	D	70.3	Confident	73.4	Confident	56 Å²	56	37 Å²	37	30%	0.299	18%	0.176	S	C	.	.			trans	-99.7	110.4	175.1	-173.9	-3.6	0	0	0	110	L268 D272 L273 I274	L268-D270 PolarHBondContact O-N 2.84Å; D270-D272 PolarHBondContact O-N 3.2Å; D270-D272 PolarHBondContact OD1-N 3.37Å; D270-D272 VanDerWaalsContact OD1-N 3.1Å; D270-L273 HydrophobicContact CB-CB 4.31Å; D270-L273 HydrophobicContact CB-CD1 4.06Å; D270-L273 HydrophobicContact CB-CG 4.36Å; D270-L273 PolarHBondContact O-N 3.41Å; D270-L273 WeakPolarHBondContact OD2-CD1 3.1Å; D270-I274 VanDerWaalsContact O-CD1 3.27Å; D270-I274 WeakPolarHBondContact O-CD1 3.46Å; D270-I274 WeakPolarHBondContact O-CG1 3.35Å; D270-I274 PolarHBondContact O-N 3.05Å
271	M	69.2	Low	72.8	Confident	60 Å²	60	36 Å²	36	30%	0.296	17%	0.171	S	C	.	.	H	α-helix	trans	-65	-27.8	-176.2	-64.4	-63.7	160.4	0	0	112.4	N269 I274 R275 I308	N269-M271 WeakPolarHBondContact OD1-CE 3.35Å; M271-I274 HydrophobicContact SD-CD1 4.22Å; M271-R275 WeakPolarHBondContact O-CB 3.49Å; M271-R275 PolarHBondContact O-N 3.43Å; M271-I308 HydrophobicContact CE-CD1 4.28Å; M271-I308 HydrophobicContact CE-CG1 4.37Å; M271-I308 HydrophobicContact CE-CG2 3.92Å; M271-I308 HydrophobicContact SD-CG2 3.54Å; M271-I308 VanDerWaalsContact SD-CG2 3.54Å
272	D	72.8	Confident	72	Confident	108 Å²	108	37.4 Å²	37.4	58%	0.578	19%	0.185	S	C	*	.	H	α-helix	trans	-74.7	-44.9	-178.8	-70.8	-31	0	0	0	111.2	D270 I274 R275 E276	D270-D272 PolarHBondContact O-N 3.2Å; D270-D272 PolarHBondContact OD1-N 3.37Å; D270-D272 VanDerWaalsContact OD1-N 3.1Å; D272-I274 VanDerWaalsContact C-N 3.31Å; D272-I274 PolarHBondContact O-N 2.67Å; D272-R275 WeakPolarHBondContact O-CB 3.42Å; D272-R275 PolarHBondContact O-N 3.13Å; D272-R275 VanDerWaalsContact O-N 3.17Å; D272-E276 WeakPolarHBondContact O-CG 3.33Å; D272-E276 PolarHBondContact O-N 3.45Å
273	L	72.5	Confident	71.2	Confident	33 Å²	33	45.2 Å²	45.2	17%	0.173	22%	0.219	C	C	.	.	H	α-helix	trans	-62	-40.3	174	-73.5	173.1	0	0	0	111.9	A265 L268 D270 R275 E276 I277	A265-L273 HydrophobicContact CB-CB 4.46Å; L268-L273 HydrophobicContact CD1-CD1 4.31Å; D270-L273 HydrophobicContact CB-CB 4.31Å; D270-L273 HydrophobicContact CB-CD1 4.06Å; D270-L273 HydrophobicContact CB-CG 4.36Å; D270-L273 PolarHBondContact O-N 3.41Å; D270-L273 WeakPolarHBondContact OD2-CD1 3.1Å; L273-R275 VanDerWaalsContact C-N 3.33Å; L273-R275 PolarHBondContact O-N 3.25Å; L273-E276 PolarHBondContact O-N 3.49Å; L273-I277 WeakPolarHBondContact O-CD1 3.5Å; L273-I277 WeakPolarHBondContact O-CG1 3.34Å; L273-I277 PolarHBondContact O-N 3.41Å
274	I	75	Confident	70.4	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.1	-45.1	174.6	-70.2	164.4	0	0	0	110.3	M262 A265 L266 D270 M271 D272 I277 F278 L303 I308 F310	M262-I274 HydrophobicContact CE-CB 3.96Å; M262-I274 HydrophobicContact CE-CG1 3.87Å; M262-I274 HydrophobicContact CE-CG2 3.23Å; M262-I274 HydrophobicContact SD-CB 4.49Å; M262-I274 HydrophobicContact SD-CG1 4.41Å; M262-I274 HydrophobicContact SD-CG2 4.2Å; A265-I274 HydrophobicContact CB-CG1 4.01Å; L266-I274 HydrophobicContact CD2-CD1 3.71Å; L266-I274 HydrophobicContact CD2-CG1 4.16Å; D270-I274 VanDerWaalsContact O-CD1 3.27Å; D270-I274 WeakPolarHBondContact O-CD1 3.46Å; D270-I274 WeakPolarHBondContact O-CG1 3.35Å; D270-I274 PolarHBondContact O-N 3.05Å; M271-I274 HydrophobicContact SD-CD1 4.22Å; D272-I274 VanDerWaalsContact C-N 3.31Å; D272-I274 PolarHBondContact O-N 2.67Å; I274-I277 PolarHBondContact O-N 3.17Å; I274-F278 VanDerWaalsContact O-CB 3.29Å; I274-F278 WeakPolarHBondContact O-CB 3.43Å; I274-F278 PolarHBondContact O-N 3.37Å; I274-L303 HydrophobicContact CG2-CD2 4.08Å; I274-I308 HydrophobicContact CD1-CD1 4.46Å; I274-F310 HydrophobicContact CG2-CE1 3.62Å; I274-F310 HydrophobicContact CG2-CZ 3.59Å
275	R	74	Confident	69.3	Low	90 Å²	90	51.9 Å²	51.9	34%	0.34	25%	0.25	S	S	.	.	H	α-helix	trans	-63.8	-44.7	177.9	-175.6	-175.4	-176.6	163.6	9.7	111.9	M271 D272 L273 F278 L279 F310 D312	M271-R275 WeakPolarHBondContact O-CB 3.49Å; M271-R275 PolarHBondContact O-N 3.43Å; D272-R275 WeakPolarHBondContact O-CB 3.42Å; D272-R275 PolarHBondContact O-N 3.13Å; D272-R275 VanDerWaalsContact O-N 3.17Å; L273-R275 VanDerWaalsContact C-N 3.33Å; L273-R275 PolarHBondContact O-N 3.25Å; R275-F278 PolarHBondContact O-N 2.95Å; R275-L279 HydrophobicContact CG-CD1 4.11Å; R275-L279 WeakPolarHBondContact O-CG 3.45Å; R275-L279 PolarHBondContact O-N 3.13Å; R275-F310 HydrophobicContact CB-CD1 4.38Å; R275-F310 HydrophobicContact CB-CE1 3.93Å; R275-F310 HydrophobicContact CG-CE1 4.48Å; R275-D312 IonicContact CZ-OD2 2.99Å; R275-D312 IonicContact NH1-OD2 3.08Å; R275-D312 PolarHBondContact NH1-OD2 2.77Å; R275-D312 IonicContact NH2-OD2 3.97Å; R275-D312 PolarHBondContact NH2-OD2 2.76Å
276	E	78.1	Confident	67.7	Low	91 Å²	91	57.8 Å²	57.8	43%	0.425	28%	0.276	S	S	.	.	H	α-helix	trans	-58.9	-50.1	177.1	-75.4	-171.2	-178.6	0	0	111.4	R253 D272 L273 F278 L279 E280	R253-E276 IonicContact CZ-OE2 2.74Å; R253-E276 IonicContact NH1-OE2 3.05Å; R253-E276 PolarHBondContact NH1-OE2 3.17Å; R253-E276 VanDerWaalsContact NH1-OE2 3.13Å; R253-E276 IonicContact NH2-OE2 3.86Å; R253-E276 PolarHBondContact NH2-OE2 3.13Å; D272-E276 WeakPolarHBondContact O-CG 3.33Å; D272-E276 PolarHBondContact O-N 3.45Å; L273-E276 PolarHBondContact O-N 3.49Å; E276-F278 VanDerWaalsContact C-N 3.27Å; E276-F278 PolarHBondContact O-N 2.96Å; E276-L279 PolarHBondContact O-N 3.12Å; E276-E280 WeakPolarHBondContact O-CB 3.33Å; E276-E280 VanDerWaalsContact O-CG 3.29Å; E276-E280 WeakPolarHBondContact O-CG 3.45Å; E276-E280 PolarHBondContact O-N 3.38Å
277	I	74.8	Confident	66.5	Low	0 Å²	0	60 Å²	60	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-61.9	-39.2	179.9	-66.4	164.3	0	0	0	110.6	T249 L258 A261 M262 A265 L273 I274 E280 S281	T249-I277 HydrophobicContact CG2-CD1 3.65Å; L258-I277 HydrophobicContact CD2-CG2 4.42Å; A261-I277 HydrophobicContact CB-CD1 4.32Å; M262-I277 HydrophobicContact CB-CG2 4.43Å; M262-I277 HydrophobicContact SD-CB 4.47Å; M262-I277 HydrophobicContact SD-CG2 4.19Å; A265-I277 HydrophobicContact CB-CD1 3.58Å; L273-I277 WeakPolarHBondContact O-CD1 3.5Å; L273-I277 WeakPolarHBondContact O-CG1 3.34Å; L273-I277 PolarHBondContact O-N 3.41Å; I274-I277 PolarHBondContact O-N 3.17Å; I277-E280 PolarHBondContact O-N 2.98Å; I277-S281 WeakPolarHBondContact O-CB 3.17Å; I277-S281 PolarHBondContact O-N 3.11Å
278	F	72.6	Confident	65	Low	7 Å²	7	62.6 Å²	62.6	3%	0.031	33%	0.332	C	S	.	.	H	α-helix	trans	-66.6	-41.2	177.3	-174.8	-100.4	0	0	0	112.6	I274 R275 E276 S281 Q296 L299 L303 F310 L316 L321	I274-F278 VanDerWaalsContact O-CB 3.29Å; I274-F278 WeakPolarHBondContact O-CB 3.43Å; I274-F278 PolarHBondContact O-N 3.37Å; R275-F278 PolarHBondContact O-N 2.95Å; E276-F278 VanDerWaalsContact C-N 3.27Å; E276-F278 PolarHBondContact O-N 2.96Å; F278-S281 PolarHBondContact O-N 3.1Å; F278-S281 PolarHBondContact O-OG 3.31Å; F278-Q296 PolarHBondContact O-NE2 3.24Å; F278-L299 HydrophobicContact CB-CD2 4.22Å; F278-L299 HydrophobicContact CD2-CD2 3.67Å; F278-L299 HydrophobicContact CD2-CG 4.03Å; F278-L299 HydrophobicContact CG-CD2 4.4Å; F278-L303 HydrophobicContact CD2-CD1 3.79Å; F278-L303 HydrophobicContact CE2-CD1 4.13Å; F278-F310 HydrophobicContact CB-CE2 4.3Å; F278-F310 HydrophobicContact CB-CZ 3.92Å; F278-F310 AromaticContact CD1-CE2 3.88Å; F278-F310 HydrophobicContact CD1-CE2 3.88Å; F278-F310 HydrophobicContact CD1-CZ 4.27Å; F278-F310 HydrophobicContact CD2-CE2 4.2Å; F278-F310 HydrophobicContact CE1-CE2 4.18Å; F278-F310 AromaticContact CG-CE2 3.87Å; F278-F310 HydrophobicContact CG-CE2 3.87Å; F278-F310 HydrophobicContact CG-CZ 4.02Å; F278-F310 HydrophobicContact CZ-CE2 4.49Å; F278-L316 HydrophobicContact CE1-CD1 3.96Å; F278-L316 HydrophobicContact CE1-CD2 3.64Å; F278-L316 HydrophobicContact CE1-CG 4.37Å; F278-L316 HydrophobicContact CZ-CD1 4.33Å; F278-L316 HydrophobicContact CZ-CD2 4.22Å; F278-L321 HydrophobicContact CE1-CD2 4.45Å; F278-L321 HydrophobicContact CZ-CD1 4.36Å; F278-L321 HydrophobicContact CZ-CD2 3.85Å; F278-L321 HydrophobicContact CZ-CG 4.26Å
279	L	73.8	Confident	63.7	Low	75 Å²	75	69.2 Å²	69.2	39%	0.393	36%	0.355	S	S	.	.	H	α-helix	trans	-70.7	-36.9	175.2	-70.6	173.3	0	0	0	112.6	R275 E276 S281 G282	R275-L279 HydrophobicContact CG-CD1 4.11Å; R275-L279 WeakPolarHBondContact O-CG 3.45Å; R275-L279 PolarHBondContact O-N 3.13Å; E276-L279 PolarHBondContact O-N 3.12Å; L279-S281 VanDerWaalsContact C-N 3.3Å; L279-G282 PolarHBondContact O-N 2.9Å
280	E	68	Low	63	Low	68 Å²	68	73.6 Å²	73.6	32%	0.318	38%	0.378	S	S	.	.	H	α-helix	trans	-63.7	-38.5	174.1	-76.5	-176.7	165.3	0	0	111.2	R253 E276 I277 G282 K283 V284	R253-E280 IonicContact CZ-OE1 3.06Å; R253-E280 IonicContact CZ-OE2 3.29Å; R253-E280 IonicContact NE-OE1 2.69Å; R253-E280 IonicContact NE-OE2 2.91Å; R253-E280 PolarHBondContact NE-OE2 3.02Å; R253-E280 VanDerWaalsContact NH2-CD 3.28Å; R253-E280 IonicContact NH2-OE1 2.75Å; R253-E280 PolarHBondContact NH2-OE1 3.18Å; R253-E280 IonicContact NH2-OE2 3.67Å; R253-E280 PolarHBondContact NH2-OE2 3.14Å; E276-E280 WeakPolarHBondContact O-CB 3.33Å; E276-E280 VanDerWaalsContact O-CG 3.29Å; E276-E280 WeakPolarHBondContact O-CG 3.45Å; E276-E280 PolarHBondContact O-N 3.38Å; I277-E280 PolarHBondContact O-N 2.98Å; E280-G282 PolarHBondContact O-N 2.87Å; E280-G282 VanDerWaalsContact O-N 3.17Å; E280-K283 PolarHBondContact O-N 3.48Å; E280-V284 WeakPolarHBondContact O-CG2 3.33Å; E280-V284 PolarHBondContact O-N 3.19Å
281	S	61.8	Low	62.4	Low	0 Å²	0	73 Å²	73	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-59.2	-29.6	177.6	76.1	0	0	0	0	113	L258 I277 F278 L279 K283 G292 Q296	L258-S281 VanDerWaalsContact CD1-CA 3.48Å; I277-S281 WeakPolarHBondContact O-CB 3.17Å; I277-S281 PolarHBondContact O-N 3.11Å; F278-S281 PolarHBondContact O-N 3.1Å; F278-S281 PolarHBondContact O-OG 3.31Å; L279-S281 VanDerWaalsContact C-N 3.3Å; S281-K283 VanDerWaalsContact C-N 3.33Å; S281-K283 PolarHBondContact O-N 3.49Å; S281-G292 WeakPolarHBondContact O-CA 3.16Å; S281-Q296 WeakPolarHBondContact OG-CG 3.26Å
282	G	59.9	Low	62	Low	29 Å²	29	70.2 Å²	70.2	30%	0.299	36%	0.359	S	S	.	.	H	α-helix	trans	-74.1	-19.9	173.8	0	0	0	0	0	115.1	L279 E280	L279-G282 PolarHBondContact O-N 2.9Å; E280-G282 PolarHBondContact O-N 2.87Å; E280-G282 VanDerWaalsContact O-N 3.17Å
283	K	59.5	Low	61.7	Low	163 Å²	163	67.2 Å²	67.2	71%	0.709	35%	0.345	S	S	*	.	H	α-helix	trans	-98.1	-10.9	-174.4	-66.4	173.6	-175.4	170.9	0	113.3	E280 S281 K285	E280-K283 PolarHBondContact O-N 3.48Å; S281-K283 VanDerWaalsContact C-N 3.33Å; S281-K283 PolarHBondContact O-N 3.49Å; K283-K285 PolarHBondContact O-N 3.06Å
284	V	57.7	Low	61.5	Low	22 Å²	22	66.3 Å²	66.3	13%	0.133	34%	0.343	C	S	.	.			trans	-66.9	117.8	-177.1	-176.9	0	0	0	0	111.5	L258 E280 K286 G292	L258-V284 HydrophobicContact CD1-CG2 3.64Å; E280-V284 WeakPolarHBondContact O-CG2 3.33Å; E280-V284 PolarHBondContact O-N 3.19Å; V284-K286 HydrophobicContact CG1-CG 4.5Å; V284-G292 PolarHBondContact O-N 3.42Å
285	K	49	Very low	61.2	Low	147 Å²	147	67.4 Å²	67.4	64%	0.639	35%	0.348	S	S	*	.			trans	-116.6	94.9	175.1	-68.5	-178.8	-179.4	179	0	110.2	K283 G287 N290	K283-K285 PolarHBondContact O-N 3.06Å; K285-G287 VanDerWaalsContact C-N 3.33Å; K285-G287 PolarHBondContact O-N 3.44Å; K285-G287 VanDerWaalsContact O-N 3.12Å; K285-N290 WeakPolarHBondContact CE-OD1 3.32Å
286	K	45.9	Very low	61.1	Low	124 Å²	124	64.3 Å²	64.3	54%	0.539	34%	0.338	S	S	.	.			trans	-81.3	70.6	167.8	-79.9	-172	174.5	176.2	0	112.2	E256 V284 Y291	E256-K286 WeakPolarHBondContact OE2-CE 3.45Å; E256-K286 IonicContact OE2-NZ 2.63Å; V284-K286 HydrophobicContact CG1-CG 4.5Å; K286-Y291 HydrophobicContact CB-CD2 3.79Å; K286-Y291 HydrophobicContact CB-CE2 3.92Å; K286-Y291 WeakPolarHBondContact O-CE2 3.15Å
287	G	48.8	Very low	60.9	Low	59 Å²	59	62.5 Å²	62.5	61%	0.608	33%	0.327	S	S	*	.	S	Bend	trans	95.6	-148.6	-179.1	0	0	0	0	0	113.8	K285 R289	K285-G287 VanDerWaalsContact C-N 3.33Å; K285-G287 PolarHBondContact O-N 3.44Å; K285-G287 VanDerWaalsContact O-N 3.12Å; G287-R289 VanDerWaalsContact C-N 3.31Å; G287-R289 PolarHBondContact O-N 3.47Å
288	S	39.9	Very low	60.8	Low	132 Å²	132	62.9 Å²	62.9	92%	0.923	33%	0.329	S	S	*	.	S	Bend	trans	-77.3	-3.2	-170.1	-169.8	0	0	0	0	115.7
289	R	45	Very low	60.8	Low	166 Å²	166	62.9 Å²	62.9	63%	0.626	33%	0.329	S	S	*	.	S	Bend	trans	-114.4	139.4	-179.7	-69.4	-175.6	179.7	-179.7	1.6	110.1	G287 Y291	G287-R289 VanDerWaalsContact C-N 3.31Å; G287-R289 PolarHBondContact O-N 3.47Å; R289-Y291 HydrophobicContact CB-CE1 4.22Å; R289-Y291 HydrophobicContact CB-CE2 3.85Å; R289-Y291 WeakPolarHBondContact O-CD2 3.39Å; R289-Y291 WeakPolarHBondContact O-CE2 3.16Å; R289-Y291 PolarHBondContact O-N 3.28Å
290	N	53.6	Low	60.7	Low	115 Å²	115	59.3 Å²	59.3	62%	0.615	31%	0.31	S	S	*	.			trans	-75.1	101.2	173.3	-72.6	-16	0	0	0	108.3	K285 G292 P293	K285-N290 WeakPolarHBondContact CE-OD1 3.32Å; N290-G292 VanDerWaalsContact C-N 3.34Å; N290-P293 WeakPolarHBondContact O-CD 3.08Å
291	Y	57.5	Low	61	Low	45 Å²	45	56.5 Å²	56.5	18%	0.176	30%	0.296	C	S	.	.			trans	-84.5	-14	175	-62.3	-75.3	0	0	0	112.9	K286 R289 P293 A294 I295 R985	K286-Y291 HydrophobicContact CB-CD2 3.79Å; K286-Y291 HydrophobicContact CB-CE2 3.92Å; K286-Y291 WeakPolarHBondContact O-CE2 3.15Å; R289-Y291 HydrophobicContact CB-CE1 4.22Å; R289-Y291 HydrophobicContact CB-CE2 3.85Å; R289-Y291 WeakPolarHBondContact O-CD2 3.39Å; R289-Y291 WeakPolarHBondContact O-CE2 3.16Å; R289-Y291 PolarHBondContact O-N 3.28Å; Y291-P293 VanDerWaalsContact C-CD 3.45Å; Y291-A294 PolarHBondContact O-N 3.03Å; Y291-I295 PolarHBondContact O-N 2.66Å; Y291-R985 PolarHBondContact OH-NH2 3.41Å
292	G	60.8	Low	61.5	Low	1 Å²	1	57.3 Å²	57.3	1%	0.01	30%	0.301	C	S	.	.	H	α-helix	trans	-46.7	-49.2	-179.4	0	0	0	0	0	115.5	S281 V284 N290 A294 I295 Q296	S281-G292 WeakPolarHBondContact O-CA 3.16Å; V284-G292 PolarHBondContact O-N 3.42Å; N290-G292 VanDerWaalsContact C-N 3.34Å; G292-A294 VanDerWaalsContact C-N 3.33Å; G292-A294 PolarHBondContact O-N 3.49Å; G292-I295 PolarHBondContact O-N 2.88Å; G292-Q296 WeakPolarHBondContact O-CB 3.38Å; G292-Q296 WeakPolarHBondContact O-CG 3.48Å; G292-Q296 PolarHBondContact O-N 3.32Å
293	P	67.1	Low	62.1	Low	45 Å²	45	56 Å²	56	29%	0.292	29%	0.287	S	S	.	.	H	α-helix	trans	-66.3	-33	-175.7	24.5	-34.1	0	0	0	112.9	N290 Y291 Q296 R297	N290-P293 WeakPolarHBondContact O-CD 3.08Å; Y291-P293 VanDerWaalsContact C-CD 3.45Å; P293-Q296 PolarHBondContact O-N 3.3Å; P293-R297 WeakPolarHBondContact O-CB 3.41Å; P293-R297 WeakPolarHBondContact O-CD 3.33Å; P293-R297 WeakPolarHBondContact O-CG 3.23Å; P293-R297 PolarHBondContact O-N 3.49Å
294	A	67.9	Low	62.6	Low	14 Å²	14	48.2 Å²	48.2	12%	0.116	25%	0.253	C	S	.	.	H	α-helix	trans	-75.3	-36.5	-177.9	0	0	0	0	0	112.1	Y291 G292 R297 Q298 I973 L983	Y291-A294 PolarHBondContact O-N 3.03Å; G292-A294 VanDerWaalsContact C-N 3.33Å; G292-A294 PolarHBondContact O-N 3.49Å; A294-R297 PolarHBondContact O-N 3.16Å; A294-Q298 PolarHBondContact O-N 3.43Å; A294-Q298 VanDerWaalsContact O-N 3.11Å; A294-I973 HydrophobicContact CB-CD1 3.53Å; A294-I973 HydrophobicContact CB-CG2 4.42Å; A294-L983 WeakPolarHBondContact O-CD1 3.17Å
295	I	70.5	Confident	63.1	Low	23 Å²	23	49 Å²	49	12%	0.118	25%	0.254	C	S	.	.	H	α-helix	trans	-67.9	-43.6	172.2	-61	170.3	0	0	0	109.8	L258 Y291 G292 R297 Q298 L299 I973 T974	L258-I295 HydrophobicContact CB-CG2 4.46Å; L258-I295 HydrophobicContact CD1-CG2 4.22Å; Y291-I295 PolarHBondContact O-N 2.66Å; G292-I295 PolarHBondContact O-N 2.88Å; I295-R297 VanDerWaalsContact C-N 3.32Å; I295-R297 PolarHBondContact O-N 3.01Å; I295-Q298 PolarHBondContact O-N 3.06Å; I295-L299 VanDerWaalsContact O-CB 3.28Å; I295-L299 WeakPolarHBondContact O-CB 3.49Å; I295-L299 PolarHBondContact O-N 3.04Å; I295-I973 HydrophobicContact CB-CG2 4.43Å; I295-I973 HydrophobicContact CG1-CG2 3.57Å; I295-T974 HydrophobicContact CG2-CG2 4.3Å
296	Q	71.2	Confident	64	Low	25 Å²	25	42.4 Å²	42.4	12%	0.117	23%	0.225	C	C	.	.	H	α-helix	trans	-57.9	-42.7	174.3	-83.6	-177.9	-39.5	0	0	112.6	F278 S281 G292 P293 L299 A300 L321	F278-Q296 PolarHBondContact O-NE2 3.24Å; S281-Q296 WeakPolarHBondContact OG-CG 3.26Å; G292-Q296 WeakPolarHBondContact O-CB 3.38Å; G292-Q296 WeakPolarHBondContact O-CG 3.48Å; G292-Q296 PolarHBondContact O-N 3.32Å; P293-Q296 PolarHBondContact O-N 3.3Å; Q296-L299 PolarHBondContact O-N 3.11Å; Q296-A300 VanDerWaalsContact O-CB 3.27Å; Q296-A300 WeakPolarHBondContact O-CB 3.3Å; Q296-A300 PolarHBondContact O-N 3.31Å; Q296-L321 HydrophobicContact CB-CD1 4.26Å
297	R	72.9	Confident	64.9	Low	52 Å²	52	37.3 Å²	37.3	20%	0.196	20%	0.204	C	C	.	.	H	α-helix	trans	-64.3	-42.9	176.9	-76.2	169.9	-169.5	175.2	0.3	112	P293 A294 I295 L299 A300 Y301 L321 M324 E918 L983	P293-R297 WeakPolarHBondContact O-CB 3.41Å; P293-R297 WeakPolarHBondContact O-CD 3.33Å; P293-R297 WeakPolarHBondContact O-CG 3.23Å; P293-R297 PolarHBondContact O-N 3.49Å; A294-R297 PolarHBondContact O-N 3.16Å; I295-R297 VanDerWaalsContact C-N 3.32Å; I295-R297 PolarHBondContact O-N 3.01Å; R297-L299 VanDerWaalsContact C-N 3.33Å; R297-A300 PolarHBondContact O-N 3.46Å; R297-Y301 WeakPolarHBondContact O-CD2 3.33Å; R297-Y301 PolarHBondContact O-N 3.02Å; R297-L321 HydrophobicContact CG-CD1 4.45Å; R297-M324 HydrophobicContact CB-CE 3.61Å; R297-M324 HydrophobicContact CB-SD 4.26Å; R297-M324 HydrophobicContact CG-CE 4.02Å; R297-M324 HydrophobicContact CG-SD 4.01Å; R297-M324 WeakPolarHBondContact O-CE 3.29Å; R297-E918 PolarHBondContact NH1-O 2.87Å; R297-L983 HydrophobicContact CB-CD1 3.55Å
298	Q	72.6	Confident	65.7	Low	9 Å²	9	35.4 Å²	35.4	4%	0.042	18%	0.18	C	C	.	.	H	α-helix	trans	-66.8	-38.3	176.3	-167.9	172	8.7	0	0	111.7	A294 I295 A300 Y301 L302 T974 L976 L983	A294-Q298 PolarHBondContact O-N 3.43Å; A294-Q298 VanDerWaalsContact O-N 3.11Å; I295-Q298 PolarHBondContact O-N 3.06Å; Q298-A300 VanDerWaalsContact C-N 3.34Å; Q298-Y301 PolarHBondContact O-N 3.32Å; Q298-L302 PolarHBondContact O-N 3.15Å; Q298-L302 VanDerWaalsContact O-N 3.13Å; Q298-T974 PolarHBondContact NE2-OG1 2.81Å; Q298-T974 PolarHBondContact OE1-OG1 3.29Å; Q298-L976 HydrophobicContact CG-CD1 4.48Å; Q298-L983 HydrophobicContact CB-CD1 4.3Å
299	L	72.6	Confident	66.6	Low	6 Å²	6	30 Å²	30	3%	0.031	14%	0.141	C	C	.	.	H	α-helix	trans	-65.7	-37.5	174.7	-170.1	60.1	0	0	0	111.9	M262 F278 I295 Q296 R297 L302 L303	M262-L299 HydrophobicContact CB-CD1 3.56Å; M262-L299 HydrophobicContact CE-CD1 4.49Å; M262-L299 HydrophobicContact CG-CD1 3.34Å; M262-L299 HydrophobicContact SD-CD1 3.9Å; F278-L299 HydrophobicContact CB-CD2 4.22Å; F278-L299 HydrophobicContact CD2-CD2 3.67Å; F278-L299 HydrophobicContact CD2-CG 4.03Å; F278-L299 HydrophobicContact CG-CD2 4.4Å; I295-L299 VanDerWaalsContact O-CB 3.28Å; I295-L299 WeakPolarHBondContact O-CB 3.49Å; I295-L299 PolarHBondContact O-N 3.04Å; Q296-L299 PolarHBondContact O-N 3.11Å; R297-L299 VanDerWaalsContact C-N 3.33Å; L299-L302 HydrophobicContact CD1-CD2 4.4Å; L299-L302 WeakPolarHBondContact O-CB 3.42Å; L299-L302 PolarHBondContact O-N 3.06Å; L299-L303 HydrophobicContact CG-CD1 4.47Å; L299-L303 WeakPolarHBondContact O-CB 3.47Å; L299-L303 PolarHBondContact O-N 3.42Å
300	A	73.3	Confident	67.1	Low	0 Å²	0	23 Å²	23	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-64.3	-39.3	174.2	0	0	0	0	0	111.7	Q296 R297 Q298 L302 L303 G304 L321 M324	Q296-A300 VanDerWaalsContact O-CB 3.27Å; Q296-A300 WeakPolarHBondContact O-CB 3.3Å; Q296-A300 PolarHBondContact O-N 3.31Å; R297-A300 PolarHBondContact O-N 3.46Å; Q298-A300 VanDerWaalsContact C-N 3.34Å; A300-L302 VanDerWaalsContact C-N 3.32Å; A300-L302 PolarHBondContact O-N 3.5Å; A300-L303 PolarHBondContact O-N 3.1Å; A300-G304 PolarHBondContact O-N 3.23Å; A300-L321 HydrophobicContact CB-CD1 3.62Å; A300-M324 HydrophobicContact CB-CB 4.41Å
301	Y	73.7	Confident	67	Low	9 Å²	9	22.7 Å²	22.7	4%	0.035	12%	0.119	C	C	.	.	H	α-helix	trans	-64.3	-35.5	171.5	-78.1	-53.4	0	0	0	112.9	R297 Q298 R305 M324 F916 F981	R297-Y301 WeakPolarHBondContact O-CD2 3.33Å; R297-Y301 PolarHBondContact O-N 3.02Å; Q298-Y301 PolarHBondContact O-N 3.32Å; Y301-R305 VanDerWaalsContact O-CB 3.3Å; Y301-R305 WeakPolarHBondContact O-CB 3.43Å; Y301-R305 VanDerWaalsContact O-CG 3.25Å; Y301-R305 WeakPolarHBondContact O-CG 3.46Å; Y301-R305 PolarHBondContact O-N 3.28Å; Y301-M324 HydrophobicContact CD1-CE 4.07Å; Y301-M324 HydrophobicContact CD2-CE 3.36Å; Y301-M324 HydrophobicContact CE1-CE 3.77Å; Y301-M324 HydrophobicContact CE1-CG 4.22Å; Y301-M324 HydrophobicContact CE2-CE 3.02Å; Y301-M324 HydrophobicContact CE2-SD 4.26Å; Y301-M324 HydrophobicContact CG-CE 3.87Å; Y301-F916 HydrophobicContact CE2-CD2 4.45Å; Y301-F981 HydrophobicContact CD1-CB 4Å; Y301-F981 AromaticContact CD1-CD2 3.52Å; Y301-F981 HydrophobicContact CD1-CD2 3.52Å; Y301-F981 HydrophobicContact CD1-CE2 4.35Å; Y301-F981 HydrophobicContact CD1-CG 4.07Å; Y301-F981 HydrophobicContact CD2-CB 3.66Å; Y301-F981 HydrophobicContact CE1-CB 4.16Å; Y301-F981 AromaticContact CE1-CD2 3.7Å; Y301-F981 HydrophobicContact CE1-CD2 3.7Å; Y301-F981 HydrophobicContact CE1-CE2 4.33Å; Y301-F981 HydrophobicContact CE1-CG 4.05Å; Y301-F981 HydrophobicContact CE2-CB 3.82Å; Y301-F981 HydrophobicContact CE2-CG 4.5Å; Y301-F981 HydrophobicContact CG-CB 3.75Å; Y301-F981 HydrophobicContact CG-CD2 4.09Å; Y301-F981 HydrophobicContact CG-CG 4.34Å
302	L	71.5	Confident	66.3	Low	18 Å²	18	24.6 Å²	24.6	9%	0.094	13%	0.133	C	C	.	.	H	α-helix	trans	-67.7	-43	175.2	-178.1	64.9	0	0	0	111.3	M262 L266 Q298 L299 A300 R305 Q306 L976	M262-L302 HydrophobicContact CB-CD2 4.42Å; M262-L302 HydrophobicContact CG-CD2 4.13Å; L266-L302 HydrophobicContact CD1-CD2 4.03Å; L266-L302 HydrophobicContact CD1-CG 4.24Å; Q298-L302 PolarHBondContact O-N 3.15Å; Q298-L302 VanDerWaalsContact O-N 3.13Å; L299-L302 HydrophobicContact CD1-CD2 4.4Å; L299-L302 WeakPolarHBondContact O-CB 3.42Å; L299-L302 PolarHBondContact O-N 3.06Å; A300-L302 VanDerWaalsContact C-N 3.32Å; A300-L302 PolarHBondContact O-N 3.5Å; L302-R305 WeakPolarHBondContact O-CB 3.37Å; L302-R305 PolarHBondContact O-N 3.18Å; L302-Q306 PolarHBondContact O-N 3.06Å; L302-L976 HydrophobicContact CD2-CD1 4.35Å
303	L	72.5	Confident	65.6	Low	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-66.6	-45.7	176.6	-81.7	172	0	0	0	112.5	M262 L266 I274 F278 L299 A300 R305 Q306 N307 I308 F310 L325	M262-L303 HydrophobicContact CE-CD1 4.11Å; M262-L303 HydrophobicContact CE-CD2 3.3Å; M262-L303 HydrophobicContact CE-CG 3.76Å; L266-L303 HydrophobicContact CD2-CD2 4.22Å; I274-L303 HydrophobicContact CG2-CD2 4.08Å; F278-L303 HydrophobicContact CD2-CD1 3.79Å; F278-L303 HydrophobicContact CE2-CD1 4.13Å; L299-L303 HydrophobicContact CG-CD1 4.47Å; L299-L303 WeakPolarHBondContact O-CB 3.47Å; L299-L303 PolarHBondContact O-N 3.42Å; A300-L303 PolarHBondContact O-N 3.1Å; L303-R305 PolarHBondContact O-N 3.42Å; L303-Q306 CarbonylContact O-C 3.54Å; L303-Q306 WeakPolarHBondContact O-CA 3.36Å; L303-Q306 PolarHBondContact O-N 3.34Å; L303-N307 PolarHBondContact O-N 3.34Å; L303-I308 HydrophobicContact CD2-CB 4.19Å; L303-I308 HydrophobicContact CD2-CG2 4.48Å; L303-I308 PolarHBondContact O-N 3.46Å; L303-F310 HydrophobicContact CD1-CE2 3.59Å; L303-F310 HydrophobicContact CD1-CZ 3.84Å; L303-L325 HydrophobicContact CB-CD1 3.97Å
304	G	71	Confident	64.5	Low	1 Å²	1	37.1 Å²	37.1	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-58.6	-35.4	172.9	0	0	0	0	0	111.4	A300 Q306 N307 N327	A300-G304 PolarHBondContact O-N 3.23Å; G304-Q306 VanDerWaalsContact C-N 3.31Å; G304-Q306 PolarHBondContact O-N 2.9Å; G304-N307 PolarHBondContact O-N 2.95Å; G304-N307 PolarHBondContact O-OD1 2.82Å; G304-N327 PolarHBondContact O-ND2 2.73Å
305	R	68.5	Low	63.1	Low	38 Å²	38	41.2 Å²	41.2	14%	0.143	21%	0.214	C	C	.	.	H	α-helix	trans	-71.2	-17.7	171.8	-83.4	178.1	153.5	-149.3	-13.3	115.3	Y301 L302 L303 R872 E979	Y301-R305 VanDerWaalsContact O-CB 3.3Å; Y301-R305 WeakPolarHBondContact O-CB 3.43Å; Y301-R305 VanDerWaalsContact O-CG 3.25Å; Y301-R305 WeakPolarHBondContact O-CG 3.46Å; Y301-R305 PolarHBondContact O-N 3.28Å; L302-R305 WeakPolarHBondContact O-CB 3.37Å; L302-R305 PolarHBondContact O-N 3.18Å; L303-R305 PolarHBondContact O-N 3.42Å; R305-R872 VanDerWaalsContact C-NH1 3.33Å; R305-R872 PolarHBondContact O-NH1 2.97Å; R305-E979 VanDerWaalsContact NH1-C 3.26Å; R305-E979 PolarHBondContact NH1-O 3.18Å
306	Q	66.5	Low	62.1	Low	8 Å²	8	42.2 Å²	42.2	4%	0.037	22%	0.219	C	C	.	.	H	α-helix	trans	-100.9	-3	172.3	-66.1	-168.1	4.5	0	0	112.8	L302 L303 G304 I308 H865	L302-Q306 PolarHBondContact O-N 3.06Å; L303-Q306 CarbonylContact O-C 3.54Å; L303-Q306 WeakPolarHBondContact O-CA 3.36Å; L303-Q306 PolarHBondContact O-N 3.34Å; G304-Q306 VanDerWaalsContact C-N 3.31Å; G304-Q306 PolarHBondContact O-N 2.9Å; Q306-I308 HydrophobicContact CB-CD1 4.29Å; Q306-I308 HydrophobicContact CB-CG1 4.32Å; Q306-I308 PolarHBondContact O-N 3.39Å; Q306-H865 PolarHBondContact NE2-CE1 3.37Å; Q306-H865 VanDerWaalsContact NE2-CE1 3.34Å
307	N	65.3	Low	61.1	Low	18 Å²	18	45.9 Å²	45.9	10%	0.096	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.7	24	-176.2	-74.4	19.1	0	0	0	114.2	L303 G304 R872	L303-N307 PolarHBondContact O-N 3.34Å; G304-N307 PolarHBondContact O-N 2.95Å; G304-N307 PolarHBondContact O-OD1 2.82Å; N307-R872 VanDerWaalsContact CG-NH2 3.26Å; N307-R872 PolarHBondContact ND2-NH2 3.07Å; N307-R872 PolarHBondContact OD1-NH1 3.36Å; N307-R872 PolarHBondContact OD1-NH2 3.44Å
308	I	65	Low	60.5	Low	18 Å²	18	47.2 Å²	47.2	9%	0.092	27%	0.265	C	S	.	.			trans	-80.9	124.7	174	-63	169.6	0	0	0	107.8	L266 M271 I274 L303 Q306	L266-I308 HydrophobicContact CD2-CD1 3.46Å; L266-I308 VanDerWaalsContact CD2-CD1 3.46Å; M271-I308 HydrophobicContact CE-CD1 4.28Å; M271-I308 HydrophobicContact CE-CG1 4.37Å; M271-I308 HydrophobicContact CE-CG2 3.92Å; M271-I308 HydrophobicContact SD-CG2 3.54Å; M271-I308 VanDerWaalsContact SD-CG2 3.54Å; I274-I308 HydrophobicContact CD1-CD1 4.46Å; L303-I308 HydrophobicContact CD2-CB 4.19Å; L303-I308 HydrophobicContact CD2-CG2 4.48Å; L303-I308 PolarHBondContact O-N 3.46Å; Q306-I308 HydrophobicContact CB-CD1 4.29Å; Q306-I308 HydrophobicContact CB-CG1 4.32Å; Q306-I308 PolarHBondContact O-N 3.39Å
309	V	59.5	Low	60.2	Low	18 Å²	18	54.6 Å²	54.6	11%	0.109	30%	0.299	C	S	.	.			trans	-116.3	130.9	176.3	179.5	0	0	0	0	109.9	K462	V309-K462 HydrophobicContact CB-CD 4.47Å; V309-K462 HydrophobicContact CG1-CD 4.33Å; V309-K462 HydrophobicContact CG2-CD 3.75Å
310	F	56.2	Low	59.9	Low	19 Å²	19	57.2 Å²	57.2	8%	0.083	31%	0.313	C	S	.	.			trans	-67.7	130.9	175.3	-66.8	-67.9	0	0	0	109.9	I274 R275 F278 L303 D312 L325	I274-F310 HydrophobicContact CG2-CE1 3.62Å; I274-F310 HydrophobicContact CG2-CZ 3.59Å; R275-F310 HydrophobicContact CB-CD1 4.38Å; R275-F310 HydrophobicContact CB-CE1 3.93Å; R275-F310 HydrophobicContact CG-CE1 4.48Å; F278-F310 HydrophobicContact CB-CE2 4.3Å; F278-F310 HydrophobicContact CB-CZ 3.92Å; F278-F310 AromaticContact CD1-CE2 3.88Å; F278-F310 HydrophobicContact CD1-CE2 3.88Å; F278-F310 HydrophobicContact CD1-CZ 4.27Å; F278-F310 HydrophobicContact CD2-CE2 4.2Å; F278-F310 HydrophobicContact CE1-CE2 4.18Å; F278-F310 AromaticContact CG-CE2 3.87Å; F278-F310 HydrophobicContact CG-CE2 3.87Å; F278-F310 HydrophobicContact CG-CZ 4.02Å; F278-F310 HydrophobicContact CZ-CE2 4.49Å; L303-F310 HydrophobicContact CD1-CE2 3.59Å; L303-F310 HydrophobicContact CD1-CZ 3.84Å; F310-D312 PolarHBondContact O-N 3.21Å; F310-L325 HydrophobicContact CD2-CD2 4.4Å
311	P	51.6	Low	59.5	Low	109 Å²	109	57.6 Å²	57.6	71%	0.708	32%	0.315	S	S	*	.	S	Bend	trans	-65.1	-23.3	176	-21.5	32.1	0	0	0	114.2	E313	P311-E313 PolarHBondContact O-N 2.69Å
312	D	42.7	Very low	59.2	Low	86 Å²	86	58.3 Å²	58.3	46%	0.46	32%	0.321	S	S	.	.			trans	-103.6	78.2	-174.3	-68.2	-13.9	0	0	0	111	R275 F310 E314	R275-D312 IonicContact CZ-OD2 2.99Å; R275-D312 IonicContact NH1-OD2 3.08Å; R275-D312 PolarHBondContact NH1-OD2 2.77Å; R275-D312 IonicContact NH2-OD2 3.97Å; R275-D312 PolarHBondContact NH2-OD2 2.76Å; F310-D312 PolarHBondContact O-N 3.21Å; D312-E314 PolarHBondContact O-N 3.39Å
313	E	45.5	Very low	59	Low	109 Å²	109	60.7 Å²	60.7	51%	0.509	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-72.5	-9.3	-176.3	-67.5	-178.1	150.3	0	0	114	P311 C315	P311-E313 PolarHBondContact O-N 2.69Å; E313-C315 PolarHBondContact O-N 2.9Å
314	E	43.9	Very low	58.6	Low	199 Å²	199	60.9 Å²	60.9	93%	0.93	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-83.6	-2.9	-169.5	-60.8	-173.4	168.5	0	0	115.6	D312	D312-E314 PolarHBondContact O-N 3.39Å
315	C	38	Very low	58.4	Low	101 Å²	101	61.4 Å²	61.4	68%	0.682	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-106.1	-0.9	-173.7	-76.9	0	0	0	0	115.8	E313	E313-C315 PolarHBondContact O-N 2.9Å
316	L	50.2	Low	58.4	Low	44 Å²	44	60.9 Å²	60.9	23%	0.23	33%	0.333	C	S	.	.			trans	-101	104.1	-179.4	-70.6	167.7	0	0	0	110.2	F278 D318 L321	F278-L316 HydrophobicContact CE1-CD1 3.96Å; F278-L316 HydrophobicContact CE1-CD2 3.64Å; F278-L316 HydrophobicContact CE1-CG 4.37Å; F278-L316 HydrophobicContact CZ-CD1 4.33Å; F278-L316 HydrophobicContact CZ-CD2 4.22Å; L316-D318 PolarHBondContact O-N 3.3Å; L316-L321 HydrophobicContact CD1-CD2 4.34Å; L316-L321 HydrophobicContact CD2-CD2 3.47Å; L316-L321 VanDerWaalsContact CD2-CD2 3.47Å; L316-L321 HydrophobicContact CG-CD2 4.34Å
317	A	50.1	Low	58.7	Low	101 Å²	101	61.3 Å²	61.3	84%	0.835	34%	0.335	S	S	*	.			trans	-74.2	-7	-177.1	0	0	0	0	0	114.8
318	D	61	Low	58.9	Low	81 Å²	81	62.5 Å²	62.5	43%	0.433	34%	0.344	S	S	.	.			trans	-106.1	109.2	-174.2	-73.5	-12.3	0	0	0	111.2	L316 D320 L321 T322	L316-D318 PolarHBondContact O-N 3.3Å; D318-D320 VanDerWaalsContact C-N 3.26Å; D318-D320 PolarHBondContact O-N 3.46Å; D318-L321 HydrophobicContact CB-CB 4.07Å; D318-L321 WeakPolarHBondContact O-CB 3.09Å; D318-L321 PolarHBondContact O-N 3.05Å; D318-T322 PolarHBondContact O-N 3.37Å
319	E	65.2	Low	59	Low	163 Å²	163	64.4 Å²	64.4	76%	0.762	35%	0.349	S	S	*	.	H	α-helix	trans	-53.7	-40.5	175.7	-66.9	174.7	174.6	0	0	112.1	L321 T322 E323	E319-L321 VanDerWaalsContact C-N 3.27Å; E319-L321 PolarHBondContact O-N 3.48Å; E319-T322 PolarHBondContact O-N 3.21Å; E319-E323 WeakPolarHBondContact O-CG 3.41Å; E319-E323 PolarHBondContact O-N 3.28Å
320	D	66.1	Low	59.6	Low	62 Å²	62	64.4 Å²	64.4	33%	0.332	35%	0.349	S	S	.	.	H	α-helix	trans	-58.2	-36.1	177	-79.6	-38.2	0	0	0	113	D318 M324 R329	D318-D320 VanDerWaalsContact C-N 3.26Å; D318-D320 PolarHBondContact O-N 3.46Å; D320-M324 WeakPolarHBondContact O-CB 3.39Å; D320-M324 WeakPolarHBondContact O-CG 3.5Å; D320-M324 PolarHBondContact O-N 3.33Å; D320-M324 VanDerWaalsContact O-N 3.11Å; D320-R329 IonicContact OD1-CZ 3.12Å; D320-R329 IonicContact OD1-NH1 3.99Å; D320-R329 IonicContact OD1-NH2 3.81Å; D320-R329 PolarHBondContact OD1-NH2 3.34Å
321	L	64.7	Low	60.3	Low	7 Å²	7	64.6 Å²	64.6	4%	0.037	35%	0.352	C	S	.	.	H	α-helix	trans	-73.8	-37.7	-177.7	-173.3	66.4	0	0	0	110.8	F278 Q296 R297 A300 L316 D318 E319 M324 L325	F278-L321 HydrophobicContact CE1-CD2 4.45Å; F278-L321 HydrophobicContact CZ-CD1 4.36Å; F278-L321 HydrophobicContact CZ-CD2 3.85Å; F278-L321 HydrophobicContact CZ-CG 4.26Å; Q296-L321 HydrophobicContact CB-CD1 4.26Å; R297-L321 HydrophobicContact CG-CD1 4.45Å; A300-L321 HydrophobicContact CB-CD1 3.62Å; L316-L321 HydrophobicContact CD1-CD2 4.34Å; L316-L321 HydrophobicContact CD2-CD2 3.47Å; L316-L321 VanDerWaalsContact CD2-CD2 3.47Å; L316-L321 HydrophobicContact CG-CD2 4.34Å; D318-L321 HydrophobicContact CB-CB 4.07Å; D318-L321 WeakPolarHBondContact O-CB 3.09Å; D318-L321 PolarHBondContact O-N 3.05Å; E319-L321 VanDerWaalsContact C-N 3.27Å; E319-L321 PolarHBondContact O-N 3.48Å; L321-M324 PolarHBondContact O-N 3.49Å; L321-L325 WeakPolarHBondContact O-CB 3.35Å; L321-L325 PolarHBondContact O-N 2.91Å
322	T	68.3	Low	61.4	Low	25 Å²	25	65.5 Å²	65.5	15%	0.153	35%	0.347	C	S	.	.	H	α-helix	trans	-67.5	-44.8	176.2	-52.8	0	0	0	0	110.7	D318 E319 M324 L325 W326	D318-T322 PolarHBondContact O-N 3.37Å; E319-T322 PolarHBondContact O-N 3.21Å; T322-M324 VanDerWaalsContact C-N 3.27Å; T322-M324 PolarHBondContact O-N 2.93Å; T322-L325 PolarHBondContact O-N 3.36Å; T322-W326 HydrophobicContact CG2-CD2 3.64Å; T322-W326 VanDerWaalsContact CG2-CE2 3.44Å; T322-W326 HydrophobicContact CG2-CE3 3.65Å; T322-W326 HydrophobicContact CG2-CG 4.46Å; T322-W326 HydrophobicContact CG2-CH2 3.27Å; T322-W326 HydrophobicContact CG2-CZ2 3.32Å; T322-W326 HydrophobicContact CG2-CZ3 3.42Å; T322-W326 VanDerWaalsContact CG2-CZ3 3.42Å; T322-W326 VanDerWaalsContact O-CB 3.29Å; T322-W326 WeakPolarHBondContact O-CB 3.39Å; T322-W326 VanDerWaalsContact O-CG 3.28Å; T322-W326 PolarHBondContact O-N 3.41Å
323	E	66.4	Low	62.9	Low	68 Å²	68	62.4 Å²	62.4	32%	0.318	33%	0.33	S	S	.	.	H	α-helix	trans	-57.9	-39.1	173.2	-74.4	-177.5	-174.9	0	0	112.6	E319 W326 N327 T328 R329	E319-E323 WeakPolarHBondContact O-CG 3.41Å; E319-E323 PolarHBondContact O-N 3.28Å; E323-W326 CarbonylContact O-C 3.59Å; E323-W326 PolarHBondContact O-N 3.17Å; E323-N327 PolarHBondContact O-N 3.12Å; E323-N327 VanDerWaalsContact O-N 3.11Å; E323-T328 PolarHBondContact O-N 2.93Å; E323-T328 PolarHBondContact O-OG1 3.3Å; E323-R329 IonicContact OE2-CZ 3.37Å; E323-R329 VanDerWaalsContact OE2-CZ 3.29Å; E323-R329 IonicContact OE2-NE 3.39Å; E323-R329 PolarHBondContact OE2-NE 3.34Å; E323-R329 IonicContact OE2-NH2 2.75Å; E323-R329 PolarHBondContact OE2-NH2 3.05Å
324	M	64.1	Low	64.1	Low	3 Å²	3	57.3 Å²	57.3	2%	0.015	31%	0.306	C	S	.	.	H	α-helix	trans	-72.2	-38.2	177.2	-73.9	177.7	53.3	0	0	112.6	R297 A300 Y301 D320 L321 T322 W326 N327 L920	R297-M324 HydrophobicContact CB-CE 3.61Å; R297-M324 HydrophobicContact CB-SD 4.26Å; R297-M324 HydrophobicContact CG-CE 4.02Å; R297-M324 HydrophobicContact CG-SD 4.01Å; R297-M324 WeakPolarHBondContact O-CE 3.29Å; A300-M324 HydrophobicContact CB-CB 4.41Å; Y301-M324 HydrophobicContact CD1-CE 4.07Å; Y301-M324 HydrophobicContact CD2-CE 3.36Å; Y301-M324 HydrophobicContact CE1-CE 3.77Å; Y301-M324 HydrophobicContact CE1-CG 4.22Å; Y301-M324 HydrophobicContact CE2-CE 3.02Å; Y301-M324 HydrophobicContact CE2-SD 4.26Å; Y301-M324 HydrophobicContact CG-CE 3.87Å; D320-M324 WeakPolarHBondContact O-CB 3.39Å; D320-M324 WeakPolarHBondContact O-CG 3.5Å; D320-M324 PolarHBondContact O-N 3.33Å; D320-M324 VanDerWaalsContact O-N 3.11Å; L321-M324 PolarHBondContact O-N 3.49Å; T322-M324 VanDerWaalsContact C-N 3.27Å; T322-M324 PolarHBondContact O-N 2.93Å; M324-W326 VanDerWaalsContact C-N 3.28Å; M324-N327 PolarHBondContact O-N 3.21Å; M324-L920 HydrophobicContact SD-CD2 4.12Å
325	L	68.5	Low	65.7	Low	12 Å²	12	50 Å²	50	6%	0.063	27%	0.273	C	S	.	.	H	α-helix	trans	-64.6	-36.5	173.2	-175.5	66.6	0	0	0	111.2	L303 F310 L321 T322 N327	L303-L325 HydrophobicContact CB-CD1 3.97Å; F310-L325 HydrophobicContact CD2-CD2 4.4Å; L321-L325 WeakPolarHBondContact O-CB 3.35Å; L321-L325 PolarHBondContact O-N 2.91Å; T322-L325 PolarHBondContact O-N 3.36Å; L325-N327 VanDerWaalsContact C-N 3.33Å
326	W	68.1	Low	67.4	Low	27 Å²	27	46.8 Å²	46.8	10%	0.102	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	1.9	179.9	-68.7	-11.5	0	0	0	114.4	T322 E323 M324 T328 V461 K462 E464	T322-W326 HydrophobicContact CG2-CD2 3.64Å; T322-W326 VanDerWaalsContact CG2-CE2 3.44Å; T322-W326 HydrophobicContact CG2-CE3 3.65Å; T322-W326 HydrophobicContact CG2-CG 4.46Å; T322-W326 HydrophobicContact CG2-CH2 3.27Å; T322-W326 HydrophobicContact CG2-CZ2 3.32Å; T322-W326 HydrophobicContact CG2-CZ3 3.42Å; T322-W326 VanDerWaalsContact CG2-CZ3 3.42Å; T322-W326 VanDerWaalsContact O-CB 3.29Å; T322-W326 WeakPolarHBondContact O-CB 3.39Å; T322-W326 VanDerWaalsContact O-CG 3.28Å; T322-W326 PolarHBondContact O-N 3.41Å; E323-W326 CarbonylContact O-C 3.59Å; E323-W326 PolarHBondContact O-N 3.17Å; M324-W326 VanDerWaalsContact C-N 3.28Å; W326-T328 HydrophobicContact CB-CG2 4.3Å; W326-T328 PolarHBondContact O-N 3.06Å; W326-V461 WeakPolarHBondContact O-CA 3.21Å; W326-K462 HydrophobicContact CB-CB 3.99Å; W326-K462 WeakPolarHBondContact CB-O 3.22Å; W326-K462 HydrophobicContact CD2-CB 4.3Å; W326-K462 HydrophobicContact CG-CB 3.73Å; W326-K462 PolarHBondContact O-N 3.47Å; W326-K462 VanDerWaalsContact O-N 3.11Å; W326-E464 HydrophobicContact CE3-CG 4.2Å; W326-E464 HydrophobicContact CH2-CG 3.35Å; W326-E464 WeakPolarHBondContact CH2-OE1 3.46Å; W326-E464 HydrophobicContact CZ3-CB 4.49Å; W326-E464 HydrophobicContact CZ3-CG 3.13Å; W326-E464 VanDerWaalsContact CZ3-OE1 3.29Å; W326-E464 WeakPolarHBondContact CZ3-OE1 3.26Å
327	N	72.4	Confident	68.5	Low	17 Å²	17	44.8 Å²	44.8	9%	0.091	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	23.5	178.1	-70	-38	0	0	0	115.7	G304 E323 M324 L325 R329 L330 G460	G304-N327 PolarHBondContact O-ND2 2.73Å; E323-N327 PolarHBondContact O-N 3.12Å; E323-N327 VanDerWaalsContact O-N 3.11Å; M324-N327 PolarHBondContact O-N 3.21Å; L325-N327 VanDerWaalsContact C-N 3.33Å; N327-R329 VanDerWaalsContact C-N 3.26Å; N327-R329 PolarHBondContact O-N 2.96Å; N327-L330 HydrophobicContact CB-CB 4.33Å; N327-L330 WeakPolarHBondContact O-CB 3.38Å; N327-L330 PolarHBondContact O-N 3.36Å; N327-L330 VanDerWaalsContact O-N 3.09Å; N327-G460 WeakPolarHBondContact CB-O 3.29Å; N327-G460 PolarHBondContact ND2-O 2.86Å; N327-G460 VanDerWaalsContact ND2-O 3.09Å
328	T	69.3	Low	69.7	Low	44 Å²	44	40 Å²	40	27%	0.27	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-34.3	-176.5	55.3	0	0	0	0	112.7	E323 W326 L330 S331 V461	E323-T328 PolarHBondContact O-N 2.93Å; E323-T328 PolarHBondContact O-OG1 3.3Å; W326-T328 HydrophobicContact CB-CG2 4.3Å; W326-T328 PolarHBondContact O-N 3.06Å; T328-L330 VanDerWaalsContact C-N 3.27Å; T328-L330 PolarHBondContact O-N 3.43Å; T328-S331 PolarHBondContact O-OG 3.32Å; T328-V461 HydrophobicContact CG2-CG1 4Å
329	R	67.8	Low	70.4	Confident	57 Å²	57	44.1 Å²	44.1	22%	0.215	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-4.9	178.8	-58.1	-172.8	-176.1	-178.4	2.3	114.5	D320 E323 N327 S331 E332 H333	D320-R329 IonicContact OD1-CZ 3.12Å; D320-R329 IonicContact OD1-NH1 3.99Å; D320-R329 IonicContact OD1-NH2 3.81Å; D320-R329 PolarHBondContact OD1-NH2 3.34Å; E323-R329 IonicContact OE2-CZ 3.37Å; E323-R329 VanDerWaalsContact OE2-CZ 3.29Å; E323-R329 IonicContact OE2-NE 3.39Å; E323-R329 PolarHBondContact OE2-NE 3.34Å; E323-R329 IonicContact OE2-NH2 2.75Å; E323-R329 PolarHBondContact OE2-NH2 3.05Å; N327-R329 VanDerWaalsContact C-N 3.26Å; N327-R329 PolarHBondContact O-N 2.96Å; R329-S331 VanDerWaalsContact C-N 3.28Å; R329-S331 PolarHBondContact O-N 3.44Å; R329-E332 PolarHBondContact O-N 3.41Å; R329-H333 PolarHBondContact O-CD2 3.25Å; R329-H333 VanDerWaalsContact O-CG 3.22Å; R329-H333 PolarHBondContact O-N 3.02Å; R329-H333 VanDerWaalsContact O-N 3.07Å
330	L	72.4	Confident	70.8	Confident	18 Å²	18	42 Å²	42	9%	0.094	20%	0.201	C	C	.	.	H	α-helix	trans	-60.1	-38.5	-178.8	-177.7	65	0	0	0	112	N327 T328 H333 F334 W426 P910 F981	N327-L330 HydrophobicContact CB-CB 4.33Å; N327-L330 WeakPolarHBondContact O-CB 3.38Å; N327-L330 PolarHBondContact O-N 3.36Å; N327-L330 VanDerWaalsContact O-N 3.09Å; T328-L330 VanDerWaalsContact C-N 3.27Å; T328-L330 PolarHBondContact O-N 3.43Å; L330-H333 PolarHBondContact O-N 3.24Å; L330-F334 VanDerWaalsContact O-CB 3.31Å; L330-F334 WeakPolarHBondContact O-CB 3.12Å; L330-F334 PolarHBondContact O-N 3.43Å; L330-W426 HydrophobicContact CD2-CD2 3.48Å; L330-W426 VanDerWaalsContact CD2-CD2 3.48Å; L330-W426 HydrophobicContact CD2-CE3 3.72Å; L330-W426 HydrophobicContact CD2-CG 3.92Å; L330-W426 HydrophobicContact CD2-CH2 4.25Å; L330-W426 HydrophobicContact CD2-CZ2 4.01Å; L330-W426 HydrophobicContact CD2-CZ3 4.1Å; L330-W426 HydrophobicContact CG-CD2 4.05Å; L330-W426 HydrophobicContact CG-CE3 3.83Å; L330-W426 HydrophobicContact CG-CZ3 4.21Å; L330-P910 HydrophobicContact CD1-CG 4.16Å; L330-F981 HydrophobicContact CD1-CE2 3.79Å; L330-F981 HydrophobicContact CD1-CZ 3.84Å
331	S	70.1	Confident	71.2	Confident	23 Å²	23	41.9 Å²	41.9	16%	0.161	20%	0.201	C	C	.	.	H	α-helix	trans	-63.8	-44.7	178.4	59.8	0	0	0	0	111.7	T328 R329 H333 F334 L335	T328-S331 PolarHBondContact O-OG 3.32Å; R329-S331 VanDerWaalsContact C-N 3.28Å; R329-S331 PolarHBondContact O-N 3.44Å; S331-H333 PolarHBondContact O-N 2.93Å; S331-F334 PolarHBondContact O-N 3.25Å; S331-L335 WeakPolarHBondContact O-CB 3.44Å; S331-L335 VanDerWaalsContact O-CG 3.28Å; S331-L335 WeakPolarHBondContact O-CG 3.39Å; S331-L335 PolarHBondContact O-N 3.28Å
332	E	74.7	Confident	71.7	Confident	128 Å²	128	48.5 Å²	48.5	60%	0.598	24%	0.236	S	C	*	.	H	α-helix	trans	-63.1	-43.6	177.1	-61.6	-167.6	154.8	0	0	111.8	R329 L335 S336	R329-E332 PolarHBondContact O-N 3.41Å; E332-L335 PolarHBondContact O-N 3.34Å; E332-S336 PolarHBondContact O-N 2.98Å
333	H	73.2	Confident	72	Confident	22 Å²	22	49 Å²	49	10%	0.102	24%	0.237	C	C	.	.	H	α-helix	trans	-67.2	-38	178.1	-61.4	-30.7	0	0	0	112.3	R329 L330 S331 S336 L337 F916 F981	R329-H333 PolarHBondContact O-CD2 3.25Å; R329-H333 VanDerWaalsContact O-CG 3.22Å; R329-H333 PolarHBondContact O-N 3.02Å; R329-H333 VanDerWaalsContact O-N 3.07Å; L330-H333 PolarHBondContact O-N 3.24Å; S331-H333 PolarHBondContact O-N 2.93Å; H333-S336 PolarHBondContact O-N 3.49Å; H333-S336 PolarHBondContact O-OG 3.44Å; H333-L337 PolarHBondContact O-N 3.34Å; H333-F916 AromaticContact CD2-CZ 3.91Å; H333-F916 AromaticContact CE1-CE1 3.78Å; H333-F916 AromaticContact CE1-CZ 3.37Å; H333-F916 WeakPolarHBondContact CE1-CZ 3.37Å; H333-F916 AromaticContact CG-CZ 3.85Å; H333-F916 AromaticContact ND1-CE1 3.97Å; H333-F916 AromaticContact ND1-CZ 3.51Å; H333-F916 AromaticContact NE2-CZ 3.6Å; H333-F981 HydrophobicContact CB-CE1 3.59Å; H333-F981 HydrophobicContact CB-CZ 3.63Å; H333-F981 AromaticContact CD2-CE1 3.63Å; H333-F981 AromaticContact CD2-CZ 3.55Å; H333-F981 AromaticContact CG-CE1 3.75Å; H333-F981 AromaticContact CG-CZ 3.9Å
334	F	72.5	Confident	72	Confident	1 Å²	1	48.7 Å²	48.7	0%	0.004	24%	0.237	C	C	.	.	H	α-helix	trans	-68.7	-40.3	175.6	-175.1	-102.2	0	0	0	111.8	L330 S331 L337 G338 G388 F389 W426 T858 L859 P910	L330-F334 VanDerWaalsContact O-CB 3.31Å; L330-F334 WeakPolarHBondContact O-CB 3.12Å; L330-F334 PolarHBondContact O-N 3.43Å; S331-F334 PolarHBondContact O-N 3.25Å; F334-L337 PolarHBondContact O-N 3.34Å; F334-G338 PolarHBondContact O-N 3.12Å; F334-G388 WeakPolarHBondContact CD1-O 3.42Å; F334-G388 WeakPolarHBondContact CE1-O 3.16Å; F334-F389 HydrophobicContact CE1-CD1 4.45Å; F334-F389 HydrophobicContact CE1-CD2 4.37Å; F334-F389 HydrophobicContact CE1-CE1 4.29Å; F334-F389 HydrophobicContact CE1-CE2 4.21Å; F334-F389 HydrophobicContact CE1-CG 4.49Å; F334-F389 HydrophobicContact CE1-CZ 4.17Å; F334-F389 HydrophobicContact CZ-CE2 4.07Å; F334-F389 HydrophobicContact CZ-CZ 4.01Å; F334-W426 HydrophobicContact CB-CZ3 4.38Å; F334-W426 HydrophobicContact CD2-CZ3 4.13Å; F334-W426 HydrophobicContact CG-CZ3 4.13Å; F334-T858 WeakPolarHBondContact CE2-OG1 3.21Å; F334-T858 WeakPolarHBondContact CZ-OG1 3.35Å; F334-L859 HydrophobicContact CE2-CD2 3.77Å; F334-L859 HydrophobicContact CE2-CG 4.42Å; F334-L859 HydrophobicContact CZ-CD2 4.14Å; F334-L859 HydrophobicContact CZ-CG 4.43Å; F334-P910 HydrophobicContact CD2-CB 4.1Å; F334-P910 HydrophobicContact CE2-CB 4.31Å
335	L	76.8	Confident	72.2	Confident	46 Å²	46	54.8 Å²	54.8	24%	0.241	27%	0.269	C	S	.	.	H	α-helix	trans	-66.2	-36.5	174	-73.4	172	0	0	0	112	S331 E332 G338 R339 M344	S331-L335 WeakPolarHBondContact O-CB 3.44Å; S331-L335 VanDerWaalsContact O-CG 3.28Å; S331-L335 WeakPolarHBondContact O-CG 3.39Å; S331-L335 PolarHBondContact O-N 3.28Å; E332-L335 PolarHBondContact O-N 3.34Å; L335-G338 PolarHBondContact O-N 3.04Å; L335-R339 WeakPolarHBondContact O-CG 3.24Å; L335-R339 PolarHBondContact O-N 3.34Å; L335-M344 HydrophobicContact CD2-CE 4.2Å
336	S	74.1	Confident	72.3	Confident	34 Å²	34	56.7 Å²	56.7	24%	0.238	28%	0.282	C	S	.	.	H	α-helix	trans	-64.5	-43	174.6	97.1	0	0	0	0	110.9	E332 H333 G338 R339 E340 M914	E332-S336 PolarHBondContact O-N 2.98Å; H333-S336 PolarHBondContact O-N 3.49Å; H333-S336 PolarHBondContact O-OG 3.44Å; S336-G338 VanDerWaalsContact C-N 3.32Å; S336-G338 PolarHBondContact O-N 3.43Å; S336-R339 WeakPolarHBondContact O-CB 3.21Å; S336-R339 PolarHBondContact O-N 2.91Å; S336-R339 VanDerWaalsContact O-N 3.12Å; S336-E340 WeakPolarHBondContact O-CG 3.45Å; S336-E340 PolarHBondContact O-N 2.9Å; S336-M914 WeakPolarHBondContact OG-CE 3.49Å
337	L	72.3	Confident	72.3	Confident	1 Å²	1	59.3 Å²	59.3	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-60.7	-41.1	172.9	179.1	131.3	0	0	0	112	H333 F334 R339 E340 L341 T858 L912 P954 L956	H333-L337 PolarHBondContact O-N 3.34Å; F334-L337 PolarHBondContact O-N 3.34Å; L337-R339 VanDerWaalsContact C-N 3.28Å; L337-R339 PolarHBondContact O-N 3.46Å; L337-E340 PolarHBondContact O-N 3.3Å; L337-L341 HydrophobicContact CD1-CD1 4.42Å; L337-L341 HydrophobicContact CD2-CD1 3.66Å; L337-L341 HydrophobicContact CG-CD1 3.77Å; L337-L341 HydrophobicContact CG-CG 4.39Å; L337-L341 WeakPolarHBondContact O-CB 3.48Å; L337-L341 WeakPolarHBondContact O-CG 3.47Å; L337-L341 PolarHBondContact O-N 2.77Å; L337-T858 HydrophobicContact CD2-CG2 4.01Å; L337-L912 HydrophobicContact CD1-CB 3.71Å; L337-P954 HydrophobicContact CD1-CB 3.89Å; L337-L956 HydrophobicContact CD1-CD2 4.35Å; L337-L956 HydrophobicContact CD2-CD2 4.36Å
338	G	74.8	Confident	72.2	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-61.4	-34.9	174.8	0	0	0	0	0	113.6	F334 L335 S336 D342 I343 M344	F334-G338 PolarHBondContact O-N 3.12Å; L335-G338 PolarHBondContact O-N 3.04Å; S336-G338 VanDerWaalsContact C-N 3.32Å; S336-G338 PolarHBondContact O-N 3.43Å; G338-D342 PolarHBondContact O-N 3.46Å; G338-I343 PolarHBondContact O-N 3.06Å; G338-M344 VanDerWaalsContact C-SD 3.59Å
339	R	76.6	Confident	72.1	Confident	168 Å²	168	59.1 Å²	59.1	63%	0.634	29%	0.292	S	S	*	.	H	α-helix	trans	-72.5	-44.6	174.7	-69.7	175.1	-168.7	-175.6	5.9	112	L335 S336 L337 L341 D342 M344	L335-R339 WeakPolarHBondContact O-CG 3.24Å; L335-R339 PolarHBondContact O-N 3.34Å; S336-R339 WeakPolarHBondContact O-CB 3.21Å; S336-R339 PolarHBondContact O-N 2.91Å; S336-R339 VanDerWaalsContact O-N 3.12Å; L337-R339 VanDerWaalsContact C-N 3.28Å; L337-R339 PolarHBondContact O-N 3.46Å; R339-L341 VanDerWaalsContact C-N 3.33Å; R339-L341 PolarHBondContact O-N 3.04Å; R339-D342 PolarHBondContact O-N 3.1Å; R339-M344 HydrophobicContact CG-CG 4.24Å; R339-M344 HydrophobicContact CG-SD 4.18Å
340	E	74	Confident	72	Confident	118 Å²	118	62.7 Å²	62.7	55%	0.551	31%	0.311	S	S	*	.	H	α-helix	trans	-67.7	-32.9	-180	-68.3	-63.6	160.5	0	0	112.6	S336 L337 D342 P954	S336-E340 WeakPolarHBondContact O-CG 3.45Å; S336-E340 PolarHBondContact O-N 2.9Å; L337-E340 PolarHBondContact O-N 3.3Å; E340-D342 VanDerWaalsContact C-N 3.3Å; E340-P954 HydrophobicContact CB-CG 3.78Å; E340-P954 HydrophobicContact CG-CG 3.96Å
341	L	73.1	Confident	72	Confident	61 Å²	61	66.3 Å²	66.3	32%	0.319	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	3.4	177.6	-65.6	175.2	0	0	0	113.4	L337 R339 I343 T858 L956	L337-L341 HydrophobicContact CD1-CD1 4.42Å; L337-L341 HydrophobicContact CD2-CD1 3.66Å; L337-L341 HydrophobicContact CG-CD1 3.77Å; L337-L341 HydrophobicContact CG-CG 4.39Å; L337-L341 WeakPolarHBondContact O-CB 3.48Å; L337-L341 WeakPolarHBondContact O-CG 3.47Å; L337-L341 PolarHBondContact O-N 2.77Å; R339-L341 VanDerWaalsContact C-N 3.33Å; R339-L341 PolarHBondContact O-N 3.04Å; L341-I343 HydrophobicContact CB-CD1 3.64Å; L341-I343 HydrophobicContact CB-CG1 3.5Å; L341-I343 VanDerWaalsContact CB-CG1 3.5Å; L341-I343 HydrophobicContact CD1-CD1 3.98Å; L341-I343 HydrophobicContact CG-CD1 4.45Å; L341-I343 WeakPolarHBondContact O-CG1 3.12Å; L341-I343 PolarHBondContact O-N 3.27Å; L341-I343 VanDerWaalsContact O-N 3.13Å; L341-T858 HydrophobicContact CD1-CG2 4.37Å; L341-L956 HydrophobicContact CD1-CD1 3.94Å; L341-L956 HydrophobicContact CD1-CD2 4.24Å; L341-L956 HydrophobicContact CD1-CG 4.03Å
342	D	76	Confident	72	Confident	146 Å²	146	66.1 Å²	66.1	78%	0.781	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	29.8	-175.8	-71.3	-36.5	0	0	0	113.9	G338 R339 E340	G338-D342 PolarHBondContact O-N 3.46Å; R339-D342 PolarHBondContact O-N 3.1Å; E340-D342 VanDerWaalsContact C-N 3.3Å
343	I	73.8	Confident	71.7	Confident	35 Å²	35	61 Å²	61	18%	0.179	30%	0.303	C	S	.	.			trans	-100	19.7	-175.6	-31.3	179.5	0	0	0	112.5	G338 L341 D345 F389 K856 T858	G338-I343 PolarHBondContact O-N 3.06Å; L341-I343 HydrophobicContact CB-CD1 3.64Å; L341-I343 HydrophobicContact CB-CG1 3.5Å; L341-I343 VanDerWaalsContact CB-CG1 3.5Å; L341-I343 HydrophobicContact CD1-CD1 3.98Å; L341-I343 HydrophobicContact CG-CD1 4.45Å; L341-I343 WeakPolarHBondContact O-CG1 3.12Å; L341-I343 PolarHBondContact O-N 3.27Å; L341-I343 VanDerWaalsContact O-N 3.13Å; I343-D345 VanDerWaalsContact C-N 3.31Å; I343-D345 PolarHBondContact O-N 3.45Å; I343-F389 HydrophobicContact CB-CE1 4.5Å; I343-K856 HydrophobicContact CB-CD 4.37Å; I343-K856 HydrophobicContact CG2-CB 3.78Å; I343-K856 HydrophobicContact CG2-CD 3.23Å; I343-K856 HydrophobicContact CG2-CG 4.11Å; I343-K856 PolarHBondContact O-NZ 3.24Å; I343-T858 HydrophobicContact CD1-CG2 4.13Å
344	M	66.6	Low	71.4	Confident	62 Å²	62	65 Å²	65	31%	0.305	32%	0.32	S	S	.	.			trans	-68.6	-27.4	-177.8	-66.4	-57.3	-62.4	0	0	113.4	L335 G338 R339 F389	L335-M344 HydrophobicContact CD2-CE 4.2Å; G338-M344 VanDerWaalsContact C-SD 3.59Å; R339-M344 HydrophobicContact CG-CG 4.24Å; R339-M344 HydrophobicContact CG-SD 4.18Å; M344-F389 HydrophobicContact SD-CD1 4.23Å
345	D	68.5	Low	70.6	Confident	130 Å²	130	67.6 Å²	67.6	70%	0.695	34%	0.338	S	S	*	.	S	Bend	trans	-68	124.1	-175.4	-72.9	-29.5	0	0	0	111.7	I343 K347 K856	I343-D345 VanDerWaalsContact C-N 3.31Å; I343-D345 PolarHBondContact O-N 3.45Å; D345-K347 PolarHBondContact O-N 3.39Å; D345-K856 PolarHBondContact O-NZ 3.34Å
346	P	70.3	Confident	69.6	Low	53 Å²	53	74.1 Å²	74.1	34%	0.344	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-67.2	124.9	-178.1	27.3	-33.4	0	0	0	109.7
347	K	70.1	Confident	68.7	Low	81 Å²	81	78.2 Å²	78.2	35%	0.352	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-82.5	136.5	173.6	-66.5	179.7	-177.4	172.3	0	108.4	D345 V385 N386 K856	D345-K347 PolarHBondContact O-N 3.39Å; K347-V385 HydrophobicContact CB-CG1 4.02Å; K347-N386 PolarHBondContact N-OD1 3.42Å; K347-N386 PolarHBondContact O-ND2 3.28Å; K347-K856 HydrophobicContact CD-CD 4.35Å; K347-K856 HydrophobicContact CD-CG 4.33Å
