A0A077YZ43_TRITR Loading...

BK channel

AlphaFold DB , UniProt , Accession A0A077YZ43, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,206 aa.

						>A0A077YZ43_TRITR|A0A077YZ43
MTDFHKGSKSMGFYPLNCNQTAYQHRFEQMTEEERRCLEERKYWCFLLSSIITFCLSMLLVVTYRILNHLCCERKKSRRADVTEPDHREANGLFPTSPSNNTIEKTSLTAAVADAQSPPQQHQTEEAHVGWMTEAKDWAGELISGQSTTGRILVVLVFVLSIASLIIYFYDASNPHFQVETCIPLSQSPSQQIDLAFNIFFLVYFFIRFIAATDKVWFLLEVYSFVDYFTIPPSFVAIYLERNWLGLRFSRALRLMTLPDILQYLNIMKTSNAIRLAQLVSIFISVNLTGAGLIHLVSLRFVRALRLMSVPDILQYLNVLKTCRSIRLTQLLSIFLSVSLTGAGFIHLLENSGDPFQNFENPQRITYWECVYFLLVTMSTVGYGDIYCKTTLARLFMVFFILGGLAMFASYVPEIADLIGARQKYGGQYKSEHGKRHIVVCGYITFESVSHFLQDFLHEDREDVDVEVLFIHRVPPDLELEGLFKRHFTKVEFFQGTVMDSVDLTRVKVDEADACLVLANKYSPDPDAEDAANIMRVISIKNYSADIRVIVQLMQYHNKAYLLNIPSWDWRRGDDVICLAELKLGFIAQSCLAPGFSTMMANLFAMRSFKTLPNMPQWLNDYLRGAGMEMYTEKFSTSFYGMTFPEAADLLYTKLGLLLLAIETKDDEKRECNIAINPGPSVLITGHTQGFFIAQSADEVKRAFFYCKSCHADIKDVTLIKKCKCKNLALFRKEIKQIAMMSNSTRKVSMAVMRPTDRRMSEVRNRHREEGRARRADRYKRPRVRCDSLESTLDSETTDGSPTDADPKLYISDSATIETPTIKMGDMEHQEIKYDSTGMFHWCPPRPIEECVLDRNQAKMTVLNGHVVVCLFADKDSPLIGLRNFVMPLRASNFHYHELKHMVIVGDIEYLKREWRTLYNLPKISILQGSPLSRADLRAVNINNCDMCVILSARVPNPSEDPTLADKEAILASLNIKAMQFEDATSFYSFPQELVGLSPFGNTGMLLRPSVSLGTQVPMITELVNDSNVQFLDQDDDDDPDTELYLTQPFACGTAFAISVLDSLMSTTYFNDSALTLIRTLVTGGATPELELILAEGAGLRGDFSTEERLKNRDRCRVAQIPLVDSCFQAFQTGATYGQVLSQALKEYGMLCIGLYRLHDMAPSELNKRYVITNPPPDLKLLPTDYVYVLQPYDHGLKYPAKQAEQ
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.9	Very low	34.8	Very low	233 Å²	233	159.6 Å²	159.6	100%	1.148	86%	0.855	S	S	*	*				0	67.2	0	-87.5	166.6	158	0	0	107.5
2	T	32.8	Very low	34.5	Very low	126 Å²	126	151.4 Å²	151.4	77%	0.773	84%	0.836	S	S	*	*				59.4	112.8	83.5	55.9	0	0	0	0	114.4
3	D	36.8	Very low	34.2	Very low	142 Å²	142	154.9 Å²	154.9	76%	0.759	84%	0.839	S	S	*	*			trans	77.5	97.9	156.7	-55.3	-30.2	0	0	0	120.6
4	F	43	Very low	34	Very low	213 Å²	213	158.9 Å²	158.9	93%	0.934	84%	0.838	S	S	*	*				-153.3	135.6	126.4	-119.9	-87	0	0	0	111.6
5	H	41.3	Very low	34	Very low	161 Å²	161	156.1 Å²	156.1	75%	0.745	83%	0.833	S	S	*	*			trans	-83.2	150.9	-158.6	-112.9	-95.2	0	0	0	115.1
6	K	39.7	Very low	34.1	Very low	203 Å²	203	156 Å²	156	88%	0.883	83%	0.831	S	S	*	*	S	Bend	trans	79.5	96.8	156.1	-69	177.3	177.2	176.9	0	118.6
7	G	30.8	Very low	34.1	Very low	84 Å²	84	153.8 Å²	153.8	87%	0.866	82%	0.819	S	S	*	*			trans	157	45.4	158.3	0	0	0	0	0	115.2
8	S	30.4	Very low	34	Very low	121 Å²	121	151.6 Å²	151.6	85%	0.846	82%	0.816	S	S	*	*			trans	-100.7	108.9	-177.2	-173.1	0	0	0	0	112.1
9	K	30.3	Very low	34.2	Very low	200 Å²	200	149.5 Å²	149.5	87%	0.87	81%	0.805	S	S	*	*			trans	-138.5	121.5	142.8	-86.6	-169.3	178.7	179.6	0	108.5
10	S	28.3	Very low	34.5	Very low	116 Å²	116	148 Å²	148	81%	0.811	79%	0.793	S	S	*	*			trans	-50.1	130	163.2	52.9	0	0	0	0	112.7
11	M	29.7	Very low	34.5	Very low	157 Å²	157	146.4 Å²	146.4	77%	0.773	79%	0.788	S	S	*	*			trans	-139.2	108	157.7	-122.9	164.9	84.7	0	0	104.3	L16	M11-L16 HydrophobicContact CE-CD1 4.3Å
12	G	31.2	Very low	34.5	Very low	61 Å²	61	138 Å²	138	63%	0.629	76%	0.757	S	S	*	*			cis	71	104.3	46.7	0	0	0	0	0	107.4
13	F	30.4	Very low	34.8	Very low	197 Å²	197	137.9 Å²	137.9	86%	0.864	74%	0.743	S	S	*	*	S	Bend	trans	-15.8	141.2	159.6	-86.4	-112.5	0	0	0	114.6
14	Y	31.2	Very low	34.8	Very low	211 Å²	211	138.6 Å²	138.6	83%	0.827	74%	0.741	S	S	*	*			trans	142.6	132.2	151	-76.9	-65.8	0	0	0	111.3
15	P	34.3	Very low	34.5	Very low	117 Å²	117	134.9 Å²	134.9	76%	0.76	73%	0.727	S	S	*	*			trans	-79	131.1	-175	32.8	-31.5	0	0	0	110.4	N17	P15-N17 PolarHBondContact O-N 3.26Å
16	L	35.1	Very low	34.6	Very low	154 Å²	154	134.1 Å²	134.1	81%	0.806	72%	0.717	S	S	*	*			trans	-87.1	106.6	176.9	-90.6	156.8	0	0	0	110.7	M11 C18	M11-L16 HydrophobicContact CE-CD1 4.3Å; L16-C18 PolarHBondContact O-N 3.2Å
17	N	33.9	Very low	34.6	Very low	118 Å²	118	129.4 Å²	129.4	63%	0.631	70%	0.697	S	S	*	*			trans	-37.2	113.9	162.5	-78.1	-32.1	0	0	0	113.5	P15 Q20	P15-N17 PolarHBondContact O-N 3.26Å; N17-Q20 PolarHBondContact ND2-OE1 3.46Å
18	C	33.7	Very low	35.3	Very low	114 Å²	114	132.4 Å²	132.4	77%	0.77	69%	0.688	S	S	*	*	S	Bend	trans	-122.7	1.2	155.4	-154.5	0	0	0	0	112.7	L16	L16-C18 PolarHBondContact O-N 3.2Å
19	N	37.9	Very low	36.3	Very low	112 Å²	112	133.8 Å²	133.8	60%	0.599	68%	0.681	S	S	*	*	S	Bend	trans	-97.4	-11.2	-178.3	-106.6	-3.3	0	0	0	114.7	Y23	N19-Y23 WeakPolarHBondContact O-CD2 3.17Å
20	Q	38.4	Very low	37.5	Very low	120 Å²	120	126.2 Å²	126.2	56%	0.561	65%	0.65	S	S	*	*	H	α-helix	trans	-75.4	-27.6	-175.6	-99.4	171.4	-17.8	0	0	114.4	N17 Q24	N17-Q20 PolarHBondContact ND2-OE1 3.46Å; Q20-Q24 PolarHBondContact O-N 2.98Å
21	T	36.1	Very low	39.2	Very low	114 Å²	114	124.1 Å²	124.1	70%	0.699	63%	0.632	S	S	*	*	H	α-helix	trans	-78.1	-27.9	-179.2	47.6	0	0	0	0	113.4
22	A	39.4	Very low	40.9	Very low	58 Å²	58	123.6 Å²	123.6	48%	0.479	63%	0.628	S	S	.	*	H	α-helix	trans	-76.4	-25.1	174.3	0	0	0	0	0	113.2
23	Y	38.9	Very low	42.6	Very low	123 Å²	123	128.1 Å²	128.1	48%	0.482	63%	0.632	S	S	.	*	H	α-helix	trans	-82.8	-30.8	-178.7	-86.9	-103.9	0	0	0	113.2	N19	N19-Y23 WeakPolarHBondContact O-CD2 3.17Å
24	Q	37.3	Very low	44.3	Very low	156 Å²	156	122.1 Å²	122.1	73%	0.729	61%	0.607	S	S	*	*	H	α-helix	trans	-77	-31.2	176.3	-112	158.6	-43.4	0	0	113	Q20 R26	Q20-Q24 PolarHBondContact O-N 2.98Å; Q24-R26 PolarHBondContact O-N 3.33Å
25	H	36.4	Very low	46	Very low	135 Å²	135	117.7 Å²	117.7	63%	0.625	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	-10.7	178.2	-137.1	-55.5	0	0	0	114.1	E28	H25-E28 IonicContact CE1-OE2 2.93Å; H25-E28 IonicContact ND1-OE2 2.63Å
26	R	42.2	Very low	47.7	Very low	145 Å²	145	119.9 Å²	119.9	55%	0.547	58%	0.582	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.3	-9.2	-175.1	-150.4	177.2	-111.4	-176.8	-3.5	113.7	Q24 E28	Q24-R26 PolarHBondContact O-N 3.33Å; R26-E28 VanDerWaalsContact C-N 3.35Å
27	F	41.6	Very low	49.5	Very low	104 Å²	104	114.1 Å²	114.1	46%	0.456	55%	0.554	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.7	-10	176	-121.6	-84.6	0	0	0	113.8	M30 R35 R364	F27-M30 HydrophobicContact CD1-CE 4.41Å; F27-M30 HydrophobicContact CE1-CE 4.22Å; F27-R35 PolarHBondContact O-NH2 2.72Å; F27-R364 VanDerWaalsContact CE2-CZ 3.44Å; F27-R364 VanDerWaalsContact CZ-NH2 3.3Å
28	E	44.3	Very low	51.3	Low	147 Å²	147	110.1 Å²	110.1	69%	0.687	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-6.2	179.4	-73.2	-178.3	156.1	0	0	114.1	H25 R26	H25-E28 IonicContact CE1-OE2 2.93Å; H25-E28 IonicContact ND1-OE2 2.63Å; R26-E28 VanDerWaalsContact C-N 3.35Å
29	Q	51.8	Low	53	Low	150 Å²	150	112.3 Å²	112.3	70%	0.701	53%	0.532	S	S	*	.			trans	-99.9	15.3	-178.8	-77.4	-172.1	-24.7	0	0	115.1
30	M	56.3	Low	54.9	Low	41 Å²	41	112.6 Å²	112.6	20%	0.202	53%	0.53	C	S	.	.	S	Bend	trans	-80.8	122.7	169.7	-129.8	-172.9	-36.8	0	0	108.2	F27 E34 R35 L38	F27-M30 HydrophobicContact CD1-CE 4.41Å; F27-M30 HydrophobicContact CE1-CE 4.22Å; M30-E34 HydrophobicContact CG-CB 4.01Å; M30-R35 HydrophobicContact CB-CG 4.11Å; M30-R35 HydrophobicContact CE-CG 3.81Å; M30-R35 HydrophobicContact CG-CG 4.32Å; M30-R35 HydrophobicContact SD-CG 3.68Å; M30-L38 HydrophobicContact SD-CD1 4.1Å
31	T	62.7	Low	56.7	Low	73 Å²	73	113 Å²	113	45%	0.448	53%	0.526	S	S	.	.			trans	-61	148.1	173	58.1	0	0	0	0	109.3	E33 E34 R35	T31-E33 PolarHBondContact O-N 2.75Å; T31-E33 VanDerWaalsContact O-N 3.15Å; T31-E34 PolarHBondContact N-OE2 2.86Å; T31-E34 PolarHBondContact O-N 3.17Å; T31-E34 WeakPolarHBondContact OG1-CB 3.46Å; T31-E34 WeakPolarHBondContact OG1-CG 3.41Å; T31-E34 PolarHBondContact OG1-N 3.03Å; T31-E34 PolarHBondContact OG1-OE2 2.69Å; T31-R35 PolarHBondContact O-N 3.17Å; T31-R35 VanDerWaalsContact O-N 3.08Å
32	E	64.9	Low	59	Low	145 Å²	145	110.2 Å²	110.2	68%	0.678	50%	0.504	S	S	*	.	H	α-helix	trans	-62.3	-23.7	-179.7	-161.9	138.5	-166.8	0	0	112	R36	E32-R36 WeakPolarHBondContact O-CB 3.27Å; E32-R36 PolarHBondContact O-N 2.84Å; E32-R36 VanDerWaalsContact O-N 3.09Å
33	E	67	Low	61.1	Low	156 Å²	156	111.6 Å²	111.6	73%	0.729	50%	0.497	S	S	*	.	H	α-helix	trans	-68.2	-46	171.2	-63	-177.8	171.4	0	0	112.2	T31 R35 R36 C37	T31-E33 PolarHBondContact O-N 2.75Å; T31-E33 VanDerWaalsContact O-N 3.15Å; E33-R35 PolarHBondContact O-N 3.14Å; E33-R36 PolarHBondContact O-N 3.42Å; E33-C37 PolarHBondContact O-N 3.35Å
34	E	66	Low	63.4	Low	71 Å²	71	112.2 Å²	112.2	33%	0.332	50%	0.499	S	S	.	.	H	α-helix	trans	-63	-41.7	175.8	-74.7	165.4	141.4	0	0	111.7	M30 T31 C37 L38	M30-E34 HydrophobicContact CG-CB 4.01Å; T31-E34 PolarHBondContact N-OE2 2.86Å; T31-E34 PolarHBondContact O-N 3.17Å; T31-E34 WeakPolarHBondContact OG1-CB 3.46Å; T31-E34 WeakPolarHBondContact OG1-CG 3.41Å; T31-E34 PolarHBondContact OG1-N 3.03Å; T31-E34 PolarHBondContact OG1-OE2 2.69Å; E34-C37 PolarHBondContact O-N 2.85Å; E34-L38 WeakPolarHBondContact O-CB 3.13Å; E34-L38 WeakPolarHBondContact O-CG 3.15Å; E34-L38 PolarHBondContact O-N 2.98Å; E34-L38 VanDerWaalsContact O-N 3.09Å
35	R	68	Low	66	Low	119 Å²	119	106.1 Å²	106.1	45%	0.449	47%	0.473	S	S	.	.	H	α-helix	trans	-60.9	-49.3	175.4	-81.4	-176.1	-179.5	168.4	3	111.6	F27 M30 T31 E33 C37 L38 E39	F27-R35 PolarHBondContact O-NH2 2.72Å; M30-R35 HydrophobicContact CB-CG 4.11Å; M30-R35 HydrophobicContact CE-CG 3.81Å; M30-R35 HydrophobicContact CG-CG 4.32Å; M30-R35 HydrophobicContact SD-CG 3.68Å; T31-R35 PolarHBondContact O-N 3.17Å; T31-R35 VanDerWaalsContact O-N 3.08Å; E33-R35 PolarHBondContact O-N 3.14Å; R35-C37 VanDerWaalsContact C-N 3.26Å; R35-C37 PolarHBondContact O-N 3.4Å; R35-L38 PolarHBondContact O-N 3.46Å; R35-L38 VanDerWaalsContact O-N 3.09Å; R35-E39 PolarHBondContact O-N 2.87Å; R35-E39 VanDerWaalsContact O-N 3.16Å
36	R	70.2	Confident	68.6	Low	162 Å²	162	99.8 Å²	99.8	61%	0.611	44%	0.444	S	S	*	.	H	α-helix	trans	-59.3	-38	177	-84.9	-172.1	-114.5	173.5	-5	112.3	E32 E33 L38	E32-R36 WeakPolarHBondContact O-CB 3.27Å; E32-R36 PolarHBondContact O-N 2.84Å; E32-R36 VanDerWaalsContact O-N 3.09Å; E33-R36 PolarHBondContact O-N 3.42Å; R36-L38 VanDerWaalsContact C-N 3.29Å; R36-L38 PolarHBondContact O-N 3.16Å
37	C	72.3	Confident	70.8	Confident	33 Å²	33	96.1 Å²	96.1	22%	0.223	44%	0.435	C	S	.	.	H	α-helix	trans	-67.4	-32.1	177.7	-169.1	0	0	0	0	113	E33 E34 R35 C182 R242	E33-C37 PolarHBondContact O-N 3.35Å; E34-C37 PolarHBondContact O-N 2.85Å; R35-C37 VanDerWaalsContact C-N 3.26Å; R35-C37 PolarHBondContact O-N 3.4Å; C37-C182 HydrophobicContact CB-CB 3.53Å; C37-C182 WeakPolarHBondContact CB-SG 3.24Å; C37-C182 WeakPolarHBondContact SG-CB 3.09Å; C37-C182 CovalentContact SG-SG 2.01Å; C37-C182 PolarHBondContact SG-SG 2.91Å; C37-R242 PolarHBondContact O-NH2 2.59Å
38	L	71.6	Confident	73.2	Confident	34 Å²	34	94.8 Å²	94.8	18%	0.178	43%	0.432	C	S	.	.	H	α-helix	trans	-88.4	-4	-178	-68.2	171.5	0	0	0	114.7	M30 E34 R35 R36 E40 E180	M30-L38 HydrophobicContact SD-CD1 4.1Å; E34-L38 WeakPolarHBondContact O-CB 3.13Å; E34-L38 WeakPolarHBondContact O-CG 3.15Å; E34-L38 PolarHBondContact O-N 2.98Å; E34-L38 VanDerWaalsContact O-N 3.09Å; R35-L38 PolarHBondContact O-N 3.46Å; R35-L38 VanDerWaalsContact O-N 3.09Å; R36-L38 VanDerWaalsContact C-N 3.29Å; R36-L38 PolarHBondContact O-N 3.16Å; L38-E40 VanDerWaalsContact C-N 3.28Å; L38-E40 PolarHBondContact O-N 3.38Å; L38-E180 HydrophobicContact CD2-CB 4.18Å; L38-E180 HydrophobicContact CD2-CG 4.26Å; L38-E180 WeakPolarHBondContact CD2-O 3.42Å
39	E	70.7	Confident	75.5	Confident	161 Å²	161	88.7 Å²	88.7	75%	0.752	41%	0.406	S	S	*	.	S	Bend	trans	-59.6	-40	174	-77.5	178.2	-177.8	0	0	111.7	R35	R35-E39 PolarHBondContact O-N 2.87Å; R35-E39 VanDerWaalsContact O-N 3.16Å
40	E	76	Confident	77.5	Confident	118 Å²	118	81.7 Å²	81.7	55%	0.551	37%	0.373	S	S	*	.	S	Bend	trans	-107.4	98.8	173.9	-168.9	-170.8	-160.4	0	0	109.8	L38 K42 R242	L38-E40 VanDerWaalsContact C-N 3.28Å; L38-E40 PolarHBondContact O-N 3.38Å; E40-K42 WeakPolarHBondContact OE2-CE 3.25Å; E40-K42 IonicContact OE2-NZ 2.73Å; E40-K42 PolarHBondContact OE2-NZ 3.42Å; E40-R242 PolarHBondContact O-NH1 3.29Å
41	R	76.1	Confident	79.2	Confident	128 Å²	128	83.6 Å²	83.6	48%	0.483	38%	0.384	S	S	.	.			trans	-72.4	128.8	177.8	-62.3	-175	179.6	-179	0.7	111.4	Y43	R41-Y43 HydrophobicContact CB-CD1 4.02Å; R41-Y43 HydrophobicContact CB-CE1 4.5Å
42	K	85	Confident	80.6	Confident	55 Å²	55	84.4 Å²	84.4	24%	0.239	38%	0.384	C	S	.	.			trans	-112.9	19.7	-177.6	-68.7	-178.9	-175.6	177.1	0	113.4	E40 W44 C45 F46 E180 L240	E40-K42 WeakPolarHBondContact OE2-CE 3.25Å; E40-K42 IonicContact OE2-NZ 2.73Å; E40-K42 PolarHBondContact OE2-NZ 3.42Å; K42-W44 PolarHBondContact O-N 3.06Å; K42-C45 WeakPolarHBondContact O-CB 3.32Å; K42-C45 PolarHBondContact O-N 2.94Å; K42-F46 WeakPolarHBondContact O-CD2 3.27Å; K42-E180 PolarHBondContact N-OE1 2.07Å; K42-E180 PolarHBondContact N-OE2 2.72Å; K42-E180 VanDerWaalsContact N-OE2 3.14Å; K42-L240 HydrophobicContact CB-CD1 4.33Å
43	Y	84.3	Confident	81.9	Confident	87 Å²	87	80.2 Å²	80.2	34%	0.341	37%	0.368	S	S	.	.	H	α-helix	trans	-49.6	-34	175.7	75.6	-89.6	0	0	0	113.9	R41 C45 F46 L47 E180	R41-Y43 HydrophobicContact CB-CD1 4.02Å; R41-Y43 HydrophobicContact CB-CE1 4.5Å; Y43-C45 VanDerWaalsContact C-N 3.29Å; Y43-C45 PolarHBondContact O-N 3.45Å; Y43-F46 WeakPolarHBondContact O-CB 3.25Å; Y43-F46 PolarHBondContact O-N 3.22Å; Y43-L47 PolarHBondContact O-N 3.25Å; Y43-E180 PolarHBondContact N-OE2 2.71Å
44	W	87.3	Confident	83.1	Confident	137 Å²	137	75.3 Å²	75.3	52%	0.519	35%	0.345	S	S	.	.	H	α-helix	trans	-66.4	-28.1	-179	62.7	-88.8	0	0	0	112.9	K42 F46 L47 L48	K42-W44 PolarHBondContact O-N 3.06Å; W44-F46 VanDerWaalsContact C-N 3.32Å; W44-F46 PolarHBondContact O-N 3.19Å; W44-L47 PolarHBondContact O-N 3.08Å; W44-L48 HydrophobicContact CE3-CD2 4.34Å; W44-L48 HydrophobicContact CZ3-CD2 4.21Å; W44-L48 WeakPolarHBondContact O-CB 3.46Å; W44-L48 PolarHBondContact O-N 3.11Å
45	C	91	Very high	84.4	Confident	28 Å²	28	75.1 Å²	75.1	19%	0.189	35%	0.351	C	S	.	.	H	α-helix	trans	-64.1	-39.6	175.9	-60.1	0	0	0	0	111.5	K42 Y43 S49 V236 L240	K42-C45 WeakPolarHBondContact O-CB 3.32Å; K42-C45 PolarHBondContact O-N 2.94Å; Y43-C45 VanDerWaalsContact C-N 3.29Å; Y43-C45 PolarHBondContact O-N 3.45Å; C45-S49 WeakPolarHBondContact O-CB 3.4Å; C45-S49 PolarHBondContact O-N 3.16Å; C45-V236 HydrophobicContact CB-CG1 4.31Å; C45-L240 HydrophobicContact CB-CD1 3.69Å
46	F	90.5	Very high	85.6	Confident	2 Å²	2	74.3 Å²	74.3	1%	0.009	36%	0.355	C	S	.	.	H	α-helix	trans	-65.2	-50	177.4	-61.7	-90.2	0	0	0	111.3	K42 Y43 W44 L48 S49 S50 P233 V236 A237 L240 R242 W244	K42-F46 WeakPolarHBondContact O-CD2 3.27Å; Y43-F46 WeakPolarHBondContact O-CB 3.25Å; Y43-F46 PolarHBondContact O-N 3.22Å; W44-F46 VanDerWaalsContact C-N 3.32Å; W44-F46 PolarHBondContact O-N 3.19Å; F46-L48 PolarHBondContact O-N 2.98Å; F46-S49 WeakPolarHBondContact O-CB 3.38Å; F46-S49 PolarHBondContact O-N 3.24Å; F46-S49 PolarHBondContact O-OG 3.17Å; F46-S50 PolarHBondContact O-N 3.04Å; F46-P233 HydrophobicContact CB-CB 4.21Å; F46-P233 HydrophobicContact CD1-CB 4.07Å; F46-P233 WeakPolarHBondContact CD1-O 3.3Å; F46-V236 HydrophobicContact CD1-CB 4.08Å; F46-V236 HydrophobicContact CD1-CG1 3.91Å; F46-V236 HydrophobicContact CE1-CB 4.32Å; F46-V236 HydrophobicContact CE1-CG1 4.04Å; F46-V236 HydrophobicContact CG-CG1 4.26Å; F46-V236 HydrophobicContact CZ-CG1 4.48Å; F46-A237 HydrophobicContact CE1-CB 3.82Å; F46-L240 HydrophobicContact CE2-CD1 4.22Å; F46-L240 HydrophobicContact CZ-CD1 4.34Å; F46-R242 HydrophobicContact CZ-CB 4.21Å; F46-R242 WeakPolarHBondContact CZ-O 3.42Å; F46-W244 HydrophobicContact CB-CD2 4.07Å; F46-W244 HydrophobicContact CB-CE3 3.24Å; F46-W244 HydrophobicContact CB-CZ3 3.54Å; F46-W244 HydrophobicContact CD1-CB 4.18Å; F46-W244 HydrophobicContact CD1-CE3 4.3Å; F46-W244 HydrophobicContact CD2-CB 3.91Å; F46-W244 HydrophobicContact CD2-CD2 4.29Å; F46-W244 HydrophobicContact CD2-CE3 4.25Å; F46-W244 HydrophobicContact CD2-CG 4.19Å; F46-W244 HydrophobicContact CE1-CB 4.11Å; F46-W244 HydrophobicContact CE2-CB 3.85Å; F46-W244 HydrophobicContact CG-CB 4.07Å; F46-W244 HydrophobicContact CG-CD2 4.18Å; F46-W244 AromaticContact CG-CE3 3.71Å; F46-W244 HydrophobicContact CG-CE3 3.71Å; F46-W244 HydrophobicContact CG-CG 4.38Å; F46-W244 HydrophobicContact CG-CZ3 4.47Å; F46-W244 HydrophobicContact CZ-CB 3.95Å
47	L	89	Confident	86.5	Confident	67 Å²	67	67.6 Å²	67.6	35%	0.351	33%	0.333	S	S	.	.	H	α-helix	trans	-63.8	-42.7	180	-173.9	68.7	0	0	0	111.6	Y43 W44 S49 S50 I51 W244 L247	Y43-L47 PolarHBondContact O-N 3.25Å; W44-L47 PolarHBondContact O-N 3.08Å; L47-S49 VanDerWaalsContact C-N 3.27Å; L47-S49 PolarHBondContact O-N 2.87Å; L47-S50 PolarHBondContact O-N 2.98Å; L47-I51 HydrophobicContact CD2-CD1 4.46Å; L47-I51 HydrophobicContact CG-CD1 4.01Å; L47-I51 WeakPolarHBondContact O-CG1 3.47Å; L47-I51 PolarHBondContact O-N 3.32Å; L47-I51 VanDerWaalsContact O-N 3.13Å; L47-W244 HydrophobicContact CB-CH2 4.34Å; L47-L247 HydrophobicContact CD1-CD1 3.93Å
48	L	92.5	Very high	87.3	Confident	76 Å²	76	67.3 Å²	67.3	40%	0.398	33%	0.328	S	S	.	.	H	α-helix	trans	-61.9	-37.2	178.4	-172.3	68.6	0	0	0	111.2	W44 F46 S50 I51 I52	W44-L48 HydrophobicContact CE3-CD2 4.34Å; W44-L48 HydrophobicContact CZ3-CD2 4.21Å; W44-L48 WeakPolarHBondContact O-CB 3.46Å; W44-L48 PolarHBondContact O-N 3.11Å; F46-L48 PolarHBondContact O-N 2.98Å; L48-S50 VanDerWaalsContact C-N 3.35Å; L48-S50 PolarHBondContact O-N 3.15Å; L48-I51 PolarHBondContact O-N 2.85Å; L48-I52 HydrophobicContact CD1-CD1 4.05Å; L48-I52 HydrophobicContact CD1-CG1 4.16Å; L48-I52 HydrophobicContact CD2-CD1 4.06Å; L48-I52 HydrophobicContact CG-CD1 3.63Å; L48-I52 HydrophobicContact CG-CG1 4.11Å; L48-I52 WeakPolarHBondContact O-CB 3.21Å; L48-I52 VanDerWaalsContact O-CG1 3.29Å; L48-I52 WeakPolarHBondContact O-CG1 3.41Å; L48-I52 PolarHBondContact O-N 3.01Å
49	S	93.3	Very high	88.3	Confident	19 Å²	19	70.9 Å²	70.9	13%	0.133	35%	0.347	C	S	.	.	H	α-helix	trans	-59.9	-42.3	176.5	79.1	0	0	0	0	112.9	C45 F46 L47 T53	C45-S49 WeakPolarHBondContact O-CB 3.4Å; C45-S49 PolarHBondContact O-N 3.16Å; F46-S49 WeakPolarHBondContact O-CB 3.38Å; F46-S49 PolarHBondContact O-N 3.24Å; F46-S49 PolarHBondContact O-OG 3.17Å; L47-S49 VanDerWaalsContact C-N 3.27Å; L47-S49 PolarHBondContact O-N 2.87Å; S49-T53 WeakPolarHBondContact O-CB 3.32Å; S49-T53 PolarHBondContact O-N 3.29Å; S49-T53 PolarHBondContact O-OG1 2.98Å
50	S	92.2	Very high	89.3	Confident	3 Å²	3	68.2 Å²	68.2	2%	0.021	34%	0.338	C	S	.	.	H	α-helix	trans	-65.3	-45.9	175.6	-64.9	0	0	0	0	112.1	F46 L47 L48 T53 F54 Y228 P233	F46-S50 PolarHBondContact O-N 3.04Å; L47-S50 PolarHBondContact O-N 2.98Å; L48-S50 VanDerWaalsContact C-N 3.35Å; L48-S50 PolarHBondContact O-N 3.15Å; S50-T53 PolarHBondContact O-N 2.91Å; S50-F54 PolarHBondContact O-N 3.38Å; S50-Y228 WeakPolarHBondContact CB-O 3.38Å; S50-Y228 PolarHBondContact OG-O 3.35Å; S50-P233 WeakPolarHBondContact OG-CD 3.43Å; S50-P233 VanDerWaalsContact OG-CG 3.26Å; S50-P233 WeakPolarHBondContact OG-CG 3.35Å