348	L	69.2	Low	67.9	Low	51 Å²	51	80.2 Å²	80.2	27%	0.267	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-79.8	148.2	172.3	-70.8	165.4	0	0	0	109.2	E350 D351 K393 L394	L348-E350 PolarHBondContact O-N 3.22Å; L348-E350 VanDerWaalsContact O-N 3.1Å; L348-D351 PolarHBondContact N-OD2 2.89Å; L348-D351 WeakPolarHBondContact O-CB 3.27Å; L348-D351 PolarHBondContact O-N 3.12Å; L348-K393 HydrophobicContact CD2-CB 4.36Å; L348-K393 HydrophobicContact CD2-CD 4.45Å; L348-L394 HydrophobicContact CD2-CD2 4.29Å
349	P	67.3	Low	66.5	Low	7 Å²	7	84.7 Å²	84.7	5%	0.045	43%	0.432	C	S	.	.	H	α-helix	trans	-53.4	-30.6	172.6	-28.8	36.3	0	0	0	113.3	D351 I352 Y353 V381 N382 L394	P349-D351 VanDerWaalsContact C-N 3.31Å; P349-D351 PolarHBondContact O-N 3.13Å; P349-I352 PolarHBondContact O-N 3.37Å; P349-Y353 HydrophobicContact CB-CE2 4.2Å; P349-Y353 WeakPolarHBondContact O-CD2 3.49Å; P349-Y353 VanDerWaalsContact O-CG 3.3Å; P349-Y353 PolarHBondContact O-N 3.12Å; P349-Y353 VanDerWaalsContact O-N 3.08Å; P349-V381 HydrophobicContact CB-CB 4.41Å; P349-V381 HydrophobicContact CB-CG1 3.94Å; P349-V381 HydrophobicContact CG-CG1 4.42Å; P349-N382 HydrophobicContact CG-CB 3.66Å; P349-L394 HydrophobicContact CG-CD1 4.14Å
350	E	66.4	Low	65.3	Low	131 Å²	131	81.7 Å²	81.7	61%	0.612	43%	0.432	S	S	*	.	H	α-helix	trans	-65.4	-32	177.4	-60.9	-171.6	168.8	0	0	113.2	L348 I352 Y353 K354	L348-E350 PolarHBondContact O-N 3.22Å; L348-E350 VanDerWaalsContact O-N 3.1Å; E350-I352 VanDerWaalsContact C-N 3.26Å; E350-I352 PolarHBondContact O-N 3.07Å; E350-Y353 PolarHBondContact O-N 3.45Å; E350-K354 PolarHBondContact O-N 2.96Å
351	D	72	Confident	64	Low	95 Å²	95	85.2 Å²	85.2	51%	0.508	44%	0.44	S	S	.	.	H	α-helix	trans	-67.7	-31.5	177.6	-60.4	-37.1	0	0	0	111.3	L348 P349 K354	L348-D351 PolarHBondContact N-OD2 2.89Å; L348-D351 WeakPolarHBondContact O-CB 3.27Å; L348-D351 PolarHBondContact O-N 3.12Å; P349-D351 VanDerWaalsContact C-N 3.31Å; P349-D351 PolarHBondContact O-N 3.13Å; D351-K354 VanDerWaalsContact O-CG 3.29Å; D351-K354 WeakPolarHBondContact O-CG 3.41Å
352	I	70.6	Confident	62.7	Low	18 Å²	18	88.8 Å²	88.8	9%	0.092	47%	0.467	C	S	.	.	H	α-helix	trans	-78.3	-44.3	178	-70.4	165.4	0	0	0	110.9	P349 E350 K354 V381 V385 Q849 H853	P349-I352 PolarHBondContact O-N 3.37Å; E350-I352 VanDerWaalsContact C-N 3.26Å; E350-I352 PolarHBondContact O-N 3.07Å; I352-K354 PolarHBondContact O-N 3.42Å; I352-K354 VanDerWaalsContact O-N 3.15Å; I352-V381 HydrophobicContact CD1-CG1 4.3Å; I352-V385 HydrophobicContact CD1-CB 3.93Å; I352-V385 HydrophobicContact CD1-CG1 3.6Å; I352-V385 HydrophobicContact CD1-CG2 3.09Å; I352-Q849 HydrophobicContact CG2-CB 4.34Å; I352-H853 HydrophobicContact CD1-CB 4.19Å; I352-H853 VanDerWaalsContact CG2-CD2 3.44Å; I352-H853 WeakPolarHBondContact CG2-CD2 3.48Å
353	Y	66.9	Low	61.4	Low	21 Å²	21	87.2 Å²	87.2	8%	0.082	46%	0.463	C	S	.	.	H	α-helix	trans	-59.1	-26.9	173.8	-59.9	-26.5	0	0	0	110.9	P349 E350 S355 V381 R846	P349-Y353 HydrophobicContact CB-CE2 4.2Å; P349-Y353 WeakPolarHBondContact O-CD2 3.49Å; P349-Y353 VanDerWaalsContact O-CG 3.3Å; P349-Y353 PolarHBondContact O-N 3.12Å; P349-Y353 VanDerWaalsContact O-N 3.08Å; E350-Y353 PolarHBondContact O-N 3.45Å; Y353-S355 PolarHBondContact O-N 2.86Å; Y353-V381 HydrophobicContact CE1-CG1 4.48Å; Y353-V381 HydrophobicContact CE1-CG2 4.32Å; Y353-R846 HydrophobicContact CE1-CB 4.08Å; Y353-R846 HydrophobicContact CE1-CG 3.76Å
354	K	67.2	Low	60	Low	107 Å²	107	89.7 Å²	89.7	47%	0.465	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.8	53.8	-170	-65.7	-173.8	178.3	-179.2	0	108.3	E350 D351 I352 H356 L357	E350-K354 PolarHBondContact O-N 2.96Å; D351-K354 VanDerWaalsContact O-CG 3.29Å; D351-K354 WeakPolarHBondContact O-CG 3.41Å; I352-K354 PolarHBondContact O-N 3.42Å; I352-K354 VanDerWaalsContact O-N 3.15Å; K354-H356 PolarHBondContact O-N 3.45Å; K354-L357 HydrophobicContact CB-CB 4.4Å; K354-L357 HydrophobicContact CB-CD1 3.92Å; K354-L357 HydrophobicContact CD-CD1 3.86Å; K354-L357 HydrophobicContact CG-CD1 4.45Å; K354-L357 WeakPolarHBondContact O-CB 3.48Å; K354-L357 PolarHBondContact O-N 3.06Å
355	S	56.9	Low	58.8	Low	54 Å²	54	92.6 Å²	92.6	38%	0.378	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.1	-25.8	-174.8	55	0	0	0	0	113.1	Y353 L357 E358	Y353-S355 PolarHBondContact O-N 2.86Å; S355-L357 VanDerWaalsContact C-N 3.34Å; S355-L357 PolarHBondContact O-N 2.75Å; S355-E358 PolarHBondContact O-N 3.5Å
356	H	54.8	Low	57.8	Low	184 Å²	184	90.3 Å²	90.3	85%	0.852	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-28.1	171.8	-61.6	-56.9	0	0	0	115.6	K354	K354-H356 PolarHBondContact O-N 3.45Å
357	L	54.9	Low	56.7	Low	119 Å²	119	92.3 Å²	92.3	62%	0.623	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-20.7	175.8	-85.7	127.9	0	0	0	112.5	K354 S355 A359	K354-L357 HydrophobicContact CB-CB 4.4Å; K354-L357 HydrophobicContact CB-CD1 3.92Å; K354-L357 HydrophobicContact CD-CD1 3.86Å; K354-L357 HydrophobicContact CG-CD1 4.45Å; K354-L357 WeakPolarHBondContact O-CB 3.48Å; K354-L357 PolarHBondContact O-N 3.06Å; S355-L357 VanDerWaalsContact C-N 3.34Å; S355-L357 PolarHBondContact O-N 2.75Å; L357-A359 VanDerWaalsContact C-N 3.26Å; L357-A359 PolarHBondContact O-N 2.92Å
358	E	56.3	Low	55.6	Low	44 Å²	44	94.1 Å²	94.1	21%	0.206	53%	0.531	C	S	.	.			trans	-79.6	77.1	170.4	-65.2	-173.2	166	0	0	108.9	S355 V360	S355-E358 PolarHBondContact O-N 3.5Å; E358-V360 PolarHBondContact O-N 3.49Å
359	A	45.6	Very low	54.8	Low	94 Å²	94	95 Å²	95	78%	0.777	54%	0.535	S	S	*	.			trans	-68.8	77	170.8	0	0	0	0	0	109.7	L357 R361	L357-A359 VanDerWaalsContact C-N 3.26Å; L357-A359 PolarHBondContact O-N 2.92Å; A359-R361 PolarHBondContact O-N 2.9Å
360	V	50.9	Low	54.2	Low	105 Å²	105	98.1 Å²	98.1	64%	0.636	55%	0.552	S	S	*	*			trans	-53	115.4	164.7	178.4	0	0	0	0	105.9	E358 P362	E358-V360 PolarHBondContact O-N 3.49Å; V360-P362 VanDerWaalsContact O-N 3.16Å
361	R	47.4	Very low	54.2	Low	191 Å²	191	95.2 Å²	95.2	72%	0.721	55%	0.546	S	S	*	.			trans	-48.6	127.7	173	-82.9	-178.5	171.8	176.6	-1.7	107.5	A359 T363 L364	A359-R361 PolarHBondContact O-N 2.9Å; R361-T363 PolarHBondContact O-N 3.3Å; R361-L364 PolarHBondContact O-N 2.96Å
362	P	46.2	Very low	54	Low	137 Å²	137	91.5 Å²	91.5	89%	0.89	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	7	-176	24.2	-32.8	0	0	0	114.1	V360	V360-P362 VanDerWaalsContact O-N 3.16Å
363	T	48.1	Very low	53.9	Low	113 Å²	113	94 Å²	94	69%	0.693	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	-3.8	-180	62	0	0	0	0	113.9	R361	R361-T363 PolarHBondContact O-N 3.3Å
364	L	44.2	Very low	54.1	Low	86 Å²	86	93.9 Å²	93.9	45%	0.45	54%	0.541	S	S	.	.	S	Bend	trans	-100.4	118.7	173.5	-87.6	97.2	0	0	0	110.8	R361 A366	R361-L364 PolarHBondContact O-N 2.96Å; L364-A366 PolarHBondContact O-N 3.07Å; L364-A366 VanDerWaalsContact O-N 3.1Å
365	N	40.5	Very low	54.5	Low	124 Å²	124	89.8 Å²	89.8	66%	0.663	52%	0.524	S	S	*	.			trans	-57.1	110.8	173.9	-79.1	-16.1	0	0	0	110.5	A367 T368	N365-A367 PolarHBondContact O-N 3.47Å; N365-T368 PolarHBondContact O-N 3.49Å; N365-T368 PolarHBondContact O-OG1 3.45Å; N365-T368 VanDerWaalsContact O-OG1 3.12Å
366	A	48.1	Very low	55.4	Low	81 Å²	81	88 Å²	88	67%	0.669	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-57.9	-15.4	173.3	0	0	0	0	0	113.6	L364	L364-A366 PolarHBondContact O-N 3.07Å; L364-A366 VanDerWaalsContact O-N 3.1Å
367	A	46.7	Very low	56.4	Low	96 Å²	96	79.2 Å²	79.2	79%	0.793	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-75.4	-15.8	179.9	0	0	0	0	0	114.9	N365	N365-A367 PolarHBondContact O-N 3.47Å
368	T	48.2	Very low	57.5	Low	118 Å²	118	74.1 Å²	74.1	72%	0.724	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-88.9	-8.7	177.4	55.7	0	0	0	0	113.4	N365 D370	N365-T368 PolarHBondContact O-N 3.49Å; N365-T368 PolarHBondContact O-OG1 3.45Å; N365-T368 VanDerWaalsContact O-OG1 3.12Å; T368-D370 PolarHBondContact O-N 3.44Å
369	L	50.9	Low	58.7	Low	69 Å²	69	72.1 Å²	72.1	36%	0.361	44%	0.435	S	S	.	.	S	Bend	trans	-76.7	115	169.7	-75.7	146.4	0	0	0	107.7	S371 L842	L369-S371 VanDerWaalsContact C-N 3.34Å; L369-S371 PolarHBondContact O-N 2.88Å; L369-L842 HydrophobicContact CD2-CD2 3.64Å
370	D	55.4	Low	60.4	Low	73 Å²	73	67.6 Å²	67.6	39%	0.39	40%	0.398	S	S	.	.			trans	-59.4	95.5	177.5	-170.1	5	0	0	0	109.9	T368 A372 R373 A374	T368-D370 PolarHBondContact O-N 3.44Å; D370-A372 PolarHBondContact O-N 2.77Å; D370-A372 VanDerWaalsContact O-N 3.08Å; D370-R373 PolarHBondContact O-N 3.24Å; D370-A374 PolarHBondContact O-N 3.36Å
371	S	66	Low	61.9	Low	70 Å²	70	62.6 Å²	62.6	49%	0.49	37%	0.368	S	S	.	.	H	α-helix	trans	-54.8	-32.3	-170.7	176.8	0	0	0	0	111.8	L369 R373 A374 N375	L369-S371 VanDerWaalsContact C-N 3.34Å; L369-S371 PolarHBondContact O-N 2.88Å; S371-R373 PolarHBondContact O-N 2.9Å; S371-A374 PolarHBondContact O-N 3.03Å; S371-N375 WeakPolarHBondContact O-CB 3.44Å; S371-N375 PolarHBondContact O-N 3.3Å; S371-N375 PolarHBondContact O-ND2 2.96Å; S371-N375 PolarHBondContact O-OD1 3.17Å; S371-N375 PolarHBondContact OG-ND2 2.88Å
372	A	68.6	Low	63.6	Low	17 Å²	17	53.6 Å²	53.6	14%	0.14	33%	0.334	C	S	.	.	H	α-helix	trans	-61.1	-47.4	-178.7	0	0	0	0	0	112.8	D370 N375 L376 Q408	D370-A372 PolarHBondContact O-N 2.77Å; D370-A372 VanDerWaalsContact O-N 3.08Å; A372-N375 PolarHBondContact O-N 3.46Å; A372-L376 WeakPolarHBondContact O-CB 3.47Å; A372-L376 PolarHBondContact O-N 3.26Å; A372-Q408 PolarHBondContact O-OE1 3.39Å
373	R	68.7	Low	65.2	Low	70 Å²	70	47.1 Å²	47.1	26%	0.264	29%	0.291	S	S	.	.	H	α-helix	trans	-73.1	-35.6	-179.7	-71.3	-169.1	174.5	138.5	-2.9	112.8	D370 S371 N375 L376 A377 Y840 M894	D370-R373 PolarHBondContact O-N 3.24Å; S371-R373 PolarHBondContact O-N 2.9Å; R373-N375 VanDerWaalsContact C-N 3.26Å; R373-N375 PolarHBondContact O-N 3.42Å; R373-L376 PolarHBondContact O-N 3.08Å; R373-A377 PolarHBondContact O-N 2.84Å; R373-Y840 VanDerWaalsContact CZ-CZ 3.42Å; R373-Y840 PolarHBondContact NH1-OH 3.47Å; R373-Y840 VanDerWaalsContact NH1-OH 3.09Å; R373-Y840 PolarHBondContact NH2-OH 2.85Å; R373-M894 PolarHBondContact NH2-O 2.85Å
374	A	71.7	Confident	66.8	Low	20 Å²	20	41.8 Å²	41.8	17%	0.165	26%	0.259	C	S	.	.	H	α-helix	trans	-59.7	-40.3	172.1	0	0	0	0	0	111.6	D370 S371 A378 R846	D370-A374 PolarHBondContact O-N 3.36Å; S371-A374 PolarHBondContact O-N 3.03Å; A374-A378 PolarHBondContact O-N 3.3Å; A374-R846 VanDerWaalsContact CA-NH1 3.33Å; A374-R846 VanDerWaalsContact CB-NH1 3.25Å; A374-R846 PolarHBondContact O-NH1 3.16Å
375	N	75.6	Confident	68.6	Low	21 Å²	21	37.8 Å²	37.8	11%	0.112	24%	0.238	C	C	.	.	H	α-helix	trans	-70.6	-39.1	177.4	-62.3	-18.2	0	0	0	111.6	S371 A372 R373 A378 S379 W404 Q408	S371-N375 WeakPolarHBondContact O-CB 3.44Å; S371-N375 PolarHBondContact O-N 3.3Å; S371-N375 PolarHBondContact O-ND2 2.96Å; S371-N375 PolarHBondContact O-OD1 3.17Å; S371-N375 PolarHBondContact OG-ND2 2.88Å; A372-N375 PolarHBondContact O-N 3.46Å; R373-N375 VanDerWaalsContact C-N 3.26Å; R373-N375 PolarHBondContact O-N 3.42Å; N375-A378 PolarHBondContact O-N 3.43Å; N375-S379 PolarHBondContact O-N 3.04Å; N375-W404 HydrophobicContact CB-CH2 3.69Å; N375-W404 HydrophobicContact CB-CZ2 3.5Å; N375-W404 HydrophobicContact CB-CZ3 4.49Å; N375-W404 VanDerWaalsContact CG-CH2 3.44Å; N375-W404 WeakPolarHBondContact OD1-CH2 3.36Å; N375-Q408 PolarHBondContact O-NE2 3.12Å
376	L	75	Confident	70.4	Confident	15 Å²	15	31.9 Å²	31.9	8%	0.079	21%	0.206	C	C	.	.	H	α-helix	trans	-66.7	-38.8	177.2	-172.5	156.5	0	0	0	111.9	A372 R373 A378 S379 Y380 G412 F843	A372-L376 WeakPolarHBondContact O-CB 3.47Å; A372-L376 PolarHBondContact O-N 3.26Å; R373-L376 PolarHBondContact O-N 3.08Å; L376-A378 VanDerWaalsContact C-N 3.3Å; L376-A378 PolarHBondContact O-N 3.24Å; L376-S379 PolarHBondContact O-N 2.71Å; L376-S379 PolarHBondContact O-OG 2.97Å; L376-Y380 HydrophobicContact CD2-CD2 3.64Å; L376-Y380 HydrophobicContact CD2-CE2 3.3Å; L376-Y380 HydrophobicContact CG-CE2 4.26Å; L376-Y380 WeakPolarHBondContact O-CD2 3.4Å; L376-Y380 PolarHBondContact O-N 3.16Å; L376-G412 VanDerWaalsContact CD1-CA 3.47Å; L376-F843 HydrophobicContact CD2-CD2 4.08Å; L376-F843 HydrophobicContact CD2-CE2 3.21Å; L376-F843 HydrophobicContact CD2-CZ 3.68Å
377	A	75.6	Confident	71.7	Confident	0 Å²	0	28 Å²	28	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-58.4	-43.8	168	0	0	0	0	0	111.7	R373 S379 Y380 V381 F843 R846	R373-A377 PolarHBondContact O-N 2.84Å; A377-S379 VanDerWaalsContact C-N 3.33Å; A377-S379 PolarHBondContact O-N 3.44Å; A377-Y380 PolarHBondContact O-N 3.14Å; A377-V381 VanDerWaalsContact O-CG2 3.29Å; A377-V381 WeakPolarHBondContact O-CG2 3.34Å; A377-V381 PolarHBondContact O-N 3.41Å; A377-F843 HydrophobicContact CB-CD2 3.6Å; A377-F843 HydrophobicContact CB-CE2 3.99Å; A377-R846 HydrophobicContact CB-CB 3.8Å; A377-R846 HydrophobicContact CB-CG 4.46Å
378	A	77.6	Confident	72.8	Confident	13 Å²	13	23.9 Å²	23.9	11%	0.107	14%	0.141	C	C	.	.	H	α-helix	trans	-66.7	-32.2	-178.6	0	0	0	0	0	113	A374 N375 L376 N382 W404	A374-A378 PolarHBondContact O-N 3.3Å; N375-A378 PolarHBondContact O-N 3.43Å; L376-A378 VanDerWaalsContact C-N 3.3Å; L376-A378 PolarHBondContact O-N 3.24Å; A378-N382 WeakPolarHBondContact O-CB 3.3Å; A378-N382 PolarHBondContact O-N 3Å; A378-W404 HydrophobicContact CB-CZ2 4.07Å
379	S	81.1	Confident	73.8	Confident	1 Å²	1	18.5 Å²	18.5	1%	0.007	11%	0.108	C	C	.	.	H	α-helix	trans	-68.7	-42.6	172.3	50.4	0	0	0	0	112.3	N375 L376 A377 N382 G383 T416	N375-S379 PolarHBondContact O-N 3.04Å; L376-S379 PolarHBondContact O-N 2.71Å; L376-S379 PolarHBondContact O-OG 2.97Å; A377-S379 VanDerWaalsContact C-N 3.33Å; A377-S379 PolarHBondContact O-N 3.44Å; S379-N382 PolarHBondContact O-N 2.97Å; S379-G383 PolarHBondContact O-N 3.11Å; S379-T416 PolarHBondContact OG-OG1 3.47Å
380	Y	82.5	Confident	74.3	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-61.8	-44.6	173.2	-76.7	-56	0	0	0	112.8	L376 A377 N382 G383 L384 S415 T419 W422 F843 D898 I901 F902	L376-Y380 HydrophobicContact CD2-CD2 3.64Å; L376-Y380 HydrophobicContact CD2-CE2 3.3Å; L376-Y380 HydrophobicContact CG-CE2 4.26Å; L376-Y380 WeakPolarHBondContact O-CD2 3.4Å; L376-Y380 PolarHBondContact O-N 3.16Å; A377-Y380 PolarHBondContact O-N 3.14Å; Y380-N382 VanDerWaalsContact C-N 3.27Å; Y380-N382 PolarHBondContact O-N 3.05Å; Y380-G383 PolarHBondContact O-N 3.47Å; Y380-L384 WeakPolarHBondContact O-CB 3.44Å; Y380-L384 VanDerWaalsContact O-CG 3.31Å; Y380-L384 WeakPolarHBondContact O-CG 3.36Å; Y380-L384 PolarHBondContact O-N 3.42Å; Y380-S415 WeakPolarHBondContact OH-CB 3.22Å; Y380-S415 PolarHBondContact OH-OG 3.4Å; Y380-T419 HydrophobicContact CD1-CG2 3.54Å; Y380-T419 HydrophobicContact CE1-CG2 4.04Å; Y380-T419 HydrophobicContact CG-CG2 4.37Å; Y380-W422 AromaticContact CD1-CH2 3.86Å; Y380-W422 HydrophobicContact CD1-CH2 3.86Å; Y380-W422 AromaticContact CD1-CZ3 3.63Å; Y380-W422 HydrophobicContact CD1-CZ3 3.63Å; Y380-W422 HydrophobicContact CE1-CH2 4.2Å; Y380-W422 HydrophobicContact CE1-CZ3 4.34Å; Y380-F843 AromaticContact CD2-CE2 3.89Å; Y380-F843 HydrophobicContact CD2-CE2 3.89Å; Y380-F843 AromaticContact CD2-CZ 3.85Å; Y380-F843 HydrophobicContact CD2-CZ 3.85Å; Y380-F843 HydrophobicContact CE2-CE2 4.2Å; Y380-F843 AromaticContact CE2-CZ 3.87Å; Y380-F843 HydrophobicContact CE2-CZ 3.87Å; Y380-D898 HydrophobicContact CE2-CB 4.38Å; Y380-D898 VanDerWaalsContact OH-CB 3.28Å; Y380-D898 WeakPolarHBondContact OH-CB 3.36Å; Y380-D898 PolarHBondContact OH-O 3.33Å; Y380-D898 VanDerWaalsContact OH-O 3.12Å; Y380-I901 HydrophobicContact CE1-CD1 4.45Å; Y380-I901 HydrophobicContact CE2-CD1 4.22Å; Y380-F902 HydrophobicContact CE1-CE2 4.18Å; Y380-F902 AromaticContact CE1-CZ 3.98Å; Y380-F902 HydrophobicContact CE1-CZ 3.98Å
381	V	82.1	Confident	74.8	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-59.8	-42.2	176.2	171.9	0	0	0	0	110.1	P349 I352 Y353 A377 L384 V385 R846	P349-V381 HydrophobicContact CB-CB 4.41Å; P349-V381 HydrophobicContact CB-CG1 3.94Å; P349-V381 HydrophobicContact CG-CG1 4.42Å; I352-V381 HydrophobicContact CD1-CG1 4.3Å; Y353-V381 HydrophobicContact CE1-CG1 4.48Å; Y353-V381 HydrophobicContact CE1-CG2 4.32Å; A377-V381 VanDerWaalsContact O-CG2 3.29Å; A377-V381 WeakPolarHBondContact O-CG2 3.34Å; A377-V381 PolarHBondContact O-N 3.41Å; V381-L384 PolarHBondContact O-N 3.32Å; V381-V385 HydrophobicContact CG1-CG2 3.97Å; V381-V385 VanDerWaalsContact O-CB 3.24Å; V381-V385 WeakPolarHBondContact O-CB 3.44Å; V381-V385 WeakPolarHBondContact O-CG2 3.47Å; V381-V385 PolarHBondContact O-N 3.31Å; V381-R846 HydrophobicContact CG2-CB 4.36Å; V381-R846 WeakPolarHBondContact CG2-O 3.27Å
382	N	83	Confident	74.9	Confident	2 Å²	2	16.1 Å²	16.1	1%	0.011	9%	0.088	C	C	.	.	H	α-helix	trans	-65.3	-42.3	178.8	-154.3	17.9	0	0	0	112.7	P349 A378 S379 Y380 N386 E392 L394	P349-N382 HydrophobicContact CG-CB 3.66Å; A378-N382 WeakPolarHBondContact O-CB 3.3Å; A378-N382 PolarHBondContact O-N 3Å; S379-N382 PolarHBondContact O-N 2.97Å; Y380-N382 VanDerWaalsContact C-N 3.27Å; Y380-N382 PolarHBondContact O-N 3.05Å; N382-N386 PolarHBondContact O-N 3.26Å; N382-N386 VanDerWaalsContact O-N 3.16Å; N382-N386 PolarHBondContact OD1-ND2 3.02Å; N382-E392 WeakPolarHBondContact ND2-CG 3.32Å; N382-E392 PolarHBondContact ND2-OE1 2.93Å; N382-L394 HydrophobicContact CB-CD1 4.09Å; N382-L394 WeakPolarHBondContact ND2-CB 3.48Å; N382-L394 WeakPolarHBondContact ND2-CD1 3.47Å; N382-L394 WeakPolarHBondContact ND2-CG 3.4Å
383	G	80.1	Confident	74.5	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-59.9	-48.2	175.4	0	0	0	0	0	112.4	S379 Y380 C387	S379-G383 PolarHBondContact O-N 3.11Å; Y380-G383 PolarHBondContact O-N 3.47Å; G383-C387 PolarHBondContact O-N 2.98Å; G383-C387 PolarHBondContact O-SG 3.21Å
384	L	82.1	Confident	74.2	Confident	1 Å²	1	21.4 Å²	21.4	1%	0.005	11%	0.112	C	C	.	.	H	α-helix	trans	-68.1	-37	-178.3	-68.6	170.8	0	0	0	113	Y380 V381 C387 W422 L851 L854 G855	Y380-L384 WeakPolarHBondContact O-CB 3.44Å; Y380-L384 VanDerWaalsContact O-CG 3.31Å; Y380-L384 WeakPolarHBondContact O-CG 3.36Å; Y380-L384 PolarHBondContact O-N 3.42Å; V381-L384 PolarHBondContact O-N 3.32Å; L384-C387 VanDerWaalsContact CA-SG 3.53Å; L384-C387 PolarHBondContact O-SG 3.46Å; L384-C387 VanDerWaalsContact O-SG 3.33Å; L384-W422 HydrophobicContact CD1-CZ3 4.21Å; L384-W422 HydrophobicContact CD2-CD2 4.21Å; L384-W422 HydrophobicContact CD2-CE3 3.68Å; L384-W422 HydrophobicContact CD2-CH2 3.8Å; L384-W422 HydrophobicContact CD2-CZ2 4.29Å; L384-W422 HydrophobicContact CD2-CZ3 3.44Å; L384-W422 VanDerWaalsContact CD2-CZ3 3.44Å; L384-W422 HydrophobicContact CG-CE3 3.85Å; L384-W422 HydrophobicContact CG-CH2 4.22Å; L384-W422 HydrophobicContact CG-CZ3 3.5Å; L384-W422 VanDerWaalsContact CG-CZ3 3.5Å; L384-L851 HydrophobicContact CD1-CD2 3.91Å; L384-L851 HydrophobicContact CD1-CG 4.15Å; L384-L851 HydrophobicContact CD2-CD2 4.21Å; L384-L854 HydrophobicContact CB-CD1 4.03Å; L384-L854 HydrophobicContact CD2-CD1 3.62Å; L384-L854 HydrophobicContact CG-CD1 4.4Å; L384-L854 WeakPolarHBondContact O-CA 3.33Å; L384-G855 PolarHBondContact O-N 3.24Å
385	V	81.8	Confident	73.7	Confident	2 Å²	2	20.8 Å²	20.8	1%	0.012	11%	0.106	C	C	.	.	H	α-helix	trans	-74.7	-39	-175.7	169.6	0	0	0	0	111.3	K347 I352 V381 H853 K856	K347-V385 HydrophobicContact CB-CG1 4.02Å; I352-V385 HydrophobicContact CD1-CB 3.93Å; I352-V385 HydrophobicContact CD1-CG1 3.6Å; I352-V385 HydrophobicContact CD1-CG2 3.09Å; V381-V385 HydrophobicContact CG1-CG2 3.97Å; V381-V385 VanDerWaalsContact O-CB 3.24Å; V381-V385 WeakPolarHBondContact O-CB 3.44Å; V381-V385 WeakPolarHBondContact O-CG2 3.47Å; V381-V385 PolarHBondContact O-N 3.31Å; V385-H853 HydrophobicContact CG2-CB 4.26Å; V385-K856 HydrophobicContact CG1-CG 4.36Å; V385-K856 WeakPolarHBondContact O-CG 3.27Å; V385-K856 PolarHBondContact O-N 2.75Å
386	N	78.3	Confident	72.9	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	18.5	-178.6	-65.1	-46.4	0	0	0	112.9	K347 N382 G388 F389 V423 K856	K347-N386 PolarHBondContact N-OD1 3.42Å; K347-N386 PolarHBondContact O-ND2 3.28Å; N382-N386 PolarHBondContact O-N 3.26Å; N382-N386 VanDerWaalsContact O-N 3.16Å; N382-N386 PolarHBondContact OD1-ND2 3.02Å; N386-G388 PolarHBondContact O-N 3.01Å; N386-F389 PolarHBondContact O-N 3.28Å; N386-V423 HydrophobicContact CB-CG2 4.37Å; N386-K856 VanDerWaalsContact OD1-CE 3.23Å; N386-K856 WeakPolarHBondContact OD1-CE 3.43Å
387	C	73.8	Confident	71.8	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.8	124.7	174.8	-78.6	0	0	0	0	112.2	G383 L384 F389 W422 L859	G383-C387 PolarHBondContact O-N 2.98Å; G383-C387 PolarHBondContact O-SG 3.21Å; L384-C387 VanDerWaalsContact CA-SG 3.53Å; L384-C387 PolarHBondContact O-SG 3.46Å; L384-C387 VanDerWaalsContact O-SG 3.33Å; C387-F389 VanDerWaalsContact C-N 3.28Å; C387-F389 VanDerWaalsContact O-CD2 3.24Å; C387-F389 WeakPolarHBondContact O-CD2 3.46Å; C387-F389 PolarHBondContact O-N 2.91Å; C387-W422 VanDerWaalsContact CA-O 3.29Å; C387-W422 WeakPolarHBondContact CA-O 3.12Å; C387-L859 HydrophobicContact CB-CD1 3.44Å; C387-L859 VanDerWaalsContact CB-CD1 3.44Å
388	G	71.6	Confident	70.3	Confident	9 Å²	9	35.4 Å²	35.4	9%	0.093	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	74	1.7	174.2	0	0	0	0	0	116.6	F334 N386 W422 V423	F334-G388 WeakPolarHBondContact CD1-O 3.42Å; F334-G388 WeakPolarHBondContact CE1-O 3.16Å; N386-G388 PolarHBondContact O-N 3.01Å; G388-W422 PolarHBondContact N-O 3.06Å; G388-V423 WeakPolarHBondContact CA-O 3.09Å; G388-V423 PolarHBondContact N-O 3.34Å; G388-V423 VanDerWaalsContact N-O 3.14Å
389	F	68.5	Low	69	Low	5 Å²	5	38.7 Å²	38.7	2%	0.022	20%	0.202	C	C	.	.	S	Bend	trans	-94	-3	-178.7	-70.9	-77.5	0	0	0	113.9	F334 I343 M344 N386 C387 K391 V423 K856 T858	F334-F389 HydrophobicContact CE1-CD1 4.45Å; F334-F389 HydrophobicContact CE1-CD2 4.37Å; F334-F389 HydrophobicContact CE1-CE1 4.29Å; F334-F389 HydrophobicContact CE1-CE2 4.21Å; F334-F389 HydrophobicContact CE1-CG 4.49Å; F334-F389 HydrophobicContact CE1-CZ 4.17Å; F334-F389 HydrophobicContact CZ-CE2 4.07Å; F334-F389 HydrophobicContact CZ-CZ 4.01Å; I343-F389 HydrophobicContact CB-CE1 4.5Å; M344-F389 HydrophobicContact SD-CD1 4.23Å; N386-F389 PolarHBondContact O-N 3.28Å; C387-F389 VanDerWaalsContact C-N 3.28Å; C387-F389 VanDerWaalsContact O-CD2 3.24Å; C387-F389 WeakPolarHBondContact O-CD2 3.46Å; C387-F389 PolarHBondContact O-N 2.91Å; F389-K391 PolarHBondContact O-N 3.19Å; F389-V423 PolarHBondContact N-O 3.48Å; F389-K856 HydrophobicContact CD2-CD 4.41Å; F389-K856 HydrophobicContact CE2-CD 4.03Å; F389-K856 HydrophobicContact CE2-CG 4.18Å; F389-K856 HydrophobicContact CZ-CD 4.35Å; F389-T858 HydrophobicContact CZ-CG2 4.47Å
390	G	61.3	Low	67.2	Low	20 Å²	20	48 Å²	48	21%	0.206	24%	0.242	C	C	.	.	S	Bend	trans	68.8	-8.5	170.3	0	0	0	0	0	116.9	Q396 V423	G390-Q396 PolarHBondContact O-NE2 3.48Å; G390-V423 PolarHBondContact N-O 2.63Å
391	K	65.2	Low	65.5	Low	141 Å²	141	56.1 Å²	56.1	61%	0.613	28%	0.28	S	S	*	.			trans	-127.5	125.8	178.8	-67.4	-176.5	-177.8	176.8	0	111.8	F389	F389-K391 PolarHBondContact O-N 3.19Å
392	E	69.5	Low	64.3	Low	2 Å²	2	56.9 Å²	56.9	1%	0.009	29%	0.285	C	S	.	.			trans	-132.7	132.1	175.7	-172.5	-165.8	160.4	0	0	109.5	N382 Q396 V423	N382-E392 WeakPolarHBondContact ND2-CG 3.32Å; N382-E392 PolarHBondContact ND2-OE1 2.93Å; E392-Q396 WeakPolarHBondContact O-CB 3.37Å; E392-Q396 VanDerWaalsContact O-CG 3.24Å; E392-Q396 WeakPolarHBondContact O-CG 3.29Å; E392-Q396 PolarHBondContact O-OE1 3.38Å; E392-V423 HydrophobicContact CB-CG1 4.12Å; E392-V423 HydrophobicContact CB-CG2 4.24Å; E392-V423 HydrophobicContact CG-CG2 4.49Å; E392-V423 WeakPolarHBondContact OE2-CG2 3.44Å
393	K	60.6	Low	63.2	Low	143 Å²	143	60.7 Å²	60.7	62%	0.622	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-19.8	-177.1	-162.5	173.3	178.9	-179	0	114.2	L348	L348-K393 HydrophobicContact CD2-CB 4.36Å; L348-K393 HydrophobicContact CD2-CD 4.45Å
394	L	61.2	Low	62.5	Low	55 Å²	55	63.4 Å²	63.4	29%	0.288	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-27.8	-173	-64.1	-176.7	0	0	0	114.3	L348 P349 N382	L348-L394 HydrophobicContact CD2-CD2 4.29Å; P349-L394 HydrophobicContact CG-CD1 4.14Å; N382-L394 HydrophobicContact CB-CD1 4.09Å; N382-L394 WeakPolarHBondContact ND2-CB 3.48Å; N382-L394 WeakPolarHBondContact ND2-CD1 3.47Å; N382-L394 WeakPolarHBondContact ND2-CG 3.4Å
395	L	61	Low	61.7	Low	7 Å²	7	64.6 Å²	64.6	4%	0.037	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.7	-10.6	-171.4	-71	170.4	0	0	0	114.6	E397 V402 T416 L420 Y438	L395-E397 VanDerWaalsContact C-N 3.27Å; L395-E397 PolarHBondContact O-N 3.31Å; L395-V402 HydrophobicContact CD2-CG1 4.48Å; L395-T416 HydrophobicContact CD1-CG2 4.07Å; L395-T416 WeakPolarHBondContact CD1-O 3.02Å; L395-T416 HydrophobicContact CD2-CG2 3.9Å; L395-L420 HydrophobicContact CB-CD1 4.18Å; L395-Y438 PolarHBondContact O-OH 3.29Å; L395-Y438 VanDerWaalsContact O-OH 3.12Å
396	Q	58.6	Low	60.8	Low	81 Å²	81	69.1 Å²	69.1	38%	0.379	36%	0.357	S	S	.	.			trans	-81.6	1.3	-177.2	-70	-176.5	-20	0	0	114.4	G390 E392	G390-Q396 PolarHBondContact O-NE2 3.48Å; E392-Q396 WeakPolarHBondContact O-CB 3.37Å; E392-Q396 VanDerWaalsContact O-CG 3.24Å; E392-Q396 WeakPolarHBondContact O-CG 3.29Å; E392-Q396 PolarHBondContact O-OE1 3.38Å
397	E	52.2	Low	60.4	Low	140 Å²	140	74.9 Å²	74.9	65%	0.654	38%	0.382	S	S	*	.	S	Bend	trans	-79.7	141.8	171.3	-67.6	-173.5	174	0	0	111.7	L395	L395-E397 VanDerWaalsContact C-N 3.27Å; L395-E397 PolarHBondContact O-N 3.31Å
398	T	44.6	Very low	60.2	Low	122 Å²	122	75.3 Å²	75.3	75%	0.748	38%	0.384	S	S	*	.			trans	-42.1	143.8	-170.4	27.2	0	0	0	0	116.9	K400	T398-K400 VanDerWaalsContact C-N 3.27Å; T398-K400 PolarHBondContact O-N 3.23Å
399	P	49	Very low	60.2	Low	81 Å²	81	82.1 Å²	82.1	53%	0.526	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	12.3	-156.6	30.8	-38.3	0	0	0	117.2
400	K	44.5	Very low	60.5	Low	198 Å²	198	87.7 Å²	87.7	86%	0.861	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	-25.3	-172.2	-75.7	-171.3	175.5	-178	0	115.9	T398	T398-K400 VanDerWaalsContact C-N 3.27Å; T398-K400 PolarHBondContact O-N 3.23Å
401	E	46.3	Very low	61.2	Low	169 Å²	169	88.7 Å²	88.7	79%	0.79	44%	0.436	S	S	*	.			trans	-156.6	69.3	172.6	-66.1	-173.4	-178.9	0	0	109.6	P403	E401-P403 WeakPolarHBondContact O-CD 3.21Å; E401-P403 VanDerWaalsContact O-N 3.09Å
402	V	56.5	Low	61.7	Low	17 Å²	17	82.2 Å²	82.2	10%	0.103	41%	0.409	C	S	.	.			trans	-69.7	108	163.3	-173.2	0	0	0	0	105.2	L395 W404 L405 C406	L395-V402 HydrophobicContact CD2-CG1 4.48Å; V402-W404 HydrophobicContact CG1-CB 3.7Å; V402-W404 PolarHBondContact O-N 3.02Å; V402-L405 HydrophobicContact CB-CB 4.23Å; V402-L405 PolarHBondContact O-N 3.45Å; V402-C406 PolarHBondContact O-N 3.35Å
403	P	60.7	Low	62.2	Low	82 Å²	82	83.5 Å²	83.5	53%	0.532	42%	0.415	S	S	.	.	H	α-helix	trans	-61.5	-19.8	-176.5	-19.2	34.8	0	0	0	110.6	E401 K407	E401-P403 WeakPolarHBondContact O-CD 3.21Å; E401-P403 VanDerWaalsContact O-N 3.09Å; P403-K407 VanDerWaalsContact O-CD 3.27Å; P403-K407 WeakPolarHBondContact O-CD 3.32Å; P403-K407 WeakPolarHBondContact O-CG 3.23Å; P403-K407 PolarHBondContact O-N 3.46Å
404	W	65.2	Low	63.3	Low	56 Å²	56	76.9 Å²	76.9	21%	0.212	39%	0.386	C	S	.	.	H	α-helix	trans	-69.3	-44.9	174.5	-156.7	-112.3	0	0	0	113.7	N375 A378 V402 K407	N375-W404 HydrophobicContact CB-CH2 3.69Å; N375-W404 HydrophobicContact CB-CZ2 3.5Å; N375-W404 HydrophobicContact CB-CZ3 4.49Å; N375-W404 VanDerWaalsContact CG-CH2 3.44Å; N375-W404 WeakPolarHBondContact OD1-CH2 3.36Å; A378-W404 HydrophobicContact CB-CZ2 4.07Å; V402-W404 HydrophobicContact CG1-CB 3.7Å; V402-W404 PolarHBondContact O-N 3.02Å; W404-K407 HydrophobicContact CE3-CD 4.32Å; W404-K407 PolarHBondContact O-N 2.99Å
405	L	64.5	Low	64.2	Low	27 Å²	27	74.3 Å²	74.3	14%	0.141	37%	0.373	C	S	.	.	H	α-helix	trans	-69	-37.7	-179.5	-172.5	65.1	0	0	0	111.3	V402 K407 Q408 K413 T416 V417 T446	V402-L405 HydrophobicContact CB-CB 4.23Å; V402-L405 PolarHBondContact O-N 3.45Å; L405-K407 VanDerWaalsContact C-N 3.27Å; L405-K407 PolarHBondContact O-N 3.33Å; L405-Q408 PolarHBondContact O-N 2.65Å; L405-K413 HydrophobicContact CD1-CB 4.07Å; L405-K413 HydrophobicContact CD1-CG 4.16Å; L405-K413 WeakPolarHBondContact O-CE 3Å; L405-T416 HydrophobicContact CD1-CG2 4.38Å; L405-V417 HydrophobicContact CD1-CG2 4.14Å; L405-T446 HydrophobicContact CD2-CG2 4.16Å
406	C	63.2	Low	65.1	Low	97 Å²	97	74 Å²	74	66%	0.655	37%	0.371	S	S	*	.	H	α-helix	trans	-68.3	-23.3	176	-65.2	0	0	0	0	113.5	V402 Q408	V402-C406 PolarHBondContact O-N 3.35Å; C406-Q408 VanDerWaalsContact C-N 3.29Å
407	K	69.6	Low	66.3	Low	121 Å²	121	70.3 Å²	70.3	53%	0.526	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-15.7	175.8	-77.9	168.7	-172.6	-177.6	0	113.3	P403 W404 L405	P403-K407 VanDerWaalsContact O-CD 3.27Å; P403-K407 WeakPolarHBondContact O-CD 3.32Å; P403-K407 WeakPolarHBondContact O-CG 3.23Å; P403-K407 PolarHBondContact O-N 3.46Å; W404-K407 HydrophobicContact CE3-CD 4.32Å; W404-K407 PolarHBondContact O-N 2.99Å; L405-K407 VanDerWaalsContact C-N 3.27Å; L405-K407 PolarHBondContact O-N 3.33Å
408	Q	70.9	Confident	67.9	Low	8 Å²	8	63.6 Å²	63.6	4%	0.037	32%	0.323	C	S	.	.	S	Bend	trans	-88.5	142.3	-178.9	-60.9	-67.2	-3.5	0	0	111.4	A372 N375 L405 C406 K413	A372-Q408 PolarHBondContact O-OE1 3.39Å; N375-Q408 PolarHBondContact O-NE2 3.12Å; L405-Q408 PolarHBondContact O-N 2.65Å; C406-Q408 VanDerWaalsContact C-N 3.29Å; Q408-K413 HydrophobicContact CB-CG 3.95Å; Q408-K413 WeakPolarHBondContact O-CE 3.42Å
409	K	70.7	Confident	69.7	Low	153 Å²	153	57.8 Å²	57.8	67%	0.665	29%	0.287	S	S	*	.			trans	-85.8	141.4	173.6	-66.8	-179.4	178	174.3	0	110	F411 G412 K413	K409-F411 PolarHBondContact O-N 2.86Å; K409-G412 VanDerWaalsContact O-CA 3.29Å; K409-G412 WeakPolarHBondContact O-CA 3.45Å; K409-G412 PolarHBondContact O-N 2.75Å; K409-K413 PolarHBondContact O-N 3.45Å
410	E	75.7	Confident	71.3	Confident	122 Å²	122	54 Å²	54	57%	0.57	26%	0.262	S	S	*	.	H	α-helix	trans	12.6	-84.5	171.7	-65.5	175.8	-173.8	0	0	116.9	G412 K413 M414 H445	E410-G412 VanDerWaalsContact C-N 3.34Å; E410-G412 PolarHBondContact O-N 3.34Å; E410-K413 WeakPolarHBondContact O-CB 3.45Å; E410-K413 PolarHBondContact O-N 3.06Å; E410-K413 VanDerWaalsContact O-N 3.07Å; E410-M414 PolarHBondContact O-N 2.94Å; E410-H445 WeakPolarHBondContact O-CB 3.35Å
411	F	75.1	Confident	73.1	Confident	41 Å²	41	44.6 Å²	44.6	18%	0.18	22%	0.221	C	C	.	.	H	α-helix	trans	-63.4	-33.7	180	-66.7	-76.4	0	0	0	114.1	K409 K413 M414 S415 R896	K409-F411 PolarHBondContact O-N 2.86Å; F411-K413 PolarHBondContact O-N 3.15Å; F411-M414 WeakPolarHBondContact O-CB 3.49Å; F411-M414 PolarHBondContact O-N 3.39Å; F411-S415 PolarHBondContact O-N 3.38Å; F411-S415 PolarHBondContact O-OG 3.49Å; F411-R896 HydrophobicContact CD2-CB 4.29Å; F411-R896 HydrophobicContact CD2-CG 4.44Å; F411-R896 HydrophobicContact CE2-CB 4.03Å; F411-R896 HydrophobicContact CE2-CG 4.09Å; F411-R896 HydrophobicContact CZ-CB 4.28Å
412	G	75.3	Confident	74.9	Confident	5 Å²	5	36.6 Å²	36.6	5%	0.052	18%	0.184	C	C	.	.	H	α-helix	trans	-63.5	-28.2	172.5	0	0	0	0	0	113.5	L376 K409 E410 T416	L376-G412 VanDerWaalsContact CD1-CA 3.47Å; K409-G412 VanDerWaalsContact O-CA 3.29Å; K409-G412 WeakPolarHBondContact O-CA 3.45Å; K409-G412 PolarHBondContact O-N 2.75Å; E410-G412 VanDerWaalsContact C-N 3.34Å; E410-G412 PolarHBondContact O-N 3.34Å; G412-T416 VanDerWaalsContact O-CB 3.27Å; G412-T416 WeakPolarHBondContact O-CB 3.23Å; G412-T416 PolarHBondContact O-N 3.27Å; G412-T416 PolarHBondContact O-OG1 3.2Å
413	K	81.5	Confident	76.2	Confident	29 Å²	29	35.8 Å²	35.8	13%	0.126	18%	0.179	C	C	.	.	H	α-helix	trans	-69.7	-43.5	171.7	-63.8	-175.5	175.5	176.9	0	111.1	L405 Q408 K409 E410 F411 T416 V417 E443 H445 T446	L405-K413 HydrophobicContact CD1-CB 4.07Å; L405-K413 HydrophobicContact CD1-CG 4.16Å; L405-K413 WeakPolarHBondContact O-CE 3Å; Q408-K413 HydrophobicContact CB-CG 3.95Å; Q408-K413 WeakPolarHBondContact O-CE 3.42Å; K409-K413 PolarHBondContact O-N 3.45Å; E410-K413 WeakPolarHBondContact O-CB 3.45Å; E410-K413 PolarHBondContact O-N 3.06Å; E410-K413 VanDerWaalsContact O-N 3.07Å; F411-K413 PolarHBondContact O-N 3.15Å; K413-T416 PolarHBondContact O-N 3.04Å; K413-V417 WeakPolarHBondContact O-CG2 3.31Å; K413-V417 PolarHBondContact O-N 2.8Å; K413-E443 WeakPolarHBondContact CD-OE2 3.36Å; K413-E443 WeakPolarHBondContact CE-OE2 3.33Å; K413-E443 IonicContact NZ-OE1 2.65Å; K413-E443 PolarHBondContact NZ-OE1 3.19Å; K413-E443 IonicContact NZ-OE2 2.83Å; K413-E443 PolarHBondContact NZ-OE2 2.94Å; K413-H445 HydrophobicContact CB-CB 4.44Å; K413-T446 HydrophobicContact CB-CG2 4.11Å; K413-T446 HydrophobicContact CD-CG2 4.33Å
414	M	82.2	Confident	77.2	Confident	3 Å²	3	32 Å²	32	2%	0.015	15%	0.154	C	C	.	.	H	α-helix	trans	-57	-50.8	174.1	176	-178.9	170	0	0	111.1	E410 F411 T416 V417 A418 H445 A448 G449 L452 V482 A486 Y899	E410-M414 PolarHBondContact O-N 2.94Å; F411-M414 WeakPolarHBondContact O-CB 3.49Å; F411-M414 PolarHBondContact O-N 3.39Å; M414-T416 PolarHBondContact O-N 3.26Å; M414-V417 PolarHBondContact O-N 3.17Å; M414-A418 WeakPolarHBondContact O-CB 3.36Å; M414-A418 PolarHBondContact O-N 2.65Å; M414-H445 VanDerWaalsContact CA-O 3.3Å; M414-H445 WeakPolarHBondContact CA-O 3.41Å; M414-H445 HydrophobicContact CB-CB 4.44Å; M414-H445 WeakPolarHBondContact CB-O 3.34Å; M414-A448 HydrophobicContact CG-CB 4.3Å; M414-A448 HydrophobicContact SD-CB 4.19Å; M414-G449 VanDerWaalsContact O-CA 3.3Å; M414-G449 WeakPolarHBondContact O-CA 3.44Å; M414-L452 HydrophobicContact CE-CD2 3.96Å; M414-V482 HydrophobicContact SD-CG1 4.05Å; M414-A486 HydrophobicContact CE-CB 3.73Å; M414-Y899 HydrophobicContact CE-CD1 4.22Å; M414-Y899 HydrophobicContact CE-CG 4.13Å; M414-Y899 HydrophobicContact SD-CD1 4.46Å
415	S	80.1	Confident	77.8	Confident	2 Å²	2	29.5 Å²	29.5	1%	0.014	15%	0.145	C	C	.	.	H	α-helix	trans	-64.2	-40.8	179.6	-61.8	0	0	0	0	113.3	Y380 F411 V417 A418 T419	Y380-S415 WeakPolarHBondContact OH-CB 3.22Å; Y380-S415 PolarHBondContact OH-OG 3.4Å; F411-S415 PolarHBondContact O-N 3.38Å; F411-S415 PolarHBondContact O-OG 3.49Å; S415-V417 PolarHBondContact O-N 3.12Å; S415-A418 PolarHBondContact O-N 3.41Å; S415-T419 WeakPolarHBondContact O-CG2 3.47Å; S415-T419 PolarHBondContact O-N 2.89Å; S415-T419 PolarHBondContact O-OG1 3.41Å
416	T	81.7	Confident	78.3	Confident	0 Å²	0	29 Å²	29	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-67.3	-35.3	-179.8	-58.6	0	0	0	0	112.2	S379 L395 L405 G412 K413 M414 T419	S379-T416 PolarHBondContact OG-OG1 3.47Å; L395-T416 HydrophobicContact CD1-CG2 4.07Å; L395-T416 WeakPolarHBondContact CD1-O 3.02Å; L395-T416 HydrophobicContact CD2-CG2 3.9Å; L405-T416 HydrophobicContact CD1-CG2 4.38Å; G412-T416 VanDerWaalsContact O-CB 3.27Å; G412-T416 WeakPolarHBondContact O-CB 3.23Å; G412-T416 PolarHBondContact O-N 3.27Å; G412-T416 PolarHBondContact O-OG1 3.2Å; K413-T416 PolarHBondContact O-N 3.04Å; M414-T416 PolarHBondContact O-N 3.26Å; T416-T419 PolarHBondContact O-OG1 2.82Å
417	V	83.6	Confident	79.1	Confident	3 Å²	3	26.2 Å²	26.2	2%	0.018	12%	0.12	C	C	.	.	H	α-helix	trans	-71.2	-40	172.5	177	0	0	0	0	110.2	L405 K413 M414 S415 T419 L420 Y438 T446 G449	L405-V417 HydrophobicContact CD1-CG2 4.14Å; K413-V417 WeakPolarHBondContact O-CG2 3.31Å; K413-V417 PolarHBondContact O-N 2.8Å; M414-V417 PolarHBondContact O-N 3.17Å; S415-V417 PolarHBondContact O-N 3.12Å; V417-T419 VanDerWaalsContact C-N 3.32Å; V417-T419 PolarHBondContact O-N 2.91Å; V417-L420 WeakPolarHBondContact O-CB 3.47Å; V417-L420 PolarHBondContact O-N 3.11Å; V417-L420 VanDerWaalsContact O-N 3.13Å; V417-Y438 HydrophobicContact CG1-CD1 4.4Å; V417-Y438 HydrophobicContact CG1-CD2 4.19Å; V417-Y438 HydrophobicContact CG1-CG 3.86Å; V417-Y438 HydrophobicContact CG2-CD1 4.14Å; V417-Y438 HydrophobicContact CG2-CG 4.41Å; V417-T446 HydrophobicContact CG2-CG2 4.46Å; V417-G449 VanDerWaalsContact CG1-C 3.49Å
418	A	84.5	Confident	79.3	Confident	0 Å²	0	21 Å²	21	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-67.2	-28.3	179.1	0	0	0	0	0	114	M414 S415 L420 G421 L452 F902	M414-A418 WeakPolarHBondContact O-CB 3.36Å; M414-A418 PolarHBondContact O-N 2.65Å; S415-A418 PolarHBondContact O-N 3.41Å; A418-L420 PolarHBondContact O-N 3.19Å; A418-G421 WeakPolarHBondContact O-CA 3.4Å; A418-G421 PolarHBondContact O-N 3.38Å; A418-L452 HydrophobicContact CB-CB 4.15Å; A418-L452 HydrophobicContact CB-CD2 3.61Å; A418-L452 HydrophobicContact CB-CG 4.19Å; A418-F902 HydrophobicContact CB-CD2 4.43Å; A418-F902 HydrophobicContact CB-CE1 3.73Å; A418-F902 HydrophobicContact CB-CE2 3.62Å; A418-F902 HydrophobicContact CB-CZ 3.22Å
419	T	83.6	Confident	79.6	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-63.7	-23	172.7	47.8	0	0	0	0	113.2	Y380 S415 T416 V417 G421 W422 V423 F902	Y380-T419 HydrophobicContact CD1-CG2 3.54Å; Y380-T419 HydrophobicContact CE1-CG2 4.04Å; Y380-T419 HydrophobicContact CG-CG2 4.37Å; S415-T419 WeakPolarHBondContact O-CG2 3.47Å; S415-T419 PolarHBondContact O-N 2.89Å; S415-T419 PolarHBondContact O-OG1 3.41Å; T416-T419 PolarHBondContact O-OG1 2.82Å; V417-T419 VanDerWaalsContact C-N 3.32Å; V417-T419 PolarHBondContact O-N 2.91Å; T419-G421 PolarHBondContact O-N 3.41Å; T419-W422 HydrophobicContact CG2-CE3 3.99Å; T419-W422 HydrophobicContact CG2-CZ3 4.08Å; T419-W422 WeakPolarHBondContact O-CB 3.33Å; T419-W422 PolarHBondContact O-N 3.34Å; T419-W422 VanDerWaalsContact O-N 3.1Å; T419-V423 PolarHBondContact O-N 2.8Å; T419-F902 HydrophobicContact CG2-CZ 4.35Å
420	L	81.6	Confident	80	Confident	2 Å²	2	22.1 Å²	22.1	1%	0.01	11%	0.114	C	C	.	.	H	α-helix	trans	-60.5	-34.4	169.9	-165.4	85.1	0	0	0	111	L395 V417 A418 W422 V423 L424 Q434 L435 Y438	L395-L420 HydrophobicContact CB-CD1 4.18Å; V417-L420 WeakPolarHBondContact O-CB 3.47Å; V417-L420 PolarHBondContact O-N 3.11Å; V417-L420 VanDerWaalsContact O-N 3.13Å; A418-L420 PolarHBondContact O-N 3.19Å; L420-W422 VanDerWaalsContact C-N 3.29Å; L420-W422 PolarHBondContact O-N 3.03Å; L420-V423 PolarHBondContact O-N 3.22Å; L420-L424 HydrophobicContact CD2-CD1 4.11Å; L420-L424 HydrophobicContact CG-CD1 3.86Å; L420-L424 PolarHBondContact O-N 2.83Å; L420-Q434 HydrophobicContact CD2-CB 4Å; L420-L435 HydrophobicContact CB-CD2 4.31Å; L420-L435 HydrophobicContact CD2-CD2 3.74Å; L420-L435 HydrophobicContact CD2-CG 4.15Å; L420-Y438 HydrophobicContact CD2-CD2 4.04Å; L420-Y438 HydrophobicContact CD2-CE2 3.6Å
421	G	82.5	Confident	80.1	Confident	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-63.6	-31.3	174.8	0	0	0	0	0	113.2	A418 T419 L424 L425	A418-G421 WeakPolarHBondContact O-CA 3.4Å; A418-G421 PolarHBondContact O-N 3.38Å; T419-G421 PolarHBondContact O-N 3.41Å; G421-L424 CarbonylContact O-C 3.5Å; G421-L425 PolarHBondContact O-N 3.45Å; G421-L425 VanDerWaalsContact O-N 3.16Å
422	W	83.9	Confident	80.4	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-71.1	-38.6	173.2	-76.3	-21.5	0	0	0	112.9	Y380 L384 C387 G388 T419 L420 L424 L425 V456 I901 F902 I904 T905	Y380-W422 AromaticContact CD1-CH2 3.86Å; Y380-W422 HydrophobicContact CD1-CH2 3.86Å; Y380-W422 AromaticContact CD1-CZ3 3.63Å; Y380-W422 HydrophobicContact CD1-CZ3 3.63Å; Y380-W422 HydrophobicContact CE1-CH2 4.2Å; Y380-W422 HydrophobicContact CE1-CZ3 4.34Å; L384-W422 HydrophobicContact CD1-CZ3 4.21Å; L384-W422 HydrophobicContact CD2-CD2 4.21Å; L384-W422 HydrophobicContact CD2-CE3 3.68Å; L384-W422 HydrophobicContact CD2-CH2 3.8Å; L384-W422 HydrophobicContact CD2-CZ2 4.29Å; L384-W422 HydrophobicContact CD2-CZ3 3.44Å; L384-W422 VanDerWaalsContact CD2-CZ3 3.44Å; L384-W422 HydrophobicContact CG-CE3 3.85Å; L384-W422 HydrophobicContact CG-CH2 4.22Å; L384-W422 HydrophobicContact CG-CZ3 3.5Å; L384-W422 VanDerWaalsContact CG-CZ3 3.5Å; C387-W422 VanDerWaalsContact CA-O 3.29Å; C387-W422 WeakPolarHBondContact CA-O 3.12Å; G388-W422 PolarHBondContact N-O 3.06Å; T419-W422 HydrophobicContact CG2-CE3 3.99Å; T419-W422 HydrophobicContact CG2-CZ3 4.08Å; T419-W422 WeakPolarHBondContact O-CB 3.33Å; T419-W422 PolarHBondContact O-N 3.34Å; T419-W422 VanDerWaalsContact O-N 3.1Å; L420-W422 VanDerWaalsContact C-N 3.29Å; L420-W422 PolarHBondContact O-N 3.03Å; W422-L424 PolarHBondContact O-N 3.21Å; W422-L425 WeakPolarHBondContact O-CB 3.47Å; W422-L425 PolarHBondContact O-N 2.99Å; W422-V456 HydrophobicContact CG-CG1 4.33Å; W422-I901 HydrophobicContact CH2-CG2 3.68Å; W422-I901 HydrophobicContact CZ2-CG2 3.98Å; W422-F902 HydrophobicContact CD2-CD1 4.37Å; W422-F902 AromaticContact CD2-CE1 4Å; W422-F902 HydrophobicContact CD2-CE1 4Å; W422-F902 AromaticContact CE2-CD1 3.53Å; W422-F902 AromaticContact CE2-CE1 3.58Å; W422-F902 HydrophobicContact CE3-CE1 4.47Å; W422-F902 HydrophobicContact CH2-CD1 4.43Å; W422-F902 HydrophobicContact CH2-CE1 4.17Å; W422-F902 AromaticContact CZ2-CD1 3.56Å; W422-F902 HydrophobicContact CZ2-CD1 3.56Å; W422-F902 AromaticContact CZ2-CE1 3.68Å; W422-F902 HydrophobicContact CZ2-CE1 3.68Å; W422-F902 HydrophobicContact CZ2-CG 4.33Å; W422-F902 AromaticContact NE1-CD1 3.56Å; W422-F902 AromaticContact NE1-CE1 3.92Å; W422-I904 HydrophobicContact CZ2-CG2 4.22Å; W422-T905 PolarHBondContact NE1-OG1 2.98Å; W422-T905 VanDerWaalsContact NE1-OG1 3.08Å
423	V	83.7	Confident	80.8	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-62.9	-35	177.2	176.7	0	0	0	0	111.1	N386 G388 F389 G390 E392 T419 L420	N386-V423 HydrophobicContact CB-CG2 4.37Å; G388-V423 WeakPolarHBondContact CA-O 3.09Å; G388-V423 PolarHBondContact N-O 3.34Å; G388-V423 VanDerWaalsContact N-O 3.14Å; F389-V423 PolarHBondContact N-O 3.48Å; G390-V423 PolarHBondContact N-O 2.63Å; E392-V423 HydrophobicContact CB-CG1 4.12Å; E392-V423 HydrophobicContact CB-CG2 4.24Å; E392-V423 HydrophobicContact CG-CG2 4.49Å; E392-V423 WeakPolarHBondContact OE2-CG2 3.44Å; T419-V423 PolarHBondContact O-N 2.8Å; L420-V423 PolarHBondContact O-N 3.22Å
424	L	81.1	Confident	80.7	Confident	2 Å²	2	18.7 Å²	18.7	1%	0.01	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	21.5	-177.3	-62	157.7	0	0	0	112.5	L420 G421 W422 W426 D427 Q434 V457	L420-L424 HydrophobicContact CD2-CD1 4.11Å; L420-L424 HydrophobicContact CG-CD1 3.86Å; L420-L424 PolarHBondContact O-N 2.83Å; G421-L424 CarbonylContact O-C 3.5Å; W422-L424 PolarHBondContact O-N 3.21Å; L424-W426 PolarHBondContact O-N 3.48Å; L424-D427 PolarHBondContact O-N 3.29Å; L424-D427 VanDerWaalsContact O-N 3.12Å; L424-Q434 HydrophobicContact CD1-CB 3.89Å; L424-Q434 HydrophobicContact CD1-CG 4.25Å; L424-V457 HydrophobicContact CB-CG2 4.1Å
425	L	78	Confident	80.7	Confident	5 Å²	5	18.5 Å²	18.5	3%	0.026	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	129.4	179.5	-172.4	67.6	0	0	0	110.6	G421 W422 D427 V456 C459 T905 I908	G421-L425 PolarHBondContact O-N 3.45Å; G421-L425 VanDerWaalsContact O-N 3.16Å; W422-L425 WeakPolarHBondContact O-CB 3.47Å; W422-L425 PolarHBondContact O-N 2.99Å; L425-D427 VanDerWaalsContact C-N 3.27Å; L425-D427 PolarHBondContact O-N 3.37Å; L425-V456 HydrophobicContact CD1-CG1 4.39Å; L425-V456 VanDerWaalsContact CD1-O 3.28Å; L425-V456 WeakPolarHBondContact CD1-O 3.5Å; L425-C459 HydrophobicContact CD1-CB 4.28Å; L425-T905 HydrophobicContact CD1-CG2 3.58Å; L425-I908 HydrophobicContact CD2-CG2 4.1Å
426	W	76.3	Confident	80.8	Confident	16 Å²	16	21.1 Å²	21.1	6%	0.061	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.8	-3.2	-178.4	-45.5	-42	0	0	0	117.3	L330 F334 L424 V457 C459 V461 L859 P910	L330-W426 HydrophobicContact CD2-CD2 3.48Å; L330-W426 VanDerWaalsContact CD2-CD2 3.48Å; L330-W426 HydrophobicContact CD2-CE3 3.72Å; L330-W426 HydrophobicContact CD2-CG 3.92Å; L330-W426 HydrophobicContact CD2-CH2 4.25Å; L330-W426 HydrophobicContact CD2-CZ2 4.01Å; L330-W426 HydrophobicContact CD2-CZ3 4.1Å; L330-W426 HydrophobicContact CG-CD2 4.05Å; L330-W426 HydrophobicContact CG-CE3 3.83Å; L330-W426 HydrophobicContact CG-CZ3 4.21Å; F334-W426 HydrophobicContact CB-CZ3 4.38Å; F334-W426 HydrophobicContact CD2-CZ3 4.13Å; F334-W426 HydrophobicContact CG-CZ3 4.13Å; L424-W426 PolarHBondContact O-N 3.48Å; W426-V457 PolarHBondContact N-O 3.09Å; W426-C459 PolarHBondContact NE1-O 3.35Å; W426-V461 HydrophobicContact CB-CG2 3.99Å; W426-V461 HydrophobicContact CG-CG2 4.39Å; W426-L859 HydrophobicContact CH2-CD2 3.89Å; W426-L859 HydrophobicContact CZ3-CD2 4.4Å; W426-P910 HydrophobicContact CH2-CB 4.06Å; W426-P910 HydrophobicContact CH2-CG 3.68Å; W426-P910 HydrophobicContact CZ3-CB 4.34Å; W426-P910 HydrophobicContact CZ3-CG 4.07Å
427	D	79.1	Confident	80.9	Confident	38 Å²	38	27.2 Å²	27.2	20%	0.203	14%	0.144	C	C	.	.			trans	-99.8	93.8	174.5	-172.7	-13.2	0	0	0	110.5	L424 L425 D429 T430 G431 V457	L424-D427 PolarHBondContact O-N 3.29Å; L424-D427 VanDerWaalsContact O-N 3.12Å; L425-D427 VanDerWaalsContact C-N 3.27Å; L425-D427 PolarHBondContact O-N 3.37Å; D427-D429 PolarHBondContact OD1-N 3.29Å; D427-T430 PolarHBondContact OD1-N 3.3Å; D427-T430 PolarHBondContact OD1-OG1 3.47Å; D427-T430 WeakPolarHBondContact OD2-CB 2.97Å; D427-T430 WeakPolarHBondContact OD2-CG2 3.38Å; D427-T430 PolarHBondContact OD2-OG1 3.33Å; D427-G431 VanDerWaalsContact O-CA 3.25Å; D427-G431 WeakPolarHBondContact O-CA 3.08Å; D427-G431 PolarHBondContact O-N 3.05Å; D427-V457 WeakPolarHBondContact O-CG1 3.49Å
428	V	73.2	Confident	80.7	Confident	12 Å²	12	28.3 Å²	28.3	7%	0.073	15%	0.148	C	C	.	.	H	α-helix	trans	-67.5	-40.9	-176.2	-175.6	0	0	0	0	111.3	L432 V461 P467	V428-L432 HydrophobicContact CG1-CD1 3.84Å; V428-L432 WeakPolarHBondContact O-CB 3.05Å; V428-L432 WeakPolarHBondContact O-CD1 3.4Å; V428-L432 WeakPolarHBondContact O-CG 2.99Å; V428-L432 PolarHBondContact O-N 3.12Å; V428-V461 HydrophobicContact CG2-CB 4.31Å; V428-V461 HydrophobicContact CG2-CG1 3.92Å; V428-P467 HydrophobicContact CG1-CG 4.31Å
429	D	77.9	Confident	80.4	Confident	127 Å²	127	29.1 Å²	29.1	68%	0.679	15%	0.153	S	C	*	.	H	α-helix	trans	-77.3	-50.8	-170.7	-65.5	-28.3	0	0	0	112.2	D427	D427-D429 PolarHBondContact OD1-N 3.29Å
430	T	80.3	Confident	80.4	Confident	58 Å²	58	38.1 Å²	38.1	36%	0.356	19%	0.188	S	C	.	.	H	α-helix	trans	-77.2	-31.9	179.7	84.4	0	0	0	0	111	D427 S433 Q434	D427-T430 PolarHBondContact OD1-N 3.3Å; D427-T430 PolarHBondContact OD1-OG1 3.47Å; D427-T430 WeakPolarHBondContact OD2-CB 2.97Å; D427-T430 WeakPolarHBondContact OD2-CG2 3.38Å; D427-T430 PolarHBondContact OD2-OG1 3.33Å; T430-S433 PolarHBondContact O-N 3.29Å; T430-S433 PolarHBondContact O-OG 3.31Å; T430-Q434 WeakPolarHBondContact O-CG 3.45Å; T430-Q434 PolarHBondContact O-N 3.23Å
431	G	77.5	Confident	80.3	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-56.5	-53.9	177.6	0	0	0	0	0	112.8	D427 S433 Q434 L435	D427-G431 VanDerWaalsContact O-CA 3.25Å; D427-G431 WeakPolarHBondContact O-CA 3.08Å; D427-G431 PolarHBondContact O-N 3.05Å; G431-S433 PolarHBondContact O-N 3.33Å; G431-Q434 PolarHBondContact O-N 3.44Å; G431-L435 WeakPolarHBondContact O-CG 3.26Å; G431-L435 PolarHBondContact O-N 3.22Å
432	L	80.5	Confident	80	Confident	25 Å²	25	46.3 Å²	46.3	13%	0.131	24%	0.239	C	C	.	.	H	α-helix	trans	-62.1	-43.3	-179.2	-69.4	171.7	0	0	0	111.8	V428 Q434 L435 D436 C454 P467	V428-L432 HydrophobicContact CG1-CD1 3.84Å; V428-L432 WeakPolarHBondContact O-CB 3.05Å; V428-L432 WeakPolarHBondContact O-CD1 3.4Å; V428-L432 WeakPolarHBondContact O-CG 2.99Å; V428-L432 PolarHBondContact O-N 3.12Å; L432-Q434 PolarHBondContact O-N 2.95Å; L432-L435 PolarHBondContact O-N 3.41Å; L432-L435 VanDerWaalsContact O-N 3.13Å; L432-D436 WeakPolarHBondContact O-CB 3.37Å; L432-D436 PolarHBondContact O-N 2.97Å; L432-C454 HydrophobicContact CD2-CB 4.3Å; L432-P467 HydrophobicContact CD1-CB 3.91Å; L432-P467 HydrophobicContact CD1-CG 3.74Å
433	S	83.9	Confident	79.9	Confident	62 Å²	62	50.2 Å²	50.2	43%	0.434	26%	0.258	S	S	.	.	H	α-helix	trans	-61	-30.3	179.5	78.4	0	0	0	0	114	T430 G431	T430-S433 PolarHBondContact O-N 3.29Å; T430-S433 PolarHBondContact O-OG 3.31Å; G431-S433 PolarHBondContact O-N 3.33Å
434	Q	80.4	Confident	79.9	Confident	37 Å²	37	52.5 Å²	52.5	17%	0.173	27%	0.27	C	S	.	.	H	α-helix	trans	-81.8	-37.7	177.4	-65.6	-174.6	35.4	0	0	111.3	L420 L424 T430 G431 L432 Y438	L420-Q434 HydrophobicContact CD2-CB 4Å; L424-Q434 HydrophobicContact CD1-CB 3.89Å; L424-Q434 HydrophobicContact CD1-CG 4.25Å; T430-Q434 WeakPolarHBondContact O-CG 3.45Å; T430-Q434 PolarHBondContact O-N 3.23Å; G431-Q434 PolarHBondContact O-N 3.44Å; L432-Q434 PolarHBondContact O-N 2.95Å; Q434-Y438 VanDerWaalsContact O-CD2 3.27Å; Q434-Y438 WeakPolarHBondContact O-CD2 3.34Å; Q434-Y438 WeakPolarHBondContact O-CE2 3.07Å
435	L	80.7	Confident	80	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-71.8	-34.8	177.9	-71.5	168.2	0	0	0	112.7	L420 G431 L432 K437 Y438 L439 G453 C454 V457	L420-L435 HydrophobicContact CB-CD2 4.31Å; L420-L435 HydrophobicContact CD2-CD2 3.74Å; L420-L435 HydrophobicContact CD2-CG 4.15Å; G431-L435 WeakPolarHBondContact O-CG 3.26Å; G431-L435 PolarHBondContact O-N 3.22Å; L432-L435 PolarHBondContact O-N 3.41Å; L432-L435 VanDerWaalsContact O-N 3.13Å; L435-K437 PolarHBondContact O-N 3.36Å; L435-Y438 WeakPolarHBondContact O-CB 3.48Å; L435-Y438 PolarHBondContact O-N 3.33Å; L435-L439 PolarHBondContact O-N 3.31Å; L435-G453 VanDerWaalsContact CD1-C 3.45Å; L435-C454 HydrophobicContact CD1-CB 4.47Å; L435-V457 HydrophobicContact CD1-CG2 3.68Å
436	D	83.2	Confident	80.3	Confident	57 Å²	57	53.9 Å²	53.9	31%	0.305	28%	0.276	S	S	.	.	H	α-helix	trans	-57.8	-33.5	178.8	-80	-18.9	0	0	0	112.1	L432 Y438 L439 Y440	L432-D436 WeakPolarHBondContact O-CB 3.37Å; L432-D436 PolarHBondContact O-N 2.97Å; D436-Y438 PolarHBondContact O-N 3.39Å; D436-L439 PolarHBondContact O-N 3.19Å; D436-Y440 WeakPolarHBondContact O-CD2 3.44Å
437	K	82.5	Confident	80.6	Confident	127 Å²	127	56.2 Å²	56.2	55%	0.552	29%	0.285	S	S	*	.	H	α-helix	trans	-59.1	-32.8	175.4	-63.3	173.6	-173	169.4	0	112.3	L435	L435-K437 PolarHBondContact O-N 3.36Å
438	Y	80.3	Confident	80.8	Confident	26 Å²	26	54.4 Å²	54.4	10%	0.102	28%	0.275	C	S	.	.	H	α-helix	trans	-87.4	-25.2	-179.9	-60.9	-74.5	0	0	0	112.6	L395 V417 L420 Q434 L435 D436 Y440 S441	L395-Y438 PolarHBondContact O-OH 3.29Å; L395-Y438 VanDerWaalsContact O-OH 3.12Å; V417-Y438 HydrophobicContact CG1-CD1 4.4Å; V417-Y438 HydrophobicContact CG1-CD2 4.19Å; V417-Y438 HydrophobicContact CG1-CG 3.86Å; V417-Y438 HydrophobicContact CG2-CD1 4.14Å; V417-Y438 HydrophobicContact CG2-CG 4.41Å; L420-Y438 HydrophobicContact CD2-CD2 4.04Å; L420-Y438 HydrophobicContact CD2-CE2 3.6Å; Q434-Y438 VanDerWaalsContact O-CD2 3.27Å; Q434-Y438 WeakPolarHBondContact O-CD2 3.34Å; Q434-Y438 WeakPolarHBondContact O-CE2 3.07Å; L435-Y438 WeakPolarHBondContact O-CB 3.48Å; L435-Y438 PolarHBondContact O-N 3.33Å; D436-Y438 PolarHBondContact O-N 3.39Å; Y438-Y440 VanDerWaalsContact C-N 3.31Å; Y438-Y440 PolarHBondContact O-N 3.26Å; Y438-S441 VanDerWaalsContact O-CB 3.3Å; Y438-S441 WeakPolarHBondContact O-CB 3.21Å; Y438-S441 PolarHBondContact O-N 2.96Å