51	I	91.8	Very high	89.9	Confident	82 Å²	82	63.7 Å²	63.7	42%	0.421	32%	0.318	S	S	.	.	H	α-helix	trans	-64.3	-47.1	-179.6	-65.3	169.2	0	0	0	110.8	L47 L48 T53 F54 C55	L47-I51 HydrophobicContact CD2-CD1 4.46Å; L47-I51 HydrophobicContact CG-CD1 4.01Å; L47-I51 WeakPolarHBondContact O-CG1 3.47Å; L47-I51 PolarHBondContact O-N 3.32Å; L47-I51 VanDerWaalsContact O-N 3.13Å; L48-I51 PolarHBondContact O-N 2.85Å; I51-T53 VanDerWaalsContact C-N 3.34Å; I51-T53 PolarHBondContact O-N 3.24Å; I51-F54 PolarHBondContact O-N 3.47Å; I51-C55 WeakPolarHBondContact O-CB 3.46Å; I51-C55 PolarHBondContact O-N 3.07Å; I51-C55 PolarHBondContact O-SG 3.36Å; I51-C55 VanDerWaalsContact O-SG 3.37Å
52	I	93.6	Very high	90.4	Very high	89 Å²	89	60.5 Å²	60.5	46%	0.456	31%	0.313	S	S	.	.	H	α-helix	trans	-62.1	-44.1	178.5	-69.8	176	0	0	0	110.3	L48 F54 C55 L56	L48-I52 HydrophobicContact CD1-CD1 4.05Å; L48-I52 HydrophobicContact CD1-CG1 4.16Å; L48-I52 HydrophobicContact CD2-CD1 4.06Å; L48-I52 HydrophobicContact CG-CD1 3.63Å; L48-I52 HydrophobicContact CG-CG1 4.11Å; L48-I52 WeakPolarHBondContact O-CB 3.21Å; L48-I52 VanDerWaalsContact O-CG1 3.29Å; L48-I52 WeakPolarHBondContact O-CG1 3.41Å; L48-I52 PolarHBondContact O-N 3.01Å; I52-F54 VanDerWaalsContact C-N 3.34Å; I52-F54 PolarHBondContact O-N 3.1Å; I52-C55 PolarHBondContact O-N 3.1Å; I52-L56 WeakPolarHBondContact O-CB 3.47Å; I52-L56 PolarHBondContact O-N 3.39Å
53	T	92.6	Very high	90.6	Very high	57 Å²	57	60.8 Å²	60.8	35%	0.35	32%	0.319	S	S	.	.	H	α-helix	trans	-60.2	-45.4	178.9	-56.6	0	0	0	0	111.1	S49 S50 I51 S57 Y228 P232	S49-T53 WeakPolarHBondContact O-CB 3.32Å; S49-T53 PolarHBondContact O-N 3.29Å; S49-T53 PolarHBondContact O-OG1 2.98Å; S50-T53 PolarHBondContact O-N 2.91Å; I51-T53 VanDerWaalsContact C-N 3.34Å; I51-T53 PolarHBondContact O-N 3.24Å; T53-S57 VanDerWaalsContact O-CB 3.26Å; T53-S57 WeakPolarHBondContact O-CB 3.34Å; T53-S57 PolarHBondContact O-N 2.58Å; T53-S57 PolarHBondContact O-OG 3.17Å; T53-Y228 HydrophobicContact CG2-CD1 4.01Å; T53-Y228 HydrophobicContact CG2-CE1 4.14Å; T53-P232 HydrophobicContact CG2-CG 4.16Å
54	F	92.1	Very high	90.8	Very high	53 Å²	53	63 Å²	63	23%	0.232	33%	0.327	C	S	.	.	H	α-helix	trans	-61.4	-55.4	175.5	171.4	-103.7	0	0	0	111.8	S50 I51 I52 L56 S57 M58 L220 F225 Y228	S50-F54 PolarHBondContact O-N 3.38Å; I51-F54 PolarHBondContact O-N 3.47Å; I52-F54 VanDerWaalsContact C-N 3.34Å; I52-F54 PolarHBondContact O-N 3.1Å; F54-L56 VanDerWaalsContact C-N 3.34Å; F54-L56 PolarHBondContact O-N 2.99Å; F54-S57 PolarHBondContact O-N 3.4Å; F54-S57 PolarHBondContact O-OG 3.29Å; F54-M58 HydrophobicContact CD2-CG 4.41Å; F54-M58 HydrophobicContact CE1-CG 4.41Å; F54-M58 HydrophobicContact CE2-CE 3.8Å; F54-M58 HydrophobicContact CE2-CG 3.92Å; F54-M58 HydrophobicContact CZ-CE 4.19Å; F54-M58 HydrophobicContact CZ-CG 3.92Å; F54-M58 PolarHBondContact O-N 3.07Å; F54-L220 HydrophobicContact CE2-CD2 4.34Å; F54-L220 HydrophobicContact CZ-CD2 4.23Å; F54-F225 AromaticContact CD2-CE1 3.97Å; F54-F225 HydrophobicContact CD2-CE1 3.97Å; F54-F225 HydrophobicContact CD2-CZ 4.49Å; F54-F225 AromaticContact CE2-CE1 3.69Å; F54-F225 HydrophobicContact CE2-CE1 3.69Å; F54-F225 AromaticContact CE2-CZ 3.78Å; F54-F225 HydrophobicContact CE2-CZ 3.78Å; F54-F225 HydrophobicContact CZ-CE1 4.12Å; F54-F225 HydrophobicContact CZ-CZ 4.1Å; F54-Y228 HydrophobicContact CB-CD2 4.38Å; F54-Y228 HydrophobicContact CB-CG 4.49Å; F54-Y228 AromaticContact CD2-CD2 3.99Å; F54-Y228 HydrophobicContact CD2-CD2 3.99Å; F54-Y228 AromaticContact CD2-CE2 3.79Å; F54-Y228 HydrophobicContact CD2-CE2 3.79Å
55	C	92.5	Very high	90.7	Very high	68 Å²	68	63 Å²	63	46%	0.459	33%	0.327	S	S	.	.	H	α-helix	trans	-60.2	-41.8	-177.9	-70.5	0	0	0	0	112.5	I51 I52 M58 L59	I51-C55 WeakPolarHBondContact O-CB 3.46Å; I51-C55 PolarHBondContact O-N 3.07Å; I51-C55 PolarHBondContact O-SG 3.36Å; I51-C55 VanDerWaalsContact O-SG 3.37Å; I52-C55 PolarHBondContact O-N 3.1Å; C55-M58 PolarHBondContact O-N 3.36Å; C55-L59 VanDerWaalsContact O-CB 3.24Å; C55-L59 WeakPolarHBondContact O-CB 3.37Å; C55-L59 PolarHBondContact O-N 2.96Å
56	L	92.9	Very high	90.4	Very high	101 Å²	101	66 Å²	66	53%	0.529	34%	0.341	S	S	.	.	H	α-helix	trans	-68.1	-41.6	178.6	-169.5	134.1	0	0	0	111.1	I52 F54 M58 L59 L60	I52-L56 WeakPolarHBondContact O-CB 3.47Å; I52-L56 PolarHBondContact O-N 3.39Å; F54-L56 VanDerWaalsContact C-N 3.34Å; F54-L56 PolarHBondContact O-N 2.99Å; L56-M58 PolarHBondContact O-N 3.46Å; L56-L59 PolarHBondContact O-N 2.7Å; L56-L60 HydrophobicContact CD2-CD1 3.66Å; L56-L60 HydrophobicContact CD2-CG 4.37Å; L56-L60 HydrophobicContact CG-CD1 4.45Å; L56-L60 WeakPolarHBondContact O-CB 3.37Å; L56-L60 VanDerWaalsContact O-CG 3.27Å; L56-L60 WeakPolarHBondContact O-CG 3.25Å; L56-L60 PolarHBondContact O-N 2.96Å
57	S	89.7	Confident	90.2	Very high	22 Å²	22	70.5 Å²	70.5	15%	0.154	36%	0.364	C	S	.	.	H	α-helix	trans	-62	-43	175.3	73.3	0	0	0	0	112.3	T53 F54 L60 V61 Y228	T53-S57 VanDerWaalsContact O-CB 3.26Å; T53-S57 WeakPolarHBondContact O-CB 3.34Å; T53-S57 PolarHBondContact O-N 2.58Å; T53-S57 PolarHBondContact O-OG 3.17Å; F54-S57 PolarHBondContact O-N 3.4Å; F54-S57 PolarHBondContact O-OG 3.29Å; S57-L60 PolarHBondContact O-N 3.17Å; S57-V61 WeakPolarHBondContact O-CG2 3.44Å; S57-V61 PolarHBondContact O-N 2.89Å; S57-V61 VanDerWaalsContact O-N 3.12Å; S57-Y228 PolarHBondContact OG-OH 2.75Å
58	M	89.3	Confident	89.7	Confident	26 Å²	26	70.4 Å²	70.4	13%	0.128	36%	0.364	C	S	.	.	H	α-helix	trans	-64	-48	175.5	-84.3	-61.9	172.2	0	0	112.3	F54 C55 L56 L60 V61 V62 L219 L220	F54-M58 HydrophobicContact CD2-CG 4.41Å; F54-M58 HydrophobicContact CE1-CG 4.41Å; F54-M58 HydrophobicContact CE2-CE 3.8Å; F54-M58 HydrophobicContact CE2-CG 3.92Å; F54-M58 HydrophobicContact CZ-CE 4.19Å; F54-M58 HydrophobicContact CZ-CG 3.92Å; F54-M58 PolarHBondContact O-N 3.07Å; C55-M58 PolarHBondContact O-N 3.36Å; L56-M58 PolarHBondContact O-N 3.46Å; M58-L60 VanDerWaalsContact C-N 3.31Å; M58-L60 PolarHBondContact O-N 2.84Å; M58-V61 PolarHBondContact O-N 3.25Å; M58-V62 WeakPolarHBondContact O-CB 3.26Å; M58-V62 VanDerWaalsContact O-CG2 3.27Å; M58-V62 WeakPolarHBondContact O-CG2 3.25Å; M58-V62 PolarHBondContact O-N 2.94Å; M58-L219 HydrophobicContact CE-CB 3.22Å; M58-L219 HydrophobicContact CE-CD1 4.12Å; M58-L219 HydrophobicContact CE-CG 4.33Å; M58-L219 HydrophobicContact SD-CB 4.2Å; M58-L219 HydrophobicContact SD-CD1 4Å; M58-L220 HydrophobicContact CE-CD1 4.5Å; M58-L220 HydrophobicContact CE-CD2 3.54Å; M58-L220 HydrophobicContact CE-CG 3.54Å
59	L	91.7	Very high	89	Confident	109 Å²	109	72.3 Å²	72.3	57%	0.571	37%	0.371	S	S	*	.	H	α-helix	trans	-59.6	-43.5	179.2	-175.3	141.5	0	0	0	110.8	C55 L56 T63	C55-L59 VanDerWaalsContact O-CB 3.24Å; C55-L59 WeakPolarHBondContact O-CB 3.37Å; C55-L59 PolarHBondContact O-N 2.96Å; L56-L59 PolarHBondContact O-N 2.7Å; L59-T63 WeakPolarHBondContact O-CB 3.26Å; L59-T63 PolarHBondContact O-N 3.29Å; L59-T63 PolarHBondContact O-OG1 3.41Å
60	L	91.5	Very high	88.4	Confident	106 Å²	106	76.3 Å²	76.3	56%	0.555	39%	0.39	S	S	*	.	H	α-helix	trans	-61.8	-46.8	177.4	-73.8	174.1	0	0	0	112.4	L56 S57 M58 Y64	L56-L60 HydrophobicContact CD2-CD1 3.66Å; L56-L60 HydrophobicContact CD2-CG 4.37Å; L56-L60 HydrophobicContact CG-CD1 4.45Å; L56-L60 WeakPolarHBondContact O-CB 3.37Å; L56-L60 VanDerWaalsContact O-CG 3.27Å; L56-L60 WeakPolarHBondContact O-CG 3.25Å; L56-L60 PolarHBondContact O-N 2.96Å; S57-L60 PolarHBondContact O-N 3.17Å; M58-L60 VanDerWaalsContact C-N 3.31Å; M58-L60 PolarHBondContact O-N 2.84Å; L60-Y64 VanDerWaalsContact O-CB 3.26Å; L60-Y64 WeakPolarHBondContact O-CB 3.42Å; L60-Y64 PolarHBondContact O-N 3.18Å
61	V	88.1	Confident	87.3	Confident	23 Å²	23	80 Å²	80	14%	0.139	42%	0.415	C	S	.	.	H	α-helix	trans	-69.1	-42.7	-179.3	174.1	0	0	0	0	111.8	S57 M58 Y64 R65 F209 K215 V216 L219	S57-V61 WeakPolarHBondContact O-CG2 3.44Å; S57-V61 PolarHBondContact O-N 2.89Å; S57-V61 VanDerWaalsContact O-N 3.12Å; M58-V61 PolarHBondContact O-N 3.25Å; V61-Y64 PolarHBondContact O-N 3.48Å; V61-R65 WeakPolarHBondContact O-CB 3.28Å; V61-R65 PolarHBondContact O-N 3.28Å; V61-F209 HydrophobicContact CG2-CE2 4.45Å; V61-F209 HydrophobicContact CG2-CZ 4.42Å; V61-K215 HydrophobicContact CG1-CB 3.8Å; V61-K215 HydrophobicContact CG2-CB 4.45Å; V61-V216 HydrophobicContact CG1-CG2 3.61Å; V61-L219 HydrophobicContact CB-CD1 4.04Å; V61-L219 HydrophobicContact CG2-CD1 3.63Å
62	V	88.7	Confident	85.8	Confident	61 Å²	61	79.3 Å²	79.3	37%	0.37	42%	0.416	S	S	.	.	H	α-helix	trans	-65.8	-43.7	177.3	172.8	0	0	0	0	110.5	M58 Y64 R65 I66	M58-V62 WeakPolarHBondContact O-CB 3.26Å; M58-V62 VanDerWaalsContact O-CG2 3.27Å; M58-V62 WeakPolarHBondContact O-CG2 3.25Å; M58-V62 PolarHBondContact O-N 2.94Å; V62-Y64 VanDerWaalsContact C-N 3.35Å; V62-Y64 PolarHBondContact O-N 3.13Å; V62-R65 PolarHBondContact O-N 3.35Å; V62-I66 HydrophobicContact CG1-CD1 3.7Å; V62-I66 HydrophobicContact CG1-CG1 4.3Å; V62-I66 WeakPolarHBondContact O-CB 3.18Å; V62-I66 VanDerWaalsContact O-CG1 3.27Å; V62-I66 WeakPolarHBondContact O-CG1 3.32Å; V62-I66 PolarHBondContact O-N 3.41Å
63	T	88.4	Confident	83.8	Confident	60 Å²	60	80.5 Å²	80.5	37%	0.368	42%	0.42	S	S	.	.	H	α-helix	trans	-62.6	-42.8	176.2	-54.5	0	0	0	0	110.8	L59 R65 I66 L67	L59-T63 WeakPolarHBondContact O-CB 3.26Å; L59-T63 PolarHBondContact O-N 3.29Å; L59-T63 PolarHBondContact O-OG1 3.41Å; T63-R65 VanDerWaalsContact C-N 3.34Å; T63-R65 PolarHBondContact O-N 3.43Å; T63-I66 PolarHBondContact O-N 2.99Å; T63-L67 HydrophobicContact CG2-CD1 3.91Å; T63-L67 HydrophobicContact CG2-CG 4.21Å; T63-L67 VanDerWaalsContact O-CB 3.31Å; T63-L67 WeakPolarHBondContact O-CB 3.23Å; T63-L67 WeakPolarHBondContact O-CG 3.43Å; T63-L67 PolarHBondContact O-N 3.34Å
64	Y	87.3	Confident	81.5	Confident	133 Å²	133	87.8 Å²	87.8	52%	0.522	44%	0.441	S	S	.	.	H	α-helix	trans	-60	-42.2	173.7	179.1	-100.7	0	0	0	112.2	L60 V61 V62 L67 N68	L60-Y64 VanDerWaalsContact O-CB 3.26Å; L60-Y64 WeakPolarHBondContact O-CB 3.42Å; L60-Y64 PolarHBondContact O-N 3.18Å; V61-Y64 PolarHBondContact O-N 3.48Å; V62-Y64 VanDerWaalsContact C-N 3.35Å; V62-Y64 PolarHBondContact O-N 3.13Å; Y64-L67 PolarHBondContact O-N 2.98Å; Y64-N68 WeakPolarHBondContact CE1-ND2 3.39Å; Y64-N68 WeakPolarHBondContact O-CB 3.45Å; Y64-N68 PolarHBondContact O-N 2.98Å; Y64-N68 PolarHBondContact OH-ND2 3.1Å
65	R	86	Confident	79.3	Confident	138 Å²	138	93.1 Å²	93.1	52%	0.521	46%	0.464	S	S	.	.	H	α-helix	trans	-65.4	-42.6	177.1	-163.4	177.2	-177.7	152.1	1.8	111.7	V61 V62 T63 H69 D214	V61-R65 WeakPolarHBondContact O-CB 3.28Å; V61-R65 PolarHBondContact O-N 3.28Å; V62-R65 PolarHBondContact O-N 3.35Å; T63-R65 VanDerWaalsContact C-N 3.34Å; T63-R65 PolarHBondContact O-N 3.43Å; R65-H69 WeakPolarHBondContact O-CB 3.32Å; R65-H69 PolarHBondContact O-N 3.41Å; R65-D214 IonicContact NH1-OD1 3.67Å; R65-D214 IonicContact NH1-OD2 3.53Å
66	I	84.8	Confident	76.8	Confident	92 Å²	92	98 Å²	98	47%	0.472	48%	0.478	S	S	.	.	H	α-helix	trans	-64.7	-48	175.6	-68.6	168.3	0	0	0	110.5	V62 T63 N68 H69 L70	V62-I66 HydrophobicContact CG1-CD1 3.7Å; V62-I66 HydrophobicContact CG1-CG1 4.3Å; V62-I66 WeakPolarHBondContact O-CB 3.18Å; V62-I66 VanDerWaalsContact O-CG1 3.27Å; V62-I66 WeakPolarHBondContact O-CG1 3.32Å; V62-I66 PolarHBondContact O-N 3.41Å; T63-I66 PolarHBondContact O-N 2.99Å; I66-N68 PolarHBondContact O-N 3.41Å; I66-H69 PolarHBondContact O-N 3.38Å; I66-H69 VanDerWaalsContact O-N 3.15Å; I66-L70 HydrophobicContact CG2-CD1 3.65Å; I66-L70 HydrophobicContact CG2-CG 4.21Å; I66-L70 WeakPolarHBondContact O-CB 3.42Å; I66-L70 VanDerWaalsContact O-CG 3.29Å; I66-L70 WeakPolarHBondContact O-CG 3.35Å; I66-L70 PolarHBondContact O-N 3.45Å
67	L	85.5	Confident	74.2	Confident	95 Å²	95	97.9 Å²	97.9	50%	0.497	49%	0.486	S	S	.	.	H	α-helix	trans	-60.4	-43.3	177.8	-74.4	171.6	0	0	0	111.7	T63 Y64 C71	T63-L67 HydrophobicContact CG2-CD1 3.91Å; T63-L67 HydrophobicContact CG2-CG 4.21Å; T63-L67 VanDerWaalsContact O-CB 3.31Å; T63-L67 WeakPolarHBondContact O-CB 3.23Å; T63-L67 WeakPolarHBondContact O-CG 3.43Å; T63-L67 PolarHBondContact O-N 3.34Å; Y64-L67 PolarHBondContact O-N 2.98Å; L67-C71 VanDerWaalsContact O-CB 3.24Å; L67-C71 WeakPolarHBondContact O-CB 3.39Å; L67-C71 PolarHBondContact O-N 3.31Å; L67-C71 PolarHBondContact O-SG 3.41Å; L67-C71 VanDerWaalsContact O-SG 3.32Å
68	N	79.3	Confident	71.7	Confident	66 Å²	66	107.6 Å²	107.6	35%	0.353	52%	0.519	S	S	.	.	H	α-helix	trans	-64.5	-40.4	174.3	-83.4	-9.6	0	0	0	111.8	Y64 I66 C71 C72	Y64-N68 WeakPolarHBondContact CE1-ND2 3.39Å; Y64-N68 WeakPolarHBondContact O-CB 3.45Å; Y64-N68 PolarHBondContact O-N 2.98Å; Y64-N68 PolarHBondContact OH-ND2 3.1Å; I66-N68 PolarHBondContact O-N 3.41Å; N68-C71 PolarHBondContact O-N 3.38Å; N68-C72 WeakPolarHBondContact O-CB 3.08Å; N68-C72 PolarHBondContact O-N 3.25Å; N68-C72 PolarHBondContact O-SG 2.88Å
69	H	78.7	Confident	69.2	Low	115 Å²	115	117.4 Å²	117.4	53%	0.532	55%	0.554	S	S	.	*	H	α-helix	trans	-65	-46.4	177.6	-164.5	48.2	0	0	0	111.7	R65 I66 C71 C72 E73	R65-H69 WeakPolarHBondContact O-CB 3.32Å; R65-H69 PolarHBondContact O-N 3.41Å; I66-H69 PolarHBondContact O-N 3.38Å; I66-H69 VanDerWaalsContact O-N 3.15Å; H69-C71 PolarHBondContact O-N 3.24Å; H69-C72 PolarHBondContact O-N 2.95Å; H69-E73 IonicContact NE2-OE1 3.99Å; H69-E73 PolarHBondContact O-N 3.09Å
70	L	79.6	Confident	66.5	Low	104 Å²	104	116.4 Å²	116.4	55%	0.545	56%	0.562	S	S	.	*	H	α-helix	trans	-62.3	-39.6	176.1	-70	169.6	0	0	0	112.5	I66	I66-L70 HydrophobicContact CG2-CD1 3.65Å; I66-L70 HydrophobicContact CG2-CG 4.21Å; I66-L70 WeakPolarHBondContact O-CB 3.42Å; I66-L70 VanDerWaalsContact O-CG 3.29Å; I66-L70 WeakPolarHBondContact O-CG 3.35Å; I66-L70 PolarHBondContact O-N 3.45Å
71	C	70.5	Confident	63.8	Low	80 Å²	80	118.1 Å²	118.1	54%	0.541	57%	0.572	S	S	.	*	H	α-helix	trans	-74.6	-32.1	176.7	-75.2	0	0	0	0	112.9	L67 N68 H69	L67-C71 VanDerWaalsContact O-CB 3.24Å; L67-C71 WeakPolarHBondContact O-CB 3.39Å; L67-C71 PolarHBondContact O-N 3.31Å; L67-C71 PolarHBondContact O-SG 3.41Å; L67-C71 VanDerWaalsContact O-SG 3.32Å; N68-C71 PolarHBondContact O-N 3.38Å; H69-C71 PolarHBondContact O-N 3.24Å
72	C	58.5	Low	61.4	Low	67 Å²	67	123.4 Å²	123.4	45%	0.453	60%	0.604	S	S	.	*	H	α-helix	trans	-83.6	-28.3	-179.8	-76.1	0	0	0	0	113.4	N68 H69 R74 K75 K76	N68-C72 WeakPolarHBondContact O-CB 3.08Å; N68-C72 PolarHBondContact O-N 3.25Å; N68-C72 PolarHBondContact O-SG 2.88Å; H69-C72 PolarHBondContact O-N 2.95Å; C72-R74 PolarHBondContact O-N 3.35Å; C72-K75 CarbonylContact O-C 3.52Å; C72-K75 PolarHBondContact O-N 3.06Å; C72-K76 PolarHBondContact O-N 3.06Å
73	E	51.7	Low	58.7	Low	114 Å²	114	127 Å²	127	53%	0.533	63%	0.626	S	S	.	*	H	α-helix	trans	-63.5	-34.1	169.5	-82	-168.1	144.9	0	0	111.4	H69 K75 S77	H69-E73 IonicContact NE2-OE1 3.99Å; H69-E73 PolarHBondContact O-N 3.09Å; E73-K75 VanDerWaalsContact C-N 3.27Å; E73-K75 PolarHBondContact O-N 3.25Å; E73-S77 VanDerWaalsContact O-CB 3.26Å; E73-S77 WeakPolarHBondContact O-CB 3.31Å; E73-S77 PolarHBondContact O-N 3.1Å
74	R	44.6	Very low	56.1	Low	211 Å²	211	132.1 Å²	132.1	80%	0.796	65%	0.646	S	S	*	*	H	α-helix	trans	-67	-22.1	170.2	-97.3	-178.5	174.3	172.7	-0.4	114.6	C72	C72-R74 PolarHBondContact O-N 3.35Å
75	K	45.4	Very low	53.6	Low	164 Å²	164	130.8 Å²	130.8	71%	0.713	65%	0.654	S	S	*	*	H	α-helix	trans	-96.9	-27.9	176.6	-81.3	-176.2	175.8	179.2	0	113.5	C72 E73	C72-K75 CarbonylContact O-C 3.52Å; C72-K75 PolarHBondContact O-N 3.06Å; E73-K75 VanDerWaalsContact C-N 3.27Å; E73-K75 PolarHBondContact O-N 3.25Å
76	K	40.6	Very low	51.1	Low	171 Å²	171	130.1 Å²	130.1	74%	0.743	66%	0.66	S	S	*	*	H	α-helix	trans	-77.5	-31.4	172.8	-91	-177.5	171.4	-177.5	0	112.3	C72 R78 R79	C72-K76 PolarHBondContact O-N 3.06Å; K76-R78 PolarHBondContact O-N 2.92Å; K76-R79 PolarHBondContact O-N 3Å
77	S	39.2	Very low	48.8	Very low	99 Å²	99	133.4 Å²	133.4	69%	0.692	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	-5.4	172.7	-166.9	0	0	0	0	114.4	E73	E73-S77 VanDerWaalsContact O-CB 3.26Å; E73-S77 WeakPolarHBondContact O-CB 3.31Å; E73-S77 PolarHBondContact O-N 3.1Å
78	R	37.3	Very low	46.4	Very low	225 Å²	225	138.6 Å²	138.6	85%	0.849	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.1	2.4	174.8	-84.2	-172.1	-175.5	-173.9	1.6	114.2	K76	K76-R78 PolarHBondContact O-N 2.92Å
79	R	35.2	Very low	44.1	Very low	232 Å²	232	144.2 Å²	144.2	88%	0.875	71%	0.71	S	S	*	*	S	Bend	trans	-121.6	10.9	179.3	-110.7	-179.6	-171.1	176.2	0.3	113.4	K76	K76-R79 PolarHBondContact O-N 3Å
80	A	35.9	Very low	42	Very low	89 Å²	89	143.5 Å²	143.5	74%	0.736	72%	0.724	S	S	*	*	S	Bend	trans	-107.6	10.8	178.9	0	0	0	0	0	113.2
81	D	34.7	Very low	39.7	Very low	141 Å²	141	146.7 Å²	146.7	75%	0.754	74%	0.742	S	S	*	*	S	Bend	trans	-120.2	135.6	170.6	-99.3	-36.3	0	0	0	107.5
82	V	36.9	Very low	37.9	Very low	135 Å²	135	146.5 Å²	146.5	82%	0.818	75%	0.754	S	S	*	*	S	Bend	trans	84.1	97.3	-173.8	-164.4	0	0	0	0	112.1
83	T	32.3	Very low	36.6	Very low	137 Å²	137	150.8 Å²	150.8	84%	0.84	77%	0.771	S	S	*	*			cis	-165.2	139.3	46.5	-23.1	0	0	0	0	111.2
84	E	33.3	Very low	35.6	Very low	166 Å²	166	154.4 Å²	154.4	78%	0.776	79%	0.785	S	S	*	*			trans	-92.8	-173.1	167.5	-115.5	-178.7	175	0	0	110.5
85	P	35.9	Very low	35.2	Very low	106 Å²	106	149 Å²	149	69%	0.688	78%	0.778	S	S	*	*			cis	-142.7	167.2	11.1	29.9	-4.4	0	0	0	119.5
86	D	33.1	Very low	34.2	Very low	124 Å²	124	146.8 Å²	146.8	66%	0.663	78%	0.778	S	S	*	*			trans	38	129	142.6	-72.8	-29.5	0	0	0	125.5
87	H	36.8	Very low	33.8	Very low	160 Å²	160	143.6 Å²	143.6	74%	0.741	78%	0.777	S	S	*	*				-175.3	113.4	100.2	-93	-56.7	0	0	0	115.3
88	R	34.3	Very low	33.7	Very low	204 Å²	204	144.2 Å²	144.2	77%	0.77	78%	0.779	S	S	*	*			trans	50.5	124.4	132.8	-68.2	-175.8	178.6	173	-1.7	125.1
89	E	31.2	Very low	33.2	Very low	184 Å²	184	138.4 Å²	138.4	86%	0.86	77%	0.773	S	S	*	*				40.2	136.5	128.8	-61.3	178.7	150.7	0	0	119.7
90	A	35.7	Very low	32.9	Very low	100 Å²	100	133.3 Å²	133.3	83%	0.826	76%	0.763	S	S	*	*				-167.4	168.1	50.1	0	0	0	0	0	114
91	N	31.3	Very low	32.6	Very low	171 Å²	171	135 Å²	135	91%	0.914	76%	0.76	S	S	*	*			trans	-53.6	155.8	-174.2	-58.8	-44.3	0	0	0	118.8
92	G	31.7	Very low	32.3	Very low	76 Å²	76	133.1 Å²	133.1	78%	0.784	75%	0.754	S	S	*	*			trans	154.1	90.1	148.7	0	0	0	0	0	118.6
93	L	31	Very low	31.9	Very low	157 Å²	157	132.7 Å²	132.7	82%	0.822	75%	0.745	S	S	*	*			trans	36.4	116.9	136.5	-137.9	72.7	0	0	0	121.6
94	F	31.4	Very low	31.7	Very low	190 Å²	190	132.9 Å²	132.9	83%	0.833	74%	0.737	S	S	*	*			trans	24.6	164.6	138	-69.7	-76.5	0	0	0	122.3
95	P	35.6	Very low	31.5	Very low	97 Å²	97	132 Å²	132	63%	0.63	73%	0.73	S	S	*	*			cis	-138.5	-167.2	-28	36.3	-15.3	0	0	0	113.5
96	T	25.2	Very low	31	Very low	119 Å²	119	133 Å²	133	73%	0.73	73%	0.734	S	S	*	*			trans	74.1	105.4	153.1	51.9	0	0	0	0	121
97	S	31	Very low	30.7	Very low	103 Å²	103	131.5 Å²	131.5	72%	0.72	73%	0.734	S	S	*	*				30	167.3	114.9	58.8	0	0	0	0	121.1
98	P	37.9	Very low	30.4	Very low	112 Å²	112	131.4 Å²	131.4	73%	0.727	74%	0.738	S	S	*	*			cis	-135.2	-160.7	-24.4	29.7	-6.4	0	0	0	111.2
99	S	27.8	Very low	30	Very low	103 Å²	103	128.8 Å²	128.8	72%	0.72	75%	0.745	S	S	*	*			trans	82.8	145.9	157.7	90.1	0	0	0	0	114.2
100	N	27.9	Very low	29.9	Very low	126 Å²	126	124.5 Å²	124.5	67%	0.674	74%	0.741	S	S	*	*			cis	-173.8	162.5	2.1	-127.3	-0.3	0	0	0	105.5
101	N	29.2	Very low	29.5	Very low	124 Å²	124	124.1 Å²	124.1	66%	0.663	74%	0.738	S	S	*	*			trans	72.4	136.1	146.2	-63	-5.1	0	0	0	115.6
102	T	28.7	Very low	29.2	Very low	102 Å²	102	122.4 Å²	122.4	63%	0.626	73%	0.733	S	S	*	*			cis	174.3	145.2	11.7	17.4	0	0	0	0	104.8
103	I	29	Very low	29	Very low	126 Å²	126	122.5 Å²	122.5	65%	0.646	73%	0.727	S	S	*	*				101	117	118.8	-80	170	0	0	0	116.3
104	E	27.3	Very low	28.8	Very low	141 Å²	141	123 Å²	123	66%	0.659	73%	0.73	S	S	*	*			trans	76.8	148.9	138.6	-71.3	179.8	158.1	0	0	119.5
105	K	28.9	Very low	28.6	Very low	148 Å²	148	118 Å²	118	64%	0.643	72%	0.724	S	S	*	*			cis	-163.7	141.2	9.6	-110.4	153.8	179.9	154.6	0	105.3
106	T	26.4	Very low	28.3	Very low	125 Å²	125	122.6 Å²	122.6	77%	0.767	74%	0.737	S	S	*	*				49.8	141.2	108.1	-3.8	0	0	0	0	114.4
107	S	26.6	Very low	28.5	Very low	93 Å²	93	122.4 Å²	122.4	65%	0.65	74%	0.741	S	S	*	*			cis	177.8	161.5	29.6	34.3	0	0	0	0	108
108	L	29.6	Very low	28.5	Very low	159 Å²	159	123 Å²	123	83%	0.832	74%	0.742	S	S	*	*			trans	1.8	135.7	152.8	-65.4	92.2	0	0	0	119.9
109	T	27.1	Very low	28	Very low	148 Å²	148	123.6 Å²	123.6	91%	0.908	75%	0.746	S	S	*	*				-168.6	147.3	122.6	35.3	0	0	0	0	111.9
110	A	28.7	Very low	28.1	Very low	95 Å²	95	128 Å²	128	79%	0.785	76%	0.755	S	S	*	*			trans	-80	156.5	167.6	0	0	0	0	0	111.5
111	A	27.7	Very low	27.9	Very low	92 Å²	92	131 Å²	131	76%	0.76	77%	0.765	S	S	*	*			trans	73.3	144.4	150.7	0	0	0	0	0	120.7
112	V	25.6	Very low	27.9	Very low	135 Å²	135	133.8 Å²	133.8	82%	0.818	77%	0.773	S	S	*	*			trans	94.9	110.1	154	-165.8	0	0	0	0	118.2
113	A	27	Very low	27.8	Very low	78 Å²	78	137.1 Å²	137.1	65%	0.645	78%	0.782	S	S	*	*			trans	31.5	136.8	137	0	0	0	0	0	123
114	D	25.8	Very low	27.6	Very low	166 Å²	166	136.6 Å²	136.6	89%	0.888	79%	0.785	S	S	*	*			trans	85.4	142.3	138.8	-77.1	-25.3	0	0	0	123.2
115	A	28.4	Very low	27.6	Very low	85 Å²	85	139.2 Å²	139.2	70%	0.702	80%	0.797	S	S	*	*			trans	87.6	87	155	0	0	0	0	0	120.2
116	Q	28.9	Very low	27.4	Very low	194 Å²	194	140.8 Å²	140.8	91%	0.907	81%	0.807	S	S	*	*				26.7	122.7	118.2	-70.1	166	-16.7	0	0	119.7
117	S	28.8	Very low	27.8	Very low	116 Å²	116	139.1 Å²	139.1	81%	0.811	81%	0.806	S	S	*	*			trans	-172.2	161.2	134.6	55.9	0	0	0	0	110.1
118	P	30.6	Very low	28.2	Very low	115 Å²	115	143.8 Å²	143.8	75%	0.747	82%	0.817	S	S	*	*				-111.3	171.9	-86.9	21.6	-0.3	0	0	0	113.1
119	P	28.3	Very low	29	Very low	124 Å²	124	142 Å²	142	81%	0.805	81%	0.812	S	S	*	*			trans	-81.3	131.8	-169.3	32.7	-31.6	0	0	0	111.7
120	Q	29.6	Very low	31.1	Very low	197 Å²	197	136.6 Å²	136.6	92%	0.921	79%	0.786	S	S	*	*			trans	-94.8	109.5	161.7	-83.7	-178.9	-14.2	0	0	109.4	H122	Q120-H122 PolarHBondContact O-N 3.2Å
121	Q	24.6	Very low	33.6	Very low	188 Å²	188	141.6 Å²	141.6	88%	0.879	79%	0.785	S	S	*	*			trans	-60	120.2	165	-71	167.9	-29.4	0	0	109.3
122	H	29.4	Very low	35.9	Very low	182 Å²	182	142.6 Å²	142.6	84%	0.843	78%	0.775	S	S	*	*			trans	-123.9	128.7	148.9	-114.6	-49.5	0	0	0	108.9	Q120	Q120-H122 PolarHBondContact O-N 3.2Å
123	Q	26.6	Very low	38.6	Very low	172 Å²	172	139.2 Å²	139.2	80%	0.804	75%	0.754	S	S	*	*			trans	-56.9	124.8	-168.3	-70.5	152.7	-25.1	0	0	113.8
124	T	23.9	Very low	41.4	Very low	115 Å²	115	142.2 Å²	142.2	71%	0.706	76%	0.755	S	S	*	*				28.3	102.7	129	-17.2	0	0	0	0	118.9	E126	T124-E126 HydrophobicContact CG2-CG 4.38Å
125	E	26.4	Very low	44.4	Very low	197 Å²	197	136 Å²	136	92%	0.921	73%	0.727	S	S	*	*			trans	-133.5	93.8	136.2	-106.7	-172	166.1	0	0	108.1	A127	E125-A127 PolarHBondContact O-N 2.77Å
126	E	26.7	Very low	47.3	Very low	181 Å²	181	135.5 Å²	135.5	85%	0.846	71%	0.709	S	S	*	*			trans	-70.3	90.4	169.2	-72.1	-178.9	160	0	0	109.2	T124 H128	T124-E126 HydrophobicContact CG2-CG 4.38Å; E126-H128 PolarHBondContact O-N 2.9Å
127	A	34.6	Very low	50.1	Low	90 Å²	90	131.1 Å²	131.1	74%	0.744	69%	0.691	S	S	*	*			trans	-84.3	107.5	167.3	0	0	0	0	0	109.3	E125 V129	E125-A127 PolarHBondContact O-N 2.77Å; A127-V129 PolarHBondContact O-N 3.17Å
128	H	33.6	Very low	53	Low	190 Å²	190	132.1 Å²	132.1	88%	0.88	68%	0.678	S	S	*	*			trans	-37.4	107.7	171.9	-94.2	-94.8	0	0	0	113.2	E126 G130	E126-H128 PolarHBondContact O-N 2.9Å; H128-G130 PolarHBondContact O-N 3.09Å
129	V	46.5	Very low	55.8	Low	123 Å²	123	126.7 Å²	126.7	75%	0.745	64%	0.642	S	S	*	*			trans	-65	114.2	165.2	-177.6	0	0	0	0	107.4	A127 T133	A127-V129 PolarHBondContact O-N 3.17Å; V129-T133 VanDerWaalsContact CG1-OG1 3.23Å; V129-T133 WeakPolarHBondContact CG1-OG1 3.48Å
130	G	71.4	Confident	58.5	Low	34 Å²	34	122.1 Å²	122.1	35%	0.351	62%	0.617	S	S	.	*			trans	-87.6	152.4	-176.6	0	0	0	0	0	112.4	H128 M132 T133 E134	H128-G130 PolarHBondContact O-N 3.09Å; G130-M132 PolarHBondContact O-N 3.12Å; G130-T133 PolarHBondContact O-N 2.86Å; G130-T133 PolarHBondContact O-OG1 3.44Å; G130-E134 PolarHBondContact O-N 2.66Å
131	W	82	Confident	61.1	Low	200 Å²	200	117.8 Å²	117.8	76%	0.758	60%	0.597	S	S	*	*	H	α-helix	trans	-47.9	-29.2	175	69	-79.5	0	0	0	114.6	A135	W131-A135 WeakPolarHBondContact O-CB 3.34Å; W131-A135 PolarHBondContact O-N 3.23Å
132	M	75.6	Confident	64.1	Low	113 Å²	113	109.9 Å²	109.9	56%	0.557	56%	0.561	S	S	*	*	H	α-helix	trans	-67.6	-33.3	175.6	-81.3	175.9	71.7	0	0	113.7	G130 K136	G130-M132 PolarHBondContact O-N 3.12Å; M132-K136 WeakPolarHBondContact O-CB 3.49Å; M132-K136 PolarHBondContact O-N 3.14Å
133	T	82.2	Confident	66.6	Low	63 Å²	63	102.8 Å²	102.8	39%	0.387	53%	0.529	S	S	.	.	H	α-helix	trans	-73.8	-42.1	177	51.9	0	0	0	0	110.2	V129 G130 A135 K136 D137	V129-T133 VanDerWaalsContact CG1-OG1 3.23Å; V129-T133 WeakPolarHBondContact CG1-OG1 3.48Å; G130-T133 PolarHBondContact O-N 2.86Å; G130-T133 PolarHBondContact O-OG1 3.44Å; T133-A135 PolarHBondContact O-N 3.08Å; T133-K136 WeakPolarHBondContact O-CB 3.37Å; T133-K136 PolarHBondContact O-N 2.98Å; T133-D137 VanDerWaalsContact O-CG 3.25Å; T133-D137 PolarHBondContact O-N 3.39Å
134	E	86.7	Confident	68.9	Low	141 Å²	141	95.6 Å²	95.6	66%	0.659	50%	0.497	S	S	*	.	H	α-helix	trans	-60	-46.5	175.9	-171.1	-179.5	-176.4	0	0	112.3	G130 K136 D137 W138	G130-E134 PolarHBondContact O-N 2.66Å; E134-K136 VanDerWaalsContact C-N 3.3Å; E134-K136 PolarHBondContact O-N 3.02Å; E134-D137 PolarHBondContact O-N 2.99Å; E134-W138 WeakPolarHBondContact O-CB 3.3Å; E134-W138 PolarHBondContact O-N 3.32Å
135	A	88.2	Confident	71.2	Confident	35 Å²	35	90.3 Å²	90.3	29%	0.289	47%	0.466	S	S	.	.	H	α-helix	trans	-62.9	-36.4	177.5	0	0	0	0	0	112.8	W131 T133 A139 I210	W131-A135 WeakPolarHBondContact O-CB 3.34Å; W131-A135 PolarHBondContact O-N 3.23Å; T133-A135 PolarHBondContact O-N 3.08Å; A135-A139 WeakPolarHBondContact O-CB 3.38Å; A135-A139 PolarHBondContact O-N 3.13Å; A135-A139 VanDerWaalsContact O-N 3.08Å; A135-I210 HydrophobicContact CB-CG2 4.37Å; A135-I210 WeakPolarHBondContact O-CG2 3.33Å
136	K	88.9	Confident	73.5	Confident	76 Å²	76	86.9 Å²	86.9	33%	0.33	45%	0.45	S	S	.	.	H	α-helix	trans	-68.1	-43.6	176.9	-179.3	-176.5	173.1	-168.9	0	111.4	M132 T133 E134 A139 G140	M132-K136 WeakPolarHBondContact O-CB 3.49Å; M132-K136 PolarHBondContact O-N 3.14Å; T133-K136 WeakPolarHBondContact O-CB 3.37Å; T133-K136 PolarHBondContact O-N 2.98Å; E134-K136 VanDerWaalsContact C-N 3.3Å; E134-K136 PolarHBondContact O-N 3.02Å; K136-A139 PolarHBondContact O-N 2.95Å; K136-G140 PolarHBondContact O-N 3.24Å
137	D	87.2	Confident	76.2	Confident	101 Å²	101	79.5 Å²	79.5	54%	0.54	42%	0.419	S	S	.	.	H	α-helix	trans	-67.1	-44.7	-179.6	-65.9	-20.3	0	0	0	110.7	T133 E134 A139 G140 E141	T133-D137 VanDerWaalsContact O-CG 3.25Å; T133-D137 PolarHBondContact O-N 3.39Å; E134-D137 PolarHBondContact O-N 2.99Å; D137-A139 PolarHBondContact O-N 3.01Å; D137-G140 PolarHBondContact O-N 3.09Å; D137-G140 VanDerWaalsContact O-N 3.14Å; D137-E141 PolarHBondContact O-N 3.16Å
138	W	89.7	Confident	78.4	Confident	138 Å²	138	80.2 Å²	80.2	52%	0.523	41%	0.413	S	S	.	.	H	α-helix	trans	-56.5	-48.1	173	172.2	78.9	0	0	0	112.7	E134 G140 E141 L142	E134-W138 WeakPolarHBondContact O-CB 3.3Å; E134-W138 PolarHBondContact O-N 3.32Å; W138-G140 VanDerWaalsContact C-N 3.3Å; W138-G140 PolarHBondContact O-N 3.25Å; W138-E141 PolarHBondContact O-N 3.21Å; W138-L142 HydrophobicContact CD2-CD1 4.3Å; W138-L142 HydrophobicContact CH2-CD2 4.18Å; W138-L142 HydrophobicContact CZ2-CD1 4.05Å; W138-L142 HydrophobicContact CZ2-CD2 3.91Å; W138-L142 WeakPolarHBondContact O-CD1 3.48Å; W138-L142 PolarHBondContact O-N 3.32Å; W138-L142 VanDerWaalsContact O-N 3.16Å
139	A	89.7	Confident	81	Confident	0 Å²	0	75 Å²	75	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-65.2	-36.1	177.9	0	0	0	0	0	111.8	A135 K136 D137 L142 I143 I207 I210 A211	A135-A139 WeakPolarHBondContact O-CB 3.38Å; A135-A139 PolarHBondContact O-N 3.13Å; A135-A139 VanDerWaalsContact O-N 3.08Å; K136-A139 PolarHBondContact O-N 2.95Å; D137-A139 PolarHBondContact O-N 3.01Å; A139-L142 PolarHBondContact O-N 2.92Å; A139-I143 WeakPolarHBondContact O-CD1 3.16Å; A139-I143 WeakPolarHBondContact O-CG1 3.41Å; A139-I143 PolarHBondContact O-N 3.24Å; A139-I143 VanDerWaalsContact O-N 3.12Å; A139-I207 HydrophobicContact CB-CG2 4.26Å; A139-I210 HydrophobicContact CB-CB 4.09Å; A139-I210 HydrophobicContact CB-CG2 3.78Å; A139-A211 HydrophobicContact CB-CB 3.86Å
140	G	84.9	Confident	82.7	Confident	28 Å²	28	69.2 Å²	69.2	29%	0.289	36%	0.36	S	S	.	.	H	α-helix	trans	-63.5	-41.1	174.7	0	0	0	0	0	113.2	K136 D137 W138 S144	K136-G140 PolarHBondContact O-N 3.24Å; D137-G140 PolarHBondContact O-N 3.09Å; D137-G140 VanDerWaalsContact O-N 3.14Å; W138-G140 VanDerWaalsContact C-N 3.3Å; W138-G140 PolarHBondContact O-N 3.25Å; G140-S144 VanDerWaalsContact O-CB 3.27Å; G140-S144 WeakPolarHBondContact O-CB 3.47Å; G140-S144 PolarHBondContact O-N 3.47Å; G140-S144 PolarHBondContact O-OG 2.88Å
141	E	85.3	Confident	83	Confident	106 Å²	106	73.6 Å²	73.6	50%	0.495	37%	0.366	S	S	.	.	H	α-helix	trans	-63.3	-42.1	174.1	-75	-171.7	174.6	0	0	112.4	D137 W138 S144	D137-E141 PolarHBondContact O-N 3.16Å; W138-E141 PolarHBondContact O-N 3.21Å; E141-S144 PolarHBondContact O-OG 3.05Å
142	L	87.4	Confident	83.2	Confident	22 Å²	22	69.4 Å²	69.4	12%	0.115	36%	0.357	C	S	.	.	H	α-helix	trans	-61.8	-46.7	177.4	-102.5	77.4	0	0	0	112.2	W138 A139 G150 L153	W138-L142 HydrophobicContact CD2-CD1 4.3Å; W138-L142 HydrophobicContact CH2-CD2 4.18Å; W138-L142 HydrophobicContact CZ2-CD1 4.05Å; W138-L142 HydrophobicContact CZ2-CD2 3.91Å; W138-L142 WeakPolarHBondContact O-CD1 3.48Å; W138-L142 PolarHBondContact O-N 3.32Å; W138-L142 VanDerWaalsContact O-N 3.16Å; A139-L142 PolarHBondContact O-N 2.92Å; L142-G150 WeakPolarHBondContact O-CA 3.48Å; L142-L153 HydrophobicContact CB-CD2 4.33Å; L142-L153 HydrophobicContact CD2-CD2 4.12Å
143	I	82.1	Confident	83.7	Confident	34 Å²	34	65.2 Å²	65.2	17%	0.174	34%	0.337	C	S	.	.	H	α-helix	trans	-72.3	-36.4	-176.5	-65	162.5	0	0	0	111.6	A139 G145 I207 R208 A211	A139-I143 WeakPolarHBondContact O-CD1 3.16Å; A139-I143 WeakPolarHBondContact O-CG1 3.41Å; A139-I143 PolarHBondContact O-N 3.24Å; A139-I143 VanDerWaalsContact O-N 3.12Å; I143-G145 PolarHBondContact O-N 2.96Å; I143-I207 HydrophobicContact CD1-CG2 4.1Å; I143-I207 HydrophobicContact CG1-CG2 3.95Å; I143-R208 HydrophobicContact CD1-CB 4.27Å; I143-R208 HydrophobicContact CD1-CG 3.98Å; I143-R208 HydrophobicContact CG1-CG 4.37Å; I143-A211 HydrophobicContact CD1-CB 3.29Å
144	S	75.1	Confident	83.5	Confident	20 Å²	20	62.4 Å²	62.4	14%	0.14	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-5	-176.5	64.5	0	0	0	0	114.3	G140 E141 Q146 Y264 R275	G140-S144 VanDerWaalsContact O-CB 3.27Å; G140-S144 WeakPolarHBondContact O-CB 3.47Å; G140-S144 PolarHBondContact O-N 3.47Å; G140-S144 PolarHBondContact O-OG 2.88Å; E141-S144 PolarHBondContact O-OG 3.05Å; S144-Q146 PolarHBondContact O-N 3.01Å; S144-Q146 WeakPolarHBondContact OG-CG 3.43Å; S144-Q146 PolarHBondContact OG-NE2 3.47Å; S144-Y264 VanDerWaalsContact O-CD1 3.25Å; S144-Y264 WeakPolarHBondContact O-CD1 3.31Å; S144-R275 PolarHBondContact O-NH2 3.44Å
145	G	72	Confident	83.1	Confident	4 Å²	4	58.5 Å²	58.5	4%	0.041	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.3	18.8	179.9	0	0	0	0	0	114.1	I143 R151	I143-G145 PolarHBondContact O-N 2.96Å; G145-R151 WeakPolarHBondContact O-CG 3.33Å; G145-R151 PolarHBondContact O-NE 3.25Å
146	Q	73.9	Confident	83	Confident	125 Å²	125	60.1 Å²	60.1	58%	0.584	31%	0.309	S	S	*	.			trans	-73.5	-37.4	-179.9	-69.6	-176	32.4	0	0	111.5	S144	S144-Q146 PolarHBondContact O-N 3.01Å; S144-Q146 WeakPolarHBondContact OG-CG 3.43Å; S144-Q146 PolarHBondContact OG-NE2 3.47Å
147	S	84	Confident	82.8	Confident	27 Å²	27	56.8 Å²	56.8	19%	0.189	30%	0.295	C	S	.	.	S	Bend	trans	-83.4	154.3	172.6	61.5	0	0	0	0	111.9	T149 G150 R151	S147-T149 VanDerWaalsContact C-N 3.26Å; S147-T149 PolarHBondContact O-N 3.07Å; S147-T149 PolarHBondContact OG-OG1 3.14Å; S147-T149 VanDerWaalsContact OG-OG1 3.12Å; S147-G150 PolarHBondContact O-N 3.49Å; S147-G150 VanDerWaalsContact O-N 3.15Å; S147-G150 PolarHBondContact OG-N 3.33Å; S147-R151 WeakPolarHBondContact O-CG 3.26Å; S147-R151 PolarHBondContact O-N 3.4Å
148	T	80.3	Confident	82.4	Confident	104 Å²	104	54.3 Å²	54.3	64%	0.638	28%	0.28	S	S	*	.	H	α-helix	trans	-60.2	-39.2	173.7	49.3	0	0	0	0	111.6	R151 I152	T148-R151 PolarHBondContact O-N 3.07Å; T148-I152 WeakPolarHBondContact O-CG1 3.39Å; T148-I152 PolarHBondContact O-N 3.03Å
149	T	87.7	Confident	82.1	Confident	82 Å²	82	51.6 Å²	51.6	50%	0.503	28%	0.278	S	S	.	.	H	α-helix	trans	-62.2	-42.6	173	48.9	0	0	0	0	111.6	S147 I152 L153	S147-T149 VanDerWaalsContact C-N 3.26Å; S147-T149 PolarHBondContact O-N 3.07Å; S147-T149 PolarHBondContact OG-OG1 3.14Å; S147-T149 VanDerWaalsContact OG-OG1 3.12Å; T149-I152 PolarHBondContact O-N 2.91Å; T149-L153 WeakPolarHBondContact O-CB 3.4Å; T149-L153 PolarHBondContact O-N 3.48Å
150	G	83.7	Confident	82.2	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-61.1	-43.4	173.2	0	0	0	0	0	112.9	L142 S147 I152 L153 V154	L142-G150 WeakPolarHBondContact O-CA 3.48Å; S147-G150 PolarHBondContact O-N 3.49Å; S147-G150 VanDerWaalsContact O-N 3.15Å; S147-G150 PolarHBondContact OG-N 3.33Å; G150-I152 PolarHBondContact O-N 3.31Å; G150-L153 WeakPolarHBondContact O-CB 3.32Å; G150-L153 PolarHBondContact O-N 3.33Å; G150-V154 WeakPolarHBondContact O-CB 3.45Å; G150-V154 VanDerWaalsContact O-CG2 3.3Å; G150-V154 WeakPolarHBondContact O-CG2 3.45Å; G150-V154 PolarHBondContact O-N 3.47Å
151	R	77.2	Confident	82.3	Confident	127 Å²	127	52 Å²	52	48%	0.479	27%	0.274	S	S	.	.	H	α-helix	trans	-61.1	-45.2	174.9	-66.8	-178.9	-171.2	171	2.9	112.1	G145 S147 T148 L153 V154 V155	G145-R151 WeakPolarHBondContact O-CG 3.33Å; G145-R151 PolarHBondContact O-NE 3.25Å; S147-R151 WeakPolarHBondContact O-CG 3.26Å; S147-R151 PolarHBondContact O-N 3.4Å; T148-R151 PolarHBondContact O-N 3.07Å; R151-L153 VanDerWaalsContact C-N 3.32Å; R151-L153 PolarHBondContact O-N 3.02Å; R151-V154 PolarHBondContact O-N 3.46Å; R151-V155 WeakPolarHBondContact O-CG2 3.17Å; R151-V155 PolarHBondContact O-N 3.34Å
152	I	84.9	Confident	82.3	Confident	111 Å²	111	49.8 Å²	49.8	57%	0.569	27%	0.265	S	S	*	.	H	α-helix	trans	-59.5	-45.7	176.3	-68.2	161.9	0	0	0	110.1	T148 T149 G150 V154 V155 L156	T148-I152 WeakPolarHBondContact O-CG1 3.39Å; T148-I152 PolarHBondContact O-N 3.03Å; T149-I152 PolarHBondContact O-N 2.91Å; G150-I152 PolarHBondContact O-N 3.31Å; I152-V154 VanDerWaalsContact C-N 3.34Å; I152-V154 PolarHBondContact O-N 2.84Å; I152-V155 PolarHBondContact O-N 3.41Å; I152-L156 VanDerWaalsContact O-CB 3.22Å; I152-L156 WeakPolarHBondContact O-CB 3.22Å; I152-L156 PolarHBondContact O-N 2.78Å
153	L	87.2	Confident	82.3	Confident	25 Å²	25	50 Å²	50	13%	0.131	27%	0.27	C	S	.	.	H	α-helix	trans	-58.4	-46.4	177	-177.7	69.9	0	0	0	111.3	L142 T149 G150 R151 L156 V157 F200 Y204 I207	L142-L153 HydrophobicContact CB-CD2 4.33Å; L142-L153 HydrophobicContact CD2-CD2 4.12Å; T149-L153 WeakPolarHBondContact O-CB 3.4Å; T149-L153 PolarHBondContact O-N 3.48Å; G150-L153 WeakPolarHBondContact O-CB 3.32Å; G150-L153 PolarHBondContact O-N 3.33Å; R151-L153 VanDerWaalsContact C-N 3.32Å; R151-L153 PolarHBondContact O-N 3.02Å; L153-L156 PolarHBondContact O-N 3.24Å; L153-V157 HydrophobicContact CG-CG2 4.42Å; L153-V157 WeakPolarHBondContact O-CB 3.3Å; L153-V157 WeakPolarHBondContact O-CG2 3.31Å; L153-V157 PolarHBondContact O-N 2.74Å; L153-F200 HydrophobicContact CD1-CE2 4.1Å; L153-F200 HydrophobicContact CD1-CZ 3.76Å; L153-Y204 HydrophobicContact CD1-CD2 4.45Å; L153-Y204 HydrophobicContact CD2-CD2 4.18Å; L153-Y204 HydrophobicContact CD2-CE2 4.17Å; L153-Y204 HydrophobicContact CG-CD2 4.35Å; L153-Y204 HydrophobicContact CG-CE2 4.38Å; L153-I207 HydrophobicContact CD2-CD1 4.35Å
154	V	77.4	Confident	82.7	Confident	4 Å²	4	48.4 Å²	48.4	2%	0.024	26%	0.261	C	S	.	.	H	α-helix	trans	-62.9	-44.3	179.6	168	0	0	0	0	112.2	G150 R151 I152 L156 V157 F158 I261 Y264	G150-V154 WeakPolarHBondContact O-CB 3.45Å; G150-V154 VanDerWaalsContact O-CG2 3.3Å; G150-V154 WeakPolarHBondContact O-CG2 3.45Å; G150-V154 PolarHBondContact O-N 3.47Å; R151-V154 PolarHBondContact O-N 3.46Å; I152-V154 VanDerWaalsContact C-N 3.34Å; I152-V154 PolarHBondContact O-N 2.84Å; V154-L156 VanDerWaalsContact C-N 3.32Å; V154-L156 PolarHBondContact O-N 3.11Å; V154-V157 PolarHBondContact O-N 3.41Å; V154-F158 PolarHBondContact O-N 3.09Å; V154-F158 VanDerWaalsContact O-N 3.09Å; V154-I261 HydrophobicContact CG1-CB 4.03Å; V154-I261 HydrophobicContact CG1-CG1 4Å; V154-I261 HydrophobicContact CG1-CG2 3.58Å; V154-Y264 HydrophobicContact CG1-CD2 4.18Å; V154-Y264 HydrophobicContact CG2-CD2 4.47Å
155	V	78.1	Confident	83.4	Confident	60 Å²	60	47.9 Å²	47.9	36%	0.364	26%	0.257	S	S	.	.	H	α-helix	trans	-61	-43.6	173.3	176.7	0	0	0	0	110.9	R151 I152 F158 V159 L265	R151-V155 WeakPolarHBondContact O-CG2 3.17Å; R151-V155 PolarHBondContact O-N 3.34Å; I152-V155 PolarHBondContact O-N 3.41Å; V155-F158 WeakPolarHBondContact O-CB 3.37Å; V155-F158 PolarHBondContact O-N 3.13Å; V155-V159 HydrophobicContact CG1-CG2 4.33Å; V155-V159 WeakPolarHBondContact O-CG2 3.36Å; V155-V159 PolarHBondContact O-N 3.18Å; V155-L265 HydrophobicContact CG2-CD1 3.85Å; V155-L265 HydrophobicContact CG2-CD2 3.33Å; V155-L265 HydrophobicContact CG2-CG 4.22Å