439	L	79.2	Confident	81.3	Confident	17 Å²	17	53.8 Å²	53.8	9%	0.089	27%	0.272	C	S	.	.	H	α-helix	trans	-63.3	-37	178.7	-168.1	71.6	0	0	0	112.2	L435 D436 S441 R447 L451	L435-L439 PolarHBondContact O-N 3.31Å; D436-L439 PolarHBondContact O-N 3.19Å; L439-S441 PolarHBondContact O-N 2.75Å; L439-R447 HydrophobicContact CD1-CG 3.81Å; L439-R447 PolarHBondContact O-NE 3.46Å; L439-L451 HydrophobicContact CD1-CD2 3.68Å; L439-L451 HydrophobicContact CD1-CG 3.92Å
440	Y	82.3	Confident	81.6	Confident	189 Å²	189	47.8 Å²	47.8	74%	0.741	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.6	2.2	178.9	-64	-67.4	0	0	0	114.9	D436 Y438	D436-Y440 WeakPolarHBondContact O-CD2 3.44Å; Y438-Y440 VanDerWaalsContact C-N 3.31Å; Y438-Y440 PolarHBondContact O-N 3.26Å
441	S	79.5	Confident	81.9	Confident	39 Å²	39	45 Å²	45	27%	0.273	22%	0.223	S	C	.	.			trans	-66.5	150.4	175.8	179.3	0	0	0	0	112	Y438 L439 E443 T446 R447	Y438-S441 VanDerWaalsContact O-CB 3.3Å; Y438-S441 WeakPolarHBondContact O-CB 3.21Å; Y438-S441 PolarHBondContact O-N 2.96Å; L439-S441 PolarHBondContact O-N 2.75Å; S441-E443 VanDerWaalsContact C-N 3.28Å; S441-E443 PolarHBondContact OG-N 2.79Å; S441-T446 WeakPolarHBondContact CB-OG1 3.49Å; S441-T446 PolarHBondContact OG-OG1 3.32Å; S441-R447 PolarHBondContact O-NH2 2.9Å
442	V	76.6	Confident	82.2	Confident	135 Å²	135	45.1 Å²	45.1	82%	0.818	22%	0.223	S	C	*	.	S	Bend	trans	-71.9	-25.4	178.6	-175.4	0	0	0	0	111.1
443	E	82.5	Confident	82.4	Confident	82 Å²	82	43.9 Å²	43.9	38%	0.383	22%	0.217	S	C	.	.			trans	-82.9	121.3	-177.7	-61.4	-173.6	167.6	0	0	112	K413 S441 H445 T446 R447	K413-E443 WeakPolarHBondContact CD-OE2 3.36Å; K413-E443 WeakPolarHBondContact CE-OE2 3.33Å; K413-E443 IonicContact NZ-OE1 2.65Å; K413-E443 PolarHBondContact NZ-OE1 3.19Å; K413-E443 IonicContact NZ-OE2 2.83Å; K413-E443 PolarHBondContact NZ-OE2 2.94Å; S441-E443 VanDerWaalsContact C-N 3.28Å; S441-E443 PolarHBondContact OG-N 2.79Å; E443-H445 PolarHBondContact O-N 2.74Å; E443-T446 HydrophobicContact CB-CG2 4.13Å; E443-T446 WeakPolarHBondContact CB-OG1 3.32Å; E443-T446 PolarHBondContact O-N 3.13Å; E443-T446 PolarHBondContact O-OG1 2.9Å; E443-R447 PolarHBondContact O-N 2.95Å; E443-R447 VanDerWaalsContact O-N 3.12Å
444	D	83.5	Confident	82.3	Confident	48 Å²	48	41.1 Å²	41.1	26%	0.257	20%	0.197	S	C	.	.	H	α-helix	trans	-57.5	-34.7	-178.4	-66.5	-34.7	0	0	0	113.4	R447 A448 K480	D444-R447 PolarHBondContact O-N 3.48Å; D444-A448 VanDerWaalsContact O-CB 3.29Å; D444-A448 WeakPolarHBondContact O-CB 3.32Å; D444-A448 PolarHBondContact O-N 3.38Å; D444-K480 HydrophobicContact CB-CD 4.43Å; D444-K480 IonicContact OD1-NZ 2.66Å; D444-K480 PolarHBondContact OD1-NZ 3.26Å; D444-K480 WeakPolarHBondContact OD2-CD 3.35Å; D444-K480 WeakPolarHBondContact OD2-CE 3.45Å; D444-K480 IonicContact OD2-NZ 2.68Å; D444-K480 PolarHBondContact OD2-NZ 3.39Å
445	H	83.3	Confident	82.4	Confident	36 Å²	36	39.4 Å²	39.4	17%	0.167	19%	0.189	C	C	.	.	H	α-helix	trans	-68.3	-36.8	177.5	-61.2	-70	0	0	0	112.8	E410 K413 M414 E443 G449	E410-H445 WeakPolarHBondContact O-CB 3.35Å; K413-H445 HydrophobicContact CB-CB 4.44Å; M414-H445 VanDerWaalsContact CA-O 3.3Å; M414-H445 WeakPolarHBondContact CA-O 3.41Å; M414-H445 HydrophobicContact CB-CB 4.44Å; M414-H445 WeakPolarHBondContact CB-O 3.34Å; E443-H445 PolarHBondContact O-N 2.74Å; H445-G449 PolarHBondContact O-N 2.76Å
446	T	83.2	Confident	82.6	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.006	19%	0.189	C	C	.	.	H	α-helix	trans	-71.8	-37.9	177.1	57.9	0	0	0	0	111.3	L405 K413 V417 S441 E443 G449 G450	L405-T446 HydrophobicContact CD2-CG2 4.16Å; K413-T446 HydrophobicContact CB-CG2 4.11Å; K413-T446 HydrophobicContact CD-CG2 4.33Å; V417-T446 HydrophobicContact CG2-CG2 4.46Å; S441-T446 WeakPolarHBondContact CB-OG1 3.49Å; S441-T446 PolarHBondContact OG-OG1 3.32Å; E443-T446 HydrophobicContact CB-CG2 4.13Å; E443-T446 WeakPolarHBondContact CB-OG1 3.32Å; E443-T446 PolarHBondContact O-N 3.13Å; E443-T446 PolarHBondContact O-OG1 2.9Å; T446-G449 PolarHBondContact O-N 3.47Å; T446-G450 PolarHBondContact O-N 3.09Å
447	R	83.4	Confident	82.7	Confident	64 Å²	64	36.7 Å²	36.7	24%	0.242	18%	0.175	C	C	.	.	H	α-helix	trans	-63.3	-45	172.2	-173.7	-178.8	-58.3	160	11.5	111.6	L439 S441 E443 D444 G449 G450 L451 L483	L439-R447 HydrophobicContact CD1-CG 3.81Å; L439-R447 PolarHBondContact O-NE 3.46Å; S441-R447 PolarHBondContact O-NH2 2.9Å; E443-R447 PolarHBondContact O-N 2.95Å; E443-R447 VanDerWaalsContact O-N 3.12Å; D444-R447 PolarHBondContact O-N 3.48Å; R447-G449 VanDerWaalsContact C-N 3.31Å; R447-G449 PolarHBondContact O-N 3.21Å; R447-G450 PolarHBondContact O-N 3.2Å; R447-L451 PolarHBondContact O-N 3.13Å; R447-L483 HydrophobicContact CB-CD2 4.01Å; R447-L483 HydrophobicContact CG-CD2 3.84Å
448	A	83.2	Confident	82.6	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-59.9	-41.6	174.7	0	0	0	0	0	111.9	M414 D444 G450 L451 L452 V482 L483 A486	M414-A448 HydrophobicContact CG-CB 4.3Å; M414-A448 HydrophobicContact SD-CB 4.19Å; D444-A448 VanDerWaalsContact O-CB 3.29Å; D444-A448 WeakPolarHBondContact O-CB 3.32Å; D444-A448 PolarHBondContact O-N 3.38Å; A448-G450 VanDerWaalsContact C-N 3.33Å; A448-G450 PolarHBondContact O-N 2.98Å; A448-L451 PolarHBondContact O-N 3.22Å; A448-L452 PolarHBondContact O-N 3.37Å; A448-V482 HydrophobicContact CB-CG1 3.68Å; A448-L483 HydrophobicContact CB-CD2 3.94Å; A448-A486 HydrophobicContact CB-CB 3.9Å; A448-A486 VanDerWaalsContact O-CB 3.3Å; A448-A486 WeakPolarHBondContact O-CB 3.5Å
449	G	83.5	Confident	82.3	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-64.2	-36.5	175.1	0	0	0	0	0	113	M414 V417 H445 T446 R447 G453	M414-G449 VanDerWaalsContact O-CA 3.3Å; M414-G449 WeakPolarHBondContact O-CA 3.44Å; V417-G449 VanDerWaalsContact CG1-C 3.49Å; H445-G449 PolarHBondContact O-N 2.76Å; T446-G449 PolarHBondContact O-N 3.47Å; R447-G449 VanDerWaalsContact C-N 3.31Å; R447-G449 PolarHBondContact O-N 3.21Å; G449-G453 PolarHBondContact O-N 3.36Å
450	G	84.7	Confident	81.9	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-61.9	-48	172.7	0	0	0	0	0	112.1	T446 R447 A448 L452 G453 C454	T446-G450 PolarHBondContact O-N 3.09Å; R447-G450 PolarHBondContact O-N 3.2Å; A448-G450 VanDerWaalsContact C-N 3.33Å; A448-G450 PolarHBondContact O-N 2.98Å; G450-L452 PolarHBondContact O-N 3.19Å; G450-G453 PolarHBondContact O-N 2.91Å; G450-C454 PolarHBondContact O-N 3.12Å; G450-C454 PolarHBondContact O-SG 3.41Å
451	L	85.9	Confident	81.4	Confident	1 Å²	1	21.5 Å²	21.5	1%	0.005	12%	0.118	C	C	.	.	H	α-helix	trans	-61.3	-44.6	177.5	-67.8	174.5	0	0	0	112.7	L439 R447 A448 G453 C454 G455 L472 Y475 L483	L439-L451 HydrophobicContact CD1-CD2 3.68Å; L439-L451 HydrophobicContact CD1-CG 3.92Å; R447-L451 PolarHBondContact O-N 3.13Å; A448-L451 PolarHBondContact O-N 3.22Å; L451-G453 VanDerWaalsContact C-N 3.32Å; L451-G453 PolarHBondContact O-N 3.25Å; L451-C454 WeakPolarHBondContact O-CB 3.27Å; L451-C454 PolarHBondContact O-N 3.39Å; L451-G455 PolarHBondContact O-N 2.92Å; L451-L472 HydrophobicContact CB-CD2 4.09Å; L451-L472 HydrophobicContact CD2-CD2 4.23Å; L451-Y475 HydrophobicContact CD1-CD1 4.16Å; L451-Y475 HydrophobicContact CD1-CD2 3.73Å; L451-Y475 HydrophobicContact CD1-CE2 4.33Å; L451-Y475 HydrophobicContact CD1-CG 3.66Å; L451-Y475 HydrophobicContact CD2-CD2 3.49Å; L451-Y475 VanDerWaalsContact CD2-CD2 3.49Å; L451-Y475 HydrophobicContact CD2-CE2 3.69Å; L451-Y475 HydrophobicContact CD2-CG 4.31Å; L451-Y475 HydrophobicContact CG-CD2 4.27Å; L451-L483 HydrophobicContact CD1-CD2 4.05Å
452	L	83.5	Confident	80.8	Confident	1 Å²	1	21.6 Å²	21.6	1%	0.005	11%	0.114	C	C	.	.	H	α-helix	trans	-62	-43.4	175.5	-167.2	76	0	0	0	110.8	M414 A418 A448 G450 C454 G455 V456 A486 I489 F902	M414-L452 HydrophobicContact CE-CD2 3.96Å; A418-L452 HydrophobicContact CB-CB 4.15Å; A418-L452 HydrophobicContact CB-CD2 3.61Å; A418-L452 HydrophobicContact CB-CG 4.19Å; A448-L452 PolarHBondContact O-N 3.37Å; G450-L452 PolarHBondContact O-N 3.19Å; L452-C454 VanDerWaalsContact C-N 3.31Å; L452-C454 PolarHBondContact O-N 3.24Å; L452-G455 PolarHBondContact O-N 3.21Å; L452-V456 WeakPolarHBondContact O-CG2 3.29Å; L452-V456 PolarHBondContact O-N 3.26Å; L452-A486 HydrophobicContact CB-CB 4.35Å; L452-I489 HydrophobicContact CD1-CB 3.74Å; L452-I489 HydrophobicContact CD1-CG2 3.58Å; L452-F902 HydrophobicContact CD2-CB 4.4Å; L452-F902 HydrophobicContact CD2-CD2 3.24Å; L452-F902 HydrophobicContact CD2-CE2 3.54Å; L452-F902 HydrophobicContact CD2-CG 3.82Å; L452-F902 HydrophobicContact CD2-CZ 4.33Å; L452-F902 HydrophobicContact CG-CD2 4.27Å; L452-F902 HydrophobicContact CG-CG 4.41Å
453	G	84.6	Confident	80.4	Confident	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-57.7	-41.3	174.1	0	0	0	0	0	112.5	L435 G449 G450 L451 G455 V456 V457	L435-G453 VanDerWaalsContact CD1-C 3.45Å; G449-G453 PolarHBondContact O-N 3.36Å; G450-G453 PolarHBondContact O-N 2.91Å; L451-G453 VanDerWaalsContact C-N 3.32Å; L451-G453 PolarHBondContact O-N 3.25Å; G453-G455 VanDerWaalsContact C-N 3.31Å; G453-G455 PolarHBondContact O-N 3.31Å; G453-V456 PolarHBondContact O-N 3.25Å; G453-V457 WeakPolarHBondContact O-CG2 3.14Å; G453-V457 PolarHBondContact O-N 2.9Å
454	C	82.4	Confident	79.1	Confident	4 Å²	4	20.9 Å²	20.9	3%	0.027	10%	0.103	C	C	.	.	H	α-helix	trans	-63.2	-37.4	177	-66.2	0	0	0	0	112	L432 L435 G450 L451 L452 N458	L432-C454 HydrophobicContact CD2-CB 4.3Å; L435-C454 HydrophobicContact CD1-CB 4.47Å; G450-C454 PolarHBondContact O-N 3.12Å; G450-C454 PolarHBondContact O-SG 3.41Å; L451-C454 WeakPolarHBondContact O-CB 3.27Å; L451-C454 PolarHBondContact O-N 3.39Å; L452-C454 VanDerWaalsContact C-N 3.31Å; L452-C454 PolarHBondContact O-N 3.24Å; C454-N458 PolarHBondContact O-N 3.47Å; C454-N458 PolarHBondContact O-ND2 3.19Å
455	G	81.8	Confident	78	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-67.3	-38	174.6	0	0	0	0	0	113.1	L451 L452 G453 C459 G490	L451-G455 PolarHBondContact O-N 2.92Å; L452-G455 PolarHBondContact O-N 3.21Å; G453-G455 VanDerWaalsContact C-N 3.31Å; G453-G455 PolarHBondContact O-N 3.31Å; G455-C459 PolarHBondContact O-N 3.33Å; G455-G490 WeakPolarHBondContact CA-O 3.46Å
456	V	85.4	Confident	77.1	Confident	1 Å²	1	23.7 Å²	23.7	1%	0.006	13%	0.126	C	C	.	.	H	α-helix	trans	-68.8	-41.2	177.9	170.6	0	0	0	0	111.8	W422 L425 L452 G453 N458 C459 F902 T905	W422-V456 HydrophobicContact CG-CG1 4.33Å; L425-V456 HydrophobicContact CD1-CG1 4.39Å; L425-V456 VanDerWaalsContact CD1-O 3.28Å; L425-V456 WeakPolarHBondContact CD1-O 3.5Å; L452-V456 WeakPolarHBondContact O-CG2 3.29Å; L452-V456 PolarHBondContact O-N 3.26Å; G453-V456 PolarHBondContact O-N 3.25Å; V456-N458 VanDerWaalsContact C-N 3.31Å; V456-N458 PolarHBondContact O-N 3.46Å; V456-C459 WeakPolarHBondContact O-CB 3.5Å; V456-C459 PolarHBondContact O-N 3.32Å; V456-C459 VanDerWaalsContact O-N 3.15Å; V456-F902 HydrophobicContact CG2-CB 4.32Å; V456-F902 HydrophobicContact CG2-CD1 3.85Å; V456-F902 HydrophobicContact CG2-CG 4.39Å; V456-T905 HydrophobicContact CG1-CG2 3.78Å
457	V	84.7	Confident	76.2	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-60.4	-41.9	178.2	168.3	0	0	0	0	111.5	L424 W426 D427 L435 G453 C459	L424-V457 HydrophobicContact CB-CG2 4.1Å; W426-V457 PolarHBondContact N-O 3.09Å; D427-V457 WeakPolarHBondContact O-CG1 3.49Å; L435-V457 HydrophobicContact CD1-CG2 3.68Å; G453-V457 WeakPolarHBondContact O-CG2 3.14Å; G453-V457 PolarHBondContact O-N 2.9Å; V457-C459 PolarHBondContact O-N 3.19Å
458	N	80.8	Confident	75.4	Confident	9 Å²	9	22 Å²	22	5%	0.048	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	5.2	-179.7	-64.7	-39.3	0	0	0	113.5	C454 V456 G460 V461 A494	C454-N458 PolarHBondContact O-N 3.47Å; C454-N458 PolarHBondContact O-ND2 3.19Å; V456-N458 VanDerWaalsContact C-N 3.31Å; V456-N458 PolarHBondContact O-N 3.46Å; N458-G460 PolarHBondContact O-N 3.48Å; N458-V461 PolarHBondContact O-N 3.25Å; N458-A494 HydrophobicContact CB-CB 4.21Å
459	C	74.8	Confident	74.8	Confident	4 Å²	4	23.6 Å²	23.6	3%	0.027	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	109.6	179.8	-177.9	0	0	0	0	110.8	L425 W426 G455 V456 V457 V493 T905	L425-C459 HydrophobicContact CD1-CB 4.28Å; W426-C459 PolarHBondContact NE1-O 3.35Å; G455-C459 PolarHBondContact O-N 3.33Å; V456-C459 WeakPolarHBondContact O-CB 3.5Å; V456-C459 PolarHBondContact O-N 3.32Å; V456-C459 VanDerWaalsContact O-N 3.15Å; V457-C459 PolarHBondContact O-N 3.19Å; C459-V493 HydrophobicContact CB-CG1 4.02Å; C459-T905 HydrophobicContact CB-CG2 3.77Å
460	G	70.1	Confident	74.1	Confident	14 Å²	14	27 Å²	27	14%	0.144	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.2	5.6	175	0	0	0	0	0	115.7	N327 N458	N327-G460 WeakPolarHBondContact CB-O 3.29Å; N327-G460 PolarHBondContact ND2-O 2.86Å; N327-G460 VanDerWaalsContact ND2-O 3.09Å; N458-G460 PolarHBondContact O-N 3.48Å
461	V	72.6	Confident	73.7	Confident	12 Å²	12	29.4 Å²	29.4	7%	0.073	17%	0.173	C	C	.	.			trans	-115.7	128.5	167.8	-179.3	0	0	0	0	108.1	W326 T328 W426 V428 N458	W326-V461 WeakPolarHBondContact O-CA 3.21Å; T328-V461 HydrophobicContact CG2-CG1 4Å; W426-V461 HydrophobicContact CB-CG2 3.99Å; W426-V461 HydrophobicContact CG-CG2 4.39Å; V428-V461 HydrophobicContact CG2-CB 4.31Å; V428-V461 HydrophobicContact CG2-CG1 3.92Å; N458-V461 PolarHBondContact O-N 3.25Å
462	K	66	Low	73.2	Confident	41 Å²	41	29.4 Å²	29.4	18%	0.178	17%	0.173	C	C	.	.			trans	-101	138.9	169.3	-66.2	-166.6	178	-169.7	0	108.8	V309 W326 S498	V309-K462 HydrophobicContact CB-CD 4.47Å; V309-K462 HydrophobicContact CG1-CD 4.33Å; V309-K462 HydrophobicContact CG2-CD 3.75Å; W326-K462 HydrophobicContact CB-CB 3.99Å; W326-K462 WeakPolarHBondContact CB-O 3.22Å; W326-K462 HydrophobicContact CD2-CB 4.3Å; W326-K462 HydrophobicContact CG-CB 3.73Å; W326-K462 PolarHBondContact O-N 3.47Å; W326-K462 VanDerWaalsContact O-N 3.11Å; K462-S498 PolarHBondContact NZ-O 3.14Å
463	N	68.6	Low	72.7	Confident	50 Å²	50	30.2 Å²	30.2	27%	0.267	18%	0.182	S	C	.	.			trans	-130.8	136.3	177.6	-171.7	-13.8	0	0	0	107.6	C465 D466	N463-C465 PolarHBondContact O-N 3.33Å; N463-C465 PolarHBondContact OD1-N 3.43Å; N463-D466 PolarHBondContact O-N 3.48Å
464	E	56.2	Low	72.4	Confident	152 Å²	152	33.9 Å²	33.9	71%	0.71	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-31.2	179.1	-60.2	-175.4	163.7	0	0	113	W326 D466	W326-E464 HydrophobicContact CE3-CG 4.2Å; W326-E464 HydrophobicContact CH2-CG 3.35Å; W326-E464 WeakPolarHBondContact CH2-OE1 3.46Å; W326-E464 HydrophobicContact CZ3-CB 4.49Å; W326-E464 HydrophobicContact CZ3-CG 3.13Å; W326-E464 VanDerWaalsContact CZ3-OE1 3.29Å; W326-E464 WeakPolarHBondContact CZ3-OE1 3.26Å; E464-D466 VanDerWaalsContact C-N 3.32Å; E464-D466 PolarHBondContact O-N 3.17Å
465	C	59.1	Low	72.1	Confident	105 Å²	105	36.4 Å²	36.4	71%	0.709	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.1	2.7	-178.4	-69.2	0	0	0	0	114.5	N463 P467	N463-C465 PolarHBondContact O-N 3.33Å; N463-C465 PolarHBondContact OD1-N 3.43Å; C465-P467 VanDerWaalsContact C-CD 3.41Å; C465-P467 VanDerWaalsContact C-N 3.33Å; C465-P467 WeakPolarHBondContact O-CD 3.13Å
466	D	64	Low	71.8	Confident	38 Å²	38	36.7 Å²	36.7	20%	0.203	22%	0.219	C	C	.	.			trans	21.9	59.8	177.4	-80.7	-27.7	0	0	0	115.7	N463 E464 A468 L469 A470 Y495 K500	N463-D466 PolarHBondContact O-N 3.48Å; E464-D466 VanDerWaalsContact C-N 3.32Å; E464-D466 PolarHBondContact O-N 3.17Å; D466-A468 PolarHBondContact O-N 2.96Å; D466-A468 VanDerWaalsContact O-N 3.13Å; D466-L469 HydrophobicContact CB-CB 4.41Å; D466-L469 PolarHBondContact O-N 3.23Å; D466-L469 VanDerWaalsContact O-N 3.14Å; D466-A470 PolarHBondContact O-N 3.31Å; D466-Y495 PolarHBondContact OD1-OH 3.28Å; D466-K500 IonicContact OD2-NZ 2.73Å; D466-K500 PolarHBondContact OD2-NZ 2.81Å
467	P	64.4	Low	71.4	Confident	27 Å²	27	42.8 Å²	42.8	18%	0.175	25%	0.251	C	S	.	.	H	α-helix	trans	-61.7	-29.6	-176.5	24.4	-33.5	0	0	0	111.6	V428 L432 C465 L471	V428-P467 HydrophobicContact CG1-CG 4.31Å; L432-P467 HydrophobicContact CD1-CB 3.91Å; L432-P467 HydrophobicContact CD1-CG 3.74Å; C465-P467 VanDerWaalsContact C-CD 3.41Å; C465-P467 VanDerWaalsContact C-N 3.33Å; C465-P467 WeakPolarHBondContact O-CD 3.13Å; P467-L471 VanDerWaalsContact O-CB 3.32Å; P467-L471 WeakPolarHBondContact O-CB 3.43Å; P467-L471 VanDerWaalsContact O-CG 3.25Å; P467-L471 WeakPolarHBondContact O-CG 3.41Å; P467-L471 PolarHBondContact O-N 3.17Å
468	A	67.9	Low	70.9	Confident	3 Å²	3	44.6 Å²	44.6	3%	0.025	26%	0.264	C	S	.	.	H	α-helix	trans	-63.8	-43.2	178	0	0	0	0	0	112.6	D466 L472 A494 Y495	D466-A468 PolarHBondContact O-N 2.96Å; D466-A468 VanDerWaalsContact O-N 3.13Å; A468-L472 HydrophobicContact CB-CD1 4.13Å; A468-L472 WeakPolarHBondContact O-CB 3.33Å; A468-L472 WeakPolarHBondContact O-CD1 3.48Å; A468-L472 WeakPolarHBondContact O-CG 3.43Å; A468-L472 PolarHBondContact O-N 3.29Å; A468-A494 HydrophobicContact CB-CB 4.31Å; A468-Y495 HydrophobicContact CB-CE2 4.32Å
469	L	70.1	Confident	70.4	Confident	34 Å²	34	51.7 Å²	51.7	18%	0.178	30%	0.302	C	S	.	.	H	α-helix	trans	-70.8	-44.1	-177.3	-167.3	150.1	0	0	0	110.6	D466 G473 Y495 K500 E502	D466-L469 HydrophobicContact CB-CB 4.41Å; D466-L469 PolarHBondContact O-N 3.23Å; D466-L469 VanDerWaalsContact O-N 3.14Å; L469-G473 WeakPolarHBondContact O-CA 2.68Å; L469-G473 PolarHBondContact O-N 3Å; L469-Y495 HydrophobicContact CB-CE2 4.14Å; L469-Y495 WeakPolarHBondContact CB-OH 3.17Å; L469-Y495 PolarHBondContact N-OH 2.93Å; L469-K500 HydrophobicContact CD1-CD 4.19Å; L469-E502 HydrophobicContact CD1-CB 3.81Å
470	A	69.1	Low	70.6	Confident	72 Å²	72	55.9 Å²	55.9	60%	0.595	32%	0.32	S	S	*	.	H	α-helix	trans	-63	-44.1	179.6	0	0	0	0	0	112.4	D466	D466-A470 PolarHBondContact O-N 3.31Å
471	L	75.4	Confident	70.9	Confident	50 Å²	50	58.9 Å²	58.9	26%	0.262	33%	0.332	S	S	.	.	H	α-helix	trans	-72.2	-55.3	178.5	-68.1	171.2	0	0	0	110.8	P467 S474 Y475	P467-L471 VanDerWaalsContact O-CB 3.32Å; P467-L471 WeakPolarHBondContact O-CB 3.43Å; P467-L471 VanDerWaalsContact O-CG 3.25Å; P467-L471 WeakPolarHBondContact O-CG 3.41Å; P467-L471 PolarHBondContact O-N 3.17Å; L471-S474 PolarHBondContact O-N 3.01Å; L471-S474 PolarHBondContact O-OG 2.91Å; L471-Y475 WeakPolarHBondContact O-CD2 3.44Å
472	L	75.7	Confident	71.3	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-70.1	-38.2	-171.1	-59.9	167.6	0	0	0	112	L451 A468 S474 Y475 V476 A487 L491	L451-L472 HydrophobicContact CB-CD2 4.09Å; L451-L472 HydrophobicContact CD2-CD2 4.23Å; A468-L472 HydrophobicContact CB-CD1 4.13Å; A468-L472 WeakPolarHBondContact O-CB 3.33Å; A468-L472 WeakPolarHBondContact O-CD1 3.48Å; A468-L472 WeakPolarHBondContact O-CG 3.43Å; A468-L472 PolarHBondContact O-N 3.29Å; L472-S474 PolarHBondContact O-N 3.33Å; L472-Y475 PolarHBondContact O-N 3.41Å; L472-V476 WeakPolarHBondContact O-CG2 3.17Å; L472-V476 PolarHBondContact O-N 2.98Å; L472-V476 VanDerWaalsContact O-N 3.12Å; L472-A487 HydrophobicContact CD2-CB 4.28Å; L472-L491 HydrophobicContact CB-CD1 4.22Å; L472-L491 HydrophobicContact CD1-CB 4.22Å; L472-L491 HydrophobicContact CD1-CD1 4.24Å
473	G	73.9	Confident	72.1	Confident	18 Å²	18	57.6 Å²	57.6	19%	0.186	33%	0.327	C	S	.	.	H	α-helix	trans	-56	-36.1	179.6	0	0	0	0	0	113	L469 Y475	L469-G473 WeakPolarHBondContact O-CA 2.68Å; L469-G473 PolarHBondContact O-N 3Å; G473-Y475 PolarHBondContact O-N 2.96Å
474	S	78	Confident	72.7	Confident	77 Å²	77	55.5 Å²	55.5	54%	0.538	32%	0.317	S	S	.	.	H	α-helix	trans	-71.3	-26.1	176.6	72.7	0	0	0	0	114.4	L471 L472	L471-S474 PolarHBondContact O-N 3.01Å; L471-S474 PolarHBondContact O-OG 2.91Å; L472-S474 PolarHBondContact O-N 3.33Å
475	Y	75.8	Confident	73.8	Confident	57 Å²	57	49.5 Å²	49.5	22%	0.224	29%	0.288	C	S	.	.	H	α-helix	trans	-95.8	-11.5	-177	-69.1	-69.4	0	0	0	113.8	L451 L471 L472 G473 D477 S478	L451-Y475 HydrophobicContact CD1-CD1 4.16Å; L451-Y475 HydrophobicContact CD1-CD2 3.73Å; L451-Y475 HydrophobicContact CD1-CE2 4.33Å; L451-Y475 HydrophobicContact CD1-CG 3.66Å; L451-Y475 HydrophobicContact CD2-CD2 3.49Å; L451-Y475 VanDerWaalsContact CD2-CD2 3.49Å; L451-Y475 HydrophobicContact CD2-CE2 3.69Å; L451-Y475 HydrophobicContact CD2-CG 4.31Å; L451-Y475 HydrophobicContact CG-CD2 4.27Å; L471-Y475 WeakPolarHBondContact O-CD2 3.44Å; L472-Y475 PolarHBondContact O-N 3.41Å; G473-Y475 PolarHBondContact O-N 2.96Å; Y475-D477 VanDerWaalsContact C-N 3.26Å; Y475-D477 PolarHBondContact O-N 3.26Å; Y475-S478 WeakPolarHBondContact O-CB 3.47Å; Y475-S478 PolarHBondContact O-N 3.4Å
476	V	75.5	Confident	75	Confident	7 Å²	7	44.5 Å²	44.5	4%	0.042	25%	0.254	C	S	.	.	H	α-helix	trans	-61.7	-37.7	175.1	171.8	0	0	0	0	110.9	L472 S478 A487 I488 T506 V510	L472-V476 WeakPolarHBondContact O-CG2 3.17Å; L472-V476 PolarHBondContact O-N 2.98Å; L472-V476 VanDerWaalsContact O-N 3.12Å; V476-S478 VanDerWaalsContact C-N 3.33Å; V476-S478 PolarHBondContact O-N 3.06Å; V476-A487 HydrophobicContact CG2-CB 4.07Å; V476-I488 HydrophobicContact CG1-CG1 4.38Å; V476-I488 HydrophobicContact CG2-CG1 4.49Å; V476-T506 HydrophobicContact CB-CG2 4.49Å; V476-T506 HydrophobicContact CG2-CG2 4.37Å; V476-V510 HydrophobicContact CG1-CG2 3.37Å
477	D	76.4	Confident	75.9	Confident	128 Å²	128	42.7 Å²	42.7	68%	0.684	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.5	2.7	179.9	-66.8	-26.2	0	0	0	114.2	Y475 D479	Y475-D477 VanDerWaalsContact C-N 3.26Å; Y475-D477 PolarHBondContact O-N 3.26Å; D477-D479 PolarHBondContact O-N 2.82Å
478	S	75.6	Confident	77	Confident	38 Å²	38	41.4 Å²	41.4	27%	0.266	24%	0.236	S	C	.	.			trans	-67.3	135.1	-176	-172.2	0	0	0	0	112.5	Y475 V476 K480	Y475-S478 WeakPolarHBondContact O-CB 3.47Å; Y475-S478 PolarHBondContact O-N 3.4Å; V476-S478 VanDerWaalsContact C-N 3.33Å; V476-S478 PolarHBondContact O-N 3.06Å; S478-K480 PolarHBondContact O-N 2.89Å
479	D	68.4	Low	77.8	Confident	159 Å²	159	41.3 Å²	41.3	85%	0.85	24%	0.235	S	C	*	.	S	Bend	trans	-57.8	-17.7	176.5	-63.4	-35.6	0	0	0	114.2	D477	D477-D479 PolarHBondContact O-N 2.82Å
480	K	78.9	Confident	78.4	Confident	92 Å²	92	39.7 Å²	39.7	40%	0.4	23%	0.226	S	C	.	.			trans	-87.8	112.6	-179.9	-61.5	-168.3	-176.4	-170.4	0	110.8	D444 S478 V482 L483 S484	D444-K480 HydrophobicContact CB-CD 4.43Å; D444-K480 IonicContact OD1-NZ 2.66Å; D444-K480 PolarHBondContact OD1-NZ 3.26Å; D444-K480 WeakPolarHBondContact OD2-CD 3.35Å; D444-K480 WeakPolarHBondContact OD2-CE 3.45Å; D444-K480 IonicContact OD2-NZ 2.68Å; D444-K480 PolarHBondContact OD2-NZ 3.39Å; S478-K480 PolarHBondContact O-N 2.89Å; K480-V482 PolarHBondContact O-N 2.77Å; K480-L483 HydrophobicContact CB-CB 4.39Å; K480-L483 HydrophobicContact CB-CD1 4.04Å; K480-L483 HydrophobicContact CB-CG 4.23Å; K480-L483 HydrophobicContact CD-CD1 4.03Å; K480-L483 HydrophobicContact CG-CD1 4.45Å; K480-L483 PolarHBondContact O-N 3.32Å; K480-S484 PolarHBondContact O-N 3.47Å; K480-S484 PolarHBondContact O-OG 3.18Å
481	D	76.8	Confident	79.1	Confident	77 Å²	77	36.3 Å²	36.3	41%	0.412	20%	0.198	S	C	.	.	H	α-helix	trans	-51.7	-30.6	-178.7	-67.5	-24.6	0	0	0	115.3	S484 R485 H521	D481-S484 PolarHBondContact O-OG 3.36Å; D481-R485 WeakPolarHBondContact O-CB 3.45Å; D481-R485 WeakPolarHBondContact O-CG 3.47Å; D481-R485 PolarHBondContact O-N 3.43Å; D481-R485 PolarHBondContact O-NE 3.5Å; D481-H521 WeakPolarHBondContact CA-NE2 3.18Å; D481-H521 PolarHBondContact O-NE2 3.01Å; D481-H521 VanDerWaalsContact O-NE2 3.13Å; D481-H521 IonicContact OD1-CE1 3.33Å; D481-H521 PolarHBondContact OD1-CE1 3.45Å; D481-H521 IonicContact OD1-NE2 3.92Å
482	V	81.4	Confident	79.4	Confident	22 Å²	22	33.9 Å²	33.9	13%	0.133	19%	0.186	C	C	.	.	H	α-helix	trans	-76.8	-38.7	-178.9	-173.4	0	0	0	0	111.3	M414 A448 K480 A486	M414-V482 HydrophobicContact SD-CG1 4.05Å; A448-V482 HydrophobicContact CB-CG1 3.68Å; K480-V482 PolarHBondContact O-N 2.77Å; V482-A486 WeakPolarHBondContact O-CB 3.4Å; V482-A486 PolarHBondContact O-N 3Å; V482-A486 VanDerWaalsContact O-N 3.13Å
483	L	82.8	Confident	79.7	Confident	3 Å²	3	34 Å²	34	2%	0.016	19%	0.186	C	C	.	.	H	α-helix	trans	-70.8	-45.6	-179.5	-68.4	175.4	0	0	0	110.8	R447 A448 L451 K480 R485 A486 A487	R447-L483 HydrophobicContact CB-CD2 4.01Å; R447-L483 HydrophobicContact CG-CD2 3.84Å; A448-L483 HydrophobicContact CB-CD2 3.94Å; L451-L483 HydrophobicContact CD1-CD2 4.05Å; K480-L483 HydrophobicContact CB-CB 4.39Å; K480-L483 HydrophobicContact CB-CD1 4.04Å; K480-L483 HydrophobicContact CB-CG 4.23Å; K480-L483 HydrophobicContact CD-CD1 4.03Å; K480-L483 HydrophobicContact CG-CD1 4.45Å; K480-L483 PolarHBondContact O-N 3.32Å; L483-R485 PolarHBondContact O-N 3.39Å; L483-A486 PolarHBondContact O-N 3.01Å; L483-A487 WeakPolarHBondContact O-CB 3.23Å; L483-A487 PolarHBondContact O-N 3.13Å
484	S	81.4	Confident	80.1	Confident	6 Å²	6	33.7 Å²	33.7	4%	0.042	18%	0.182	C	C	.	.	H	α-helix	trans	-63.3	-41.4	178.1	48.6	0	0	0	0	111.9	K480 D481 A486 A487 I488 H521	K480-S484 PolarHBondContact O-N 3.47Å; K480-S484 PolarHBondContact O-OG 3.18Å; D481-S484 PolarHBondContact O-OG 3.36Å; S484-A486 PolarHBondContact O-N 3.21Å; S484-A487 PolarHBondContact O-N 2.68Å; S484-I488 WeakPolarHBondContact O-CD1 3.48Å; S484-I488 WeakPolarHBondContact O-CG1 3.48Å; S484-I488 PolarHBondContact O-N 3.34Å; S484-H521 PolarHBondContact OG-CD2 2.98Å; S484-H521 PolarHBondContact OG-NE2 2.67Å
485	R	79.8	Confident	80.2	Confident	26 Å²	26	30.6 Å²	30.6	10%	0.098	16%	0.159	C	C	.	.	H	α-helix	trans	-60	-46.2	173	-76.2	-178.5	-65.4	-172.3	2.2	112.5	D481 L483 A487 I489 L524	D481-R485 WeakPolarHBondContact O-CB 3.45Å; D481-R485 WeakPolarHBondContact O-CG 3.47Å; D481-R485 PolarHBondContact O-N 3.43Å; D481-R485 PolarHBondContact O-NE 3.5Å; L483-R485 PolarHBondContact O-N 3.39Å; R485-A487 VanDerWaalsContact C-N 3.34Å; R485-I489 VanDerWaalsContact O-CG1 3.24Å; R485-I489 WeakPolarHBondContact O-CG1 3.42Å; R485-I489 PolarHBondContact O-N 3.29Å; R485-L524 HydrophobicContact CB-CD1 4.41Å; R485-L524 HydrophobicContact CG-CD1 3.99Å
486	A	83.1	Confident	80.2	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-64.7	-39.2	178.7	0	0	0	0	0	112.2	M414 A448 L452 V482 L483 S484 G490	M414-A486 HydrophobicContact CE-CB 3.73Å; A448-A486 HydrophobicContact CB-CB 3.9Å; A448-A486 VanDerWaalsContact O-CB 3.3Å; A448-A486 WeakPolarHBondContact O-CB 3.5Å; L452-A486 HydrophobicContact CB-CB 4.35Å; V482-A486 WeakPolarHBondContact O-CB 3.4Å; V482-A486 PolarHBondContact O-N 3Å; V482-A486 VanDerWaalsContact O-N 3.13Å; L483-A486 PolarHBondContact O-N 3.01Å; S484-A486 PolarHBondContact O-N 3.21Å; A486-G490 PolarHBondContact O-N 3.43Å
487	A	84.5	Confident	80.1	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-65.9	-45.1	179.3	0	0	0	0	0	112.3	L472 V476 L483 S484 R485 I489 G490 L491	L472-A487 HydrophobicContact CD2-CB 4.28Å; V476-A487 HydrophobicContact CG2-CB 4.07Å; L483-A487 WeakPolarHBondContact O-CB 3.23Å; L483-A487 PolarHBondContact O-N 3.13Å; S484-A487 PolarHBondContact O-N 2.68Å; R485-A487 VanDerWaalsContact C-N 3.34Å; A487-I489 PolarHBondContact O-N 2.92Å; A487-G490 PolarHBondContact O-N 3.39Å; A487-L491 WeakPolarHBondContact O-CB 3.37Å; A487-L491 PolarHBondContact O-N 3.19Å
488	I	86.1	Confident	80	Confident	1 Å²	1	22.9 Å²	22.9	1%	0.005	13%	0.127	C	C	.	.	H	α-helix	trans	-61.7	-43.7	178.4	-68.2	161.8	0	0	0	111.4	V476 S484 G492 L507 V510 H521 L524 A525 S528	V476-I488 HydrophobicContact CG1-CG1 4.38Å; V476-I488 HydrophobicContact CG2-CG1 4.49Å; S484-I488 WeakPolarHBondContact O-CD1 3.48Å; S484-I488 WeakPolarHBondContact O-CG1 3.48Å; S484-I488 PolarHBondContact O-N 3.34Å; I488-G492 PolarHBondContact O-N 3.43Å; I488-L507 HydrophobicContact CG1-CD2 4.35Å; I488-L507 HydrophobicContact CG2-CD2 4.11Å; I488-V510 HydrophobicContact CD1-CG1 3.91Å; I488-H521 HydrophobicContact CD1-CB 4.14Å; I488-L524 HydrophobicContact CG2-CB 4.2Å; I488-A525 HydrophobicContact CD1-CB 4.47Å; I488-A525 HydrophobicContact CG2-CB 4.07Å; I488-S528 WeakPolarHBondContact O-CB 3.33Å; I488-S528 PolarHBondContact O-OG 2.83Å
489	I	84.3	Confident	79.8	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-68.9	-45.1	178.4	-61.4	173.4	0	0	0	110.1	L452 R485 A487 L491 G492 V493 L524 Y899 Y903	L452-I489 HydrophobicContact CD1-CB 3.74Å; L452-I489 HydrophobicContact CD1-CG2 3.58Å; R485-I489 VanDerWaalsContact O-CG1 3.24Å; R485-I489 WeakPolarHBondContact O-CG1 3.42Å; R485-I489 PolarHBondContact O-N 3.29Å; A487-I489 PolarHBondContact O-N 2.92Å; I489-L491 VanDerWaalsContact C-N 3.27Å; I489-L491 PolarHBondContact O-N 3.29Å; I489-G492 PolarHBondContact O-N 3.45Å; I489-V493 HydrophobicContact CG2-CG2 4.25Å; I489-V493 WeakPolarHBondContact O-CG2 3.24Å; I489-V493 PolarHBondContact O-N 3.07Å; I489-L524 HydrophobicContact CD1-CD1 4.28Å; I489-L524 HydrophobicContact CD1-CD2 4.38Å; I489-L524 HydrophobicContact CG1-CD2 4.49Å; I489-Y899 HydrophobicContact CD1-CD2 3.25Å; I489-Y899 HydrophobicContact CD1-CE2 3.39Å; I489-Y899 HydrophobicContact CD1-CG 4.36Å; I489-Y903 HydrophobicContact CD1-CE2 4.41Å; I489-Y903 HydrophobicContact CG1-CE2 4.25Å; I489-Y903 WeakPolarHBondContact CG1-OH 3.4Å; I489-Y903 HydrophobicContact CG2-CD1 4.46Å; I489-Y903 HydrophobicContact CG2-CE1 3.97Å; I489-Y903 HydrophobicContact CG2-CE2 4.13Å
490	G	83.9	Confident	79.9	Confident	0 Å²	0	20 Å²	20	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-57.8	-40.1	177	0	0	0	0	0	112.4	G455 A486 A487 A494	G455-G490 WeakPolarHBondContact CA-O 3.46Å; A486-G490 PolarHBondContact O-N 3.43Å; A487-G490 PolarHBondContact O-N 3.39Å; G490-A494 VanDerWaalsContact O-CB 3.26Å; G490-A494 WeakPolarHBondContact O-CB 3.45Å; G490-A494 PolarHBondContact O-N 2.95Å
491	L	83.7	Confident	79.7	Confident	1 Å²	1	19.1 Å²	19.1	1%	0.005	11%	0.114	C	C	.	.	H	α-helix	trans	-69.1	-43.6	178.4	-167	77	0	0	0	111.2	L472 A487 I489 Y495 A503 L507	L472-L491 HydrophobicContact CB-CD1 4.22Å; L472-L491 HydrophobicContact CD1-CB 4.22Å; L472-L491 HydrophobicContact CD1-CD1 4.24Å; A487-L491 WeakPolarHBondContact O-CB 3.37Å; A487-L491 PolarHBondContact O-N 3.19Å; I489-L491 VanDerWaalsContact C-N 3.27Å; I489-L491 PolarHBondContact O-N 3.29Å; L491-Y495 HydrophobicContact CD1-CD2 3.63Å; L491-Y495 HydrophobicContact CD1-CE2 3.61Å; L491-Y495 HydrophobicContact CG-CD2 4.04Å; L491-Y495 WeakPolarHBondContact O-CB 3.17Å; L491-Y495 PolarHBondContact O-N 2.89Å; L491-A503 HydrophobicContact CD2-CB 4.37Å; L491-A503 HydrophobicContact CG-CB 4.47Å; L491-L507 HydrophobicContact CD2-CD1 4.11Å; L491-L507 HydrophobicContact CD2-CD2 3.96Å; L491-L507 HydrophobicContact CD2-CG 3.82Å
492	G	82.1	Confident	79.7	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-64.3	-38.3	177.5	0	0	0	0	0	113.4	I488 I489 A496	I488-G492 PolarHBondContact O-N 3.43Å; I489-G492 PolarHBondContact O-N 3.45Å; G492-A496 PolarHBondContact O-N 2.84Å
493	V	82.5	Confident	79.4	Confident	1 Å²	1	19.1 Å²	19.1	1%	0.006	11%	0.11	C	C	.	.	H	α-helix	trans	-74.3	-41	178	172.6	0	0	0	0	111.7	C459 I489 Y903 T905 P906	C459-V493 HydrophobicContact CB-CG1 4.02Å; I489-V493 HydrophobicContact CG2-CG2 4.25Å; I489-V493 WeakPolarHBondContact O-CG2 3.24Å; I489-V493 PolarHBondContact O-N 3.07Å; V493-Y903 HydrophobicContact CG2-CD1 3.85Å; V493-Y903 HydrophobicContact CG2-CE1 4.23Å; V493-T905 HydrophobicContact CG1-CG2 4.41Å; V493-P906 HydrophobicContact CG1-CG 4.17Å
494	A	81.8	Confident	79.2	Confident	12 Å²	12	19.4 Å²	19.4	10%	0.099	11%	0.111	C	C	.	.	H	α-helix	trans	-64.1	-44.7	178.4	0	0	0	0	0	112	N458 A468 G490	N458-A494 HydrophobicContact CB-CB 4.21Å; A468-A494 HydrophobicContact CB-CB 4.31Å; G490-A494 VanDerWaalsContact O-CB 3.26Å; G490-A494 WeakPolarHBondContact O-CB 3.45Å; G490-A494 PolarHBondContact O-N 2.95Å
495	Y	79.2	Confident	79.2	Confident	12 Å²	12	22.5 Å²	22.5	5%	0.047	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	19.7	-174	-69.6	-63.2	0	0	0	114.4	D466 A468 L469 L491 G497 S498 K500 A503	D466-Y495 PolarHBondContact OD1-OH 3.28Å; A468-Y495 HydrophobicContact CB-CE2 4.32Å; L469-Y495 HydrophobicContact CB-CE2 4.14Å; L469-Y495 WeakPolarHBondContact CB-OH 3.17Å; L469-Y495 PolarHBondContact N-OH 2.93Å; L491-Y495 HydrophobicContact CD1-CD2 3.63Å; L491-Y495 HydrophobicContact CD1-CE2 3.61Å; L491-Y495 HydrophobicContact CG-CD2 4.04Å; L491-Y495 WeakPolarHBondContact O-CB 3.17Å; L491-Y495 PolarHBondContact O-N 2.89Å; Y495-G497 PolarHBondContact O-N 3.35Å; Y495-S498 WeakPolarHBondContact CA-OG 3.17Å; Y495-S498 WeakPolarHBondContact CB-OG 3.34Å; Y495-S498 WeakPolarHBondContact O-CB 3.49Å; Y495-S498 PolarHBondContact O-N 3.39Å; Y495-S498 VanDerWaalsContact O-N 3.12Å; Y495-S498 PolarHBondContact O-OG 3.28Å; Y495-K500 HydrophobicContact CE1-CD 4.29Å; Y495-A503 HydrophobicContact CD2-CB 3.98Å; Y495-A503 HydrophobicContact CG-CB 4.24Å
496	A	77.1	Confident	79.1	Confident	5 Å²	5	23.1 Å²	23.1	4%	0.041	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	120.4	-179.1	0	0	0	0	0	112	G492 S498 L531 V874 P906	G492-A496 PolarHBondContact O-N 2.84Å; A496-S498 VanDerWaalsContact C-N 3.27Å; A496-S498 PolarHBondContact O-N 3.31Å; A496-L531 WeakPolarHBondContact CA-O 3.4Å; A496-V874 HydrophobicContact CB-CG1 3.61Å; A496-P906 HydrophobicContact CB-CB 4.29Å; A496-P906 HydrophobicContact CB-CG 4.21Å
497	G	73.4	Confident	78.9	Confident	17 Å²	17	23.1 Å²	23.1	18%	0.175	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	76	0.5	-178.4	0	0	0	0	0	116.3	Y495 L531	Y495-G497 PolarHBondContact O-N 3.35Å; G497-L531 PolarHBondContact N-O 3.48Å
498	S	73.1	Confident	78.8	Confident	9 Å²	9	24.6 Å²	24.6	6%	0.063	15%	0.149	C	C	.	.			trans	-80.5	-14.5	-172.1	69.2	0	0	0	0	115.5	K462 Y495 A496 K500	K462-S498 PolarHBondContact NZ-O 3.14Å; Y495-S498 WeakPolarHBondContact CA-OG 3.17Å; Y495-S498 WeakPolarHBondContact CB-OG 3.34Å; Y495-S498 WeakPolarHBondContact O-CB 3.49Å; Y495-S498 PolarHBondContact O-N 3.39Å; Y495-S498 VanDerWaalsContact O-N 3.12Å; Y495-S498 PolarHBondContact O-OG 3.28Å; A496-S498 VanDerWaalsContact C-N 3.27Å; A496-S498 PolarHBondContact O-N 3.31Å; S498-K500 PolarHBondContact O-N 3.49Å; S498-K500 VanDerWaalsContact O-N 3.09Å
499	M	71	Confident	78.4	Confident	82 Å²	82	28.2 Å²	28.2	40%	0.404	17%	0.172	S	C	.	.			trans	45.5	33.8	-174.1	-157.9	173.5	177.1	0	0	114.8	A501 I532 S536 D538	M499-A501 PolarHBondContact O-N 3.49Å; M499-I532 PolarHBondContact N-O 3.09Å; M499-S536 VanDerWaalsContact SD-CB 3.6Å; M499-D538 HydrophobicContact CE-CB 4.29Å
500	K	71.7	Confident	78.1	Confident	53 Å²	53	29.1 Å²	29.1	23%	0.23	18%	0.178	C	C	.	.			trans	-73.3	114.5	178.1	-163.8	175.8	-169.8	-169.8	0	110.9	D466 L469 Y495 S498 E502 A503 I504	D466-K500 IonicContact OD2-NZ 2.73Å; D466-K500 PolarHBondContact OD2-NZ 2.81Å; L469-K500 HydrophobicContact CD1-CD 4.19Å; Y495-K500 HydrophobicContact CE1-CD 4.29Å; S498-K500 PolarHBondContact O-N 3.49Å; S498-K500 VanDerWaalsContact O-N 3.09Å; K500-E502 VanDerWaalsContact C-N 3.26Å; K500-E502 WeakPolarHBondContact CE-OE2 3.12Å; K500-E502 HydrophobicContact CG-CB 4.39Å; K500-E502 IonicContact NZ-OE2 2.72Å; K500-E502 PolarHBondContact NZ-OE2 3.44Å; K500-E502 PolarHBondContact O-N 3.4Å; K500-A503 HydrophobicContact CB-CB 4.45Å; K500-A503 PolarHBondContact O-N 3.47Å; K500-A503 VanDerWaalsContact O-N 3.16Å; K500-I504 PolarHBondContact O-N 2.92Å
501	A	75	Confident	77.8	Confident	74 Å²	74	29.1 Å²	29.1	61%	0.612	18%	0.178	S	C	*	.	H	α-helix	trans	-58	-35.3	-178.4	0	0	0	0	0	113.3	M499 A503 I504 S505	M499-A501 PolarHBondContact O-N 3.49Å; A501-A503 PolarHBondContact O-N 3.45Å; A501-I504 PolarHBondContact O-N 3.08Å; A501-S505 PolarHBondContact O-N 2.95Å; A501-S505 PolarHBondContact O-OG 2.93Å
502	E	75.8	Confident	77.5	Confident	100 Å²	100	32 Å²	32	47%	0.467	19%	0.193	S	C	.	.	H	α-helix	trans	-64.6	-37.7	178.8	-62.1	-179.6	164	0	0	113.1	L469 K500 S505 T506	L469-E502 HydrophobicContact CD1-CB 3.81Å; K500-E502 VanDerWaalsContact C-N 3.26Å; K500-E502 WeakPolarHBondContact CE-OE2 3.12Å; K500-E502 HydrophobicContact CG-CB 4.39Å; K500-E502 IonicContact NZ-OE2 2.72Å; K500-E502 PolarHBondContact NZ-OE2 3.44Å; K500-E502 PolarHBondContact O-N 3.4Å; E502-S505 WeakPolarHBondContact CA-OG 3.22Å; E502-S505 PolarHBondContact O-N 2.89Å; E502-S505 PolarHBondContact O-OG 3.48Å; E502-T506 PolarHBondContact O-N 3.18Å; E502-T506 VanDerWaalsContact O-N 3.09Å; E502-T506 PolarHBondContact O-OG1 3.46Å
503	A	74.9	Confident	77.2	Confident	0 Å²	0	34 Å²	34	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-70	-39.8	176.8	0	0	0	0	0	110.6	L491 Y495 K500 A501 T506 L507 I532	L491-A503 HydrophobicContact CD2-CB 4.37Å; L491-A503 HydrophobicContact CG-CB 4.47Å; Y495-A503 HydrophobicContact CD2-CB 3.98Å; Y495-A503 HydrophobicContact CG-CB 4.24Å; K500-A503 HydrophobicContact CB-CB 4.45Å; K500-A503 PolarHBondContact O-N 3.47Å; K500-A503 VanDerWaalsContact O-N 3.16Å; A501-A503 PolarHBondContact O-N 3.45Å; A503-T506 PolarHBondContact O-N 3.33Å; A503-L507 WeakPolarHBondContact O-CG 3.45Å; A503-L507 PolarHBondContact O-N 3.31Å; A503-I532 HydrophobicContact CB-CD1 4.06Å
504	I	78.9	Confident	76.3	Confident	8 Å²	8	38 Å²	38	4%	0.041	23%	0.228	C	C	.	.	H	α-helix	trans	-62.7	-47.3	173.8	-64.3	170.9	0	0	0	110	K500 A501 T506 L507 T508 I532 V541	K500-I504 PolarHBondContact O-N 2.92Å; A501-I504 PolarHBondContact O-N 3.08Å; I504-T506 PolarHBondContact O-N 3.39Å; I504-L507 PolarHBondContact O-N 3.1Å; I504-T508 PolarHBondContact O-N 3.44Å; I504-T508 PolarHBondContact O-OG1 3.39Å; I504-I532 HydrophobicContact CD1-CG2 4.17Å; I504-I532 HydrophobicContact CG1-CG2 3.89Å; I504-V541 HydrophobicContact CD1-CG2 4.11Å; I504-V541 HydrophobicContact CG1-CG2 4.3Å; I504-V541 HydrophobicContact CG2-CG2 3.58Å
505	S	81.1	Confident	75.7	Confident	71 Å²	71	42 Å²	42	50%	0.497	25%	0.248	S	C	.	.	H	α-helix	trans	-63.6	-26.8	179.8	62.9	0	0	0	0	113.6	A501 E502 P509	A501-S505 PolarHBondContact O-N 2.95Å; A501-S505 PolarHBondContact O-OG 2.93Å; E502-S505 WeakPolarHBondContact CA-OG 3.22Å; E502-S505 PolarHBondContact O-N 2.89Å; E502-S505 PolarHBondContact O-OG 3.48Å; S505-P509 WeakPolarHBondContact O-CD 3.41Å
506	T	78.8	Confident	74.7	Confident	39 Å²	39	46.2 Å²	46.2	24%	0.239	28%	0.275	C	S	.	.	H	α-helix	trans	-74.8	-31.4	174.4	-53.3	0	0	0	0	111.5	V476 E502 A503 I504	V476-T506 HydrophobicContact CB-CG2 4.49Å; V476-T506 HydrophobicContact CG2-CG2 4.37Å; E502-T506 PolarHBondContact O-N 3.18Å; E502-T506 VanDerWaalsContact O-N 3.09Å; E502-T506 PolarHBondContact O-OG1 3.46Å; A503-T506 PolarHBondContact O-N 3.33Å; I504-T506 PolarHBondContact O-N 3.39Å
507	L	78.5	Confident	73.8	Confident	0 Å²	0	50 Å²	50	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-85.1	-30.5	179.1	-67.9	174.2	0	0	0	113.3	I488 L491 A503 I504 V510 I511 A525 A529 I532	I488-L507 HydrophobicContact CG1-CD2 4.35Å; I488-L507 HydrophobicContact CG2-CD2 4.11Å; L491-L507 HydrophobicContact CD2-CD1 4.11Å; L491-L507 HydrophobicContact CD2-CD2 3.96Å; L491-L507 HydrophobicContact CD2-CG 3.82Å; A503-L507 WeakPolarHBondContact O-CG 3.45Å; A503-L507 PolarHBondContact O-N 3.31Å; I504-L507 PolarHBondContact O-N 3.1Å; L507-V510 WeakPolarHBondContact O-CB 3.38Å; L507-V510 PolarHBondContact O-N 3.42Å; L507-I511 WeakPolarHBondContact O-CG1 3.46Å; L507-I511 PolarHBondContact O-N 3.11Å; L507-I511 VanDerWaalsContact O-N 3.13Å; L507-A525 HydrophobicContact CD2-CB 4.38Å; L507-A529 HydrophobicContact CD1-CB 4.19Å; L507-I532 HydrophobicContact CD1-CD1 3.61Å
508	T	81.6	Confident	73.5	Confident	31 Å²	31	53.2 Å²	53.2	19%	0.19	32%	0.316	C	S	.	.	H	α-helix	trans	-53.5	-45.5	-178.3	-60.2	0	0	0	0	113.6	I504 V510 I511 L512 T544	I504-T508 PolarHBondContact O-N 3.44Å; I504-T508 PolarHBondContact O-OG1 3.39Å; T508-V510 VanDerWaalsContact C-N 3.27Å; T508-V510 PolarHBondContact O-N 3.32Å; T508-I511 PolarHBondContact O-N 3.36Å; T508-L512 HydrophobicContact CG2-CD1 4.27Å; T508-L512 PolarHBondContact O-N 3.47Å; T508-T544 HydrophobicContact CG2-CG2 3.66Å
509	P	78.8	Confident	73.4	Confident	77 Å²	77	53.6 Å²	53.6	50%	0.5	32%	0.317	S	S	.	.	H	α-helix	trans	-60.6	-34.4	175.8	-23.9	33.9	0	0	0	113.4	S505 L512 D513	S505-P509 WeakPolarHBondContact O-CD 3.41Å; P509-L512 PolarHBondContact O-N 3.38Å; P509-D513 PolarHBondContact O-N 2.86Å
510	V	77.6	Confident	73.6	Confident	19 Å²	19	52.1 Å²	52.1	12%	0.115	31%	0.309	C	S	.	.	H	α-helix	trans	-72.2	-31.9	-179.8	-173.4	0	0	0	0	111.6	V476 I488 L507 T508 L512 H521 A525	V476-V510 HydrophobicContact CG1-CG2 3.37Å; I488-V510 HydrophobicContact CD1-CG1 3.91Å; L507-V510 WeakPolarHBondContact O-CB 3.38Å; L507-V510 PolarHBondContact O-N 3.42Å; T508-V510 VanDerWaalsContact C-N 3.27Å; T508-V510 PolarHBondContact O-N 3.32Å; V510-L512 VanDerWaalsContact C-N 3.34Å; V510-H521 HydrophobicContact CG1-CB 4.45Å; V510-A525 HydrophobicContact CB-CB 3.95Å; V510-A525 HydrophobicContact CG1-CB 3.68Å
511	I	77.7	Confident	73.8	Confident	1 Å²	1	50 Å²	50	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-70.2	-34.4	178	-65.4	167.9	0	0	0	111.2	L507 T508 A525 A526 A529 S548	L507-I511 WeakPolarHBondContact O-CG1 3.46Å; L507-I511 PolarHBondContact O-N 3.11Å; L507-I511 VanDerWaalsContact O-N 3.13Å; T508-I511 PolarHBondContact O-N 3.36Å; I511-A525 HydrophobicContact CG1-CB 3.84Å; I511-A526 HydrophobicContact CG1-CB 4.46Å; I511-A529 HydrophobicContact CD1-CB 3.85Å; I511-S548 PolarHBondContact O-OG 3.05Å
512	L	78	Confident	74	Confident	62 Å²	62	46.5 Å²	46.5	33%	0.325	27%	0.271	S	S	.	.	H	α-helix	trans	-81.3	-13	179.9	-65.5	172.2	0	0	0	113.5	T508 P509 V510 T514 Q547	T508-L512 HydrophobicContact CG2-CD1 4.27Å; T508-L512 PolarHBondContact O-N 3.47Å; P509-L512 PolarHBondContact O-N 3.38Å; V510-L512 VanDerWaalsContact C-N 3.34Å; L512-T514 PolarHBondContact O-N 3.3Å; L512-T514 VanDerWaalsContact O-N 3.12Å; L512-Q547 HydrophobicContact CD2-CG 4.36Å
513	D	74.5	Confident	74.1	Confident	41 Å²	41	41.8 Å²	41.8	22%	0.219	25%	0.249	C	C	.	.			trans	-68.9	110.3	177.2	-167.2	-6.7	0	0	0	110.3	P509 N515 K518	P509-D513 PolarHBondContact O-N 2.86Å; D513-N515 VanDerWaalsContact C-N 3.33Å; D513-N515 WeakPolarHBondContact OD1-CB 3.38Å; D513-N515 VanDerWaalsContact OD1-CG 3.28Å; D513-N515 PolarHBondContact OD1-N 3.16Å; D513-N515 PolarHBondContact OD1-ND2 2.88Å; D513-K518 WeakPolarHBondContact OD2-CD 3.46Å; D513-K518 IonicContact OD2-NZ 2.65Å; D513-K518 PolarHBondContact OD2-NZ 2.98Å
514	T	64	Low	74.4	Confident	85 Å²	85	41.8 Å²	41.8	52%	0.521	25%	0.249	S	C	.	.			trans	-87.8	5.1	-175.5	48.3	0	0	0	0	113.9	L512 T516 E551	L512-T514 PolarHBondContact O-N 3.3Å; L512-T514 VanDerWaalsContact O-N 3.12Å; T514-T516 PolarHBondContact O-N 3.24Å; T514-E551 HydrophobicContact CG2-CB 4.28Å; T514-E551 WeakPolarHBondContact CG2-OE2 3.33Å
515	N	68.5	Low	74.6	Confident	95 Å²	95	41.4 Å²	41.4	51%	0.508	25%	0.247	S	C	.	.			trans	-64.1	123.8	-178.6	-75.6	-47.6	0	0	0	112.7	D513 A517 K518	D513-N515 VanDerWaalsContact C-N 3.33Å; D513-N515 WeakPolarHBondContact OD1-CB 3.38Å; D513-N515 VanDerWaalsContact OD1-CG 3.28Å; D513-N515 PolarHBondContact OD1-N 3.16Å; D513-N515 PolarHBondContact OD1-ND2 2.88Å; N515-A517 PolarHBondContact O-N 3.38Å; N515-A517 VanDerWaalsContact O-N 3.07Å; N515-K518 PolarHBondContact O-N 3.18Å
516	T	58	Low	74.7	Confident	101 Å²	101	38 Å²	38	62%	0.62	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-54	-32	-177.8	-54.5	0	0	0	0	114.1	T514	T514-T516 PolarHBondContact O-N 3.24Å
517	A	59.2	Low	75	Confident	85 Å²	85	36.2 Å²	36.2	70%	0.702	21%	0.212	S	C	*	.	G	3₁₀ helix	trans	-71.3	-28.2	178.9	0	0	0	0	0	113.3	N515	N515-A517 PolarHBondContact O-N 3.38Å; N515-A517 VanDerWaalsContact O-N 3.07Å
518	K	66.9	Low	75.2	Confident	85 Å²	85	36.2 Å²	36.2	37%	0.37	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-99.1	18.4	-177.2	-65.3	179.9	-176.2	177.8	0	113.2	D513 N515 Q520 H521 A522	D513-K518 WeakPolarHBondContact OD2-CD 3.46Å; D513-K518 IonicContact OD2-NZ 2.65Å; D513-K518 PolarHBondContact OD2-NZ 2.98Å; N515-K518 PolarHBondContact O-N 3.18Å; K518-Q520 PolarHBondContact O-N 3.17Å; K518-H521 HydrophobicContact CB-CB 4.33Å; K518-H521 WeakPolarHBondContact O-CB 3.26Å; K518-H521 PolarHBondContact O-N 2.89Å; K518-A522 PolarHBondContact O-N 3.35Å; K518-A522 VanDerWaalsContact O-N 3.07Å
519	L	71.9	Confident	75.3	Confident	16 Å²	16	34.8 Å²	34.8	8%	0.084	20%	0.203	C	C	.	.	H	α-helix	trans	-53.6	-41.3	-179.8	-171.6	77.5	0	0	0	112	C523 H556 N559	L519-C523 PolarHBondContact O-N 3.27Å; L519-C523 VanDerWaalsContact O-N 3.11Å; L519-C523 PolarHBondContact O-SG 3.47Å; L519-H556 HydrophobicContact CD1-CB 4.22Å; L519-H556 HydrophobicContact CD2-CB 4.27Å; L519-N559 HydrophobicContact CD2-CB 4.08Å; L519-N559 WeakPolarHBondContact CD2-ND2 3.45Å
520	Q	73.5	Confident	75.5	Confident	51 Å²	51	31.1 Å²	31.1	24%	0.238	18%	0.18	C	C	.	.	H	α-helix	trans	-63.5	-42.1	177.9	-61.4	-171.6	-11.2	0	0	111.7	K518 C523 L524 F561 H897	K518-Q520 PolarHBondContact O-N 3.17Å; Q520-C523 PolarHBondContact O-N 3.41Å; Q520-L524 WeakPolarHBondContact O-CB 3.27Å; Q520-L524 VanDerWaalsContact O-CG 3.22Å; Q520-L524 WeakPolarHBondContact O-CG 3.48Å; Q520-L524 PolarHBondContact O-N 3.4Å; Q520-F561 HydrophobicContact CB-CD1 4.35Å; Q520-F561 HydrophobicContact CB-CE1 4.34Å; Q520-F561 HydrophobicContact CB-CZ 4.47Å; Q520-F561 HydrophobicContact CG-CD1 4.28Å; Q520-F561 HydrophobicContact CG-CD2 3.75Å; Q520-F561 HydrophobicContact CG-CE1 4.17Å; Q520-F561 HydrophobicContact CG-CE2 3.63Å; Q520-F561 HydrophobicContact CG-CG 4.1Å; Q520-F561 HydrophobicContact CG-CZ 3.86Å; Q520-H897 PolarHBondContact OE1-CE1 2.88Å
521	H	77.5	Confident	75.7	Confident	9 Å²	9	30.2 Å²	30.2	4%	0.042	17%	0.174	C	C	.	.	H	α-helix	trans	-64	-45.6	179.6	-57.7	77.4	0	0	0	111.9	D481 S484 I488 V510 K518 C523 L524 A525	D481-H521 WeakPolarHBondContact CA-NE2 3.18Å; D481-H521 PolarHBondContact O-NE2 3.01Å; D481-H521 VanDerWaalsContact O-NE2 3.13Å; D481-H521 IonicContact OD1-CE1 3.33Å; D481-H521 PolarHBondContact OD1-CE1 3.45Å; D481-H521 IonicContact OD1-NE2 3.92Å; S484-H521 PolarHBondContact OG-CD2 2.98Å; S484-H521 PolarHBondContact OG-NE2 2.67Å; I488-H521 HydrophobicContact CD1-CB 4.14Å; V510-H521 HydrophobicContact CG1-CB 4.45Å; K518-H521 HydrophobicContact CB-CB 4.33Å; K518-H521 WeakPolarHBondContact O-CB 3.26Å; K518-H521 PolarHBondContact O-N 2.89Å; H521-C523 PolarHBondContact O-N 3.35Å; H521-L524 CarbonylContact O-C 3.42Å; H521-L524 PolarHBondContact O-N 3.08Å; H521-A525 WeakPolarHBondContact O-CB 3.33Å; H521-A525 PolarHBondContact O-N 2.97Å
522	A	78.7	Confident	76	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.008	17%	0.174	C	C	.	.	H	α-helix	trans	-68.8	-35.4	-179.2	0	0	0	0	0	111.9	K518 A525 A526	K518-A522 PolarHBondContact O-N 3.35Å; K518-A522 VanDerWaalsContact O-N 3.07Å; A522-A525 PolarHBondContact O-N 3.27Å; A522-A526 WeakPolarHBondContact O-CB 3.29Å; A522-A526 PolarHBondContact O-N 3.19Å
523	C	77.4	Confident	75.9	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.007	16%	0.159	C	C	.	.	H	α-helix	trans	-66.9	-40.1	171.3	-68.2	0	0	0	0	112.7	L519 Q520 H521 L527 R552 F561	L519-C523 PolarHBondContact O-N 3.27Å; L519-C523 VanDerWaalsContact O-N 3.11Å; L519-C523 PolarHBondContact O-SG 3.47Å; Q520-C523 PolarHBondContact O-N 3.41Å; H521-C523 PolarHBondContact O-N 3.35Å; C523-L527 WeakPolarHBondContact O-CB 3.4Å; C523-L527 PolarHBondContact O-N 3.03Å; C523-L527 VanDerWaalsContact O-N 3.08Å; C523-R552 PolarHBondContact SG-NH1 3.05Å; C523-R552 VanDerWaalsContact SG-NH1 3.45Å; C523-F561 HydrophobicContact CB-CB 3.87Å; C523-F561 WeakPolarHBondContact CB-O 3.31Å; C523-F561 PolarHBondContact SG-O 2.87Å
524	L	80.3	Confident	76	Confident	0 Å²	0	26 Å²	26	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-70.3	-33.8	175.3	-70.1	170.1	0	0	0	112	R485 I488 I489 Q520 H521 L527 S528 Y899 L900 Y903	R485-L524 HydrophobicContact CB-CD1 4.41Å; R485-L524 HydrophobicContact CG-CD1 3.99Å; I488-L524 HydrophobicContact CG2-CB 4.2Å; I489-L524 HydrophobicContact CD1-CD1 4.28Å; I489-L524 HydrophobicContact CD1-CD2 4.38Å; I489-L524 HydrophobicContact CG1-CD2 4.49Å; Q520-L524 WeakPolarHBondContact O-CB 3.27Å; Q520-L524 VanDerWaalsContact O-CG 3.22Å; Q520-L524 WeakPolarHBondContact O-CG 3.48Å; Q520-L524 PolarHBondContact O-N 3.4Å; H521-L524 CarbonylContact O-C 3.42Å; H521-L524 PolarHBondContact O-N 3.08Å; L524-L527 PolarHBondContact O-N 2.83Å; L524-S528 WeakPolarHBondContact O-CB 3.44Å; L524-S528 PolarHBondContact O-N 3.23Å; L524-S528 PolarHBondContact O-OG 2.72Å; L524-Y899 HydrophobicContact CD1-CE2 4.34Å; L524-L900 HydrophobicContact CD2-CD2 3.86Å; L524-Y903 HydrophobicContact CD2-CE2 4.36Å
525	A	83.2	Confident	76.4	Confident	0 Å²	0	22 Å²	22	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-68.5	-43.3	176.7	0	0	0	0	0	111.1	I488 L507 V510 I511 H521 A522 L527 S528 A529	I488-A525 HydrophobicContact CD1-CB 4.47Å; I488-A525 HydrophobicContact CG2-CB 4.07Å; L507-A525 HydrophobicContact CD2-CB 4.38Å; V510-A525 HydrophobicContact CB-CB 3.95Å; V510-A525 HydrophobicContact CG1-CB 3.68Å; I511-A525 HydrophobicContact CG1-CB 3.84Å; H521-A525 WeakPolarHBondContact O-CB 3.33Å; H521-A525 PolarHBondContact O-N 2.97Å; A522-A525 PolarHBondContact O-N 3.27Å; A525-L527 VanDerWaalsContact C-N 3.28Å; A525-L527 PolarHBondContact O-N 2.81Å; A525-S528 PolarHBondContact O-N 2.85Å; A525-A529 VanDerWaalsContact O-CB 3.28Å; A525-A529 WeakPolarHBondContact O-CB 3.46Å; A525-A529 PolarHBondContact O-N 3.49Å
526	A	84.3	Confident	76.5	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-61.8	-38.4	172.4	0	0	0	0	0	111.9	I511 A522 A529 G530 I545 M565	I511-A526 HydrophobicContact CG1-CB 4.46Å; A522-A526 WeakPolarHBondContact O-CB 3.29Å; A522-A526 PolarHBondContact O-N 3.19Å; A526-A529 PolarHBondContact O-N 2.93Å; A526-G530 PolarHBondContact O-N 3.49Å; A526-I545 HydrophobicContact CB-CD1 4.46Å; A526-I545 HydrophobicContact CB-CG1 4.18Å; A526-M565 HydrophobicContact CB-CE 3.85Å; A526-M565 HydrophobicContact CB-SD 3.16Å; A526-M565 WeakPolarHBondContact CB-SD 3.47Å