156	L	86.9	Confident	84.2	Confident	69 Å²	69	52.4 Å²	52.4	36%	0.361	28%	0.279	S	S	.	.	H	α-helix	trans	-67.9	-41.3	-176.3	-165.2	155	0	0	0	110.7	I152 L153 V154 F158 V159 L160 F200	I152-L156 VanDerWaalsContact O-CB 3.22Å; I152-L156 WeakPolarHBondContact O-CB 3.22Å; I152-L156 PolarHBondContact O-N 2.78Å; L153-L156 PolarHBondContact O-N 3.24Å; V154-L156 VanDerWaalsContact C-N 3.32Å; V154-L156 PolarHBondContact O-N 3.11Å; L156-F158 VanDerWaalsContact C-N 3.29Å; L156-F158 PolarHBondContact O-N 3.09Å; L156-V159 PolarHBondContact O-N 3.3Å; L156-L160 HydrophobicContact CD2-CD1 3.33Å; L156-L160 HydrophobicContact CD2-CG 3.81Å; L156-L160 HydrophobicContact CG-CD1 4.41Å; L156-L160 HydrophobicContact CG-CG 4.47Å; L156-L160 VanDerWaalsContact O-CB 3.3Å; L156-L160 WeakPolarHBondContact O-CB 3.36Å; L156-L160 VanDerWaalsContact O-CG 3.28Å; L156-L160 WeakPolarHBondContact O-CG 3.3Å; L156-L160 PolarHBondContact O-N 3.43Å; L156-F200 HydrophobicContact CD2-CD1 4.23Å; L156-F200 HydrophobicContact CD2-CD2 3.82Å; L156-F200 HydrophobicContact CD2-CE1 3.7Å; L156-F200 HydrophobicContact CD2-CE2 3.26Å; L156-F200 HydrophobicContact CD2-CG 4.28Å; L156-F200 HydrophobicContact CD2-CZ 3.18Å; L156-F200 HydrophobicContact CG-CZ 4.48Å
157	V	85.1	Confident	84.9	Confident	6 Å²	6	47.5 Å²	47.5	4%	0.036	26%	0.257	C	S	.	.	H	α-helix	trans	-57.1	-42.7	171.4	171.2	0	0	0	0	111	L153 V154 S161 F200 Y204	L153-V157 HydrophobicContact CG-CG2 4.42Å; L153-V157 WeakPolarHBondContact O-CB 3.3Å; L153-V157 WeakPolarHBondContact O-CG2 3.31Å; L153-V157 PolarHBondContact O-N 2.74Å; V154-V157 PolarHBondContact O-N 3.41Å; V157-S161 WeakPolarHBondContact O-CB 3.29Å; V157-S161 PolarHBondContact O-N 3.11Å; V157-S161 PolarHBondContact O-OG 3.25Å; V157-F200 HydrophobicContact CB-CE1 4.5Å; V157-F200 HydrophobicContact CG2-CE1 3.69Å; V157-F200 HydrophobicContact CG2-CZ 3.88Å; V157-Y204 HydrophobicContact CG1-CD1 4.36Å; V157-Y204 HydrophobicContact CG1-CE1 3.92Å; V157-Y204 HydrophobicContact CG2-CD1 4.15Å; V157-Y204 HydrophobicContact CG2-CD2 3.6Å; V157-Y204 HydrophobicContact CG2-CE1 4.1Å; V157-Y204 HydrophobicContact CG2-CE2 3.57Å; V157-Y204 HydrophobicContact CG2-CG 3.9Å
158	F	78.2	Confident	85.2	Confident	49 Å²	49	46.3 Å²	46.3	22%	0.215	25%	0.248	C	C	.	.	H	α-helix	trans	-61.5	-54.3	177.5	179.7	-111.1	0	0	0	112.5	V154 V155 L156 L160 S161 I162 L258 I261	V154-F158 PolarHBondContact O-N 3.09Å; V154-F158 VanDerWaalsContact O-N 3.09Å; V155-F158 WeakPolarHBondContact O-CB 3.37Å; V155-F158 PolarHBondContact O-N 3.13Å; L156-F158 VanDerWaalsContact C-N 3.29Å; L156-F158 PolarHBondContact O-N 3.09Å; F158-L160 PolarHBondContact O-N 3.47Å; F158-S161 PolarHBondContact O-N 3.11Å; F158-I162 HydrophobicContact CD1-CD1 4.24Å; F158-I162 HydrophobicContact CD2-CD1 4.37Å; F158-I162 HydrophobicContact CE1-CD1 3.64Å; F158-I162 HydrophobicContact CE2-CD1 3.77Å; F158-I162 HydrophobicContact CZ-CD1 3.38Å; F158-I162 PolarHBondContact O-N 3.18Å; F158-I162 VanDerWaalsContact O-N 3.12Å; F158-L258 HydrophobicContact CE2-CB 4.11Å; F158-L258 HydrophobicContact CE2-CD1 3.64Å; F158-L258 HydrophobicContact CE2-CG 3.63Å; F158-L258 HydrophobicContact CZ-CD1 4Å; F158-L258 HydrophobicContact CZ-CG 4.24Å; F158-I261 HydrophobicContact CB-CD1 3.88Å; F158-I261 HydrophobicContact CB-CG2 3.82Å; F158-I261 HydrophobicContact CD2-CD1 4.01Å; F158-I261 HydrophobicContact CD2-CG2 4.25Å; F158-I261 HydrophobicContact CG-CD1 4.42Å; F158-I261 HydrophobicContact CG-CG2 4.13Å
159	V	84.3	Confident	85.6	Confident	81 Å²	81	43 Å²	43	49%	0.491	23%	0.225	S	C	.	.	H	α-helix	trans	-62.2	-45.1	-178.1	173.5	0	0	0	0	110.7	V155 L156 S161 I162 A163	V155-V159 HydrophobicContact CG1-CG2 4.33Å; V155-V159 WeakPolarHBondContact O-CG2 3.36Å; V155-V159 PolarHBondContact O-N 3.18Å; L156-V159 PolarHBondContact O-N 3.3Å; V159-S161 VanDerWaalsContact C-N 3.31Å; V159-S161 PolarHBondContact O-N 2.86Å; V159-I162 PolarHBondContact O-N 3.34Å; V159-A163 WeakPolarHBondContact O-CB 3.48Å; V159-A163 PolarHBondContact O-N 3.36Å
160	L	90.3	Very high	85.6	Confident	30 Å²	30	45.9 Å²	45.9	16%	0.157	23%	0.228	C	C	.	.	H	α-helix	trans	-67.6	-31.6	178	-67.9	-167.7	0	0	0	112.5	L156 F158 A163 S164 F197 F200 F201	L156-L160 HydrophobicContact CD2-CD1 3.33Å; L156-L160 HydrophobicContact CD2-CG 3.81Å; L156-L160 HydrophobicContact CG-CD1 4.41Å; L156-L160 HydrophobicContact CG-CG 4.47Å; L156-L160 VanDerWaalsContact O-CB 3.3Å; L156-L160 WeakPolarHBondContact O-CB 3.36Å; L156-L160 VanDerWaalsContact O-CG 3.28Å; L156-L160 WeakPolarHBondContact O-CG 3.3Å; L156-L160 PolarHBondContact O-N 3.43Å; F158-L160 PolarHBondContact O-N 3.47Å; L160-A163 PolarHBondContact O-N 2.87Å; L160-S164 VanDerWaalsContact O-CB 3.27Å; L160-S164 WeakPolarHBondContact O-CB 3.45Å; L160-S164 PolarHBondContact O-N 2.95Å; L160-S164 PolarHBondContact O-OG 3.18Å; L160-F197 HydrophobicContact CD1-CD1 4.44Å; L160-F197 HydrophobicContact CD2-CD1 3.76Å; L160-F197 HydrophobicContact CD2-CE1 3.5Å; L160-F197 VanDerWaalsContact CD2-CE1 3.5Å; L160-F197 HydrophobicContact CD2-CZ 4.11Å; L160-F200 HydrophobicContact CD1-CB 4.03Å; L160-F200 HydrophobicContact CD1-CD1 3.43Å; L160-F200 VanDerWaalsContact CD1-CD1 3.43Å; L160-F200 HydrophobicContact CD1-CD2 4.16Å; L160-F200 HydrophobicContact CD1-CE1 3.92Å; L160-F200 HydrophobicContact CD1-CG 3.57Å; L160-F200 HydrophobicContact CD1-CZ 4.49Å; L160-F201 HydrophobicContact CB-CZ 3.96Å
161	S	86.7	Confident	85.7	Confident	7 Å²	7	46 Å²	46	5%	0.049	23%	0.228	C	C	.	.	H	α-helix	trans	-64.8	-46.6	175.8	-65.8	0	0	0	0	110.9	V157 F158 V159 S164 L165	V157-S161 WeakPolarHBondContact O-CB 3.29Å; V157-S161 PolarHBondContact O-N 3.11Å; V157-S161 PolarHBondContact O-OG 3.25Å; F158-S161 PolarHBondContact O-N 3.11Å; V159-S161 VanDerWaalsContact C-N 3.31Å; V159-S161 PolarHBondContact O-N 2.86Å; S161-S164 PolarHBondContact O-N 3.03Å; S161-S164 PolarHBondContact O-OG 3.05Å; S161-L165 PolarHBondContact O-N 3.3Å; S161-L165 VanDerWaalsContact O-N 3.12Å
162	I	85.7	Confident	86.1	Confident	59 Å²	59	40.5 Å²	40.5	30%	0.303	21%	0.21	S	C	.	.	H	α-helix	trans	-62.9	-46.7	174.9	-65.4	173.2	0	0	0	110.6	F158 V159 S164 L165 I166 L255	F158-I162 HydrophobicContact CD1-CD1 4.24Å; F158-I162 HydrophobicContact CD2-CD1 4.37Å; F158-I162 HydrophobicContact CE1-CD1 3.64Å; F158-I162 HydrophobicContact CE2-CD1 3.77Å; F158-I162 HydrophobicContact CZ-CD1 3.38Å; F158-I162 PolarHBondContact O-N 3.18Å; F158-I162 VanDerWaalsContact O-N 3.12Å; V159-I162 PolarHBondContact O-N 3.34Å; I162-S164 VanDerWaalsContact C-N 3.33Å; I162-S164 PolarHBondContact O-N 2.7Å; I162-L165 WeakPolarHBondContact O-CB 3.44Å; I162-L165 PolarHBondContact O-N 3.38Å; I162-L165 VanDerWaalsContact O-N 3.11Å; I162-I166 HydrophobicContact CG2-CD1 3.84Å; I162-I166 HydrophobicContact CG2-CG1 4.37Å; I162-I166 WeakPolarHBondContact O-CG1 3.35Å; I162-I166 PolarHBondContact O-N 3.29Å; I162-L255 HydrophobicContact CG1-CD2 4.26Å
163	A	88.5	Confident	86	Confident	26 Å²	26	37.8 Å²	37.8	22%	0.215	20%	0.201	C	C	.	.	H	α-helix	trans	-60	-41.8	178.1	0	0	0	0	0	112.1	V159 L160 L165 I166 I167 F197	V159-A163 WeakPolarHBondContact O-CB 3.48Å; V159-A163 PolarHBondContact O-N 3.36Å; L160-A163 PolarHBondContact O-N 2.87Å; A163-L165 VanDerWaalsContact C-N 3.26Å; A163-L165 PolarHBondContact O-N 3.38Å; A163-I166 PolarHBondContact O-N 2.99Å; A163-I167 WeakPolarHBondContact O-CG1 3.41Å; A163-I167 PolarHBondContact O-N 3.45Å; A163-F197 HydrophobicContact CB-CE2 3.62Å; A163-F197 HydrophobicContact CB-CZ 3.85Å
164	S	90.7	Very high	85.6	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-64.3	-30.5	176.6	79	0	0	0	0	113.3	L160 S161 I162 Y168 R251 R254	L160-S164 VanDerWaalsContact O-CB 3.27Å; L160-S164 WeakPolarHBondContact O-CB 3.45Å; L160-S164 PolarHBondContact O-N 2.95Å; L160-S164 PolarHBondContact O-OG 3.18Å; S161-S164 PolarHBondContact O-N 3.03Å; S161-S164 PolarHBondContact O-OG 3.05Å; I162-S164 VanDerWaalsContact C-N 3.33Å; I162-S164 PolarHBondContact O-N 2.7Å; S164-Y168 PolarHBondContact O-N 2.85Å; S164-R251 WeakPolarHBondContact O-CD 3.35Å; S164-R251 PolarHBondContact O-NH1 2.92Å; S164-R254 PolarHBondContact OG-NH1 3.46Å
165	L	88.8	Confident	84.9	Confident	10 Å²	10	42.8 Å²	42.8	5%	0.052	23%	0.232	C	C	.	.	H	α-helix	trans	-76.5	-39.3	174.8	-178.3	63	0	0	0	111.5	S161 I162 A163 I167 Y168 F169 R251 A252 L255	S161-L165 PolarHBondContact O-N 3.3Å; S161-L165 VanDerWaalsContact O-N 3.12Å; I162-L165 WeakPolarHBondContact O-CB 3.44Å; I162-L165 PolarHBondContact O-N 3.38Å; I162-L165 VanDerWaalsContact O-N 3.11Å; A163-L165 VanDerWaalsContact C-N 3.26Å; A163-L165 PolarHBondContact O-N 3.38Å; L165-I167 VanDerWaalsContact C-N 3.31Å; L165-I167 PolarHBondContact O-N 2.85Å; L165-Y168 HydrophobicContact CD1-CD1 4.09Å; L165-Y168 WeakPolarHBondContact O-CA 3.16Å; L165-Y168 WeakPolarHBondContact O-CB 3.49Å; L165-Y168 PolarHBondContact O-N 2.78Å; L165-Y168 VanDerWaalsContact O-N 3.11Å; L165-F169 HydrophobicContact CD1-CE1 3.85Å; L165-F169 HydrophobicContact CD1-CE2 4.29Å; L165-F169 HydrophobicContact CD1-CZ 3.71Å; L165-F169 HydrophobicContact CD2-CE2 4.01Å; L165-F169 HydrophobicContact CD2-CZ 3.85Å; L165-F169 HydrophobicContact CG-CD2 4.37Å; L165-F169 HydrophobicContact CG-CE1 4.19Å; L165-F169 HydrophobicContact CG-CE2 3.7Å; L165-F169 HydrophobicContact CG-CZ 3.59Å; L165-F169 WeakPolarHBondContact O-CG 3.45Å; L165-F169 PolarHBondContact O-N 3.04Å; L165-R251 HydrophobicContact CD1-CB 4.35Å; L165-A252 HydrophobicContact CD1-CB 3.93Å; L165-L255 HydrophobicContact CD2-CD1 3.84Å; L165-L255 HydrophobicContact CD2-CG 4.22Å
166	I	88.7	Confident	84.2	Confident	99 Å²	99	46.2 Å²	46.2	51%	0.508	24%	0.244	S	C	.	.	H	α-helix	trans	-61.3	-41.1	174.1	-68.8	168.3	0	0	0	110.7	I162 A163 Y168 F169 Y170	I162-I166 HydrophobicContact CG2-CD1 3.84Å; I162-I166 HydrophobicContact CG2-CG1 4.37Å; I162-I166 WeakPolarHBondContact O-CG1 3.35Å; I162-I166 PolarHBondContact O-N 3.29Å; A163-I166 PolarHBondContact O-N 2.99Å; I166-Y168 VanDerWaalsContact C-N 3.29Å; I166-Y168 PolarHBondContact O-N 2.94Å; I166-F169 PolarHBondContact O-N 2.87Å; I166-F169 VanDerWaalsContact O-N 3.17Å; I166-Y170 WeakPolarHBondContact O-CB 3.37Å; I166-Y170 PolarHBondContact O-N 3.44Å
167	I	89.5	Confident	83	Confident	22 Å²	22	44.6 Å²	44.6	11%	0.113	23%	0.234	C	C	.	.	H	α-helix	trans	-60.1	-42.1	173.7	-68.6	174.5	0	0	0	110.7	A163 L165 F169 Y170 D171 I193 D194 F197	A163-I167 WeakPolarHBondContact O-CG1 3.41Å; A163-I167 PolarHBondContact O-N 3.45Å; L165-I167 VanDerWaalsContact C-N 3.31Å; L165-I167 PolarHBondContact O-N 2.85Å; I167-F169 PolarHBondContact O-N 3.37Å; I167-Y170 PolarHBondContact O-N 2.95Å; I167-D171 PolarHBondContact O-N 3.25Å; I167-I193 HydrophobicContact CD1-CB 4.1Å; I167-I193 HydrophobicContact CD1-CG2 3.55Å; I167-D194 HydrophobicContact CG2-CB 4.41Å; I167-F197 HydrophobicContact CD1-CD2 3.73Å; I167-F197 HydrophobicContact CD1-CE2 3.4Å; I167-F197 HydrophobicContact CD1-CZ 4.42Å; I167-F197 HydrophobicContact CG1-CE2 4.48Å
168	Y	89.2	Confident	82.2	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.008	25%	0.247	C	C	.	.	H	α-helix	trans	-60.2	-44.5	174	165.2	-103	0	0	0	112	S164 L165 I166 Y170 D171 A172 L245 R248 F249 Y367	S164-Y168 PolarHBondContact O-N 2.85Å; L165-Y168 HydrophobicContact CD1-CD1 4.09Å; L165-Y168 WeakPolarHBondContact O-CA 3.16Å; L165-Y168 WeakPolarHBondContact O-CB 3.49Å; L165-Y168 PolarHBondContact O-N 2.78Å; L165-Y168 VanDerWaalsContact O-N 3.11Å; I166-Y168 VanDerWaalsContact C-N 3.29Å; I166-Y168 PolarHBondContact O-N 2.94Å; Y168-Y170 VanDerWaalsContact C-N 3.33Å; Y168-Y170 PolarHBondContact O-N 3.14Å; Y168-D171 PolarHBondContact O-N 2.87Å; Y168-A172 HydrophobicContact CE2-CB 4.11Å; Y168-A172 WeakPolarHBondContact O-CB 3.48Å; Y168-A172 PolarHBondContact O-N 2.92Å; Y168-L245 HydrophobicContact CD2-CD1 3.87Å; Y168-L245 HydrophobicContact CE2-CD1 3.74Å; Y168-L245 HydrophobicContact CE2-CD2 4.36Å; Y168-L245 HydrophobicContact CE2-CG 4Å; Y168-R248 HydrophobicContact CD2-CB 3.66Å; Y168-R248 HydrophobicContact CE2-CB 4.23Å; Y168-R248 HydrophobicContact CG-CB 4.48Å; Y168-F249 HydrophobicContact CE1-CB 3.92Å; Y168-F249 HydrophobicContact CE2-CB 4.03Å; Y168-F249 WeakPolarHBondContact OH-CB 3.22Å; Y168-Y367 HydrophobicContact CE1-CD2 4.05Å; Y168-Y367 AromaticContact CE1-CE2 3.67Å; Y168-Y367 HydrophobicContact CE1-CE2 3.67Å; Y168-Y367 AromaticContact CE1-CZ 3.97Å; Y168-Y367 AromaticContact CZ-CE2 3.96Å; Y168-Y367 VanDerWaalsContact OH-CD2 3.26Å; Y168-Y367 WeakPolarHBondContact OH-CD2 3.34Å; Y168-Y367 WeakPolarHBondContact OH-CE2 3.17Å
169	F	89.8	Confident	82.2	Confident	34 Å²	34	47 Å²	47	15%	0.149	25%	0.248	C	C	.	.	H	α-helix	trans	-64.4	-37.6	176.4	-62.5	-29.9	0	0	0	112.8	L165 I166 I167 S173 L340 Y367 W368	L165-F169 HydrophobicContact CD1-CE1 3.85Å; L165-F169 HydrophobicContact CD1-CE2 4.29Å; L165-F169 HydrophobicContact CD1-CZ 3.71Å; L165-F169 HydrophobicContact CD2-CE2 4.01Å; L165-F169 HydrophobicContact CD2-CZ 3.85Å; L165-F169 HydrophobicContact CG-CD2 4.37Å; L165-F169 HydrophobicContact CG-CE1 4.19Å; L165-F169 HydrophobicContact CG-CE2 3.7Å; L165-F169 HydrophobicContact CG-CZ 3.59Å; L165-F169 WeakPolarHBondContact O-CG 3.45Å; L165-F169 PolarHBondContact O-N 3.04Å; I166-F169 PolarHBondContact O-N 2.87Å; I166-F169 VanDerWaalsContact O-N 3.17Å; I167-F169 PolarHBondContact O-N 3.37Å; F169-S173 WeakPolarHBondContact O-CB 3.37Å; F169-S173 PolarHBondContact O-N 3.38Å; F169-S173 PolarHBondContact O-OG 3.39Å; F169-L340 HydrophobicContact CZ-CD1 4.24Å; F169-L340 HydrophobicContact CZ-CD2 4.17Å; F169-Y367 AromaticContact CD1-CD1 3.99Å; F169-Y367 HydrophobicContact CD1-CD1 3.99Å; F169-Y367 AromaticContact CD1-CE1 3.58Å; F169-Y367 HydrophobicContact CD1-CE1 3.58Å; F169-Y367 HydrophobicContact CE1-CD1 4.19Å; F169-Y367 AromaticContact CE1-CE1 3.32Å; F169-Y367 HydrophobicContact CE1-CE1 3.32Å; F169-Y367 AromaticContact CE1-CZ 3.61Å; F169-Y367 HydrophobicContact CZ-CE1 4.27Å; F169-W368 HydrophobicContact CB-CZ2 4.13Å; F169-W368 HydrophobicContact CD1-CH2 4.38Å; F169-W368 HydrophobicContact CD2-CH2 4.06Å; F169-W368 HydrophobicContact CD2-CZ2 4.36Å; F169-W368 HydrophobicContact CE2-CH2 4.27Å; F169-W368 HydrophobicContact CG-CH2 4.12Å; F169-W368 HydrophobicContact CG-CZ2 4.12Å
170	Y	87.5	Confident	81.9	Confident	142 Å²	142	43.6 Å²	43.6	56%	0.557	23%	0.227	S	C	*	.	H	α-helix	trans	-62.7	-51.4	174.8	178.4	-94.4	0	0	0	111	I166 I167 Y168 A172 S173 N174	I166-Y170 WeakPolarHBondContact O-CB 3.37Å; I166-Y170 PolarHBondContact O-N 3.44Å; I167-Y170 PolarHBondContact O-N 2.95Å; Y168-Y170 VanDerWaalsContact C-N 3.33Å; Y168-Y170 PolarHBondContact O-N 3.14Å; Y170-A172 PolarHBondContact O-N 3.47Å; Y170-S173 PolarHBondContact O-N 3.16Å; Y170-S173 PolarHBondContact O-OG 3.12Å; Y170-S173 VanDerWaalsContact O-OG 3.12Å; Y170-N174 PolarHBondContact O-N 3.32Å
171	D	86	Confident	81.4	Confident	3 Å²	3	42.8 Å²	42.8	2%	0.016	22%	0.223	C	C	.	.	H	α-helix	trans	-63.2	-40.7	177.9	-71.3	-14.8	0	0	0	111.2	I167 Y168 S173 N174 F177 S190 L245 R248	I167-D171 PolarHBondContact O-N 3.25Å; Y168-D171 PolarHBondContact O-N 2.87Å; D171-S173 PolarHBondContact O-N 3.33Å; D171-N174 PolarHBondContact O-N 2.86Å; D171-F177 HydrophobicContact CB-CD1 4.4Å; D171-F177 HydrophobicContact CB-CE1 4.37Å; D171-F177 WeakPolarHBondContact O-CB 3.43Å; D171-F177 WeakPolarHBondContact O-CD1 3.42Å; D171-S190 WeakPolarHBondContact OD1-CB 3.48Å; D171-S190 PolarHBondContact OD1-OG 3.08Å; D171-L245 HydrophobicContact CB-CD1 4.3Å; D171-R248 IonicContact OD2-NH1 3.6Å; D171-R248 PolarHBondContact OD2-NH1 3.47Å
172	A	85.1	Confident	81.1	Confident	11 Å²	11	43.8 Å²	43.8	9%	0.091	23%	0.23	C	C	.	.	H	α-helix	trans	-74.5	-21	-178.9	0	0	0	0	0	114.3	Y168 Y170 L245	Y168-A172 HydrophobicContact CE2-CB 4.11Å; Y168-A172 WeakPolarHBondContact O-CB 3.48Å; Y168-A172 PolarHBondContact O-N 2.92Å; Y170-A172 PolarHBondContact O-N 3.47Å; A172-L245 HydrophobicContact CB-CD1 4.29Å; A172-L245 HydrophobicContact CB-CD2 4.19Å
173	S	82.8	Confident	80.7	Confident	55 Å²	55	43.6 Å²	43.6	39%	0.385	23%	0.229	S	C	.	.	H	α-helix	trans	-93	-16.2	177.1	59.9	0	0	0	0	113.1	F169 Y170 D171 P175	F169-S173 WeakPolarHBondContact O-CB 3.37Å; F169-S173 PolarHBondContact O-N 3.38Å; F169-S173 PolarHBondContact O-OG 3.39Å; Y170-S173 PolarHBondContact O-N 3.16Å; Y170-S173 PolarHBondContact O-OG 3.12Å; Y170-S173 VanDerWaalsContact O-OG 3.12Å; D171-S173 PolarHBondContact O-N 3.33Å; S173-P175 VanDerWaalsContact O-CD 3.29Å; S173-P175 WeakPolarHBondContact O-CD 3.33Å
174	N	78.3	Confident	80.2	Confident	54 Å²	54	44.2 Å²	44.2	29%	0.289	23%	0.23	S	C	.	.			trans	-73.2	116.2	-177.3	-167.5	-14.6	0	0	0	110.4	Y170 D171 H176 F177	Y170-N174 PolarHBondContact O-N 3.32Å; D171-N174 PolarHBondContact O-N 2.86Å; N174-H176 PolarHBondContact O-N 3.24Å; N174-H176 VanDerWaalsContact O-N 3.12Å; N174-H176 PolarHBondContact OD1-N 3.18Å; N174-F177 HydrophobicContact CB-CB 4.12Å; N174-F177 WeakPolarHBondContact O-CB 3.4Å; N174-F177 PolarHBondContact O-N 2.94Å
175	P	63	Low	79.6	Confident	79 Å²	79	46.4 Å²	46.4	51%	0.513	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-17.9	-174.3	24.9	-34.4	0	0	0	114.2	S173 F177	S173-P175 VanDerWaalsContact O-CD 3.29Å; S173-P175 WeakPolarHBondContact O-CD 3.33Å; P175-F177 VanDerWaalsContact C-N 3.32Å
176	H	62.4	Low	79	Confident	132 Å²	132	50.4 Å²	50.4	61%	0.611	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-15.3	174	-67.2	-76.3	0	0	0	112.8	N174 Q178	N174-H176 PolarHBondContact O-N 3.24Å; N174-H176 VanDerWaalsContact O-N 3.12Å; N174-H176 PolarHBondContact OD1-N 3.18Å; H176-Q178 PolarHBondContact O-N 2.86Å
177	F	63	Low	78.7	Confident	35 Å²	35	52.5 Å²	52.5	15%	0.154	28%	0.278	C	S	.	.			trans	-87.9	99.4	-177	-158.4	-96.7	0	0	0	110	D171 N174 P175 T181 N243 L245	D171-F177 HydrophobicContact CB-CD1 4.4Å; D171-F177 HydrophobicContact CB-CE1 4.37Å; D171-F177 WeakPolarHBondContact O-CB 3.43Å; D171-F177 WeakPolarHBondContact O-CD1 3.42Å; N174-F177 HydrophobicContact CB-CB 4.12Å; N174-F177 WeakPolarHBondContact O-CB 3.4Å; N174-F177 PolarHBondContact O-N 2.94Å; P175-F177 VanDerWaalsContact C-N 3.32Å; F177-T181 HydrophobicContact CD2-CG2 3.99Å; F177-T181 HydrophobicContact CE2-CG2 4.18Å; F177-T181 WeakPolarHBondContact CE2-OG1 3.39Å; F177-T181 HydrophobicContact CG-CG2 4.4Å; F177-N243 HydrophobicContact CE2-CB 4.15Å; F177-N243 VanDerWaalsContact CE2-ND2 3.3Å; F177-N243 WeakPolarHBondContact CE2-ND2 3.47Å; F177-N243 HydrophobicContact CZ-CB 4.03Å; F177-N243 WeakPolarHBondContact CZ-ND2 3.25Å; F177-L245 HydrophobicContact CD1-CD1 4.35Å; F177-L245 HydrophobicContact CE1-CB 3.99Å; F177-L245 HydrophobicContact CE1-CD1 3.93Å; F177-L245 HydrophobicContact CE1-CG 4.48Å
178	Q	67.7	Low	78.3	Confident	68 Å²	68	52 Å²	52	32%	0.318	28%	0.277	S	S	.	.			trans	-77.7	175.2	170.6	-62.7	-171	13.6	0	0	110.4	H176 E180 T181	H176-Q178 PolarHBondContact O-N 2.86Å; Q178-E180 PolarHBondContact O-N 2.87Å; Q178-E180 VanDerWaalsContact O-N 3.16Å; Q178-T181 HydrophobicContact CB-CG2 4.45Å
179	V	77.5	Confident	78.1	Confident	37 Å²	37	56 Å²	56	22%	0.224	30%	0.303	C	S	.	.	S	Bend	trans	-53.8	-36.8	179.8	-179.4	0	0	0	0	111.8	W244 L245 L348 N351	V179-W244 WeakPolarHBondContact O-CA 3.49Å; V179-L245 PolarHBondContact O-N 2.74Å; V179-L348 HydrophobicContact CG1-CD1 4.43Å; V179-N351 HydrophobicContact CG2-CB 4.01Å
180	E	79.9	Confident	77.9	Confident	11 Å²	11	55.5 Å²	55.5	5%	0.051	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	135.1	172.7	-170.7	174.8	170.9	0	0	108.8	L38 K42 Y43 Q178 R242 N243	L38-E180 HydrophobicContact CD2-CB 4.18Å; L38-E180 HydrophobicContact CD2-CG 4.26Å; L38-E180 WeakPolarHBondContact CD2-O 3.42Å; K42-E180 PolarHBondContact N-OE1 2.07Å; K42-E180 PolarHBondContact N-OE2 2.72Å; K42-E180 VanDerWaalsContact N-OE2 3.14Å; Y43-E180 PolarHBondContact N-OE2 2.71Å; Q178-E180 PolarHBondContact O-N 2.87Å; Q178-E180 VanDerWaalsContact O-N 3.16Å; E180-R242 WeakPolarHBondContact OE1-CD 3.47Å; E180-R242 IonicContact OE1-CZ 3.14Å; E180-R242 IonicContact OE1-NH1 3.36Å; E180-R242 PolarHBondContact OE1-NH1 3.46Å; E180-N243 CarbonylContact C-O 3.46Å; E180-N243 VanDerWaalsContact CA-O 3.32Å; E180-N243 WeakPolarHBondContact CA-O 3.41Å
181	T	79	Confident	77.7	Confident	13 Å²	13	49 Å²	49	8%	0.08	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	137.2	177	59	0	0	0	0	110.6	F177 Q178 I183 N243	F177-T181 HydrophobicContact CD2-CG2 3.99Å; F177-T181 HydrophobicContact CE2-CG2 4.18Å; F177-T181 WeakPolarHBondContact CE2-OG1 3.39Å; F177-T181 HydrophobicContact CG-CG2 4.4Å; Q178-T181 HydrophobicContact CB-CG2 4.45Å; T181-I183 PolarHBondContact O-N 3.17Å; T181-N243 PolarHBondContact N-O 3.41Å; T181-N243 PolarHBondContact O-N 3.14Å
182	C	80.1	Confident	77.8	Confident	28 Å²	28	53.3 Å²	53.3	19%	0.189	30%	0.298	C	S	.	.			trans	-97.8	76.9	-179.8	-61.1	0	0	0	0	111.6	C37 R242	C37-C182 HydrophobicContact CB-CB 3.53Å; C37-C182 WeakPolarHBondContact CB-SG 3.24Å; C37-C182 WeakPolarHBondContact SG-CB 3.09Å; C37-C182 CovalentContact SG-SG 2.01Å; C37-C182 PolarHBondContact SG-SG 2.91Å; C182-R242 HydrophobicContact CB-CG 4.42Å
183	I	77.3	Confident	78	Confident	55 Å²	55	56.8 Å²	56.8	28%	0.282	32%	0.315	S	S	.	.			trans	-117.2	125.9	178.3	-58	172.8	0	0	0	107.6	T181 Q187	T181-I183 PolarHBondContact O-N 3.17Å; I183-Q187 HydrophobicContact CG2-CB 4.05Å
184	P	77.8	Confident	78.3	Confident	38 Å²	38	54.3 Å²	54.3	25%	0.247	30%	0.297	C	S	.	.			trans	-65.6	143.7	176.5	26	-32.7	0	0	0	110.7	S186 Q187	P184-S186 PolarHBondContact O-N 2.85Å; P184-Q187 HydrophobicContact CG-CB 4.4Å; P184-Q187 HydrophobicContact CG-CG 4.03Å; P184-Q187 PolarHBondContact O-N 3.2Å
185	L	77.8	Confident	78.8	Confident	47 Å²	47	53.2 Å²	53.2	25%	0.246	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-32.5	-176.4	178.9	67.9	0	0	0	113.3	Q187 S188 Q191 Q192 L195 I238	L185-Q187 PolarHBondContact O-N 3.03Å; L185-S188 PolarHBondContact O-N 2.87Å; L185-Q191 HydrophobicContact CD1-CB 3.84Å; L185-Q191 HydrophobicContact CD1-CG 3.53Å; L185-Q192 HydrophobicContact CD1-CG 3.93Å; L185-Q192 HydrophobicContact CG-CG 4.16Å; L185-Q192 WeakPolarHBondContact O-CG 3.37Å; L185-Q192 PolarHBondContact O-NE2 2.67Å; L185-L195 HydrophobicContact CD2-CD2 4.39Å; L185-I238 HydrophobicContact CD2-CG1 4.36Å; L185-I238 HydrophobicContact CD2-CG2 4.38Å
186	S	77.4	Confident	80.1	Confident	93 Å²	93	52.1 Å²	52.1	65%	0.65	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-26.6	-179.7	58.3	0	0	0	0	113.4	P184 Q192	P184-S186 PolarHBondContact O-N 2.85Å; S186-Q192 PolarHBondContact O-NE2 3.35Å
187	Q	81.3	Confident	81.6	Confident	143 Å²	143	47.5 Å²	47.5	67%	0.668	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-18	-176	-66	-179.8	1.6	0	0	113.3	I183 P184 L185 P189	I183-Q187 HydrophobicContact CG2-CB 4.05Å; P184-Q187 HydrophobicContact CG-CB 4.4Å; P184-Q187 HydrophobicContact CG-CG 4.03Å; P184-Q187 PolarHBondContact O-N 3.2Å; L185-Q187 PolarHBondContact O-N 3.03Å; Q187-P189 WeakPolarHBondContact O-CD 3.29Å
188	S	80.5	Confident	83	Confident	13 Å²	13	45.8 Å²	45.8	9%	0.091	26%	0.26	C	S	.	.			trans	-107.2	100.7	-176.1	56.2	0	0	0	0	112.3	L185 S190 Q191 Q192	L185-S188 PolarHBondContact O-N 2.87Å; S188-S190 VanDerWaalsContact C-N 3.27Å; S188-S190 PolarHBondContact O-N 3.12Å; S188-Q191 PolarHBondContact O-N 2.9Å; S188-Q191 VanDerWaalsContact OG-CB 3.25Å; S188-Q191 WeakPolarHBondContact OG-CB 3.33Å; S188-Q191 PolarHBondContact OG-OE1 3.25Å; S188-Q192 PolarHBondContact O-N 2.84Å
189	P	85.5	Confident	84.2	Confident	85 Å²	85	46.5 Å²	46.5	55%	0.552	27%	0.265	S	S	*	.	H	α-helix	trans	-63.7	-31.9	178.5	25.1	-33.8	0	0	0	112.5	Q187 Q191 Q192 I193	Q187-P189 WeakPolarHBondContact O-CD 3.29Å; P189-Q191 VanDerWaalsContact C-N 3.34Å; P189-Q191 PolarHBondContact O-N 3.04Å; P189-Q192 PolarHBondContact O-N 3.44Å; P189-I193 WeakPolarHBondContact O-CG1 3.31Å; P189-I193 PolarHBondContact O-N 2.67Å; P189-I193 VanDerWaalsContact O-N 3.09Å
190	S	85.4	Confident	84.9	Confident	24 Å²	24	46.9 Å²	46.9	17%	0.168	26%	0.263	C	S	.	.	H	α-helix	trans	-61.7	-41.5	177.3	61	0	0	0	0	111.9	D171 S188 I193 D194	D171-S190 WeakPolarHBondContact OD1-CB 3.48Å; D171-S190 PolarHBondContact OD1-OG 3.08Å; S188-S190 VanDerWaalsContact C-N 3.27Å; S188-S190 PolarHBondContact O-N 3.12Å; S190-I193 PolarHBondContact O-N 3.43Å; S190-D194 VanDerWaalsContact O-CB 3.27Å; S190-D194 WeakPolarHBondContact O-CB 3.38Å; S190-D194 PolarHBondContact O-N 2.92Å
191	Q	83.5	Confident	85.5	Confident	6 Å²	6	46.5 Å²	46.5	3%	0.028	26%	0.261	C	S	.	.	H	α-helix	trans	-69.2	-34.9	178.2	-166.2	-177.9	-14.1	0	0	112.5	L185 S188 P189 D194 L195	L185-Q191 HydrophobicContact CD1-CB 3.84Å; L185-Q191 HydrophobicContact CD1-CG 3.53Å; S188-Q191 PolarHBondContact O-N 2.9Å; S188-Q191 VanDerWaalsContact OG-CB 3.25Å; S188-Q191 WeakPolarHBondContact OG-CB 3.33Å; S188-Q191 PolarHBondContact OG-OE1 3.25Å; P189-Q191 VanDerWaalsContact C-N 3.34Å; P189-Q191 PolarHBondContact O-N 3.04Å; Q191-D194 PolarHBondContact O-N 3.25Å; Q191-L195 WeakPolarHBondContact O-CB 3.47Å; Q191-L195 PolarHBondContact O-N 3.44Å
192	Q	88.8	Confident	86.2	Confident	92 Å²	92	48.5 Å²	48.5	43%	0.43	27%	0.271	S	S	.	.	H	α-helix	trans	-64.3	-45.9	175.7	-66.8	175.7	9.3	0	0	111.5	L185 S186 S188 P189 L195 A196	L185-Q192 HydrophobicContact CD1-CG 3.93Å; L185-Q192 HydrophobicContact CG-CG 4.16Å; L185-Q192 WeakPolarHBondContact O-CG 3.37Å; L185-Q192 PolarHBondContact O-NE2 2.67Å; S186-Q192 PolarHBondContact O-NE2 3.35Å; S188-Q192 PolarHBondContact O-N 2.84Å; P189-Q192 PolarHBondContact O-N 3.44Å; Q192-L195 PolarHBondContact O-N 3.01Å; Q192-A196 PolarHBondContact O-N 3.48Å
193	I	90.1	Very high	86.8	Confident	85 Å²	85	51 Å²	51	44%	0.436	29%	0.286	S	S	.	.	H	α-helix	trans	-67	-41	177.4	-60.5	166.9	0	0	0	110.1	I167 P189 S190 L195 A196 F197	I167-I193 HydrophobicContact CD1-CB 4.1Å; I167-I193 HydrophobicContact CD1-CG2 3.55Å; P189-I193 WeakPolarHBondContact O-CG1 3.31Å; P189-I193 PolarHBondContact O-N 2.67Å; P189-I193 VanDerWaalsContact O-N 3.09Å; S190-I193 PolarHBondContact O-N 3.43Å; I193-L195 VanDerWaalsContact C-N 3.32Å; I193-L195 PolarHBondContact O-N 3.48Å; I193-A196 WeakPolarHBondContact O-CB 3.34Å; I193-A196 PolarHBondContact O-N 3.29Å; I193-F197 HydrophobicContact CG2-CD2 4.25Å; I193-F197 HydrophobicContact CG2-CE1 4.02Å; I193-F197 HydrophobicContact CG2-CE2 3.65Å; I193-F197 HydrophobicContact CG2-CZ 3.51Å; I193-F197 PolarHBondContact O-N 3.32Å; I193-F197 VanDerWaalsContact O-N 3.1Å
194	D	88.8	Confident	87.5	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.011	28%	0.279	C	S	.	.	H	α-helix	trans	-59.9	-42.2	178	-165.5	52.1	0	0	0	112.4	I167 S190 Q191 F197 N198 R248 R251	I167-D194 HydrophobicContact CG2-CB 4.41Å; S190-D194 VanDerWaalsContact O-CB 3.27Å; S190-D194 WeakPolarHBondContact O-CB 3.38Å; S190-D194 PolarHBondContact O-N 2.92Å; Q191-D194 PolarHBondContact O-N 3.25Å; D194-F197 PolarHBondContact O-N 3.16Å; D194-N198 PolarHBondContact O-N 2.81Å; D194-N198 PolarHBondContact O-ND2 2.91Å; D194-N198 PolarHBondContact OD2-ND2 3.1Å; D194-R248 IonicContact OD2-CZ 2.73Å; D194-R248 IonicContact OD2-NH1 2.82Å; D194-R248 PolarHBondContact OD2-NH1 3.4Å; D194-R248 IonicContact OD2-NH2 3.84Å; D194-R248 PolarHBondContact OD2-NH2 3.34Å; D194-R251 IonicContact OD1-CZ 3.25Å; D194-R251 IonicContact OD1-NH1 2.65Å; D194-R251 PolarHBondContact OD1-NH1 3.02Å; D194-R251 IonicContact OD1-NH2 2.91Å; D194-R251 PolarHBondContact OD1-NH2 2.92Å; D194-R251 IonicContact OD2-CZ 3.92Å; D194-R251 IonicContact OD2-NH1 3.89Å; D194-R251 IonicContact OD2-NH2 2.98Å; D194-R251 PolarHBondContact OD2-NH2 3.06Å
195	L	88.1	Confident	88.1	Confident	32 Å²	32	49.2 Å²	49.2	17%	0.168	27%	0.271	C	S	.	.	H	α-helix	trans	-60.9	-45.5	174.9	178.3	58.2	0	0	0	111.8	L185 Q191 Q192 I193 F197 N198 I199 F235 I238	L185-L195 HydrophobicContact CD2-CD2 4.39Å; Q191-L195 WeakPolarHBondContact O-CB 3.47Å; Q191-L195 PolarHBondContact O-N 3.44Å; Q192-L195 PolarHBondContact O-N 3.01Å; I193-L195 VanDerWaalsContact C-N 3.32Å; I193-L195 PolarHBondContact O-N 3.48Å; L195-F197 VanDerWaalsContact C-N 3.26Å; L195-F197 PolarHBondContact O-N 3.12Å; L195-N198 PolarHBondContact O-N 2.94Å; L195-I199 HydrophobicContact CD1-CD1 4.16Å; L195-I199 HydrophobicContact CD1-CG1 4.23Å; L195-I199 HydrophobicContact CG-CD1 4.01Å; L195-I199 WeakPolarHBondContact O-CG1 3.14Å; L195-I199 PolarHBondContact O-N 3.02Å; L195-F235 HydrophobicContact CD1-CD1 4.34Å; L195-F235 HydrophobicContact CD1-CE1 4.08Å; L195-I238 HydrophobicContact CD1-CD1 3.55Å; L195-I238 HydrophobicContact CD2-CD1 3.42Å; L195-I238 VanDerWaalsContact CD2-CD1 3.42Å; L195-I238 HydrophobicContact CD2-CG1 4.35Å; L195-I238 HydrophobicContact CG-CD1 4.05Å
196	A	91.3	Very high	88.9	Confident	56 Å²	56	52.2 Å²	52.2	46%	0.463	28%	0.283	S	S	.	.	H	α-helix	trans	-58.3	-40.8	178.4	0	0	0	0	0	111.6	Q192 I193 F200	Q192-A196 PolarHBondContact O-N 3.48Å; I193-A196 WeakPolarHBondContact O-CB 3.34Å; I193-A196 PolarHBondContact O-N 3.29Å; A196-F200 PolarHBondContact O-N 3.36Å
197	F	92.7	Very high	89.5	Confident	34 Å²	34	48.8 Å²	48.8	15%	0.149	26%	0.257	C	S	.	.	H	α-helix	trans	-68	-42.5	176	-63.6	-15.4	0	0	0	112.4	L160 A163 I167 I193 D194 L195 I199 F200 F201	L160-F197 HydrophobicContact CD1-CD1 4.44Å; L160-F197 HydrophobicContact CD2-CD1 3.76Å; L160-F197 HydrophobicContact CD2-CE1 3.5Å; L160-F197 VanDerWaalsContact CD2-CE1 3.5Å; L160-F197 HydrophobicContact CD2-CZ 4.11Å; A163-F197 HydrophobicContact CB-CE2 3.62Å; A163-F197 HydrophobicContact CB-CZ 3.85Å; I167-F197 HydrophobicContact CD1-CD2 3.73Å; I167-F197 HydrophobicContact CD1-CE2 3.4Å; I167-F197 HydrophobicContact CD1-CZ 4.42Å; I167-F197 HydrophobicContact CG1-CE2 4.48Å; I193-F197 HydrophobicContact CG2-CD2 4.25Å; I193-F197 HydrophobicContact CG2-CE1 4.02Å; I193-F197 HydrophobicContact CG2-CE2 3.65Å; I193-F197 HydrophobicContact CG2-CZ 3.51Å; I193-F197 PolarHBondContact O-N 3.32Å; I193-F197 VanDerWaalsContact O-N 3.1Å; D194-F197 PolarHBondContact O-N 3.16Å; L195-F197 VanDerWaalsContact C-N 3.26Å; L195-F197 PolarHBondContact O-N 3.12Å; F197-I199 VanDerWaalsContact C-N 3.32Å; F197-I199 PolarHBondContact O-N 2.82Å; F197-F200 WeakPolarHBondContact O-CB 3.41Å; F197-F200 PolarHBondContact O-N 2.86Å; F197-F200 VanDerWaalsContact O-N 3.15Å; F197-F201 HydrophobicContact CB-CD2 4.44Å; F197-F201 HydrophobicContact CB-CE2 4.1Å; F197-F201 WeakPolarHBondContact O-CD2 3.38Å; F197-F201 PolarHBondContact O-N 3.39Å
198	N	91.7	Very high	89.9	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-67.1	-31.6	178.8	-68.2	-44.3	0	0	0	112.9	D194 L195 F200 F201 L202 S234	D194-N198 PolarHBondContact O-N 2.81Å; D194-N198 PolarHBondContact O-ND2 2.91Å; D194-N198 PolarHBondContact OD2-ND2 3.1Å; L195-N198 PolarHBondContact O-N 2.94Å; N198-F200 VanDerWaalsContact C-N 3.35Å; N198-F201 PolarHBondContact O-N 2.84Å; N198-L202 WeakPolarHBondContact O-CB 3.22Å; N198-L202 PolarHBondContact O-N 3.29Å; N198-S234 WeakPolarHBondContact ND2-CB 3.39Å; N198-S234 PolarHBondContact ND2-OG 2.94Å
199	I	92.9	Very high	90.4	Very high	83 Å²	83	45.3 Å²	45.3	43%	0.426	24%	0.237	S	C	.	.	H	α-helix	trans	-62.8	-43.8	170.8	-68.9	167	0	0	0	110.4	L195 F197 L202 V203 F235	L195-I199 HydrophobicContact CD1-CD1 4.16Å; L195-I199 HydrophobicContact CD1-CG1 4.23Å; L195-I199 HydrophobicContact CG-CD1 4.01Å; L195-I199 WeakPolarHBondContact O-CG1 3.14Å; L195-I199 PolarHBondContact O-N 3.02Å; F197-I199 VanDerWaalsContact C-N 3.32Å; F197-I199 PolarHBondContact O-N 2.82Å; I199-L202 WeakPolarHBondContact O-CB 3.26Å; I199-L202 PolarHBondContact O-N 2.91Å; I199-V203 PolarHBondContact O-N 2.8Å; I199-F235 HydrophobicContact CG1-CZ 4.27Å
200	F	93.6	Very high	90.7	Very high	45 Å²	45	44.5 Å²	44.5	20%	0.197	23%	0.227	C	C	.	.	H	α-helix	trans	-61.7	-45.8	175.3	176.5	-91	0	0	0	111.8	L153 L156 V157 L160 A196 F197 N198 L202 V203 Y204	L153-F200 HydrophobicContact CD1-CE2 4.1Å; L153-F200 HydrophobicContact CD1-CZ 3.76Å; L156-F200 HydrophobicContact CD2-CD1 4.23Å; L156-F200 HydrophobicContact CD2-CD2 3.82Å; L156-F200 HydrophobicContact CD2-CE1 3.7Å; L156-F200 HydrophobicContact CD2-CE2 3.26Å; L156-F200 HydrophobicContact CD2-CG 4.28Å; L156-F200 HydrophobicContact CD2-CZ 3.18Å; L156-F200 HydrophobicContact CG-CZ 4.48Å; V157-F200 HydrophobicContact CB-CE1 4.5Å; V157-F200 HydrophobicContact CG2-CE1 3.69Å; V157-F200 HydrophobicContact CG2-CZ 3.88Å; L160-F200 HydrophobicContact CD1-CB 4.03Å; L160-F200 HydrophobicContact CD1-CD1 3.43Å; L160-F200 VanDerWaalsContact CD1-CD1 3.43Å; L160-F200 HydrophobicContact CD1-CD2 4.16Å; L160-F200 HydrophobicContact CD1-CE1 3.92Å; L160-F200 HydrophobicContact CD1-CG 3.57Å; L160-F200 HydrophobicContact CD1-CZ 4.49Å; A196-F200 PolarHBondContact O-N 3.36Å; F197-F200 WeakPolarHBondContact O-CB 3.41Å; F197-F200 PolarHBondContact O-N 2.86Å; F197-F200 VanDerWaalsContact O-N 3.15Å; N198-F200 VanDerWaalsContact C-N 3.35Å; F200-L202 VanDerWaalsContact C-N 3.27Å; F200-L202 PolarHBondContact O-N 2.97Å; F200-V203 PolarHBondContact O-N 3.49Å; F200-Y204 PolarHBondContact O-N 2.69Å
201	F	92.2	Very high	90.8	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.009	23%	0.227	C	C	.	.	H	α-helix	trans	-64.9	-30.2	177.7	-68.6	-58.5	0	0	0	113.1	L160 F197 N198 Y204 F205 I231	L160-F201 HydrophobicContact CB-CZ 3.96Å; F197-F201 HydrophobicContact CB-CD2 4.44Å; F197-F201 HydrophobicContact CB-CE2 4.1Å; F197-F201 WeakPolarHBondContact O-CD2 3.38Å; F197-F201 PolarHBondContact O-N 3.39Å; N198-F201 PolarHBondContact O-N 2.84Å; F201-Y204 PolarHBondContact O-N 3.45Å; F201-F205 WeakPolarHBondContact O-CB 3.42Å; F201-F205 PolarHBondContact O-N 3.32Å; F201-I231 HydrophobicContact CB-CD1 3.95Å; F201-I231 HydrophobicContact CB-CG1 4.47Å
202	L	93.3	Very high	91	Very high	55 Å²	55	44.9 Å²	44.9	29%	0.288	23%	0.233	S	C	.	.	H	α-helix	trans	-63.8	-45.6	173.2	-179.6	67.6	0	0	0	111.5	N198 I199 F200 Y204 F205 F206 I231 F235	N198-L202 WeakPolarHBondContact O-CB 3.22Å; N198-L202 PolarHBondContact O-N 3.29Å; I199-L202 WeakPolarHBondContact O-CB 3.26Å; I199-L202 PolarHBondContact O-N 2.91Å; F200-L202 VanDerWaalsContact C-N 3.27Å; F200-L202 PolarHBondContact O-N 2.97Å; L202-Y204 VanDerWaalsContact C-N 3.33Å; L202-F205 WeakPolarHBondContact O-CB 3.38Å; L202-F205 PolarHBondContact O-N 2.8Å; L202-F206 HydrophobicContact CD1-CD2 4.27Å; L202-F206 HydrophobicContact CD1-CE2 3.61Å; L202-F206 HydrophobicContact CD1-CZ 4.28Å; L202-F206 HydrophobicContact CD2-CE2 4.48Å; L202-F206 HydrophobicContact CG-CD2 4.21Å; L202-F206 HydrophobicContact CG-CE2 3.81Å; L202-F206 WeakPolarHBondContact O-CD2 3.36Å; L202-F206 PolarHBondContact O-N 3.2Å; L202-F206 VanDerWaalsContact O-N 3.15Å; L202-I231 HydrophobicContact CB-CD1 4.4Å; L202-I231 HydrophobicContact CB-CG2 4.26Å; L202-I231 HydrophobicContact CD1-CG2 4.19Å; L202-F235 HydrophobicContact CD2-CE2 4.32Å; L202-F235 HydrophobicContact CD2-CZ 4.22Å
203	V	93.1	Very high	90.8	Very high	81 Å²	81	46.5 Å²	46.5	49%	0.491	25%	0.249	S	C	.	.	H	α-helix	trans	-61.9	-45.1	174.8	176.2	0	0	0	0	110.1	I199 F200 F205 F206 I207	I199-V203 PolarHBondContact O-N 2.8Å; F200-V203 PolarHBondContact O-N 3.49Å; V203-F205 VanDerWaalsContact C-N 3.34Å; V203-F205 PolarHBondContact O-N 3.1Å; V203-F206 PolarHBondContact O-N 2.66Å; V203-I207 HydrophobicContact CG1-CD1 4.03Å; V203-I207 WeakPolarHBondContact O-CG1 3.25Å; V203-I207 PolarHBondContact O-N 3.41Å
204	Y	91.1	Very high	90.7	Very high	36 Å²	36	44.5 Å²	44.5	14%	0.141	24%	0.24	C	C	.	.	H	α-helix	trans	-61.6	-40.2	178	-173.6	-113.9	0	0	0	112.6	L153 V157 F200 F201 L202 F206 I207 R208	L153-Y204 HydrophobicContact CD1-CD2 4.45Å; L153-Y204 HydrophobicContact CD2-CD2 4.18Å; L153-Y204 HydrophobicContact CD2-CE2 4.17Å; L153-Y204 HydrophobicContact CG-CD2 4.35Å; L153-Y204 HydrophobicContact CG-CE2 4.38Å; V157-Y204 HydrophobicContact CG1-CD1 4.36Å; V157-Y204 HydrophobicContact CG1-CE1 3.92Å; V157-Y204 HydrophobicContact CG2-CD1 4.15Å; V157-Y204 HydrophobicContact CG2-CD2 3.6Å; V157-Y204 HydrophobicContact CG2-CE1 4.1Å; V157-Y204 HydrophobicContact CG2-CE2 3.57Å; V157-Y204 HydrophobicContact CG2-CG 3.9Å; F200-Y204 PolarHBondContact O-N 2.69Å; F201-Y204 PolarHBondContact O-N 3.45Å; L202-Y204 VanDerWaalsContact C-N 3.33Å; Y204-F206 PolarHBondContact O-N 3.04Å; Y204-I207 PolarHBondContact O-N 3.14Å; Y204-R208 HydrophobicContact CD1-CG 4.42Å; Y204-R208 VanDerWaalsContact CE1-CD 3.45Å; Y204-R208 HydrophobicContact CE1-CG 4.05Å; Y204-R208 HydrophobicContact CE2-CG 4.33Å; Y204-R208 WeakPolarHBondContact O-CG 3.25Å; Y204-R208 PolarHBondContact O-N 3.38Å
205	F	92	Very high	90.7	Very high	20 Å²	20	47.3 Å²	47.3	9%	0.088	25%	0.252	C	S	.	.	H	α-helix	trans	-57.3	-45.7	173.5	172.3	-91.7	0	0	0	111.7	F201 L202 V203 R208 F209 F218 L219 D227 Y228	F201-F205 WeakPolarHBondContact O-CB 3.42Å; F201-F205 PolarHBondContact O-N 3.32Å; L202-F205 WeakPolarHBondContact O-CB 3.38Å; L202-F205 PolarHBondContact O-N 2.8Å; V203-F205 VanDerWaalsContact C-N 3.34Å; V203-F205 PolarHBondContact O-N 3.1Å; F205-R208 PolarHBondContact O-N 3.24Å; F205-F209 WeakPolarHBondContact O-CB 3.5Å; F205-F209 PolarHBondContact O-N 3.26Å; F205-F218 HydrophobicContact CD2-CE1 4.26Å; F205-F218 HydrophobicContact CD2-CZ 4.09Å; F205-F218 AromaticContact CE2-CE1 3.68Å; F205-F218 HydrophobicContact CE2-CE1 3.68Å; F205-F218 AromaticContact CE2-CZ 3.95Å; F205-F218 HydrophobicContact CE2-CZ 3.95Å; F205-F218 AromaticContact CZ-CE1 3.87Å; F205-F218 HydrophobicContact CZ-CE1 3.87Å; F205-F218 HydrophobicContact CZ-CZ 4.5Å; F205-L219 HydrophobicContact CZ-CD2 4.24Å; F205-D227 HydrophobicContact CD2-CB 4.12Å; F205-Y228 HydrophobicContact CE2-CE1 4.43Å; F205-Y228 HydrophobicContact CZ-CE1 4.18Å
206	F	92.7	Very high	90.7	Very high	110 Å²	110	47.1 Å²	47.1	48%	0.482	25%	0.252	S	S	.	.	H	α-helix	trans	-67.6	-37.4	178.3	-74.3	-60.4	0	0	0	113.2	L202 V203 Y204 R208 F209 I210	L202-F206 HydrophobicContact CD1-CD2 4.27Å; L202-F206 HydrophobicContact CD1-CE2 3.61Å; L202-F206 HydrophobicContact CD1-CZ 4.28Å; L202-F206 HydrophobicContact CD2-CE2 4.48Å; L202-F206 HydrophobicContact CG-CD2 4.21Å; L202-F206 HydrophobicContact CG-CE2 3.81Å; L202-F206 WeakPolarHBondContact O-CD2 3.36Å; L202-F206 PolarHBondContact O-N 3.2Å; L202-F206 VanDerWaalsContact O-N 3.15Å; V203-F206 PolarHBondContact O-N 2.66Å; Y204-F206 PolarHBondContact O-N 3.04Å; F206-R208 VanDerWaalsContact C-N 3.35Å; F206-F209 PolarHBondContact O-N 2.71Å; F206-I210 VanDerWaalsContact O-CG1 3.32Å; F206-I210 WeakPolarHBondContact O-CG1 3.36Å; F206-I210 PolarHBondContact O-N 3.4Å