527	L	84.3	Confident	77.1	Confident	0 Å²	0	15.2 Å²	15.2	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-67	-46	176	-174	67.4	0	0	0	112.5	C523 L524 A525 A529 G530 L531 F564 L567 L571 I881 Y903	C523-L527 WeakPolarHBondContact O-CB 3.4Å; C523-L527 PolarHBondContact O-N 3.03Å; C523-L527 VanDerWaalsContact O-N 3.08Å; L524-L527 PolarHBondContact O-N 2.83Å; A525-L527 VanDerWaalsContact C-N 3.28Å; A525-L527 PolarHBondContact O-N 2.81Å; L527-A529 VanDerWaalsContact C-N 3.33Å; L527-A529 PolarHBondContact O-N 3.06Å; L527-G530 PolarHBondContact O-N 3.22Å; L527-L531 PolarHBondContact O-N 3.03Å; L527-F564 HydrophobicContact CD2-CB 4.41Å; L527-F564 HydrophobicContact CD2-CD1 4.32Å; L527-F564 HydrophobicContact CD2-CG 4.45Å; L527-L567 HydrophobicContact CD1-CB 4.14Å; L527-L567 HydrophobicContact CD1-CD2 3.82Å; L527-L567 HydrophobicContact CD1-CG 4.19Å; L527-L571 HydrophobicContact CD1-CD1 3.89Å; L527-I881 HydrophobicContact CD1-CD1 3.76Å; L527-I881 HydrophobicContact CD1-CG1 3.78Å; L527-I881 HydrophobicContact CD2-CD1 4.02Å; L527-I881 HydrophobicContact CD2-CG1 4.16Å; L527-I881 HydrophobicContact CD2-CG2 3.81Å; L527-I881 HydrophobicContact CG-CD1 3.92Å; L527-I881 HydrophobicContact CG-CG1 4.31Å; L527-Y903 HydrophobicContact CD2-CD2 4.46Å; L527-Y903 HydrophobicContact CD2-CE1 4.42Å; L527-Y903 HydrophobicContact CD2-CE2 3.83Å
528	S	83.2	Confident	77.8	Confident	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-63.2	-38.6	175.6	-71.9	0	0	0	0	111.8	I488 L524 A525 L531 I532 Y903	I488-S528 WeakPolarHBondContact O-CB 3.33Å; I488-S528 PolarHBondContact O-OG 2.83Å; L524-S528 WeakPolarHBondContact O-CB 3.44Å; L524-S528 PolarHBondContact O-N 3.23Å; L524-S528 PolarHBondContact O-OG 2.72Å; A525-S528 PolarHBondContact O-N 2.85Å; S528-L531 WeakPolarHBondContact O-CB 3.4Å; S528-L531 PolarHBondContact O-N 3Å; S528-I532 VanDerWaalsContact O-CG1 3.3Å; S528-I532 WeakPolarHBondContact O-CG1 3.32Å; S528-I532 PolarHBondContact O-N 3.09Å; S528-Y903 PolarHBondContact OG-OH 2.99Å
529	A	83.3	Confident	78.3	Confident	1 Å²	1	11 Å²	11	1%	0.008	7%	0.069	C	C	.	.	H	α-helix	trans	-65.9	-41	174.5	0	0	0	0	0	111.6	L507 I511 A525 A526 L527 L531 I532 S533 V541	L507-A529 HydrophobicContact CD1-CB 4.19Å; I511-A529 HydrophobicContact CD1-CB 3.85Å; A525-A529 VanDerWaalsContact O-CB 3.28Å; A525-A529 WeakPolarHBondContact O-CB 3.46Å; A525-A529 PolarHBondContact O-N 3.49Å; A526-A529 PolarHBondContact O-N 2.93Å; L527-A529 VanDerWaalsContact C-N 3.33Å; L527-A529 PolarHBondContact O-N 3.06Å; A529-L531 VanDerWaalsContact C-N 3.31Å; A529-L531 PolarHBondContact O-N 3.34Å; A529-I532 PolarHBondContact O-N 3.12Å; A529-S533 PolarHBondContact O-N 3.19Å; A529-S533 VanDerWaalsContact O-N 3.13Å; A529-S533 PolarHBondContact O-OG 3.38Å; A529-V541 HydrophobicContact CB-CG1 3.88Å
530	G	82.8	Confident	78.6	Confident	0 Å²	0	13.5 Å²	13.5	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-61.1	-37.2	171.9	0	0	0	0	0	112.8	A526 L527 S533 V534	A526-G530 PolarHBondContact O-N 3.49Å; L527-G530 PolarHBondContact O-N 3.22Å; G530-S533 CarbonylContact O-C 3.58Å; G530-S533 PolarHBondContact O-N 3.36Å; G530-V534 WeakPolarHBondContact O-CG2 3.41Å; G530-V534 PolarHBondContact O-N 2.89Å
531	L	83.3	Confident	78.9	Confident	0 Å²	0	11.1 Å²	11.1	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-69.9	-30.1	174.9	-81.5	174.4	0	0	0	114.3	A496 G497 L527 S528 A529 V534 L571 A877 I881 Y903	A496-L531 WeakPolarHBondContact CA-O 3.4Å; G497-L531 PolarHBondContact N-O 3.48Å; L527-L531 PolarHBondContact O-N 3.03Å; S528-L531 WeakPolarHBondContact O-CB 3.4Å; S528-L531 PolarHBondContact O-N 3Å; A529-L531 VanDerWaalsContact C-N 3.31Å; A529-L531 PolarHBondContact O-N 3.34Å; L531-V534 HydrophobicContact CD2-CG2 4.49Å; L531-V534 WeakPolarHBondContact O-CG2 3.25Å; L531-L571 HydrophobicContact CD2-CD1 4.15Å; L531-L571 HydrophobicContact CG-CD1 4.25Å; L531-A877 HydrophobicContact CD2-CB 3.66Å; L531-I881 HydrophobicContact CD1-CD1 3.53Å; L531-I881 HydrophobicContact CD2-CD1 3.6Å; L531-I881 HydrophobicContact CG-CD1 3.65Å; L531-Y903 HydrophobicContact CD1-CD1 3.42Å; L531-Y903 VanDerWaalsContact CD1-CD1 3.42Å; L531-Y903 HydrophobicContact CD1-CE1 3.4Å; L531-Y903 VanDerWaalsContact CD1-CE1 3.4Å
532	I	83.4	Confident	79	Confident	1 Å²	1	11 Å²	11	1%	0.005	8%	0.075	C	C	.	.	H	α-helix	trans	-74.9	-35.1	176.4	-66.5	162.7	0	0	0	110.7	M499 A503 I504 L507 S528 A529	M499-I532 PolarHBondContact N-O 3.09Å; A503-I532 HydrophobicContact CB-CD1 4.06Å; I504-I532 HydrophobicContact CD1-CG2 4.17Å; I504-I532 HydrophobicContact CG1-CG2 3.89Å; L507-I532 HydrophobicContact CD1-CD1 3.61Å; S528-I532 VanDerWaalsContact O-CG1 3.3Å; S528-I532 WeakPolarHBondContact O-CG1 3.32Å; S528-I532 PolarHBondContact O-N 3.09Å; A529-I532 PolarHBondContact O-N 3.12Å
533	S	76	Confident	79.2	Confident	1 Å²	1	14.2 Å²	14.2	1%	0.007	10%	0.097	C	C	.	.	S	Bend	trans	-105.7	26.5	-173.9	57.7	0	0	0	0	114.1	A529 G530 G535 S536 T572	A529-S533 PolarHBondContact O-N 3.19Å; A529-S533 VanDerWaalsContact O-N 3.13Å; A529-S533 PolarHBondContact O-OG 3.38Å; G530-S533 CarbonylContact O-C 3.58Å; G530-S533 PolarHBondContact O-N 3.36Å; S533-G535 PolarHBondContact O-N 3.37Å; S533-G535 VanDerWaalsContact O-N 3.08Å; S533-S536 PolarHBondContact O-N 2.87Å; S533-S536 PolarHBondContact O-OG 3.13Å; S533-T572 WeakPolarHBondContact OG-CG2 3.47Å
534	V	76.6	Confident	79.4	Confident	15 Å²	15	14.9 Å²	14.9	9%	0.091	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	119.1	-177.2	-172.9	0	0	0	0	110.2	G530 L531 S536 L571 L574 P873 A877	G530-V534 WeakPolarHBondContact O-CG2 3.41Å; G530-V534 PolarHBondContact O-N 2.89Å; L531-V534 HydrophobicContact CD2-CG2 4.49Å; L531-V534 WeakPolarHBondContact O-CG2 3.25Å; V534-S536 VanDerWaalsContact C-N 3.29Å; V534-S536 PolarHBondContact O-N 2.93Å; V534-L571 WeakPolarHBondContact CA-O 3.46Å; V534-L574 HydrophobicContact CG1-CB 3.92Å; V534-L574 HydrophobicContact CG1-CD2 3.53Å; V534-L574 HydrophobicContact CG1-CG 4.37Å; V534-P873 HydrophobicContact CG1-CB 3.68Å; V534-A877 HydrophobicContact CG2-CB 4.18Å
535	G	71.3	Confident	79.5	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.6	-1.5	173.8	0	0	0	0	0	116.5	N269 S533 L571 T572 L574 R576	N269-G535 PolarHBondContact ND2-O 3.15Å; S533-G535 PolarHBondContact O-N 3.37Å; S533-G535 VanDerWaalsContact O-N 3.08Å; G535-L571 PolarHBondContact N-O 3.35Å; G535-T572 PolarHBondContact N-O 2.82Å; G535-L574 VanDerWaalsContact CA-O 3.26Å; G535-L574 WeakPolarHBondContact CA-O 3.39Å; G535-R576 PolarHBondContact O-NE 3.25Å
536	S	71.2	Confident	79.4	Confident	17 Å²	17	16.7 Å²	16.7	12%	0.119	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-10.3	175.9	61.4	0	0	0	0	113.9	M499 S533 V534 D538 R576	M499-S536 VanDerWaalsContact SD-CB 3.6Å; S533-S536 PolarHBondContact O-N 2.87Å; S533-S536 PolarHBondContact O-OG 3.13Å; V534-S536 VanDerWaalsContact C-N 3.29Å; V534-S536 PolarHBondContact O-N 2.93Å; S536-D538 VanDerWaalsContact C-N 3.26Å; S536-D538 PolarHBondContact O-N 3.32Å; S536-R576 PolarHBondContact O-NH1 3.5Å; S536-R576 PolarHBondContact O-NH2 3.28Å
537	L	69.9	Low	79.4	Confident	36 Å²	36	20.9 Å²	20.9	19%	0.188	13%	0.13	C	C	.	.			trans	44.1	53.2	-174.9	-158.2	149.3	0	0	0	111.1	G539 T572 E579 I583	L537-G539 PolarHBondContact O-N 3.15Å; L537-G539 VanDerWaalsContact O-N 3.16Å; L537-T572 PolarHBondContact N-O 2.9Å; L537-E579 HydrophobicContact CD1-CB 3.72Å; L537-I583 HydrophobicContact CD1-CD1 3.5Å; L537-I583 HydrophobicContact CD2-CD1 3.98Å; L537-I583 HydrophobicContact CG-CD1 3.75Å
538	D	74.5	Confident	78.9	Confident	35 Å²	35	21 Å²	21	19%	0.187	13%	0.131	C	C	.	.			trans	-63.1	123.8	176.8	-175.7	18.9	0	0	0	109.7	M499 S536 T540 V541 T542	M499-D538 HydrophobicContact CE-CB 4.29Å; S536-D538 VanDerWaalsContact C-N 3.26Å; S536-D538 PolarHBondContact O-N 3.32Å; D538-T540 PolarHBondContact O-N 3.03Å; D538-T540 PolarHBondContact OD1-N 2.97Å; D538-T540 PolarHBondContact OD2-OG1 3.24Å; D538-V541 HydrophobicContact CB-CG2 4.41Å; D538-V541 PolarHBondContact O-N 3.17Å; D538-T542 WeakPolarHBondContact O-CB 3.25Å; D538-T542 PolarHBondContact O-N 3.22Å; D538-T542 PolarHBondContact O-OG1 3.42Å
539	G	76.7	Confident	78.5	Confident	46 Å²	46	21.1 Å²	21.1	47%	0.474	13%	0.131	S	C	.	.	H	α-helix	trans	-62.1	-28.7	-179.8	0	0	0	0	0	111.9	L537 S543	L537-G539 PolarHBondContact O-N 3.15Å; L537-G539 VanDerWaalsContact O-N 3.16Å; G539-S543 WeakPolarHBondContact O-CB 3.41Å; G539-S543 PolarHBondContact O-N 2.89Å; G539-S543 PolarHBondContact O-OG 3.09Å
540	T	79.8	Confident	78.3	Confident	69 Å²	69	26.7 Å²	26.7	42%	0.423	16%	0.16	S	C	.	.	H	α-helix	trans	-70.3	-48.7	179.4	80.1	0	0	0	0	111.7	D538 S543 T544	D538-T540 PolarHBondContact O-N 3.03Å; D538-T540 PolarHBondContact OD1-N 2.97Å; D538-T540 PolarHBondContact OD2-OG1 3.24Å; T540-S543 PolarHBondContact O-OG 2.86Å; T540-S543 VanDerWaalsContact O-OG 3.12Å; T540-T544 WeakPolarHBondContact O-CB 3.42Å; T540-T544 WeakPolarHBondContact O-CG2 3.18Å; T540-T544 PolarHBondContact O-N 3.34Å; T540-T544 PolarHBondContact O-OG1 3.39Å
541	V	79.3	Confident	77.9	Confident	1 Å²	1	31 Å²	31	1%	0.006	18%	0.18	C	C	.	.	H	α-helix	trans	-67.2	-42.9	178.2	-178.8	0	0	0	0	110.6	I504 A529 D538 T544 I545 T572	I504-V541 HydrophobicContact CD1-CG2 4.11Å; I504-V541 HydrophobicContact CG1-CG2 4.3Å; I504-V541 HydrophobicContact CG2-CG2 3.58Å; A529-V541 HydrophobicContact CB-CG1 3.88Å; D538-V541 HydrophobicContact CB-CG2 4.41Å; D538-V541 PolarHBondContact O-N 3.17Å; V541-T544 WeakPolarHBondContact CA-OG1 3.33Å; V541-T544 PolarHBondContact O-N 2.89Å; V541-T544 PolarHBondContact O-OG1 3.38Å; V541-I545 HydrophobicContact CG1-CD1 3.68Å; V541-I545 HydrophobicContact CG1-CG1 4.36Å; V541-I545 VanDerWaalsContact O-CG1 3.23Å; V541-I545 WeakPolarHBondContact O-CG1 3.41Å; V541-I545 PolarHBondContact O-N 2.84Å; V541-T572 HydrophobicContact CB-CG2 4.49Å; V541-T572 HydrophobicContact CG1-CG2 3.88Å
542	T	79.6	Confident	77.2	Confident	8 Å²	8	32.4 Å²	32.4	5%	0.049	19%	0.186	C	C	.	.	H	α-helix	trans	-65.5	-46.1	-178.7	-53.5	0	0	0	0	111.4	D538 I545 I546 I583	D538-T542 WeakPolarHBondContact O-CB 3.25Å; D538-T542 PolarHBondContact O-N 3.22Å; D538-T542 PolarHBondContact O-OG1 3.42Å; T542-I545 PolarHBondContact O-N 2.92Å; T542-I546 HydrophobicContact CG2-CD1 3.97Å; T542-I546 VanDerWaalsContact O-CG1 3.25Å; T542-I546 WeakPolarHBondContact O-CG1 3.3Å; T542-I546 PolarHBondContact O-N 3.35Å; T542-I583 HydrophobicContact CG2-CD1 3.86Å; T542-I583 HydrophobicContact CG2-CG1 4.24Å; T542-I583 HydrophobicContact CG2-CG2 4.49Å
543	S	83.2	Confident	76.1	Confident	68 Å²	68	35.9 Å²	35.9	48%	0.476	21%	0.208	S	C	.	.	H	α-helix	trans	-66.1	-39.8	178	59.6	0	0	0	0	112.8	G539 T540 I546 Q547	G539-S543 WeakPolarHBondContact O-CB 3.41Å; G539-S543 PolarHBondContact O-N 2.89Å; G539-S543 PolarHBondContact O-OG 3.09Å; T540-S543 PolarHBondContact O-OG 2.86Å; T540-S543 VanDerWaalsContact O-OG 3.12Å; S543-I546 PolarHBondContact O-N 2.81Å; S543-Q547 WeakPolarHBondContact O-CB 3.46Å; S543-Q547 PolarHBondContact O-N 2.76Å
544	T	81.8	Confident	75.3	Confident	14 Å²	14	39 Å²	39	9%	0.086	23%	0.234	C	C	.	.	H	α-helix	trans	-66.8	-37.8	178.1	52.5	0	0	0	0	112.2	T508 T540 V541 Q547 S548	T508-T544 HydrophobicContact CG2-CG2 3.66Å; T540-T544 WeakPolarHBondContact O-CB 3.42Å; T540-T544 WeakPolarHBondContact O-CG2 3.18Å; T540-T544 PolarHBondContact O-N 3.34Å; T540-T544 PolarHBondContact O-OG1 3.39Å; V541-T544 WeakPolarHBondContact CA-OG1 3.33Å; V541-T544 PolarHBondContact O-N 2.89Å; V541-T544 PolarHBondContact O-OG1 3.38Å; T544-Q547 PolarHBondContact O-N 2.8Å; T544-S548 WeakPolarHBondContact O-CB 3.43Å; T544-S548 PolarHBondContact O-N 3.37Å
545	I	81.7	Confident	74.3	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-68	-44.3	173.5	-63.1	167.3	0	0	0	110.7	A526 V541 T542 Q547 S548 L549 M565 L569	A526-I545 HydrophobicContact CB-CD1 4.46Å; A526-I545 HydrophobicContact CB-CG1 4.18Å; V541-I545 HydrophobicContact CG1-CD1 3.68Å; V541-I545 HydrophobicContact CG1-CG1 4.36Å; V541-I545 VanDerWaalsContact O-CG1 3.23Å; V541-I545 WeakPolarHBondContact O-CG1 3.41Å; V541-I545 PolarHBondContact O-N 2.84Å; T542-I545 PolarHBondContact O-N 2.92Å; I545-Q547 VanDerWaalsContact C-N 3.3Å; I545-Q547 PolarHBondContact O-N 3.24Å; I545-S548 PolarHBondContact O-N 3.19Å; I545-L549 HydrophobicContact CG2-CD1 4.24Å; I545-L549 HydrophobicContact CG2-CG 4.43Å; I545-L549 WeakPolarHBondContact O-CG 3.38Å; I545-L549 PolarHBondContact O-N 3.07Å; I545-M565 HydrophobicContact CG2-CG 4.35Å; I545-M565 HydrophobicContact CG2-SD 3.87Å; I545-L569 HydrophobicContact CB-CD1 4.21Å; I545-L569 HydrophobicContact CG2-CB 3.91Å; I545-L569 HydrophobicContact CG2-CD1 3.79Å; I545-L569 HydrophobicContact CG2-CG 4.38Å
546	I	81.8	Confident	73.6	Confident	38 Å²	38	44 Å²	44	20%	0.195	27%	0.266	C	S	.	.	H	α-helix	trans	-60	-42	176.1	-68.8	169.4	0	0	0	110.9	T542 S543 L549 L550 L569 L587	T542-I546 HydrophobicContact CG2-CD1 3.97Å; T542-I546 VanDerWaalsContact O-CG1 3.25Å; T542-I546 WeakPolarHBondContact O-CG1 3.3Å; T542-I546 PolarHBondContact O-N 3.35Å; S543-I546 PolarHBondContact O-N 2.81Å; I546-L549 WeakPolarHBondContact O-CB 3.35Å; I546-L549 PolarHBondContact O-N 3.27Å; I546-L550 PolarHBondContact O-N 3.06Å; I546-L569 HydrophobicContact CD1-CD1 4.39Å; I546-L569 HydrophobicContact CG1-CD1 3.59Å; I546-L587 HydrophobicContact CG1-CD2 4.46Å
547	Q	82.8	Confident	72.8	Confident	89 Å²	89	44.3 Å²	44.3	42%	0.416	27%	0.265	S	S	.	.	H	α-helix	trans	-62	-45.7	175.2	-176.3	178.4	-7.2	0	0	111.2	L512 S543 T544 I545 L549 L550 E551	L512-Q547 HydrophobicContact CD2-CG 4.36Å; S543-Q547 WeakPolarHBondContact O-CB 3.46Å; S543-Q547 PolarHBondContact O-N 2.76Å; T544-Q547 PolarHBondContact O-N 2.8Å; I545-Q547 VanDerWaalsContact C-N 3.3Å; I545-Q547 PolarHBondContact O-N 3.24Å; Q547-L549 PolarHBondContact O-N 2.98Å; Q547-L550 PolarHBondContact O-N 3Å; Q547-L550 VanDerWaalsContact O-N 3.08Å; Q547-E551 HydrophobicContact CG-CG 4.43Å; Q547-E551 VanDerWaalsContact CG-OE1 3.3Å; Q547-E551 WeakPolarHBondContact CG-OE1 3.41Å; Q547-E551 PolarHBondContact NE2-OE1 3.22Å; Q547-E551 WeakPolarHBondContact O-CG 3.49Å; Q547-E551 PolarHBondContact O-N 3.44Å
548	S	75	Confident	71.8	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.014	29%	0.285	C	S	.	.	H	α-helix	trans	-61.8	-29.7	175.6	-161.9	0	0	0	0	112.5	I511 T544 I545 R552	I511-S548 PolarHBondContact O-OG 3.05Å; T544-S548 WeakPolarHBondContact O-CB 3.43Å; T544-S548 PolarHBondContact O-N 3.37Å; I545-S548 PolarHBondContact O-N 3.19Å; S548-R552 VanDerWaalsContact O-CD 3.29Å; S548-R552 WeakPolarHBondContact O-CD 3.48Å; S548-R552 VanDerWaalsContact O-CG 3.25Å; S548-R552 WeakPolarHBondContact O-CG 3.45Å; S548-R552 PolarHBondContact O-NE 3.48Å
549	L	75.5	Confident	71.3	Confident	2 Å²	2	48.4 Å²	48.4	1%	0.01	29%	0.294	C	S	.	.	H	α-helix	trans	-72.8	-36.9	173.1	-71	171.2	0	0	0	112.7	I545 I546 Q547 M565 L569 L587 M594	I545-L549 HydrophobicContact CG2-CD1 4.24Å; I545-L549 HydrophobicContact CG2-CG 4.43Å; I545-L549 WeakPolarHBondContact O-CG 3.38Å; I545-L549 PolarHBondContact O-N 3.07Å; I546-L549 WeakPolarHBondContact O-CB 3.35Å; I546-L549 PolarHBondContact O-N 3.27Å; Q547-L549 PolarHBondContact O-N 2.98Å; L549-M565 HydrophobicContact CD2-CG 3.63Å; L549-M565 HydrophobicContact CG-CG 4.23Å; L549-L569 HydrophobicContact CD1-CD1 4.07Å; L549-L587 HydrophobicContact CD1-CD2 4.22Å; L549-M594 HydrophobicContact CD2-CE 3.32Å; L549-M594 HydrophobicContact CD2-CG 4.1Å
550	L	78.2	Confident	70.8	Confident	119 Å²	119	47.4 Å²	47.4	62%	0.623	28%	0.279	S	S	*	.	H	α-helix	trans	-73.7	-34.3	-178.8	-168.5	68.7	0	0	0	112.6	I546 Q547 R552	I546-L550 PolarHBondContact O-N 3.06Å; Q547-L550 PolarHBondContact O-N 3Å; Q547-L550 VanDerWaalsContact O-N 3.08Å; L550-R552 VanDerWaalsContact C-N 3.34Å; L550-R552 PolarHBondContact O-N 2.87Å
551	E	74.6	Confident	70.2	Confident	90 Å²	90	45 Å²	45	42%	0.421	26%	0.262	S	S	.	.	S	Bend	trans	-78.1	-13.4	-175.5	-70.3	176.7	-176.7	0	0	113.9	T514 Q547	T514-E551 HydrophobicContact CG2-CB 4.28Å; T514-E551 WeakPolarHBondContact CG2-OE2 3.33Å; Q547-E551 HydrophobicContact CG-CG 4.43Å; Q547-E551 VanDerWaalsContact CG-OE1 3.3Å; Q547-E551 WeakPolarHBondContact CG-OE1 3.41Å; Q547-E551 PolarHBondContact NE2-OE1 3.22Å; Q547-E551 WeakPolarHBondContact O-CG 3.49Å; Q547-E551 PolarHBondContact O-N 3.44Å
552	R	67.8	Low	69.8	Low	30 Å²	30	45.6 Å²	45.6	11%	0.113	27%	0.266	C	S	.	.			trans	-92.1	131.3	-172.1	-73.9	175.6	-174.8	-141.3	-9.8	114	C523 S548 L550	C523-R552 PolarHBondContact SG-NH1 3.05Å; C523-R552 VanDerWaalsContact SG-NH1 3.45Å; S548-R552 VanDerWaalsContact O-CD 3.29Å; S548-R552 WeakPolarHBondContact O-CD 3.48Å; S548-R552 VanDerWaalsContact O-CG 3.25Å; S548-R552 WeakPolarHBondContact O-CG 3.45Å; S548-R552 PolarHBondContact O-NE 3.48Å; L550-R552 VanDerWaalsContact C-N 3.34Å; L550-R552 PolarHBondContact O-N 2.87Å
553	P	60	Low	69.5	Low	73 Å²	73	45.9 Å²	45.9	47%	0.474	27%	0.267	S	S	.	.			trans	-78.3	156.2	177.2	29.3	-34	0	0	0	113.8	S555 H556	P553-S555 PolarHBondContact O-N 3.44Å; P553-H556 PolarHBondContact O-CD2 2.99Å; P553-H556 PolarHBondContact O-N 2.85Å
554	A	60.8	Low	69.2	Low	67 Å²	67	42.7 Å²	42.7	55%	0.554	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-66	-11.4	-168.3	0	0	0	0	0	116.9	H556 W557	A554-H556 PolarHBondContact O-N 3.34Å; A554-W557 VanDerWaalsContact CA-NE1 3.27Å
555	S	54.1	Low	69	Low	89 Å²	89	42.1 Å²	42.1	62%	0.622	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-70.7	-17.9	174.9	49	0	0	0	0	113.5	P553 W557	P553-S555 PolarHBondContact O-N 3.44Å; S555-W557 VanDerWaalsContact C-N 3.31Å
556	H	57	Low	68.9	Low	30 Å²	30	42.1 Å²	42.1	14%	0.139	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-82.3	-7.4	179.9	-63.5	-62.6	0	0	0	114	L519 P553 A554 S558 N559	L519-H556 HydrophobicContact CD1-CB 4.22Å; L519-H556 HydrophobicContact CD2-CB 4.27Å; P553-H556 PolarHBondContact O-CD2 2.99Å; P553-H556 PolarHBondContact O-N 2.85Å; A554-H556 PolarHBondContact O-N 3.34Å; H556-S558 VanDerWaalsContact C-N 3.3Å; H556-S558 PolarHBondContact O-N 2.97Å; H556-N559 PolarHBondContact O-N 3.22Å
557	W	53.9	Low	68.8	Low	24 Å²	24	40.5 Å²	40.5	9%	0.091	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-69.4	-24.8	-175.4	-60.2	135.5	0	0	0	113.8	A554 S555 N559 S562 P593 M594	A554-W557 VanDerWaalsContact CA-NE1 3.27Å; S555-W557 VanDerWaalsContact C-N 3.31Å; W557-N559 PolarHBondContact O-N 3.06Å; W557-S562 PolarHBondContact O-OG 3.15Å; W557-P593 HydrophobicContact CB-CG 4.48Å; W557-P593 HydrophobicContact CG-CG 4.37Å; W557-M594 HydrophobicContact CD2-CB 4.12Å; W557-M594 HydrophobicContact CE3-CB 3.73Å; W557-M594 HydrophobicContact CE3-CG 4.02Å; W557-M594 HydrophobicContact CE3-SD 4.03Å; W557-M594 HydrophobicContact CH2-CB 3.38Å; W557-M594 HydrophobicContact CH2-CG 3.48Å; W557-M594 VanDerWaalsContact CH2-CG 3.48Å; W557-M594 HydrophobicContact CH2-SD 4.39Å; W557-M594 HydrophobicContact CZ2-CB 3.74Å; W557-M594 HydrophobicContact CZ2-CG 4.34Å; W557-M594 HydrophobicContact CZ3-CB 3.36Å; W557-M594 HydrophobicContact CZ3-CE 3.96Å; W557-M594 HydrophobicContact CZ3-CG 3.27Å; W557-M594 HydrophobicContact CZ3-SD 3.58Å; W557-M594 VanDerWaalsContact CZ3-SD 3.58Å
558	S	50.7	Low	68.8	Low	87 Å²	87	36.2 Å²	36.2	61%	0.608	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-69.3	-11.8	179.9	69.5	0	0	0	0	114.1	H556	H556-S558 VanDerWaalsContact C-N 3.3Å; H556-S558 PolarHBondContact O-N 2.97Å
559	N	62.9	Low	69.1	Low	70 Å²	70	36.1 Å²	36.1	37%	0.374	21%	0.212	S	C	.	.	S	Bend	trans	-87.1	132.4	-178.1	-72.8	-31.5	0	0	0	111.2	L519 H556 W557 F561 S562	L519-N559 HydrophobicContact CD2-CB 4.08Å; L519-N559 WeakPolarHBondContact CD2-ND2 3.45Å; H556-N559 PolarHBondContact O-N 3.22Å; W557-N559 PolarHBondContact O-N 3.06Å; N559-F561 PolarHBondContact O-N 3.17Å; N559-S562 WeakPolarHBondContact O-CB 3.44Å; N559-S562 PolarHBondContact O-N 3.36Å; N559-S562 PolarHBondContact O-OG 2.74Å
560	V	66.2	Low	69.4	Low	26 Å²	26	36 Å²	36	16%	0.158	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49	-30.4	177.2	-177.8	0	0	0	0	113.2	S562 K563 D888 M891	V560-S562 PolarHBondContact O-N 2.89Å; V560-K563 WeakPolarHBondContact O-CB 3.44Å; V560-K563 PolarHBondContact O-N 3.22Å; V560-D888 HydrophobicContact CG1-CB 4.21Å; V560-D888 HydrophobicContact CG2-CB 4.31Å; V560-M891 HydrophobicContact CG2-CB 3.83Å; V560-M891 HydrophobicContact CG2-CG 4.27Å
561	F	68	Low	69.5	Low	18 Å²	18	30.4 Å²	30.4	8%	0.079	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-16	-180	-62	-83.9	0	0	0	114.6	Q520 C523 N559 K563 F564 M565 H897	Q520-F561 HydrophobicContact CB-CD1 4.35Å; Q520-F561 HydrophobicContact CB-CE1 4.34Å; Q520-F561 HydrophobicContact CB-CZ 4.47Å; Q520-F561 HydrophobicContact CG-CD1 4.28Å; Q520-F561 HydrophobicContact CG-CD2 3.75Å; Q520-F561 HydrophobicContact CG-CE1 4.17Å; Q520-F561 HydrophobicContact CG-CE2 3.63Å; Q520-F561 HydrophobicContact CG-CG 4.1Å; Q520-F561 HydrophobicContact CG-CZ 3.86Å; C523-F561 HydrophobicContact CB-CB 3.87Å; C523-F561 WeakPolarHBondContact CB-O 3.31Å; C523-F561 PolarHBondContact SG-O 2.87Å; N559-F561 PolarHBondContact O-N 3.17Å; F561-K563 PolarHBondContact O-N 2.97Å; F561-F564 HydrophobicContact CB-CD2 4.39Å; F561-F564 AromaticContact CD1-CD2 3.74Å; F561-F564 HydrophobicContact CD1-CD2 3.74Å; F561-F564 AromaticContact CD1-CE2 3.93Å; F561-F564 HydrophobicContact CD1-CE2 3.93Å; F561-F564 HydrophobicContact CE1-CD2 4.43Å; F561-F564 HydrophobicContact CE1-CE2 4.21Å; F561-F564 HydrophobicContact CG-CD2 4.42Å; F561-F564 PolarHBondContact O-N 3.06Å; F561-M565 PolarHBondContact O-N 3.24Å; F561-H897 AromaticContact CZ-CD2 3.97Å; F561-H897 AromaticContact CZ-CE1 3.63Å; F561-H897 AromaticContact CZ-ND1 3.91Å; F561-H897 AromaticContact CZ-NE2 3.66Å
562	S	70.7	Confident	69.9	Low	13 Å²	13	26.1 Å²	26.1	9%	0.091	16%	0.162	C	C	.	.	H	α-helix	trans	-59.2	-38.5	173.7	62.2	0	0	0	0	111	W557 N559 V560 F564 M565 A566 M594	W557-S562 PolarHBondContact O-OG 3.15Å; N559-S562 WeakPolarHBondContact O-CB 3.44Å; N559-S562 PolarHBondContact O-N 3.36Å; N559-S562 PolarHBondContact O-OG 2.74Å; V560-S562 PolarHBondContact O-N 2.89Å; S562-F564 VanDerWaalsContact C-N 3.29Å; S562-F564 PolarHBondContact O-N 3.36Å; S562-M565 WeakPolarHBondContact O-CB 3.47Å; S562-M565 PolarHBondContact O-N 3.07Å; S562-M565 VanDerWaalsContact O-N 3.11Å; S562-A566 PolarHBondContact O-N 3.34Å; S562-M594 WeakPolarHBondContact O-CE 3.1Å
563	K	73.1	Confident	70.3	Confident	14 Å²	14	24.7 Å²	24.7	6%	0.061	16%	0.156	C	C	.	.	H	α-helix	trans	-56.9	-39.9	175.9	-61.6	174.7	-178.8	176.7	0	112.2	V560 F561 M565 A566 L567 M597 D888	V560-K563 WeakPolarHBondContact O-CB 3.44Å; V560-K563 PolarHBondContact O-N 3.22Å; F561-K563 PolarHBondContact O-N 2.97Å; K563-M565 VanDerWaalsContact C-N 3.33Å; K563-M565 PolarHBondContact O-N 3.13Å; K563-A566 PolarHBondContact O-N 3.47Å; K563-L567 WeakPolarHBondContact O-CB 3.36Å; K563-L567 PolarHBondContact O-N 3.43Å; K563-M597 HydrophobicContact CB-SD 4.48Å; K563-M597 HydrophobicContact CG-SD 3.87Å; K563-D888 VanDerWaalsContact NZ-CG 3.31Å; K563-D888 IonicContact NZ-OD1 2.72Å; K563-D888 PolarHBondContact NZ-OD1 3.07Å; K563-D888 IonicContact NZ-OD2 2.99Å; K563-D888 PolarHBondContact NZ-OD2 3.1Å
564	F	77.6	Confident	71.2	Confident	2 Å²	2	21.5 Å²	21.5	1%	0.009	14%	0.136	C	C	.	.	H	α-helix	trans	-70.3	-27.6	-179.8	-60.2	-46.7	0	0	0	113.5	L527 F561 S562 L567 G568 L900	L527-F564 HydrophobicContact CD2-CB 4.41Å; L527-F564 HydrophobicContact CD2-CD1 4.32Å; L527-F564 HydrophobicContact CD2-CG 4.45Å; F561-F564 HydrophobicContact CB-CD2 4.39Å; F561-F564 AromaticContact CD1-CD2 3.74Å; F561-F564 HydrophobicContact CD1-CD2 3.74Å; F561-F564 AromaticContact CD1-CE2 3.93Å; F561-F564 HydrophobicContact CD1-CE2 3.93Å; F561-F564 HydrophobicContact CE1-CD2 4.43Å; F561-F564 HydrophobicContact CE1-CE2 4.21Å; F561-F564 HydrophobicContact CG-CD2 4.42Å; F561-F564 PolarHBondContact O-N 3.06Å; S562-F564 VanDerWaalsContact C-N 3.29Å; S562-F564 PolarHBondContact O-N 3.36Å; F564-L567 HydrophobicContact CD1-CD2 4.48Å; F564-L567 WeakPolarHBondContact O-CB 3.5Å; F564-L567 PolarHBondContact O-N 3.42Å; F564-G568 PolarHBondContact O-N 3.1Å; F564-L900 HydrophobicContact CE2-CD1 4.12Å; F564-L900 HydrophobicContact CZ-CD1 3.98Å
565	M	76.9	Confident	71.6	Confident	2 Å²	2	20.1 Å²	20.1	1%	0.01	13%	0.128	C	C	.	.	H	α-helix	trans	-69.4	-47	174.4	-175.2	67.1	76.7	0	0	110.9	A526 I545 L549 F561 S562 K563 L567 G568 L569 M594	A526-M565 HydrophobicContact CB-CE 3.85Å; A526-M565 HydrophobicContact CB-SD 3.16Å; A526-M565 WeakPolarHBondContact CB-SD 3.47Å; I545-M565 HydrophobicContact CG2-CG 4.35Å; I545-M565 HydrophobicContact CG2-SD 3.87Å; L549-M565 HydrophobicContact CD2-CG 3.63Å; L549-M565 HydrophobicContact CG-CG 4.23Å; F561-M565 PolarHBondContact O-N 3.24Å; S562-M565 WeakPolarHBondContact O-CB 3.47Å; S562-M565 PolarHBondContact O-N 3.07Å; S562-M565 VanDerWaalsContact O-N 3.11Å; K563-M565 VanDerWaalsContact C-N 3.33Å; K563-M565 PolarHBondContact O-N 3.13Å; M565-L567 PolarHBondContact O-N 3.05Å; M565-G568 PolarHBondContact O-N 3.46Å; M565-L569 PolarHBondContact O-N 3.15Å; M565-M594 HydrophobicContact CB-CE 4.11Å; M565-M594 HydrophobicContact CG-CE 4.36Å
566	A	79.6	Confident	72.4	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-61.8	-36.4	173.4	0	0	0	0	0	111.3	S562 K563 L569 G570 M594 A598 I601	S562-A566 PolarHBondContact O-N 3.34Å; K563-A566 PolarHBondContact O-N 3.47Å; A566-L569 PolarHBondContact O-N 3.23Å; A566-G570 PolarHBondContact O-N 3.31Å; A566-M594 HydrophobicContact CB-CE 3.65Å; A566-M594 HydrophobicContact CB-SD 4.24Å; A566-A598 HydrophobicContact CB-CB 4.25Å; A566-I601 HydrophobicContact CB-CD1 3.61Å; A566-I601 WeakPolarHBondContact O-CG2 3.48Å
567	L	79.7	Confident	73.2	Confident	3 Å²	3	18.4 Å²	18.4	2%	0.016	11%	0.108	C	C	.	.	H	α-helix	trans	-63.9	-44.4	175.3	-158.6	69.2	0	0	0	113.2	L527 K563 F564 M565 L569 G570 L571 I601 L880 I881 T884	L527-L567 HydrophobicContact CD1-CB 4.14Å; L527-L567 HydrophobicContact CD1-CD2 3.82Å; L527-L567 HydrophobicContact CD1-CG 4.19Å; K563-L567 WeakPolarHBondContact O-CB 3.36Å; K563-L567 PolarHBondContact O-N 3.43Å; F564-L567 HydrophobicContact CD1-CD2 4.48Å; F564-L567 WeakPolarHBondContact O-CB 3.5Å; F564-L567 PolarHBondContact O-N 3.42Å; M565-L567 PolarHBondContact O-N 3.05Å; L567-L569 PolarHBondContact O-N 3.47Å; L567-G570 PolarHBondContact O-N 3.28Å; L567-L571 HydrophobicContact CG-CD1 4.44Å; L567-L571 HydrophobicContact CG-CG 4.39Å; L567-L571 VanDerWaalsContact O-CG 3.29Å; L567-L571 WeakPolarHBondContact O-CG 3.32Å; L567-L571 PolarHBondContact O-N 2.9Å; L567-I601 HydrophobicContact CD1-CG2 4.1Å; L567-L880 HydrophobicContact CD1-CD2 3.04Å; L567-L880 HydrophobicContact CD2-CD2 3.92Å; L567-L880 HydrophobicContact CG-CD2 3.88Å; L567-I881 HydrophobicContact CD2-CB 4.27Å; L567-I881 HydrophobicContact CD2-CG1 3.59Å; L567-T884 HydrophobicContact CD1-CG2 4.12Å; L567-T884 WeakPolarHBondContact CD2-OG1 3.31Å
568	G	81.6	Confident	74.2	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-54	-42.4	176.1	0	0	0	0	0	111.8	F564 M565 L571 T572	F564-G568 PolarHBondContact O-N 3.1Å; M565-G568 PolarHBondContact O-N 3.46Å; G568-L571 PolarHBondContact O-N 3.33Å; G568-T572 PolarHBondContact O-N 2.9Å
569	L	82.1	Confident	75.2	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-71.4	-37.6	175.9	-163.6	145.9	0	0	0	112.7	I545 I546 L549 M565 A566 L567 L571 T572 C573 I583 L587 C602	I545-L569 HydrophobicContact CB-CD1 4.21Å; I545-L569 HydrophobicContact CG2-CB 3.91Å; I545-L569 HydrophobicContact CG2-CD1 3.79Å; I545-L569 HydrophobicContact CG2-CG 4.38Å; I546-L569 HydrophobicContact CD1-CD1 4.39Å; I546-L569 HydrophobicContact CG1-CD1 3.59Å; L549-L569 HydrophobicContact CD1-CD1 4.07Å; M565-L569 PolarHBondContact O-N 3.15Å; A566-L569 PolarHBondContact O-N 3.23Å; L567-L569 PolarHBondContact O-N 3.47Å; L569-L571 VanDerWaalsContact C-N 3.32Å; L569-L571 PolarHBondContact O-N 2.97Å; L569-T572 PolarHBondContact O-N 3.42Å; L569-T572 PolarHBondContact O-OG1 3.17Å; L569-C573 PolarHBondContact O-SG 2.94Å; L569-I583 HydrophobicContact CD2-CG2 3.81Å; L569-L587 HydrophobicContact CD1-CD2 4.13Å; L569-L587 HydrophobicContact CD2-CD1 3.97Å; L569-L587 HydrophobicContact CD2-CD2 4.41Å; L569-C602 WeakPolarHBondContact CD2-SG 3.16Å
570	G	81.4	Confident	75.8	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-61.6	-39	172.3	0	0	0	0	0	113	A566 L567 T572 C573 L574 C605	A566-G570 PolarHBondContact O-N 3.31Å; L567-G570 PolarHBondContact O-N 3.28Å; G570-T572 PolarHBondContact O-N 3.46Å; G570-C573 WeakPolarHBondContact O-CB 3.37Å; G570-C573 PolarHBondContact O-N 2.63Å; G570-C573 VanDerWaalsContact O-N 3.14Å; G570-L574 PolarHBondContact O-N 2.88Å; G570-C605 WeakPolarHBondContact O-CB 3.14Å
571	L	81.7	Confident	76.3	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-68	-33.2	-178.3	-69.6	178.5	0	0	0	112.8	L527 L531 V534 G535 L567 G568 L569 C573 L574 A877 I881	L527-L571 HydrophobicContact CD1-CD1 3.89Å; L531-L571 HydrophobicContact CD2-CD1 4.15Å; L531-L571 HydrophobicContact CG-CD1 4.25Å; V534-L571 WeakPolarHBondContact CA-O 3.46Å; G535-L571 PolarHBondContact N-O 3.35Å; L567-L571 HydrophobicContact CG-CD1 4.44Å; L567-L571 HydrophobicContact CG-CG 4.39Å; L567-L571 VanDerWaalsContact O-CG 3.29Å; L567-L571 WeakPolarHBondContact O-CG 3.32Å; L567-L571 PolarHBondContact O-N 2.9Å; G568-L571 PolarHBondContact O-N 3.33Å; L569-L571 VanDerWaalsContact C-N 3.32Å; L569-L571 PolarHBondContact O-N 2.97Å; L571-C573 PolarHBondContact O-N 3.01Å; L571-L574 WeakPolarHBondContact O-CB 3.29Å; L571-L574 PolarHBondContact O-N 2.92Å; L571-A877 HydrophobicContact CD1-CB 4.2Å; L571-A877 HydrophobicContact CD2-CB 3.48Å; L571-A877 VanDerWaalsContact CD2-CB 3.48Å; L571-A877 HydrophobicContact CG-CB 4.4Å; L571-I881 HydrophobicContact CD1-CD1 3.9Å; L571-I881 HydrophobicContact CD1-CG1 4.12Å
572	T	81.7	Confident	77	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-64.9	-31.5	172.7	65.5	0	0	0	0	111.8	S533 G535 L537 V541 G568 L569 G570 L574	S533-T572 WeakPolarHBondContact OG-CG2 3.47Å; G535-T572 PolarHBondContact N-O 2.82Å; L537-T572 PolarHBondContact N-O 2.9Å; V541-T572 HydrophobicContact CB-CG2 4.49Å; V541-T572 HydrophobicContact CG1-CG2 3.88Å; G568-T572 PolarHBondContact O-N 2.9Å; L569-T572 PolarHBondContact O-N 3.42Å; L569-T572 PolarHBondContact O-OG1 3.17Å; G570-T572 PolarHBondContact O-N 3.46Å; T572-L574 VanDerWaalsContact C-N 3.31Å; T572-L574 PolarHBondContact O-N 3.17Å
573	C	76.9	Confident	77.3	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-0.2	-179.8	-61.2	0	0	0	0	114.1	L569 G570 L571 G575 R576 V580 I583	L569-C573 PolarHBondContact O-SG 2.94Å; G570-C573 WeakPolarHBondContact O-CB 3.37Å; G570-C573 PolarHBondContact O-N 2.63Å; G570-C573 VanDerWaalsContact O-N 3.14Å; L571-C573 PolarHBondContact O-N 3.01Å; C573-G575 PolarHBondContact O-N 3.47Å; C573-R576 PolarHBondContact O-N 3.21Å; C573-V580 HydrophobicContact CB-CG2 3.6Å; C573-I583 WeakPolarHBondContact SG-CD1 3.29Å
574	L	77.8	Confident	77.6	Confident	7 Å²	7	27.2 Å²	27.2	4%	0.037	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	123.6	-171.5	-168.1	76.3	0	0	0	112	V534 G535 G570 L571 T572 R576 C605 A608 P873 L876	V534-L574 HydrophobicContact CG1-CB 3.92Å; V534-L574 HydrophobicContact CG1-CD2 3.53Å; V534-L574 HydrophobicContact CG1-CG 4.37Å; G535-L574 VanDerWaalsContact CA-O 3.26Å; G535-L574 WeakPolarHBondContact CA-O 3.39Å; G570-L574 PolarHBondContact O-N 2.88Å; L571-L574 WeakPolarHBondContact O-CB 3.29Å; L571-L574 PolarHBondContact O-N 2.92Å; T572-L574 VanDerWaalsContact C-N 3.31Å; T572-L574 PolarHBondContact O-N 3.17Å; L574-R576 VanDerWaalsContact C-N 3.27Å; L574-R576 PolarHBondContact O-N 2.98Å; L574-C605 WeakPolarHBondContact CA-O 3.21Å; L574-C605 HydrophobicContact CD1-CB 3.98Å; L574-A608 HydrophobicContact CD1-CB 3.77Å; L574-P873 HydrophobicContact CD2-CB 3.59Å; L574-P873 WeakPolarHBondContact CD2-O 3.5Å; L574-L876 HydrophobicContact CD1-CD2 4.13Å; L574-L876 HydrophobicContact CD2-CD2 4.43Å
575	G	69.6	Low	77.7	Confident	38 Å²	38	30 Å²	30	39%	0.392	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.3	4.3	173.5	0	0	0	0	0	115.5	C573 C605	C573-G575 PolarHBondContact O-N 3.47Å; G575-C605 PolarHBondContact N-O 3.28Å; G575-C605 VanDerWaalsContact N-O 3.12Å
576	R	71.4	Confident	77.8	Confident	53 Å²	53	32.5 Å²	32.5	20%	0.2	18%	0.184	C	C	.	.			trans	-107.2	114.3	168.6	-62.4	-158.3	180	178.8	-3.4	108.4	G535 S536 C573 L574 E579 V580 A606	G535-R576 PolarHBondContact O-NE 3.25Å; S536-R576 PolarHBondContact O-NH1 3.5Å; S536-R576 PolarHBondContact O-NH2 3.28Å; C573-R576 PolarHBondContact O-N 3.21Å; L574-R576 VanDerWaalsContact C-N 3.27Å; L574-R576 PolarHBondContact O-N 2.98Å; R576-E579 HydrophobicContact CB-CB 4.49Å; R576-E579 WeakPolarHBondContact CD-OE2 3.48Å; R576-E579 IonicContact CZ-OE2 3.65Å; R576-E579 IonicContact NE-OE2 2.85Å; R576-E579 IonicContact NH1-OE1 2.91Å; R576-E579 IonicContact NH1-OE2 3.44Å; R576-E579 PolarHBondContact NH1-OE2 3.45Å; R576-V580 WeakPolarHBondContact O-CG2 3.34Å; R576-A606 WeakPolarHBondContact O-CB 3.3Å
577	Q	74.4	Confident	77.7	Confident	30 Å²	30	32.6 Å²	32.6	14%	0.14	18%	0.184	C	C	.	.	S	Bend	trans	-83.1	-68	-172.8	-65.9	161.9	-11.6	0	0	110.4	T238 E579 V580 A606 Y607	T238-Q577 HydrophobicContact CG2-CB 4.46Å; T238-Q577 HydrophobicContact CG2-CG 4.46Å; Q577-E579 PolarHBondContact O-N 2.9Å; Q577-V580 WeakPolarHBondContact O-CB 3.4Å; Q577-V580 PolarHBondContact O-N 3.48Å; Q577-A606 WeakPolarHBondContact CG-O 3.15Å; Q577-Y607 HydrophobicContact CB-CE1 4.33Å; Q577-Y607 HydrophobicContact CG-CD1 4.26Å; Q577-Y607 HydrophobicContact CG-CE1 4.35Å
578	E	74.1	Confident	77.6	Confident	89 Å²	89	38 Å²	38	42%	0.416	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-41.2	-172	-66.8	168.9	-146.4	0	0	113.4	P239 N242 V580 E581	P239-E578 WeakPolarHBondContact CA-OE1 3.39Å; P239-E578 WeakPolarHBondContact CB-OE1 3.18Å; N242-E578 PolarHBondContact ND2-OE1 3.13Å; E578-V580 PolarHBondContact O-N 3.21Å; E578-E581 PolarHBondContact O-N 3.45Å; E578-E581 VanDerWaalsContact O-N 3.1Å
579	E	71.6	Confident	77.3	Confident	91 Å²	91	42 Å²	42	43%	0.425	24%	0.242	S	C	.	.	H	α-helix	trans	-62.4	-20.9	-178	-62.6	-173.6	172.3	0	0	112.8	L537 R576 Q577 E581 V582	L537-E579 HydrophobicContact CD1-CB 3.72Å; R576-E579 HydrophobicContact CB-CB 4.49Å; R576-E579 WeakPolarHBondContact CD-OE2 3.48Å; R576-E579 IonicContact CZ-OE2 3.65Å; R576-E579 IonicContact NE-OE2 2.85Å; R576-E579 IonicContact NH1-OE1 2.91Å; R576-E579 IonicContact NH1-OE2 3.44Å; R576-E579 PolarHBondContact NH1-OE2 3.45Å; Q577-E579 PolarHBondContact O-N 2.9Å; E579-E581 VanDerWaalsContact C-N 3.3Å; E579-E581 PolarHBondContact O-N 3.08Å; E579-V582 PolarHBondContact O-N 3.27Å
580	V	75.6	Confident	76.9	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.006	25%	0.246	C	C	.	.	H	α-helix	trans	-74	-23.1	-179.2	175.3	0	0	0	0	111.6	C573 R576 Q577 E578 V582 I583 L584 C602 A606	C573-V580 HydrophobicContact CB-CG2 3.6Å; R576-V580 WeakPolarHBondContact O-CG2 3.34Å; Q577-V580 WeakPolarHBondContact O-CB 3.4Å; Q577-V580 PolarHBondContact O-N 3.48Å; E578-V580 PolarHBondContact O-N 3.21Å; V580-V582 PolarHBondContact O-N 3.31Å; V580-I583 CarbonylContact O-C 3.57Å; V580-I583 PolarHBondContact O-N 3.18Å; V580-L584 HydrophobicContact CG1-CD1 4.01Å; V580-L584 HydrophobicContact CG1-CD2 4.35Å; V580-L584 HydrophobicContact CG1-CG 3.81Å; V580-L584 WeakPolarHBondContact O-CB 3.39Å; V580-L584 VanDerWaalsContact O-CG 3.27Å; V580-L584 WeakPolarHBondContact O-CG 3.5Å; V580-L584 PolarHBondContact O-N 3.29Å; V580-C602 HydrophobicContact CG1-CB 4.12Å; V580-A606 HydrophobicContact CB-CB 3.75Å; V580-A606 HydrophobicContact CG1-CB 3.83Å; V580-A606 HydrophobicContact CG2-CB 3.63Å
581	E	77.6	Confident	76.4	Confident	125 Å²	125	45.4 Å²	45.4	58%	0.584	27%	0.266	S	S	*	.	H	α-helix	trans	-60.4	-36.1	175.8	-64.1	-167.2	164.7	0	0	112.3	E578 E579 I583 L584 A585	E578-E581 PolarHBondContact O-N 3.45Å; E578-E581 VanDerWaalsContact O-N 3.1Å; E579-E581 VanDerWaalsContact C-N 3.3Å; E579-E581 PolarHBondContact O-N 3.08Å; E581-I583 VanDerWaalsContact C-N 3.35Å; E581-L584 PolarHBondContact O-N 3.45Å; E581-A585 WeakPolarHBondContact O-CB 3.44Å; E581-A585 PolarHBondContact O-N 3.11Å
582	V	81.5	Confident	75.4	Confident	103 Å²	103	53.1 Å²	53.1	62%	0.624	30%	0.302	S	S	*	.	H	α-helix	trans	-66.2	-39.4	175.3	-176.7	0	0	0	0	111	E579 V580 S586	E579-V582 PolarHBondContact O-N 3.27Å; V580-V582 PolarHBondContact O-N 3.31Å; V582-S586 PolarHBondContact O-N 3.34Å; V582-S586 VanDerWaalsContact O-N 3.12Å; V582-S586 PolarHBondContact O-OG 3.49Å
583	I	78	Confident	74.7	Confident	9 Å²	9	54.9 Å²	54.9	5%	0.046	31%	0.313	C	S	.	.	H	α-helix	trans	-70	-43	176.9	-63.3	178.2	0	0	0	110.5	L537 T542 L569 C573 V580 E581 A585 S586 L587	L537-I583 HydrophobicContact CD1-CD1 3.5Å; L537-I583 HydrophobicContact CD2-CD1 3.98Å; L537-I583 HydrophobicContact CG-CD1 3.75Å; T542-I583 HydrophobicContact CG2-CD1 3.86Å; T542-I583 HydrophobicContact CG2-CG1 4.24Å; T542-I583 HydrophobicContact CG2-CG2 4.49Å; L569-I583 HydrophobicContact CD2-CG2 3.81Å; C573-I583 WeakPolarHBondContact SG-CD1 3.29Å; V580-I583 CarbonylContact O-C 3.57Å; V580-I583 PolarHBondContact O-N 3.18Å; E581-I583 VanDerWaalsContact C-N 3.35Å; I583-A585 VanDerWaalsContact C-N 3.34Å; I583-A585 PolarHBondContact O-N 3.43Å; I583-S586 CarbonylContact O-C 3.47Å; I583-S586 WeakPolarHBondContact O-CA 3.31Å; I583-S586 WeakPolarHBondContact O-CB 3.45Å; I583-S586 PolarHBondContact O-N 3.49Å; I583-L587 HydrophobicContact CG2-CD1 4.11Å; I583-L587 HydrophobicContact CG2-CG 4.36Å; I583-L587 WeakPolarHBondContact O-CG 3.34Å; I583-L587 PolarHBondContact O-N 2.76Å
584	L	78.6	Confident	74.1	Confident	18 Å²	18	54.9 Å²	54.9	9%	0.094	31%	0.313	C	S	.	.	H	α-helix	trans	-59.4	-44.9	176.6	-68.9	173.3	0	0	0	111	V580 E581 S586 L587 E588 H599 C602	V580-L584 HydrophobicContact CG1-CD1 4.01Å; V580-L584 HydrophobicContact CG1-CD2 4.35Å; V580-L584 HydrophobicContact CG1-CG 3.81Å; V580-L584 WeakPolarHBondContact O-CB 3.39Å; V580-L584 VanDerWaalsContact O-CG 3.27Å; V580-L584 WeakPolarHBondContact O-CG 3.5Å; V580-L584 PolarHBondContact O-N 3.29Å; E581-L584 PolarHBondContact O-N 3.45Å; L584-S586 VanDerWaalsContact C-N 3.27Å; L584-S586 PolarHBondContact O-N 2.9Å; L584-L587 HydrophobicContact CD2-CD1 4.47Å; L584-L587 WeakPolarHBondContact O-CB 3.48Å; L584-L587 PolarHBondContact O-N 3.47Å; L584-L587 VanDerWaalsContact O-N 3.13Å; L584-E588 PolarHBondContact O-N 2.91Å; L584-H599 HydrophobicContact CD2-CB 4.36Å; L584-H599 WeakPolarHBondContact CD2-O 3.36Å; L584-C602 HydrophobicContact CD2-CB 3.67Å
585	A	80.7	Confident	73.9	Confident	60 Å²	60	57.2 Å²	57.2	50%	0.496	32%	0.323	S	S	.	.	H	α-helix	trans	-60.1	-37.8	174.1	0	0	0	0	0	112.1	E581 I583 E588	E581-A585 WeakPolarHBondContact O-CB 3.44Å; E581-A585 PolarHBondContact O-N 3.11Å; I583-A585 VanDerWaalsContact C-N 3.34Å; I583-A585 PolarHBondContact O-N 3.43Å; A585-E588 WeakPolarHBondContact O-CB 3.45Å; A585-E588 PolarHBondContact O-N 2.78Å
586	S	78.5	Confident	74.1	Confident	56 Å²	56	58 Å²	58	39%	0.392	32%	0.322	S	S	.	.	H	α-helix	trans	-68.9	-33.4	176.3	-56.7	0	0	0	0	112.6	V582 I583 L584 E588	V582-S586 PolarHBondContact O-N 3.34Å; V582-S586 VanDerWaalsContact O-N 3.12Å; V582-S586 PolarHBondContact O-OG 3.49Å; I583-S586 CarbonylContact O-C 3.47Å; I583-S586 WeakPolarHBondContact O-CA 3.31Å; I583-S586 WeakPolarHBondContact O-CB 3.45Å; I583-S586 PolarHBondContact O-N 3.49Å; L584-S586 VanDerWaalsContact C-N 3.27Å; L584-S586 PolarHBondContact O-N 2.9Å; S586-E588 PolarHBondContact O-N 3.46Å
587	L	77.4	Confident	74.3	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.005	32%	0.316	C	S	.	.	H	α-helix	trans	-71.6	-16.5	177	-70.5	170.6	0	0	0	113	I546 L549 L569 I583 L584 A589 V590 A598 C602	I546-L587 HydrophobicContact CG1-CD2 4.46Å; L549-L587 HydrophobicContact CD1-CD2 4.22Å; L569-L587 HydrophobicContact CD1-CD2 4.13Å; L569-L587 HydrophobicContact CD2-CD1 3.97Å; L569-L587 HydrophobicContact CD2-CD2 4.41Å; I583-L587 HydrophobicContact CG2-CD1 4.11Å; I583-L587 HydrophobicContact CG2-CG 4.36Å; I583-L587 WeakPolarHBondContact O-CG 3.34Å; I583-L587 PolarHBondContact O-N 2.76Å; L584-L587 HydrophobicContact CD2-CD1 4.47Å; L584-L587 WeakPolarHBondContact O-CB 3.48Å; L584-L587 PolarHBondContact O-N 3.47Å; L584-L587 VanDerWaalsContact O-N 3.13Å; L587-A589 PolarHBondContact O-N 2.92Å; L587-V590 HydrophobicContact CD2-CG2 4.43Å; L587-V590 WeakPolarHBondContact O-CB 3.31Å; L587-V590 PolarHBondContact O-N 2.99Å; L587-V590 VanDerWaalsContact O-N 3.12Å; L587-A598 HydrophobicContact CD1-CB 4.26Å; L587-A598 HydrophobicContact CD2-CB 4.25Å; L587-C602 HydrophobicContact CD1-CB 4.41Å
588	E	77.2	Confident	74.4	Confident	118 Å²	118	54.8 Å²	54.8	55%	0.551	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-23.1	178.5	-68	-170	169.3	0	0	113.9	L584 A585 S586 V590 K595	L584-E588 PolarHBondContact O-N 2.91Å; A585-E588 WeakPolarHBondContact O-CB 3.45Å; A585-E588 PolarHBondContact O-N 2.78Å; S586-E588 PolarHBondContact O-N 3.46Å; E588-V590 VanDerWaalsContact C-N 3.26Å; E588-V590 PolarHBondContact O-N 3.04Å; E588-K595 PolarHBondContact O-NZ 2.94Å
589	A	75.9	Confident	74.7	Confident	82 Å²	82	54 Å²	54	68%	0.678	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-10.2	177.1	0	0	0	0	0	113.8	L587	L587-A589 PolarHBondContact O-N 2.92Å
590	V	73	Confident	75.1	Confident	12 Å²	12	50.3 Å²	50.3	7%	0.073	29%	0.289	C	S	.	.	S	Bend	trans	-81.7	148.6	-178.7	-176.4	0	0	0	0	111	L587 E588	L587-V590 HydrophobicContact CD2-CG2 4.43Å; L587-V590 WeakPolarHBondContact O-CB 3.31Å; L587-V590 PolarHBondContact O-N 2.99Å; L587-V590 VanDerWaalsContact O-N 3.12Å; E588-V590 VanDerWaalsContact C-N 3.26Å; E588-V590 PolarHBondContact O-N 3.04Å
591	S	71.3	Confident	75.4	Confident	60 Å²	60	50.6 Å²	50.6	42%	0.42	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-66.2	143.7	178.4	59.9	0	0	0	0	113.8	K595	S591-K595 PolarHBondContact O-N 3.12Å
592	E	61.2	Low	75.6	Confident	163 Å²	163	44.6 Å²	44.6	76%	0.762	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	134.3	170.8	-60.4	178.4	175	0	0	108.7	K595	E592-K595 HydrophobicContact CG-CD 4.46Å
593	P	65.5	Low	75.6	Confident	36 Å²	36	40.3 Å²	40.3	23%	0.234	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	cis	-97.4	-12.2	21.2	35.6	-35.9	0	0	0	116.7	W557 K595 S596 H732	W557-P593 HydrophobicContact CB-CG 4.48Å; W557-P593 HydrophobicContact CG-CG 4.37Å; P593-K595 VanDerWaalsContact C-N 3.28Å; P593-K595 PolarHBondContact O-N 2.63Å; P593-S596 PolarHBondContact O-N 3.3Å; P593-S596 PolarHBondContact O-OG 3.23Å; P593-H732 PolarHBondContact O-CE1 3.25Å
594	M	65.6	Low	75.6	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-63.2	-34	-178.9	-173.8	66.4	160.2	0	0	112.6	L549 W557 S562 M565 A566 S596 M597 A598	L549-M594 HydrophobicContact CD2-CE 3.32Å; L549-M594 HydrophobicContact CD2-CG 4.1Å; W557-M594 HydrophobicContact CD2-CB 4.12Å; W557-M594 HydrophobicContact CE3-CB 3.73Å; W557-M594 HydrophobicContact CE3-CG 4.02Å; W557-M594 HydrophobicContact CE3-SD 4.03Å; W557-M594 HydrophobicContact CH2-CB 3.38Å; W557-M594 HydrophobicContact CH2-CG 3.48Å; W557-M594 VanDerWaalsContact CH2-CG 3.48Å; W557-M594 HydrophobicContact CH2-SD 4.39Å; W557-M594 HydrophobicContact CZ2-CB 3.74Å; W557-M594 HydrophobicContact CZ2-CG 4.34Å; W557-M594 HydrophobicContact CZ3-CB 3.36Å; W557-M594 HydrophobicContact CZ3-CE 3.96Å; W557-M594 HydrophobicContact CZ3-CG 3.27Å; W557-M594 HydrophobicContact CZ3-SD 3.58Å; W557-M594 VanDerWaalsContact CZ3-SD 3.58Å; S562-M594 WeakPolarHBondContact O-CE 3.1Å; M565-M594 HydrophobicContact CB-CE 4.11Å; M565-M594 HydrophobicContact CG-CE 4.36Å; A566-M594 HydrophobicContact CB-CE 3.65Å; A566-M594 HydrophobicContact CB-SD 4.24Å; M594-S596 VanDerWaalsContact C-N 3.32Å; M594-S596 PolarHBondContact O-N 2.8Å; M594-M597 PolarHBondContact O-N 3.06Å; M594-M597 VanDerWaalsContact O-N 3.12Å; M594-A598 WeakPolarHBondContact O-CB 3.45Å; M594-A598 PolarHBondContact O-N 2.73Å
595	K	73.8	Confident	75.5	Confident	56 Å²	56	39.5 Å²	39.5	24%	0.243	23%	0.232	C	C	.	.	H	α-helix	trans	-48.9	-52.4	175.2	174.1	173.5	171.4	165.8	0	112.1	E588 S591 E592 P593 M597 H599	E588-K595 PolarHBondContact O-NZ 2.94Å; S591-K595 PolarHBondContact O-N 3.12Å; E592-K595 HydrophobicContact CG-CD 4.46Å; P593-K595 VanDerWaalsContact C-N 3.28Å; P593-K595 PolarHBondContact O-N 2.63Å; K595-M597 VanDerWaalsContact C-N 3.34Å; K595-M597 PolarHBondContact O-N 3.03Å; K595-H599 WeakPolarHBondContact O-CB 3.48Å; K595-H599 PolarHBondContact O-N 2.82Å
596	S	73.7	Confident	75.4	Confident	54 Å²	54	36.6 Å²	36.6	38%	0.378	21%	0.208	S	C	.	.	H	α-helix	trans	-67.3	-35.5	-178.5	68.5	0	0	0	0	112.3	P593 M594 M600 H732	P593-S596 PolarHBondContact O-N 3.3Å; P593-S596 PolarHBondContact O-OG 3.23Å; M594-S596 VanDerWaalsContact C-N 3.32Å; M594-S596 PolarHBondContact O-N 2.8Å; S596-M600 WeakPolarHBondContact O-CB 3.42Å; S596-M600 PolarHBondContact O-N 2.73Å; S596-H732 PolarHBondContact OG-CE1 3.41Å; S596-H732 PolarHBondContact OG-NE2 2.9Å
597	M	74.2	Confident	75.3	Confident	15 Å²	15	34.5 Å²	34.5	7%	0.074	19%	0.191	C	C	.	.	H	α-helix	trans	-68.4	-48	177.2	-158.8	-177.1	-48.1	0	0	112.2	K563 M594 K595 M600 I601 L735	K563-M597 HydrophobicContact CB-SD 4.48Å; K563-M597 HydrophobicContact CG-SD 3.87Å; M594-M597 PolarHBondContact O-N 3.06Å; M594-M597 VanDerWaalsContact O-N 3.12Å; K595-M597 VanDerWaalsContact C-N 3.34Å; K595-M597 PolarHBondContact O-N 3.03Å; M597-M600 PolarHBondContact O-N 3.32Å; M597-I601 HydrophobicContact CG-CD1 4.01Å; M597-I601 WeakPolarHBondContact O-CB 3.39Å; M597-I601 WeakPolarHBondContact O-CG1 3.19Å; M597-I601 PolarHBondContact O-N 2.82Å; M597-L735 HydrophobicContact CG-CD1 3.52Å; M597-L735 HydrophobicContact SD-CD1 3.95Å
598	A	77.1	Confident	75.2	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.008	20%	0.199	C	C	.	.	H	α-helix	trans	-65.2	-47.3	178.8	0	0	0	0	0	110.4	A566 L587 M594 M600 I601 C602	A566-A598 HydrophobicContact CB-CB 4.25Å; L587-A598 HydrophobicContact CD1-CB 4.26Å; L587-A598 HydrophobicContact CD2-CB 4.25Å; M594-A598 WeakPolarHBondContact O-CB 3.45Å; M594-A598 PolarHBondContact O-N 2.73Å; A598-M600 VanDerWaalsContact C-N 3.27Å; A598-M600 PolarHBondContact O-N 3.22Å; A598-I601 PolarHBondContact O-N 3.43Å; A598-C602 WeakPolarHBondContact O-CB 3.32Å; A598-C602 PolarHBondContact O-N 3.29Å; A598-C602 PolarHBondContact O-SG 3.12Å
599	H	81.6	Confident	74.7	Confident	71 Å²	71	30.5 Å²	30.5	33%	0.329	18%	0.18	S	C	.	.	H	α-helix	trans	-54.1	-46.4	175.5	-176	-71	0	0	0	111.4	L584 K595 D603	L584-H599 HydrophobicContact CD2-CB 4.36Å; L584-H599 WeakPolarHBondContact CD2-O 3.36Å; K595-H599 WeakPolarHBondContact O-CB 3.48Å; K595-H599 PolarHBondContact O-N 2.82Å; H599-D603 WeakPolarHBondContact O-CB 3.47Å; H599-D603 PolarHBondContact O-N 2.74Å
600	M	79	Confident	74.4	Confident	15 Å²	15	27.3 Å²	27.3	7%	0.074	15%	0.153	C	C	.	.	H	α-helix	trans	-65.9	-46	179.7	-177.9	-179.6	-70.5	0	0	112.7	S596 M597 A598 C602 D603 F604 I622 L735 A736	S596-M600 WeakPolarHBondContact O-CB 3.42Å; S596-M600 PolarHBondContact O-N 2.73Å; M597-M600 PolarHBondContact O-N 3.32Å; A598-M600 VanDerWaalsContact C-N 3.27Å; A598-M600 PolarHBondContact O-N 3.22Å; M600-C602 VanDerWaalsContact C-N 3.35Å; M600-C602 PolarHBondContact O-N 3.35Å; M600-D603 PolarHBondContact O-N 3Å; M600-F604 HydrophobicContact CB-CE2 4.46Å; M600-F604 HydrophobicContact CB-CZ 4.36Å; M600-F604 HydrophobicContact CG-CD2 4.06Å; M600-F604 HydrophobicContact CG-CE1 3.79Å; M600-F604 HydrophobicContact CG-CE2 3.16Å; M600-F604 HydrophobicContact CG-CZ 3Å; M600-F604 WeakPolarHBondContact O-CD1 3.02Å; M600-F604 WeakPolarHBondContact O-CD2 3.44Å; M600-F604 WeakPolarHBondContact O-CG 3.38Å; M600-F604 PolarHBondContact O-N 3.46Å; M600-F604 HydrophobicContact SD-CE2 3.71Å; M600-F604 HydrophobicContact SD-CZ 3.65Å; M600-I622 HydrophobicContact CE-CD1 4.1Å; M600-I622 HydrophobicContact CE-CG2 3.8Å; M600-L735 HydrophobicContact SD-CB 4.3Å; M600-A736 HydrophobicContact CE-CB 4.16Å; M600-A736 HydrophobicContact SD-CB 3.8Å
601	I	82	Confident	74.3	Confident	6 Å²	6	27.1 Å²	27.1	3%	0.031	15%	0.153	C	C	.	.	H	α-helix	trans	-63.7	-41.2	178.6	-74.3	167.7	0	0	0	111.1	A566 L567 M597 A598 F604 C605 L735	A566-I601 HydrophobicContact CB-CD1 3.61Å; A566-I601 WeakPolarHBondContact O-CG2 3.48Å; L567-I601 HydrophobicContact CD1-CG2 4.1Å; M597-I601 HydrophobicContact CG-CD1 4.01Å; M597-I601 WeakPolarHBondContact O-CB 3.39Å; M597-I601 WeakPolarHBondContact O-CG1 3.19Å; M597-I601 PolarHBondContact O-N 2.82Å; A598-I601 PolarHBondContact O-N 3.43Å; I601-F604 PolarHBondContact O-N 2.91Å; I601-C605 WeakPolarHBondContact O-CB 3.35Å; I601-C605 PolarHBondContact O-N 2.77Å; I601-C605 PolarHBondContact O-SG 3.29Å; I601-C605 VanDerWaalsContact O-SG 3.38Å; I601-L735 HydrophobicContact CD1-CD1 4.12Å; I601-L735 HydrophobicContact CD1-CD2 4.28Å; I601-L735 HydrophobicContact CG1-CD1 4.48Å; I601-L735 HydrophobicContact CG1-CD2 4.39Å
602	C	82.3	Confident	74.3	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-61.6	-45.4	175.1	-68	0	0	0	0	111.9	L569 V580 L584 L587 A598 M600 F604 C605 A606	L569-C602 WeakPolarHBondContact CD2-SG 3.16Å; V580-C602 HydrophobicContact CG1-CB 4.12Å; L584-C602 HydrophobicContact CD2-CB 3.67Å; L587-C602 HydrophobicContact CD1-CB 4.41Å; A598-C602 WeakPolarHBondContact O-CB 3.32Å; A598-C602 PolarHBondContact O-N 3.29Å; A598-C602 PolarHBondContact O-SG 3.12Å; M600-C602 VanDerWaalsContact C-N 3.35Å; M600-C602 PolarHBondContact O-N 3.35Å; C602-F604 VanDerWaalsContact C-N 3.33Å; C602-F604 PolarHBondContact O-N 3.36Å; C602-C605 PolarHBondContact O-N 3.39Å; C602-A606 VanDerWaalsContact O-CB 3.24Å; C602-A606 WeakPolarHBondContact O-CB 3.33Å; C602-A606 PolarHBondContact O-N 3.47Å
603	D	81.5	Confident	75	Confident	13 Å²	13	22.2 Å²	22.2	7%	0.07	13%	0.131	C	C	.	.	H	α-helix	trans	-60.2	-43.3	177.8	-156.3	28	0	0	0	110.4	H599 M600 C605 A606 Y607 K615	H599-D603 WeakPolarHBondContact O-CB 3.47Å; H599-D603 PolarHBondContact O-N 2.74Å; M600-D603 PolarHBondContact O-N 3Å; D603-C605 PolarHBondContact O-N 2.72Å; D603-A606 PolarHBondContact O-N 3.1Å; D603-Y607 WeakPolarHBondContact O-CD2 3.36Å; D603-Y607 PolarHBondContact O-N 3.18Å; D603-Y607 VanDerWaalsContact O-N 3.12Å; D603-Y607 WeakPolarHBondContact OD1-CD2 3.37Å; D603-Y607 WeakPolarHBondContact OD1-CE2 3.29Å; D603-K615 IonicContact OD1-NZ 3.49Å; D603-K615 PolarHBondContact OD1-NZ 2.96Å; D603-K615 IonicContact OD2-NZ 3.48Å; D603-K615 PolarHBondContact OD2-NZ 3.31Å