207	I	91.4	Very high	90.5	Very high	20 Å²	20	49.8 Å²	49.8	10%	0.103	25%	0.25	C	C	.	.	H	α-helix	trans	-60.6	-47.1	173.9	-64.6	168	0	0	0	109.7	A139 I143 L153 V203 Y204 F209 I210 A211	A139-I207 HydrophobicContact CB-CG2 4.26Å; I143-I207 HydrophobicContact CD1-CG2 4.1Å; I143-I207 HydrophobicContact CG1-CG2 3.95Å; L153-I207 HydrophobicContact CD2-CD1 4.35Å; V203-I207 HydrophobicContact CG1-CD1 4.03Å; V203-I207 WeakPolarHBondContact O-CG1 3.25Å; V203-I207 PolarHBondContact O-N 3.41Å; Y204-I207 PolarHBondContact O-N 3.14Å; I207-F209 VanDerWaalsContact C-N 3.35Å; I207-F209 PolarHBondContact O-N 2.85Å; I207-I210 PolarHBondContact O-N 2.87Å; I207-A211 PolarHBondContact O-N 2.99Å; I207-A211 VanDerWaalsContact O-N 3.1Å
208	R	89.8	Confident	90.3	Very high	25 Å²	25	48.3 Å²	48.3	9%	0.094	24%	0.244	C	C	.	.	H	α-helix	trans	-61.7	-41.2	175.1	-65.6	-168.3	-66.6	125.7	-2.7	112.6	I143 Y204 F205 F206 I210 A211 A212 F218 D227	I143-R208 HydrophobicContact CD1-CB 4.27Å; I143-R208 HydrophobicContact CD1-CG 3.98Å; I143-R208 HydrophobicContact CG1-CG 4.37Å; Y204-R208 HydrophobicContact CD1-CG 4.42Å; Y204-R208 VanDerWaalsContact CE1-CD 3.45Å; Y204-R208 HydrophobicContact CE1-CG 4.05Å; Y204-R208 HydrophobicContact CE2-CG 4.33Å; Y204-R208 WeakPolarHBondContact O-CG 3.25Å; Y204-R208 PolarHBondContact O-N 3.38Å; F205-R208 PolarHBondContact O-N 3.24Å; F206-R208 VanDerWaalsContact C-N 3.35Å; R208-I210 PolarHBondContact O-N 3.44Å; R208-A211 PolarHBondContact O-N 3.06Å; R208-A212 PolarHBondContact O-N 3.21Å; R208-F218 HydrophobicContact CB-CE2 3.53Å; R208-F218 HydrophobicContact CB-CZ 3.77Å; R208-D227 IonicContact CZ-OD2 2.64Å; R208-D227 IonicContact NH2-OD2 3.24Å; R208-D227 PolarHBondContact NH2-OD2 2.74Å
209	F	91.5	Very high	90.1	Very high	58 Å²	58	48.5 Å²	48.5	25%	0.254	24%	0.244	S	C	.	.	H	α-helix	trans	-60.7	-42.2	175.9	-180	-99.3	0	0	0	111.9	V61 F205 F206 I207 K215 F218 L219	V61-F209 HydrophobicContact CG2-CE2 4.45Å; V61-F209 HydrophobicContact CG2-CZ 4.42Å; F205-F209 WeakPolarHBondContact O-CB 3.5Å; F205-F209 PolarHBondContact O-N 3.26Å; F206-F209 PolarHBondContact O-N 2.71Å; I207-F209 VanDerWaalsContact C-N 3.35Å; I207-F209 PolarHBondContact O-N 2.85Å; F209-K215 HydrophobicContact CD2-CD 4.47Å; F209-K215 HydrophobicContact CE1-CD 4.47Å; F209-K215 HydrophobicContact CE2-CB 4.09Å; F209-K215 HydrophobicContact CE2-CD 4.07Å; F209-K215 HydrophobicContact CE2-CG 4.38Å; F209-K215 HydrophobicContact CZ-CB 4.36Å; F209-K215 HydrophobicContact CZ-CD 4.07Å; F209-K215 HydrophobicContact CZ-CG 4.28Å; F209-K215 PolarHBondContact O-NZ 3.49Å; F209-F218 HydrophobicContact CB-CD1 4.2Å; F209-F218 HydrophobicContact CB-CE1 3.62Å; F209-F218 HydrophobicContact CB-CZ 4.08Å; F209-F218 AromaticContact CD2-CD1 3.57Å; F209-F218 HydrophobicContact CD2-CD1 3.57Å; F209-F218 AromaticContact CD2-CE1 3.7Å; F209-F218 HydrophobicContact CD2-CE1 3.7Å; F209-F218 HydrophobicContact CE2-CD1 4.47Å; F209-F218 HydrophobicContact CG-CD1 4.36Å; F209-F218 HydrophobicContact CG-CE1 4.17Å; F209-L219 HydrophobicContact CD2-CD2 4.2Å; F209-L219 HydrophobicContact CE2-CD2 4.11Å; F209-L219 HydrophobicContact CE2-CG 4.5Å
210	I	90.7	Very high	89.9	Confident	68 Å²	68	48.3 Å²	48.3	35%	0.349	24%	0.244	S	C	.	.	H	α-helix	trans	-65.7	-45.4	179	-68.9	165.9	0	0	0	110.8	A135 A139 F206 I207 R208 A212 K215	A135-I210 HydrophobicContact CB-CG2 4.37Å; A135-I210 WeakPolarHBondContact O-CG2 3.33Å; A139-I210 HydrophobicContact CB-CB 4.09Å; A139-I210 HydrophobicContact CB-CG2 3.78Å; F206-I210 VanDerWaalsContact O-CG1 3.32Å; F206-I210 WeakPolarHBondContact O-CG1 3.36Å; F206-I210 PolarHBondContact O-N 3.4Å; I207-I210 PolarHBondContact O-N 2.87Å; R208-I210 PolarHBondContact O-N 3.44Å; I210-A212 VanDerWaalsContact C-N 3.32Å; I210-A212 PolarHBondContact O-N 2.85Å; I210-K215 PolarHBondContact O-NZ 2.57Å
211	A	87.9	Confident	89.5	Confident	20 Å²	20	50.1 Å²	50.1	17%	0.165	25%	0.253	C	S	.	.	H	α-helix	trans	-67	-29.2	-179.3	0	0	0	0	0	114	A139 I143 I207 R208 T213	A139-A211 HydrophobicContact CB-CB 3.86Å; I143-A211 HydrophobicContact CD1-CB 3.29Å; I207-A211 PolarHBondContact O-N 2.99Å; I207-A211 VanDerWaalsContact O-N 3.1Å; R208-A211 PolarHBondContact O-N 3.06Å; A211-T213 PolarHBondContact O-N 2.88Å
212	A	86.9	Confident	88.9	Confident	19 Å²	19	53.9 Å²	53.9	16%	0.157	28%	0.276	C	S	.	.			trans	-57.6	133.8	-176.6	0	0	0	0	0	112.9	R208 I210 K215 F218	R208-A212 PolarHBondContact O-N 3.21Å; I210-A212 VanDerWaalsContact C-N 3.32Å; I210-A212 PolarHBondContact O-N 2.85Å; A212-K215 HydrophobicContact CB-CD 4.43Å; A212-K215 PolarHBondContact O-NZ 3.21Å; A212-F218 HydrophobicContact CB-CB 3.66Å; A212-F218 HydrophobicContact CB-CD2 3.97Å; A212-F218 HydrophobicContact CB-CG 3.86Å
213	T	85.9	Confident	88.4	Confident	125 Å²	125	54.4 Å²	54.4	77%	0.767	28%	0.275	S	S	*	.	S	Bend	trans	-73.6	-46	177	50.2	0	0	0	0	111.8	A211	A211-T213 PolarHBondContact O-N 2.88Å
214	D	87.6	Confident	88.2	Confident	44 Å²	44	50.6 Å²	50.6	24%	0.235	25%	0.251	C	S	.	.			trans	-109.8	113.7	172.8	-167.8	-33.1	0	0	0	110.3	R65 V216 W217 F218	R65-D214 IonicContact NH1-OD1 3.67Å; R65-D214 IonicContact NH1-OD2 3.53Å; D214-V216 VanDerWaalsContact C-N 3.34Å; D214-V216 PolarHBondContact O-N 2.88Å; D214-V216 WeakPolarHBondContact OD1-CB 3.29Å; D214-V216 PolarHBondContact OD1-N 3.4Å; D214-W217 HydrophobicContact CB-CB 4.16Å; D214-W217 HydrophobicContact CB-CG 4.48Å; D214-W217 PolarHBondContact OD1-N 3.26Å; D214-W217 VanDerWaalsContact OD2-CD1 3.28Å; D214-F218 WeakPolarHBondContact O-CB 3.3Å; D214-F218 PolarHBondContact O-N 2.89Å; D214-F218 VanDerWaalsContact O-N 3.1Å
215	K	88.3	Confident	88.1	Confident	61 Å²	61	51.8 Å²	51.8	27%	0.265	26%	0.258	S	S	.	.	H	α-helix	trans	-69.2	-30.8	-178.3	-53.5	-53.1	-174.8	-165.9	0	112.4	V61 F209 I210 A212 L219	V61-K215 HydrophobicContact CG1-CB 3.8Å; V61-K215 HydrophobicContact CG2-CB 4.45Å; F209-K215 HydrophobicContact CD2-CD 4.47Å; F209-K215 HydrophobicContact CE1-CD 4.47Å; F209-K215 HydrophobicContact CE2-CB 4.09Å; F209-K215 HydrophobicContact CE2-CD 4.07Å; F209-K215 HydrophobicContact CE2-CG 4.38Å; F209-K215 HydrophobicContact CZ-CB 4.36Å; F209-K215 HydrophobicContact CZ-CD 4.07Å; F209-K215 HydrophobicContact CZ-CG 4.28Å; F209-K215 PolarHBondContact O-NZ 3.49Å; I210-K215 PolarHBondContact O-NZ 2.57Å; A212-K215 HydrophobicContact CB-CD 4.43Å; A212-K215 PolarHBondContact O-NZ 3.21Å; K215-L219 VanDerWaalsContact O-CG 3.24Å; K215-L219 WeakPolarHBondContact O-CG 3.46Å; K215-L219 PolarHBondContact O-N 2.93Å
216	V	87.5	Confident	87.9	Confident	27 Å²	27	51 Å²	51	16%	0.164	25%	0.254	C	S	.	.	H	α-helix	trans	-71.2	-46	179.8	177.4	0	0	0	0	110	V61 D214 F218 L219 L220	V61-V216 HydrophobicContact CG1-CG2 3.61Å; D214-V216 VanDerWaalsContact C-N 3.34Å; D214-V216 PolarHBondContact O-N 2.88Å; D214-V216 WeakPolarHBondContact OD1-CB 3.29Å; D214-V216 PolarHBondContact OD1-N 3.4Å; V216-F218 VanDerWaalsContact C-N 3.35Å; V216-F218 PolarHBondContact O-N 3.31Å; V216-L219 PolarHBondContact O-N 2.82Å; V216-L220 PolarHBondContact O-N 3.37Å
217	W	87	Confident	87.8	Confident	112 Å²	112	46.1 Å²	46.1	42%	0.424	23%	0.233	S	C	.	.	H	α-helix	trans	-63	-42.3	177.4	-81.6	113.5	0	0	0	112	D214 L219 L220 E221 T289	D214-W217 HydrophobicContact CB-CB 4.16Å; D214-W217 HydrophobicContact CB-CG 4.48Å; D214-W217 PolarHBondContact OD1-N 3.26Å; D214-W217 VanDerWaalsContact OD2-CD1 3.28Å; W217-L219 VanDerWaalsContact C-N 3.3Å; W217-L219 PolarHBondContact O-N 3.07Å; W217-L220 CarbonylContact O-C 3.55Å; W217-L220 WeakPolarHBondContact O-CA 3.32Å; W217-L220 PolarHBondContact O-N 3.05Å; W217-E221 PolarHBondContact O-N 2.86Å; W217-E221 VanDerWaalsContact O-N 3.11Å; W217-T289 HydrophobicContact CH2-CG2 3.93Å; W217-T289 HydrophobicContact CZ2-CG2 4.44Å
218	F	88.3	Confident	87.8	Confident	4 Å²	4	45.7 Å²	45.7	2%	0.018	23%	0.23	C	C	.	.	H	α-helix	trans	-56.1	-43.6	176.1	172.4	-96	0	0	0	112.9	F205 R208 F209 A212 D214 V216 L220 E221 S224	F205-F218 HydrophobicContact CD2-CE1 4.26Å; F205-F218 HydrophobicContact CD2-CZ 4.09Å; F205-F218 AromaticContact CE2-CE1 3.68Å; F205-F218 HydrophobicContact CE2-CE1 3.68Å; F205-F218 AromaticContact CE2-CZ 3.95Å; F205-F218 HydrophobicContact CE2-CZ 3.95Å; F205-F218 AromaticContact CZ-CE1 3.87Å; F205-F218 HydrophobicContact CZ-CE1 3.87Å; F205-F218 HydrophobicContact CZ-CZ 4.5Å; R208-F218 HydrophobicContact CB-CE2 3.53Å; R208-F218 HydrophobicContact CB-CZ 3.77Å; F209-F218 HydrophobicContact CB-CD1 4.2Å; F209-F218 HydrophobicContact CB-CE1 3.62Å; F209-F218 HydrophobicContact CB-CZ 4.08Å; F209-F218 AromaticContact CD2-CD1 3.57Å; F209-F218 HydrophobicContact CD2-CD1 3.57Å; F209-F218 AromaticContact CD2-CE1 3.7Å; F209-F218 HydrophobicContact CD2-CE1 3.7Å; F209-F218 HydrophobicContact CE2-CD1 4.47Å; F209-F218 HydrophobicContact CG-CD1 4.36Å; F209-F218 HydrophobicContact CG-CE1 4.17Å; A212-F218 HydrophobicContact CB-CB 3.66Å; A212-F218 HydrophobicContact CB-CD2 3.97Å; A212-F218 HydrophobicContact CB-CG 3.86Å; D214-F218 WeakPolarHBondContact O-CB 3.3Å; D214-F218 PolarHBondContact O-N 2.89Å; D214-F218 VanDerWaalsContact O-N 3.1Å; V216-F218 VanDerWaalsContact C-N 3.35Å; V216-F218 PolarHBondContact O-N 3.31Å; F218-L220 PolarHBondContact O-N 2.86Å; F218-E221 WeakPolarHBondContact O-CB 3.47Å; F218-E221 PolarHBondContact O-N 2.99Å; F218-E221 VanDerWaalsContact O-N 3.15Å; F218-S224 WeakPolarHBondContact O-CB 3.26Å; F218-S224 PolarHBondContact O-OG 3.14Å
219	L	88.5	Confident	87.9	Confident	3 Å²	3	47.9 Å²	47.9	2%	0.016	24%	0.241	C	C	.	.	H	α-helix	trans	-69.3	-18.9	178.7	-61.3	172.1	0	0	0	112.4	M58 V61 F205 F209 K215 V216 W217 Y228	M58-L219 HydrophobicContact CE-CB 3.22Å; M58-L219 HydrophobicContact CE-CD1 4.12Å; M58-L219 HydrophobicContact CE-CG 4.33Å; M58-L219 HydrophobicContact SD-CB 4.2Å; M58-L219 HydrophobicContact SD-CD1 4Å; V61-L219 HydrophobicContact CB-CD1 4.04Å; V61-L219 HydrophobicContact CG2-CD1 3.63Å; F205-L219 HydrophobicContact CZ-CD2 4.24Å; F209-L219 HydrophobicContact CD2-CD2 4.2Å; F209-L219 HydrophobicContact CE2-CD2 4.11Å; F209-L219 HydrophobicContact CE2-CG 4.5Å; K215-L219 VanDerWaalsContact O-CG 3.24Å; K215-L219 WeakPolarHBondContact O-CG 3.46Å; K215-L219 PolarHBondContact O-N 2.93Å; V216-L219 PolarHBondContact O-N 2.82Å; W217-L219 VanDerWaalsContact C-N 3.3Å; W217-L219 PolarHBondContact O-N 3.07Å; L219-Y228 WeakPolarHBondContact CD2-OH 3.25Å
220	L	87.9	Confident	87.8	Confident	79 Å²	79	45.2 Å²	45.2	41%	0.414	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-0.6	173.3	-67.5	175.6	0	0	0	113.7	F54 M58 V216 W217 F218 F225	F54-L220 HydrophobicContact CE2-CD2 4.34Å; F54-L220 HydrophobicContact CZ-CD2 4.23Å; M58-L220 HydrophobicContact CE-CD1 4.5Å; M58-L220 HydrophobicContact CE-CD2 3.54Å; M58-L220 HydrophobicContact CE-CG 3.54Å; V216-L220 PolarHBondContact O-N 3.37Å; W217-L220 CarbonylContact O-C 3.55Å; W217-L220 WeakPolarHBondContact O-CA 3.32Å; W217-L220 PolarHBondContact O-N 3.05Å; F218-L220 PolarHBondContact O-N 2.86Å; L220-F225 HydrophobicContact CD2-CZ 4.29Å; L220-F225 WeakPolarHBondContact O-CE2 3.1Å
221	E	85.1	Confident	87.9	Confident	84 Å²	84	42.4 Å²	42.4	39%	0.393	22%	0.215	S	C	.	.	S	Bend	trans	-68.2	145.4	176.2	-73.4	179.2	-176	0	0	111.7	W217 F218 Y223 S224 F225	W217-E221 PolarHBondContact O-N 2.86Å; W217-E221 VanDerWaalsContact O-N 3.11Å; F218-E221 WeakPolarHBondContact O-CB 3.47Å; F218-E221 PolarHBondContact O-N 2.99Å; F218-E221 VanDerWaalsContact O-N 3.15Å; E221-Y223 PolarHBondContact O-N 2.93Å; E221-S224 WeakPolarHBondContact O-CB 3.15Å; E221-S224 PolarHBondContact O-N 2.87Å; E221-F225 WeakPolarHBondContact O-CD2 3.08Å; E221-F225 PolarHBondContact O-N 2.92Å; E221-F225 VanDerWaalsContact O-N 3.13Å
222	V	80.9	Confident	88.1	Confident	81 Å²	81	42.4 Å²	42.4	49%	0.491	21%	0.213	S	C	.	.	H	α-helix	trans	-54.8	-40.3	179.3	178.4	0	0	0	0	111.7	S224 F225 V226 L253	V222-S224 VanDerWaalsContact C-N 3.33Å; V222-S224 PolarHBondContact O-N 2.91Å; V222-F225 WeakPolarHBondContact O-CB 3.21Å; V222-F225 PolarHBondContact O-N 3.33Å; V222-V226 WeakPolarHBondContact O-CG2 3.25Å; V222-V226 PolarHBondContact O-N 2.8Å; V222-V226 VanDerWaalsContact O-N 3.08Å; V222-L253 HydrophobicContact CG1-CD1 4.34Å
223	Y	82.9	Confident	88.2	Confident	66 Å²	66	42.1 Å²	42.1	26%	0.259	21%	0.21	S	C	.	.	H	α-helix	trans	-66.7	-34.1	179.4	-54.4	-56.8	0	0	0	112.9	E221 V226 D227 M256 T257	E221-Y223 PolarHBondContact O-N 2.93Å; Y223-V226 PolarHBondContact O-N 2.81Å; Y223-D227 PolarHBondContact O-N 3.02Å; Y223-M256 HydrophobicContact CE1-CB 4.3Å; Y223-T257 HydrophobicContact CD1-CG2 3.82Å; Y223-T257 HydrophobicContact CE1-CG2 3.28Å; Y223-T257 HydrophobicContact CE2-CG2 4.25Å; Y223-T257 HydrophobicContact CG-CG2 4.49Å
224	S	87.9	Confident	88.3	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-67.7	-38.5	174.5	-59	0	0	0	0	110.7	F218 E221 V222 V226 D227 Y228	F218-S224 WeakPolarHBondContact O-CB 3.26Å; F218-S224 PolarHBondContact O-OG 3.14Å; E221-S224 WeakPolarHBondContact O-CB 3.15Å; E221-S224 PolarHBondContact O-N 2.87Å; V222-S224 VanDerWaalsContact C-N 3.33Å; V222-S224 PolarHBondContact O-N 2.91Å; S224-V226 PolarHBondContact O-N 2.77Å; S224-D227 PolarHBondContact O-N 3Å; S224-Y228 WeakPolarHBondContact O-CD2 3.16Å; S224-Y228 PolarHBondContact O-N 2.79Å
225	F	88.8	Confident	88.4	Confident	62 Å²	62	38.2 Å²	38.2	27%	0.272	18%	0.181	S	C	.	.	H	α-helix	trans	-60.8	-42	171.7	-79	-68.7	0	0	0	113.3	F54 L220 E221 V222 D227 Y228 F229	F54-F225 AromaticContact CD2-CE1 3.97Å; F54-F225 HydrophobicContact CD2-CE1 3.97Å; F54-F225 HydrophobicContact CD2-CZ 4.49Å; F54-F225 AromaticContact CE2-CE1 3.69Å; F54-F225 HydrophobicContact CE2-CE1 3.69Å; F54-F225 AromaticContact CE2-CZ 3.78Å; F54-F225 HydrophobicContact CE2-CZ 3.78Å; F54-F225 HydrophobicContact CZ-CE1 4.12Å; F54-F225 HydrophobicContact CZ-CZ 4.1Å; L220-F225 HydrophobicContact CD2-CZ 4.29Å; L220-F225 WeakPolarHBondContact O-CE2 3.1Å; E221-F225 WeakPolarHBondContact O-CD2 3.08Å; E221-F225 PolarHBondContact O-N 2.92Å; E221-F225 VanDerWaalsContact O-N 3.13Å; V222-F225 WeakPolarHBondContact O-CB 3.21Å; V222-F225 PolarHBondContact O-N 3.33Å; F225-D227 VanDerWaalsContact C-N 3.26Å; F225-D227 PolarHBondContact O-N 3.15Å; F225-Y228 HydrophobicContact CD1-CD2 4.37Å; F225-Y228 PolarHBondContact O-N 3.3Å; F225-F229 HydrophobicContact CB-CD2 4.44Å; F225-F229 HydrophobicContact CB-CE2 4.04Å; F225-F229 HydrophobicContact CD1-CE2 4.26Å; F225-F229 HydrophobicContact CD1-CZ 4.19Å; F225-F229 WeakPolarHBondContact O-CD2 3.28Å; F225-F229 WeakPolarHBondContact O-CG 3.37Å; F225-F229 PolarHBondContact O-N 3.42Å
226	V	88.3	Confident	88.5	Confident	3 Å²	3	36.6 Å²	36.6	2%	0.018	18%	0.176	C	C	.	.	H	α-helix	trans	-58.6	-42	174.9	177.1	0	0	0	0	110.9	V222 Y223 S224 F229 T230 S250 L253 R254	V222-V226 WeakPolarHBondContact O-CG2 3.25Å; V222-V226 PolarHBondContact O-N 2.8Å; V222-V226 VanDerWaalsContact O-N 3.08Å; Y223-V226 PolarHBondContact O-N 2.81Å; S224-V226 PolarHBondContact O-N 2.77Å; V226-F229 PolarHBondContact O-N 3.44Å; V226-T230 HydrophobicContact CG1-CG2 4.33Å; V226-T230 WeakPolarHBondContact O-CB 3.45Å; V226-T230 VanDerWaalsContact O-CG2 3.29Å; V226-T230 WeakPolarHBondContact O-CG2 3.12Å; V226-T230 PolarHBondContact O-N 3.28Å; V226-T230 VanDerWaalsContact O-N 3.12Å; V226-T230 PolarHBondContact O-OG1 2.67Å; V226-S250 WeakPolarHBondContact CG1-O 3.39Å; V226-L253 HydrophobicContact CG2-CB 3.76Å; V226-L253 HydrophobicContact CG2-CD1 3.95Å; V226-L253 HydrophobicContact CG2-CG 4.46Å; V226-R254 HydrophobicContact CG1-CG 3.98Å
227	D	91.2	Very high	88.5	Confident	8 Å²	8	35.4 Å²	35.4	4%	0.043	17%	0.169	C	C	.	.	H	α-helix	trans	-68.8	-37.6	178.7	-72	-15.2	0	0	0	111.8	F205 R208 Y223 S224 F225 F229 T230 I231 P232 R254	F205-D227 HydrophobicContact CD2-CB 4.12Å; R208-D227 IonicContact CZ-OD2 2.64Å; R208-D227 IonicContact NH2-OD2 3.24Å; R208-D227 PolarHBondContact NH2-OD2 2.74Å; Y223-D227 PolarHBondContact O-N 3.02Å; S224-D227 PolarHBondContact O-N 3Å; F225-D227 VanDerWaalsContact C-N 3.26Å; F225-D227 PolarHBondContact O-N 3.15Å; D227-F229 VanDerWaalsContact C-N 3.35Å; D227-F229 PolarHBondContact O-N 3.28Å; D227-T230 PolarHBondContact O-N 3.18Å; D227-I231 HydrophobicContact CB-CD1 3.71Å; D227-I231 HydrophobicContact CB-CG1 4.4Å; D227-I231 VanDerWaalsContact O-CB 3.27Å; D227-I231 WeakPolarHBondContact O-CB 3.36Å; D227-I231 WeakPolarHBondContact O-CG1 3.38Å; D227-I231 PolarHBondContact O-N 2.65Å; D227-P232 WeakPolarHBondContact O-CD 3.32Å; D227-R254 IonicContact OD1-CZ 3.78Å; D227-R254 IonicContact OD1-NE 2.99Å; D227-R254 IonicContact OD1-NH2 2.68Å; D227-R254 PolarHBondContact OD1-NH2 3.42Å
228	Y	91.4	Very high	88.4	Confident	11 Å²	11	32.8 Å²	32.8	4%	0.043	16%	0.163	C	C	.	.	H	α-helix	trans	-64.2	-34.8	172.4	-65.2	-47.8	0	0	0	113.8	S50 T53 F54 S57 F205 L219 S224 F225 P232	S50-Y228 WeakPolarHBondContact CB-O 3.38Å; S50-Y228 PolarHBondContact OG-O 3.35Å; T53-Y228 HydrophobicContact CG2-CD1 4.01Å; T53-Y228 HydrophobicContact CG2-CE1 4.14Å; F54-Y228 HydrophobicContact CB-CD2 4.38Å; F54-Y228 HydrophobicContact CB-CG 4.49Å; F54-Y228 AromaticContact CD2-CD2 3.99Å; F54-Y228 HydrophobicContact CD2-CD2 3.99Å; F54-Y228 AromaticContact CD2-CE2 3.79Å; F54-Y228 HydrophobicContact CD2-CE2 3.79Å; S57-Y228 PolarHBondContact OG-OH 2.75Å; F205-Y228 HydrophobicContact CE2-CE1 4.43Å; F205-Y228 HydrophobicContact CZ-CE1 4.18Å; L219-Y228 WeakPolarHBondContact CD2-OH 3.25Å; S224-Y228 WeakPolarHBondContact O-CD2 3.16Å; S224-Y228 PolarHBondContact O-N 2.79Å; F225-Y228 HydrophobicContact CD1-CD2 4.37Å; F225-Y228 PolarHBondContact O-N 3.3Å; Y228-P232 VanDerWaalsContact O-CD 3.24Å; Y228-P232 WeakPolarHBondContact O-CD 3.21Å
229	F	90.4	Very high	88.3	Confident	70 Å²	70	42 Å²	42	31%	0.307	20%	0.199	S	C	.	.	H	α-helix	trans	-83.4	-14.3	-179.6	-64.2	-41.1	0	0	0	114	F225 V226 D227 L247	F225-F229 HydrophobicContact CB-CD2 4.44Å; F225-F229 HydrophobicContact CB-CE2 4.04Å; F225-F229 HydrophobicContact CD1-CE2 4.26Å; F225-F229 HydrophobicContact CD1-CZ 4.19Å; F225-F229 WeakPolarHBondContact O-CD2 3.28Å; F225-F229 WeakPolarHBondContact O-CG 3.37Å; F225-F229 PolarHBondContact O-N 3.42Å; V226-F229 PolarHBondContact O-N 3.44Å; D227-F229 VanDerWaalsContact C-N 3.35Å; D227-F229 PolarHBondContact O-N 3.28Å; F229-L247 HydrophobicContact CB-CB 4Å; F229-L247 HydrophobicContact CB-CD1 4.13Å; F229-L247 HydrophobicContact CD1-CD1 3.52Å; F229-L247 HydrophobicContact CE1-CD1 4.04Å; F229-L247 HydrophobicContact CG-CD1 3.83Å
230	T	90.1	Very high	88.2	Confident	3 Å²	3	43.9 Å²	43.9	2%	0.018	21%	0.209	C	C	.	.	H	α-helix	trans	-112	-41.6	-174.7	54.2	0	0	0	0	112.7	V226 D227 S250 R251 R254	V226-T230 HydrophobicContact CG1-CG2 4.33Å; V226-T230 WeakPolarHBondContact O-CB 3.45Å; V226-T230 VanDerWaalsContact O-CG2 3.29Å; V226-T230 WeakPolarHBondContact O-CG2 3.12Å; V226-T230 PolarHBondContact O-N 3.28Å; V226-T230 VanDerWaalsContact O-N 3.12Å; V226-T230 PolarHBondContact O-OG1 2.67Å; D227-T230 PolarHBondContact O-N 3.18Å; T230-S250 WeakPolarHBondContact CG2-OG 3.14Å; T230-R251 HydrophobicContact CG2-CG 3.65Å; T230-R254 PolarHBondContact OG1-NH2 3.04Å
231	I	92.1	Very high	88.1	Confident	9 Å²	9	46.2 Å²	46.2	5%	0.046	22%	0.217	C	C	.	.	H	α-helix	trans	-77.7	-59.6	-170.7	-57.8	174.2	0	0	0	112.4	F201 L202 D227 S234 F235	F201-I231 HydrophobicContact CB-CD1 3.95Å; F201-I231 HydrophobicContact CB-CG1 4.47Å; L202-I231 HydrophobicContact CB-CD1 4.4Å; L202-I231 HydrophobicContact CB-CG2 4.26Å; L202-I231 HydrophobicContact CD1-CG2 4.19Å; D227-I231 HydrophobicContact CB-CD1 3.71Å; D227-I231 HydrophobicContact CB-CG1 4.4Å; D227-I231 VanDerWaalsContact O-CB 3.27Å; D227-I231 WeakPolarHBondContact O-CB 3.36Å; D227-I231 WeakPolarHBondContact O-CG1 3.38Å; D227-I231 PolarHBondContact O-N 2.65Å; I231-S234 WeakPolarHBondContact O-CB 3.5Å; I231-S234 PolarHBondContact O-N 3.22Å; I231-S234 PolarHBondContact O-OG 3.3Å; I231-F235 HydrophobicContact CG2-CD2 4.1Å; I231-F235 HydrophobicContact CG2-CE2 3.59Å; I231-F235 WeakPolarHBondContact O-CD2 3.06Å; I231-F235 PolarHBondContact O-N 2.95Å
232	P	92.1	Very high	88	Confident	19 Å²	19	43.3 Å²	43.3	12%	0.123	20%	0.203	C	C	.	.	H	α-helix	trans	-55.5	-44	179.6	-19.6	29.1	0	0	0	114.4	T53 D227 Y228 S234 F235 V236	T53-P232 HydrophobicContact CG2-CG 4.16Å; D227-P232 WeakPolarHBondContact O-CD 3.32Å; Y228-P232 VanDerWaalsContact O-CD 3.24Å; Y228-P232 WeakPolarHBondContact O-CD 3.21Å; P232-S234 PolarHBondContact O-N 3.28Å; P232-F235 PolarHBondContact O-N 3.19Å; P232-F235 VanDerWaalsContact O-N 3.09Å; P232-V236 PolarHBondContact O-N 2.92Å
233	P	90.1	Very high	88.2	Confident	13 Å²	13	39.6 Å²	39.6	8%	0.084	18%	0.18	C	C	.	.	H	α-helix	trans	-60	-31.3	176.6	-29.6	40	0	0	0	113.9	F46 S50 F235 V236 A237	F46-P233 HydrophobicContact CB-CB 4.21Å; F46-P233 HydrophobicContact CD1-CB 4.07Å; F46-P233 WeakPolarHBondContact CD1-O 3.3Å; S50-P233 WeakPolarHBondContact OG-CD 3.43Å; S50-P233 VanDerWaalsContact OG-CG 3.26Å; S50-P233 WeakPolarHBondContact OG-CG 3.35Å; P233-F235 VanDerWaalsContact C-N 3.34Å; P233-V236 PolarHBondContact O-N 3.22Å; P233-A237 WeakPolarHBondContact O-CB 3.45Å; P233-A237 PolarHBondContact O-N 2.78Å
234	S	87.9	Confident	88.3	Confident	6 Å²	6	37.6 Å²	37.6	4%	0.042	17%	0.172	C	C	.	.	H	α-helix	trans	-67.3	-34.1	176.9	75.6	0	0	0	0	112.6	N198 I231 P232 A237	N198-S234 WeakPolarHBondContact ND2-CB 3.39Å; N198-S234 PolarHBondContact ND2-OG 2.94Å; I231-S234 WeakPolarHBondContact O-CB 3.5Å; I231-S234 PolarHBondContact O-N 3.22Å; I231-S234 PolarHBondContact O-OG 3.3Å; P232-S234 PolarHBondContact O-N 3.28Å; S234-A237 WeakPolarHBondContact O-CB 3.23Å
235	F	90.4	Very high	88.2	Confident	81 Å²	81	38.2 Å²	38.2	36%	0.355	18%	0.175	S	C	.	.	H	α-helix	trans	-74.3	-38.6	173.7	-70.2	-71.8	0	0	0	112	L195 I199 L202 I231 P232 P233 A237 I238 Y239	L195-F235 HydrophobicContact CD1-CD1 4.34Å; L195-F235 HydrophobicContact CD1-CE1 4.08Å; I199-F235 HydrophobicContact CG1-CZ 4.27Å; L202-F235 HydrophobicContact CD2-CE2 4.32Å; L202-F235 HydrophobicContact CD2-CZ 4.22Å; I231-F235 HydrophobicContact CG2-CD2 4.1Å; I231-F235 HydrophobicContact CG2-CE2 3.59Å; I231-F235 WeakPolarHBondContact O-CD2 3.06Å; I231-F235 PolarHBondContact O-N 2.95Å; P232-F235 PolarHBondContact O-N 3.19Å; P232-F235 VanDerWaalsContact O-N 3.09Å; P233-F235 VanDerWaalsContact C-N 3.34Å; F235-A237 PolarHBondContact O-N 3.2Å; F235-I238 HydrophobicContact CD1-CD1 4.41Å; F235-I238 WeakPolarHBondContact O-CB 3.46Å; F235-I238 PolarHBondContact O-N 3.4Å; F235-Y239 PolarHBondContact O-N 2.84Å; F235-Y239 VanDerWaalsContact O-N 3.15Å
236	V	89.7	Confident	87.9	Confident	28 Å²	28	35.3 Å²	35.3	17%	0.17	16%	0.163	C	C	.	.	H	α-helix	trans	-63.3	-34	173.9	175.4	0	0	0	0	111.4	C45 F46 P232 P233 I238 Y239 L240	C45-V236 HydrophobicContact CB-CG1 4.31Å; F46-V236 HydrophobicContact CD1-CB 4.08Å; F46-V236 HydrophobicContact CD1-CG1 3.91Å; F46-V236 HydrophobicContact CE1-CB 4.32Å; F46-V236 HydrophobicContact CE1-CG1 4.04Å; F46-V236 HydrophobicContact CG-CG1 4.26Å; F46-V236 HydrophobicContact CZ-CG1 4.48Å; P232-V236 PolarHBondContact O-N 2.92Å; P233-V236 PolarHBondContact O-N 3.22Å; V236-I238 PolarHBondContact O-N 3.32Å; V236-Y239 PolarHBondContact O-N 3.28Å; V236-Y239 VanDerWaalsContact O-N 3.16Å; V236-L240 HydrophobicContact CG1-CD1 3.57Å; V236-L240 HydrophobicContact CG1-CG 4.02Å; V236-L240 WeakPolarHBondContact O-CB 3.01Å; V236-L240 PolarHBondContact O-N 3.47Å
237	A	86.6	Confident	88	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.008	17%	0.169	C	C	.	.	H	α-helix	trans	-59.5	-35.3	175.9	0	0	0	0	0	112.8	F46 P233 S234 F235 E241 R242	F46-A237 HydrophobicContact CE1-CB 3.82Å; P233-A237 WeakPolarHBondContact O-CB 3.45Å; P233-A237 PolarHBondContact O-N 2.78Å; S234-A237 WeakPolarHBondContact O-CB 3.23Å; F235-A237 PolarHBondContact O-N 3.2Å; A237-E241 WeakPolarHBondContact O-CA 3.35Å; A237-E241 PolarHBondContact O-N 3.03Å; A237-R242 CarbonylContact C-O 3.59Å; A237-R242 WeakPolarHBondContact CA-O 3.35Å; A237-R242 WeakPolarHBondContact CB-O 3.37Å; A237-R242 PolarHBondContact O-N 2.69Å; A237-R242 VanDerWaalsContact O-N 3.1Å
238	I	85.8	Confident	87.9	Confident	58 Å²	58	37 Å²	37	30%	0.297	17%	0.17	S	C	.	.	H	α-helix	trans	-71.9	-47.6	175.3	-56	165.6	0	0	0	109.7	L185 L195 F235 V236 L240 E241	L185-I238 HydrophobicContact CD2-CG1 4.36Å; L185-I238 HydrophobicContact CD2-CG2 4.38Å; L195-I238 HydrophobicContact CD1-CD1 3.55Å; L195-I238 HydrophobicContact CD2-CD1 3.42Å; L195-I238 VanDerWaalsContact CD2-CD1 3.42Å; L195-I238 HydrophobicContact CD2-CG1 4.35Å; L195-I238 HydrophobicContact CG-CD1 4.05Å; F235-I238 HydrophobicContact CD1-CD1 4.41Å; F235-I238 WeakPolarHBondContact O-CB 3.46Å; F235-I238 PolarHBondContact O-N 3.4Å; V236-I238 PolarHBondContact O-N 3.32Å; I238-L240 VanDerWaalsContact C-N 3.31Å; I238-L240 PolarHBondContact O-N 2.85Å; I238-E241 PolarHBondContact O-N 2.95Å
239	Y	86.6	Confident	87.8	Confident	198 Å²	198	36.9 Å²	36.9	78%	0.776	17%	0.17	S	C	*	.	H	α-helix	trans	-63.2	-36.9	-176.4	-177.3	-100.8	0	0	0	113	F235 V236	F235-Y239 PolarHBondContact O-N 2.84Å; F235-Y239 VanDerWaalsContact O-N 3.15Å; V236-Y239 PolarHBondContact O-N 3.28Å; V236-Y239 VanDerWaalsContact O-N 3.16Å
240	L	86.3	Confident	87.6	Confident	42 Å²	42	33.8 Å²	33.8	22%	0.22	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-4.2	179.6	-65.2	179.1	0	0	0	113.7	K42 C45 F46 V236 I238 R242	K42-L240 HydrophobicContact CB-CD1 4.33Å; C45-L240 HydrophobicContact CB-CD1 3.69Å; F46-L240 HydrophobicContact CE2-CD1 4.22Å; F46-L240 HydrophobicContact CZ-CD1 4.34Å; V236-L240 HydrophobicContact CG1-CD1 3.57Å; V236-L240 HydrophobicContact CG1-CG 4.02Å; V236-L240 WeakPolarHBondContact O-CB 3.01Å; V236-L240 PolarHBondContact O-N 3.47Å; I238-L240 VanDerWaalsContact C-N 3.31Å; I238-L240 PolarHBondContact O-N 2.85Å; L240-R242 HydrophobicContact CB-CB 4.29Å; L240-R242 WeakPolarHBondContact O-CG 3.39Å; L240-R242 PolarHBondContact O-N 3.38Å
241	E	85.1	Confident	87.6	Confident	128 Å²	128	33.7 Å²	33.7	60%	0.598	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.3	39.4	-170.8	-60.2	-173.2	162	0	0	113	A237 I238	A237-E241 WeakPolarHBondContact O-CA 3.35Å; A237-E241 PolarHBondContact O-N 3.03Å; I238-E241 PolarHBondContact O-N 2.95Å
242	R	84.3	Confident	87.2	Confident	22 Å²	22	33.3 Å²	33.3	8%	0.083	16%	0.155	C	C	.	.			trans	-137.3	139.5	-175.6	-73.2	174.3	179.9	-150.6	1.2	110.3	C37 E40 F46 E180 C182 A237 L240	C37-R242 PolarHBondContact O-NH2 2.59Å; E40-R242 PolarHBondContact O-NH1 3.29Å; F46-R242 HydrophobicContact CZ-CB 4.21Å; F46-R242 WeakPolarHBondContact CZ-O 3.42Å; E180-R242 WeakPolarHBondContact OE1-CD 3.47Å; E180-R242 IonicContact OE1-CZ 3.14Å; E180-R242 IonicContact OE1-NH1 3.36Å; E180-R242 PolarHBondContact OE1-NH1 3.46Å; C182-R242 HydrophobicContact CB-CG 4.42Å; A237-R242 CarbonylContact C-O 3.59Å; A237-R242 WeakPolarHBondContact CA-O 3.35Å; A237-R242 WeakPolarHBondContact CB-O 3.37Å; A237-R242 PolarHBondContact O-N 2.69Å; A237-R242 VanDerWaalsContact O-N 3.1Å; L240-R242 HydrophobicContact CB-CB 4.29Å; L240-R242 WeakPolarHBondContact O-CG 3.39Å; L240-R242 PolarHBondContact O-N 3.38Å
243	N	83.5	Confident	86.9	Confident	4 Å²	4	34 Å²	34	2%	0.021	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	139.7	174.9	-161.9	2.9	0	0	0	110.4	F177 E180 T181 R248	F177-N243 HydrophobicContact CE2-CB 4.15Å; F177-N243 VanDerWaalsContact CE2-ND2 3.3Å; F177-N243 WeakPolarHBondContact CE2-ND2 3.47Å; F177-N243 HydrophobicContact CZ-CB 4.03Å; F177-N243 WeakPolarHBondContact CZ-ND2 3.25Å; E180-N243 CarbonylContact C-O 3.46Å; E180-N243 VanDerWaalsContact CA-O 3.32Å; E180-N243 WeakPolarHBondContact CA-O 3.41Å; T181-N243 PolarHBondContact N-O 3.41Å; T181-N243 PolarHBondContact O-N 3.14Å; N243-R248 PolarHBondContact OD1-NH2 2.66Å
244	W	86.5	Confident	86.5	Confident	23 Å²	23	34 Å²	34	9%	0.087	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	125.8	179.9	179.7	59.3	0	0	0	109.5	F46 L47 V179 G246 R248	F46-W244 HydrophobicContact CB-CD2 4.07Å; F46-W244 HydrophobicContact CB-CE3 3.24Å; F46-W244 HydrophobicContact CB-CZ3 3.54Å; F46-W244 HydrophobicContact CD1-CB 4.18Å; F46-W244 HydrophobicContact CD1-CE3 4.3Å; F46-W244 HydrophobicContact CD2-CB 3.91Å; F46-W244 HydrophobicContact CD2-CD2 4.29Å; F46-W244 HydrophobicContact CD2-CE3 4.25Å; F46-W244 HydrophobicContact CD2-CG 4.19Å; F46-W244 HydrophobicContact CE1-CB 4.11Å; F46-W244 HydrophobicContact CE2-CB 3.85Å; F46-W244 HydrophobicContact CG-CB 4.07Å; F46-W244 HydrophobicContact CG-CD2 4.18Å; F46-W244 AromaticContact CG-CE3 3.71Å; F46-W244 HydrophobicContact CG-CE3 3.71Å; F46-W244 HydrophobicContact CG-CG 4.38Å; F46-W244 HydrophobicContact CG-CZ3 4.47Å; F46-W244 HydrophobicContact CZ-CB 3.95Å; L47-W244 HydrophobicContact CB-CH2 4.34Å; V179-W244 WeakPolarHBondContact O-CA 3.49Å; W244-G246 VanDerWaalsContact CD2-CA 3.49Å; W244-R248 PolarHBondContact O-NE 3.32Å
245	L	84.5	Confident	85.8	Confident	13 Å²	13	35.1 Å²	35.1	7%	0.068	16%	0.161	C	C	.	.			trans	-67.6	-44.8	-179.9	-165.4	65.8	0	0	0	111.1	Y168 D171 A172 F177 V179 L247 R248	Y168-L245 HydrophobicContact CD2-CD1 3.87Å; Y168-L245 HydrophobicContact CE2-CD1 3.74Å; Y168-L245 HydrophobicContact CE2-CD2 4.36Å; Y168-L245 HydrophobicContact CE2-CG 4Å; D171-L245 HydrophobicContact CB-CD1 4.3Å; A172-L245 HydrophobicContact CB-CD1 4.29Å; A172-L245 HydrophobicContact CB-CD2 4.19Å; F177-L245 HydrophobicContact CD1-CD1 4.35Å; F177-L245 HydrophobicContact CE1-CB 3.99Å; F177-L245 HydrophobicContact CE1-CD1 3.93Å; F177-L245 HydrophobicContact CE1-CG 4.48Å; V179-L245 PolarHBondContact O-N 2.74Å; L245-L247 PolarHBondContact O-N 3.27Å; L245-R248 WeakPolarHBondContact O-CB 3.29Å; L245-R248 WeakPolarHBondContact O-CG 3.29Å; L245-R248 PolarHBondContact O-N 2.73Å
246	G	83.7	Confident	85	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.01	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	38.2	-127.4	170.4	0	0	0	0	0	116.1	W244 R248 F249	W244-G246 VanDerWaalsContact CD2-CA 3.49Å; G246-R248 VanDerWaalsContact C-N 3.28Å; G246-R248 PolarHBondContact O-N 2.66Å; G246-F249 WeakPolarHBondContact O-CD1 3.42Å; G246-F249 WeakPolarHBondContact O-CE1 3.37Å
247	L	89	Confident	84.2	Confident	30 Å²	30	33.5 Å²	33.5	16%	0.157	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-87.8	17.6	-178.6	-59.1	177	0	0	0	113.3	L47 F229 L245 F249 S250 L348	L47-L247 HydrophobicContact CD1-CD1 3.93Å; F229-L247 HydrophobicContact CB-CB 4Å; F229-L247 HydrophobicContact CB-CD1 4.13Å; F229-L247 HydrophobicContact CD1-CD1 3.52Å; F229-L247 HydrophobicContact CE1-CD1 4.04Å; F229-L247 HydrophobicContact CG-CD1 3.83Å; L245-L247 PolarHBondContact O-N 3.27Å; L247-F249 HydrophobicContact CD2-CE1 3.81Å; L247-F249 HydrophobicContact CD2-CZ 3.6Å; L247-F249 PolarHBondContact O-N 3.42Å; L247-S250 VanDerWaalsContact O-CB 3.31Å; L247-S250 WeakPolarHBondContact O-CB 3.33Å; L247-S250 PolarHBondContact O-N 3.47Å; L247-S250 PolarHBondContact O-OG 3.12Å; L247-L348 HydrophobicContact CD2-CD2 4.19Å
248	R	90.2	Very high	83.3	Confident	16 Å²	16	35.2 Å²	35.2	6%	0.06	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-61.2	-24.1	178.4	-70.8	-178.5	178	-145.2	-10.9	112.9	Y168 D171 D194 N243 W244 L245 G246 S250 R251	Y168-R248 HydrophobicContact CD2-CB 3.66Å; Y168-R248 HydrophobicContact CE2-CB 4.23Å; Y168-R248 HydrophobicContact CG-CB 4.48Å; D171-R248 IonicContact OD2-NH1 3.6Å; D171-R248 PolarHBondContact OD2-NH1 3.47Å; D194-R248 IonicContact OD2-CZ 2.73Å; D194-R248 IonicContact OD2-NH1 2.82Å; D194-R248 PolarHBondContact OD2-NH1 3.4Å; D194-R248 IonicContact OD2-NH2 3.84Å; D194-R248 PolarHBondContact OD2-NH2 3.34Å; N243-R248 PolarHBondContact OD1-NH2 2.66Å; W244-R248 PolarHBondContact O-NE 3.32Å; L245-R248 WeakPolarHBondContact O-CB 3.29Å; L245-R248 WeakPolarHBondContact O-CG 3.29Å; L245-R248 PolarHBondContact O-N 2.73Å; G246-R248 VanDerWaalsContact C-N 3.28Å; G246-R248 PolarHBondContact O-N 2.66Å; R248-S250 PolarHBondContact O-N 3.28Å; R248-R251 WeakPolarHBondContact O-CB 3.41Å; R248-R251 WeakPolarHBondContact O-CD 3.31Å; R248-R251 WeakPolarHBondContact O-CG 3.14Å; R248-R251 PolarHBondContact O-N 3.02Å; R248-R251 VanDerWaalsContact O-N 3.15Å
249	F	88.3	Confident	82.3	Confident	10 Å²	10	32.7 Å²	32.7	4%	0.044	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-61.1	-22.4	174.5	63.2	-98.7	0	0	0	113.5	Y168 G246 L247 R251 A252 T341 G344 F345 L348	Y168-F249 HydrophobicContact CE1-CB 3.92Å; Y168-F249 HydrophobicContact CE2-CB 4.03Å; Y168-F249 WeakPolarHBondContact OH-CB 3.22Å; G246-F249 WeakPolarHBondContact O-CD1 3.42Å; G246-F249 WeakPolarHBondContact O-CE1 3.37Å; L247-F249 HydrophobicContact CD2-CE1 3.81Å; L247-F249 HydrophobicContact CD2-CZ 3.6Å; L247-F249 PolarHBondContact O-N 3.42Å; F249-R251 PolarHBondContact O-N 3.31Å; F249-A252 WeakPolarHBondContact O-CB 3.34Å; F249-A252 PolarHBondContact O-N 3.15Å; F249-T341 HydrophobicContact CD2-CG2 3.89Å; F249-T341 HydrophobicContact CE2-CG2 4.05Å; F249-G344 WeakPolarHBondContact CD1-O 3.38Å; F249-F345 HydrophobicContact CE2-CB 4.19Å; F249-F345 HydrophobicContact CE2-CD2 4.07Å; F249-F345 HydrophobicContact CZ-CB 4.18Å; F249-F345 AromaticContact CZ-CD2 3.61Å; F249-F345 HydrophobicContact CZ-CD2 3.61Å; F249-F345 HydrophobicContact CZ-CG 4.36Å; F249-L348 HydrophobicContact CE1-CB 4.26Å; F249-L348 HydrophobicContact CE1-CD2 3.92Å
250	S	86.9	Confident	81.3	Confident	5 Å²	5	25.3 Å²	25.3	4%	0.035	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-59.6	-17.7	175.7	63.3	0	0	0	0	113	V226 T230 L247 R248 A252 L253	V226-S250 WeakPolarHBondContact CG1-O 3.39Å; T230-S250 WeakPolarHBondContact CG2-OG 3.14Å; L247-S250 VanDerWaalsContact O-CB 3.31Å; L247-S250 WeakPolarHBondContact O-CB 3.33Å; L247-S250 PolarHBondContact O-N 3.47Å; L247-S250 PolarHBondContact O-OG 3.12Å; R248-S250 PolarHBondContact O-N 3.28Å; S250-A252 PolarHBondContact O-N 3.48Å; S250-L253 WeakPolarHBondContact O-CB 2.88Å; S250-L253 PolarHBondContact O-N 3Å
251	R	89.4	Confident	80.4	Confident	1 Å²	1	23.8 Å²	23.8	0%	0.004	12%	0.117	C	C	.	.	G	3₁₀ helix	trans	-56.2	-27.8	170.1	-66.9	173.2	-172.7	-177	0	112.8	S164 L165 D194 T230 R248 F249 L253 R254	S164-R251 WeakPolarHBondContact O-CD 3.35Å; S164-R251 PolarHBondContact O-NH1 2.92Å; L165-R251 HydrophobicContact CD1-CB 4.35Å; D194-R251 IonicContact OD1-CZ 3.25Å; D194-R251 IonicContact OD1-NH1 2.65Å; D194-R251 PolarHBondContact OD1-NH1 3.02Å; D194-R251 IonicContact OD1-NH2 2.91Å; D194-R251 PolarHBondContact OD1-NH2 2.92Å; D194-R251 IonicContact OD2-CZ 3.92Å; D194-R251 IonicContact OD2-NH1 3.89Å; D194-R251 IonicContact OD2-NH2 2.98Å; D194-R251 PolarHBondContact OD2-NH2 3.06Å; T230-R251 HydrophobicContact CG2-CG 3.65Å; R248-R251 WeakPolarHBondContact O-CB 3.41Å; R248-R251 WeakPolarHBondContact O-CD 3.31Å; R248-R251 WeakPolarHBondContact O-CG 3.14Å; R248-R251 PolarHBondContact O-N 3.02Å; R248-R251 VanDerWaalsContact O-N 3.15Å; F249-R251 PolarHBondContact O-N 3.31Å; R251-L253 PolarHBondContact O-N 3.36Å; R251-R254 VanDerWaalsContact O-CB 3.29Å; R251-R254 WeakPolarHBondContact O-CB 3.36Å; R251-R254 WeakPolarHBondContact O-CG 3.27Å; R251-R254 PolarHBondContact O-N 3.02Å
252	A	84.4	Confident	79.4	Confident	1 Å²	1	19.4 Å²	19.4	1%	0.008	10%	0.098	C	C	.	.	G	3₁₀ helix	trans	-62.1	-28.2	176.6	0	0	0	0	0	112.7	L165 F249 S250 R254 L255 S337 L340	L165-A252 HydrophobicContact CD1-CB 3.93Å; F249-A252 WeakPolarHBondContact O-CB 3.34Å; F249-A252 PolarHBondContact O-N 3.15Å; S250-A252 PolarHBondContact O-N 3.48Å; A252-R254 PolarHBondContact O-N 3.03Å; A252-L255 WeakPolarHBondContact O-CB 3.43Å; A252-L255 WeakPolarHBondContact O-CG 3.28Å; A252-L255 PolarHBondContact O-N 3.41Å; A252-L255 VanDerWaalsContact O-N 3.14Å; A252-S337 WeakPolarHBondContact O-CB 3.32Å; A252-L340 HydrophobicContact CB-CB 3.85Å
253	L	84.9	Confident	78.4	Confident	33 Å²	33	19.3 Å²	19.3	17%	0.173	10%	0.098	C	C	.	.	G	3₁₀ helix	trans	-66.2	-19.8	175.3	-64.1	174.7	0	0	0	112.8	V222 V226 S250 R251 L255 M256 T341	V222-L253 HydrophobicContact CG1-CD1 4.34Å; V226-L253 HydrophobicContact CG2-CB 3.76Å; V226-L253 HydrophobicContact CG2-CD1 3.95Å; V226-L253 HydrophobicContact CG2-CG 4.46Å; S250-L253 WeakPolarHBondContact O-CB 2.88Å; S250-L253 PolarHBondContact O-N 3Å; R251-L253 PolarHBondContact O-N 3.36Å; L253-L255 PolarHBondContact O-N 3.31Å; L253-M256 HydrophobicContact CD2-CE 3.69Å; L253-M256 HydrophobicContact CD2-SD 4.27Å; L253-M256 WeakPolarHBondContact O-CB 3.21Å; L253-M256 WeakPolarHBondContact O-CG 3.48Å; L253-M256 PolarHBondContact O-N 3.4Å; L253-M256 VanDerWaalsContact O-N 3.11Å; L253-T341 HydrophobicContact CD1-CG2 4.3Å; L253-T341 HydrophobicContact CD2-CG2 4.16Å; L253-T341 WeakPolarHBondContact CD2-OG1 3.45Å; L253-T341 HydrophobicContact CG-CG2 4.09Å
254	R	82.8	Confident	77.6	Confident	13 Å²	13	22.5 Å²	22.5	5%	0.049	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-62.6	-24	173.5	-64.1	-176.6	171.9	153.7	-3.5	112.1	S164 V226 D227 T230 R251 A252 M256 T257	S164-R254 PolarHBondContact OG-NH1 3.46Å; V226-R254 HydrophobicContact CG1-CG 3.98Å; D227-R254 IonicContact OD1-CZ 3.78Å; D227-R254 IonicContact OD1-NE 2.99Å; D227-R254 IonicContact OD1-NH2 2.68Å; D227-R254 PolarHBondContact OD1-NH2 3.42Å; T230-R254 PolarHBondContact OG1-NH2 3.04Å; R251-R254 VanDerWaalsContact O-CB 3.29Å; R251-R254 WeakPolarHBondContact O-CB 3.36Å; R251-R254 WeakPolarHBondContact O-CG 3.27Å; R251-R254 PolarHBondContact O-N 3.02Å; A252-R254 PolarHBondContact O-N 3.03Å; R254-M256 PolarHBondContact O-N 2.82Å; R254-T257 PolarHBondContact O-N 3.3Å; R254-T257 VanDerWaalsContact O-N 3.13Å; R254-T257 PolarHBondContact O-OG1 3.33Å