604	F	78.4	Confident	75.7	Confident	7 Å²	7	26 Å²	26	3%	0.031	15%	0.148	C	C	.	.	H	α-helix	trans	-67.8	-40	-180	-57.6	-18.7	0	0	0	114	M600 I601 C602 A608 L619 L735 A736 I743	M600-F604 HydrophobicContact CB-CE2 4.46Å; M600-F604 HydrophobicContact CB-CZ 4.36Å; M600-F604 HydrophobicContact CG-CD2 4.06Å; M600-F604 HydrophobicContact CG-CE1 3.79Å; M600-F604 HydrophobicContact CG-CE2 3.16Å; M600-F604 HydrophobicContact CG-CZ 3Å; M600-F604 WeakPolarHBondContact O-CD1 3.02Å; M600-F604 WeakPolarHBondContact O-CD2 3.44Å; M600-F604 WeakPolarHBondContact O-CG 3.38Å; M600-F604 PolarHBondContact O-N 3.46Å; M600-F604 HydrophobicContact SD-CE2 3.71Å; M600-F604 HydrophobicContact SD-CZ 3.65Å; I601-F604 PolarHBondContact O-N 2.91Å; C602-F604 VanDerWaalsContact C-N 3.33Å; C602-F604 PolarHBondContact O-N 3.36Å; F604-A608 PolarHBondContact O-N 2.91Å; F604-A608 VanDerWaalsContact O-N 3.17Å; F604-L619 HydrophobicContact CD1-CD1 3.54Å; F604-L619 HydrophobicContact CD1-CD2 4.32Å; F604-L619 HydrophobicContact CD1-CG 4.45Å; F604-L619 HydrophobicContact CE1-CD1 3.01Å; F604-L619 HydrophobicContact CE1-CD2 3.18Å; F604-L619 HydrophobicContact CE1-CG 3.56Å; F604-L619 HydrophobicContact CZ-CD1 3.67Å; F604-L619 HydrophobicContact CZ-CD2 3.6Å; F604-L619 HydrophobicContact CZ-CG 4.08Å; F604-L735 VanDerWaalsContact CE2-O 3.29Å; F604-L735 WeakPolarHBondContact CE2-O 3.37Å; F604-A736 HydrophobicContact CZ-CB 4.26Å; F604-I743 HydrophobicContact CD1-CD1 4.4Å
605	C	76.3	Confident	76.1	Confident	2 Å²	2	27.7 Å²	27.7	1%	0.014	16%	0.156	C	C	.	.	H	α-helix	trans	-72	-36.6	179	-68.8	0	0	0	0	111.4	G570 L574 G575 I601 C602 D603 A608	G570-C605 WeakPolarHBondContact O-CB 3.14Å; L574-C605 WeakPolarHBondContact CA-O 3.21Å; L574-C605 HydrophobicContact CD1-CB 3.98Å; G575-C605 PolarHBondContact N-O 3.28Å; G575-C605 VanDerWaalsContact N-O 3.12Å; I601-C605 WeakPolarHBondContact O-CB 3.35Å; I601-C605 PolarHBondContact O-N 2.77Å; I601-C605 PolarHBondContact O-SG 3.29Å; I601-C605 VanDerWaalsContact O-SG 3.38Å; C602-C605 PolarHBondContact O-N 3.39Å; D603-C605 PolarHBondContact O-N 2.72Å; C605-A608 WeakPolarHBondContact O-CB 3.45Å; C605-A608 PolarHBondContact O-N 3.14Å
606	A	78.9	Confident	76.3	Confident	0 Å²	0	26 Å²	26	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-60.8	-46.4	175.8	0	0	0	0	0	112	R576 Q577 V580 C602 D603 A608	R576-A606 WeakPolarHBondContact O-CB 3.3Å; Q577-A606 WeakPolarHBondContact CG-O 3.15Å; V580-A606 HydrophobicContact CB-CB 3.75Å; V580-A606 HydrophobicContact CG1-CB 3.83Å; V580-A606 HydrophobicContact CG2-CB 3.63Å; C602-A606 VanDerWaalsContact O-CB 3.24Å; C602-A606 WeakPolarHBondContact O-CB 3.33Å; C602-A606 PolarHBondContact O-N 3.47Å; D603-A606 PolarHBondContact O-N 3.1Å; A606-A608 VanDerWaalsContact C-N 3.32Å; A606-A608 PolarHBondContact O-N 3.14Å
607	Y	75.7	Confident	76.6	Confident	11 Å²	11	28.6 Å²	28.6	4%	0.043	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	12.6	-176.9	-68.7	-75.8	0	0	0	113.9	Q577 D603 G609 S610 K615	Q577-Y607 HydrophobicContact CB-CE1 4.33Å; Q577-Y607 HydrophobicContact CG-CD1 4.26Å; Q577-Y607 HydrophobicContact CG-CE1 4.35Å; D603-Y607 WeakPolarHBondContact O-CD2 3.36Å; D603-Y607 PolarHBondContact O-N 3.18Å; D603-Y607 VanDerWaalsContact O-N 3.12Å; D603-Y607 WeakPolarHBondContact OD1-CD2 3.37Å; D603-Y607 WeakPolarHBondContact OD1-CE2 3.29Å; Y607-G609 PolarHBondContact O-N 3.22Å; Y607-S610 WeakPolarHBondContact O-CB 3.42Å; Y607-S610 PolarHBondContact O-N 3.25Å; Y607-S610 PolarHBondContact O-OG 2.94Å; Y607-K615 HydrophobicContact CD1-CG 4.16Å; Y607-K615 HydrophobicContact CD2-CD 3.86Å; Y607-K615 HydrophobicContact CD2-CG 3.91Å; Y607-K615 HydrophobicContact CE1-CG 4.28Å; Y607-K615 HydrophobicContact CE2-CD 3.8Å; Y607-K615 HydrophobicContact CE2-CG 4.13Å; Y607-K615 HydrophobicContact CG-CD 4.44Å; Y607-K615 HydrophobicContact CG-CG 3.98Å; Y607-K615 VanDerWaalsContact CZ-CE 3.41Å
608	A	74.2	Confident	76.8	Confident	19 Å²	19	32.2 Å²	32.2	16%	0.157	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	126.1	179.1	0	0	0	0	0	111.7	L574 F604 C605 A606 S610 I742 L876	L574-A608 HydrophobicContact CD1-CB 3.77Å; F604-A608 PolarHBondContact O-N 2.91Å; F604-A608 VanDerWaalsContact O-N 3.17Å; C605-A608 WeakPolarHBondContact O-CB 3.45Å; C605-A608 PolarHBondContact O-N 3.14Å; A606-A608 VanDerWaalsContact C-N 3.32Å; A606-A608 PolarHBondContact O-N 3.14Å; A608-S610 VanDerWaalsContact C-N 3.25Å; A608-S610 PolarHBondContact O-N 3.49Å; A608-I742 HydrophobicContact CB-CG2 3.47Å; A608-I742 VanDerWaalsContact CB-CG2 3.47Å; A608-L876 HydrophobicContact CB-CD2 4.26Å
609	G	68.1	Low	76.7	Confident	16 Å²	16	32.3 Å²	32.3	17%	0.165	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.2	9.1	178.4	0	0	0	0	0	116.3	Y607 I742	Y607-G609 PolarHBondContact O-N 3.22Å; G609-I742 PolarHBondContact N-O 2.93Å
610	S	69.9	Low	76.4	Confident	15 Å²	15	31.3 Å²	31.3	11%	0.105	17%	0.172	C	C	.	.			trans	-87.6	-13.5	-178.9	66.9	0	0	0	0	115.1	Y607 A608 N612	Y607-S610 WeakPolarHBondContact O-CB 3.42Å; Y607-S610 PolarHBondContact O-N 3.25Å; Y607-S610 PolarHBondContact O-OG 2.94Å; A608-S610 VanDerWaalsContact C-N 3.25Å; A608-S610 PolarHBondContact O-N 3.49Å; S610-N612 PolarHBondContact O-N 3.14Å; S610-N612 VanDerWaalsContact O-N 3.09Å
611	G	69	Low	76.3	Confident	8 Å²	8	36.4 Å²	36.4	8%	0.082	20%	0.196	C	C	.	.			trans	66.3	6.4	-178.2	0	0	0	0	0	115.2	V613 I743	G611-V613 PolarHBondContact O-N 3.01Å; G611-I743 PolarHBondContact N-O 3.38Å
612	N	73.1	Confident	75.9	Confident	36 Å²	36	39.1 Å²	39.1	19%	0.193	21%	0.209	C	C	.	.			trans	-64.5	107.7	-170.9	-170.1	-18.1	0	0	0	112.7	S610 L614 K615 I616	S610-N612 PolarHBondContact O-N 3.14Å; S610-N612 VanDerWaalsContact O-N 3.09Å; N612-L614 VanDerWaalsContact C-N 3.31Å; N612-L614 PolarHBondContact O-N 3.16Å; N612-L614 WeakPolarHBondContact OD1-CB 3.49Å; N612-L614 PolarHBondContact OD1-N 2.82Å; N612-K615 HydrophobicContact CB-CB 4.49Å; N612-K615 HydrophobicContact CB-CG 4.44Å; N612-K615 PolarHBondContact O-N 2.84Å; N612-I616 PolarHBondContact O-N 2.98Å
613	V	75.6	Confident	75.2	Confident	84 Å²	84	39.8 Å²	39.8	51%	0.509	21%	0.213	S	C	.	.	H	α-helix	trans	-65	-32.6	-177.4	-177.6	0	0	0	0	112.2	G611 K615 I616 Q617	G611-V613 PolarHBondContact O-N 3.01Å; V613-K615 VanDerWaalsContact C-N 3.31Å; V613-K615 PolarHBondContact O-N 2.84Å; V613-I616 PolarHBondContact O-N 2.93Å; V613-Q617 HydrophobicContact CG1-CG 4.28Å; V613-Q617 WeakPolarHBondContact O-CB 3.35Å; V613-Q617 WeakPolarHBondContact O-CG 3.39Å; V613-Q617 PolarHBondContact O-N 3.04Å
614	L	78.8	Confident	74.5	Confident	115 Å²	115	42.7 Å²	42.7	60%	0.602	23%	0.234	S	C	*	.	H	α-helix	trans	-63.2	-41.8	179.4	-68	168.2	0	0	0	111	N612 Q617 N618	N612-L614 VanDerWaalsContact C-N 3.31Å; N612-L614 PolarHBondContact O-N 3.16Å; N612-L614 WeakPolarHBondContact OD1-CB 3.49Å; N612-L614 PolarHBondContact OD1-N 2.82Å; L614-Q617 PolarHBondContact O-N 3.22Å; L614-N618 VanDerWaalsContact O-CG 3.29Å; L614-N618 PolarHBondContact O-N 3.38Å
615	K	75.2	Confident	73.8	Confident	38 Å²	38	47.7 Å²	47.7	17%	0.165	26%	0.258	C	S	.	.	H	α-helix	trans	-65.7	-48.1	175.7	-68.9	-73.4	175.3	160.6	0	109.9	D603 Y607 N612 V613 Q617 N618 L619 I743	D603-K615 IonicContact OD1-NZ 3.49Å; D603-K615 PolarHBondContact OD1-NZ 2.96Å; D603-K615 IonicContact OD2-NZ 3.48Å; D603-K615 PolarHBondContact OD2-NZ 3.31Å; Y607-K615 HydrophobicContact CD1-CG 4.16Å; Y607-K615 HydrophobicContact CD2-CD 3.86Å; Y607-K615 HydrophobicContact CD2-CG 3.91Å; Y607-K615 HydrophobicContact CE1-CG 4.28Å; Y607-K615 HydrophobicContact CE2-CD 3.8Å; Y607-K615 HydrophobicContact CE2-CG 4.13Å; Y607-K615 HydrophobicContact CG-CD 4.44Å; Y607-K615 HydrophobicContact CG-CG 3.98Å; Y607-K615 VanDerWaalsContact CZ-CE 3.41Å; N612-K615 HydrophobicContact CB-CB 4.49Å; N612-K615 HydrophobicContact CB-CG 4.44Å; N612-K615 PolarHBondContact O-N 2.84Å; V613-K615 VanDerWaalsContact C-N 3.31Å; V613-K615 PolarHBondContact O-N 2.84Å; K615-Q617 VanDerWaalsContact C-N 3.26Å; K615-Q617 PolarHBondContact O-N 3.12Å; K615-N618 WeakPolarHBondContact O-CB 3.42Å; K615-N618 PolarHBondContact O-N 2.98Å; K615-N618 VanDerWaalsContact O-N 3.08Å; K615-L619 VanDerWaalsContact O-CG 3.29Å; K615-L619 WeakPolarHBondContact O-CG 3.18Å; K615-L619 PolarHBondContact O-N 2.88Å; K615-I743 HydrophobicContact CB-CD1 4.26Å
616	I	77.3	Confident	72.6	Confident	21 Å²	21	55.6 Å²	55.6	11%	0.108	29%	0.292	C	S	.	.	H	α-helix	trans	-53.3	-45.2	174.6	-62.8	170.6	0	0	0	111	N612 V613 N618 L619 L620 V740 I743 M757	N612-I616 PolarHBondContact O-N 2.98Å; V613-I616 PolarHBondContact O-N 2.93Å; I616-N618 PolarHBondContact O-N 3.21Å; I616-L619 PolarHBondContact O-N 3.45Å; I616-L620 HydrophobicContact CG2-CD1 4.2Å; I616-L620 HydrophobicContact CG2-CG 4.37Å; I616-L620 VanDerWaalsContact O-CG 3.28Å; I616-L620 WeakPolarHBondContact O-CG 3.29Å; I616-L620 PolarHBondContact O-N 3.05Å; I616-V740 HydrophobicContact CG2-CG1 4.26Å; I616-I743 HydrophobicContact CD1-CG2 3.92Å; I616-I743 HydrophobicContact CG1-CB 4.22Å; I616-I743 HydrophobicContact CG1-CG2 3.8Å; I616-M757 HydrophobicContact CG2-CE 4.08Å
617	Q	80.1	Confident	70.8	Confident	107 Å²	107	63.5 Å²	63.5	50%	0.5	32%	0.323	S	S	.	.	H	α-helix	trans	-61.1	-43.9	177.7	-75.8	179.6	0.2	0	0	112.9	V613 L614 K615 L619 L620 H621	V613-Q617 HydrophobicContact CG1-CG 4.28Å; V613-Q617 WeakPolarHBondContact O-CB 3.35Å; V613-Q617 WeakPolarHBondContact O-CG 3.39Å; V613-Q617 PolarHBondContact O-N 3.04Å; L614-Q617 PolarHBondContact O-N 3.22Å; K615-Q617 VanDerWaalsContact C-N 3.26Å; K615-Q617 PolarHBondContact O-N 3.12Å; Q617-L619 PolarHBondContact O-N 3.44Å; Q617-L620 PolarHBondContact O-N 3.36Å; Q617-H621 PolarHBondContact O-N 3.35Å
618	N	78	Confident	68.6	Low	91 Å²	91	71.1 Å²	71.1	49%	0.487	36%	0.359	S	S	.	.	H	α-helix	trans	-59.3	-39	175.7	-68.3	-16.4	0	0	0	111.2	L614 K615 I616 H621 I622	L614-N618 VanDerWaalsContact O-CG 3.29Å; L614-N618 PolarHBondContact O-N 3.38Å; K615-N618 WeakPolarHBondContact O-CB 3.42Å; K615-N618 PolarHBondContact O-N 2.98Å; K615-N618 VanDerWaalsContact O-N 3.08Å; I616-N618 PolarHBondContact O-N 3.21Å; N618-H621 WeakPolarHBondContact O-CB 3.43Å; N618-H621 PolarHBondContact O-N 3.25Å; N618-I622 WeakPolarHBondContact O-CG1 3.16Å; N618-I622 PolarHBondContact O-N 3.46Å
619	L	75	Confident	66.7	Low	3 Å²	3	78 Å²	78	2%	0.016	39%	0.388	C	S	.	.	H	α-helix	trans	-71.4	-35.7	178.1	-55.7	177.9	0	0	0	113.2	F604 K615 I616 Q617 H621 I622 L623 V740 I743	F604-L619 HydrophobicContact CD1-CD1 3.54Å; F604-L619 HydrophobicContact CD1-CD2 4.32Å; F604-L619 HydrophobicContact CD1-CG 4.45Å; F604-L619 HydrophobicContact CE1-CD1 3.01Å; F604-L619 HydrophobicContact CE1-CD2 3.18Å; F604-L619 HydrophobicContact CE1-CG 3.56Å; F604-L619 HydrophobicContact CZ-CD1 3.67Å; F604-L619 HydrophobicContact CZ-CD2 3.6Å; F604-L619 HydrophobicContact CZ-CG 4.08Å; K615-L619 VanDerWaalsContact O-CG 3.29Å; K615-L619 WeakPolarHBondContact O-CG 3.18Å; K615-L619 PolarHBondContact O-N 2.88Å; I616-L619 PolarHBondContact O-N 3.45Å; Q617-L619 PolarHBondContact O-N 3.44Å; L619-H621 VanDerWaalsContact C-N 3.26Å; L619-H621 PolarHBondContact O-N 2.92Å; L619-I622 HydrophobicContact CD2-CD1 4.09Å; L619-I622 PolarHBondContact O-N 3.17Å; L619-L623 WeakPolarHBondContact O-CB 3.23Å; L619-L623 VanDerWaalsContact O-CG 3.23Å; L619-L623 WeakPolarHBondContact O-CG 3.37Å; L619-L623 PolarHBondContact O-N 2.78Å; L619-V740 HydrophobicContact CB-CG2 4.1Å; L619-V740 HydrophobicContact CD1-CG2 4.27Å; L619-I743 HydrophobicContact CD1-CD1 3.82Å
620	L	75.4	Confident	64.8	Low	51 Å²	51	85.6 Å²	85.6	27%	0.267	42%	0.416	S	S	.	.	H	α-helix	trans	-65.5	-35.7	170.9	-63.7	168.6	0	0	0	111.7	I616 Q617 I622 L623 S624 M757	I616-L620 HydrophobicContact CG2-CD1 4.2Å; I616-L620 HydrophobicContact CG2-CG 4.37Å; I616-L620 VanDerWaalsContact O-CG 3.28Å; I616-L620 WeakPolarHBondContact O-CG 3.29Å; I616-L620 PolarHBondContact O-N 3.05Å; Q617-L620 PolarHBondContact O-N 3.36Å; L620-I622 VanDerWaalsContact C-N 3.33Å; L620-L623 HydrophobicContact CD2-CD1 4.29Å; L620-L623 CarbonylContact O-C 3.48Å; L620-L623 PolarHBondContact O-N 2.89Å; L620-S624 VanDerWaalsContact O-CB 3.27Å; L620-S624 WeakPolarHBondContact O-CB 3.1Å; L620-S624 PolarHBondContact O-N 3.49Å; L620-S624 PolarHBondContact O-OG 3.12Å; L620-M757 HydrophobicContact CD1-CE 3.12Å; L620-M757 HydrophobicContact CD2-CE 3.24Å; L620-M757 HydrophobicContact CG-CE 3.62Å
621	H	78.1	Confident	62.7	Low	122 Å²	122	93.1 Å²	93.1	57%	0.565	45%	0.45	S	S	*	.	H	α-helix	trans	-60.6	-47.7	175.6	-138	-75	0	0	0	109.9	Q617 N618 L619 L623 S624 E625	Q617-H621 PolarHBondContact O-N 3.35Å; N618-H621 WeakPolarHBondContact O-CB 3.43Å; N618-H621 PolarHBondContact O-N 3.25Å; L619-H621 VanDerWaalsContact C-N 3.26Å; L619-H621 PolarHBondContact O-N 2.92Å; H621-L623 VanDerWaalsContact C-N 3.32Å; H621-L623 PolarHBondContact O-N 3.01Å; H621-S624 PolarHBondContact O-N 3.11Å; H621-S624 PolarHBondContact O-OG 3.08Å; H621-E625 IonicContact ND1-OE1 2.72Å; H621-E625 PolarHBondContact O-N 3.3Å; H621-E625 VanDerWaalsContact O-N 3.13Å
622	I	74.1	Confident	60.7	Low	62 Å²	62	100.2 Å²	100.2	32%	0.318	49%	0.486	S	S	.	.	H	α-helix	trans	-60.4	-39.9	174.3	-61.9	168.4	0	0	0	111.7	M600 N618 L619 L620 S624	M600-I622 HydrophobicContact CE-CD1 4.1Å; M600-I622 HydrophobicContact CE-CG2 3.8Å; N618-I622 WeakPolarHBondContact O-CG1 3.16Å; N618-I622 PolarHBondContact O-N 3.46Å; L619-I622 HydrophobicContact CD2-CD1 4.09Å; L619-I622 PolarHBondContact O-N 3.17Å; L620-I622 VanDerWaalsContact C-N 3.33Å; I622-S624 PolarHBondContact O-N 3.31Å
623	L	66.5	Low	58.5	Low	15 Å²	15	103.3 Å²	103.3	8%	0.079	51%	0.506	C	S	.	.	H	α-helix	trans	-69.5	-21.4	175.9	-71.6	169.4	0	0	0	113.4	L619 L620 H621 Q733 A736 V737 V740 L761 I769	L619-L623 WeakPolarHBondContact O-CB 3.23Å; L619-L623 VanDerWaalsContact O-CG 3.23Å; L619-L623 WeakPolarHBondContact O-CG 3.37Å; L619-L623 PolarHBondContact O-N 2.78Å; L620-L623 HydrophobicContact CD2-CD1 4.29Å; L620-L623 CarbonylContact O-C 3.48Å; L620-L623 PolarHBondContact O-N 2.89Å; H621-L623 VanDerWaalsContact C-N 3.32Å; H621-L623 PolarHBondContact O-N 3.01Å; L623-Q733 HydrophobicContact CD2-CB 4.3Å; L623-Q733 WeakPolarHBondContact CD2-O 3.35Å; L623-A736 HydrophobicContact CD1-CB 4.4Å; L623-A736 HydrophobicContact CD2-CB 3.72Å; L623-A736 HydrophobicContact CG-CB 3.93Å; L623-V737 HydrophobicContact CD1-CG2 4.24Å; L623-V737 HydrophobicContact CD2-CG2 3.8Å; L623-V740 HydrophobicContact CD1-CG2 4.42Å; L623-L761 HydrophobicContact CB-CD2 4.49Å; L623-L761 HydrophobicContact CD1-CD1 4.28Å; L623-L761 HydrophobicContact CD1-CD2 4.4Å; L623-I769 HydrophobicContact CD2-CD1 4.27Å; L623-I769 HydrophobicContact CD2-CG1 4.42Å
624	S	67.3	Low	56.3	Low	74 Å²	74	106.1 Å²	106.1	52%	0.517	52%	0.518	S	S	.	.	H	α-helix	trans	-92.3	-18.5	-177.4	76	0	0	0	0	113.9	L620 H621 I622 K626	L620-S624 VanDerWaalsContact O-CB 3.27Å; L620-S624 WeakPolarHBondContact O-CB 3.1Å; L620-S624 PolarHBondContact O-N 3.49Å; L620-S624 PolarHBondContact O-OG 3.12Å; H621-S624 PolarHBondContact O-N 3.11Å; H621-S624 PolarHBondContact O-OG 3.08Å; I622-S624 PolarHBondContact O-N 3.31Å; S624-K626 VanDerWaalsContact C-N 3.32Å; S624-K626 PolarHBondContact O-N 2.65Å
625	E	64.3	Low	53.9	Low	112 Å²	112	110.6 Å²	110.6	52%	0.523	53%	0.533	S	S	.	.			trans	-66.6	90.9	175.1	-75.7	175.2	-167.4	0	0	109.7	H621	H621-E625 IonicContact ND1-OE1 2.72Å; H621-E625 PolarHBondContact O-N 3.3Å; H621-E625 VanDerWaalsContact O-N 3.13Å
626	K	50.2	Low	51.9	Low	167 Å²	167	113.9 Å²	113.9	73%	0.726	57%	0.567	S	S	*	*			trans	-69	127	169.1	-67.3	-178	179.9	-179.2	0	108.3	S624 E628	S624-K626 VanDerWaalsContact C-N 3.32Å; S624-K626 PolarHBondContact O-N 2.65Å; K626-E628 PolarHBondContact O-N 3.33Å; K626-E628 VanDerWaalsContact O-N 3.11Å
627	Y	40	Very low	49.8	Very low	167 Å²	167	118 Å²	118	66%	0.655	60%	0.598	S	S	*	*			trans	-69.8	109.7	170.3	-153	-94	0	0	0	108.5	E629	Y627-E629 PolarHBondContact O-N 3Å
628	E	31.5	Very low	47.3	Very low	170 Å²	170	117.8 Å²	117.8	79%	0.794	61%	0.608	S	S	*	*			trans	-70.8	113.1	156.5	-72.7	-173.2	165.7	0	0	106.2	K626 K630	K626-E628 PolarHBondContact O-N 3.33Å; K626-E628 VanDerWaalsContact O-N 3.11Å; E628-K630 PolarHBondContact O-N 3.31Å
629	E	32.7	Very low	45	Very low	165 Å²	165	120.5 Å²	120.5	77%	0.771	62%	0.623	S	S	*	*			trans	-50.3	108	162	-72.6	-179.8	166.1	0	0	107.4	Y627 E631	Y627-E629 PolarHBondContact O-N 3Å; E629-E631 VanDerWaalsContact C-N 3.31Å; E629-E631 PolarHBondContact O-N 3.46Å
630	K	28.6	Very low	43	Very low	174 Å²	174	126 Å²	126	76%	0.757	66%	0.657	S	S	*	*			trans	-64.4	98.9	170.1	-80	-178	178.9	171.9	0	107.5	E628 N632	E628-K630 PolarHBondContact O-N 3.31Å; K630-N632 PolarHBondContact O-N 3.19Å
631	E	25.4	Very low	40.9	Very low	173 Å²	173	132.3 Å²	132.3	81%	0.808	68%	0.682	S	S	*	*			trans	-53.2	86.7	155.3	-76.1	-172.3	151.4	0	0	108.6	E629 T633	E629-E631 VanDerWaalsContact C-N 3.31Å; E629-E631 PolarHBondContact O-N 3.46Å; E631-T633 PolarHBondContact O-N 3.17Å
632	N	28.2	Very low	38.4	Very low	157 Å²	157	132.6 Å²	132.6	84%	0.84	69%	0.692	S	S	*	*			trans	-81.2	69.4	164.5	-94.2	-15.7	0	0	0	108.8	K630	K630-N632 PolarHBondContact O-N 3.19Å
633	T	26	Very low	36.4	Very low	101 Å²	101	138.5 Å²	138.5	62%	0.62	72%	0.716	S	S	*	*			trans	-106.1	131.6	152.7	34.7	0	0	0	0	108.8	E631	E631-T633 PolarHBondContact O-N 3.17Å
634	D	28.7	Very low	34.7	Very low	143 Å²	143	143.9 Å²	143.9	77%	0.765	74%	0.74	S	S	*	*	S	Bend	trans	84.5	92	161.4	-52.2	-24.1	0	0	0	118.8
635	K	29.1	Very low	33	Very low	210 Å²	210	148 Å²	148	91%	0.913	75%	0.749	S	S	*	*				161.6	89.3	124.9	-84.1	156.9	-169.4	171.9	0	112.2
636	A	34.3	Very low	31.3	Very low	107 Å²	107	150 Å²	150	88%	0.884	76%	0.756	S	S	*	*			trans	-149.9	70.1	155.8	0	0	0	0	0	110.1
637	S	32	Very low	30.2	Very low	107 Å²	107	147.8 Å²	147.8	75%	0.748	75%	0.748	S	S	*	*			trans	-75.6	135.8	168.3	51	0	0	0	0	111.8
638	S	28.4	Very low	29.8	Very low	102 Å²	102	147.7 Å²	147.7	71%	0.713	75%	0.751	S	S	*	*			trans	109.3	126.8	140	79.9	0	0	0	0	120
639	N	29.7	Very low	29.8	Very low	149 Å²	149	144.2 Å²	144.2	80%	0.797	75%	0.746	S	S	*	*			trans	71.5	112.1	161.8	-66.2	-25.9	0	0	0	116.8
640	T	31.9	Very low	29.4	Very low	119 Å²	119	141.3 Å²	141.3	73%	0.73	74%	0.743	S	S	*	*				-171.8	114.1	73.5	-58.8	0	0	0	0	112.7
641	K	31.3	Very low	29.4	Very low	183 Å²	183	142 Å²	142	80%	0.796	75%	0.749	S	S	*	*			trans	65.6	102.3	136.2	-68.7	-180	-178.5	173.3	0	123.9
642	T	26	Very low	29.6	Very low	127 Å²	127	137.6 Å²	137.6	78%	0.779	74%	0.742	S	S	*	*				65.3	114.8	118.9	42	0	0	0	0	123.8
643	K	31.5	Very low	29.6	Very low	187 Å²	187	140 Å²	140	81%	0.813	74%	0.74	S	S	*	*				160	139	116.2	-87	-178.3	175.7	179.5	0	108.8
644	E	31.3	Very low	29.8	Very low	127 Å²	127	145.7 Å²	145.7	59%	0.593	75%	0.75	S	S	*	*			cis	-169.1	137.3	-2.3	-108.9	178.5	127.7	0	0	108.9
645	K	30.7	Very low	29.8	Very low	161 Å²	161	142.8 Å²	142.8	70%	0.7	75%	0.754	S	S	*	*			trans	64.7	141.2	143.3	-64.3	168.5	174.3	154.8	0	120.2
646	K	28.9	Very low	29.7	Very low	155 Å²	155	136.8 Å²	136.8	67%	0.674	75%	0.751	S	S	*	*			cis	-175	142.2	3.8	-118.1	-177.5	172.2	-142.6	0	110
647	E	28.9	Very low	29.5	Very low	119 Å²	119	135.2 Å²	135.2	56%	0.556	75%	0.746	S	S	*	*			trans	69.2	132.9	140.6	-69.1	173.7	-149.5	0	0	119
648	K	30.9	Very low	29.4	Very low	166 Å²	166	142.3 Å²	142.3	72%	0.722	76%	0.756	S	S	*	*			cis	-172.6	137.3	26.6	-122.4	162.3	-175.8	147.6	0	112.7
649	S	30.6	Very low	29.5	Very low	97 Å²	97	141.2 Å²	141.2	68%	0.678	76%	0.761	S	S	*	*			trans	49.4	117.4	141	55.8	0	0	0	0	121.3
650	S	25.8	Very low	29.7	Very low	103 Å²	103	146 Å²	146	72%	0.72	77%	0.768	S	S	*	*				71.6	113.9	56.7	78.5	0	0	0	0	115.7
651	E	28.1	Very low	29.6	Very low	188 Å²	188	147.5 Å²	147.5	88%	0.879	77%	0.772	S	S	*	*			trans	159.6	106.3	133.9	-90.8	173.7	154.8	0	0	109.6
652	A	28.6	Very low	29.7	Very low	81 Å²	81	150.3 Å²	150.3	67%	0.669	78%	0.777	S	S	*	*				84.2	117.8	71.4	0	0	0	0	0	114.5
653	R	28.9	Very low	29.8	Very low	207 Å²	207	156.1 Å²	156.1	78%	0.781	79%	0.785	S	S	*	*			trans	89.5	115.8	135.9	-73.6	174.4	173.7	-174	-0	120.6
654	R	29.2	Very low	29.7	Very low	221 Å²	221	151.4 Å²	151.4	83%	0.834	79%	0.789	S	S	*	*				93	129.3	117.6	-79.1	178	168.4	-175	-4.4	119.7
655	G	28.9	Very low	29.6	Very low	83 Å²	83	149 Å²	149	86%	0.856	80%	0.799	S	S	*	*			trans	91.4	123	151.7	0	0	0	0	0	112.2
656	G	28.6	Very low	29.6	Very low	83 Å²	83	146.4 Å²	146.4	86%	0.856	80%	0.801	S	S	*	*			cis	128.8	127.8	24.7	0	0	0	0	0	107.4
657	G	30.3	Very low	29.7	Very low	75 Å²	75	144.8 Å²	144.8	77%	0.773	80%	0.804	S	S	*	*			trans	100.6	102.1	153.7	0	0	0	0	0	118.8
658	R	29.5	Very low	29.7	Very low	256 Å²	256	150.7 Å²	150.7	97%	0.966	82%	0.821	S	S	*	*				52	111.6	129.7	-70.9	178.8	162.3	172.7	-4.6	119.7
659	G	29.9	Very low	30	Very low	79 Å²	79	148.3 Å²	148.3	81%	0.814	82%	0.823	S	S	*	*				107.2	129.1	107.2	0	0	0	0	0	118.9
660	R	35	Very low	29.9	Very low	248 Å²	248	147.6 Å²	147.6	94%	0.936	82%	0.823	S	S	*	*			trans	102.2	106.4	137.7	-149.3	170.1	177	164.8	-1.4	118
661	N	29.9	Very low	30.1	Very low	151 Å²	151	148.8 Å²	148.8	81%	0.807	83%	0.826	S	S	*	*			trans	-3.7	135.3	150.2	-77.8	-4.5	0	0	0	118.7
662	R	32.3	Very low	30.4	Very low	242 Å²	242	146 Å²	146	91%	0.913	82%	0.822	S	S	*	*				178.4	123.1	113.3	-98	168.9	-179.5	-173.4	0	113.9
663	R	29.2	Very low	30.5	Very low	250 Å²	250	149 Å²	149	94%	0.943	83%	0.826	S	S	*	*			trans	24.6	136.4	137.5	-80.9	-178.6	168.5	177.5	-3.6	122.3
664	G	28.1	Very low	30.7	Very low	88 Å²	88	145.5 Å²	145.5	91%	0.907	82%	0.823	S	S	*	*			trans	95.5	138.9	142.3	0	0	0	0	0	113.7
665	G	29.1	Very low	31	Very low	76 Å²	76	143.5 Å²	143.5	78%	0.784	82%	0.823	S	S	*	*			cis	179.3	163.8	8.2	0	0	0	0	0	108.3
666	S	30.6	Very low	31.2	Very low	107 Å²	107	143.6 Å²	143.6	75%	0.748	82%	0.824	S	S	*	*			trans	-44.8	148.1	-177.9	-169.9	0	0	0	0	117.5
667	T	32	Very low	31.3	Very low	121 Å²	121	147.6 Å²	147.6	74%	0.742	83%	0.826	S	S	*	*				159.9	123.1	110.9	39.5	0	0	0	0	116
668	R	29.3	Very low	31.3	Very low	242 Å²	242	147 Å²	147	91%	0.913	82%	0.819	S	S	*	*			trans	74.9	152.5	135.1	-78.9	-171.4	165	179.4	-4	125.3
669	P	36.7	Very low	31.6	Very low	117 Å²	117	142.7 Å²	142.7	76%	0.76	81%	0.81	S	S	*	*			trans	-118	-179.5	-161.6	42.8	-27.2	0	0	0	115.1
670	A	28.8	Very low	31.7	Very low	82 Å²	82	145 Å²	145	68%	0.678	80%	0.804	S	S	*	*			trans	151.9	135.7	136.9	0	0	0	0	0	116.7
671	T	30.2	Very low	31.6	Very low	127 Å²	127	139 Å²	139	78%	0.779	80%	0.795	S	S	*	*			trans	64.3	132.5	140.9	55.1	0	0	0	0	123.1
672	T	33.8	Very low	31.7	Very low	129 Å²	129	139.3 Å²	139.3	79%	0.791	80%	0.796	S	S	*	*				173	126.8	108.1	42.7	0	0	0	0	115.1
673	N	30.5	Very low	31.6	Very low	144 Å²	144	132.1 Å²	132.1	77%	0.77	79%	0.789	S	S	*	*			trans	25.9	134.8	142.1	-59.6	-7.5	0	0	0	124.4
674	D	32.6	Very low	31.9	Very low	135 Å²	135	125.4 Å²	125.4	72%	0.722	78%	0.778	S	S	*	*				176.2	117.8	101	-115.2	2.3	0	0	0	112.7
675	H	36.3	Very low	31.8	Very low	178 Å²	178	127.4 Å²	127.4	82%	0.824	77%	0.772	S	S	*	*				77.4	124.1	101.1	-81.4	64.4	0	0	0	117.8
676	G	32.8	Very low	31.9	Very low	85 Å²	85	128.3 Å²	128.3	88%	0.876	77%	0.772	S	S	*	*			trans	162.3	73.7	165	0	0	0	0	0	118.8
677	N	30.2	Very low	31.7	Very low	168 Å²	168	131.5 Å²	131.5	90%	0.898	78%	0.778	S	S	*	*			trans	-71	158.1	-172.9	-164.8	24.3	0	0	0	119
678	G	31.5	Very low	31.7	Very low	61 Å²	61	132.8 Å²	132.8	63%	0.629	78%	0.78	S	S	*	*			trans	108.8	138.4	148.3	0	0	0	0	0	117.2
679	H	35.3	Very low	31.8	Very low	167 Å²	167	126.7 Å²	126.7	77%	0.773	77%	0.769	S	S	*	*			cis	-171.4	131	5.6	-135.9	-18.1	0	0	0	110.3
680	N	30.9	Very low	31.3	Very low	127 Å²	127	127.3 Å²	127.3	68%	0.679	77%	0.771	S	S	*	*			trans	42.5	151.9	137.1	-66	7.3	0	0	0	126.5
681	T	33.7	Very low	31.3	Very low	123 Å²	123	129.3 Å²	129.3	76%	0.755	78%	0.781	S	S	*	*			trans	98.5	136.3	149.6	70.4	0	0	0	0	116.5
682	D	32.1	Very low	31.1	Very low	157 Å²	157	132.6 Å²	132.6	84%	0.84	79%	0.787	S	S	*	*			cis	-170.7	158.5	-26.9	-97.5	-39	0	0	0	105.5
683	A	29.1	Very low	30.9	Very low	91 Å²	91	130.8 Å²	130.8	75%	0.752	79%	0.785	S	S	*	*			trans	-72.9	-152.7	-174.3	0	0	0	0	0	114.1
684	P	35.7	Very low	30.6	Very low	109 Å²	109	131.2 Å²	131.2	71%	0.708	79%	0.788	S	S	*	*			cis	-141.1	170.6	-24.2	19.6	7.1	0	0	0	116.1
685	T	26.5	Very low	30.3	Very low	130 Å²	130	132.8 Å²	132.8	80%	0.798	79%	0.791	S	S	*	*			trans	32.2	132.8	133.4	-29.3	0	0	0	0	125.4
686	A	31.5	Very low	29.7	Very low	95 Å²	95	131.8 Å²	131.8	79%	0.785	79%	0.791	S	S	*	*			trans	-178.1	106.1	139.9	0	0	0	0	0	111
687	M	26.8	Very low	29.5	Very low	174 Å²	174	133.7 Å²	133.7	86%	0.857	79%	0.786	S	S	*	*				34.2	118	91.6	-75.1	-169.1	-176.8	0	0	117.9
688	D	32	Very low	29.6	Very low	147 Å²	147	132.6 Å²	132.6	79%	0.786	78%	0.779	S	S	*	*				-179.7	128.5	120.1	-99.2	-15.3	0	0	0	116.5
689	T	30.9	Very low	29.2	Very low	114 Å²	114	135.5 Å²	135.5	70%	0.699	78%	0.784	S	S	*	*			trans	66.9	107.3	140.2	49.6	0	0	0	0	125.3
690	T	25.7	Very low	28.8	Very low	130 Å²	130	132.3 Å²	132.3	80%	0.798	78%	0.781	S	S	*	*				42.6	120.5	124.4	39.9	0	0	0	0	122.2
691	S	29.6	Very low	28.6	Very low	125 Å²	125	134.4 Å²	134.4	87%	0.874	78%	0.784	S	S	*	*				173.8	138.1	100.7	47.4	0	0	0	0	112.3
692	Q	25.3	Very low	28.2	Very low	195 Å²	195	134.9 Å²	134.9	91%	0.911	78%	0.778	S	S	*	*			trans	-80.4	172.1	-175.7	-73.5	174.6	-24.7	0	0	114.9
693	A	29	Very low	28	Very low	92 Å²	92	134.2 Å²	134.2	76%	0.76	78%	0.78	S	S	*	*			trans	93.1	131.8	164.3	0	0	0	0	0	114.6
694	N	24.2	Very low	27.7	Very low	153 Å²	153	132.9 Å²	132.9	82%	0.818	77%	0.774	S	S	*	*			cis	-179	166.7	-11.4	-121.3	10.4	0	0	0	105.6
695	E	26.5	Very low	27.4	Very low	167 Å²	167	134.4 Å²	134.4	78%	0.78	78%	0.781	S	S	*	*			trans	90	100.4	161.1	-66.2	175.2	-172.1	0	0	120.1
696	D	24.3	Very low	27.6	Very low	157 Å²	157	133 Å²	133	84%	0.84	78%	0.775	S	S	*	*				46.9	104.7	129.9	-57.6	-14.4	0	0	0	121.2
697	T	29.4	Very low	27.4	Very low	126 Å²	126	137 Å²	137	77%	0.773	78%	0.777	S	S	*	*			trans	-159.4	103.4	156	-43.8	0	0	0	0	108.5
698	I	31	Very low	27.7	Very low	145 Å²	145	133.2 Å²	133.2	74%	0.744	77%	0.766	S	S	*	*				60.7	108.4	97.9	-61.2	169.6	0	0	0	114.6
699	T	23.9	Very low	27.6	Very low	121 Å²	121	133.4 Å²	133.4	74%	0.742	77%	0.765	S	S	*	*			trans	32.8	128.6	145	63.2	0	0	0	0	120.6
700	S	26.5	Very low	27.7	Very low	101 Å²	101	133 Å²	133	71%	0.706	76%	0.764	S	S	*	*				154.1	132.3	108	54.7	0	0	0	0	113.1
701	K	26.4	Very low	27.9	Very low	171 Å²	171	134.8 Å²	134.8	74%	0.743	77%	0.765	S	S	*	*			trans	64.2	151.9	136.5	-67.2	-180	169.7	-157	0	118
702	E	25.4	Very low	27.9	Very low	133 Å²	133	137 Å²	137	62%	0.621	77%	0.768	S	S	*	*			cis	179.7	155.9	0.5	-109.5	162.7	-164.8	0	0	104
703	T	27.7	Very low	27.9	Very low	143 Å²	143	133.5 Å²	133.5	88%	0.877	76%	0.76	S	S	*	*			trans	68	137.3	154.5	62.2	0	0	0	0	118.5
704	G	24.2	Very low	27.8	Very low	62 Å²	62	134.1 Å²	134.1	64%	0.639	76%	0.759	S	S	*	*			cis	145.8	112.7	9.5	0	0	0	0	0	109.6
705	V	28.1	Very low	27.9	Very low	141 Å²	141	134.4 Å²	134.4	86%	0.855	76%	0.76	S	S	*	*			trans	61.4	170.6	151.9	-111.7	0	0	0	0	119.2
706	P	32	Very low	28.1	Very low	102 Å²	102	131.4 Å²	131.4	66%	0.662	76%	0.764	S	S	*	*			cis	-142.2	-178.7	-19.8	28.2	-3.9	0	0	0	116.1
707	Q	27.1	Very low	28.1	Very low	179 Å²	179	133.3 Å²	133.3	84%	0.836	77%	0.768	S	S	*	*			trans	99.8	161.5	146.8	-59.4	-150.8	-23.9	0	0	121.1
708	P	32.4	Very low	28	Very low	94 Å²	94	136.4 Å²	136.4	61%	0.61	77%	0.773	S	S	*	*				-143.1	-166.5	-92.9	32.8	-4.3	0	0	0	116
709	I	29.4	Very low	27.7	Very low	151 Å²	151	135.1 Å²	135.1	77%	0.774	78%	0.777	S	S	*	*			trans	84.8	147.2	154.6	-48.7	155.1	0	0	0	117.7
710	P	33.6	Very low	27.7	Very low	106 Å²	106	135.6 Å²	135.6	69%	0.688	78%	0.78	S	S	*	*			cis	-137.3	177.1	-40.3	40.9	-21.9	0	0	0	115.5
711	M	29.1	Very low	27.9	Very low	166 Å²	166	135.6 Å²	135.6	82%	0.818	78%	0.778	S	S	*	*			trans	8	130.6	154	-62.6	-176.4	-138.5	0	0	121.7
712	D	31	Very low	27.7	Very low	172 Å²	172	136.9 Å²	136.9	92%	0.92	79%	0.787	S	S	*	*			trans	-148.5	108.1	130.8	-99.6	-26.2	0	0	0	110.7
713	T	25.3	Very low	27.9	Very low	122 Å²	122	137.8 Å²	137.8	75%	0.748	79%	0.791	S	S	*	*			trans	-83	131.1	170.5	40.2	0	0	0	0	110.5
714	S	26.6	Very low	28	Very low	105 Å²	105	139 Å²	139	73%	0.734	79%	0.792	S	S	*	*				164.9	137.5	122.9	49.6	0	0	0	0	113.8
715	N	26.1	Very low	28.3	Very low	158 Å²	158	141.7 Å²	141.7	85%	0.845	80%	0.801	S	S	*	*			trans	85.5	89.7	154.8	-59.2	-11.9	0	0	0	120.2
716	A	30.2	Very low	28.6	Very low	105 Å²	105	139 Å²	139	87%	0.868	79%	0.785	S	S	*	*				-164.2	109.1	122.4	0	0	0	0	0	109.8
717	E	24.1	Very low	29	Very low	196 Å²	196	140.6 Å²	140.6	92%	0.916	78%	0.782	S	S	*	*			trans	-70.9	116.3	173.8	-60.4	168.1	151.5	0	0	110.2
718	E	27.4	Very low	30.4	Very low	191 Å²	191	135.9 Å²	135.9	89%	0.893	76%	0.762	S	S	*	*			trans	-145.8	118.1	144.4	-78.3	-165.3	164.3	0	0	108.4	T720	E718-T720 PolarHBondContact O-N 3.13Å
719	S	24.7	Very low	31.4	Very low	118 Å²	118	136.4 Å²	136.4	83%	0.825	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-58.5	117.8	-176.3	46.9	0	0	0	0	113.6
720	T	25.3	Very low	32.9	Very low	132 Å²	132	132.3 Å²	132.3	81%	0.81	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-83.7	116.8	158.2	40.1	0	0	0	0	109.3	E718	E718-T720 PolarHBondContact O-N 3.13Å
721	P	29.3	Very low	34.4	Very low	100 Å²	100	128 Å²	128	65%	0.649	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-75.9	135.5	168.7	28.7	-24.7	0	0	0	109.3	E723	P721-E723 PolarHBondContact O-N 3.33Å
722	Q	23.6	Very low	36.4	Very low	199 Å²	199	120.6 Å²	120.6	93%	0.93	67%	0.669	S	S	*	*			trans	-62.8	112.4	170.5	-68.6	165.2	-53.5	0	0	109.4
723	E	28.6	Very low	38.4	Very low	151 Å²	151	112.8 Å²	112.8	71%	0.706	63%	0.627	S	S	*	*			trans	-122.8	18.6	178.2	-77.4	-170	167.6	0	0	113.6	P721	P721-E723 PolarHBondContact O-N 3.33Å
724	D	29.2	Very low	40.8	Very low	170 Å²	170	107.1 Å²	107.1	91%	0.909	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.5	32	-164.3	-66.8	-31.7	0	0	0	116.8
725	S	30.4	Very low	43.2	Very low	118 Å²	118	102.4 Å²	102.4	83%	0.825	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-141.2	8.7	174.8	68.6	0	0	0	0	116.8
726	T	35.2	Very low	45.7	Very low	84 Å²	84	94.9 Å²	94.9	52%	0.515	52%	0.519	S	S	.	.	S	Bend	trans	-106.9	-8.5	-174	50	0	0	0	0	114.2	H730	T726-H730 PolarHBondContact O-CD2 2.76Å; T726-H730 PolarHBondContact O-NE2 2.88Å
727	F	41.5	Very low	48.3	Very low	136 Å²	136	89.9 Å²	89.9	60%	0.596	48%	0.478	S	S	*	.	H	α-helix	trans	-82.5	-19.9	-161.9	-158.5	-102.9	0	0	0	116.3
728	D	55.7	Low	51.1	Low	79 Å²	79	80.9 Å²	80.9	42%	0.422	44%	0.436	S	S	.	.	H	α-helix	trans	-86	-32.6	-169	-71.3	-22.4	0	0	0	114.7	H730 H732	D728-H730 VanDerWaalsContact C-N 3.31Å; D728-H730 PolarHBondContact O-N 2.76Å; D728-H732 PolarHBondContact O-CD2 3.04Å
729	F	53.8	Low	53.6	Low	105 Å²	105	71.8 Å²	71.8	46%	0.461	39%	0.394	S	S	.	.	H	α-helix	trans	-73.3	-26.2	-178.4	-137	-95.2	0	0	0	113.2	A731 H732	F729-A731 VanDerWaalsContact C-N 3.34Å; F729-A731 PolarHBondContact O-N 3.35Å; F729-H732 PolarHBondContact O-N 3.35Å
730	H	60.6	Low	56.4	Low	66 Å²	66	66.3 Å²	66.3	31%	0.306	36%	0.355	S	S	.	.	H	α-helix	trans	-67.1	-31.5	-179.5	-67.8	-39.2	0	0	0	113.3	T726 D728 G734 E766 P768	T726-H730 PolarHBondContact O-CD2 2.76Å; T726-H730 PolarHBondContact O-NE2 2.88Å; D728-H730 VanDerWaalsContact C-N 3.31Å; D728-H730 PolarHBondContact O-N 2.76Å; H730-G734 PolarHBondContact O-N 3.32Å; H730-E766 IonicContact CE1-OE2 2.93Å; H730-E766 IonicContact ND1-OE2 2.91Å; H730-P768 HydrophobicContact CB-CB 3.92Å; H730-P768 HydrophobicContact CB-CG 3.47Å; H730-P768 VanDerWaalsContact CB-CG 3.47Å; H730-P768 VanDerWaalsContact CG-CG 3.46Å; H730-P768 WeakPolarHBondContact ND1-CG 3.3Å
731	A	64.5	Low	59.1	Low	16 Å²	16	60 Å²	60	13%	0.132	32%	0.317	C	S	.	.	H	α-helix	trans	-69.1	-37	176.7	0	0	0	0	0	112.3	F729 G734 L735	F729-A731 VanDerWaalsContact C-N 3.34Å; F729-A731 PolarHBondContact O-N 3.35Å; A731-G734 PolarHBondContact O-N 3.33Å; A731-L735 WeakPolarHBondContact O-CG 3.49Å; A731-L735 PolarHBondContact O-N 3.48Å
732	H	70.6	Confident	61.6	Low	10 Å²	10	55.5 Å²	55.5	5%	0.046	29%	0.287	C	S	.	.	H	α-helix	trans	-62.6	-44.9	178.4	-60.8	-59.9	0	0	0	111.7	P593 S596 D728 F729 G734 L735 A736	P593-H732 PolarHBondContact O-CE1 3.25Å; S596-H732 PolarHBondContact OG-CE1 3.41Å; S596-H732 PolarHBondContact OG-NE2 2.9Å; D728-H732 PolarHBondContact O-CD2 3.04Å; F729-H732 PolarHBondContact O-N 3.35Å; H732-G734 PolarHBondContact O-N 3.31Å; H732-L735 PolarHBondContact O-N 3.39Å; H732-A736 WeakPolarHBondContact O-CB 3.44Å; H732-A736 PolarHBondContact O-N 2.88Å
733	Q	73.2	Confident	64.4	Low	7 Å²	7	46.1 Å²	46.1	3%	0.033	24%	0.243	C	C	.	.	H	α-helix	trans	-64.2	-41.8	178.2	-67.2	179.7	-9.4	0	0	111.7	L623 L735 A736 V737 E766 I769	L623-Q733 HydrophobicContact CD2-CB 4.3Å; L623-Q733 WeakPolarHBondContact CD2-O 3.35Å; Q733-L735 VanDerWaalsContact C-N 3.34Å; Q733-L735 PolarHBondContact O-N 3.33Å; Q733-A736 PolarHBondContact O-N 3.5Å; Q733-V737 WeakPolarHBondContact O-CG2 3.48Å; Q733-V737 PolarHBondContact O-N 3.38Å; Q733-E766 PolarHBondContact OE1-OE2 2.97Å; Q733-I769 HydrophobicContact CB-CD1 4.21Å; Q733-I769 HydrophobicContact CB-CG1 3.78Å; Q733-I769 HydrophobicContact CG-CD1 4.44Å; Q733-I769 HydrophobicContact CG-CG1 4.5Å
734	G	75.4	Confident	66.8	Low	3 Å²	3	39 Å²	39	3%	0.031	21%	0.21	C	C	.	.	H	α-helix	trans	-61.5	-41	176.3	0	0	0	0	0	113	H730 A731 H732 V737 L738	H730-G734 PolarHBondContact O-N 3.32Å; A731-G734 PolarHBondContact O-N 3.33Å; H732-G734 PolarHBondContact O-N 3.31Å; G734-V737 PolarHBondContact O-N 3.19Å; G734-L738 PolarHBondContact O-N 3.33Å
735	L	77.2	Confident	69	Low	6 Å²	6	31.3 Å²	31.3	3%	0.031	17%	0.169	C	C	.	.	H	α-helix	trans	-66.4	-40.2	175.1	-73.4	163.6	0	0	0	112	M597 M600 I601 F604 A731 H732 Q733 V737 L738 G739 T884 L887	M597-L735 HydrophobicContact CG-CD1 3.52Å; M597-L735 HydrophobicContact SD-CD1 3.95Å; M600-L735 HydrophobicContact SD-CB 4.3Å; I601-L735 HydrophobicContact CD1-CD1 4.12Å; I601-L735 HydrophobicContact CD1-CD2 4.28Å; I601-L735 HydrophobicContact CG1-CD1 4.48Å; I601-L735 HydrophobicContact CG1-CD2 4.39Å; F604-L735 VanDerWaalsContact CE2-O 3.29Å; F604-L735 WeakPolarHBondContact CE2-O 3.37Å; A731-L735 WeakPolarHBondContact O-CG 3.49Å; A731-L735 PolarHBondContact O-N 3.48Å; H732-L735 PolarHBondContact O-N 3.39Å; Q733-L735 VanDerWaalsContact C-N 3.34Å; Q733-L735 PolarHBondContact O-N 3.33Å; L735-V737 VanDerWaalsContact C-N 3.3Å; L735-V737 PolarHBondContact O-N 3.22Å; L735-L738 WeakPolarHBondContact O-CB 3.44Å; L735-L738 PolarHBondContact O-N 3.27Å; L735-L738 VanDerWaalsContact O-N 3.11Å; L735-G739 PolarHBondContact O-N 3.2Å; L735-T884 HydrophobicContact CD2-CG2 3.91Å; L735-L887 HydrophobicContact CD2-CD1 3.82Å; L735-L887 HydrophobicContact CG-CD1 4.01Å
736	A	80.2	Confident	70.9	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-59.9	-37.9	177.3	0	0	0	0	0	112.9	M600 F604 L623 H732 Q733 G739 V740	M600-A736 HydrophobicContact CE-CB 4.16Å; M600-A736 HydrophobicContact SD-CB 3.8Å; F604-A736 HydrophobicContact CZ-CB 4.26Å; L623-A736 HydrophobicContact CD1-CB 4.4Å; L623-A736 HydrophobicContact CD2-CB 3.72Å; L623-A736 HydrophobicContact CG-CB 3.93Å; H732-A736 WeakPolarHBondContact O-CB 3.44Å; H732-A736 PolarHBondContact O-N 2.88Å; Q733-A736 PolarHBondContact O-N 3.5Å; A736-G739 PolarHBondContact O-N 3.12Å; A736-V740 PolarHBondContact O-N 3.19Å
737	V	83.9	Confident	72.7	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-64.7	-39.8	175	-178.1	0	0	0	0	111.4	L623 Q733 G734 L735 G739 V740 A741 F758 I769 A772 V773 A776	L623-V737 HydrophobicContact CD1-CG2 4.24Å; L623-V737 HydrophobicContact CD2-CG2 3.8Å; Q733-V737 WeakPolarHBondContact O-CG2 3.48Å; Q733-V737 PolarHBondContact O-N 3.38Å; G734-V737 PolarHBondContact O-N 3.19Å; L735-V737 VanDerWaalsContact C-N 3.3Å; L735-V737 PolarHBondContact O-N 3.22Å; V737-G739 VanDerWaalsContact C-N 3.33Å; V737-V740 PolarHBondContact O-N 3Å; V737-A741 PolarHBondContact O-N 3.09Å; V737-F758 HydrophobicContact CG1-CD1 4.02Å; V737-F758 HydrophobicContact CG1-CE1 3.61Å; V737-I769 HydrophobicContact CG2-CG2 3.98Å; V737-A772 HydrophobicContact CB-CB 4.18Å; V737-A772 HydrophobicContact CG1-CB 4.43Å; V737-V773 HydrophobicContact CG1-CG2 3.99Å; V737-A776 HydrophobicContact CG1-CB 3.7Å
738	L	82.7	Confident	74.3	Confident	8 Å²	8	24.1 Å²	24.1	4%	0.042	12%	0.124	C	C	.	.	H	α-helix	trans	-65.5	-37.4	173.5	-66.4	177.1	0	0	0	111.5	G734 L735 V740 A741 I742 L775 A776 T884 L887	G734-L738 PolarHBondContact O-N 3.33Å; L735-L738 WeakPolarHBondContact O-CB 3.44Å; L735-L738 PolarHBondContact O-N 3.27Å; L735-L738 VanDerWaalsContact O-N 3.11Å; L738-V740 PolarHBondContact O-N 3.18Å; L738-A741 WeakPolarHBondContact O-CB 3.49Å; L738-A741 PolarHBondContact O-N 3.1Å; L738-A741 VanDerWaalsContact O-N 3.15Å; L738-I742 WeakPolarHBondContact O-CG1 3.47Å; L738-I742 PolarHBondContact O-N 3.15Å; L738-L775 HydrophobicContact CD2-CB 4.02Å; L738-A776 HydrophobicContact CD2-CB 4.28Å; L738-T884 HydrophobicContact CD1-CG2 4.07Å; L738-L887 HydrophobicContact CD1-CD1 3.93Å; L738-L887 HydrophobicContact CD1-CD2 4.2Å; L738-L887 HydrophobicContact CD1-CG 4.18Å
739	G	80.5	Confident	75.4	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-57.9	-46.6	174.4	0	0	0	0	0	113.3	L735 A736 V737 A741 I742 I743	L735-G739 PolarHBondContact O-N 3.2Å; A736-G739 PolarHBondContact O-N 3.12Å; V737-G739 VanDerWaalsContact C-N 3.33Å; G739-A741 VanDerWaalsContact C-N 3.25Å; G739-A741 PolarHBondContact O-N 3.26Å; G739-I742 PolarHBondContact O-N 3.15Å; G739-I743 WeakPolarHBondContact O-CG1 3.41Å; G739-I743 PolarHBondContact O-N 3.5Å; G739-I743 VanDerWaalsContact O-N 3.1Å
740	V	82.7	Confident	76.5	Confident	2 Å²	2	20 Å²	20	1%	0.012	11%	0.108	C	C	.	.	H	α-helix	trans	-58.3	-40	175.2	174.9	0	0	0	0	111.1	I616 L619 L623 A736 V737 L738 A744 F758	I616-V740 HydrophobicContact CG2-CG1 4.26Å; L619-V740 HydrophobicContact CB-CG2 4.1Å; L619-V740 HydrophobicContact CD1-CG2 4.27Å; L623-V740 HydrophobicContact CD1-CG2 4.42Å; A736-V740 PolarHBondContact O-N 3.19Å; V737-V740 PolarHBondContact O-N 3Å; L738-V740 PolarHBondContact O-N 3.18Å; V740-A744 WeakPolarHBondContact O-CB 3.45Å; V740-A744 PolarHBondContact O-N 2.92Å; V740-F758 HydrophobicContact CG1-CE1 4.32Å; V740-F758 HydrophobicContact CG1-CZ 4.23Å
741	A	82.9	Confident	77.3	Confident	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-65.7	-44.7	177.9	0	0	0	0	0	112.5	V737 L738 G739 I743 A744 M745 F758 A776 L779	V737-A741 PolarHBondContact O-N 3.09Å; L738-A741 WeakPolarHBondContact O-CB 3.49Å; L738-A741 PolarHBondContact O-N 3.1Å; L738-A741 VanDerWaalsContact O-N 3.15Å; G739-A741 VanDerWaalsContact C-N 3.25Å; G739-A741 PolarHBondContact O-N 3.26Å; A741-I743 PolarHBondContact O-N 2.68Å; A741-A744 PolarHBondContact O-N 3.1Å; A741-M745 VanDerWaalsContact O-CG 3.3Å; A741-M745 WeakPolarHBondContact O-CG 3.23Å; A741-M745 PolarHBondContact O-N 3.24Å; A741-F758 HydrophobicContact CB-CZ 4.03Å; A741-A776 HydrophobicContact CB-CB 3.9Å; A741-L779 HydrophobicContact CB-CB 4.35Å; A741-L779 HydrophobicContact CB-CD2 3.53Å
742	I	82	Confident	78.2	Confident	6 Å²	6	20.9 Å²	20.9	3%	0.031	11%	0.113	C	C	.	.	H	α-helix	trans	-63.8	-41.1	-178.6	-65	159.2	0	0	0	111.5	A608 G609 L738 G739 L779 L876 L880	A608-I742 HydrophobicContact CB-CG2 3.47Å; A608-I742 VanDerWaalsContact CB-CG2 3.47Å; G609-I742 PolarHBondContact N-O 2.93Å; L738-I742 WeakPolarHBondContact O-CG1 3.47Å; L738-I742 PolarHBondContact O-N 3.15Å; G739-I742 PolarHBondContact O-N 3.15Å; I742-L779 HydrophobicContact CB-CD2 4.2Å; I742-L779 HydrophobicContact CG1-CD1 4.37Å; I742-L779 HydrophobicContact CG1-CD2 3.45Å; I742-L779 VanDerWaalsContact CG1-CD2 3.45Å; I742-L876 HydrophobicContact CG2-CD2 4.35Å; I742-L880 HydrophobicContact CD1-CD1 3.33Å; I742-L880 HydrophobicContact CD1-CG 4.08Å; I742-L880 HydrophobicContact CG1-CD1 4.23Å
743	I	80.9	Confident	78.7	Confident	1 Å²	1	25.4 Å²	25.4	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-69.3	-40.2	178.1	-60.1	167.6	0	0	0	110.2	F604 G611 K615 I616 L619 G739 A741 M745	F604-I743 HydrophobicContact CD1-CD1 4.4Å; G611-I743 PolarHBondContact N-O 3.38Å; K615-I743 HydrophobicContact CB-CD1 4.26Å; I616-I743 HydrophobicContact CD1-CG2 3.92Å; I616-I743 HydrophobicContact CG1-CB 4.22Å; I616-I743 HydrophobicContact CG1-CG2 3.8Å; L619-I743 HydrophobicContact CD1-CD1 3.82Å; G739-I743 WeakPolarHBondContact O-CG1 3.41Å; G739-I743 PolarHBondContact O-N 3.5Å; G739-I743 VanDerWaalsContact O-N 3.1Å; A741-I743 PolarHBondContact O-N 2.68Å; I743-M745 VanDerWaalsContact C-N 3.34Å; I743-M745 PolarHBondContact O-N 2.94Å
744	A	80.8	Confident	79.2	Confident	2 Å²	2	25.2 Å²	25.2	2%	0.017	14%	0.135	C	C	.	.	H	α-helix	trans	-72.2	-20.2	-178.7	0	0	0	0	0	114.5	V740 A741 G746 E747 A754	V740-A744 WeakPolarHBondContact O-CB 3.45Å; V740-A744 PolarHBondContact O-N 2.92Å; A741-A744 PolarHBondContact O-N 3.1Å; A744-G746 PolarHBondContact O-N 2.98Å; A744-G746 VanDerWaalsContact O-N 3.16Å; A744-E747 PolarHBondContact O-N 2.92Å; A744-A754 HydrophobicContact CB-CB 3.76Å
745	M	75.4	Confident	79.6	Confident	9 Å²	9	27.5 Å²	27.5	4%	0.044	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-22.9	-177.5	-85.1	177.1	89.5	0	0	114.9	A741 I743 E747 L751 L779 P863 W864 L876	A741-M745 VanDerWaalsContact O-CG 3.3Å; A741-M745 WeakPolarHBondContact O-CG 3.23Å; A741-M745 PolarHBondContact O-N 3.24Å; I743-M745 VanDerWaalsContact C-N 3.34Å; I743-M745 PolarHBondContact O-N 2.94Å; M745-E747 VanDerWaalsContact C-N 3.34Å; M745-E747 PolarHBondContact O-N 3.27Å; M745-L751 HydrophobicContact CG-CD2 4.45Å; M745-L779 HydrophobicContact CE-CG 4.36Å; M745-L779 WeakPolarHBondContact CE-O 3.28Å; M745-L779 HydrophobicContact CG-CD2 4.16Å; M745-L779 HydrophobicContact SD-CD1 4.37Å; M745-L779 HydrophobicContact SD-CD2 3.29Å; M745-L779 WeakPolarHBondContact SD-CD2 3.37Å; M745-L779 HydrophobicContact SD-CG 3.47Å; M745-L779 WeakPolarHBondContact SD-CG 3.34Å; M745-P863 HydrophobicContact CE-CG 3.69Å; M745-W864 HydrophobicContact CB-CZ2 4.2Å; M745-L876 HydrophobicContact CE-CD1 4.48Å; M745-L876 HydrophobicContact SD-CD1 4.19Å
746	G	68.7	Low	80	Confident	21 Å²	21	35.5 Å²	35.5	22%	0.216	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-22.5	-175.9	0	0	0	0	0	114.6	A744	A744-G746 PolarHBondContact O-N 2.98Å; A744-G746 VanDerWaalsContact O-N 3.16Å
747	E	73.2	Confident	80.1	Confident	42 Å²	42	37.8 Å²	37.8	20%	0.196	19%	0.185	C	C	.	.			trans	-129.5	140.9	-172.8	-66.7	179.3	-173.7	0	0	112	A744 M745 I749 G750 L751	A744-E747 PolarHBondContact O-N 2.92Å; M745-E747 VanDerWaalsContact C-N 3.34Å; M745-E747 PolarHBondContact O-N 3.27Å; E747-I749 VanDerWaalsContact C-N 3.28Å; E747-I749 PolarHBondContact O-N 2.91Å; E747-G750 PolarHBondContact O-N 3.42Å; E747-L751 WeakPolarHBondContact O-CG 3.31Å; E747-L751 PolarHBondContact O-N 3.41Å
748	E	74.5	Confident	80.1	Confident	123 Å²	123	37.9 Å²	37.9	58%	0.575	19%	0.185	S	C	*	.	H	α-helix	trans	-62.1	-40.2	174	-51.8	-143.5	119.7	0	0	111.8	L751 D752 R868	E748-L751 PolarHBondContact O-N 3.32Å; E748-D752 PolarHBondContact O-N 2.63Å; E748-D752 VanDerWaalsContact O-N 3.09Å; E748-R868 IonicContact OE1-CZ 3.33Å; E748-R868 IonicContact OE1-NE 3.41Å; E748-R868 IonicContact OE1-NH1 3.55Å; E748-R868 PolarHBondContact OE1-NH1 2.95Å; E748-R868 IonicContact OE1-NH2 3.71Å; E748-R868 PolarHBondContact OE1-NH2 3.42Å
749	I	79.3	Confident	80.2	Confident	89 Å²	89	38.9 Å²	38.9	46%	0.456	20%	0.198	S	C	.	.	H	α-helix	trans	-65.7	-44.4	178.7	-56.3	173.7	0	0	0	109.6	E747 L751 D752 M753	E747-I749 VanDerWaalsContact C-N 3.28Å; E747-I749 PolarHBondContact O-N 2.91Å; I749-L751 PolarHBondContact O-N 2.87Å; I749-D752 PolarHBondContact O-N 3.27Å; I749-M753 HydrophobicContact CG2-CE 3.62Å; I749-M753 HydrophobicContact CG2-CG 4.48Å; I749-M753 HydrophobicContact CG2-SD 4.28Å; I749-M753 WeakPolarHBondContact O-CB 3.39Å; I749-M753 VanDerWaalsContact O-CG 3.31Å; I749-M753 WeakPolarHBondContact O-CG 3.44Å; I749-M753 PolarHBondContact O-N 3.05Å
750	G	77	Confident	80.3	Confident	10 Å²	10	44.4 Å²	44.4	10%	0.103	22%	0.223	C	C	.	.	H	α-helix	trans	-57.8	-44.9	174.6	0	0	0	0	0	112.7	E747 D752 M753 A754	E747-G750 PolarHBondContact O-N 3.42Å; G750-D752 PolarHBondContact O-N 3.12Å; G750-M753 PolarHBondContact O-N 3.29Å; G750-A754 VanDerWaalsContact O-CB 3.26Å; G750-A754 WeakPolarHBondContact O-CB 3.5Å; G750-A754 PolarHBondContact O-N 3.2Å
751	L	78.3	Confident	80.2	Confident	13 Å²	13	45.5 Å²	45.5	7%	0.068	23%	0.229	C	C	.	.	H	α-helix	trans	-61.2	-43	176.5	-73.7	172.8	0	0	0	112.9	M745 E747 E748 I749 F755 C780	M745-L751 HydrophobicContact CG-CD2 4.45Å; E747-L751 WeakPolarHBondContact O-CG 3.31Å; E747-L751 PolarHBondContact O-N 3.41Å; E748-L751 PolarHBondContact O-N 3.32Å; I749-L751 PolarHBondContact O-N 2.87Å; L751-F755 WeakPolarHBondContact O-CB 3.06Å; L751-F755 PolarHBondContact O-N 3.06Å; L751-C780 HydrophobicContact CD2-CB 3.53Å; L751-C780 WeakPolarHBondContact CD2-O 3.26Å
752	D	82.4	Confident	80	Confident	86 Å²	86	46.9 Å²	46.9	46%	0.46	24%	0.236	S	C	.	.	H	α-helix	trans	-68.5	-39.6	178	-96	-4.9	0	0	0	112.1	E748 I749 G750 R756	E748-D752 PolarHBondContact O-N 2.63Å; E748-D752 VanDerWaalsContact O-N 3.09Å; I749-D752 PolarHBondContact O-N 3.27Å; G750-D752 PolarHBondContact O-N 3.12Å; D752-R756 WeakPolarHBondContact O-CG 3.07Å; D752-R756 PolarHBondContact O-N 3.49Å
753	M	82.2	Confident	79.9	Confident	106 Å²	106	55.9 Å²	55.9	52%	0.522	27%	0.27	S	S	.	.	H	α-helix	trans	-64.2	-48.4	173.5	-71.4	-175	-179	0	0	110.9	I749 G750 F755 R756 M757	I749-M753 HydrophobicContact CG2-CE 3.62Å; I749-M753 HydrophobicContact CG2-CG 4.48Å; I749-M753 HydrophobicContact CG2-SD 4.28Å; I749-M753 WeakPolarHBondContact O-CB 3.39Å; I749-M753 VanDerWaalsContact O-CG 3.31Å; I749-M753 WeakPolarHBondContact O-CG 3.44Å; I749-M753 PolarHBondContact O-N 3.05Å; G750-M753 PolarHBondContact O-N 3.29Å; M753-F755 VanDerWaalsContact C-N 3.32Å; M753-F755 PolarHBondContact O-N 3.38Å; M753-R756 WeakPolarHBondContact O-CB 3.38Å; M753-R756 PolarHBondContact O-N 2.91Å; M753-R756 VanDerWaalsContact O-N 3.09Å; M753-M757 VanDerWaalsContact O-CG 3.24Å; M753-M757 WeakPolarHBondContact O-CG 3.33Å; M753-M757 PolarHBondContact O-N 2.77Å
754	A	82.3	Confident	79.7	Confident	3 Å²	3	63.5 Å²	63.5	3%	0.025	30%	0.303	C	S	.	.	H	α-helix	trans	-58.4	-42.4	177.8	0	0	0	0	0	111.6	A744 G750 R756 M757 F758	A744-A754 HydrophobicContact CB-CB 3.76Å; G750-A754 VanDerWaalsContact O-CB 3.26Å; G750-A754 WeakPolarHBondContact O-CB 3.5Å; G750-A754 PolarHBondContact O-N 3.2Å; A754-R756 VanDerWaalsContact C-N 3.32Å; A754-R756 PolarHBondContact O-N 3.45Å; A754-M757 PolarHBondContact O-N 3.22Å; A754-M757 VanDerWaalsContact O-N 3.15Å; A754-F758 HydrophobicContact CB-CD2 4.38Å; A754-F758 HydrophobicContact CB-CE2 3.86Å; A754-F758 HydrophobicContact CB-CZ 4.33Å; A754-F758 WeakPolarHBondContact O-CB 3.44Å; A754-F758 WeakPolarHBondContact O-CD2 3.39Å; A754-F758 VanDerWaalsContact O-CG 3.23Å; A754-F758 WeakPolarHBondContact O-CG 3.44Å; A754-F758 PolarHBondContact O-N 3.36Å
755	F	85.1	Confident	79.3	Confident	50 Å²	50	64.1 Å²	64.1	22%	0.219	31%	0.31	C	S	.	.	H	α-helix	trans	-56.9	-43.1	175.1	-177.7	-98.4	0	0	0	112.5	L751 M753 G759 L777 Y781 V789 T792	L751-F755 WeakPolarHBondContact O-CB 3.06Å; L751-F755 PolarHBondContact O-N 3.06Å; M753-F755 VanDerWaalsContact C-N 3.32Å; M753-F755 PolarHBondContact O-N 3.38Å; F755-G759 PolarHBondContact O-N 2.84Å; F755-L777 HydrophobicContact CD2-CD2 3.64Å; F755-L777 HydrophobicContact CE2-CD2 4.15Å; F755-Y781 HydrophobicContact CD2-CE2 4.25Å; F755-V789 HydrophobicContact CD2-CG2 4.13Å; F755-V789 HydrophobicContact CE2-CG2 3.86Å; F755-T792 HydrophobicContact CE2-CG2 4.48Å; F755-T792 HydrophobicContact CZ-CG2 4.05Å
756	R	84.8	Confident	79.5	Confident	174 Å²	174	67 Å²	67	66%	0.657	32%	0.323	S	S	*	.	H	α-helix	trans	-66.3	-43.9	175.8	-65.6	176.6	-167.7	176.7	5.9	111.2	D752 M753 A754 G759 H760	D752-R756 WeakPolarHBondContact O-CG 3.07Å; D752-R756 PolarHBondContact O-N 3.49Å; M753-R756 WeakPolarHBondContact O-CB 3.38Å; M753-R756 PolarHBondContact O-N 2.91Å; M753-R756 VanDerWaalsContact O-N 3.09Å; A754-R756 VanDerWaalsContact C-N 3.32Å; A754-R756 PolarHBondContact O-N 3.45Å; R756-G759 WeakPolarHBondContact O-CA 3.37Å; R756-G759 PolarHBondContact O-N 3.04Å; R756-H760 PolarHBondContact O-CD2 2.78Å; R756-H760 PolarHBondContact O-N 3.39Å
757	M	83.2	Confident	79.9	Confident	49 Å²	49	70.2 Å²	70.2	24%	0.241	34%	0.335	C	S	.	.	H	α-helix	trans	-63.3	-42.8	-179.6	-67.2	169.1	72.1	0	0	112.4	I616 L620 M753 A754 G759 H760 L761	I616-M757 HydrophobicContact CG2-CE 4.08Å; L620-M757 HydrophobicContact CD1-CE 3.12Å; L620-M757 HydrophobicContact CD2-CE 3.24Å; L620-M757 HydrophobicContact CG-CE 3.62Å; M753-M757 VanDerWaalsContact O-CG 3.24Å; M753-M757 WeakPolarHBondContact O-CG 3.33Å; M753-M757 PolarHBondContact O-N 2.77Å; A754-M757 PolarHBondContact O-N 3.22Å; A754-M757 VanDerWaalsContact O-N 3.15Å; M757-G759 PolarHBondContact O-N 3.25Å; M757-H760 WeakPolarHBondContact O-CA 3.23Å; M757-H760 WeakPolarHBondContact O-CB 3.29Å; M757-H760 PolarHBondContact O-N 3.12Å; M757-L761 PolarHBondContact O-N 2.73Å
758	F	83.7	Confident	80	Confident	1 Å²	1	69.4 Å²	69.4	0%	0.004	33%	0.333	C	S	.	.	H	α-helix	trans	-58.3	-37.7	171.2	-67.6	-37.9	0	0	0	111.4	V737 V740 A741 A754 H760 L761 L762 V773 A776 L777	V737-F758 HydrophobicContact CG1-CD1 4.02Å; V737-F758 HydrophobicContact CG1-CE1 3.61Å; V740-F758 HydrophobicContact CG1-CE1 4.32Å; V740-F758 HydrophobicContact CG1-CZ 4.23Å; A741-F758 HydrophobicContact CB-CZ 4.03Å; A754-F758 HydrophobicContact CB-CD2 4.38Å; A754-F758 HydrophobicContact CB-CE2 3.86Å; A754-F758 HydrophobicContact CB-CZ 4.33Å; A754-F758 WeakPolarHBondContact O-CB 3.44Å; A754-F758 WeakPolarHBondContact O-CD2 3.39Å; A754-F758 VanDerWaalsContact O-CG 3.23Å; A754-F758 WeakPolarHBondContact O-CG 3.44Å; A754-F758 PolarHBondContact O-N 3.36Å; F758-H760 VanDerWaalsContact C-N 3.28Å; F758-H760 PolarHBondContact O-N 2.68Å; F758-L761 HydrophobicContact CD1-CD1 3.99Å; F758-L761 HydrophobicContact CE1-CD1 4.47Å; F758-L761 PolarHBondContact O-N 3Å; F758-L762 WeakPolarHBondContact O-CB 3.31Å; F758-L762 WeakPolarHBondContact O-CD1 3.47Å; F758-L762 WeakPolarHBondContact O-CG 3.11Å; F758-L762 PolarHBondContact O-N 3.18Å; F758-V773 HydrophobicContact CB-CG1 3.71Å; F758-V773 HydrophobicContact CD1-CG1 4.32Å; F758-V773 HydrophobicContact CD1-CG2 4.36Å; F758-V773 HydrophobicContact CG-CG1 4.1Å; F758-A776 HydrophobicContact CE1-CB 3.94Å; F758-A776 HydrophobicContact CE2-CB 4.18Å; F758-A776 HydrophobicContact CZ-CB 3.71Å; F758-L777 HydrophobicContact CB-CD2 4.38Å; F758-L777 HydrophobicContact CD2-CD2 3.66Å; F758-L777 HydrophobicContact CD2-CG 4.14Å; F758-L777 HydrophobicContact CE2-CD2 4.45Å; F758-L777 HydrophobicContact CG-CD2 4.41Å
759	G	83.6	Confident	80.3	Confident	29 Å²	29	63.8 Å²	63.8	30%	0.299	31%	0.307	S	S	.	.	H	α-helix	trans	-58.4	-34.4	171.2	0	0	0	0	0	114.4	F755 R756 M757 R763	F755-G759 PolarHBondContact O-N 2.84Å; R756-G759 WeakPolarHBondContact O-CA 3.37Å; R756-G759 PolarHBondContact O-N 3.04Å; M757-G759 PolarHBondContact O-N 3.25Å; G759-R763 WeakPolarHBondContact O-CG 3.25Å
760	H	83	Confident	80.5	Confident	117 Å²	117	62.9 Å²	62.9	54%	0.542	30%	0.3	S	S	.	.	H	α-helix	trans	-77.3	-44	173.7	-77.4	-94.5	0	0	0	112.3	R756 M757 F758 L762 R763 F764	R756-H760 PolarHBondContact O-CD2 2.78Å; R756-H760 PolarHBondContact O-N 3.39Å; M757-H760 WeakPolarHBondContact O-CA 3.23Å; M757-H760 WeakPolarHBondContact O-CB 3.29Å; M757-H760 PolarHBondContact O-N 3.12Å; F758-H760 VanDerWaalsContact C-N 3.28Å; F758-H760 PolarHBondContact O-N 2.68Å; H760-L762 PolarHBondContact O-N 3.36Å; H760-R763 PolarHBondContact O-N 3.09Å; H760-F764 WeakPolarHBondContact O-CD2 3.46Å; H760-F764 PolarHBondContact O-N 3.46Å; H760-F764 VanDerWaalsContact O-N 3.09Å
761	L	81.3	Confident	80.6	Confident	25 Å²	25	64.7 Å²	64.7	13%	0.131	30%	0.304	C	S	.	.	H	α-helix	trans	-59.3	-35.1	176.5	-73.1	167.9	0	0	0	111.7	L623 M757 F758 R763 G765 I769 V773	L623-L761 HydrophobicContact CB-CD2 4.49Å; L623-L761 HydrophobicContact CD1-CD1 4.28Å; L623-L761 HydrophobicContact CD1-CD2 4.4Å; M757-L761 PolarHBondContact O-N 2.73Å; F758-L761 HydrophobicContact CD1-CD1 3.99Å; F758-L761 HydrophobicContact CE1-CD1 4.47Å; F758-L761 PolarHBondContact O-N 3Å; L761-R763 VanDerWaalsContact C-N 3.3Å; L761-R763 PolarHBondContact O-N 2.74Å; L761-G765 WeakPolarHBondContact O-CA 3.42Å; L761-G765 PolarHBondContact O-N 2.93Å; L761-I769 HydrophobicContact CB-CG2 4.08Å; L761-I769 HydrophobicContact CD2-CG2 4.21Å; L761-V773 HydrophobicContact CB-CG2 4.24Å
762	L	78.1	Confident	80.9	Confident	29 Å²	29	64 Å²	64	15%	0.152	30%	0.3	C	S	.	.	H	α-helix	trans	-65.7	-30	174.7	-76.1	161.6	0	0	0	113.6	F758 H760 K770 V773 F796	F758-L762 WeakPolarHBondContact O-CB 3.31Å; F758-L762 WeakPolarHBondContact O-CD1 3.47Å; F758-L762 WeakPolarHBondContact O-CG 3.11Å; F758-L762 PolarHBondContact O-N 3.18Å; H760-L762 PolarHBondContact O-N 3.36Å; L762-K770 VanDerWaalsContact O-CE 3.24Å; L762-K770 WeakPolarHBondContact O-CE 3.42Å; L762-V773 HydrophobicContact CD1-CG1 3.73Å; L762-V773 HydrophobicContact CD2-CB 3.86Å; L762-V773 HydrophobicContact CD2-CG1 3.86Å; L762-V773 HydrophobicContact CD2-CG2 4.27Å; L762-V773 HydrophobicContact CG-CB 4.09Å; L762-V773 HydrophobicContact CG-CG1 3.69Å; L762-V773 HydrophobicContact CG-CG2 4.2Å; L762-F796 HydrophobicContact CD1-CE1 4.08Å; L762-F796 HydrophobicContact CD1-CE2 3.76Å; L762-F796 HydrophobicContact CD1-CZ 3.32Å; L762-F796 HydrophobicContact CD2-CE1 4.13Å; L762-F796 HydrophobicContact CD2-CE2 4.45Å; L762-F796 HydrophobicContact CD2-CZ 4.09Å; L762-F796 HydrophobicContact CG-CZ 4.27Å
763	R	79.8	Confident	81	Confident	194 Å²	194	60 Å²	60	73%	0.732	28%	0.278	S	S	*	.	H	α-helix	trans	-82.6	-39.9	-179.9	-67.8	177.7	-174.9	-169.9	2.4	112.2	G759 H760 L761	G759-R763 WeakPolarHBondContact O-CG 3.25Å; H760-R763 PolarHBondContact O-N 3.09Å; L761-R763 VanDerWaalsContact C-N 3.3Å; L761-R763 PolarHBondContact O-N 2.74Å
764	F	77.4	Confident	81.2	Confident	161 Å²	161	54.9 Å²	54.9	71%	0.706	25%	0.254	S	S	*	.	H	α-helix	trans	-112	-13.8	-169.3	-62.8	-70.1	0	0	0	115	H760	H760-F764 WeakPolarHBondContact O-CD2 3.46Å; H760-F764 PolarHBondContact O-N 3.46Å; H760-F764 VanDerWaalsContact O-N 3.09Å
765	G	71.3	Confident	81.3	Confident	15 Å²	15	54.8 Å²	54.8	16%	0.155	25%	0.252	C	S	.	.	S	Bend	trans	-74.4	157.5	-177	0	0	0	0	0	113.5	L761 K770	L761-G765 WeakPolarHBondContact O-CA 3.42Å; L761-G765 PolarHBondContact O-N 2.93Å; G765-K770 WeakPolarHBondContact O-CE 3.1Å
766	E	79.3	Confident	81.3	Confident	70 Å²	70	52.4 Å²	52.4	33%	0.327	24%	0.242	S	C	.	.			trans	-67.4	167.2	171.2	-64.1	-177.9	-175.4	0	0	111.6	H730 Q733 P768 I769 K770	H730-E766 IonicContact CE1-OE2 2.93Å; H730-E766 IonicContact ND1-OE2 2.91Å; Q733-E766 PolarHBondContact OE1-OE2 2.97Å; E766-P768 VanDerWaalsContact C-N 3.35Å; E766-I769 WeakPolarHBondContact O-CB 3.38Å; E766-I769 PolarHBondContact O-N 3.27Å; E766-I769 VanDerWaalsContact O-N 3.16Å; E766-K770 WeakPolarHBondContact O-CG 3.16Å; E766-K770 PolarHBondContact O-N 2.82Å
767	L	77.4	Confident	81.4	Confident	89 Å²	89	44.2 Å²	44.2	47%	0.466	21%	0.211	S	C	.	.	H	α-helix	trans	-54.1	-40.3	-179	-169.4	64.3	0	0	0	114.1	K770 R771	L767-K770 PolarHBondContact O-N 3.22Å; L767-R771 WeakPolarHBondContact O-CG 3.33Å; L767-R771 PolarHBondContact O-N 2.95Å
768	P	75.7	Confident	81.5	Confident	25 Å²	25	41.9 Å²	41.9	16%	0.162	20%	0.2	C	C	.	.	H	α-helix	trans	-66.2	-39.9	177	-16	28.4	0	0	0	113	H730 E766 K770 R771 A772	H730-P768 HydrophobicContact CB-CB 3.92Å; H730-P768 HydrophobicContact CB-CG 3.47Å; H730-P768 VanDerWaalsContact CB-CG 3.47Å; H730-P768 VanDerWaalsContact CG-CG 3.46Å; H730-P768 WeakPolarHBondContact ND1-CG 3.3Å; E766-P768 VanDerWaalsContact C-N 3.35Å; P768-K770 VanDerWaalsContact C-N 3.33Å; P768-K770 PolarHBondContact O-N 3.24Å; P768-R771 PolarHBondContact O-N 2.99Å; P768-A772 PolarHBondContact O-N 3.07Å
769	I	81.8	Confident	81.4	Confident	4 Å²	4	42 Å²	42	2%	0.021	20%	0.2	C	C	.	.	H	α-helix	trans	-60	-48.3	174.4	-65.2	173.6	0	0	0	108.9	L623 Q733 V737 L761 E766 R771 A772 V773	L623-I769 HydrophobicContact CD2-CD1 4.27Å; L623-I769 HydrophobicContact CD2-CG1 4.42Å; Q733-I769 HydrophobicContact CB-CD1 4.21Å; Q733-I769 HydrophobicContact CB-CG1 3.78Å; Q733-I769 HydrophobicContact CG-CD1 4.44Å; Q733-I769 HydrophobicContact CG-CG1 4.5Å; V737-I769 HydrophobicContact CG2-CG2 3.98Å; L761-I769 HydrophobicContact CB-CG2 4.08Å; L761-I769 HydrophobicContact CD2-CG2 4.21Å; E766-I769 WeakPolarHBondContact O-CB 3.38Å; E766-I769 PolarHBondContact O-N 3.27Å; E766-I769 VanDerWaalsContact O-N 3.16Å; I769-R771 VanDerWaalsContact C-N 3.28Å; I769-R771 PolarHBondContact O-N 2.9Å; I769-A772 PolarHBondContact O-N 3.13Å; I769-V773 HydrophobicContact CG2-CG2 4.38Å; I769-V773 WeakPolarHBondContact O-CG2 3.48Å; I769-V773 PolarHBondContact O-N 3.21Å
770	K	82	Confident	81.4	Confident	70 Å²	70	41.1 Å²	41.1	30%	0.304	19%	0.189	S	C	.	.	H	α-helix	trans	-57.3	-41.1	177.8	-69.5	-178.5	-177.1	-178.6	0	112	L762 G765 E766 L767 P768 A772 P774 L804	L762-K770 VanDerWaalsContact O-CE 3.24Å; L762-K770 WeakPolarHBondContact O-CE 3.42Å; G765-K770 WeakPolarHBondContact O-CE 3.1Å; E766-K770 WeakPolarHBondContact O-CG 3.16Å; E766-K770 PolarHBondContact O-N 2.82Å; L767-K770 PolarHBondContact O-N 3.22Å; P768-K770 VanDerWaalsContact C-N 3.33Å; P768-K770 PolarHBondContact O-N 3.24Å; K770-A772 VanDerWaalsContact C-N 3.34Å; K770-A772 PolarHBondContact O-N 3Å; K770-P774 WeakPolarHBondContact O-CD 3.02Å; K770-L804 WeakPolarHBondContact O-CD1 2.98Å
771	R	80.9	Confident	81.3	Confident	48 Å²	48	35.9 Å²	35.9	18%	0.181	17%	0.165	C	C	.	.	H	α-helix	trans	-65.7	-32.7	176.7	-71.3	172.1	179.8	176.7	0.8	113.2	L767 P768 I769 D801 E803 L804 N807	L767-R771 WeakPolarHBondContact O-CG 3.33Å; L767-R771 PolarHBondContact O-N 2.95Å; P768-R771 PolarHBondContact O-N 2.99Å; I769-R771 VanDerWaalsContact C-N 3.28Å; I769-R771 PolarHBondContact O-N 2.9Å; R771-D801 IonicContact CZ-OD1 3.13Å; R771-D801 IonicContact CZ-OD2 2.78Å; R771-D801 IonicContact NE-OD1 2.68Å; R771-D801 IonicContact NE-OD2 3.8Å; R771-D801 PolarHBondContact NE-OD2 3.31Å; R771-D801 IonicContact NH2-OD1 3.57Å; R771-D801 PolarHBondContact NH2-OD1 3.44Å; R771-D801 IonicContact NH2-OD2 2.73Å; R771-D801 PolarHBondContact NH2-OD2 2.89Å; R771-D801 VanDerWaalsContact NH2-OD2 3.12Å; R771-E803 VanDerWaalsContact CD-OE2 3.32Å; R771-E803 WeakPolarHBondContact CD-OE2 3.3Å; R771-E803 HydrophobicContact CG-CB 4.22Å; R771-E803 VanDerWaalsContact CZ-CD 3.43Å; R771-E803 IonicContact CZ-OE1 3.62Å; R771-E803 IonicContact CZ-OE2 3.68Å; R771-E803 IonicContact NE-OE2 3.64Å; R771-E803 PolarHBondContact NE-OE2 3.4Å; R771-E803 IonicContact NH1-OE1 2.75Å; R771-E803 PolarHBondContact NH1-OE1 2.99Å; R771-E803 IonicContact NH1-OE2 3.14Å; R771-E803 PolarHBondContact NH1-OE2 2.91Å; R771-E803 IonicContact NH2-OE1 3.44Å; R771-E803 IonicContact NH2-OE2 3.75Å; R771-L804 HydrophobicContact CG-CB 4.44Å; R771-N807 PolarHBondContact O-ND2 3.19Å
772	A	83.3	Confident	81.3	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-81.5	-28.9	-179.6	0	0	0	0	0	113.8	V737 P768 I769 K770 L775 A776 L887	V737-A772 HydrophobicContact CB-CB 4.18Å; V737-A772 HydrophobicContact CG1-CB 4.43Å; P768-A772 PolarHBondContact O-N 3.07Å; I769-A772 PolarHBondContact O-N 3.13Å; K770-A772 VanDerWaalsContact C-N 3.34Å; K770-A772 PolarHBondContact O-N 3Å; A772-L775 WeakPolarHBondContact O-CB 3.25Å; A772-L775 PolarHBondContact O-N 3.33Å; A772-L775 VanDerWaalsContact O-N 3.11Å; A772-A776 PolarHBondContact O-N 3.46Å; A772-L887 HydrophobicContact CB-CD2 3.89Å
773	V	85.2	Confident	81.2	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-56.8	-44.4	-176.5	171.9	0	0	0	0	114	V737 F758 L761 L762 I769 L775 A776 L777	V737-V773 HydrophobicContact CG1-CG2 3.99Å; F758-V773 HydrophobicContact CB-CG1 3.71Å; F758-V773 HydrophobicContact CD1-CG1 4.32Å; F758-V773 HydrophobicContact CD1-CG2 4.36Å; F758-V773 HydrophobicContact CG-CG1 4.1Å; L761-V773 HydrophobicContact CB-CG2 4.24Å; L762-V773 HydrophobicContact CD1-CG1 3.73Å; L762-V773 HydrophobicContact CD2-CB 3.86Å; L762-V773 HydrophobicContact CD2-CG1 3.86Å; L762-V773 HydrophobicContact CD2-CG2 4.27Å; L762-V773 HydrophobicContact CG-CB 4.09Å; L762-V773 HydrophobicContact CG-CG1 3.69Å; L762-V773 HydrophobicContact CG-CG2 4.2Å; I769-V773 HydrophobicContact CG2-CG2 4.38Å; I769-V773 WeakPolarHBondContact O-CG2 3.48Å; I769-V773 PolarHBondContact O-N 3.21Å; V773-L775 VanDerWaalsContact C-N 3.26Å; V773-L775 PolarHBondContact O-N 3.07Å; V773-A776 WeakPolarHBondContact O-CB 3.46Å; V773-A776 PolarHBondContact O-N 3.3Å; V773-L777 HydrophobicContact CG1-CD1 4.09Å; V773-L777 HydrophobicContact CG1-CG 4.27Å; V773-L777 WeakPolarHBondContact O-CG 3.3Å; V773-L777 PolarHBondContact O-N 3.26Å
774	P	86.4	Confident	81.2	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-59.6	-36.2	177.1	-25.8	34.4	0	0	0	113.5	K770 L777 A778 L793 L804 S808 A811	K770-P774 WeakPolarHBondContact O-CD 3.02Å; P774-L777 PolarHBondContact O-N 2.73Å; P774-A778 PolarHBondContact O-N 3.12Å; P774-L793 HydrophobicContact CB-CD2 3.82Å; P774-L804 HydrophobicContact CG-CD1 3.68Å; P774-S808 WeakPolarHBondContact CG-OG 3.28Å; P774-A811 HydrophobicContact CB-CB 4.16Å; P774-A811 WeakPolarHBondContact O-CB 3.42Å
775	L	84.3	Confident	81.2	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-68.8	-40.3	177.2	-61	177.7	0	0	0	111.1	L738 A772 V773 A778 L779 N807 L883 C886 L887	L738-L775 HydrophobicContact CD2-CB 4.02Å; A772-L775 WeakPolarHBondContact O-CB 3.25Å; A772-L775 PolarHBondContact O-N 3.33Å; A772-L775 VanDerWaalsContact O-N 3.11Å; V773-L775 VanDerWaalsContact C-N 3.26Å; V773-L775 PolarHBondContact O-N 3.07Å; L775-A778 WeakPolarHBondContact O-CB 3.42Å; L775-A778 PolarHBondContact O-N 2.75Å; L775-L779 PolarHBondContact O-N 2.9Å; L775-N807 HydrophobicContact CD1-CB 4.46Å; L775-N807 HydrophobicContact CD2-CB 4.05Å; L775-N807 HydrophobicContact CG-CB 4.06Å; L775-L883 HydrophobicContact CB-CD2 4.03Å; L775-L883 HydrophobicContact CD2-CD2 3.95Å; L775-C886 HydrophobicContact CD1-CB 3.69Å; L775-C886 HydrophobicContact CD2-CB 3.91Å; L775-C886 HydrophobicContact CG-CB 4.48Å; L775-L887 HydrophobicContact CD1-CD2 4.11Å
776	A	85.6	Confident	81.7	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-64	-41.9	174.2	0	0	0	0	0	112.2	V737 L738 A741 F758 A772 V773 A778 L779 C780	V737-A776 HydrophobicContact CG1-CB 3.7Å; L738-A776 HydrophobicContact CD2-CB 4.28Å; A741-A776 HydrophobicContact CB-CB 3.9Å; F758-A776 HydrophobicContact CE1-CB 3.94Å; F758-A776 HydrophobicContact CE2-CB 4.18Å; F758-A776 HydrophobicContact CZ-CB 3.71Å; A772-A776 PolarHBondContact O-N 3.46Å; V773-A776 WeakPolarHBondContact O-CB 3.46Å; V773-A776 PolarHBondContact O-N 3.3Å; A776-A778 VanDerWaalsContact C-N 3.29Å; A776-A778 PolarHBondContact O-N 3.44Å; A776-L779 PolarHBondContact O-N 2.92Å; A776-C780 PolarHBondContact O-N 3.31Å; A776-C780 PolarHBondContact O-SG 3.13Å
777	L	85.6	Confident	81.8	Confident	3 Å²	3	23 Å²	23	2%	0.016	12%	0.116	C	C	.	.	H	α-helix	trans	-61.5	-37.8	172.1	-74.1	173.2	0	0	0	112.1	F755 F758 V773 P774 C780 Y781 V789 L793	F755-L777 HydrophobicContact CD2-CD2 3.64Å; F755-L777 HydrophobicContact CE2-CD2 4.15Å; F758-L777 HydrophobicContact CB-CD2 4.38Å; F758-L777 HydrophobicContact CD2-CD2 3.66Å; F758-L777 HydrophobicContact CD2-CG 4.14Å; F758-L777 HydrophobicContact CE2-CD2 4.45Å; F758-L777 HydrophobicContact CG-CD2 4.41Å; V773-L777 HydrophobicContact CG1-CD1 4.09Å; V773-L777 HydrophobicContact CG1-CG 4.27Å; V773-L777 WeakPolarHBondContact O-CG 3.3Å; V773-L777 PolarHBondContact O-N 3.26Å; P774-L777 PolarHBondContact O-N 2.73Å; L777-C780 PolarHBondContact O-N 2.99Å; L777-Y781 WeakPolarHBondContact O-CD2 3.36Å; L777-Y781 PolarHBondContact O-N 2.8Å; L777-Y781 VanDerWaalsContact O-N 3.14Å; L777-V789 HydrophobicContact CB-CG1 4.49Å; L777-L793 HydrophobicContact CB-CD2 4.45Å; L777-L793 HydrophobicContact CD1-CD2 4.29Å
778	A	84.9	Confident	82.2	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-64.9	-39.8	176.4	0	0	0	0	0	112.6	P774 L775 A776 Y781 V782 A811 I814 V815	P774-A778 PolarHBondContact O-N 3.12Å; L775-A778 WeakPolarHBondContact O-CB 3.42Å; L775-A778 PolarHBondContact O-N 2.75Å; A776-A778 VanDerWaalsContact C-N 3.29Å; A776-A778 PolarHBondContact O-N 3.44Å; A778-Y781 CarbonylContact O-C 3.54Å; A778-Y781 PolarHBondContact O-N 2.94Å; A778-V782 WeakPolarHBondContact O-CG2 3.46Å; A778-V782 PolarHBondContact O-N 3.24Å; A778-A811 HydrophobicContact CB-CB 3.7Å; A778-I814 HydrophobicContact CB-CB 4.25Å; A778-I814 HydrophobicContact CB-CG2 4.29Å; A778-V815 HydrophobicContact CB-CG2 4.21Å
779	L	83.2	Confident	82.7	Confident	2 Å²	2	25.1 Å²	25.1	1%	0.01	12%	0.119	C	C	.	.	H	α-helix	trans	-66.5	-41.2	176.3	-170.4	111.1	0	0	0	111.7	A741 I742 M745 L775 A776 Y781 V782 L876 L883	A741-L779 HydrophobicContact CB-CB 4.35Å; A741-L779 HydrophobicContact CB-CD2 3.53Å; I742-L779 HydrophobicContact CB-CD2 4.2Å; I742-L779 HydrophobicContact CG1-CD1 4.37Å; I742-L779 HydrophobicContact CG1-CD2 3.45Å; I742-L779 VanDerWaalsContact CG1-CD2 3.45Å; M745-L779 HydrophobicContact CE-CG 4.36Å; M745-L779 WeakPolarHBondContact CE-O 3.28Å; M745-L779 HydrophobicContact CG-CD2 4.16Å; M745-L779 HydrophobicContact SD-CD1 4.37Å; M745-L779 HydrophobicContact SD-CD2 3.29Å; M745-L779 WeakPolarHBondContact SD-CD2 3.37Å; M745-L779 HydrophobicContact SD-CG 3.47Å; M745-L779 WeakPolarHBondContact SD-CG 3.34Å; L775-L779 PolarHBondContact O-N 2.9Å; A776-L779 PolarHBondContact O-N 2.92Å; L779-Y781 VanDerWaalsContact C-N 3.32Å; L779-Y781 PolarHBondContact O-N 3.29Å; L779-V782 WeakPolarHBondContact O-CG2 3.27Å; L779-L876 HydrophobicContact CD1-CD1 4.33Å; L779-L883 HydrophobicContact CB-CD1 3.78Å; L779-L883 HydrophobicContact CD1-CD1 3.22Å; L779-L883 HydrophobicContact CG-CD1 4.08Å
780	C	82.4	Confident	82.8	Confident	11 Å²	11	24.9 Å²	24.9	7%	0.074	12%	0.118	C	C	.	.	H	α-helix	trans	-62.7	-36.2	175.6	-74.5	0	0	0	0	113.3	L751 A776 L777	L751-C780 HydrophobicContact CD2-CB 3.53Å; L751-C780 WeakPolarHBondContact CD2-O 3.26Å; A776-C780 PolarHBondContact O-N 3.31Å; A776-C780 PolarHBondContact O-SG 3.13Å; L777-C780 PolarHBondContact O-N 2.99Å
781	Y	82.2	Confident	83	Confident	8 Å²	8	24.3 Å²	24.3	3%	0.031	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.5	42.5	-172	-65.4	-82	0	0	0	113.2	F755 L777 A778 L779 S783 N784 Q786 V789 V815	F755-Y781 HydrophobicContact CD2-CE2 4.25Å; L777-Y781 WeakPolarHBondContact O-CD2 3.36Å; L777-Y781 PolarHBondContact O-N 2.8Å; L777-Y781 VanDerWaalsContact O-N 3.14Å; A778-Y781 CarbonylContact O-C 3.54Å; A778-Y781 PolarHBondContact O-N 2.94Å; L779-Y781 VanDerWaalsContact C-N 3.32Å; L779-Y781 PolarHBondContact O-N 3.29Å; Y781-S783 PolarHBondContact O-N 2.75Å; Y781-N784 PolarHBondContact O-N 3.15Å; Y781-Q786 HydrophobicContact CD1-CG 4.19Å; Y781-Q786 VanDerWaalsContact CE1-CD 3.43Å; Y781-Q786 HydrophobicContact CE1-CG 4.25Å; Y781-Q786 VanDerWaalsContact CE1-OE1 3.28Å; Y781-V789 HydrophobicContact CD1-CG2 4.19Å; Y781-V789 HydrophobicContact CD2-CB 4.47Å; Y781-V789 HydrophobicContact CD2-CG1 4.12Å; Y781-V789 HydrophobicContact CD2-CG2 3.62Å; Y781-V789 HydrophobicContact CE1-CG2 4.2Å; Y781-V789 HydrophobicContact CE2-CG2 3.64Å; Y781-V789 HydrophobicContact CG-CG1 4.48Å; Y781-V789 HydrophobicContact CG-CG2 3.91Å; Y781-V815 WeakPolarHBondContact O-CA 3.33Å
782	V	81.4	Confident	83.3	Confident	8 Å²	8	23.7 Å²	23.7	5%	0.048	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	125.8	179.3	-178.6	0	0	0	0	110.7	A778 L779 N784 I814 L861 L879	A778-V782 WeakPolarHBondContact O-CG2 3.46Å; A778-V782 PolarHBondContact O-N 3.24Å; L779-V782 WeakPolarHBondContact O-CG2 3.27Å; V782-N784 PolarHBondContact O-N 3.03Å; V782-I814 HydrophobicContact CG1-CG2 4.3Å; V782-I814 HydrophobicContact CG2-CG2 4.15Å; V782-L861 HydrophobicContact CG1-CB 3.72Å; V782-L861 WeakPolarHBondContact CG1-O 3.1Å; V782-L879 HydrophobicContact CG1-CD1 4.13Å; V782-L879 HydrophobicContact CG2-CD1 4.05Å
783	S	75.2	Confident	83.3	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	17	-179.8	-49.3	0	0	0	0	115.3	Y781 I814 V815 A817 T819 L861	Y781-S783 PolarHBondContact O-N 2.75Å; S783-I814 PolarHBondContact N-O 3.34Å; S783-V815 CarbonylContact C-O 3.54Å; S783-V815 VanDerWaalsContact CA-O 3.27Å; S783-V815 WeakPolarHBondContact CA-O 3.36Å; S783-V815 PolarHBondContact N-O 3.06Å; S783-A817 PolarHBondContact OG-O 2.89Å; S783-T819 WeakPolarHBondContact O-CG2 3.42Å; S783-L861 PolarHBondContact OG-N 3.27Å; S783-L861 VanDerWaalsContact OG-N 3.17Å
784	N	80.8	Confident	83.3	Confident	30 Å²	30	24.9 Å²	24.9	16%	0.16	13%	0.128	C	C	.	.			trans	-118.8	94	174.2	-175.4	1.4	0	0	0	110.2	Y781 V782 Q786 V815	Y781-N784 PolarHBondContact O-N 3.15Å; V782-N784 PolarHBondContact O-N 3.03Å; N784-Q786 VanDerWaalsContact C-N 3.25Å; N784-Q786 PolarHBondContact O-N 3.46Å; N784-V815 PolarHBondContact N-O 2.98Å; N784-V815 WeakPolarHBondContact O-CG1 2.98Å
785	P	76.8	Confident	83.3	Confident	30 Å²	30	32.2 Å²	32.2	20%	0.195	16%	0.16	C	C	.	.			trans	-79.8	71.5	-175.6	33.5	-36.1	0	0	0	111.5	L787 L790 T819 N821	P785-L787 PolarHBondContact O-N 3.08Å; P785-L790 HydrophobicContact CB-CD1 3.93Å; P785-T819 HydrophobicContact CG-CG2 4.13Å; P785-N821 HydrophobicContact CG-CB 4.43Å
786	Q	80.9	Confident	83.2	Confident	68 Å²	68	34.1 Å²	34.1	32%	0.318	17%	0.169	S	C	.	.			trans	-67.9	129.2	170.1	-68.8	-165.7	-3.4	0	0	110.7	Y781 N784 K788 V789 L790	Y781-Q786 HydrophobicContact CD1-CG 4.19Å; Y781-Q786 VanDerWaalsContact CE1-CD 3.43Å; Y781-Q786 HydrophobicContact CE1-CG 4.25Å; Y781-Q786 VanDerWaalsContact CE1-OE1 3.28Å; N784-Q786 VanDerWaalsContact C-N 3.25Å; N784-Q786 PolarHBondContact O-N 3.46Å; Q786-K788 PolarHBondContact O-N 3.31Å; Q786-V789 HydrophobicContact CB-CG2 4.12Å; Q786-V789 PolarHBondContact O-N 2.7Å; Q786-V789 VanDerWaalsContact O-N 3.13Å; Q786-L790 PolarHBondContact O-N 2.65Å; Q786-L790 VanDerWaalsContact O-N 3.08Å
787	L	82.3	Confident	82.9	Confident	86 Å²	86	34.1 Å²	34.1	45%	0.45	17%	0.169	S	C	.	.	H	α-helix	trans	-58.1	-36.6	-176.8	-63.7	179.2	0	0	0	112.9	P785 V789 L790 D791	P785-L787 PolarHBondContact O-N 3.08Å; L787-V789 PolarHBondContact O-N 3.42Å; L787-L790 PolarHBondContact O-N 3.25Å; L787-D791 WeakPolarHBondContact O-CB 3.28Å; L787-D791 VanDerWaalsContact O-CG 3.28Å; L787-D791 PolarHBondContact O-N 3.14Å
788	K	85.4	Confident	82.8	Confident	159 Å²	159	38.4 Å²	38.4	69%	0.691	19%	0.188	S	C	*	.	H	α-helix	trans	-60.8	-45.7	178.4	-65.9	179.7	-176.4	171.5	0	111.7	Q786 T792	Q786-K788 PolarHBondContact O-N 3.31Å; K788-T792 WeakPolarHBondContact O-CG2 3.32Å; K788-T792 PolarHBondContact O-N 3Å; K788-T792 VanDerWaalsContact O-N 3.17Å; K788-T792 PolarHBondContact O-OG1 3.11Å
789	V	85.5	Confident	82.6	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-69.4	-44.4	-178.9	-177.3	0	0	0	0	110.2	F755 L777 Y781 Q786 L787 D791 T792 L793	F755-V789 HydrophobicContact CD2-CG2 4.13Å; F755-V789 HydrophobicContact CE2-CG2 3.86Å; L777-V789 HydrophobicContact CB-CG1 4.49Å; Y781-V789 HydrophobicContact CD1-CG2 4.19Å; Y781-V789 HydrophobicContact CD2-CB 4.47Å; Y781-V789 HydrophobicContact CD2-CG1 4.12Å; Y781-V789 HydrophobicContact CD2-CG2 3.62Å; Y781-V789 HydrophobicContact CE1-CG2 4.2Å; Y781-V789 HydrophobicContact CE2-CG2 3.64Å; Y781-V789 HydrophobicContact CG-CG1 4.48Å; Y781-V789 HydrophobicContact CG-CG2 3.91Å; Q786-V789 HydrophobicContact CB-CG2 4.12Å; Q786-V789 PolarHBondContact O-N 2.7Å; Q786-V789 VanDerWaalsContact O-N 3.13Å; L787-V789 PolarHBondContact O-N 3.42Å; V789-D791 PolarHBondContact O-N 2.89Å; V789-T792 WeakPolarHBondContact CA-OG1 3.45Å; V789-T792 PolarHBondContact O-N 3.24Å; V789-T792 VanDerWaalsContact O-N 3.13Å; V789-T792 PolarHBondContact O-OG1 2.9Å; V789-L793 HydrophobicContact CG1-CD1 4.02Å; V789-L793 HydrophobicContact CG1-CG 4.34Å; V789-L793 WeakPolarHBondContact O-CG 3.41Å; V789-L793 PolarHBondContact O-N 3.08Å
790	L	84.7	Confident	82.3	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-60.7	-42.7	177.3	-68.3	-178	0	0	0	112.7	P785 Q786 L787 T792 L793 S794 V815 L824	P785-L790 HydrophobicContact CB-CD1 3.93Å; Q786-L790 PolarHBondContact O-N 2.65Å; Q786-L790 VanDerWaalsContact O-N 3.08Å; L787-L790 PolarHBondContact O-N 3.25Å; L790-T792 VanDerWaalsContact C-N 3.29Å; L790-T792 PolarHBondContact O-N 3.12Å; L790-L793 PolarHBondContact O-N 3.41Å; L790-S794 VanDerWaalsContact O-CB 3.27Å; L790-S794 WeakPolarHBondContact O-CB 3.49Å; L790-S794 PolarHBondContact O-N 2.83Å; L790-V815 HydrophobicContact CD2-CB 4.44Å; L790-V815 HydrophobicContact CD2-CG1 3.84Å; L790-L824 HydrophobicContact CD1-CB 4.46Å; L790-L824 HydrophobicContact CD1-CD1 4.31Å; L790-L824 HydrophobicContact CD2-CD1 3.67Å
791	D	86.8	Confident	82.3	Confident	58 Å²	58	48.2 Å²	48.2	31%	0.31	25%	0.25	S	C	.	.	H	α-helix	trans	-68.1	-28.8	177.5	-71.2	-21.4	0	0	0	111.9	L787 V789 K795 R823 M827	L787-D791 WeakPolarHBondContact O-CB 3.28Å; L787-D791 VanDerWaalsContact O-CG 3.28Å; L787-D791 PolarHBondContact O-N 3.14Å; V789-D791 PolarHBondContact O-N 2.89Å; D791-K795 WeakPolarHBondContact O-CG 3.22Å; D791-K795 PolarHBondContact O-N 3.1Å; D791-R823 VanDerWaalsContact CG-NH2 3.31Å; D791-R823 IonicContact OD1-CZ 2.85Å; D791-R823 IonicContact OD1-NH2 3.65Å; D791-R823 PolarHBondContact OD1-NH2 3.37Å; D791-R823 IonicContact OD2-NH2 3.53Å; D791-R823 PolarHBondContact OD2-NH2 2.99Å; D791-M827 WeakPolarHBondContact OD1-CE 3.31Å
792	T	85.7	Confident	82.2	Confident	34 Å²	34	49.6 Å²	49.6	21%	0.209	26%	0.262	C	S	.	.	H	α-helix	trans	-72.2	-48.2	171.3	54.5	0	0	0	0	112.3	F755 K788 V789 L790 S794 K795 F796	F755-T792 HydrophobicContact CE2-CG2 4.48Å; F755-T792 HydrophobicContact CZ-CG2 4.05Å; K788-T792 WeakPolarHBondContact O-CG2 3.32Å; K788-T792 PolarHBondContact O-N 3Å; K788-T792 VanDerWaalsContact O-N 3.17Å; K788-T792 PolarHBondContact O-OG1 3.11Å; V789-T792 WeakPolarHBondContact CA-OG1 3.45Å; V789-T792 PolarHBondContact O-N 3.24Å; V789-T792 VanDerWaalsContact O-N 3.13Å; V789-T792 PolarHBondContact O-OG1 2.9Å; L790-T792 VanDerWaalsContact C-N 3.29Å; L790-T792 PolarHBondContact O-N 3.12Å; T792-S794 VanDerWaalsContact C-N 3.3Å; T792-S794 PolarHBondContact O-N 2.86Å; T792-K795 WeakPolarHBondContact O-CB 3.39Å; T792-K795 PolarHBondContact O-N 3.27Å; T792-F796 WeakPolarHBondContact O-CD2 3.29Å; T792-F796 WeakPolarHBondContact O-CE2 3.03Å; T792-F796 WeakPolarHBondContact O-CG 3.23Å; T792-F796 PolarHBondContact O-N 3.15Å
793	L	84.8	Confident	82.1	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62.1	-38.1	178.4	-68.4	174	0	0	0	111.9	P774 L777 V789 L790 K795 F796 S797 A811 M812 V815	P774-L793 HydrophobicContact CB-CD2 3.82Å; L777-L793 HydrophobicContact CB-CD2 4.45Å; L777-L793 HydrophobicContact CD1-CD2 4.29Å; V789-L793 HydrophobicContact CG1-CD1 4.02Å; V789-L793 HydrophobicContact CG1-CG 4.34Å; V789-L793 WeakPolarHBondContact O-CG 3.41Å; V789-L793 PolarHBondContact O-N 3.08Å; L790-L793 PolarHBondContact O-N 3.41Å; L793-K795 PolarHBondContact O-N 2.83Å; L793-F796 PolarHBondContact O-N 2.79Å; L793-F796 VanDerWaalsContact O-N 3.16Å; L793-S797 PolarHBondContact O-N 2.79Å; L793-A811 HydrophobicContact CD1-CB 4.19Å; L793-A811 HydrophobicContact CD2-CB 3.92Å; L793-M812 HydrophobicContact CB-CG 3.59Å; L793-M812 HydrophobicContact CB-SD 4.23Å; L793-M812 HydrophobicContact CD1-CG 4.02Å; L793-M812 HydrophobicContact CG-CG 4.44Å; L793-V815 HydrophobicContact CD1-CG2 4.04Å
794	S	85.1	Confident	82.6	Confident	26 Å²	26	50.4 Å²	50.4	18%	0.182	27%	0.266	C	S	.	.	H	α-helix	trans	-65.3	-23.7	175.5	-178.2	0	0	0	0	113.4	L790 T792 S797 H798	L790-S794 VanDerWaalsContact O-CB 3.27Å; L790-S794 WeakPolarHBondContact O-CB 3.49Å; L790-S794 PolarHBondContact O-N 2.83Å; T792-S794 VanDerWaalsContact C-N 3.3Å; T792-S794 PolarHBondContact O-N 2.86Å; S794-S797 WeakPolarHBondContact CA-OG 3.5Å; S794-S797 PolarHBondContact O-OG 2.99Å; S794-H798 PolarHBondContact O-CD2 3.28Å; S794-H798 VanDerWaalsContact O-CD2 3.24Å
795	K	85.2	Confident	82.7	Confident	154 Å²	154	49 Å²	49	67%	0.67	26%	0.259	S	S	*	.	H	α-helix	trans	-78.2	-37.8	173.3	-71.7	170.5	-174.3	177	0	110.9	D791 T792 L793 H798	D791-K795 WeakPolarHBondContact O-CG 3.22Å; D791-K795 PolarHBondContact O-N 3.1Å; T792-K795 WeakPolarHBondContact O-CB 3.39Å; T792-K795 PolarHBondContact O-N 3.27Å; L793-K795 PolarHBondContact O-N 2.83Å; K795-H798 PolarHBondContact O-N 3.48Å
796	F	82.4	Confident	83	Confident	40 Å²	40	47.9 Å²	47.9	18%	0.175	25%	0.251	C	S	.	.	H	α-helix	trans	-72.5	-27.8	178.9	-55.3	-44.5	0	0	0	112.9	L762 T792 L793 H798 D799 S808	L762-F796 HydrophobicContact CD1-CE1 4.08Å; L762-F796 HydrophobicContact CD1-CE2 3.76Å; L762-F796 HydrophobicContact CD1-CZ 3.32Å; L762-F796 HydrophobicContact CD2-CE1 4.13Å; L762-F796 HydrophobicContact CD2-CE2 4.45Å; L762-F796 HydrophobicContact CD2-CZ 4.09Å; L762-F796 HydrophobicContact CG-CZ 4.27Å; T792-F796 WeakPolarHBondContact O-CD2 3.29Å; T792-F796 WeakPolarHBondContact O-CE2 3.03Å; T792-F796 WeakPolarHBondContact O-CG 3.23Å; T792-F796 PolarHBondContact O-N 3.15Å; L793-F796 PolarHBondContact O-N 2.79Å; L793-F796 VanDerWaalsContact O-N 3.16Å; F796-H798 PolarHBondContact O-N 3.42Å; F796-D799 WeakPolarHBondContact O-CB 3.47Å; F796-D799 PolarHBondContact O-N 3.19Å; F796-S808 WeakPolarHBondContact CB-OG 3.4Å
797	S	80.1	Confident	83.3	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-17.6	173.7	61.7	0	0	0	0	113.9	L793 S794 S805 L831 H835	L793-S797 PolarHBondContact O-N 2.79Å; S794-S797 WeakPolarHBondContact CA-OG 3.5Å; S794-S797 PolarHBondContact O-OG 2.99Å; S797-S805 PolarHBondContact O-OG 3.31Å; S797-L831 WeakPolarHBondContact OG-CD2 3.46Å; S797-H835 PolarHBondContact O-NE2 3.48Å
798	H	82.4	Confident	83.4	Confident	92 Å²	92	40.5 Å²	40.5	43%	0.426	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	3.5	175.1	-73.9	-62.5	0	0	0	113.9	S794 K795 F796 Y834	S794-H798 PolarHBondContact O-CD2 3.28Å; S794-H798 VanDerWaalsContact O-CD2 3.24Å; K795-H798 PolarHBondContact O-N 3.48Å; F796-H798 PolarHBondContact O-N 3.42Å; H798-Y834 AromaticContact ND1-CD1 3.83Å; H798-Y834 AromaticContact ND1-CE1 3.8Å
799	D	82	Confident	83.5	Confident	74 Å²	74	33 Å²	33	40%	0.396	18%	0.181	S	C	.	.	S	Bend	trans	-67.4	154.6	180	-151	-26.3	0	0	0	111.6	F796 D801 L804	F796-D799 WeakPolarHBondContact O-CB 3.47Å; F796-D799 PolarHBondContact O-N 3.19Å; D799-D801 VanDerWaalsContact C-N 3.29Å; D799-D801 PolarHBondContact O-N 3.18Å; D799-L804 HydrophobicContact CB-CD2 3.82Å; D799-L804 HydrophobicContact CB-CG 4.43Å; D799-L804 WeakPolarHBondContact OD2-CD2 3.43Å
800	S	76.8	Confident	83.6	Confident	121 Å²	121	33.2 Å²	33.2	85%	0.846	18%	0.182	S	C	*	.	S	Bend	trans	-67.1	-26.1	178.7	57.3	0	0	0	0	113.6	A802	S800-A802 PolarHBondContact O-N 2.99Å
801	D	81.4	Confident	83.6	Confident	25 Å²	25	33.2 Å²	33.2	13%	0.134	18%	0.182	C	C	.	.			trans	-80	117.7	177.6	-175.6	33.6	0	0	0	111.2	R771 D799 E803 L804 S805	R771-D801 IonicContact CZ-OD1 3.13Å; R771-D801 IonicContact CZ-OD2 2.78Å; R771-D801 IonicContact NE-OD1 2.68Å; R771-D801 IonicContact NE-OD2 3.8Å; R771-D801 PolarHBondContact NE-OD2 3.31Å; R771-D801 IonicContact NH2-OD1 3.57Å; R771-D801 PolarHBondContact NH2-OD1 3.44Å; R771-D801 IonicContact NH2-OD2 2.73Å; R771-D801 PolarHBondContact NH2-OD2 2.89Å; R771-D801 VanDerWaalsContact NH2-OD2 3.12Å; D799-D801 VanDerWaalsContact C-N 3.29Å; D799-D801 PolarHBondContact O-N 3.18Å; D801-E803 VanDerWaalsContact C-N 3.3Å; D801-E803 PolarHBondContact O-N 3.44Å; D801-L804 HydrophobicContact CB-CB 4.13Å; D801-L804 PolarHBondContact O-N 3.33Å; D801-S805 PolarHBondContact O-N 3.18Å
802	A	79.5	Confident	83.6	Confident	36 Å²	36	30.4 Å²	30.4	30%	0.298	17%	0.167	S	C	.	.	H	α-helix	trans	-61	-37.5	-175.4	0	0	0	0	0	112.7	S800 S805 H806	S800-A802 PolarHBondContact O-N 2.99Å; A802-S805 PolarHBondContact O-N 3.08Å; A802-H806 WeakPolarHBondContact O-CB 3.49Å; A802-H806 PolarHBondContact O-CD2 3.44Å; A802-H806 PolarHBondContact O-N 2.92Å; A802-H806 PolarHBondContact O-ND1 2.89Å; A802-H806 VanDerWaalsContact O-ND1 3.09Å
803	E	80.2	Confident	83.5	Confident	19 Å²	19	28.8 Å²	28.8	9%	0.089	16%	0.158	C	C	.	.	H	α-helix	trans	-70.4	-41	-179.5	-73.2	178.8	-146.2	0	0	112.4	R771 D801 S805 H806 N807 R890	R771-E803 VanDerWaalsContact CD-OE2 3.32Å; R771-E803 WeakPolarHBondContact CD-OE2 3.3Å; R771-E803 HydrophobicContact CG-CB 4.22Å; R771-E803 VanDerWaalsContact CZ-CD 3.43Å; R771-E803 IonicContact CZ-OE1 3.62Å; R771-E803 IonicContact CZ-OE2 3.68Å; R771-E803 IonicContact NE-OE2 3.64Å; R771-E803 PolarHBondContact NE-OE2 3.4Å; R771-E803 IonicContact NH1-OE1 2.75Å; R771-E803 PolarHBondContact NH1-OE1 2.99Å; R771-E803 IonicContact NH1-OE2 3.14Å; R771-E803 PolarHBondContact NH1-OE2 2.91Å; R771-E803 IonicContact NH2-OE1 3.44Å; R771-E803 IonicContact NH2-OE2 3.75Å; D801-E803 VanDerWaalsContact C-N 3.3Å; D801-E803 PolarHBondContact O-N 3.44Å; E803-S805 VanDerWaalsContact C-N 3.31Å; E803-S805 PolarHBondContact O-N 3.4Å; E803-H806 PolarHBondContact O-N 3.49Å; E803-N807 WeakPolarHBondContact O-CB 3.42Å; E803-N807 VanDerWaalsContact O-CG 3.3Å; E803-N807 PolarHBondContact O-N 3.27Å; E803-R890 HydrophobicContact CG-CG 4Å; E803-R890 WeakPolarHBondContact OE1-CD 3.45Å; E803-R890 IonicContact OE1-CZ 2.77Å; E803-R890 IonicContact OE1-NE 3.98Å; E803-R890 PolarHBondContact OE1-NE 3.49Å; E803-R890 IonicContact OE1-NH1 3.79Å; E803-R890 IonicContact OE1-NH2 2.76Å
804	L	84.8	Confident	83.6	Confident	6 Å²	6	28.8 Å²	28.8	3%	0.031	16%	0.158	C	C	.	.	H	α-helix	trans	-61.3	-42.1	173.3	-179.3	61.3	0	0	0	111.6	K770 R771 P774 D799 D801 S808	K770-L804 WeakPolarHBondContact O-CD1 2.98Å; R771-L804 HydrophobicContact CG-CB 4.44Å; P774-L804 HydrophobicContact CG-CD1 3.68Å; D799-L804 HydrophobicContact CB-CD2 3.82Å; D799-L804 HydrophobicContact CB-CG 4.43Å; D799-L804 WeakPolarHBondContact OD2-CD2 3.43Å; D801-L804 HydrophobicContact CB-CB 4.13Å; D801-L804 PolarHBondContact O-N 3.33Å; L804-S808 WeakPolarHBondContact O-CB 3.4Å; L804-S808 PolarHBondContact O-N 3.12Å; L804-S808 PolarHBondContact O-OG 2.85Å
805	S	83.8	Confident	83.6	Confident	2 Å²	2	27.6 Å²	27.6	1%	0.014	15%	0.149	C	C	.	.	H	α-helix	trans	-59.8	-50.2	173.9	170.2	0	0	0	0	111.5	S797 D801 A802 E803 N807 S808 I809 N841	S797-S805 PolarHBondContact O-OG 3.31Å; D801-S805 PolarHBondContact O-N 3.18Å; A802-S805 PolarHBondContact O-N 3.08Å; E803-S805 VanDerWaalsContact C-N 3.31Å; E803-S805 PolarHBondContact O-N 3.4Å; S805-N807 PolarHBondContact O-N 3.21Å; S805-S808 PolarHBondContact O-N 3.43Å; S805-I809 WeakPolarHBondContact O-CD1 3.39Å; S805-I809 VanDerWaalsContact O-CG1 3.29Å; S805-I809 WeakPolarHBondContact O-CG1 3.46Å; S805-I809 PolarHBondContact O-N 3.08Å; S805-N841 PolarHBondContact OG-OD1 3.44Å
806	H	84.2	Confident	83.4	Confident	5 Å²	5	20.2 Å²	20.2	2%	0.023	12%	0.117	C	C	.	.	H	α-helix	trans	-56.6	-48.3	178.3	-65.7	152	0	0	0	112.4	A802 E803 S808 I809 I810 N841 L844 M889 M894	A802-H806 WeakPolarHBondContact O-CB 3.49Å; A802-H806 PolarHBondContact O-CD2 3.44Å; A802-H806 PolarHBondContact O-N 2.92Å; A802-H806 PolarHBondContact O-ND1 2.89Å; A802-H806 VanDerWaalsContact O-ND1 3.09Å; E803-H806 PolarHBondContact O-N 3.49Å; H806-S808 VanDerWaalsContact C-N 3.32Å; H806-S808 PolarHBondContact O-N 3.3Å; H806-I809 PolarHBondContact O-N 3.03Å; H806-I810 PolarHBondContact O-N 3.39Å; H806-I810 VanDerWaalsContact O-N 3.12Å; H806-N841 PolarHBondContact CD2-OD1 3.06Å; H806-N841 PolarHBondContact NE2-OD1 3.42Å; H806-L844 HydrophobicContact CB-CD1 3.4Å; H806-M889 HydrophobicContact CB-CG 3.79Å; H806-M894 VanDerWaalsContact CE1-SD 3.52Å
807	N	85.4	Confident	83.4	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-64.9	-38.4	-179.7	-71.7	-4.1	0	0	0	111.5	R771 L775 E803 S805 A811 C886 M889	R771-N807 PolarHBondContact O-ND2 3.19Å; L775-N807 HydrophobicContact CD1-CB 4.46Å; L775-N807 HydrophobicContact CD2-CB 4.05Å; L775-N807 HydrophobicContact CG-CB 4.06Å; E803-N807 WeakPolarHBondContact O-CB 3.42Å; E803-N807 VanDerWaalsContact O-CG 3.3Å; E803-N807 PolarHBondContact O-N 3.27Å; S805-N807 PolarHBondContact O-N 3.21Å; N807-A811 WeakPolarHBondContact O-CB 3.29Å; N807-A811 PolarHBondContact O-N 3.37Å; N807-C886 PolarHBondContact OD1-O 3.32Å; N807-M889 WeakPolarHBondContact OD1-CE 3.36Å
808	S	86.2	Confident	83.3	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-66.8	-38.9	177.3	-57.8	0	0	0	0	112.5	P774 F796 L804 S805 H806 A811 M812	P774-S808 WeakPolarHBondContact CG-OG 3.28Å; F796-S808 WeakPolarHBondContact CB-OG 3.4Å; L804-S808 WeakPolarHBondContact O-CB 3.4Å; L804-S808 PolarHBondContact O-N 3.12Å; L804-S808 PolarHBondContact O-OG 2.85Å; S805-S808 PolarHBondContact O-N 3.43Å; H806-S808 VanDerWaalsContact C-N 3.32Å; H806-S808 PolarHBondContact O-N 3.3Å; S808-A811 WeakPolarHBondContact O-CB 3.21Å; S808-A811 PolarHBondContact O-N 2.88Å; S808-M812 WeakPolarHBondContact O-CG 3.38Å; S808-M812 PolarHBondContact O-N 3.36Å
809	I	87.6	Confident	83	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-66.1	-46.3	177.9	-68.7	160.3	0	0	0	111	S805 H806 A811 M812 G813 L844 V845 A848	S805-I809 WeakPolarHBondContact O-CD1 3.39Å; S805-I809 VanDerWaalsContact O-CG1 3.29Å; S805-I809 WeakPolarHBondContact O-CG1 3.46Å; S805-I809 PolarHBondContact O-N 3.08Å; H806-I809 PolarHBondContact O-N 3.03Å; I809-A811 VanDerWaalsContact C-N 3.35Å; I809-M812 WeakPolarHBondContact O-CB 3.38Å; I809-M812 PolarHBondContact O-N 3.19Å; I809-G813 PolarHBondContact O-N 3.39Å; I809-G813 VanDerWaalsContact O-N 3.15Å; I809-L844 HydrophobicContact CG2-CB 3.98Å; I809-V845 HydrophobicContact CD1-CG2 3.87Å; I809-V845 HydrophobicContact CG1-CG2 4.2Å; I809-V845 HydrophobicContact CG2-CB 4.23Å; I809-V845 HydrophobicContact CG2-CG2 3.67Å; I809-A848 HydrophobicContact CG2-CB 4.19Å; I809-A848 WeakPolarHBondContact O-CB 3.12Å
810	I	85.7	Confident	82.7	Confident	5 Å²	5	15.9 Å²	15.9	3%	0.026	10%	0.1	C	C	.	.	H	α-helix	trans	-65	-42.1	176.3	-69.1	168.9	0	0	0	110.7	H806 M812 G813 I814 L844 M889	H806-I810 PolarHBondContact O-N 3.39Å; H806-I810 VanDerWaalsContact O-N 3.12Å; I810-M812 VanDerWaalsContact C-N 3.3Å; I810-M812 PolarHBondContact O-N 3.36Å; I810-G813 WeakPolarHBondContact O-CA 3.35Å; I810-G813 PolarHBondContact O-N 2.92Å; I810-I814 HydrophobicContact CG2-CD1 3.85Å; I810-I814 HydrophobicContact CG2-CG1 4.33Å; I810-I814 PolarHBondContact O-N 3.09Å; I810-L844 HydrophobicContact CD1-CD1 4.03Å; I810-L844 HydrophobicContact CD1-CD2 3.41Å; I810-L844 VanDerWaalsContact CD1-CD2 3.41Å; I810-L844 HydrophobicContact CD1-CG 4.26Å; I810-L844 HydrophobicContact CG1-CB 4.37Å; I810-L844 HydrophobicContact CG1-CD1 4.34Å; I810-L844 HydrophobicContact CG1-CD2 3.76Å; I810-L844 HydrophobicContact CG1-CG 4.38Å; I810-M889 HydrophobicContact CD1-CE 3.19Å; I810-M889 HydrophobicContact CD1-SD 3.64Å
811	A	86.6	Confident	83	Confident	0 Å²	0	12 Å²	12	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-55.4	-44.7	175.1	0	0	0	0	0	111.9	P774 A778 L793 N807 S808 I809 G813 I814 V815	P774-A811 HydrophobicContact CB-CB 4.16Å; P774-A811 WeakPolarHBondContact O-CB 3.42Å; A778-A811 HydrophobicContact CB-CB 3.7Å; L793-A811 HydrophobicContact CD1-CB 4.19Å; L793-A811 HydrophobicContact CD2-CB 3.92Å; N807-A811 WeakPolarHBondContact O-CB 3.29Å; N807-A811 PolarHBondContact O-N 3.37Å; S808-A811 WeakPolarHBondContact O-CB 3.21Å; S808-A811 PolarHBondContact O-N 2.88Å; I809-A811 VanDerWaalsContact C-N 3.35Å; A811-G813 VanDerWaalsContact C-N 3.29Å; A811-G813 PolarHBondContact O-N 3.47Å; A811-I814 PolarHBondContact O-N 2.86Å; A811-V815 VanDerWaalsContact O-CG2 3.29Å; A811-V815 WeakPolarHBondContact O-CG2 3.11Å; A811-V815 PolarHBondContact O-N 2.88Å
812	M	85.4	Confident	82.9	Confident	0 Å²	0	14.4 Å²	14.4	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-59.9	-39.1	174	-74.5	178.1	69.5	0	0	112.4	L793 S808 I809 I810 G816 L824 M827 L828 L831	L793-M812 HydrophobicContact CB-CG 3.59Å; L793-M812 HydrophobicContact CB-SD 4.23Å; L793-M812 HydrophobicContact CD1-CG 4.02Å; L793-M812 HydrophobicContact CG-CG 4.44Å; S808-M812 WeakPolarHBondContact O-CG 3.38Å; S808-M812 PolarHBondContact O-N 3.36Å; I809-M812 WeakPolarHBondContact O-CB 3.38Å; I809-M812 PolarHBondContact O-N 3.19Å; I810-M812 VanDerWaalsContact C-N 3.3Å; I810-M812 PolarHBondContact O-N 3.36Å; M812-G816 PolarHBondContact O-N 3.21Å; M812-G816 VanDerWaalsContact O-N 3.09Å; M812-L824 HydrophobicContact CB-CD1 4.26Å; M812-L824 HydrophobicContact CE-CD1 3.55Å; M812-M827 HydrophobicContact CE-CB 4.04Å; M812-M827 HydrophobicContact CE-SD 4.45Å; M812-L828 HydrophobicContact CB-CD2 4.46Å; M812-L828 HydrophobicContact CE-CD2 4.36Å; M812-L831 HydrophobicContact CE-CD1 4.07Å; M812-L831 HydrophobicContact SD-CD1 3.93Å
813	G	84.1	Confident	83.1	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-62.6	-43.8	175.2	0	0	0	0	0	113.3	I809 I810 A811 G816 A817	I809-G813 PolarHBondContact O-N 3.39Å; I809-G813 VanDerWaalsContact O-N 3.15Å; I810-G813 WeakPolarHBondContact O-CA 3.35Å; I810-G813 PolarHBondContact O-N 2.92Å; A811-G813 VanDerWaalsContact C-N 3.29Å; A811-G813 PolarHBondContact O-N 3.47Å; G813-G816 PolarHBondContact O-N 3.47Å; G813-A817 PolarHBondContact O-N 2.88Å
814	I	86.2	Confident	83.2	Confident	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-70.4	-43.1	-180	-64.5	170.9	0	0	0	111.5	A778 V782 S783 I810 A811 G816 A817 L851 L882 L883	A778-I814 HydrophobicContact CB-CB 4.25Å; A778-I814 HydrophobicContact CB-CG2 4.29Å; V782-I814 HydrophobicContact CG1-CG2 4.3Å; V782-I814 HydrophobicContact CG2-CG2 4.15Å; S783-I814 PolarHBondContact N-O 3.34Å; I810-I814 HydrophobicContact CG2-CD1 3.85Å; I810-I814 HydrophobicContact CG2-CG1 4.33Å; I810-I814 PolarHBondContact O-N 3.09Å; A811-I814 PolarHBondContact O-N 2.86Å; I814-G816 VanDerWaalsContact C-N 3.25Å; I814-G816 PolarHBondContact O-N 3.24Å; I814-A817 WeakPolarHBondContact O-CB 3.24Å; I814-A817 PolarHBondContact O-N 3.35Å; I814-L851 HydrophobicContact CG1-CD1 4.42Å; I814-L882 HydrophobicContact CD1-CD2 4.17Å; I814-L883 HydrophobicContact CD1-CD2 3.85Å
815	V	85.6	Confident	83	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-61.7	-37.6	176.4	171.6	0	0	0	0	111.1	A778 Y781 S783 N784 L790 L793 A811	A778-V815 HydrophobicContact CB-CG2 4.21Å; Y781-V815 WeakPolarHBondContact O-CA 3.33Å; S783-V815 CarbonylContact C-O 3.54Å; S783-V815 VanDerWaalsContact CA-O 3.27Å; S783-V815 WeakPolarHBondContact CA-O 3.36Å; S783-V815 PolarHBondContact N-O 3.06Å; N784-V815 PolarHBondContact N-O 2.98Å; N784-V815 WeakPolarHBondContact O-CG1 2.98Å; L790-V815 HydrophobicContact CD2-CB 4.44Å; L790-V815 HydrophobicContact CD2-CG1 3.84Å; L793-V815 HydrophobicContact CD1-CG2 4.04Å; A811-V815 VanDerWaalsContact O-CG2 3.29Å; A811-V815 WeakPolarHBondContact O-CG2 3.11Å; A811-V815 PolarHBondContact O-N 2.88Å
816	G	81.8	Confident	83	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-2.9	178.9	0	0	0	0	0	116	M812 G813 I814 G818 T819	M812-G816 PolarHBondContact O-N 3.21Å; M812-G816 VanDerWaalsContact O-N 3.09Å; G813-G816 PolarHBondContact O-N 3.47Å; I814-G816 VanDerWaalsContact C-N 3.25Å; I814-G816 PolarHBondContact O-N 3.24Å; G816-G818 PolarHBondContact O-N 3.07Å; G816-T819 PolarHBondContact O-N 3.35Å; G816-T819 PolarHBondContact O-OG1 3.49Å
817	A	82.4	Confident	82.9	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	126	-167.7	0	0	0	0	0	111.4	S783 G813 I814 T819 L851 L861	S783-A817 PolarHBondContact OG-O 2.89Å; G813-A817 PolarHBondContact O-N 2.88Å; I814-A817 WeakPolarHBondContact O-CB 3.24Å; I814-A817 PolarHBondContact O-N 3.35Å; A817-T819 PolarHBondContact O-N 3.35Å; A817-L851 VanDerWaalsContact CA-O 3.31Å; A817-L851 WeakPolarHBondContact CA-O 3.37Å; A817-L861 HydrophobicContact CB-CB 4.29Å; A817-L861 HydrophobicContact CB-CD1 3.5Å; A817-L861 VanDerWaalsContact CB-CD1 3.5Å; A817-L861 HydrophobicContact CB-CG 3.84Å
818	G	76.9	Confident	82.8	Confident	1 Å²	1	19.4 Å²	19.4	1%	0.01	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.7	-2.5	175.2	0	0	0	0	0	117.4	G816 L851 G857 L859	G816-G818 PolarHBondContact O-N 3.07Å; G818-L851 PolarHBondContact N-O 3.35Å; G818-L851 VanDerWaalsContact N-O 3.14Å; G818-G857 CarbonylContact O-C 3.59Å; G818-G857 WeakPolarHBondContact O-CA 3.47Å; G818-L859 WeakPolarHBondContact CA-O 3.4Å
819	T	75.6	Confident	82.6	Confident	34 Å²	34	22.1 Å²	22.1	21%	0.209	13%	0.125	C	C	.	.	S	Bend	trans	-90.9	-10.3	-174.7	61.8	0	0	0	0	113.7	S783 P785 G816 A817 N821	S783-T819 WeakPolarHBondContact O-CG2 3.42Å; P785-T819 HydrophobicContact CG-CG2 4.13Å; G816-T819 PolarHBondContact O-N 3.35Å; G816-T819 PolarHBondContact O-OG1 3.49Å; A817-T819 PolarHBondContact O-N 3.35Å; T819-N821 PolarHBondContact O-N 3.13Å; T819-N821 VanDerWaalsContact O-N 3.09Å
820	N	77.5	Confident	82.4	Confident	79 Å²	79	28.8 Å²	28.8	42%	0.422	16%	0.155	S	C	.	.			trans	45.9	40.8	-177.6	-167.4	15.5	0	0	0	113.3	A822 T852 H853	N820-A822 PolarHBondContact O-N 2.91Å; N820-T852 PolarHBondContact N-O 3.33Å; N820-H853 PolarHBondContact OD1-CE1 2.98Å; N820-H853 PolarHBondContact OD1-ND1 3.29Å; N820-H853 VanDerWaalsContact OD1-ND1 3.1Å
821	N	81.2	Confident	82.2	Confident	40 Å²	40	28.6 Å²	28.6	21%	0.214	16%	0.155	C	C	.	.			trans	-73	114.6	-177.5	-173.6	-15.3	0	0	0	111	P785 T819 R823 L824 A825	P785-N821 HydrophobicContact CG-CB 4.43Å; T819-N821 PolarHBondContact O-N 3.13Å; T819-N821 VanDerWaalsContact O-N 3.09Å; N821-R823 VanDerWaalsContact C-N 3.25Å; N821-R823 PolarHBondContact O-N 3.12Å; N821-R823 PolarHBondContact OD1-N 2.92Å; N821-L824 HydrophobicContact CB-CB 4.17Å; N821-L824 PolarHBondContact O-N 3.29Å; N821-L824 VanDerWaalsContact O-N 3.17Å; N821-A825 PolarHBondContact O-N 3.27Å
822	A	81.2	Confident	81.7	Confident	76 Å²	76	29 Å²	29	63%	0.628	16%	0.157	S	C	*	.	H	α-helix	trans	-58	-33.6	-178.7	0	0	0	0	0	113.8	N820 A826	N820-A822 PolarHBondContact O-N 2.91Å; A822-A826 WeakPolarHBondContact O-CB 3.39Å; A822-A826 PolarHBondContact O-N 3.44Å
823	R	82.2	Confident	81.4	Confident	103 Å²	103	33.2 Å²	33.2	39%	0.389	18%	0.183	S	C	.	.	H	α-helix	trans	-69.4	-43.5	178.6	-177.9	173.2	170.8	174.6	-7.1	111.2	D791 N821 A826 M827	D791-R823 VanDerWaalsContact CG-NH2 3.31Å; D791-R823 IonicContact OD1-CZ 2.85Å; D791-R823 IonicContact OD1-NH2 3.65Å; D791-R823 PolarHBondContact OD1-NH2 3.37Å; D791-R823 IonicContact OD2-NH2 3.53Å; D791-R823 PolarHBondContact OD2-NH2 2.99Å; N821-R823 VanDerWaalsContact C-N 3.25Å; N821-R823 PolarHBondContact O-N 3.12Å; N821-R823 PolarHBondContact OD1-N 2.92Å; R823-A826 WeakPolarHBondContact O-CB 3.45Å; R823-A826 PolarHBondContact O-N 3.31Å; R823-M827 HydrophobicContact CG-CE 4.16Å; R823-M827 HydrophobicContact CG-SD 4.43Å; R823-M827 WeakPolarHBondContact O-CG 3.29Å; R823-M827 PolarHBondContact O-N 3.48Å
824	L	82.3	Confident	81.2	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-64.9	-43.3	176.9	-175.9	64.1	0	0	0	111.4	L790 M812 N821 A826 M827 L828 T852	L790-L824 HydrophobicContact CD1-CB 4.46Å; L790-L824 HydrophobicContact CD1-CD1 4.31Å; L790-L824 HydrophobicContact CD2-CD1 3.67Å; M812-L824 HydrophobicContact CB-CD1 4.26Å; M812-L824 HydrophobicContact CE-CD1 3.55Å; N821-L824 HydrophobicContact CB-CB 4.17Å; N821-L824 PolarHBondContact O-N 3.29Å; N821-L824 VanDerWaalsContact O-N 3.17Å; L824-A826 PolarHBondContact O-N 3.35Å; L824-M827 PolarHBondContact O-N 3.16Å; L824-M827 VanDerWaalsContact O-N 3.13Å; L824-L828 HydrophobicContact CG-CD1 4.26Å; L824-L828 WeakPolarHBondContact O-CG 3.39Å; L824-L828 PolarHBondContact O-N 3.25Å; L824-T852 HydrophobicContact CD2-CG2 3.41Å; L824-T852 VanDerWaalsContact CD2-CG2 3.41Å; L824-T852 HydrophobicContact CG-CG2 4.03Å
825	A	80.4	Confident	80.6	Confident	16 Å²	16	40.8 Å²	40.8	13%	0.132	21%	0.213	C	C	.	.	H	α-helix	trans	-61.6	-32.5	174.6	0	0	0	0	0	112.4	N821 R829	N821-A825 PolarHBondContact O-N 3.27Å; A825-R829 VanDerWaalsContact O-CG 3.31Å; A825-R829 WeakPolarHBondContact O-CG 3.34Å; A825-R829 PolarHBondContact O-N 3.32Å; A825-R829 PolarHBondContact O-NE 3.22Å; A825-R829 VanDerWaalsContact O-NE 3.15Å
826	A	84	Confident	79.7	Confident	31 Å²	31	43 Å²	43	26%	0.256	23%	0.229	S	C	.	.	H	α-helix	trans	-69.9	-42.7	172	0	0	0	0	0	112.4	A822 R823 L824 R829 Q830	A822-A826 WeakPolarHBondContact O-CB 3.39Å; A822-A826 PolarHBondContact O-N 3.44Å; R823-A826 WeakPolarHBondContact O-CB 3.45Å; R823-A826 PolarHBondContact O-N 3.31Å; L824-A826 PolarHBondContact O-N 3.35Å; A826-R829 PolarHBondContact O-N 3.09Å; A826-Q830 WeakPolarHBondContact O-CG 3.5Å; A826-Q830 PolarHBondContact O-N 2.85Å; A826-Q830 VanDerWaalsContact O-N 3.09Å
827	M	83.5	Confident	79	Confident	23 Å²	23	53.1 Å²	53.1	11%	0.113	27%	0.267	C	S	.	.	H	α-helix	trans	-62.3	-46.2	176.3	-71.4	170.2	165.2	0	0	111.9	D791 M812 R823 L824 R829 Q830 L831	D791-M827 WeakPolarHBondContact OD1-CE 3.31Å; M812-M827 HydrophobicContact CE-CB 4.04Å; M812-M827 HydrophobicContact CE-SD 4.45Å; R823-M827 HydrophobicContact CG-CE 4.16Å; R823-M827 HydrophobicContact CG-SD 4.43Å; R823-M827 WeakPolarHBondContact O-CG 3.29Å; R823-M827 PolarHBondContact O-N 3.48Å; L824-M827 PolarHBondContact O-N 3.16Å; L824-M827 VanDerWaalsContact O-N 3.13Å; M827-R829 VanDerWaalsContact C-N 3.31Å; M827-R829 PolarHBondContact O-N 3.48Å; M827-Q830 WeakPolarHBondContact O-CB 3.44Å; M827-Q830 PolarHBondContact O-N 3.32Å; M827-Q830 VanDerWaalsContact O-N 3.12Å; M827-L831 WeakPolarHBondContact O-CG 3.41Å; M827-L831 PolarHBondContact O-N 3.47Å
828	L	82.7	Confident	78.6	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-62.5	-36.7	177.8	-70.6	174.2	0	0	0	112.3	M812 L824 L831 A832 V845 A848 Q849 T852	M812-L828 HydrophobicContact CB-CD2 4.46Å; M812-L828 HydrophobicContact CE-CD2 4.36Å; L824-L828 HydrophobicContact CG-CD1 4.26Å; L824-L828 WeakPolarHBondContact O-CG 3.39Å; L824-L828 PolarHBondContact O-N 3.25Å; L828-L831 HydrophobicContact CD2-CD1 4.43Å; L828-L831 PolarHBondContact O-N 3.45Å; L828-A832 WeakPolarHBondContact O-CB 3.31Å; L828-A832 PolarHBondContact O-N 3.44Å; L828-V845 HydrophobicContact CB-CG1 4.48Å; L828-V845 WeakPolarHBondContact O-CG1 3.28Å; L828-A848 HydrophobicContact CD1-CB 4.19Å; L828-A848 HydrophobicContact CD2-CB 3.97Å; L828-Q849 HydrophobicContact CB-CG 3.81Å; L828-Q849 HydrophobicContact CD1-CG 3.93Å; L828-Q849 HydrophobicContact CG-CG 4.48Å; L828-T852 HydrophobicContact CD1-CG2 3.7Å
829	R	81.4	Confident	78.5	Confident	57 Å²	57	58.6 Å²	58.6	22%	0.215	30%	0.299	C	S	.	.	H	α-helix	trans	-64.5	-40.2	172.8	-76.1	-178.7	-65.9	147.4	-0.6	112.2	A825 A826 M827 A832 V833	A825-R829 VanDerWaalsContact O-CG 3.31Å; A825-R829 WeakPolarHBondContact O-CG 3.34Å; A825-R829 PolarHBondContact O-N 3.32Å; A825-R829 PolarHBondContact O-NE 3.22Å; A825-R829 VanDerWaalsContact O-NE 3.15Å; A826-R829 PolarHBondContact O-N 3.09Å; M827-R829 VanDerWaalsContact C-N 3.31Å; M827-R829 PolarHBondContact O-N 3.48Å; R829-A832 PolarHBondContact O-N 2.83Å; R829-V833 WeakPolarHBondContact O-CG2 3.48Å; R829-V833 PolarHBondContact O-N 2.78Å
830	Q	83.5	Confident	78.5	Confident	139 Å²	139	60.4 Å²	60.4	65%	0.65	30%	0.302	S	S	*	.	H	α-helix	trans	-64.8	-40.4	175	-69.9	174.6	-1.4	0	0	111.8	A826 M827 V833 Y834	A826-Q830 WeakPolarHBondContact O-CG 3.5Å; A826-Q830 PolarHBondContact O-N 2.85Å; A826-Q830 VanDerWaalsContact O-N 3.09Å; M827-Q830 WeakPolarHBondContact O-CB 3.44Å; M827-Q830 PolarHBondContact O-N 3.32Å; M827-Q830 VanDerWaalsContact O-N 3.12Å; Q830-V833 PolarHBondContact O-N 2.91Å; Q830-Y834 PolarHBondContact O-N 3.26Å; Q830-Y834 VanDerWaalsContact O-N 3.09Å
831	L	81.1	Confident	78.5	Confident	2 Å²	2	56.9 Å²	56.9	1%	0.01	28%	0.283	C	S	.	.	H	α-helix	trans	-65.3	-38.3	175	-69.8	170	0	0	0	112.2	S797 M812 M827 L828 V833 Y834 H835 V845	S797-L831 WeakPolarHBondContact OG-CD2 3.46Å; M812-L831 HydrophobicContact CE-CD1 4.07Å; M812-L831 HydrophobicContact SD-CD1 3.93Å; M827-L831 WeakPolarHBondContact O-CG 3.41Å; M827-L831 PolarHBondContact O-N 3.47Å; L828-L831 HydrophobicContact CD2-CD1 4.43Å; L828-L831 PolarHBondContact O-N 3.45Å; L831-V833 VanDerWaalsContact C-N 3.31Å; L831-V833 PolarHBondContact O-N 2.98Å; L831-Y834 PolarHBondContact O-N 3.39Å; L831-H835 PolarHBondContact O-CD2 3.13Å; L831-H835 PolarHBondContact O-N 2.7Å; L831-V845 HydrophobicContact CB-CG2 4.33Å
832	A	76.8	Confident	78.4	Confident	7 Å²	7	55.7 Å²	55.7	6%	0.058	28%	0.277	C	S	.	.	H	α-helix	trans	-59.5	-41.7	174.9	0	0	0	0	0	111.9	L828 R829 S836 L842 V845	L828-A832 WeakPolarHBondContact O-CB 3.31Å; L828-A832 PolarHBondContact O-N 3.44Å; R829-A832 PolarHBondContact O-N 2.83Å; A832-S836 PolarHBondContact O-N 2.96Å; A832-L842 HydrophobicContact CB-CD1 4.45Å; A832-V845 HydrophobicContact CB-CG1 3.82Å
833	V	79.2	Confident	78.3	Confident	90 Å²	90	52.8 Å²	52.8	55%	0.545	25%	0.25	S	C	.	.	H	α-helix	trans	-65.6	-43.1	176.4	175.2	0	0	0	0	111.1	R829 Q830 L831 S836	R829-V833 WeakPolarHBondContact O-CG2 3.48Å; R829-V833 PolarHBondContact O-N 2.78Å; Q830-V833 PolarHBondContact O-N 2.91Å; L831-V833 VanDerWaalsContact C-N 3.31Å; L831-V833 PolarHBondContact O-N 2.98Å; V833-S836 WeakPolarHBondContact O-CB 3.37Å; V833-S836 PolarHBondContact O-OG 3Å
834	Y	79.1	Confident	78.2	Confident	145 Å²	145	48.1 Å²	48.1	57%	0.569	23%	0.233	S	C	*	.	H	α-helix	trans	-65.6	-47.3	-179.5	-173.9	-100.8	0	0	0	112.4	H798 Q830 L831 S836	H798-Y834 AromaticContact ND1-CD1 3.83Å; H798-Y834 AromaticContact ND1-CE1 3.8Å; Q830-Y834 PolarHBondContact O-N 3.26Å; Q830-Y834 VanDerWaalsContact O-N 3.09Å; L831-Y834 PolarHBondContact O-N 3.39Å; Y834-S836 VanDerWaalsContact C-N 3.28Å; Y834-S836 PolarHBondContact O-N 3.36Å
835	H	73.8	Confident	78.3	Confident	13 Å²	13	48.1 Å²	48.1	6%	0.06	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	17.7	-178.6	-68.2	-76.9	0	0	0	114.3	S797 L831 R837 D838 N841	S797-H835 PolarHBondContact O-NE2 3.48Å; L831-H835 PolarHBondContact O-CD2 3.13Å; L831-H835 PolarHBondContact O-N 2.7Å; H835-R837 PolarHBondContact O-N 2.92Å; H835-D838 PolarHBondContact O-N 3.4Å; H835-N841 HydrophobicContact CB-CB 3.59Å; H835-N841 PolarHBondContact ND1-ND2 3.05Å
836	S	66.1	Low	78.4	Confident	48 Å²	48	49.5 Å²	49.5	34%	0.336	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-19.3	178.8	54.7	0	0	0	0	114.5	A832 V833 Y834	A832-S836 PolarHBondContact O-N 2.96Å; V833-S836 WeakPolarHBondContact O-CB 3.37Å; V833-S836 PolarHBondContact O-OG 3Å; Y834-S836 VanDerWaalsContact C-N 3.28Å; Y834-S836 PolarHBondContact O-N 3.36Å
837	R	68.2	Low	78.2	Confident	211 Å²	211	48.4 Å²	48.4	80%	0.796	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-26.9	176.9	-64.9	-176.2	177.7	-176.9	-0.9	113.8	H835	H835-R837 PolarHBondContact O-N 2.92Å
838	D	74.6	Confident	78.3	Confident	76 Å²	76	47.3 Å²	47.3	41%	0.406	22%	0.219	S	C	.	.			trans	-106.3	112.5	-173.8	-68	-28.5	0	0	0	110.8	H835 Y840 N841 L842	H835-D838 PolarHBondContact O-N 3.4Å; D838-Y840 PolarHBondContact O-N 3.12Å; D838-N841 HydrophobicContact CB-CB 3.98Å; D838-N841 WeakPolarHBondContact CB-ND2 3.48Å; D838-N841 PolarHBondContact O-N 3.41Å; D838-N841 PolarHBondContact OD2-ND2 3.1Å; D838-L842 WeakPolarHBondContact O-CB 3.28Å; D838-L842 PolarHBondContact O-N 3.2Å
839	P	73.2	Confident	78.3	Confident	40 Å²	40	47.6 Å²	47.6	26%	0.26	22%	0.22	S	C	.	.	H	α-helix	trans	-64.7	-26.8	-176.3	25.1	-33.8	0	0	0	113.1	F843	P839-F843 WeakPolarHBondContact O-CB 3.34Å; P839-F843 PolarHBondContact O-N 3.21Å
840	Y	75.8	Confident	78.3	Confident	72 Å²	72	44.9 Å²	44.9	28%	0.282	21%	0.21	S	C	.	.	H	α-helix	trans	-75.1	-49.5	179.7	-62.9	-75.4	0	0	0	112.6	R373 D838 L842 F843 L844 M894	R373-Y840 VanDerWaalsContact CZ-CZ 3.42Å; R373-Y840 PolarHBondContact NH1-OH 3.47Å; R373-Y840 VanDerWaalsContact NH1-OH 3.09Å; R373-Y840 PolarHBondContact NH2-OH 2.85Å; D838-Y840 PolarHBondContact O-N 3.12Å; Y840-L842 VanDerWaalsContact C-N 3.26Å; Y840-L842 PolarHBondContact O-N 2.88Å; Y840-F843 WeakPolarHBondContact O-CB 3.19Å; Y840-F843 PolarHBondContact O-N 2.91Å; Y840-L844 WeakPolarHBondContact O-CG 3.42Å; Y840-L844 PolarHBondContact O-N 3.24Å; Y840-L844 VanDerWaalsContact O-N 3.07Å; Y840-M894 HydrophobicContact CD1-CB 3.79Å; Y840-M894 HydrophobicContact CD1-CE 3.73Å; Y840-M894 HydrophobicContact CD1-CG 3.51Å; Y840-M894 HydrophobicContact CD1-SD 4.2Å; Y840-M894 HydrophobicContact CD2-CE 3.63Å; Y840-M894 HydrophobicContact CE1-CB 3.5Å; Y840-M894 HydrophobicContact CE1-CE 3.72Å; Y840-M894 HydrophobicContact CE1-CG 3.79Å; Y840-M894 HydrophobicContact CE2-CE 3.7Å; Y840-M894 HydrophobicContact CG-CE 3.62Å; Y840-M894 HydrophobicContact CG-CG 4.15Å; Y840-M894 HydrophobicContact CG-SD 4.28Å
841	N	78.3	Confident	78.2	Confident	6 Å²	6	38.4 Å²	38.4	3%	0.032	18%	0.18	C	C	.	.	H	α-helix	trans	-57.6	-43.4	172.6	-77.9	-52.3	0	0	0	110.2	S805 H806 H835 D838 F843 L844 V845	S805-N841 PolarHBondContact OG-OD1 3.44Å; H806-N841 PolarHBondContact CD2-OD1 3.06Å; H806-N841 PolarHBondContact NE2-OD1 3.42Å; H835-N841 HydrophobicContact CB-CB 3.59Å; H835-N841 PolarHBondContact ND1-ND2 3.05Å; D838-N841 HydrophobicContact CB-CB 3.98Å; D838-N841 WeakPolarHBondContact CB-ND2 3.48Å; D838-N841 PolarHBondContact O-N 3.41Å; D838-N841 PolarHBondContact OD2-ND2 3.1Å; N841-F843 PolarHBondContact O-N 3.29Å; N841-L844 PolarHBondContact O-N 2.88Å; N841-V845 VanDerWaalsContact O-CG2 3.29Å; N841-V845 WeakPolarHBondContact O-CG2 3.21Å; N841-V845 PolarHBondContact O-N 3.35Å
842	L	78.7	Confident	78.3	Confident	14 Å²	14	38.4 Å²	38.4	7%	0.073	18%	0.18	C	C	.	.	H	α-helix	trans	-63	-40.3	178.6	-173	65.7	0	0	0	112.7	L369 A832 D838 Y840 V845 R846	L369-L842 HydrophobicContact CD2-CD2 3.64Å; A832-L842 HydrophobicContact CB-CD1 4.45Å; D838-L842 WeakPolarHBondContact O-CB 3.28Å; D838-L842 PolarHBondContact O-N 3.2Å; Y840-L842 VanDerWaalsContact C-N 3.26Å; Y840-L842 PolarHBondContact O-N 2.88Å; L842-V845 PolarHBondContact O-N 3.23Å; L842-R846 VanDerWaalsContact O-CG 3.31Å; L842-R846 WeakPolarHBondContact O-CG 3.12Å; L842-R846 PolarHBondContact O-N 3.44Å; L842-R846 VanDerWaalsContact O-N 3.12Å
843	F	78.6	Confident	78.5	Confident	15 Å²	15	39.5 Å²	39.5	7%	0.066	18%	0.184	C	C	.	.	H	α-helix	trans	-58.1	-47.9	173.6	172.6	-101.6	0	0	0	111.2	L376 A377 Y380 P839 Y840 N841 R846 L847	L376-F843 HydrophobicContact CD2-CD2 4.08Å; L376-F843 HydrophobicContact CD2-CE2 3.21Å; L376-F843 HydrophobicContact CD2-CZ 3.68Å; A377-F843 HydrophobicContact CB-CD2 3.6Å; A377-F843 HydrophobicContact CB-CE2 3.99Å; Y380-F843 AromaticContact CD2-CE2 3.89Å; Y380-F843 HydrophobicContact CD2-CE2 3.89Å; Y380-F843 AromaticContact CD2-CZ 3.85Å; Y380-F843 HydrophobicContact CD2-CZ 3.85Å; Y380-F843 HydrophobicContact CE2-CE2 4.2Å; Y380-F843 AromaticContact CE2-CZ 3.87Å; Y380-F843 HydrophobicContact CE2-CZ 3.87Å; P839-F843 WeakPolarHBondContact O-CB 3.34Å; P839-F843 PolarHBondContact O-N 3.21Å; Y840-F843 WeakPolarHBondContact O-CB 3.19Å; Y840-F843 PolarHBondContact O-N 2.91Å; N841-F843 PolarHBondContact O-N 3.29Å; F843-R846 PolarHBondContact O-N 2.97Å; F843-L847 HydrophobicContact CE1-CD1 4.42Å; F843-L847 HydrophobicContact CZ-CD1 4.24Å; F843-L847 PolarHBondContact O-N 3.2Å
844	L	81.5	Confident	78.5	Confident	5 Å²	5	35.3 Å²	35.3	3%	0.026	16%	0.158	C	C	.	.	H	α-helix	trans	-67.5	-39	180	-66.5	-179.3	0	0	0	113.2	H806 I809 I810 Y840 N841 R846 L847 A848 M889	H806-L844 HydrophobicContact CB-CD1 3.4Å; I809-L844 HydrophobicContact CG2-CB 3.98Å; I810-L844 HydrophobicContact CD1-CD1 4.03Å; I810-L844 HydrophobicContact CD1-CD2 3.41Å; I810-L844 VanDerWaalsContact CD1-CD2 3.41Å; I810-L844 HydrophobicContact CD1-CG 4.26Å; I810-L844 HydrophobicContact CG1-CB 4.37Å; I810-L844 HydrophobicContact CG1-CD1 4.34Å; I810-L844 HydrophobicContact CG1-CD2 3.76Å; I810-L844 HydrophobicContact CG1-CG 4.38Å; Y840-L844 WeakPolarHBondContact O-CG 3.42Å; Y840-L844 PolarHBondContact O-N 3.24Å; Y840-L844 VanDerWaalsContact O-N 3.07Å; N841-L844 PolarHBondContact O-N 2.88Å; L844-R846 VanDerWaalsContact C-N 3.3Å; L844-R846 PolarHBondContact O-N 3.04Å; L844-L847 PolarHBondContact O-N 2.93Å; L844-A848 WeakPolarHBondContact O-CB 3.39Å; L844-A848 PolarHBondContact O-N 3.07Å; L844-M889 HydrophobicContact CD1-CG 4.35Å; L844-M889 HydrophobicContact CD1-SD 4.17Å; L844-M889 HydrophobicContact CD2-SD 4.29Å
845	V	83.9	Confident	78.2	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-62.5	-41.2	176.6	173.4	0	0	0	0	110.6	I809 L828 L831 A832 N841 L842 A848 Q849	I809-V845 HydrophobicContact CD1-CG2 3.87Å; I809-V845 HydrophobicContact CG1-CG2 4.2Å; I809-V845 HydrophobicContact CG2-CB 4.23Å; I809-V845 HydrophobicContact CG2-CG2 3.67Å; L828-V845 HydrophobicContact CB-CG1 4.48Å; L828-V845 WeakPolarHBondContact O-CG1 3.28Å; L831-V845 HydrophobicContact CB-CG2 4.33Å; A832-V845 HydrophobicContact CB-CG1 3.82Å; N841-V845 VanDerWaalsContact O-CG2 3.29Å; N841-V845 WeakPolarHBondContact O-CG2 3.21Å; N841-V845 PolarHBondContact O-N 3.35Å; L842-V845 PolarHBondContact O-N 3.23Å; V845-A848 WeakPolarHBondContact O-CB 3.38Å; V845-A848 PolarHBondContact O-N 3.18Å; V845-Q849 WeakPolarHBondContact O-CG 3.37Å; V845-Q849 PolarHBondContact O-N 3.3Å
846	R	81.4	Confident	78.3	Confident	46 Å²	46	28.3 Å²	28.3	17%	0.174	13%	0.131	C	C	.	.	H	α-helix	trans	-68.5	-41.6	177.5	-70.5	174.5	-178.6	-173	1.6	111.9	Y353 A374 A377 V381 L842 F843 L844 A848 Q849 G850	Y353-R846 HydrophobicContact CE1-CB 4.08Å; Y353-R846 HydrophobicContact CE1-CG 3.76Å; A374-R846 VanDerWaalsContact CA-NH1 3.33Å; A374-R846 VanDerWaalsContact CB-NH1 3.25Å; A374-R846 PolarHBondContact O-NH1 3.16Å; A377-R846 HydrophobicContact CB-CB 3.8Å; A377-R846 HydrophobicContact CB-CG 4.46Å; V381-R846 HydrophobicContact CG2-CB 4.36Å; V381-R846 WeakPolarHBondContact CG2-O 3.27Å; L842-R846 VanDerWaalsContact O-CG 3.31Å; L842-R846 WeakPolarHBondContact O-CG 3.12Å; L842-R846 PolarHBondContact O-N 3.44Å; L842-R846 VanDerWaalsContact O-N 3.12Å; F843-R846 PolarHBondContact O-N 2.97Å; L844-R846 VanDerWaalsContact C-N 3.3Å; L844-R846 PolarHBondContact O-N 3.04Å; R846-A848 VanDerWaalsContact C-N 3.3Å; R846-A848 PolarHBondContact O-N 2.94Å; R846-Q849 WeakPolarHBondContact O-CB 3.39Å; R846-Q849 PolarHBondContact O-N 3.23Å; R846-G850 PolarHBondContact O-N 3.24Å
847	L	81.7	Confident	78.7	Confident	8 Å²	8	26.6 Å²	26.6	4%	0.042	12%	0.12	C	C	.	.	H	α-helix	trans	-59.1	-43.5	172.5	-177.1	143.5	0	0	0	111.1	F843 L844 Q849 G850 L851 I901	F843-L847 HydrophobicContact CE1-CD1 4.42Å; F843-L847 HydrophobicContact CZ-CD1 4.24Å; F843-L847 PolarHBondContact O-N 3.2Å; L844-L847 PolarHBondContact O-N 2.93Å; L847-Q849 PolarHBondContact O-N 3.48Å; L847-G850 PolarHBondContact O-N 3.27Å; L847-G850 VanDerWaalsContact O-N 3.17Å; L847-L851 HydrophobicContact CD2-CD1 3.68Å; L847-L851 HydrophobicContact CD2-CG 4.26Å; L847-L851 WeakPolarHBondContact O-CG 3.37Å; L847-L851 PolarHBondContact O-N 2.88Å; L847-I901 HydrophobicContact CD1-CD1 3.56Å
848	A	84.3	Confident	79	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-60.7	-42.8	174.4	0	0	0	0	0	111.9	I809 L828 L844 V845 R846 G850 L851 T852	I809-A848 HydrophobicContact CG2-CB 4.19Å; I809-A848 WeakPolarHBondContact O-CB 3.12Å; L828-A848 HydrophobicContact CD1-CB 4.19Å; L828-A848 HydrophobicContact CD2-CB 3.97Å; L844-A848 WeakPolarHBondContact O-CB 3.39Å; L844-A848 PolarHBondContact O-N 3.07Å; V845-A848 WeakPolarHBondContact O-CB 3.38Å; V845-A848 PolarHBondContact O-N 3.18Å; R846-A848 VanDerWaalsContact C-N 3.3Å; R846-A848 PolarHBondContact O-N 2.94Å; A848-G850 VanDerWaalsContact C-N 3.34Å; A848-G850 PolarHBondContact O-N 3.34Å; A848-L851 PolarHBondContact O-N 3.49Å; A848-T852 WeakPolarHBondContact O-CG2 3.42Å; A848-T852 PolarHBondContact O-N 3.44Å
849	Q	83.4	Confident	79.3	Confident	5 Å²	5	13 Å²	13	2%	0.023	6%	0.064	C	C	.	.	H	α-helix	trans	-60.6	-42	173.5	-71.4	170.1	-14.5	0	0	111.8	I352 L828 V845 R846 L847 T852 H853	I352-Q849 HydrophobicContact CG2-CB 4.34Å; L828-Q849 HydrophobicContact CB-CG 3.81Å; L828-Q849 HydrophobicContact CD1-CG 3.93Å; L828-Q849 HydrophobicContact CG-CG 4.48Å; V845-Q849 WeakPolarHBondContact O-CG 3.37Å; V845-Q849 PolarHBondContact O-N 3.3Å; R846-Q849 WeakPolarHBondContact O-CB 3.39Å; R846-Q849 PolarHBondContact O-N 3.23Å; L847-Q849 PolarHBondContact O-N 3.48Å; Q849-T852 WeakPolarHBondContact CA-OG1 3.24Å; Q849-T852 PolarHBondContact O-N 3.24Å; Q849-T852 PolarHBondContact O-OG1 3.09Å; Q849-H853 PolarHBondContact O-CD2 2.93Å; Q849-H853 PolarHBondContact O-N 3.14Å
850	G	81	Confident	79.6	Confident	0 Å²	0	11.4 Å²	11.4	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-58	-46.5	173.2	0	0	0	0	0	112.5	R846 L847 A848 T852 H853 L854	R846-G850 PolarHBondContact O-N 3.24Å; L847-G850 PolarHBondContact O-N 3.27Å; L847-G850 VanDerWaalsContact O-N 3.17Å; A848-G850 VanDerWaalsContact C-N 3.34Å; A848-G850 PolarHBondContact O-N 3.34Å; G850-T852 PolarHBondContact O-N 3.07Å; G850-H853 CarbonylContact O-C 3.56Å; G850-H853 PolarHBondContact O-N 3.26Å; G850-L854 PolarHBondContact O-N 3.32Å; G850-L854 VanDerWaalsContact O-N 3.14Å
851	L	82.4	Confident	79.8	Confident	4 Å²	4	8 Å²	8	2%	0.021	4%	0.04	C	C	.	.	H	α-helix	trans	-62.8	-40.4	176.2	-69.3	174.4	0	0	0	112.4	L384 I814 A817 G818 L847 A848 H853 L854 L861 I904	L384-L851 HydrophobicContact CD1-CD2 3.91Å; L384-L851 HydrophobicContact CD1-CG 4.15Å; L384-L851 HydrophobicContact CD2-CD2 4.21Å; I814-L851 HydrophobicContact CG1-CD1 4.42Å; A817-L851 VanDerWaalsContact CA-O 3.31Å; A817-L851 WeakPolarHBondContact CA-O 3.37Å; G818-L851 PolarHBondContact N-O 3.35Å; G818-L851 VanDerWaalsContact N-O 3.14Å; L847-L851 HydrophobicContact CD2-CD1 3.68Å; L847-L851 HydrophobicContact CD2-CG 4.26Å; L847-L851 WeakPolarHBondContact O-CG 3.37Å; L847-L851 PolarHBondContact O-N 2.88Å; A848-L851 PolarHBondContact O-N 3.49Å; L851-H853 PolarHBondContact O-N 3.32Å; L851-L854 VanDerWaalsContact O-CB 3.25Å; L851-L854 WeakPolarHBondContact O-CB 3.48Å; L851-L854 PolarHBondContact O-N 3.35Å; L851-L854 VanDerWaalsContact O-N 3.14Å; L851-L861 HydrophobicContact CD2-CD1 4.5Å; L851-I904 HydrophobicContact CD2-CD1 4.13Å
852	T	82.6	Confident	79.4	Confident	2 Å²	2	8.5 Å²	8.5	1%	0.012	4%	0.044	C	C	.	.	H	α-helix	trans	-62.6	-27.7	177.9	59.5	0	0	0	0	113.8	N820 L824 L828 A848 Q849 G850	N820-T852 PolarHBondContact N-O 3.33Å; L824-T852 HydrophobicContact CD2-CG2 3.41Å; L824-T852 VanDerWaalsContact CD2-CG2 3.41Å; L824-T852 HydrophobicContact CG-CG2 4.03Å; L828-T852 HydrophobicContact CD1-CG2 3.7Å; A848-T852 WeakPolarHBondContact O-CG2 3.42Å; A848-T852 PolarHBondContact O-N 3.44Å; Q849-T852 WeakPolarHBondContact CA-OG1 3.24Å; Q849-T852 PolarHBondContact O-N 3.24Å; Q849-T852 PolarHBondContact O-OG1 3.09Å; G850-T852 PolarHBondContact O-N 3.07Å
853	H	80.4	Confident	79	Confident	30 Å²	30	8 Å²	8	14%	0.139	4%	0.042	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	21.4	178.1	-65.7	-66.4	0	0	0	112.9	I352 V385 N820 Q849 G850 L851 G855 K856	I352-H853 HydrophobicContact CD1-CB 4.19Å; I352-H853 VanDerWaalsContact CG2-CD2 3.44Å; I352-H853 WeakPolarHBondContact CG2-CD2 3.48Å; V385-H853 HydrophobicContact CG2-CB 4.26Å; N820-H853 PolarHBondContact OD1-CE1 2.98Å; N820-H853 PolarHBondContact OD1-ND1 3.29Å; N820-H853 VanDerWaalsContact OD1-ND1 3.1Å; Q849-H853 PolarHBondContact O-CD2 2.93Å; Q849-H853 PolarHBondContact O-N 3.14Å; G850-H853 CarbonylContact O-C 3.56Å; G850-H853 PolarHBondContact O-N 3.26Å; L851-H853 PolarHBondContact O-N 3.32Å; H853-G855 PolarHBondContact O-N 3.18Å; H853-K856 WeakPolarHBondContact O-CA 3.35Å; H853-K856 PolarHBondContact O-N 3.02Å
854	L	79.7	Confident	78.5	Confident	1 Å²	1	9.2 Å²	9.2	1%	0.005	5%	0.046	C	C	.	.	G	3₁₀ helix	trans	-49.9	125.4	178.8	-172.5	74.2	0	0	0	111.2	L384 G850 L851 K856 G857 L859 L861 I908	L384-L854 HydrophobicContact CB-CD1 4.03Å; L384-L854 HydrophobicContact CD2-CD1 3.62Å; L384-L854 HydrophobicContact CG-CD1 4.4Å; L384-L854 WeakPolarHBondContact O-CA 3.33Å; G850-L854 PolarHBondContact O-N 3.32Å; G850-L854 VanDerWaalsContact O-N 3.14Å; L851-L854 VanDerWaalsContact O-CB 3.25Å; L851-L854 WeakPolarHBondContact O-CB 3.48Å; L851-L854 PolarHBondContact O-N 3.35Å; L851-L854 VanDerWaalsContact O-N 3.14Å; L854-K856 PolarHBondContact O-N 3.45Å; L854-K856 VanDerWaalsContact O-N 3.08Å; L854-G857 PolarHBondContact O-N 3.32Å; L854-L859 HydrophobicContact CD2-CB 3.86Å; L854-L859 HydrophobicContact CG-CB 3.94Å; L854-L859 HydrophobicContact CG-CD1 4.32Å; L854-L861 HydrophobicContact CD2-CD2 4.2Å; L854-L861 HydrophobicContact CD2-CG 4.23Å; L854-I908 HydrophobicContact CD1-CD1 4.44Å; L854-I908 HydrophobicContact CD2-CG1 4.4Å; L854-I908 HydrophobicContact CD2-CG2 4.39Å
855	G	73.3	Confident	77.8	Confident	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.047	C	C	.	.	G	3₁₀ helix	trans	54.6	27.8	-177.2	0	0	0	0	0	113.6	L384 H853 G857 T858	L384-G855 PolarHBondContact O-N 3.24Å; H853-G855 PolarHBondContact O-N 3.18Å; G855-G857 PolarHBondContact O-N 3.25Å; G855-G857 VanDerWaalsContact O-N 3.11Å; G855-T858 PolarHBondContact O-N 3.1Å; G855-T858 VanDerWaalsContact O-N 3.15Å; G855-T858 PolarHBondContact O-OG1 3.05Å
856	K	74.3	Confident	76.5	Confident	11 Å²	11	9.9 Å²	9.9	5%	0.048	5%	0.05	C	C	.	.	G	3₁₀ helix	trans	60.3	16.8	-173.7	-48.5	174.8	-169.4	170.8	0	114	I343 D345 K347 V385 N386 F389 H853 L854	I343-K856 HydrophobicContact CB-CD 4.37Å; I343-K856 HydrophobicContact CG2-CB 3.78Å; I343-K856 HydrophobicContact CG2-CD 3.23Å; I343-K856 HydrophobicContact CG2-CG 4.11Å; I343-K856 PolarHBondContact O-NZ 3.24Å; D345-K856 PolarHBondContact O-NZ 3.34Å; K347-K856 HydrophobicContact CD-CD 4.35Å; K347-K856 HydrophobicContact CD-CG 4.33Å; V385-K856 HydrophobicContact CG1-CG 4.36Å; V385-K856 WeakPolarHBondContact O-CG 3.27Å; V385-K856 PolarHBondContact O-N 2.75Å; N386-K856 VanDerWaalsContact OD1-CE 3.23Å; N386-K856 WeakPolarHBondContact OD1-CE 3.43Å; F389-K856 HydrophobicContact CD2-CD 4.41Å; F389-K856 HydrophobicContact CE2-CD 4.03Å; F389-K856 HydrophobicContact CE2-CG 4.18Å; F389-K856 HydrophobicContact CZ-CD 4.35Å; H853-K856 WeakPolarHBondContact O-CA 3.35Å; H853-K856 PolarHBondContact O-N 3.02Å; L854-K856 PolarHBondContact O-N 3.45Å; L854-K856 VanDerWaalsContact O-N 3.08Å
857	G	75	Confident	75.5	Confident	12 Å²	12	10.7 Å²	10.7	12%	0.124	6%	0.057	C	C	.	.	G	3₁₀ helix	trans	106.5	3.1	-178	0	0	0	0	0	115	G818 L854 G855	G818-G857 CarbonylContact O-C 3.59Å; G818-G857 WeakPolarHBondContact O-CA 3.47Å; L854-G857 PolarHBondContact O-N 3.32Å; G855-G857 PolarHBondContact O-N 3.25Å; G855-G857 VanDerWaalsContact O-N 3.11Å
858	T	74.5	Confident	74.6	Confident	2 Å²	2	13.6 Å²	13.6	1%	0.012	7%	0.068	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-13.6	-178.3	63.9	0	0	0	0	113.9	F334 L337 L341 I343 F389 G855 R911 L956	F334-T858 WeakPolarHBondContact CE2-OG1 3.21Å; F334-T858 WeakPolarHBondContact CZ-OG1 3.35Å; L337-T858 HydrophobicContact CD2-CG2 4.01Å; L341-T858 HydrophobicContact CD1-CG2 4.37Å; I343-T858 HydrophobicContact CD1-CG2 4.13Å; F389-T858 HydrophobicContact CZ-CG2 4.47Å; G855-T858 PolarHBondContact O-N 3.1Å; G855-T858 VanDerWaalsContact O-N 3.15Å; G855-T858 PolarHBondContact O-OG1 3.05Å; T858-R911 PolarHBondContact O-N 3.46Å; T858-L956 HydrophobicContact CG2-CD1 4.27Å; T858-L956 HydrophobicContact CG2-CD2 4.22Å
859	L	81.8	Confident	73.7	Confident	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	142.5	-175	-59.8	174.6	0	0	0	110.5	F334 C387 W426 G818 L854 I908 Q909 P910	F334-L859 HydrophobicContact CE2-CD2 3.77Å; F334-L859 HydrophobicContact CE2-CG 4.42Å; F334-L859 HydrophobicContact CZ-CD2 4.14Å; F334-L859 HydrophobicContact CZ-CG 4.43Å; C387-L859 HydrophobicContact CB-CD1 3.44Å; C387-L859 VanDerWaalsContact CB-CD1 3.44Å; W426-L859 HydrophobicContact CH2-CD2 3.89Å; W426-L859 HydrophobicContact CZ3-CD2 4.4Å; G818-L859 WeakPolarHBondContact CA-O 3.4Å; L854-L859 HydrophobicContact CD2-CB 3.86Å; L854-L859 HydrophobicContact CG-CB 3.94Å; L854-L859 HydrophobicContact CG-CD1 4.32Å; L859-I908 HydrophobicContact CB-CG2 4.01Å; L859-I908 HydrophobicContact CD1-CG2 3.7Å; L859-I908 HydrophobicContact CD2-CG2 4.17Å; L859-I908 HydrophobicContact CG-CG2 4.16Å; L859-Q909 CarbonylContact C-O 3.47Å; L859-Q909 WeakPolarHBondContact CA-O 3.49Å; L859-P910 HydrophobicContact CD2-CB 3.85Å
860	T	79.7	Confident	73.1	Confident	7 Å²	7	15.2 Å²	15.2	4%	0.043	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	158.3	174.6	36.8	0	0	0	0	111.7	Q909 R911	T860-Q909 PolarHBondContact N-O 3.02Å; T860-Q909 PolarHBondContact O-N 3.4Å; T860-Q909 PolarHBondContact OG1-O 3.13Å; T860-R911 HydrophobicContact CG2-CG 3.3Å; T860-R911 WeakPolarHBondContact OG1-CG 3.26Å
861	L	78.6	Confident	72.6	Confident	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.088	C	C	.	.			trans	-102	-0.2	171.6	-66.6	179.5	0	0	0	113.1	V782 S783 A817 L851 L854 P863 L879 I904 A907 I908	V782-L861 HydrophobicContact CG1-CB 3.72Å; V782-L861 WeakPolarHBondContact CG1-O 3.1Å; S783-L861 PolarHBondContact OG-N 3.27Å; S783-L861 VanDerWaalsContact OG-N 3.17Å; A817-L861 HydrophobicContact CB-CB 4.29Å; A817-L861 HydrophobicContact CB-CD1 3.5Å; A817-L861 VanDerWaalsContact CB-CD1 3.5Å; A817-L861 HydrophobicContact CB-CG 3.84Å; L851-L861 HydrophobicContact CD2-CD1 4.5Å; L854-L861 HydrophobicContact CD2-CD2 4.2Å; L854-L861 HydrophobicContact CD2-CG 4.23Å; L861-P863 WeakPolarHBondContact O-CD 3.32Å; L861-L879 HydrophobicContact CB-CD2 4.41Å; L861-L879 HydrophobicContact CD1-CD2 4.41Å; L861-L879 WeakPolarHBondContact O-CD1 3.41Å; L861-I904 HydrophobicContact CD1-CD1 3.6Å; L861-I904 HydrophobicContact CD1-CG1 4.29Å; L861-I904 HydrophobicContact CD2-CD1 3.97Å; L861-I904 HydrophobicContact CD2-CG1 3.86Å; L861-I904 HydrophobicContact CG-CD1 4.46Å; L861-A907 WeakPolarHBondContact CA-O 3.2Å; L861-A907 HydrophobicContact CD2-CB 4.21Å; L861-I908 HydrophobicContact CD2-CG1 3.79Å
862	S	71.3	Confident	72.1	Confident	17 Å²	17	18.1 Å²	18.1	12%	0.119	9%	0.091	C	C	.	.			trans	-62.3	121.1	-174.5	51.5	0	0	0	0	110.8	W864	S862-W864 PolarHBondContact O-N 3.32Å
863	P	69.6	Low	71.8	Confident	4 Å²	4	19.5 Å²	19.5	3%	0.026	10%	0.101	C	C	.	.			trans	-75.1	-13.4	178.5	30.1	-33.9	0	0	0	112.3	M745 L861 R872 L876 L879	M745-P863 HydrophobicContact CE-CG 3.69Å; L861-P863 WeakPolarHBondContact O-CD 3.32Å; P863-R872 WeakPolarHBondContact O-CB 3.46Å; P863-R872 PolarHBondContact O-N 3.36Å; P863-L876 HydrophobicContact CB-CB 4.13Å; P863-L876 HydrophobicContact CG-CD1 4.5Å; P863-L879 HydrophobicContact CG-CD1 4.24Å
864	W	68.4	Low	71.7	Confident	40 Å²	40	18.1 Å²	18.1	15%	0.152	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	132	-179.7	-66	97	0	0	0	111.1	M745 S862 R868 L870 C871	M745-W864 HydrophobicContact CB-CZ2 4.2Å; S862-W864 PolarHBondContact O-N 3.32Å; W864-R868 WeakPolarHBondContact CZ3-O 3.37Å; W864-L870 WeakPolarHBondContact CA-O 3.46Å; W864-C871 HydrophobicContact CD2-CB 4.13Å; W864-C871 HydrophobicContact CE3-CB 3.81Å; W864-C871 HydrophobicContact CH2-CB 3.74Å; W864-C871 HydrophobicContact CZ2-CB 4.01Å; W864-C871 HydrophobicContact CZ3-CB 3.63Å
865	H	66.6	Low	71.6	Confident	10 Å²	10	18.1 Å²	18.1	5%	0.046	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	158.1	174.7	42.7	51.7	0	0	0	110.4	Q306 L870 R872	Q306-H865 PolarHBondContact NE2-CE1 3.37Å; Q306-H865 VanDerWaalsContact NE2-CE1 3.34Å; H865-L870 VanDerWaalsContact CE1-CB 3.47Å; H865-L870 WeakPolarHBondContact CE1-CB 3.39Å; H865-L870 PolarHBondContact N-O 3.11Å; H865-L870 WeakPolarHBondContact ND1-CB 3.37Å; H865-L870 PolarHBondContact ND1-O 2.69Å; H865-L870 PolarHBondContact O-N 3.16Å; H865-R872 WeakPolarHBondContact NE2-CB 3.02Å
866	S	56.9	Low	71.9	Confident	9 Å²	9	18.4 Å²	18.4	6%	0.063	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	76	-177.5	-50.4	0	0	0	0	112.7	R263 R868 F869 E979	R263-S866 PolarHBondContact NH2-O 3.24Å; S866-R868 VanDerWaalsContact C-N 3.29Å; S866-R868 PolarHBondContact O-N 3.09Å; S866-F869 WeakPolarHBondContact O-CB 3.07Å; S866-F869 PolarHBondContact O-N 3.35Å; S866-E979 WeakPolarHBondContact CA-OE2 3.2Å; S866-E979 PolarHBondContact N-OE2 3.29Å
867	D	59.7	Low	72.2	Confident	62 Å²	62	17.9 Å²	17.9	33%	0.332	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	42.5	175.5	-72.8	-25	0	0	0	113.6	F869 R962	D867-F869 PolarHBondContact O-N 3.25Å; D867-R962 IonicContact OD2-CZ 3.61Å; D867-R962 IonicContact OD2-NH1 3.21Å; D867-R962 PolarHBondContact OD2-NH1 3.34Å
868	R	63.6	Low	72.3	Confident	69 Å²	69	17.3 Å²	17.3	26%	0.26	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.7	16.2	-177.1	-54.8	-169.5	-169.4	158.1	24.3	115.6	E748 W864 S866	E748-R868 IonicContact OE1-CZ 3.33Å; E748-R868 IonicContact OE1-NE 3.41Å; E748-R868 IonicContact OE1-NH1 3.55Å; E748-R868 PolarHBondContact OE1-NH1 2.95Å; E748-R868 IonicContact OE1-NH2 3.71Å; E748-R868 PolarHBondContact OE1-NH2 3.42Å; W864-R868 WeakPolarHBondContact CZ3-O 3.37Å; S866-R868 VanDerWaalsContact C-N 3.29Å; S866-R868 PolarHBondContact O-N 3.09Å
869	F	65.7	Low	72.6	Confident	35 Å²	35	17.2 Å²	17.2	15%	0.154	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-37.3	-179	-169	-108.3	0	0	0	112.7	T230 R263 R267 S866 D867	T230-F869 HydrophobicContact CG2-CD2 3.83Å; T230-F869 HydrophobicContact CG2-CE2 3.12Å; T230-F869 HydrophobicContact CG2-CZ 3.67Å; R263-F869 HydrophobicContact CB-CD1 4.16Å; R263-F869 HydrophobicContact CB-CE1 4.21Å; R267-F869 HydrophobicContact CB-CE1 4.42Å; S866-F869 WeakPolarHBondContact O-CB 3.07Å; S866-F869 PolarHBondContact O-N 3.35Å; D867-F869 PolarHBondContact O-N 3.25Å
870	L	69.8	Low	72.6	Confident	5 Å²	5	17.6 Å²	17.6	3%	0.026	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	122.1	-175.6	-73.7	163.3	0	0	0	109.8	R263 L266 W864 H865	R263-L870 HydrophobicContact CB-CD1 4.1Å; R263-L870 HydrophobicContact CB-CG 4.48Å; R263-L870 HydrophobicContact CG-CD1 3.75Å; R263-L870 WeakPolarHBondContact O-CD2 3.23Å; L266-L870 HydrophobicContact CB-CD2 3.66Å; W864-L870 WeakPolarHBondContact CA-O 3.46Å; H865-L870 VanDerWaalsContact CE1-CB 3.47Å; H865-L870 WeakPolarHBondContact CE1-CB 3.39Å; H865-L870 PolarHBondContact N-O 3.11Å; H865-L870 WeakPolarHBondContact ND1-CB 3.37Å; H865-L870 PolarHBondContact ND1-O 2.69Å; H865-L870 PolarHBondContact O-N 3.16Å
871	C	70.1	Confident	72.7	Confident	39 Å²	39	17.3 Å²	17.3	26%	0.264	9%	0.087	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	126.8	169.6	-175.7	0	0	0	0	108.9	W864 P873	W864-C871 HydrophobicContact CD2-CB 4.13Å; W864-C871 HydrophobicContact CE3-CB 3.81Å; W864-C871 HydrophobicContact CH2-CB 3.74Å; W864-C871 HydrophobicContact CZ2-CB 4.01Å; W864-C871 HydrophobicContact CZ3-CB 3.63Å; C871-P873 WeakPolarHBondContact O-CD 3.34Å
872	R	73.5	Confident	72.8	Confident	25 Å²	25	17.7 Å²	17.7	9%	0.094	9%	0.089	C	C	.	.			trans	-73.1	108.8	166.8	-165.8	169.5	150.9	105.4	0.9	108	R305 N307 P863 H865 V874 G875 L876 P906	R305-R872 VanDerWaalsContact C-NH1 3.33Å; R305-R872 PolarHBondContact O-NH1 2.97Å; N307-R872 VanDerWaalsContact CG-NH2 3.26Å; N307-R872 PolarHBondContact ND2-NH2 3.07Å; N307-R872 PolarHBondContact OD1-NH1 3.36Å; N307-R872 PolarHBondContact OD1-NH2 3.44Å; P863-R872 WeakPolarHBondContact O-CB 3.46Å; P863-R872 PolarHBondContact O-N 3.36Å; H865-R872 WeakPolarHBondContact NE2-CB 3.02Å; R872-V874 VanDerWaalsContact C-N 3.27Å; R872-V874 PolarHBondContact O-N 2.99Å; R872-G875 PolarHBondContact O-N 2.9Å; R872-L876 PolarHBondContact O-N 3.38Å; R872-L876 VanDerWaalsContact O-N 3.1Å; R872-P906 PolarHBondContact NH2-O 3.44Å
873	P	75	Confident	73.3	Confident	32 Å²	32	17 Å²	17	21%	0.208	9%	0.085	C	C	.	.	H	α-helix	trans	-63.2	-37.9	-175.5	25	-33.5	0	0	0	111.5	V534 L574 C871 L876 A877	V534-P873 HydrophobicContact CG1-CB 3.68Å; L574-P873 HydrophobicContact CD2-CB 3.59Å; L574-P873 WeakPolarHBondContact CD2-O 3.5Å; C871-P873 WeakPolarHBondContact O-CD 3.34Å; P873-L876 PolarHBondContact O-N 3.22Å; P873-A877 VanDerWaalsContact O-CB 3.3Å; P873-A877 WeakPolarHBondContact O-CB 3.49Å; P873-A877 PolarHBondContact O-N 3.4Å
874	V	79.5	Confident	73.6	Confident	1 Å²	1	17.2 Å²	17.2	1%	0.006	9%	0.086	C	C	.	.	H	α-helix	trans	-65.4	-39.8	178.7	177.4	0	0	0	0	112.7	A496 R872 A877 G878 P906	A496-V874 HydrophobicContact CB-CG1 3.61Å; R872-V874 VanDerWaalsContact C-N 3.27Å; R872-V874 PolarHBondContact O-N 2.99Å; V874-A877 PolarHBondContact O-N 3.49Å; V874-G878 PolarHBondContact O-N 2.98Å; V874-P906 HydrophobicContact CG1-CB 3.48Å; V874-P906 VanDerWaalsContact CG1-CB 3.48Å
875	G	77.7	Confident	74	Confident	1 Å²	1	15.3 Å²	15.3	1%	0.01	8%	0.078	C	C	.	.	H	α-helix	trans	-70.1	-42.3	178.8	0	0	0	0	0	111.7	R872 A877 G878 L879	R872-G875 PolarHBondContact O-N 2.9Å; G875-A877 VanDerWaalsContact C-N 3.34Å; G875-G878 PolarHBondContact O-N 2.93Å; G875-L879 WeakPolarHBondContact O-CG 3.16Å; G875-L879 PolarHBondContact O-N 2.94Å; G875-L879 VanDerWaalsContact O-N 3.15Å
876	L	79.6	Confident	74.3	Confident	5 Å²	5	14.9 Å²	14.9	3%	0.026	8%	0.076	C	C	.	.	H	α-helix	trans	-61.7	-43.8	173.5	-178.1	61.8	0	0	0	111	L574 A608 I742 M745 L779 P863 R872 P873 G878 L879 L880	L574-L876 HydrophobicContact CD1-CD2 4.13Å; L574-L876 HydrophobicContact CD2-CD2 4.43Å; A608-L876 HydrophobicContact CB-CD2 4.26Å; I742-L876 HydrophobicContact CG2-CD2 4.35Å; M745-L876 HydrophobicContact CE-CD1 4.48Å; M745-L876 HydrophobicContact SD-CD1 4.19Å; L779-L876 HydrophobicContact CD1-CD1 4.33Å; P863-L876 HydrophobicContact CB-CB 4.13Å; P863-L876 HydrophobicContact CG-CD1 4.5Å; R872-L876 PolarHBondContact O-N 3.38Å; R872-L876 VanDerWaalsContact O-N 3.1Å; P873-L876 PolarHBondContact O-N 3.22Å; L876-G878 PolarHBondContact O-N 2.99Å; L876-L879 PolarHBondContact O-N 3.49Å; L876-L880 WeakPolarHBondContact O-CB 3.24Å; L876-L880 PolarHBondContact O-N 3.41Å
877	A	79.9	Confident	75.1	Confident	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-58.3	-47.9	177.2	0	0	0	0	0	112.3	L531 V534 L571 P873 V874 G875 L879 L880 I881	L531-A877 HydrophobicContact CD2-CB 3.66Å; V534-A877 HydrophobicContact CG2-CB 4.18Å; L571-A877 HydrophobicContact CD1-CB 4.2Å; L571-A877 HydrophobicContact CD2-CB 3.48Å; L571-A877 VanDerWaalsContact CD2-CB 3.48Å; L571-A877 HydrophobicContact CG-CB 4.4Å; P873-A877 VanDerWaalsContact O-CB 3.3Å; P873-A877 WeakPolarHBondContact O-CB 3.49Å; P873-A877 PolarHBondContact O-N 3.4Å; V874-A877 PolarHBondContact O-N 3.49Å; G875-A877 VanDerWaalsContact C-N 3.34Å; A877-L879 PolarHBondContact O-N 3.15Å; A877-L880 PolarHBondContact O-N 3.32Å; A877-I881 WeakPolarHBondContact O-CG1 3.49Å; A877-I881 PolarHBondContact O-N 3.41Å
878	G	76.9	Confident	75.5	Confident	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-60.8	-41.2	178	0	0	0	0	0	113.4	V874 G875 L876 L882 Y903	V874-G878 PolarHBondContact O-N 2.98Å; G875-G878 PolarHBondContact O-N 2.93Å; L876-G878 PolarHBondContact O-N 2.99Å; G878-L882 PolarHBondContact O-N 3.4Å; G878-Y903 WeakPolarHBondContact CA-O 3.37Å
879	L	81.3	Confident	75.6	Confident	1 Å²	1	10.3 Å²	10.3	1%	0.005	6%	0.056	C	C	.	.	H	α-helix	trans	-67.4	-41.9	174.6	-71.6	174.4	0	0	0	112.4	V782 L861 P863 G875 L876 A877 I881 L882 L883 I904 A907	V782-L879 HydrophobicContact CG1-CD1 4.13Å; V782-L879 HydrophobicContact CG2-CD1 4.05Å; L861-L879 HydrophobicContact CB-CD2 4.41Å; L861-L879 HydrophobicContact CD1-CD2 4.41Å; L861-L879 WeakPolarHBondContact O-CD1 3.41Å; P863-L879 HydrophobicContact CG-CD1 4.24Å; G875-L879 WeakPolarHBondContact O-CG 3.16Å; G875-L879 PolarHBondContact O-N 2.94Å; G875-L879 VanDerWaalsContact O-N 3.15Å; L876-L879 PolarHBondContact O-N 3.49Å; A877-L879 PolarHBondContact O-N 3.15Å; L879-I881 VanDerWaalsContact C-N 3.33Å; L879-I881 PolarHBondContact O-N 3.42Å; L879-L882 WeakPolarHBondContact O-CB 3.39Å; L879-L882 PolarHBondContact O-N 3.2Å; L879-L883 VanDerWaalsContact O-CG 3.24Å; L879-L883 WeakPolarHBondContact O-CG 3.29Å; L879-L883 PolarHBondContact O-N 3.21Å; L879-I904 HydrophobicContact CD2-CG1 4.31Å; L879-A907 HydrophobicContact CD2-CB 4.34Å; L879-A907 HydrophobicContact CG-CB 3.99Å
880	L	81.1	Confident	75.5	Confident	8 Å²	8	14.3 Å²	14.3	4%	0.042	7%	0.071	C	C	.	.	H	α-helix	trans	-65.5	-38.9	-178.5	-167.1	160.7	0	0	0	110.9	L567 I742 L876 A877 L883 T884	L567-L880 HydrophobicContact CD1-CD2 3.04Å; L567-L880 HydrophobicContact CD2-CD2 3.92Å; L567-L880 HydrophobicContact CG-CD2 3.88Å; I742-L880 HydrophobicContact CD1-CD1 3.33Å; I742-L880 HydrophobicContact CD1-CG 4.08Å; I742-L880 HydrophobicContact CG1-CD1 4.23Å; L876-L880 WeakPolarHBondContact O-CB 3.24Å; L876-L880 PolarHBondContact O-N 3.41Å; A877-L880 PolarHBondContact O-N 3.32Å; L880-L883 PolarHBondContact O-N 3.21Å; L880-T884 HydrophobicContact CD2-CG2 3.98Å; L880-T884 WeakPolarHBondContact O-CB 3.39Å; L880-T884 WeakPolarHBondContact O-CG2 3.35Å; L880-T884 PolarHBondContact O-N 3.31Å; L880-T884 PolarHBondContact O-OG1 2.97Å
881	I	82.5	Confident	75.1	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-58.8	-47.5	171.3	-69.6	167.8	0	0	0	111.3	L527 L531 L567 L571 A877 L879 L883 T884 S885 Y903	L527-I881 HydrophobicContact CD1-CD1 3.76Å; L527-I881 HydrophobicContact CD1-CG1 3.78Å; L527-I881 HydrophobicContact CD2-CD1 4.02Å; L527-I881 HydrophobicContact CD2-CG1 4.16Å; L527-I881 HydrophobicContact CD2-CG2 3.81Å; L527-I881 HydrophobicContact CG-CD1 3.92Å; L527-I881 HydrophobicContact CG-CG1 4.31Å; L531-I881 HydrophobicContact CD1-CD1 3.53Å; L531-I881 HydrophobicContact CD2-CD1 3.6Å; L531-I881 HydrophobicContact CG-CD1 3.65Å; L567-I881 HydrophobicContact CD2-CB 4.27Å; L567-I881 HydrophobicContact CD2-CG1 3.59Å; L571-I881 HydrophobicContact CD1-CD1 3.9Å; L571-I881 HydrophobicContact CD1-CG1 4.12Å; A877-I881 WeakPolarHBondContact O-CG1 3.49Å; A877-I881 PolarHBondContact O-N 3.41Å; L879-I881 VanDerWaalsContact C-N 3.33Å; L879-I881 PolarHBondContact O-N 3.42Å; I881-L883 VanDerWaalsContact C-N 3.34Å; I881-L883 PolarHBondContact O-N 3.11Å; I881-T884 PolarHBondContact O-OG1 3.22Å; I881-T884 VanDerWaalsContact O-OG1 3.06Å; I881-S885 WeakPolarHBondContact O-CB 3.28Å; I881-S885 PolarHBondContact O-N 3.41Å; I881-Y903 HydrophobicContact CD1-CD1 4.28Å; I881-Y903 HydrophobicContact CD1-CG 4.4Å; I881-Y903 HydrophobicContact CG2-CD2 3.65Å; I881-Y903 HydrophobicContact CG2-CE2 4.32Å; I881-Y903 HydrophobicContact CG2-CG 3.81Å
882	L	80.8	Confident	74.8	Confident	8 Å²	8	18.2 Å²	18.2	4%	0.042	9%	0.087	C	C	.	.	H	α-helix	trans	-61.5	-45.1	178.8	-175	70.9	0	0	0	110.9	I814 G878 L879 S885 C886 F893 I901 I904	I814-L882 HydrophobicContact CD1-CD2 4.17Å; G878-L882 PolarHBondContact O-N 3.4Å; L879-L882 WeakPolarHBondContact O-CB 3.39Å; L879-L882 PolarHBondContact O-N 3.2Å; L882-S885 WeakPolarHBondContact O-CB 3.43Å; L882-S885 PolarHBondContact O-N 3.25Å; L882-C886 PolarHBondContact O-N 3.27Å; L882-C886 PolarHBondContact O-SG 3.18Å; L882-F893 HydrophobicContact CD1-CE1 4.44Å; L882-F893 HydrophobicContact CD1-CZ 3.85Å; L882-I901 HydrophobicContact CD1-CG1 4.39Å; L882-I904 HydrophobicContact CD2-CD1 3.83Å; L882-I904 HydrophobicContact CD2-CG1 4.29Å
883	L	80.3	Confident	74.2	Confident	4 Å²	4	17.7 Å²	17.7	2%	0.021	9%	0.085	C	C	.	.	H	α-helix	trans	-71.2	-38.1	-176.2	-67.1	168.4	0	0	0	112.9	L775 L779 I814 L879 L880 I881 S885 C886 L887	L775-L883 HydrophobicContact CB-CD2 4.03Å; L775-L883 HydrophobicContact CD2-CD2 3.95Å; L779-L883 HydrophobicContact CB-CD1 3.78Å; L779-L883 HydrophobicContact CD1-CD1 3.22Å; L779-L883 HydrophobicContact CG-CD1 4.08Å; I814-L883 HydrophobicContact CD1-CD2 3.85Å; L879-L883 VanDerWaalsContact O-CG 3.24Å; L879-L883 WeakPolarHBondContact O-CG 3.29Å; L879-L883 PolarHBondContact O-N 3.21Å; L880-L883 PolarHBondContact O-N 3.21Å; I881-L883 VanDerWaalsContact C-N 3.34Å; I881-L883 PolarHBondContact O-N 3.11Å; L883-S885 VanDerWaalsContact C-N 3.33Å; L883-C886 WeakPolarHBondContact O-CB 3.35Å; L883-C886 PolarHBondContact O-N 3.06Å; L883-L887 PolarHBondContact O-N 3.11Å
884	T	77.5	Confident	73.3	Confident	8 Å²	8	17.8 Å²	17.8	5%	0.049	8%	0.083	C	C	.	.	H	α-helix	trans	-67.8	-36.1	173.5	50.7	0	0	0	0	111.8	L567 L735 L738 L880 I881 C886 L887	L567-T884 HydrophobicContact CD1-CG2 4.12Å; L567-T884 WeakPolarHBondContact CD2-OG1 3.31Å; L735-T884 HydrophobicContact CD2-CG2 3.91Å; L738-T884 HydrophobicContact CD1-CG2 4.07Å; L880-T884 HydrophobicContact CD2-CG2 3.98Å; L880-T884 WeakPolarHBondContact O-CB 3.39Å; L880-T884 WeakPolarHBondContact O-CG2 3.35Å; L880-T884 PolarHBondContact O-N 3.31Å; L880-T884 PolarHBondContact O-OG1 2.97Å; I881-T884 PolarHBondContact O-OG1 3.22Å; I881-T884 VanDerWaalsContact O-OG1 3.06Å; T884-C886 VanDerWaalsContact C-N 3.29Å; T884-C886 PolarHBondContact O-N 3.3Å; T884-L887 WeakPolarHBondContact O-CB 3.41Å; T884-L887 PolarHBondContact O-N 3.39Å
885	S	76.1	Confident	72.4	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-61.1	-36.7	169.4	171.2	0	0	0	0	112.2	I881 L882 L883 L887 T892	I881-S885 WeakPolarHBondContact O-CB 3.28Å; I881-S885 PolarHBondContact O-N 3.41Å; L882-S885 WeakPolarHBondContact O-CB 3.43Å; L882-S885 PolarHBondContact O-N 3.25Å; L883-S885 VanDerWaalsContact C-N 3.33Å; S885-L887 VanDerWaalsContact C-N 3.3Å; S885-L887 PolarHBondContact O-N 3.4Å; S885-T892 WeakPolarHBondContact O-CB 3.33Å; S885-T892 PolarHBondContact O-OG1 3.49Å; S885-T892 WeakPolarHBondContact OG-CG2 3.19Å
886	C	73.4	Confident	71.8	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-70	-17.7	177	-68.7	0	0	0	0	114.4	L775 N807 L882 L883 T884 D888 M889 F893	L775-C886 HydrophobicContact CD1-CB 3.69Å; L775-C886 HydrophobicContact CD2-CB 3.91Å; L775-C886 HydrophobicContact CG-CB 4.48Å; N807-C886 PolarHBondContact OD1-O 3.32Å; L882-C886 PolarHBondContact O-N 3.27Å; L882-C886 PolarHBondContact O-SG 3.18Å; L883-C886 WeakPolarHBondContact O-CB 3.35Å; L883-C886 PolarHBondContact O-N 3.06Å; T884-C886 VanDerWaalsContact C-N 3.29Å; T884-C886 PolarHBondContact O-N 3.3Å; C886-D888 PolarHBondContact O-N 3Å; C886-M889 HydrophobicContact CB-CE 3.56Å; C886-M889 PolarHBondContact O-N 2.69Å; C886-F893 HydrophobicContact CB-CE2 4.35Å; C886-F893 WeakPolarHBondContact SG-CE2 3.27Å
887	L	72.4	Confident	71.2	Confident	19 Å²	19	29 Å²	29	10%	0.099	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-34.2	179.1	-70.8	173	0	0	0	112	L735 L738 A772 L775 L883 T884 S885	L735-L887 HydrophobicContact CD2-CD1 3.82Å; L735-L887 HydrophobicContact CG-CD1 4.01Å; L738-L887 HydrophobicContact CD1-CD1 3.93Å; L738-L887 HydrophobicContact CD1-CD2 4.2Å; L738-L887 HydrophobicContact CD1-CG 4.18Å; A772-L887 HydrophobicContact CB-CD2 3.89Å; L775-L887 HydrophobicContact CD1-CD2 4.11Å; L883-L887 PolarHBondContact O-N 3.11Å; T884-L887 WeakPolarHBondContact O-CB 3.41Å; T884-L887 PolarHBondContact O-N 3.39Å; S885-L887 VanDerWaalsContact C-N 3.3Å; S885-L887 PolarHBondContact O-N 3.4Å
888	D	68.9	Low	70.7	Confident	25 Å²	25	29.9 Å²	29.9	13%	0.134	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114	56.5	175.1	-64.5	-27.8	0	0	0	111.7	V560 K563 C886 R890 M891 T892	V560-D888 HydrophobicContact CG1-CB 4.21Å; V560-D888 HydrophobicContact CG2-CB 4.31Å; K563-D888 VanDerWaalsContact NZ-CG 3.31Å; K563-D888 IonicContact NZ-OD1 2.72Å; K563-D888 PolarHBondContact NZ-OD1 3.07Å; K563-D888 IonicContact NZ-OD2 2.99Å; K563-D888 PolarHBondContact NZ-OD2 3.1Å; C886-D888 PolarHBondContact O-N 3Å; D888-R890 PolarHBondContact O-N 3.21Å; D888-M891 HydrophobicContact CB-CB 4.48Å; D888-M891 PolarHBondContact O-N 2.92Å; D888-T892 PolarHBondContact O-N 3.5Å; D888-T892 PolarHBondContact O-OG1 3.43Å
889	M	66.6	Low	70.6	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-45.1	-38.2	-177.2	-167.9	62.6	51.5	0	0	114.5	H806 N807 I810 L844 C886 M891 F893 M894	H806-M889 HydrophobicContact CB-CG 3.79Å; N807-M889 WeakPolarHBondContact OD1-CE 3.36Å; I810-M889 HydrophobicContact CD1-CE 3.19Å; I810-M889 HydrophobicContact CD1-SD 3.64Å; L844-M889 HydrophobicContact CD1-CG 4.35Å; L844-M889 HydrophobicContact CD1-SD 4.17Å; L844-M889 HydrophobicContact CD2-SD 4.29Å; C886-M889 HydrophobicContact CB-CE 3.56Å; C886-M889 PolarHBondContact O-N 2.69Å; M889-M891 PolarHBondContact O-N 3.18Å; M889-F893 HydrophobicContact CE-CD2 3.8Å; M889-F893 HydrophobicContact CE-CE2 3.95Å; M889-F893 PolarHBondContact O-N 3Å; M889-F893 VanDerWaalsContact O-N 3.1Å; M889-F893 HydrophobicContact SD-CB 3.57Å; M889-F893 VanDerWaalsContact SD-CB 3.57Å; M889-F893 HydrophobicContact SD-CD1 4.47Å; M889-F893 HydrophobicContact SD-CD2 3.19Å; M889-F893 WeakPolarHBondContact SD-CD2 3.18Å; M889-F893 HydrophobicContact SD-CE2 3.93Å; M889-F893 HydrophobicContact SD-CG 3.51Å; M889-F893 VanDerWaalsContact SD-CG 3.51Å; M889-M894 PolarHBondContact O-N 3.19Å; M889-M894 VanDerWaalsContact O-N 3.13Å
890	R	63.3	Low	70.3	Confident	119 Å²	119	30 Å²	30	45%	0.449	14%	0.14	S	C	.	.	H	α-helix	trans	-64.9	-35.4	-179.8	-69.9	-172	-177.9	169	9	113.6	E803 D888 M894	E803-R890 HydrophobicContact CG-CG 4Å; E803-R890 WeakPolarHBondContact OE1-CD 3.45Å; E803-R890 IonicContact OE1-CZ 2.77Å; E803-R890 IonicContact OE1-NE 3.98Å; E803-R890 PolarHBondContact OE1-NE 3.49Å; E803-R890 IonicContact OE1-NH1 3.79Å; E803-R890 IonicContact OE1-NH2 2.76Å; D888-R890 PolarHBondContact O-N 3.21Å; R890-M894 HydrophobicContact CB-SD 4.2Å; R890-M894 HydrophobicContact CG-CE 4.33Å; R890-M894 HydrophobicContact CG-SD 3.76Å; R890-M894 WeakPolarHBondContact O-CB 3.29Å
891	M	60.7	Low	70.3	Confident	121 Å²	121	30 Å²	30	60%	0.596	14%	0.14	S	C	*	.	H	α-helix	trans	-90.8	-36.5	-178.6	-68.6	-62.3	-179.2	0	0	110.8	V560 D888 M889 S895	V560-M891 HydrophobicContact CG2-CB 3.83Å; V560-M891 HydrophobicContact CG2-CG 4.27Å; D888-M891 HydrophobicContact CB-CB 4.48Å; D888-M891 PolarHBondContact O-N 2.92Å; M889-M891 PolarHBondContact O-N 3.18Å; M891-S895 PolarHBondContact O-OG 3.35Å
892	T	63.1	Low	70.2	Confident	5 Å²	5	30 Å²	30	3%	0.031	14%	0.14	C	C	.	.	I	π-helix	trans	-84.1	-55.7	-171.4	-33.7	0	0	0	0	112.6	S885 D888 H897 L900	S885-T892 WeakPolarHBondContact O-CB 3.33Å; S885-T892 PolarHBondContact O-OG1 3.49Å; S885-T892 WeakPolarHBondContact OG-CG2 3.19Å; D888-T892 PolarHBondContact O-N 3.5Å; D888-T892 PolarHBondContact O-OG1 3.43Å; T892-H897 HydrophobicContact CG2-CB 4.48Å; T892-H897 CarbonylContact O-C 3.59Å; T892-H897 WeakPolarHBondContact O-CA 3.45Å; T892-H897 WeakPolarHBondContact O-CB 3.38Å; T892-H897 PolarHBondContact O-N 2.99Å; T892-L900 HydrophobicContact CG2-CD1 3.25Å
893	F	61.2	Low	70.2	Confident	14 Å²	14	29.6 Å²	29.6	6%	0.061	14%	0.138	C	C	.	.	I	π-helix	trans	-95.2	-26.6	-176.5	-68.5	-93.7	0	0	0	113.9	L882 C886 M889 I901	L882-F893 HydrophobicContact CD1-CE1 4.44Å; L882-F893 HydrophobicContact CD1-CZ 3.85Å; C886-F893 HydrophobicContact CB-CE2 4.35Å; C886-F893 WeakPolarHBondContact SG-CE2 3.27Å; M889-F893 HydrophobicContact CE-CD2 3.8Å; M889-F893 HydrophobicContact CE-CE2 3.95Å; M889-F893 PolarHBondContact O-N 3Å; M889-F893 VanDerWaalsContact O-N 3.1Å; M889-F893 HydrophobicContact SD-CB 3.57Å; M889-F893 VanDerWaalsContact SD-CB 3.57Å; M889-F893 HydrophobicContact SD-CD1 4.47Å; M889-F893 HydrophobicContact SD-CD2 3.19Å; M889-F893 WeakPolarHBondContact SD-CD2 3.18Å; M889-F893 HydrophobicContact SD-CE2 3.93Å; M889-F893 HydrophobicContact SD-CG 3.51Å; M889-F893 VanDerWaalsContact SD-CG 3.51Å; F893-I901 HydrophobicContact CD1-CD1 4.16Å; F893-I901 HydrophobicContact CD1-CG1 4.25Å; F893-I901 HydrophobicContact CE1-CD1 3.82Å; F893-I901 HydrophobicContact CE1-CG1 3.46Å; F893-I901 VanDerWaalsContact CE1-CG1 3.46Å; F893-I901 HydrophobicContact CZ-CG1 4.35Å
894	M	56.8	Low	70.3	Confident	34 Å²	34	29.6 Å²	29.6	17%	0.167	14%	0.138	C	C	.	.	I	π-helix	trans	-86.9	-15.6	-175.4	-63.7	175.6	50.6	0	0	113.6	R373 H806 Y840 M889 R890	R373-M894 PolarHBondContact NH2-O 2.85Å; H806-M894 VanDerWaalsContact CE1-SD 3.52Å; Y840-M894 HydrophobicContact CD1-CB 3.79Å; Y840-M894 HydrophobicContact CD1-CE 3.73Å; Y840-M894 HydrophobicContact CD1-CG 3.51Å; Y840-M894 HydrophobicContact CD1-SD 4.2Å; Y840-M894 HydrophobicContact CD2-CE 3.63Å; Y840-M894 HydrophobicContact CE1-CB 3.5Å; Y840-M894 HydrophobicContact CE1-CE 3.72Å; Y840-M894 HydrophobicContact CE1-CG 3.79Å; Y840-M894 HydrophobicContact CE2-CE 3.7Å; Y840-M894 HydrophobicContact CG-CE 3.62Å; Y840-M894 HydrophobicContact CG-CG 4.15Å; Y840-M894 HydrophobicContact CG-SD 4.28Å; M889-M894 PolarHBondContact O-N 3.19Å; M889-M894 VanDerWaalsContact O-N 3.13Å; R890-M894 HydrophobicContact CB-SD 4.2Å; R890-M894 HydrophobicContact CG-CE 4.33Å; R890-M894 HydrophobicContact CG-SD 3.76Å; R890-M894 WeakPolarHBondContact O-CB 3.29Å
895	S	59.5	Low	70.4	Confident	62 Å²	62	29.3 Å²	29.3	43%	0.434	14%	0.136	S	C	.	.	I	π-helix	trans	-99.6	-73	-176	83.3	0	0	0	0	113.2	M891	M891-S895 PolarHBondContact O-OG 3.35Å
896	R	65.4	Low	70.5	Confident	161 Å²	161	29.4 Å²	29.4	61%	0.608	14%	0.136	S	C	*	.	I	π-helix	trans	-156.7	-0.2	-164.3	-61.2	-173.5	180	173.9	-0.6	116.1	F411	F411-R896 HydrophobicContact CD2-CB 4.29Å; F411-R896 HydrophobicContact CD2-CG 4.44Å; F411-R896 HydrophobicContact CE2-CB 4.03Å; F411-R896 HydrophobicContact CE2-CG 4.09Å; F411-R896 HydrophobicContact CZ-CB 4.28Å
897	H	67	Low	70.7	Confident	18 Å²	18	29.6 Å²	29.6	8%	0.083	14%	0.138	C	C	.	.			trans	-116.8	34.9	-167.5	-56.5	-74.5	0	0	0	114.4	Q520 F561 T892 Y899 L900	Q520-H897 PolarHBondContact OE1-CE1 2.88Å; F561-H897 AromaticContact CZ-CD2 3.97Å; F561-H897 AromaticContact CZ-CE1 3.63Å; F561-H897 AromaticContact CZ-ND1 3.91Å; F561-H897 AromaticContact CZ-NE2 3.66Å; T892-H897 HydrophobicContact CG2-CB 4.48Å; T892-H897 CarbonylContact O-C 3.59Å; T892-H897 WeakPolarHBondContact O-CA 3.45Å; T892-H897 WeakPolarHBondContact O-CB 3.38Å; T892-H897 PolarHBondContact O-N 2.99Å; H897-Y899 HydrophobicContact CB-CE1 4.23Å; H897-Y899 AromaticContact ND1-CE1 3.63Å; H897-Y899 AromaticContact ND1-CZ 3.47Å; H897-Y899 PolarHBondContact ND1-OH 3.13Å; H897-Y899 PolarHBondContact O-N 3.24Å; H897-L900 HydrophobicContact CB-CD1 4Å; H897-L900 HydrophobicContact CB-CG 4.47Å; H897-L900 WeakPolarHBondContact O-CG 3.35Å; H897-L900 PolarHBondContact O-N 3.48Å; H897-L900 VanDerWaalsContact O-N 3.12Å
898	D	69.7	Low	71.1	Confident	20 Å²	20	29.2 Å²	29.2	11%	0.107	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-61.3	-18.8	-179	-51.2	-15.8	0	0	0	113.4	Y380 L900 I901	Y380-D898 HydrophobicContact CE2-CB 4.38Å; Y380-D898 VanDerWaalsContact OH-CB 3.28Å; Y380-D898 WeakPolarHBondContact OH-CB 3.36Å; Y380-D898 PolarHBondContact OH-O 3.33Å; Y380-D898 VanDerWaalsContact OH-O 3.12Å; D898-L900 PolarHBondContact O-N 3.26Å; D898-I901 WeakPolarHBondContact O-CD1 3.29Å; D898-I901 WeakPolarHBondContact O-CG1 3.41Å; D898-I901 PolarHBondContact O-N 3.14Å
899	Y	74.4	Confident	71.4	Confident	4 Å²	4	29.2 Å²	29.2	2%	0.016	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-65.5	-14.8	176.5	59	-104.7	0	0	0	113.5	M414 I489 L524 H897 I901 F902	M414-Y899 HydrophobicContact CE-CD1 4.22Å; M414-Y899 HydrophobicContact CE-CG 4.13Å; M414-Y899 HydrophobicContact SD-CD1 4.46Å; I489-Y899 HydrophobicContact CD1-CD2 3.25Å; I489-Y899 HydrophobicContact CD1-CE2 3.39Å; I489-Y899 HydrophobicContact CD1-CG 4.36Å; L524-Y899 HydrophobicContact CD1-CE2 4.34Å; H897-Y899 HydrophobicContact CB-CE1 4.23Å; H897-Y899 AromaticContact ND1-CE1 3.63Å; H897-Y899 AromaticContact ND1-CZ 3.47Å; H897-Y899 PolarHBondContact ND1-OH 3.13Å; H897-Y899 PolarHBondContact O-N 3.24Å; Y899-I901 PolarHBondContact O-N 3.48Å; Y899-F902 VanDerWaalsContact O-CD2 3.27Å; Y899-F902 WeakPolarHBondContact O-CD2 3.47Å; Y899-F902 PolarHBondContact O-N 2.89Å; Y899-F902 VanDerWaalsContact O-N 3.15Å
900	L	75.3	Confident	71.8	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-65.2	-19	176.1	-69.6	170.9	0	0	0	112.6	L524 F564 T892 H897 D898 F902 Y903	L524-L900 HydrophobicContact CD2-CD2 3.86Å; F564-L900 HydrophobicContact CE2-CD1 4.12Å; F564-L900 HydrophobicContact CZ-CD1 3.98Å; T892-L900 HydrophobicContact CG2-CD1 3.25Å; H897-L900 HydrophobicContact CB-CD1 4Å; H897-L900 HydrophobicContact CB-CG 4.47Å; H897-L900 WeakPolarHBondContact O-CG 3.35Å; H897-L900 PolarHBondContact O-N 3.48Å; H897-L900 VanDerWaalsContact O-N 3.12Å; D898-L900 PolarHBondContact O-N 3.26Å; L900-F902 PolarHBondContact O-N 3.38Å; L900-Y903 HydrophobicContact CD2-CD2 3.95Å; L900-Y903 HydrophobicContact CD2-CE2 3.63Å; L900-Y903 WeakPolarHBondContact O-CD2 3.38Å; L900-Y903 PolarHBondContact O-N 3.22Å
901	I	81.4	Confident	72.1	Confident	7 Å²	7	25.5 Å²	25.5	4%	0.036	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-60.2	-29.9	174.2	-62.3	161.4	0	0	0	111.4	Y380 W422 L847 L882 F893 D898 Y899 Y903 I904	Y380-I901 HydrophobicContact CE1-CD1 4.45Å; Y380-I901 HydrophobicContact CE2-CD1 4.22Å; W422-I901 HydrophobicContact CH2-CG2 3.68Å; W422-I901 HydrophobicContact CZ2-CG2 3.98Å; L847-I901 HydrophobicContact CD1-CD1 3.56Å; L882-I901 HydrophobicContact CD1-CG1 4.39Å; F893-I901 HydrophobicContact CD1-CD1 4.16Å; F893-I901 HydrophobicContact CD1-CG1 4.25Å; F893-I901 HydrophobicContact CE1-CD1 3.82Å; F893-I901 HydrophobicContact CE1-CG1 3.46Å; F893-I901 VanDerWaalsContact CE1-CG1 3.46Å; F893-I901 HydrophobicContact CZ-CG1 4.35Å; D898-I901 WeakPolarHBondContact O-CD1 3.29Å; D898-I901 WeakPolarHBondContact O-CG1 3.41Å; D898-I901 PolarHBondContact O-N 3.14Å; Y899-I901 PolarHBondContact O-N 3.48Å; I901-Y903 PolarHBondContact O-N 3Å; I901-Y903 VanDerWaalsContact O-N 3.1Å; I901-I904 HydrophobicContact CG2-CG2 4.4Å; I901-I904 VanDerWaalsContact O-CB 3.28Å; I901-I904 WeakPolarHBondContact O-CB 3.35Å; I901-I904 WeakPolarHBondContact O-CG2 3.35Å; I901-I904 PolarHBondContact O-N 3.12Å
902	F	80.8	Confident	72.8	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.095	C	C	.	.	G	3₁₀ helix	trans	-65	-16.7	-177.5	-69.2	-74.6	0	0	0	113.7	Y380 A418 T419 W422 L452 V456 Y899 L900 I904 T905	Y380-F902 HydrophobicContact CE1-CE2 4.18Å; Y380-F902 AromaticContact CE1-CZ 3.98Å; Y380-F902 HydrophobicContact CE1-CZ 3.98Å; A418-F902 HydrophobicContact CB-CD2 4.43Å; A418-F902 HydrophobicContact CB-CE1 3.73Å; A418-F902 HydrophobicContact CB-CE2 3.62Å; A418-F902 HydrophobicContact CB-CZ 3.22Å; T419-F902 HydrophobicContact CG2-CZ 4.35Å; W422-F902 HydrophobicContact CD2-CD1 4.37Å; W422-F902 AromaticContact CD2-CE1 4Å; W422-F902 HydrophobicContact CD2-CE1 4Å; W422-F902 AromaticContact CE2-CD1 3.53Å; W422-F902 AromaticContact CE2-CE1 3.58Å; W422-F902 HydrophobicContact CE3-CE1 4.47Å; W422-F902 HydrophobicContact CH2-CD1 4.43Å; W422-F902 HydrophobicContact CH2-CE1 4.17Å; W422-F902 AromaticContact CZ2-CD1 3.56Å; W422-F902 HydrophobicContact CZ2-CD1 3.56Å; W422-F902 AromaticContact CZ2-CE1 3.68Å; W422-F902 HydrophobicContact CZ2-CE1 3.68Å; W422-F902 HydrophobicContact CZ2-CG 4.33Å; W422-F902 AromaticContact NE1-CD1 3.56Å; W422-F902 AromaticContact NE1-CE1 3.92Å; L452-F902 HydrophobicContact CD2-CB 4.4Å; L452-F902 HydrophobicContact CD2-CD2 3.24Å; L452-F902 HydrophobicContact CD2-CE2 3.54Å; L452-F902 HydrophobicContact CD2-CG 3.82Å; L452-F902 HydrophobicContact CD2-CZ 4.33Å; L452-F902 HydrophobicContact CG-CD2 4.27Å; L452-F902 HydrophobicContact CG-CG 4.41Å; V456-F902 HydrophobicContact CG2-CB 4.32Å; V456-F902 HydrophobicContact CG2-CD1 3.85Å; V456-F902 HydrophobicContact CG2-CG 4.39Å; Y899-F902 VanDerWaalsContact O-CD2 3.27Å; Y899-F902 WeakPolarHBondContact O-CD2 3.47Å; Y899-F902 PolarHBondContact O-N 2.89Å; Y899-F902 VanDerWaalsContact O-N 3.15Å; L900-F902 PolarHBondContact O-N 3.38Å; F902-I904 PolarHBondContact O-N 3.26Å; F902-T905 VanDerWaalsContact O-CB 3.31Å; F902-T905 WeakPolarHBondContact O-CB 3.41Å; F902-T905 PolarHBondContact O-N 2.63Å; F902-T905 VanDerWaalsContact O-N 3.1Å; F902-T905 PolarHBondContact O-OG1 3.22Å
903	Y	80.4	Confident	73.3	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	9%	0.094	C	C	.	.	G	3₁₀ helix	trans	-65.9	-9.6	168.9	-72.7	-63.1	0	0	0	113.9	I489 V493 L524 L527 S528 L531 G878 I881 L900 I901 T905 P906	I489-Y903 HydrophobicContact CD1-CE2 4.41Å; I489-Y903 HydrophobicContact CG1-CE2 4.25Å; I489-Y903 WeakPolarHBondContact CG1-OH 3.4Å; I489-Y903 HydrophobicContact CG2-CD1 4.46Å; I489-Y903 HydrophobicContact CG2-CE1 3.97Å; I489-Y903 HydrophobicContact CG2-CE2 4.13Å; V493-Y903 HydrophobicContact CG2-CD1 3.85Å; V493-Y903 HydrophobicContact CG2-CE1 4.23Å; L524-Y903 HydrophobicContact CD2-CE2 4.36Å; L527-Y903 HydrophobicContact CD2-CD2 4.46Å; L527-Y903 HydrophobicContact CD2-CE1 4.42Å; L527-Y903 HydrophobicContact CD2-CE2 3.83Å; S528-Y903 PolarHBondContact OG-OH 2.99Å; L531-Y903 HydrophobicContact CD1-CD1 3.42Å; L531-Y903 VanDerWaalsContact CD1-CD1 3.42Å; L531-Y903 HydrophobicContact CD1-CE1 3.4Å; L531-Y903 VanDerWaalsContact CD1-CE1 3.4Å; G878-Y903 WeakPolarHBondContact CA-O 3.37Å; I881-Y903 HydrophobicContact CD1-CD1 4.28Å; I881-Y903 HydrophobicContact CD1-CG 4.4Å; I881-Y903 HydrophobicContact CG2-CD2 3.65Å; I881-Y903 HydrophobicContact CG2-CE2 4.32Å; I881-Y903 HydrophobicContact CG2-CG 3.81Å; L900-Y903 HydrophobicContact CD2-CD2 3.95Å; L900-Y903 HydrophobicContact CD2-CE2 3.63Å; L900-Y903 WeakPolarHBondContact O-CD2 3.38Å; L900-Y903 PolarHBondContact O-N 3.22Å; I901-Y903 PolarHBondContact O-N 3Å; I901-Y903 VanDerWaalsContact O-N 3.1Å; Y903-T905 VanDerWaalsContact C-N 3.27Å; Y903-P906 VanDerWaalsContact O-CD 3.23Å; Y903-P906 WeakPolarHBondContact O-CD 3.3Å
904	I	82.7	Confident	73.9	Confident	3 Å²	3	19.3 Å²	19.3	2%	0.015	9%	0.093	C	C	.	.	G	3₁₀ helix	trans	-72.9	-21	170.8	-152.2	175.6	0	0	0	112.6	W422 L851 L861 L879 L882 I901 F902 P906 A907	W422-I904 HydrophobicContact CZ2-CG2 4.22Å; L851-I904 HydrophobicContact CD2-CD1 4.13Å; L861-I904 HydrophobicContact CD1-CD1 3.6Å; L861-I904 HydrophobicContact CD1-CG1 4.29Å; L861-I904 HydrophobicContact CD2-CD1 3.97Å; L861-I904 HydrophobicContact CD2-CG1 3.86Å; L861-I904 HydrophobicContact CG-CD1 4.46Å; L879-I904 HydrophobicContact CD2-CG1 4.31Å; L882-I904 HydrophobicContact CD2-CD1 3.83Å; L882-I904 HydrophobicContact CD2-CG1 4.29Å; I901-I904 HydrophobicContact CG2-CG2 4.4Å; I901-I904 VanDerWaalsContact O-CB 3.28Å; I901-I904 WeakPolarHBondContact O-CB 3.35Å; I901-I904 WeakPolarHBondContact O-CG2 3.35Å; I901-I904 PolarHBondContact O-N 3.12Å; F902-I904 PolarHBondContact O-N 3.26Å; I904-P906 VanDerWaalsContact C-CD 3.48Å; I904-A907 WeakPolarHBondContact O-CA 3.3Å; I904-A907 VanDerWaalsContact O-CB 3.31Å; I904-A907 WeakPolarHBondContact O-CB 3.3Å; I904-A907 PolarHBondContact O-N 2.89Å
905	T	80.1	Confident	74.8	Confident	2 Å²	2	17.9 Å²	17.9	1%	0.012	9%	0.085	C	C	.	.	G	3₁₀ helix	trans	-54.6	-43.4	-173.2	-48.6	0	0	0	0	113	W422 L425 V456 C459 V493 F902 Y903 A907 I908	W422-T905 PolarHBondContact NE1-OG1 2.98Å; W422-T905 VanDerWaalsContact NE1-OG1 3.08Å; L425-T905 HydrophobicContact CD1-CG2 3.58Å; V456-T905 HydrophobicContact CG1-CG2 3.78Å; C459-T905 HydrophobicContact CB-CG2 3.77Å; V493-T905 HydrophobicContact CG1-CG2 4.41Å; F902-T905 VanDerWaalsContact O-CB 3.31Å; F902-T905 WeakPolarHBondContact O-CB 3.41Å; F902-T905 PolarHBondContact O-N 2.63Å; F902-T905 VanDerWaalsContact O-N 3.1Å; F902-T905 PolarHBondContact O-OG1 3.22Å; Y903-T905 VanDerWaalsContact C-N 3.27Å; T905-A907 PolarHBondContact O-N 2.95Å; T905-A907 VanDerWaalsContact O-N 3.15Å; T905-I908 WeakPolarHBondContact O-CB 3.36Å; T905-I908 PolarHBondContact O-N 3.19Å; T905-I908 VanDerWaalsContact O-N 3.08Å
906	P	76.5	Confident	75.5	Confident	2 Å²	2	15 Å²	15	1%	0.013	7%	0.065	C	C	.	.	G	3₁₀ helix	trans	-66.7	-14	177.7	-19.2	33.4	0	0	0	115	V493 A496 R872 V874 Y903 I904	V493-P906 HydrophobicContact CG1-CG 4.17Å; A496-P906 HydrophobicContact CB-CB 4.29Å; A496-P906 HydrophobicContact CB-CG 4.21Å; R872-P906 PolarHBondContact NH2-O 3.44Å; V874-P906 HydrophobicContact CG1-CB 3.48Å; V874-P906 VanDerWaalsContact CG1-CB 3.48Å; Y903-P906 VanDerWaalsContact O-CD 3.23Å; Y903-P906 WeakPolarHBondContact O-CD 3.3Å; I904-P906 VanDerWaalsContact C-CD 3.48Å
907	A	78.9	Confident	75.8	Confident	5 Å²	5	8.9 Å²	8.9	4%	0.041	5%	0.045	C	C	.	.	G	3₁₀ helix	trans	-89.4	-12.7	175.2	0	0	0	0	0	113.2	L861 L879 I904 T905 Q909	L861-A907 WeakPolarHBondContact CA-O 3.2Å; L861-A907 HydrophobicContact CD2-CB 4.21Å; L879-A907 HydrophobicContact CD2-CB 4.34Å; L879-A907 HydrophobicContact CG-CB 3.99Å; I904-A907 WeakPolarHBondContact O-CA 3.3Å; I904-A907 VanDerWaalsContact O-CB 3.31Å; I904-A907 WeakPolarHBondContact O-CB 3.3Å; I904-A907 PolarHBondContact O-N 2.89Å; T905-A907 PolarHBondContact O-N 2.95Å; T905-A907 VanDerWaalsContact O-N 3.15Å; A907-Q909 PolarHBondContact O-N 2.91Å
908	I	80.2	Confident	75.8	Confident	10 Å²	10	11.3 Å²	11.3	5%	0.051	6%	0.056	C	C	.	.			trans	-75.2	113.2	178.8	-60.1	176.7	0	0	0	109.1	L425 L854 L859 L861 T905	L425-I908 HydrophobicContact CD2-CG2 4.1Å; L854-I908 HydrophobicContact CD1-CD1 4.44Å; L854-I908 HydrophobicContact CD2-CG1 4.4Å; L854-I908 HydrophobicContact CD2-CG2 4.39Å; L859-I908 HydrophobicContact CB-CG2 4.01Å; L859-I908 HydrophobicContact CD1-CG2 3.7Å; L859-I908 HydrophobicContact CD2-CG2 4.17Å; L859-I908 HydrophobicContact CG-CG2 4.16Å; L861-I908 HydrophobicContact CD2-CG1 3.79Å; T905-I908 WeakPolarHBondContact O-CB 3.36Å; T905-I908 PolarHBondContact O-N 3.19Å; T905-I908 VanDerWaalsContact O-N 3.08Å
909	Q	75	Confident	75.5	Confident	25 Å²	25	16.2 Å²	16.2	12%	0.117	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	141.4	178.2	-173.9	177.7	-9.5	0	0	110.8	L859 T860 A907	L859-Q909 CarbonylContact C-O 3.47Å; L859-Q909 WeakPolarHBondContact CA-O 3.49Å; T860-Q909 PolarHBondContact N-O 3.02Å; T860-Q909 PolarHBondContact O-N 3.4Å; T860-Q909 PolarHBondContact OG1-O 3.13Å; A907-Q909 PolarHBondContact O-N 2.91Å
910	P	74.6	Confident	75	Confident	11 Å²	11	17.5 Å²	17.5	7%	0.071	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	133	174.9	31	-28.8	0	0	0	111.9	L330 F334 W426 L859 L912	L330-P910 HydrophobicContact CD1-CG 4.16Å; F334-P910 HydrophobicContact CD2-CB 4.1Å; F334-P910 HydrophobicContact CE2-CB 4.31Å; W426-P910 HydrophobicContact CH2-CB 4.06Å; W426-P910 HydrophobicContact CH2-CG 3.68Å; W426-P910 HydrophobicContact CZ3-CB 4.34Å; W426-P910 HydrophobicContact CZ3-CG 4.07Å; L859-P910 HydrophobicContact CD2-CB 3.85Å; P910-L912 HydrophobicContact CB-CD2 3.97Å; P910-L912 HydrophobicContact CB-CG 4.5Å; P910-L912 HydrophobicContact CG-CD2 3.95Å; P910-L912 PolarHBondContact O-N 3.49Å
911	R	71.3	Confident	74.8	Confident	31 Å²	31	24.3 Å²	24.3	12%	0.117	12%	0.119	C	C	.	.			trans	-80.2	45.3	178	-54.8	179	79.3	120.8	27.5	112.8	T858 T860 L956 L957	T858-R911 PolarHBondContact O-N 3.46Å; T860-R911 HydrophobicContact CG2-CG 3.3Å; T860-R911 WeakPolarHBondContact OG1-CG 3.26Å; R911-L956 HydrophobicContact CB-CD2 4.37Å; R911-L956 WeakPolarHBondContact O-CA 3.5Å; R911-L956 WeakPolarHBondContact O-CD2 3.38Å; R911-L957 PolarHBondContact NE-O 3.13Å; R911-L957 PolarHBondContact NH2-O 3.05Å; R911-L957 PolarHBondContact O-N 3.12Å
912	L	73.7	Confident	74.4	Confident	3 Å²	3	28 Å²	28	2%	0.016	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	142	-173.8	68.4	88.2	0	0	0	111.6	L337 P910 M914 G980 F981	L337-L912 HydrophobicContact CD1-CB 3.71Å; P910-L912 HydrophobicContact CB-CD2 3.97Å; P910-L912 HydrophobicContact CB-CG 4.5Å; P910-L912 HydrophobicContact CG-CD2 3.95Å; P910-L912 PolarHBondContact O-N 3.49Å; L912-M914 HydrophobicContact CD1-CB 3.91Å; L912-M914 HydrophobicContact CD1-CG 3.98Å; L912-G980 WeakPolarHBondContact O-CA 3.29Å; L912-G980 PolarHBondContact O-N 3.31Å; L912-F981 HydrophobicContact CD1-CD1 3.59Å; L912-F981 HydrophobicContact CD1-CE1 3.33Å; L912-F981 HydrophobicContact CD1-CE2 4.38Å; L912-F981 HydrophobicContact CD1-CG 4.26Å; L912-F981 HydrophobicContact CD1-CZ 3.77Å; L912-F981 HydrophobicContact CD2-CE1 3.94Å; L912-F981 HydrophobicContact CD2-CZ 3.73Å; L912-F981 HydrophobicContact CG-CE1 4.32Å; L912-F981 HydrophobicContact CG-CZ 4.39Å
913	L	73.6	Confident	73.9	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	108.3	155.6	178.6	65.4	0	0	0	107.5	V927 T953 P954 V955 L957 A963 L978 G980 I982	L913-V927 HydrophobicContact CD2-CB 4.42Å; L913-V927 HydrophobicContact CD2-CG1 3.82Å; L913-V927 HydrophobicContact CD2-CG2 4.14Å; L913-T953 HydrophobicContact CD2-CG2 4.29Å; L913-T953 HydrophobicContact CG-CG2 4.23Å; L913-P954 WeakPolarHBondContact O-CA 3.32Å; L913-V955 PolarHBondContact N-O 3.47Å; L913-V955 PolarHBondContact O-N 2.87Å; L913-V955 VanDerWaalsContact O-N 3.14Å; L913-L957 HydrophobicContact CB-CD1 4.06Å; L913-L957 HydrophobicContact CB-CG 4.14Å; L913-L957 HydrophobicContact CD2-CD1 4.5Å; L913-L957 HydrophobicContact CD2-CD2 4.33Å; L913-A963 HydrophobicContact CD2-CB 3.58Å; L913-L978 HydrophobicContact CD1-CB 4.16Å; L913-G980 WeakPolarHBondContact CA-O 3.44Å; L913-I982 HydrophobicContact CD1-CD1 3.36Å; L913-I982 HydrophobicContact CD1-CG1 4.01Å
914	M	75.4	Confident	73.8	Confident	8 Å²	8	35.2 Å²	35.2	4%	0.039	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	133	177.4	-81.8	-69.6	-85.4	0	0	109.3	S336 L912 P922 P954 G980 F981 I982	S336-M914 WeakPolarHBondContact OG-CE 3.49Å; L912-M914 HydrophobicContact CD1-CB 3.91Å; L912-M914 HydrophobicContact CD1-CG 3.98Å; M914-P922 HydrophobicContact CE-CB 4.16Å; M914-P954 HydrophobicContact CG-CB 4.29Å; M914-P954 HydrophobicContact SD-CB 3.38Å; M914-P954 WeakPolarHBondContact SD-CB 3.42Å; M914-P954 HydrophobicContact SD-CG 3.71Å; M914-G980 PolarHBondContact N-O 3.26Å; M914-G980 VanDerWaalsContact O-O 3.08Å; M914-F981 HydrophobicContact CB-CD1 3.83Å; M914-F981 HydrophobicContact CB-CE1 4.09Å; M914-F981 HydrophobicContact CG-CE1 4.5Å; M914-F981 WeakPolarHBondContact O-CA 3.48Å; M914-I982 PolarHBondContact O-N 3.45Å
915	T	75.6	Confident	73.7	Confident	3 Å²	3	35.3 Å²	35.3	2%	0.018	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	127.1	-179.3	44.5	0	0	0	0	109.8	S923 T953 I982 L984	T915-S923 PolarHBondContact O-N 2.71Å; T915-S923 PolarHBondContact OG1-O 3.18Å; T915-T953 HydrophobicContact CG2-CG2 3.72Å; T915-T953 WeakPolarHBondContact OG1-CB 3.48Å; T915-T953 PolarHBondContact OG1-OG1 2.94Å; T915-I982 CarbonylContact C-O 3.5Å; T915-I982 WeakPolarHBondContact CA-O 3.27Å; T915-I982 HydrophobicContact CG2-CB 4.44Å; T915-L984 HydrophobicContact CG2-CD1 3.57Å; T915-L984 HydrophobicContact CG2-CD2 4.44Å; T915-L984 HydrophobicContact CG2-CG 3.92Å
916	F	74.4	Confident	73.8	Confident	3 Å²	3	37.7 Å²	37.7	1%	0.013	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	147.7	176.6	-64	-67.2	0	0	0	110.1	Y301 H333 K921 P922 F981 I982 L983 L984	Y301-F916 HydrophobicContact CE2-CD2 4.45Å; H333-F916 AromaticContact CD2-CZ 3.91Å; H333-F916 AromaticContact CE1-CE1 3.78Å; H333-F916 AromaticContact CE1-CZ 3.37Å; H333-F916 WeakPolarHBondContact CE1-CZ 3.37Å; H333-F916 AromaticContact CG-CZ 3.85Å; H333-F916 AromaticContact ND1-CE1 3.97Å; H333-F916 AromaticContact ND1-CZ 3.51Å; H333-F916 AromaticContact NE2-CZ 3.6Å; F916-K921 WeakPolarHBondContact CA-O 3.29Å; F916-P922 HydrophobicContact CD1-CB 4.31Å; F916-P922 HydrophobicContact CE1-CB 4.26Å; F916-F981 HydrophobicContact CD2-CB 4.22Å; F916-F981 HydrophobicContact CD2-CD1 4.27Å; F916-F981 HydrophobicContact CE2-CB 3.89Å; F916-F981 AromaticContact CE2-CD1 3.26Å; F916-F981 HydrophobicContact CE2-CD1 3.26Å; F916-F981 AromaticContact CE2-CE1 3.98Å; F916-F981 HydrophobicContact CE2-CE1 3.98Å; F916-F981 AromaticContact CE2-CG 3.82Å; F916-F981 HydrophobicContact CE2-CG 3.82Å; F916-F981 AromaticContact CZ-CD1 3.84Å; F916-F981 HydrophobicContact CZ-CD1 3.84Å; F916-F981 HydrophobicContact CZ-CE1 4.11Å; F916-I982 PolarHBondContact N-O 2.81Å; F916-L983 HydrophobicContact CB-CD2 3.72Å; F916-L983 CarbonylContact O-C 3.5Å; F916-L983 WeakPolarHBondContact O-CA 3.38Å; F916-L984 PolarHBondContact O-N 2.7Å
917	D	72	Confident	74	Confident	32 Å²	32	37.7 Å²	37.7	17%	0.171	20%	0.198	C	C	.	.			trans	-77	173.3	168	-152.5	-12.3	0	0	0	110.8	D919 L920 K921 L983	D917-D919 PolarHBondContact O-N 2.98Å; D917-L920 PolarHBondContact O-N 2.58Å; D917-K921 PolarHBondContact N-O 2.93Å; D917-L983 WeakPolarHBondContact O-CD2 3.11Å
918	E	66.9	Low	74.2	Confident	69 Å²	69	41.2 Å²	41.2	32%	0.322	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-27	175.3	-66.2	-176.2	170.9	0	0	112.6	R297 R985	R297-E918 PolarHBondContact NH1-O 2.87Å; E918-R985 VanDerWaalsContact OE1-CD 3.29Å; E918-R985 WeakPolarHBondContact OE1-CD 3.5Å; E918-R985 VanDerWaalsContact OE1-CG 3.23Å; E918-R985 WeakPolarHBondContact OE1-CG 3.42Å; E918-R985 IonicContact OE1-NE 3.88Å
919	D	61.7	Low	74.3	Confident	122 Å²	122	41.1 Å²	41.1	65%	0.652	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.4	15.7	177.4	-66.1	-28.2	0	0	0	114.1	D917 K921	D917-D919 PolarHBondContact O-N 2.98Å; D919-K921 PolarHBondContact O-N 3.21Å
920	L	64.3	Low	74.6	Confident	32 Å²	32	40.1 Å²	40.1	17%	0.168	21%	0.206	C	C	.	.	S	Bend	trans	60.8	14.1	178.9	-64.8	161.4	0	0	0	115	M324 D917 L983	M324-L920 HydrophobicContact SD-CD2 4.12Å; D917-L920 PolarHBondContact O-N 2.58Å; L920-L983 HydrophobicContact CD2-CD2 4.14Å
921	K	72.5	Confident	74.8	Confident	142 Å²	142	45.9 Å²	45.9	62%	0.617	23%	0.233	S	C	*	.			trans	-82.5	134.5	172.8	-70.7	176.5	-175.8	165.5	0	110.3	F916 D917 D919 S923	F916-K921 WeakPolarHBondContact CA-O 3.29Å; D917-K921 PolarHBondContact N-O 2.93Å; D919-K921 PolarHBondContact O-N 3.21Å; K921-S923 PolarHBondContact O-N 3.27Å
922	P	71.9	Confident	74.9	Confident	86 Å²	86	46 Å²	46	56%	0.558	24%	0.24	S	C	*	.	B	Isolated β-bridge	trans	-62	122.3	175.7	25.8	-32.6	0	0	0	109.2	M914 F916	M914-P922 HydrophobicContact CE-CB 4.16Å; F916-P922 HydrophobicContact CD1-CB 4.31Å; F916-P922 HydrophobicContact CE1-CB 4.26Å
923	S	71.5	Confident	74.8	Confident	23 Å²	23	48.2 Å²	48.2	16%	0.161	25%	0.254	C	S	.	.			trans	-107	126.6	176.4	-73	0	0	0	0	109.3	T915 K921 V925 T953	T915-S923 PolarHBondContact O-N 2.71Å; T915-S923 PolarHBondContact OG1-O 3.18Å; K921-S923 PolarHBondContact O-N 3.27Å; S923-V925 PolarHBondContact O-N 2.56Å; S923-T953 PolarHBondContact O-OG1 3.19Å
924	L	77.9	Confident	74.5	Confident	128 Å²	128	55.3 Å²	55.3	67%	0.67	29%	0.292	S	S	*	.			trans	-77.7	106.1	174.5	-58	175.9	0	0	0	108.5	T953	L924-T953 WeakPolarHBondContact CD2-O 3.11Å
925	V	79.1	Confident	74	Confident	5 Å²	5	59.4 Å²	59.4	3%	0.03	32%	0.317	C	S	.	.			trans	-122.3	141.1	-179.6	179.6	0	0	0	0	109.7	S923 T953 L965 Y970 L984	S923-V925 PolarHBondContact O-N 2.56Å; V925-T953 PolarHBondContact N-OG1 3.46Å; V925-T953 PolarHBondContact O-N 3.03Å; V925-T953 PolarHBondContact O-OG1 3.05Å; V925-T953 VanDerWaalsContact O-OG1 3.13Å; V925-L965 HydrophobicContact CG1-CD2 3.88Å; V925-Y970 HydrophobicContact CG1-CD2 4.15Å; V925-Y970 HydrophobicContact CG2-CD2 3.9Å; V925-Y970 HydrophobicContact CG2-CE2 4Å; V925-Y970 HydrophobicContact CG2-CG 4.21Å; V925-L984 HydrophobicContact CB-CD1 3.85Å; V925-L984 HydrophobicContact CG1-CD1 4.01Å; V925-L984 HydrophobicContact CG2-CD1 3.52Å
926	T	82.6	Confident	73.2	Confident	52 Å²	52	62.4 Å²	62.4	32%	0.319	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	125.3	177.2	50.9	0	0	0	0	111	H951 T952 A966 T967	T926-H951 CarbonylContact C-O 3.31Å; T926-H951 WeakPolarHBondContact CA-O 3.27Å; T926-T952 HydrophobicContact CG2-CG2 3.87Å; T926-A966 VanDerWaalsContact O-CB 3.3Å; T926-A966 WeakPolarHBondContact O-CB 3.32Å; T926-A966 PolarHBondContact O-N 3.3Å; T926-T967 WeakPolarHBondContact OG1-CG2 3.09Å
927	V	81.1	Confident	72.6	Confident	1 Å²	1	65 Å²	65	1%	0.006	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	135.3	-179.3	-179.9	0	0	0	0	109.3	L913 V929 T950 H951 T953 A963 E964 L965	L913-V927 HydrophobicContact CD2-CB 4.42Å; L913-V927 HydrophobicContact CD2-CG1 3.82Å; L913-V927 HydrophobicContact CD2-CG2 4.14Å; V927-V929 HydrophobicContact CG1-CG2 4.04Å; V927-T950 CarbonylContact O-C 3.56Å; V927-T950 WeakPolarHBondContact O-CA 3.12Å; V927-H951 PolarHBondContact N-O 3.43Å; V927-H951 PolarHBondContact O-N 3.17Å; V927-H951 VanDerWaalsContact O-O 3.05Å; V927-T953 HydrophobicContact CB-CG2 4.48Å; V927-T953 HydrophobicContact CG2-CG2 3.41Å; V927-T953 VanDerWaalsContact CG2-CG2 3.41Å; V927-A963 HydrophobicContact CG1-CB 3.41Å; V927-A963 VanDerWaalsContact CG1-CB 3.41Å; V927-E964 CarbonylContact C-O 3.48Å; V927-E964 WeakPolarHBondContact CA-O 3.36Å; V927-E964 WeakPolarHBondContact CG1-O 3.25Å; V927-L965 HydrophobicContact CG2-CD2 4.19Å
928	R	83	Confident	72.1	Confident	80 Å²	80	71.7 Å²	71.7	30%	0.302	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	118.4	166.8	-71.4	177.3	-172.6	158	7.6	108.7	I945 F948 Q949 T950 A963 E964 A966	R928-I945 WeakPolarHBondContact O-CD1 3.38Å; R928-F948 HydrophobicContact CB-CB 4.08Å; R928-F948 HydrophobicContact CB-CD2 4.43Å; R928-F948 HydrophobicContact CB-CG 4.46Å; R928-F948 HydrophobicContact CG-CD2 3.98Å; R928-F948 HydrophobicContact CG-CG 4.43Å; R928-Q949 CarbonylContact C-O 3.59Å; R928-Q949 WeakPolarHBondContact CA-O 3.03Å; R928-T950 HydrophobicContact CG-CG2 3.75Å; R928-A963 CarbonylContact O-C 3.56Å; R928-A963 WeakPolarHBondContact O-CA 3.38Å; R928-E964 PolarHBondContact N-O 3.35Å; R928-E964 PolarHBondContact O-N 3.12Å; R928-A966 HydrophobicContact CG-CB 3.97Å
929	V	81.6	Confident	71.4	Confident	7 Å²	7	73.4 Å²	73.4	4%	0.042	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	132.4	174.5	-177.2	0	0	0	0	108.5	V927 F948 Q949 V955 L957 E961 R962 A963	V927-V929 HydrophobicContact CG1-CG2 4.04Å; V929-F948 CarbonylContact O-C 3.58Å; V929-F948 VanDerWaalsContact O-CA 3.26Å; V929-F948 WeakPolarHBondContact O-CA 3.48Å; V929-Q949 PolarHBondContact N-O 2.9Å; V929-Q949 PolarHBondContact O-N 3.24Å; V929-V955 HydrophobicContact CG2-CG1 4.03Å; V929-L957 HydrophobicContact CG1-CD2 3.88Å; V929-L957 HydrophobicContact CG2-CD2 3.93Å; V929-E961 HydrophobicContact CG1-CB 3.78Å; V929-E961 HydrophobicContact CG1-CG 4.23Å; V929-R962 WeakPolarHBondContact CA-O 3.37Å; V929-A963 HydrophobicContact CG2-CB 4.27Å
930	G	81.9	Confident	71.1	Confident	4 Å²	4	71.2 Å²	71.2	4%	0.041	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.3	-173.4	173.5	0	0	0	0	0	111.7	A932 E961 R962	G930-A932 PolarHBondContact O-N 2.72Å; G930-E961 CarbonylContact O-C 3.57Å; G930-E961 WeakPolarHBondContact O-CA 3.16Å; G930-R962 PolarHBondContact N-O 3.4Å; G930-R962 PolarHBondContact O-N 2.79Å
931	Q	80.1	Confident	71	Confident	133 Å²	133	78.9 Å²	78.9	62%	0.621	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.6	130.1	-176.6	-174.7	173.8	-8.8	0	0	111.1	I945 T946	Q931-I945 WeakPolarHBondContact O-CA 3.34Å; Q931-T946 PolarHBondContact N-O 2.94Å; Q931-T946 PolarHBondContact O-N 3.44Å; Q931-T946 PolarHBondContact O-OG1 3.03Å
932	A	73.1	Confident	70.6	Confident	34 Å²	34	76.1 Å²	76.1	28%	0.281	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	131.6	177.4	0	0	0	0	0	111.1	G930 G960 R962	G930-A932 PolarHBondContact O-N 2.72Å; A932-G960 PolarHBondContact N-O 2.74Å; A932-R962 HydrophobicContact CB-CB 3.88Å
933	V	70.5	Confident	70.4	Confident	49 Å²	49	76.7 Å²	76.7	30%	0.297	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	139.1	171.4	-174.4	0	0	0	0	108.2	V935 V936 T944 T946	V933-V935 PolarHBondContact O-N 3.05Å; V933-V936 HydrophobicContact CB-CG2 3.85Å; V933-V936 HydrophobicContact CG1-CG2 3.38Å; V933-T944 PolarHBondContact N-O 2.72Å; V933-T944 CarbonylContact O-C 3.53Å; V933-T944 VanDerWaalsContact O-C 3.31Å; V933-T944 VanDerWaalsContact O-CA 3.22Å; V933-T944 WeakPolarHBondContact O-CA 3.36Å; V933-T946 HydrophobicContact CB-CG2 4.07Å; V933-T946 HydrophobicContact CG2-CG2 3.46Å; V933-T946 VanDerWaalsContact CG2-CG2 3.46Å; V933-T946 VanDerWaalsContact CG2-OG1 3.3Å; V933-T946 WeakPolarHBondContact CG2-OG1 3.21Å
934	D	66.9	Low	70.4	Confident	148 Å²	148	76.6 Å²	76.6	79%	0.791	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.7	-54	-170.3	-62.6	-30.4	0	0	0	113.3
935	V	64.9	Low	70.3	Confident	95 Å²	95	71 Å²	71	58%	0.576	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.5	115.9	175.6	-176	0	0	0	0	110.2	V933 P942	V933-V935 PolarHBondContact O-N 3.05Å; V935-P942 HydrophobicContact CG1-CB 3.75Å
936	V	59.7	Low	70.3	Confident	66 Å²	66	73 Å²	73	40%	0.4	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	123	169.4	-171.8	0	0	0	0	109	V933 K943 T946	V933-V936 HydrophobicContact CB-CG2 3.85Å; V933-V936 HydrophobicContact CG1-CG2 3.38Å; V936-K943 PolarHBondContact N-O 3.25Å; V936-K943 WeakPolarHBondContact O-CA 3.4Å; V936-K943 VanDerWaalsContact O-CB 3.23Å; V936-K943 WeakPolarHBondContact O-CB 3.43Å; V936-K943 PolarHBondContact O-N 3.38Å; V936-K943 VanDerWaalsContact O-O 3.04Å; V936-T946 HydrophobicContact CB-CG2 4.36Å; V936-T946 HydrophobicContact CG2-CG2 3.81Å
937	G	62.2	Low	69.9	Low	58 Å²	58	74 Å²	74	60%	0.598	44%	0.444	S	S	*	.	S	Bend	trans	154.6	178.3	175.6	0	0	0	0	0	114.2
938	Q	59.9	Low	69.6	Low	172 Å²	172	79 Å²	79	80%	0.804	47%	0.466	S	S	*	.	S	Bend	trans	-74.5	145.9	170.5	-68	176.4	-13.4	0	0	109.7	G940 R941	Q938-G940 PolarHBondContact O-N 3.06Å; Q938-G940 VanDerWaalsContact O-N 3.15Å; Q938-R941 PolarHBondContact O-N 3.42Å
939	A	53.5	Low	69.6	Low	105 Å²	105	81.6 Å²	81.6	87%	0.868	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	121.6	172.8	0	0	0	0	0	109.9
940	G	55.2	Low	69.7	Low	76 Å²	76	85.7 Å²	85.7	78%	0.784	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	114.2	-22.5	-178.9	0	0	0	0	0	115.4	Q938	Q938-G940 PolarHBondContact O-N 3.06Å; Q938-G940 VanDerWaalsContact O-N 3.15Å
941	R	62.6	Low	69.6	Low	192 Å²	192	89.1 Å²	89.1	73%	0.725	52%	0.522	S	S	*	.	S	Bend	trans	-141.5	77.1	170.2	-71.7	-170.6	179.4	-164.3	-3.2	110.2	Q938 K943	Q938-R941 PolarHBondContact O-N 3.42Å; R941-K943 PolarHBondContact O-N 3.06Å
942	P	62.7	Low	69.7	Low	85 Å²	85	87 Å²	87	55%	0.552	52%	0.518	S	S	*	.			trans	-63.6	125.3	176	28.2	-32.9	0	0	0	108.8	V935	V935-P942 HydrophobicContact CG1-CB 3.75Å
943	K	68.8	Low	69.8	Low	97 Å²	97	85.5 Å²	85.5	42%	0.422	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	140.1	167.3	-58.7	-177.8	176.3	179.5	0	108.2	V936 R941	V936-K943 PolarHBondContact N-O 3.25Å; V936-K943 WeakPolarHBondContact O-CA 3.4Å; V936-K943 VanDerWaalsContact O-CB 3.23Å; V936-K943 WeakPolarHBondContact O-CB 3.43Å; V936-K943 PolarHBondContact O-N 3.38Å; V936-K943 VanDerWaalsContact O-O 3.04Å; R941-K943 PolarHBondContact O-N 3.06Å
944	T	70.7	Confident	69.8	Low	21 Å²	21	84.1 Å²	84.1	13%	0.129	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	2.7	179.3	59.7	0	0	0	0	112.2	V933 R962 E964	V933-T944 PolarHBondContact N-O 2.72Å; V933-T944 CarbonylContact O-C 3.53Å; V933-T944 VanDerWaalsContact O-C 3.31Å; V933-T944 VanDerWaalsContact O-CA 3.22Å; V933-T944 WeakPolarHBondContact O-CA 3.36Å; T944-R962 VanDerWaalsContact CB-CZ 3.5Å; T944-R962 WeakPolarHBondContact OG1-CD 3.06Å; T944-R962 VanDerWaalsContact OG1-CZ 3.25Å; T944-R962 PolarHBondContact OG1-NE 3.04Å; T944-R962 PolarHBondContact OG1-NH2 3.3Å; T944-E964 WeakPolarHBondContact CA-OE1 3.08Å; T944-E964 PolarHBondContact N-OE1 2.73Å; T944-E964 PolarHBondContact OG1-OE1 3.44Å
945	I	76.4	Confident	70.2	Confident	10 Å²	10	77.6 Å²	77.6	5%	0.051	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	136.9	-177.4	-61.3	173.8	0	0	0	110.7	R928 Q931 F948 R962 E964	R928-I945 WeakPolarHBondContact O-CD1 3.38Å; Q931-I945 WeakPolarHBondContact O-CA 3.34Å; I945-F948 HydrophobicContact CG2-CB 4.09Å; I945-R962 HydrophobicContact CD1-CB 4.47Å; I945-R962 HydrophobicContact CD1-CG 4.47Å; I945-R962 WeakPolarHBondContact CD1-O 3.11Å; I945-R962 HydrophobicContact CG1-CB 4.03Å; I945-R962 HydrophobicContact CG1-CG 4.19Å; I945-E964 HydrophobicContact CD1-CB 3.59Å; I945-E964 HydrophobicContact CD1-CG 3.37Å; I945-E964 HydrophobicContact CG1-CG 3.97Å; I945-E964 PolarHBondContact N-OE1 2.93Å
946	T	79	Confident	70.7	Confident	48 Å²	48	75.7 Å²	75.7	29%	0.294	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	145.9	163.9	61.2	0	0	0	0	110.7	Q931 V933 V936	Q931-T946 PolarHBondContact N-O 2.94Å; Q931-T946 PolarHBondContact O-N 3.44Å; Q931-T946 PolarHBondContact O-OG1 3.03Å; V933-T946 HydrophobicContact CB-CG2 4.07Å; V933-T946 HydrophobicContact CG2-CG2 3.46Å; V933-T946 VanDerWaalsContact CG2-CG2 3.46Å; V933-T946 VanDerWaalsContact CG2-OG1 3.3Å; V933-T946 WeakPolarHBondContact CG2-OG1 3.21Å; V936-T946 HydrophobicContact CB-CG2 4.36Å; V936-T946 HydrophobicContact CG2-CG2 3.81Å
947	G	74.8	Confident	71.4	Confident	72 Å²	72	73.2 Å²	73.2	74%	0.742	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	59.9	65.6	177.5	0	0	0	0	0	114.3
948	F	75	Confident	71.9	Confident	108 Å²	108	73.2 Å²	73.2	47%	0.474	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	147.9	-173.6	61.4	-89.9	0	0	0	114.2	R928 V929 I945	R928-F948 HydrophobicContact CB-CB 4.08Å; R928-F948 HydrophobicContact CB-CD2 4.43Å; R928-F948 HydrophobicContact CB-CG 4.46Å; R928-F948 HydrophobicContact CG-CD2 3.98Å; R928-F948 HydrophobicContact CG-CG 4.43Å; V929-F948 CarbonylContact O-C 3.58Å; V929-F948 VanDerWaalsContact O-CA 3.26Å; V929-F948 WeakPolarHBondContact O-CA 3.48Å; I945-F948 HydrophobicContact CG2-CB 4.09Å
949	Q	82	Confident	72.2	Confident	134 Å²	134	68 Å²	68	63%	0.626	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.2	139.7	162.2	-63.4	-175.5	17.1	0	0	109	R928 V929	R928-Q949 CarbonylContact C-O 3.59Å; R928-Q949 WeakPolarHBondContact CA-O 3.03Å; V929-Q949 PolarHBondContact N-O 2.9Å; V929-Q949 PolarHBondContact O-N 3.24Å
950	T	82.6	Confident	73	Confident	93 Å²	93	64.9 Å²	64.9	57%	0.571	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.6	119.1	177.1	47.2	0	0	0	0	110.1	V927 R928	V927-T950 CarbonylContact O-C 3.56Å; V927-T950 WeakPolarHBondContact O-CA 3.12Å; R928-T950 HydrophobicContact CG-CG2 3.75Å
951	H	81	Confident	73.9	Confident	76 Å²	76	64.4 Å²	64.4	35%	0.352	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	156.6	173	-67.1	-78.2	0	0	0	109.9	T926 V927 V955	T926-H951 CarbonylContact C-O 3.31Å; T926-H951 WeakPolarHBondContact CA-O 3.27Å; V927-H951 PolarHBondContact N-O 3.43Å; V927-H951 PolarHBondContact O-N 3.17Å; V927-H951 VanDerWaalsContact O-O 3.05Å; H951-V955 HydrophobicContact CB-CB 4.45Å; H951-V955 HydrophobicContact CB-CG1 4.02Å; H951-V955 HydrophobicContact CB-CG2 3.5Å; H951-V955 VanDerWaalsContact CB-CG2 3.5Å
952	T	81.8	Confident	74.4	Confident	89 Å²	89	58.1 Å²	58.1	55%	0.546	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	134	168.6	46.7	0	0	0	0	108.4	T926 V955	T926-T952 HydrophobicContact CG2-CG2 3.87Å; T952-V955 WeakPolarHBondContact O-CG2 3.21Å
953	T	75.5	Confident	75	Confident	2 Å²	2	54.2 Å²	54.2	1%	0.012	31%	0.306	C	S	.	.	S	Bend	trans	-60	141.1	172.6	49.1	0	0	0	0	111	L913 T915 S923 L924 V925 V927 V955	L913-T953 HydrophobicContact CD2-CG2 4.29Å; L913-T953 HydrophobicContact CG-CG2 4.23Å; T915-T953 HydrophobicContact CG2-CG2 3.72Å; T915-T953 WeakPolarHBondContact OG1-CB 3.48Å; T915-T953 PolarHBondContact OG1-OG1 2.94Å; S923-T953 PolarHBondContact O-OG1 3.19Å; L924-T953 WeakPolarHBondContact CD2-O 3.11Å; V925-T953 PolarHBondContact N-OG1 3.46Å; V925-T953 PolarHBondContact O-N 3.03Å; V925-T953 PolarHBondContact O-OG1 3.05Å; V925-T953 VanDerWaalsContact O-OG1 3.13Å; V927-T953 HydrophobicContact CB-CG2 4.48Å; V927-T953 HydrophobicContact CG2-CG2 3.41Å; V927-T953 VanDerWaalsContact CG2-CG2 3.41Å; T953-V955 HydrophobicContact CG2-CG2 4.49Å
954	P	70.3	Confident	75.3	Confident	20 Å²	20	51.6 Å²	51.6	13%	0.13	30%	0.295	C	S	.	.	S	Bend	cis	-67.3	139.1	0.6	10.5	-15.2	0	0	0	115.7	L337 E340 L913 M914	L337-P954 HydrophobicContact CD1-CB 3.89Å; E340-P954 HydrophobicContact CB-CG 3.78Å; E340-P954 HydrophobicContact CG-CG 3.96Å; L913-P954 WeakPolarHBondContact O-CA 3.32Å; M914-P954 HydrophobicContact CG-CB 4.29Å; M914-P954 HydrophobicContact SD-CB 3.38Å; M914-P954 WeakPolarHBondContact SD-CB 3.42Å; M914-P954 HydrophobicContact SD-CG 3.71Å
955	V	75.6	Confident	75.6	Confident	11 Å²	11	52.1 Å²	52.1	7%	0.067	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	143.6	172.8	-168.1	0	0	0	0	110.7	L913 V929 H951 T952 T953	L913-V955 PolarHBondContact N-O 3.47Å; L913-V955 PolarHBondContact O-N 2.87Å; L913-V955 VanDerWaalsContact O-N 3.14Å; V929-V955 HydrophobicContact CG2-CG1 4.03Å; H951-V955 HydrophobicContact CB-CB 4.45Å; H951-V955 HydrophobicContact CB-CG1 4.02Å; H951-V955 HydrophobicContact CB-CG2 3.5Å; H951-V955 VanDerWaalsContact CB-CG2 3.5Å; T952-V955 WeakPolarHBondContact O-CG2 3.21Å; T953-V955 HydrophobicContact CG2-CG2 4.49Å
956	L	75.6	Confident	75.4	Confident	54 Å²	54	52.7 Å²	52.7	28%	0.283	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	117.6	166.7	-63.6	176	0	0	0	109	L337 L341 T858 R911	L337-L956 HydrophobicContact CD1-CD2 4.35Å; L337-L956 HydrophobicContact CD2-CD2 4.36Å; L341-L956 HydrophobicContact CD1-CD1 3.94Å; L341-L956 HydrophobicContact CD1-CD2 4.24Å; L341-L956 HydrophobicContact CD1-CG 4.03Å; T858-L956 HydrophobicContact CG2-CD1 4.27Å; T858-L956 HydrophobicContact CG2-CD2 4.22Å; R911-L956 HydrophobicContact CB-CD2 4.37Å; R911-L956 WeakPolarHBondContact O-CA 3.5Å; R911-L956 WeakPolarHBondContact O-CD2 3.38Å
957	L	74.2	Confident	74.9	Confident	15 Å²	15	52.3 Å²	52.3	8%	0.079	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-85.6	124.2	178.1	-63.8	173.5	0	0	0	110.4	R911 L913 V929 A963 L978 E979	R911-L957 PolarHBondContact NE-O 3.13Å; R911-L957 PolarHBondContact NH2-O 3.05Å; R911-L957 PolarHBondContact O-N 3.12Å; L913-L957 HydrophobicContact CB-CD1 4.06Å; L913-L957 HydrophobicContact CB-CG 4.14Å; L913-L957 HydrophobicContact CD2-CD1 4.5Å; L913-L957 HydrophobicContact CD2-CD2 4.33Å; V929-L957 HydrophobicContact CG1-CD2 3.88Å; V929-L957 HydrophobicContact CG2-CD2 3.93Å; L957-A963 HydrophobicContact CD2-CB 3.84Å; L957-L978 VanDerWaalsContact CD1-O 3.29Å; L957-L978 WeakPolarHBondContact CD1-O 3.32Å; L957-E979 HydrophobicContact CD1-CG 4.04Å
958	S	71.8	Confident	74.6	Confident	58 Å²	58	53.6 Å²	53.6	41%	0.406	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-72.9	167.9	172.8	-47.2	0	0	0	0	111.5	G960 E961	S958-G960 PolarHBondContact O-N 2.68Å; S958-E961 WeakPolarHBondContact CA-OE2 3.38Å; S958-E961 WeakPolarHBondContact CB-OE1 3.42Å; S958-E961 WeakPolarHBondContact CB-OE2 3.25Å; S958-E961 PolarHBondContact N-OE2 3.41Å; S958-E961 PolarHBondContact O-N 2.66Å; S958-E961 PolarHBondContact OG-OE1 3.48Å; S958-E961 PolarHBondContact OG-OE2 3.48Å
959	H	67.9	Low	74.1	Confident	62 Å²	62	51.8 Å²	51.8	29%	0.287	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	121.6	-176.1	178.5	-74	0	0	0	108.8	E961	H959-E961 VanDerWaalsContact C-N 3.33Å
960	G	69.7	Low	73.5	Confident	39 Å²	39	47.4 Å²	47.4	40%	0.402	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	83	5.8	-175.4	0	0	0	0	0	114.6	A932 S958	A932-G960 PolarHBondContact N-O 2.74Å; S958-G960 PolarHBondContact O-N 2.68Å
961	E	74.4	Confident	72.7	Confident	66 Å²	66	46.6 Å²	46.6	31%	0.308	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	134.2	167.1	-72.8	176.2	176.3	0	0	109.9	V929 G930 S958 H959	V929-E961 HydrophobicContact CG1-CB 3.78Å; V929-E961 HydrophobicContact CG1-CG 4.23Å; G930-E961 CarbonylContact O-C 3.57Å; G930-E961 WeakPolarHBondContact O-CA 3.16Å; S958-E961 WeakPolarHBondContact CA-OE2 3.38Å; S958-E961 WeakPolarHBondContact CB-OE1 3.42Å; S958-E961 WeakPolarHBondContact CB-OE2 3.25Å; S958-E961 PolarHBondContact N-OE2 3.41Å; S958-E961 PolarHBondContact O-N 2.66Å; S958-E961 PolarHBondContact OG-OE1 3.48Å; S958-E961 PolarHBondContact OG-OE2 3.48Å; H959-E961 VanDerWaalsContact C-N 3.33Å
962	R	72.1	Confident	72	Confident	61 Å²	61	45.1 Å²	45.1	23%	0.23	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	144.8	171.7	-177.8	164.6	174.6	168.4	-9.8	109.1	D867 V929 G930 A932 T944 I945	D867-R962 IonicContact OD2-CZ 3.61Å; D867-R962 IonicContact OD2-NH1 3.21Å; D867-R962 PolarHBondContact OD2-NH1 3.34Å; V929-R962 WeakPolarHBondContact CA-O 3.37Å; G930-R962 PolarHBondContact N-O 3.4Å; G930-R962 PolarHBondContact O-N 2.79Å; A932-R962 HydrophobicContact CB-CB 3.88Å; T944-R962 VanDerWaalsContact CB-CZ 3.5Å; T944-R962 WeakPolarHBondContact OG1-CD 3.06Å; T944-R962 VanDerWaalsContact OG1-CZ 3.25Å; T944-R962 PolarHBondContact OG1-NE 3.04Å; T944-R962 PolarHBondContact OG1-NH2 3.3Å; I945-R962 HydrophobicContact CD1-CB 4.47Å; I945-R962 HydrophobicContact CD1-CG 4.47Å; I945-R962 WeakPolarHBondContact CD1-O 3.11Å; I945-R962 HydrophobicContact CG1-CB 4.03Å; I945-R962 HydrophobicContact CG1-CG 4.19Å
963	A	76.1	Confident	71	Confident	2 Å²	2	42.7 Å²	42.7	2%	0.017	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	140.2	174.4	0	0	0	0	0	110.8	L913 V927 R928 V929 L957 L978	L913-A963 HydrophobicContact CD2-CB 3.58Å; V927-A963 HydrophobicContact CG1-CB 3.41Å; V927-A963 VanDerWaalsContact CG1-CB 3.41Å; R928-A963 CarbonylContact O-C 3.56Å; R928-A963 WeakPolarHBondContact O-CA 3.38Å; V929-A963 HydrophobicContact CG2-CB 4.27Å; L957-A963 HydrophobicContact CD2-CB 3.84Å; A963-L978 HydrophobicContact CB-CB 3.87Å; A963-L978 HydrophobicContact CB-CD1 4.34Å; A963-L978 WeakPolarHBondContact O-CD1 3.44Å; A963-L978 WeakPolarHBondContact O-CG 2.99Å
964	E	74.6	Confident	70.2	Confident	42 Å²	42	43.2 Å²	43.2	20%	0.196	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	144.9	168.7	-78.6	171.5	-174.8	0	0	108.7	V927 R928 T944 I945 A966	V927-E964 CarbonylContact C-O 3.48Å; V927-E964 WeakPolarHBondContact CA-O 3.36Å; V927-E964 WeakPolarHBondContact CG1-O 3.25Å; R928-E964 PolarHBondContact N-O 3.35Å; R928-E964 PolarHBondContact O-N 3.12Å; T944-E964 WeakPolarHBondContact CA-OE1 3.08Å; T944-E964 PolarHBondContact N-OE1 2.73Å; T944-E964 PolarHBondContact OG1-OE1 3.44Å; I945-E964 HydrophobicContact CD1-CB 3.59Å; I945-E964 HydrophobicContact CD1-CG 3.37Å; I945-E964 HydrophobicContact CG1-CG 3.97Å; I945-E964 PolarHBondContact N-OE1 2.93Å; E964-A966 PolarHBondContact O-N 2.98Å
965	L	77.4	Confident	69.7	Low	32 Å²	32	47.5 Å²	47.5	17%	0.168	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	136.5	173.3	-64.1	169.6	0	0	0	110	V925 V927 Y970 P972 L978 L984	V925-L965 HydrophobicContact CG1-CD2 3.88Å; V927-L965 HydrophobicContact CG2-CD2 4.19Å; L965-Y970 VanDerWaalsContact CD1-O 3.31Å; L965-Y970 WeakPolarHBondContact CD1-O 3.35Å; L965-P972 HydrophobicContact CD1-CG 4.28Å; L965-L978 HydrophobicContact CD2-CD1 4.36Å; L965-L978 HydrophobicContact CG-CD1 3.97Å; L965-L984 HydrophobicContact CD1-CD2 3.64Å; L965-L984 HydrophobicContact CD2-CD1 4.12Å; L965-L984 HydrophobicContact CD2-CD2 4.02Å; L965-L984 HydrophobicContact CG-CD2 4.43Å
966	A	73	Confident	69	Low	23 Å²	23	48 Å²	48	19%	0.19	26%	0.258	C	S	.	.	S	Bend	trans	-82.5	-23.5	179.9	0	0	0	0	0	112.9	T926 R928 E964	T926-A966 VanDerWaalsContact O-CB 3.3Å; T926-A966 WeakPolarHBondContact O-CB 3.32Å; T926-A966 PolarHBondContact O-N 3.3Å; R928-A966 HydrophobicContact CG-CB 3.97Å; E964-A966 PolarHBondContact O-N 2.98Å
967	T	68.4	Low	68.2	Low	39 Å²	39	45.9 Å²	45.9	24%	0.239	25%	0.248	C	C	.	.			trans	-119.5	130.4	-172.2	47.3	0	0	0	0	111.1	T926 E969	T926-T967 WeakPolarHBondContact OG1-CG2 3.09Å; T967-E969 PolarHBondContact O-N 2.95Å
968	D	67.6	Low	67.6	Low	100 Å²	100	46 Å²	46	54%	0.535	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-1.7	176.6	-66.1	-25.6	0	0	0	113.2	Y970 N987	D968-Y970 PolarHBondContact O-N 3.39Å; D968-N987 VanDerWaalsContact O-CB 3.23Å; D968-N987 WeakPolarHBondContact O-CB 3.08Å; D968-N987 PolarHBondContact O-ND2 3.18Å
969	E	65.5	Low	67.3	Low	69 Å²	69	45.7 Å²	45.7	32%	0.322	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-31.2	174.8	-74.4	178.1	-171.7	0	0	112.8	T967 K986 N987 Y990	T967-E969 PolarHBondContact O-N 2.95Å; E969-K986 WeakPolarHBondContact O-CA 3.48Å; E969-N987 WeakPolarHBondContact O-CB 3.3Å; E969-N987 PolarHBondContact O-N 3.36Å; E969-Y990 HydrophobicContact CG-CD1 3.66Å; E969-Y990 HydrophobicContact CG-CD2 3.98Å; E969-Y990 HydrophobicContact CG-CE1 3.28Å; E969-Y990 HydrophobicContact CG-CE2 3.66Å; E969-Y990 HydrophobicContact CG-CG 3.96Å; E969-Y990 WeakPolarHBondContact OE1-CE1 3.09Å; E969-Y990 VanDerWaalsContact OE1-CZ 3.26Å; E969-Y990 PolarHBondContact OE1-OH 3.06Å
970	Y	68.3	Low	67.2	Low	43 Å²	43	42.8 Å²	42.8	17%	0.169	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	129.4	-177.6	-65.7	-86.6	0	0	0	109.8	V925 L965 D968 L984 R985 K986	V925-Y970 HydrophobicContact CG1-CD2 4.15Å; V925-Y970 HydrophobicContact CG2-CD2 3.9Å; V925-Y970 HydrophobicContact CG2-CE2 4Å; V925-Y970 HydrophobicContact CG2-CG 4.21Å; L965-Y970 VanDerWaalsContact CD1-O 3.31Å; L965-Y970 WeakPolarHBondContact CD1-O 3.35Å; D968-Y970 PolarHBondContact O-N 3.39Å; Y970-L984 HydrophobicContact CD1-CB 4.11Å; Y970-L984 HydrophobicContact CG-CD1 4.34Å; Y970-R985 CarbonylContact C-O 3.59Å; Y970-R985 VanDerWaalsContact CA-O 3.26Å; Y970-R985 WeakPolarHBondContact CA-O 3.15Å; Y970-K986 HydrophobicContact CD1-CG 3.97Å; Y970-K986 HydrophobicContact CE1-CD 4.39Å; Y970-K986 HydrophobicContact CE1-CG 3.54Å
971	L	66	Low	67.2	Low	76 Å²	76	41.4 Å²	41.4	40%	0.398	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	132.6	171.9	-66.4	174.3	0	0	0	109	R985 N987	L971-R985 PolarHBondContact N-O 3.23Å; L971-R985 PolarHBondContact O-N 3.43Å; L971-N987 HydrophobicContact CD1-CB 4.1Å; L971-N987 HydrophobicContact CG-CB 4.02Å
972	P	67.3	Low	66.9	Low	45 Å²	45	38.5 Å²	38.5	29%	0.292	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	139.7	171.6	31	-30.4	0	0	0	108.8	L965 T974 L978 I982 L984	L965-P972 HydrophobicContact CD1-CG 4.28Å; P972-T974 PolarHBondContact O-N 2.99Å; P972-L978 HydrophobicContact CB-CD2 4.06Å; P972-L978 HydrophobicContact CG-CD2 4.42Å; P972-I982 HydrophobicContact CB-CG2 4.21Å; P972-L984 HydrophobicContact CB-CD2 4.25Å
973	I	59.3	Low	66.9	Low	37 Å²	37	35.6 Å²	35.6	19%	0.19	19%	0.185	C	C	.	.	S	Bend	trans	-65.2	-27.1	-175.2	-67.3	-177.1	0	0	0	112.1	A294 I295 L983 R985	A294-I973 HydrophobicContact CB-CD1 3.53Å; A294-I973 HydrophobicContact CB-CG2 4.42Å; I295-I973 HydrophobicContact CB-CG2 4.43Å; I295-I973 HydrophobicContact CG1-CG2 3.57Å; I973-L983 HydrophobicContact CD1-CB 3.48Å; I973-L983 VanDerWaalsContact CD1-CB 3.48Å; I973-L983 HydrophobicContact CG1-CB 4.17Å; I973-L983 WeakPolarHBondContact CG1-O 3.34Å; I973-L983 PolarHBondContact N-O 2.81Å; I973-L983 VanDerWaalsContact N-O 3.16Å; I973-R985 HydrophobicContact CG1-CB 4.09Å
974	T	59.9	Low	66.6	Low	13 Å²	13	35.6 Å²	35.6	8%	0.08	19%	0.185	C	C	.	.	S	Bend	trans	-129	154.3	173.1	60.6	0	0	0	0	110.9	I295 Q298 P972 L976	I295-T974 HydrophobicContact CG2-CG2 4.3Å; Q298-T974 PolarHBondContact NE2-OG1 2.81Å; Q298-T974 PolarHBondContact OE1-OG1 3.29Å; P972-T974 PolarHBondContact O-N 2.99Å; T974-L976 PolarHBondContact O-N 3.12Å; T974-L976 WeakPolarHBondContact OG1-CD1 3.24Å; T974-L976 WeakPolarHBondContact OG1-CG 3.06Å
975	Q	58.4	Low	66.4	Low	111 Å²	111	36.3 Å²	36.3	52%	0.519	19%	0.186	S	C	.	.			trans	-77.5	22.8	176	-63.3	-177.3	-9.1	0	0	112.7	Y222 D257	Y222-Q975 PolarHBondContact OH-NE2 3.04Å; Y222-Q975 PolarHBondContact OH-OE1 3.44Å; D257-Q975 PolarHBondContact OD2-OE1 3.43Å
976	L	61.4	Low	65.8	Low	20 Å²	20	40.6 Å²	40.6	11%	0.105	20%	0.203	C	C	.	.	S	Bend	trans	-64.9	145.6	175.2	-71.4	172.9	0	0	0	110	R263 Q298 L302 T974 L978	R263-L976 HydrophobicContact CG-CD2 3.88Å; Q298-L976 HydrophobicContact CG-CD1 4.48Å; L302-L976 HydrophobicContact CD2-CD1 4.35Å; T974-L976 PolarHBondContact O-N 3.12Å; T974-L976 WeakPolarHBondContact OG1-CD1 3.24Å; T974-L976 WeakPolarHBondContact OG1-CG 3.06Å; L976-L978 PolarHBondContact O-N 3.13Å
977	P	59.6	Low	65.6	Low	11 Å²	11	41 Å²	41	7%	0.071	20%	0.202	C	C	.	.			trans	-55.1	136.3	169.1	23.6	-31.8	0	0	0	108.7	R263 E979	R263-P977 VanDerWaalsContact NH1-CD 3.31Å; P977-E979 VanDerWaalsContact C-N 3.3Å; P977-E979 PolarHBondContact O-N 3.06Å
978	L	61.2	Low	65.2	Low	16 Å²	16	44 Å²	44	8%	0.084	22%	0.222	C	C	.	.	S	Bend	trans	-72.8	85	-171.7	-58.9	-177.5	0	0	0	110.4	L913 L957 A963 L965 P972 L976 I982	L913-L978 HydrophobicContact CD1-CB 4.16Å; L957-L978 VanDerWaalsContact CD1-O 3.29Å; L957-L978 WeakPolarHBondContact CD1-O 3.32Å; A963-L978 HydrophobicContact CB-CB 3.87Å; A963-L978 HydrophobicContact CB-CD1 4.34Å; A963-L978 WeakPolarHBondContact O-CD1 3.44Å; A963-L978 WeakPolarHBondContact O-CG 2.99Å; L965-L978 HydrophobicContact CD2-CD1 4.36Å; L965-L978 HydrophobicContact CG-CD1 3.97Å; P972-L978 HydrophobicContact CB-CD2 4.06Å; P972-L978 HydrophobicContact CG-CD2 4.42Å; L976-L978 PolarHBondContact O-N 3.13Å; L978-I982 HydrophobicContact CB-CD1 3.4Å; L978-I982 HydrophobicContact CD2-CD1 3.37Å; L978-I982 HydrophobicContact CD2-CG2 4.17Å; L978-I982 HydrophobicContact CG-CD1 3.91Å
979	E	64.3	Low	64.5	Low	53 Å²	53	47.5 Å²	47.5	25%	0.248	24%	0.235	C	C	.	.			trans	-132.5	129.2	174.9	-68.4	-179.7	-173.8	0	0	110.1	R305 S866 L957 P977	R305-E979 VanDerWaalsContact NH1-C 3.26Å; R305-E979 PolarHBondContact NH1-O 3.18Å; S866-E979 WeakPolarHBondContact CA-OE2 3.2Å; S866-E979 PolarHBondContact N-OE2 3.29Å; L957-E979 HydrophobicContact CD1-CG 4.04Å; P977-E979 VanDerWaalsContact C-N 3.3Å; P977-E979 PolarHBondContact O-N 3.06Å
980	G	67.4	Low	63.9	Low	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	87.7	-137.4	177.2	0	0	0	0	0	116	L912 L913 M914	L912-G980 WeakPolarHBondContact O-CA 3.29Å; L912-G980 PolarHBondContact O-N 3.31Å; L913-G980 WeakPolarHBondContact CA-O 3.44Å; M914-G980 PolarHBondContact N-O 3.26Å; M914-G980 VanDerWaalsContact O-O 3.08Å
981	F	68.3	Low	62.9	Low	11 Å²	11	55 Å²	55	5%	0.048	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	117.5	-179.9	-59.2	-57.1	0	0	0	109	Y301 L330 H333 L912 M914 F916	Y301-F981 HydrophobicContact CD1-CB 4Å; Y301-F981 AromaticContact CD1-CD2 3.52Å; Y301-F981 HydrophobicContact CD1-CD2 3.52Å; Y301-F981 HydrophobicContact CD1-CE2 4.35Å; Y301-F981 HydrophobicContact CD1-CG 4.07Å; Y301-F981 HydrophobicContact CD2-CB 3.66Å; Y301-F981 HydrophobicContact CE1-CB 4.16Å; Y301-F981 AromaticContact CE1-CD2 3.7Å; Y301-F981 HydrophobicContact CE1-CD2 3.7Å; Y301-F981 HydrophobicContact CE1-CE2 4.33Å; Y301-F981 HydrophobicContact CE1-CG 4.05Å; Y301-F981 HydrophobicContact CE2-CB 3.82Å; Y301-F981 HydrophobicContact CE2-CG 4.5Å; Y301-F981 HydrophobicContact CG-CB 3.75Å; Y301-F981 HydrophobicContact CG-CD2 4.09Å; Y301-F981 HydrophobicContact CG-CG 4.34Å; L330-F981 HydrophobicContact CD1-CE2 3.79Å; L330-F981 HydrophobicContact CD1-CZ 3.84Å; H333-F981 HydrophobicContact CB-CE1 3.59Å; H333-F981 HydrophobicContact CB-CZ 3.63Å; H333-F981 AromaticContact CD2-CE1 3.63Å; H333-F981 AromaticContact CD2-CZ 3.55Å; H333-F981 AromaticContact CG-CE1 3.75Å; H333-F981 AromaticContact CG-CZ 3.9Å; L912-F981 HydrophobicContact CD1-CD1 3.59Å; L912-F981 HydrophobicContact CD1-CE1 3.33Å; L912-F981 HydrophobicContact CD1-CE2 4.38Å; L912-F981 HydrophobicContact CD1-CG 4.26Å; L912-F981 HydrophobicContact CD1-CZ 3.77Å; L912-F981 HydrophobicContact CD2-CE1 3.94Å; L912-F981 HydrophobicContact CD2-CZ 3.73Å; L912-F981 HydrophobicContact CG-CE1 4.32Å; L912-F981 HydrophobicContact CG-CZ 4.39Å; M914-F981 HydrophobicContact CB-CD1 3.83Å; M914-F981 HydrophobicContact CB-CE1 4.09Å; M914-F981 HydrophobicContact CG-CE1 4.5Å; M914-F981 WeakPolarHBondContact O-CA 3.48Å; F916-F981 HydrophobicContact CD2-CB 4.22Å; F916-F981 HydrophobicContact CD2-CD1 4.27Å; F916-F981 HydrophobicContact CE2-CB 3.89Å; F916-F981 AromaticContact CE2-CD1 3.26Å; F916-F981 HydrophobicContact CE2-CD1 3.26Å; F916-F981 AromaticContact CE2-CE1 3.98Å; F916-F981 HydrophobicContact CE2-CE1 3.98Å; F916-F981 AromaticContact CE2-CG 3.82Å; F916-F981 HydrophobicContact CE2-CG 3.82Å; F916-F981 AromaticContact CZ-CD1 3.84Å; F916-F981 HydrophobicContact CZ-CD1 3.84Å; F916-F981 HydrophobicContact CZ-CE1 4.11Å
982	I	68.1	Low	62.2	Low	4 Å²	4	58.2 Å²	58.2	2%	0.021	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	122.2	-177.1	-52.8	-173.5	0	0	0	107.9	L913 M914 T915 F916 P972 L978 L984	L913-I982 HydrophobicContact CD1-CD1 3.36Å; L913-I982 HydrophobicContact CD1-CG1 4.01Å; M914-I982 PolarHBondContact O-N 3.45Å; T915-I982 CarbonylContact C-O 3.5Å; T915-I982 WeakPolarHBondContact CA-O 3.27Å; T915-I982 HydrophobicContact CG2-CB 4.44Å; F916-I982 PolarHBondContact N-O 2.81Å; P972-I982 HydrophobicContact CB-CG2 4.21Å; L978-I982 HydrophobicContact CB-CD1 3.4Å; L978-I982 HydrophobicContact CD2-CD1 3.37Å; L978-I982 HydrophobicContact CD2-CG2 4.17Å; L978-I982 HydrophobicContact CG-CD1 3.91Å; I982-L984 HydrophobicContact CG2-CD2 3.97Å; I982-L984 PolarHBondContact O-N 3.24Å
983	L	72.7	Confident	61.1	Low	1 Å²	1	62 Å²	62	1%	0.005	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	119.9	168	-67.8	164.7	0	0	0	107.7	A294 R297 Q298 F916 D917 L920 I973	A294-L983 WeakPolarHBondContact O-CD1 3.17Å; R297-L983 HydrophobicContact CB-CD1 3.55Å; Q298-L983 HydrophobicContact CB-CD1 4.3Å; F916-L983 HydrophobicContact CB-CD2 3.72Å; F916-L983 CarbonylContact O-C 3.5Å; F916-L983 WeakPolarHBondContact O-CA 3.38Å; D917-L983 WeakPolarHBondContact O-CD2 3.11Å; L920-L983 HydrophobicContact CD2-CD2 4.14Å; I973-L983 HydrophobicContact CD1-CB 3.48Å; I973-L983 VanDerWaalsContact CD1-CB 3.48Å; I973-L983 HydrophobicContact CG1-CB 4.17Å; I973-L983 WeakPolarHBondContact CG1-O 3.34Å; I973-L983 PolarHBondContact N-O 2.81Å; I973-L983 VanDerWaalsContact N-O 3.16Å
984	L	69.6	Low	59.9	Low	1 Å²	1	67.3 Å²	67.3	1%	0.005	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	142	172.9	-65.7	-175.4	0	0	0	108.7	T915 F916 V925 L965 Y970 P972 I982	T915-L984 HydrophobicContact CG2-CD1 3.57Å; T915-L984 HydrophobicContact CG2-CD2 4.44Å; T915-L984 HydrophobicContact CG2-CG 3.92Å; F916-L984 PolarHBondContact O-N 2.7Å; V925-L984 HydrophobicContact CB-CD1 3.85Å; V925-L984 HydrophobicContact CG1-CD1 4.01Å; V925-L984 HydrophobicContact CG2-CD1 3.52Å; L965-L984 HydrophobicContact CD1-CD2 3.64Å; L965-L984 HydrophobicContact CD2-CD1 4.12Å; L965-L984 HydrophobicContact CD2-CD2 4.02Å; L965-L984 HydrophobicContact CG-CD2 4.43Å; Y970-L984 HydrophobicContact CD1-CB 4.11Å; Y970-L984 HydrophobicContact CG-CD1 4.34Å; P972-L984 HydrophobicContact CB-CD2 4.25Å; I982-L984 HydrophobicContact CG2-CD2 3.97Å; I982-L984 PolarHBondContact O-N 3.24Å
985	R	69.9	Low	58.7	Low	57 Å²	57	79.9 Å²	79.9	22%	0.215	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	138.9	172.4	170.2	169.7	-177.2	-162.8	5	108.9	Y291 E918 Y970 L971 I973 N987	Y291-R985 PolarHBondContact OH-NH2 3.41Å; E918-R985 VanDerWaalsContact OE1-CD 3.29Å; E918-R985 WeakPolarHBondContact OE1-CD 3.5Å; E918-R985 VanDerWaalsContact OE1-CG 3.23Å; E918-R985 WeakPolarHBondContact OE1-CG 3.42Å; E918-R985 IonicContact OE1-NE 3.88Å; Y970-R985 CarbonylContact C-O 3.59Å; Y970-R985 VanDerWaalsContact CA-O 3.26Å; Y970-R985 WeakPolarHBondContact CA-O 3.15Å; L971-R985 PolarHBondContact N-O 3.23Å; L971-R985 PolarHBondContact O-N 3.43Å; I973-R985 HydrophobicContact CG1-CB 4.09Å; R985-N987 PolarHBondContact O-N 3.19Å
986	K	66.4	Low	58.7	Low	122 Å²	122	78.4 Å²	78.4	53%	0.53	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	126.5	168.7	-70.1	-178.2	-178.3	179.3	0	110.2	E969 Y970 P988	E969-K986 WeakPolarHBondContact O-CA 3.48Å; Y970-K986 HydrophobicContact CD1-CG 3.97Å; Y970-K986 HydrophobicContact CE1-CD 4.39Å; Y970-K986 HydrophobicContact CE1-CG 3.54Å; K986-P988 WeakPolarHBondContact O-CD 3.47Å
987	N	67.4	Low	58.5	Low	32 Å²	32	81.4 Å²	81.4	17%	0.171	39%	0.394	C	S	.	.			trans	-65.4	120	179.5	-171.9	-4.6	0	0	0	109.8	D968 E969 L971 R985 E989 Y990	D968-N987 VanDerWaalsContact O-CB 3.23Å; D968-N987 WeakPolarHBondContact O-CB 3.08Å; D968-N987 PolarHBondContact O-ND2 3.18Å; E969-N987 WeakPolarHBondContact O-CB 3.3Å; E969-N987 PolarHBondContact O-N 3.36Å; L971-N987 HydrophobicContact CD1-CB 4.1Å; L971-N987 HydrophobicContact CG-CB 4.02Å; R985-N987 PolarHBondContact O-N 3.19Å; N987-E989 PolarHBondContact O-N 2.9Å; N987-E989 PolarHBondContact OD1-N 3.22Å; N987-E989 VanDerWaalsContact OD1-N 3.12Å; N987-Y990 PolarHBondContact O-N 3.17Å
988	P	60	Low	58.5	Low	101 Å²	101	85.3 Å²	85.3	66%	0.656	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-14.7	178.7	28.2	-34.7	0	0	0	113.7	K986	K986-P988 WeakPolarHBondContact O-CD 3.47Å
989	E	54.1	Low	58.3	Low	174 Å²	174	89.4 Å²	89.4	81%	0.813	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-0	-179.4	-61.7	-175	168.4	0	0	113.6	N987 E991	N987-E989 PolarHBondContact O-N 2.9Å; N987-E989 PolarHBondContact OD1-N 3.22Å; N987-E989 VanDerWaalsContact OD1-N 3.12Å; E989-E991 PolarHBondContact O-N 3.29Å
990	Y	52.1	Low	57.9	Low	93 Å²	93	91.7 Å²	91.7	37%	0.365	44%	0.443	S	S	.	.			trans	-80	105	179.8	-170.8	-98	0	0	0	111	E969 N987 E992	E969-Y990 HydrophobicContact CG-CD1 3.66Å; E969-Y990 HydrophobicContact CG-CD2 3.98Å; E969-Y990 HydrophobicContact CG-CE1 3.28Å; E969-Y990 HydrophobicContact CG-CE2 3.66Å; E969-Y990 HydrophobicContact CG-CG 3.96Å; E969-Y990 WeakPolarHBondContact OE1-CE1 3.09Å; E969-Y990 VanDerWaalsContact OE1-CZ 3.26Å; E969-Y990 PolarHBondContact OE1-OH 3.06Å; N987-Y990 PolarHBondContact O-N 3.17Å; Y990-E992 HydrophobicContact CD1-CG 4.33Å; Y990-E992 HydrophobicContact CE1-CG 3.95Å
991	E	47.7	Very low	57.3	Low	176 Å²	176	97.8 Å²	97.8	82%	0.822	47%	0.473	S	S	*	.			trans	-81.1	116	161.8	-73.2	-171.7	161.4	0	0	109	E989 T993	E989-E991 PolarHBondContact O-N 3.29Å; E991-T993 PolarHBondContact O-N 3.35Å
992	E	51.9	Low	56.5	Low	145 Å²	145	104 Å²	104	68%	0.678	50%	0.503	S	S	*	.			trans	-54.7	108.2	167.2	-79.7	179.3	175	0	0	108.4	Y990 N994	Y990-E992 HydrophobicContact CD1-CG 4.33Å; Y990-E992 HydrophobicContact CE1-CG 3.95Å; E992-N994 PolarHBondContact O-N 2.9Å
993	T	42.6	Very low	55.6	Low	123 Å²	123	111.7 Å²	111.7	76%	0.755	54%	0.54	S	S	*	.			trans	-70.4	83.6	169.3	43.2	0	0	0	0	108.3	E991 K995	E991-T993 PolarHBondContact O-N 3.35Å; T993-K995 PolarHBondContact O-N 3.32Å
994	N	34.7	Very low	54.2	Low	149 Å²	149	120.9 Å²	120.9	80%	0.797	59%	0.585	S	S	*	*			trans	-51.6	110.1	169.6	-85	-46	0	0	0	109	E992	E992-N994 PolarHBondContact O-N 2.9Å
995	K	34.1	Very low	52.8	Low	278 Å²	278	131.8 Å²	131.8	100%	1.209	64%	0.637	S	S	*	*			trans	-102.9	0	160.6	-90.5	-171.1	178	177	0	109.8	T993	T993-K995 PolarHBondContact O-N 3.32Å

Retrieved 995 of 995 residues in 2048 ms (Link to these results)

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