255	L	73.1	Confident	76.4	Confident	30 Å²	30	23.7 Å²	23.7	16%	0.157	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-61.9	-24.8	175.7	-65.2	176.8	0	0	0	112.5	I162 L165 A252 L253 T257 L258 S333 L340	I162-L255 HydrophobicContact CG1-CD2 4.26Å; L165-L255 HydrophobicContact CD2-CD1 3.84Å; L165-L255 HydrophobicContact CD2-CG 4.22Å; A252-L255 WeakPolarHBondContact O-CB 3.43Å; A252-L255 WeakPolarHBondContact O-CG 3.28Å; A252-L255 PolarHBondContact O-N 3.41Å; A252-L255 VanDerWaalsContact O-N 3.14Å; L253-L255 PolarHBondContact O-N 3.31Å; L255-T257 PolarHBondContact O-N 3.47Å; L255-T257 VanDerWaalsContact O-N 3.12Å; L255-L258 WeakPolarHBondContact O-CB 3.38Å; L255-L258 PolarHBondContact O-N 2.87Å; L255-S333 VanDerWaalsContact C-OG 3.27Å; L255-S333 PolarHBondContact O-OG 3.41Å; L255-L340 HydrophobicContact CD1-CD1 4.11Å
256	M	73	Confident	75.3	Confident	46 Å²	46	28.5 Å²	28.5	23%	0.227	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-60.4	-21.4	176	-66	-176.5	173.8	0	0	113.2	Y223 L253 R254 L258 P259 S333 S337 V338	Y223-M256 HydrophobicContact CE1-CB 4.3Å; L253-M256 HydrophobicContact CD2-CE 3.69Å; L253-M256 HydrophobicContact CD2-SD 4.27Å; L253-M256 WeakPolarHBondContact O-CB 3.21Å; L253-M256 WeakPolarHBondContact O-CG 3.48Å; L253-M256 PolarHBondContact O-N 3.4Å; L253-M256 VanDerWaalsContact O-N 3.11Å; R254-M256 PolarHBondContact O-N 2.82Å; M256-L258 VanDerWaalsContact C-N 3.32Å; M256-P259 VanDerWaalsContact O-CD 3.25Å; M256-P259 WeakPolarHBondContact O-CD 3.37Å; M256-S333 WeakPolarHBondContact CA-OG 3.26Å; M256-S337 WeakPolarHBondContact CE-OG 3.29Å; M256-S337 WeakPolarHBondContact CG-OG 3.4Å; M256-V338 HydrophobicContact CE-CG2 3.56Å
257	T	72.6	Confident	74.1	Confident	28 Å²	28	34.2 Å²	34.2	17%	0.172	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-78.9	-13.1	175.5	64.6	0	0	0	0	113.5	Y223 R254 L255 P259 D260 I261	Y223-T257 HydrophobicContact CD1-CG2 3.82Å; Y223-T257 HydrophobicContact CE1-CG2 3.28Å; Y223-T257 HydrophobicContact CE2-CG2 4.25Å; Y223-T257 HydrophobicContact CG-CG2 4.49Å; R254-T257 PolarHBondContact O-N 3.3Å; R254-T257 VanDerWaalsContact O-N 3.13Å; R254-T257 PolarHBondContact O-OG1 3.33Å; L255-T257 PolarHBondContact O-N 3.47Å; L255-T257 VanDerWaalsContact O-N 3.12Å; T257-P259 VanDerWaalsContact C-CD 3.45Å; T257-D260 WeakPolarHBondContact O-CB 3.48Å; T257-D260 PolarHBondContact O-N 3.45Å; T257-I261 WeakPolarHBondContact O-CG1 2.94Å; T257-I261 PolarHBondContact O-N 3.32Å; T257-I261 WeakPolarHBondContact OG1-CD1 3.16Å
258	L	67.9	Low	72.5	Confident	37 Å²	37	33.3 Å²	33.3	19%	0.194	17%	0.168	C	C	.	.	H	α-helix	trans	-52.7	-44.7	-176.3	-177.2	159.1	0	0	0	113.1	F158 L255 M256 D260 I261 L262 T329	F158-L258 HydrophobicContact CE2-CB 4.11Å; F158-L258 HydrophobicContact CE2-CD1 3.64Å; F158-L258 HydrophobicContact CE2-CG 3.63Å; F158-L258 HydrophobicContact CZ-CD1 4Å; F158-L258 HydrophobicContact CZ-CG 4.24Å; L255-L258 WeakPolarHBondContact O-CB 3.38Å; L255-L258 PolarHBondContact O-N 2.87Å; M256-L258 VanDerWaalsContact C-N 3.32Å; L258-D260 VanDerWaalsContact C-N 3.32Å; L258-D260 PolarHBondContact O-N 2.94Å; L258-I261 PolarHBondContact O-N 3.25Å; L258-L262 HydrophobicContact CD2-CD1 3.49Å; L258-L262 VanDerWaalsContact CD2-CD1 3.49Å; L258-L262 HydrophobicContact CD2-CG 4.17Å; L258-L262 HydrophobicContact CG-CD1 4.35Å; L258-L262 WeakPolarHBondContact O-CB 3.35Å; L258-L262 WeakPolarHBondContact O-CG 3.12Å; L258-L262 PolarHBondContact O-N 3.21Å; L258-T329 HydrophobicContact CD2-CG2 3.42Å; L258-T329 VanDerWaalsContact CD2-CG2 3.42Å
259	P	64.5	Low	70.7	Confident	5 Å²	5	40.2 Å²	40.2	3%	0.032	20%	0.199	C	C	.	.	H	α-helix	trans	-61.2	-40	177	-21.6	34.5	0	0	0	112.7	M256 T257 Q263 M268 T329 Q330	M256-P259 VanDerWaalsContact O-CD 3.25Å; M256-P259 WeakPolarHBondContact O-CD 3.37Å; T257-P259 VanDerWaalsContact C-CD 3.45Å; P259-Q263 VanDerWaalsContact O-CG 3.23Å; P259-Q263 WeakPolarHBondContact O-CG 3.46Å; P259-Q263 PolarHBondContact O-N 2.98Å; P259-Q263 VanDerWaalsContact O-N 3.1Å; P259-M268 WeakPolarHBondContact O-CE 3.17Å; P259-T329 HydrophobicContact CG-CG2 4.48Å; P259-Q330 HydrophobicContact CB-CG 3.61Å; P259-Q330 HydrophobicContact CG-CB 4.36Å; P259-Q330 HydrophobicContact CG-CG 3.74Å
260	D	66.1	Low	69	Low	43 Å²	43	41.2 Å²	41.2	23%	0.23	21%	0.206	C	C	.	.	H	α-helix	trans	-68.2	-43.6	-179.4	-58.2	-28.6	0	0	0	110.7	T257 L258 L262 Q263 Y264	T257-D260 WeakPolarHBondContact O-CB 3.48Å; T257-D260 PolarHBondContact O-N 3.45Å; L258-D260 VanDerWaalsContact C-N 3.32Å; L258-D260 PolarHBondContact O-N 2.94Å; D260-L262 PolarHBondContact O-N 3.46Å; D260-Q263 WeakPolarHBondContact O-CB 3.46Å; D260-Q263 PolarHBondContact O-N 3.31Å; D260-Y264 HydrophobicContact CB-CE2 4.05Å; D260-Y264 WeakPolarHBondContact O-CD2 3.21Å; D260-Y264 PolarHBondContact O-N 3.11Å
261	I	67.4	Low	67.5	Low	10 Å²	10	43.4 Å²	43.4	5%	0.051	22%	0.221	C	C	.	.	H	α-helix	trans	-60.6	-48.2	177.4	-64.4	175.7	0	0	0	110.5	V154 F158 T257 L258 Q263 Y264 L265	V154-I261 HydrophobicContact CG1-CB 4.03Å; V154-I261 HydrophobicContact CG1-CG1 4Å; V154-I261 HydrophobicContact CG1-CG2 3.58Å; F158-I261 HydrophobicContact CB-CD1 3.88Å; F158-I261 HydrophobicContact CB-CG2 3.82Å; F158-I261 HydrophobicContact CD2-CD1 4.01Å; F158-I261 HydrophobicContact CD2-CG2 4.25Å; F158-I261 HydrophobicContact CG-CD1 4.42Å; F158-I261 HydrophobicContact CG-CG2 4.13Å; T257-I261 WeakPolarHBondContact O-CG1 2.94Å; T257-I261 PolarHBondContact O-N 3.32Å; T257-I261 WeakPolarHBondContact OG1-CD1 3.16Å; L258-I261 PolarHBondContact O-N 3.25Å; I261-Q263 VanDerWaalsContact C-N 3.26Å; I261-Q263 PolarHBondContact O-N 3.24Å; I261-Y264 PolarHBondContact O-N 3.28Å; I261-Y264 VanDerWaalsContact O-N 3.11Å; I261-L265 HydrophobicContact CG2-CD1 4.23Å; I261-L265 WeakPolarHBondContact O-CG 3.47Å; I261-L265 PolarHBondContact O-N 2.78Å
262	L	65.3	Low	65.7	Low	36 Å²	36	50.3 Å²	50.3	19%	0.188	26%	0.258	C	S	.	.	H	α-helix	trans	-65.2	-28.8	179.1	-73.3	-178.5	0	0	0	113.2	L258 D260 I267 M268 T329	L258-L262 HydrophobicContact CD2-CD1 3.49Å; L258-L262 VanDerWaalsContact CD2-CD1 3.49Å; L258-L262 HydrophobicContact CD2-CG 4.17Å; L258-L262 HydrophobicContact CG-CD1 4.35Å; L258-L262 WeakPolarHBondContact O-CB 3.35Å; L258-L262 WeakPolarHBondContact O-CG 3.12Å; L258-L262 PolarHBondContact O-N 3.21Å; D260-L262 PolarHBondContact O-N 3.46Å; L262-I267 HydrophobicContact CD2-CD1 3.97Å; L262-I267 PolarHBondContact O-N 3Å; L262-M268 HydrophobicContact CB-CE 3.41Å; L262-M268 VanDerWaalsContact CB-CE 3.41Å; L262-M268 HydrophobicContact CB-CG 4.22Å; L262-M268 HydrophobicContact CB-SD 4.28Å; L262-M268 HydrophobicContact CD1-CE 4.32Å; L262-M268 HydrophobicContact CD1-SD 4.46Å; L262-M268 PolarHBondContact O-N 3.33Å; L262-T329 HydrophobicContact CD1-CG2 4.14Å
263	Q	61.9	Low	64.2	Low	21 Å²	21	52.8 Å²	52.8	10%	0.098	28%	0.278	C	S	.	.	H	α-helix	trans	-68.6	-44.2	170.4	-72.1	171.3	28.6	0	0	111.2	P259 D260 I261 L265 N266 M268 T270	P259-Q263 VanDerWaalsContact O-CG 3.23Å; P259-Q263 WeakPolarHBondContact O-CG 3.46Å; P259-Q263 PolarHBondContact O-N 2.98Å; P259-Q263 VanDerWaalsContact O-N 3.1Å; D260-Q263 WeakPolarHBondContact O-CB 3.46Å; D260-Q263 PolarHBondContact O-N 3.31Å; I261-Q263 VanDerWaalsContact C-N 3.26Å; I261-Q263 PolarHBondContact O-N 3.24Å; Q263-L265 VanDerWaalsContact C-N 3.25Å; Q263-L265 PolarHBondContact O-N 3.24Å; Q263-N266 PolarHBondContact O-N 3.46Å; Q263-M268 HydrophobicContact CG-CE 3.74Å; Q263-T270 HydrophobicContact CG-CG2 3.98Å
264	Y	66.8	Low	62.8	Low	70 Å²	70	52.9 Å²	52.9	28%	0.275	28%	0.279	S	S	.	.	H	α-helix	trans	-63.1	-30.8	177.6	-63.3	-46.9	0	0	0	113.1	S144 V154 D260 I261 N266 R275	S144-Y264 VanDerWaalsContact O-CD1 3.25Å; S144-Y264 WeakPolarHBondContact O-CD1 3.31Å; V154-Y264 HydrophobicContact CG1-CD2 4.18Å; V154-Y264 HydrophobicContact CG2-CD2 4.47Å; D260-Y264 HydrophobicContact CB-CE2 4.05Å; D260-Y264 WeakPolarHBondContact O-CD2 3.21Å; D260-Y264 PolarHBondContact O-N 3.11Å; I261-Y264 PolarHBondContact O-N 3.28Å; I261-Y264 VanDerWaalsContact O-N 3.11Å; Y264-N266 PolarHBondContact O-N 3.45Å; Y264-R275 VanDerWaalsContact CD1-NH2 3.33Å
265	L	62.7	Low	61.4	Low	48 Å²	48	57.4 Å²	57.4	25%	0.251	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-1.8	176.1	-60.8	175.8	0	0	0	114.1	V155 I261 Q263 I267	V155-L265 HydrophobicContact CG2-CD1 3.85Å; V155-L265 HydrophobicContact CG2-CD2 3.33Å; V155-L265 HydrophobicContact CG2-CG 4.22Å; I261-L265 HydrophobicContact CG2-CD1 4.23Å; I261-L265 WeakPolarHBondContact O-CG 3.47Å; I261-L265 PolarHBondContact O-N 2.78Å; Q263-L265 VanDerWaalsContact C-N 3.25Å; Q263-L265 PolarHBondContact O-N 3.24Å; L265-I267 HydrophobicContact CB-CD1 3.87Å; L265-I267 HydrophobicContact CB-CG1 3.93Å; L265-I267 HydrophobicContact CD1-CD1 4.04Å; L265-I267 PolarHBondContact O-N 3.47Å; L265-I267 VanDerWaalsContact O-N 3.08Å
266	N	60.8	Low	60.6	Low	115 Å²	115	61.6 Å²	61.6	62%	0.615	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	20	-176.5	-153.1	18.8	0	0	0	113.9	Q263 Y264	Q263-N266 PolarHBondContact O-N 3.46Å; Y264-N266 PolarHBondContact O-N 3.45Å
267	I	58.7	Low	59.7	Low	120 Å²	120	60.6 Å²	60.6	62%	0.615	32%	0.317	S	S	*	.	S	Bend	trans	-72.2	-39.2	172.5	-64.1	171.5	0	0	0	108.6	L262 L265	L262-I267 HydrophobicContact CD2-CD1 3.97Å; L262-I267 PolarHBondContact O-N 3Å; L265-I267 HydrophobicContact CB-CD1 3.87Å; L265-I267 HydrophobicContact CB-CG1 3.93Å; L265-I267 HydrophobicContact CD1-CD1 4.04Å; L265-I267 PolarHBondContact O-N 3.47Å; L265-I267 VanDerWaalsContact O-N 3.08Å
268	M	55.5	Low	58.9	Low	12 Å²	12	62.6 Å²	62.6	6%	0.059	33%	0.325	C	S	.	.	S	Bend	trans	-94.7	111.1	166.1	-61.5	-168.2	-63.3	0	0	108.4	P259 L262 Q263 T270 I326 T329	P259-M268 WeakPolarHBondContact O-CE 3.17Å; L262-M268 HydrophobicContact CB-CE 3.41Å; L262-M268 VanDerWaalsContact CB-CE 3.41Å; L262-M268 HydrophobicContact CB-CG 4.22Å; L262-M268 HydrophobicContact CB-SD 4.28Å; L262-M268 HydrophobicContact CD1-CE 4.32Å; L262-M268 HydrophobicContact CD1-SD 4.46Å; L262-M268 PolarHBondContact O-N 3.33Å; Q263-M268 HydrophobicContact CG-CE 3.74Å; M268-T270 VanDerWaalsContact C-N 3.29Å; M268-T270 PolarHBondContact O-N 2.81Å; M268-T270 PolarHBondContact O-OG1 3.28Å; M268-I326 HydrophobicContact CB-CG1 4.04Å; M268-I326 HydrophobicContact CE-CG1 4.3Å; M268-I326 HydrophobicContact CG-CG1 4.45Å; M268-I326 HydrophobicContact SD-CB 4.37Å; M268-I326 HydrophobicContact SD-CG1 3.82Å; M268-T329 HydrophobicContact SD-CG2 4.5Å
269	K	51.2	Low	58.4	Low	160 Å²	160	66.4 Å²	66.4	70%	0.696	35%	0.345	S	S	*	.			trans	-69	78.9	-177.6	-68	-176.8	177.8	179.9	0	111.8	T322	K269-T322 HydrophobicContact CB-CG2 4.04Å; K269-T322 VanDerWaalsContact O-CB 3.25Å; K269-T322 WeakPolarHBondContact O-CB 3.33Å; K269-T322 WeakPolarHBondContact O-CG2 3.47Å; K269-T322 PolarHBondContact O-OG1 2.89Å
270	T	53	Low	58.1	Low	31 Å²	31	69.6 Å²	69.6	19%	0.19	36%	0.364	C	S	.	.			trans	-96	110.6	177.2	38.4	0	0	0	0	111.9	Q263 M268 I274 I326	Q263-T270 HydrophobicContact CG-CG2 3.98Å; M268-T270 VanDerWaalsContact C-N 3.29Å; M268-T270 PolarHBondContact O-N 2.81Å; M268-T270 PolarHBondContact O-OG1 3.28Å; T270-I274 HydrophobicContact CG2-CD1 3.29Å; T270-I326 HydrophobicContact CG2-CD1 3.02Å; T270-I326 HydrophobicContact CG2-CG1 3.89Å
271	S	55	Low	57.5	Low	51 Å²	51	69.6 Å²	69.6	36%	0.357	37%	0.367	S	S	.	.			trans	-59.5	150.6	165	54.8	0	0	0	0	111.5	A273 I274 L320	S271-A273 PolarHBondContact O-N 3.5Å; S271-I274 PolarHBondContact O-N 3.29Å; S271-L320 WeakPolarHBondContact OG-CD1 3.27Å
272	N	51.3	Low	57.1	Low	146 Å²	146	74 Å²	74	78%	0.781	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.5	-18.5	-177.3	-65.3	-24	0	0	0	117	I274 R275 L276	N272-I274 VanDerWaalsContact C-N 3.31Å; N272-I274 PolarHBondContact O-N 3.33Å; N272-R275 PolarHBondContact O-N 3.28Å; N272-L276 PolarHBondContact O-N 2.7Å
273	A	52.9	Low	56.7	Low	53 Å²	53	79 Å²	79	44%	0.438	41%	0.41	S	S	.	.	H	α-helix	trans	-60.3	-30.6	179.9	0	0	0	0	0	114.7	S271 L276 A277	S271-A273 PolarHBondContact O-N 3.5Å; A273-L276 PolarHBondContact O-N 3.12Å; A273-A277 PolarHBondContact O-N 2.63Å
274	I	56.5	Low	56.5	Low	35 Å²	35	81.6 Å²	81.6	18%	0.179	42%	0.424	C	S	.	.	H	α-helix	trans	-71.9	-37.4	-178.8	-71.3	160.7	0	0	0	111.7	T270 S271 N272 L276 A277 Q278 I326	T270-I274 HydrophobicContact CG2-CD1 3.29Å; S271-I274 PolarHBondContact O-N 3.29Å; N272-I274 VanDerWaalsContact C-N 3.31Å; N272-I274 PolarHBondContact O-N 3.33Å; I274-L276 VanDerWaalsContact C-N 3.29Å; I274-L276 PolarHBondContact O-N 3.1Å; I274-A277 PolarHBondContact O-N 3.04Å; I274-Q278 HydrophobicContact CG2-CG 4.47Å; I274-Q278 WeakPolarHBondContact O-CB 3.44Å; I274-Q278 WeakPolarHBondContact O-CG 3.47Å; I274-Q278 PolarHBondContact O-N 3.19Å; I274-I326 HydrophobicContact CD1-CD1 3.97Å
275	R	54.3	Low	55.7	Low	109 Å²	109	80.1 Å²	80.1	41%	0.411	42%	0.424	S	S	.	.	H	α-helix	trans	-64	-37.5	173.9	-73.1	-167	178.8	-178.1	2.8	111.4	S144 Y264 N272 L279	S144-R275 PolarHBondContact O-NH2 3.44Å; Y264-R275 VanDerWaalsContact CD1-NH2 3.33Å; N272-R275 PolarHBondContact O-N 3.28Å; R275-L279 WeakPolarHBondContact O-CB 3.39Å; R275-L279 PolarHBondContact O-N 3.15Å
276	L	56.1	Low	55.6	Low	117 Å²	117	80.7 Å²	80.7	61%	0.613	43%	0.429	S	S	*	.	H	α-helix	trans	-66.7	-44.5	175.7	-171.7	68.5	0	0	0	111.3	N272 A273 I274 Q278 L279 V280	N272-L276 PolarHBondContact O-N 2.7Å; A273-L276 PolarHBondContact O-N 3.12Å; I274-L276 VanDerWaalsContact C-N 3.29Å; I274-L276 PolarHBondContact O-N 3.1Å; L276-Q278 PolarHBondContact O-N 3.43Å; L276-L279 PolarHBondContact O-N 3.09Å; L276-V280 HydrophobicContact CG-CG2 4.48Å; L276-V280 WeakPolarHBondContact O-CB 3.19Å; L276-V280 VanDerWaalsContact O-CG2 3.25Å; L276-V280 WeakPolarHBondContact O-CG2 3.12Å; L276-V280 PolarHBondContact O-N 3.39Å
277	A	53.8	Low	55.4	Low	26 Å²	26	79.6 Å²	79.6	22%	0.215	42%	0.423	C	S	.	.	H	α-helix	trans	-64.1	-39.8	177.3	0	0	0	0	0	112.7	A273 I274 S281 L314	A273-A277 PolarHBondContact O-N 2.63Å; I274-A277 PolarHBondContact O-N 3.04Å; A277-S281 WeakPolarHBondContact O-CB 3.44Å; A277-S281 PolarHBondContact O-N 3.32Å; A277-L314 HydrophobicContact CB-CD1 3.59Å
278	Q	54.3	Low	54.9	Low	70 Å²	70	79 Å²	79	33%	0.327	42%	0.421	S	S	.	.	H	α-helix	trans	-64.4	-44.1	173.1	-76	175.2	-30.3	0	0	111.5	I274 L276 S281 I282	I274-Q278 HydrophobicContact CG2-CG 4.47Å; I274-Q278 WeakPolarHBondContact O-CB 3.44Å; I274-Q278 WeakPolarHBondContact O-CG 3.47Å; I274-Q278 PolarHBondContact O-N 3.19Å; L276-Q278 PolarHBondContact O-N 3.43Å; Q278-S281 PolarHBondContact O-N 2.97Å; Q278-I282 WeakPolarHBondContact O-CB 3.45Å; Q278-I282 WeakPolarHBondContact O-CD1 3.5Å; Q278-I282 WeakPolarHBondContact O-CG1 3.37Å; Q278-I282 PolarHBondContact O-N 2.74Å
279	L	57.5	Low	54.4	Low	117 Å²	117	81.5 Å²	81.5	61%	0.613	44%	0.437	S	S	*	.	H	α-helix	trans	-62.3	-43.3	176.5	-108.5	152.4	0	0	0	112.5	R275 L276 I282 F283	R275-L279 WeakPolarHBondContact O-CB 3.39Å; R275-L279 PolarHBondContact O-N 3.15Å; L276-L279 PolarHBondContact O-N 3.09Å; L279-I282 PolarHBondContact O-N 3.29Å; L279-F283 VanDerWaalsContact O-CB 3.26Å; L279-F283 WeakPolarHBondContact O-CB 3.04Å; L279-F283 PolarHBondContact O-N 3.28Å
280	V	59.1	Low	54.5	Low	72 Å²	72	76.1 Å²	76.1	44%	0.436	43%	0.427	S	S	.	.	H	α-helix	trans	-69	-40.3	178.1	173.1	0	0	0	0	110.7	L276 F283 I284	L276-V280 HydrophobicContact CG-CG2 4.48Å; L276-V280 WeakPolarHBondContact O-CB 3.19Å; L276-V280 VanDerWaalsContact O-CG2 3.25Å; L276-V280 WeakPolarHBondContact O-CG2 3.12Å; L276-V280 PolarHBondContact O-N 3.39Å; V280-F283 PolarHBondContact O-N 2.76Å; V280-I284 HydrophobicContact CG1-CD1 3.64Å; V280-I284 HydrophobicContact CG1-CG1 4.37Å; V280-I284 WeakPolarHBondContact O-CB 3.1Å; V280-I284 WeakPolarHBondContact O-CG1 3.34Å; V280-I284 PolarHBondContact O-N 3.33Å
281	S	53.4	Low	54.4	Low	43 Å²	43	78.2 Å²	78.2	30%	0.301	45%	0.447	S	S	.	.	H	α-helix	trans	-61.6	-44.8	173.6	177.9	0	0	0	0	111.9	A277 Q278 I284 S285	A277-S281 WeakPolarHBondContact O-CB 3.44Å; A277-S281 PolarHBondContact O-N 3.32Å; Q278-S281 PolarHBondContact O-N 2.97Å; S281-I284 PolarHBondContact O-N 2.71Å; S281-S285 VanDerWaalsContact O-CB 3.24Å; S281-S285 WeakPolarHBondContact O-CB 3.4Å; S281-S285 PolarHBondContact O-N 3.29Å; S281-S285 PolarHBondContact O-OG 2.83Å
282	I	58.6	Low	53.9	Low	101 Å²	101	78 Å²	78	52%	0.518	45%	0.454	S	S	.	.	H	α-helix	trans	-64.1	-47.5	176	-69.2	163.8	0	0	0	110.2	Q278 L279 I284 S285 V286	Q278-I282 WeakPolarHBondContact O-CB 3.45Å; Q278-I282 WeakPolarHBondContact O-CD1 3.5Å; Q278-I282 WeakPolarHBondContact O-CG1 3.37Å; Q278-I282 PolarHBondContact O-N 2.74Å; L279-I282 PolarHBondContact O-N 3.29Å; I282-I284 PolarHBondContact O-N 3Å; I282-S285 WeakPolarHBondContact CA-OG 3.46Å; I282-S285 PolarHBondContact O-N 3.24Å; I282-S285 PolarHBondContact O-OG 3.32Å; I282-V286 HydrophobicContact CG2-CG2 4.23Å; I282-V286 WeakPolarHBondContact O-CB 3.32Å; I282-V286 VanDerWaalsContact O-CG2 3.29Å; I282-V286 WeakPolarHBondContact O-CG2 3.5Å; I282-V286 PolarHBondContact O-N 3.49Å
283	F	58.1	Low	53.8	Low	141 Å²	141	77.5 Å²	77.5	62%	0.618	45%	0.45	S	S	*	.	H	α-helix	trans	-59.5	-45.2	178.8	-174	-99.2	0	0	0	111.8	L279 V280 V286 N287	L279-F283 VanDerWaalsContact O-CB 3.26Å; L279-F283 WeakPolarHBondContact O-CB 3.04Å; L279-F283 PolarHBondContact O-N 3.28Å; V280-F283 PolarHBondContact O-N 2.76Å; F283-V286 PolarHBondContact O-N 2.8Å; F283-N287 WeakPolarHBondContact CE1-ND2 3.09Å; F283-N287 WeakPolarHBondContact CZ-ND2 3.37Å; F283-N287 WeakPolarHBondContact O-CB 3.42Å; F283-N287 PolarHBondContact O-N 2.75Å; F283-N287 VanDerWaalsContact O-N 3.07Å; F283-N287 PolarHBondContact O-ND2 3.05Å
284	I	56.2	Low	54	Low	77 Å²	77	81.8 Å²	81.8	40%	0.395	46%	0.464	S	S	.	.	H	α-helix	trans	-67.1	-41	177.3	-68.4	170	0	0	0	110.6	V280 S281 I282 N287 L288	V280-I284 HydrophobicContact CG1-CD1 3.64Å; V280-I284 HydrophobicContact CG1-CG1 4.37Å; V280-I284 WeakPolarHBondContact O-CB 3.1Å; V280-I284 WeakPolarHBondContact O-CG1 3.34Å; V280-I284 PolarHBondContact O-N 3.33Å; S281-I284 PolarHBondContact O-N 2.71Å; I282-I284 PolarHBondContact O-N 3Å; I284-N287 PolarHBondContact O-N 3.16Å; I284-L288 HydrophobicContact CG2-CD1 3.55Å; I284-L288 WeakPolarHBondContact O-CB 3.45Å; I284-L288 WeakPolarHBondContact O-CD1 3.47Å; I284-L288 WeakPolarHBondContact O-CG 3.41Å; I284-L288 PolarHBondContact O-N 3.11Å
285	S	51.6	Low	53.2	Low	38 Å²	38	88.2 Å²	88.2	27%	0.266	49%	0.493	S	S	.	.	H	α-helix	trans	-62.9	-42.4	176.9	76.5	0	0	0	0	112.4	S281 I282 L288 T289	S281-S285 VanDerWaalsContact O-CB 3.24Å; S281-S285 WeakPolarHBondContact O-CB 3.4Å; S281-S285 PolarHBondContact O-N 3.29Å; S281-S285 PolarHBondContact O-OG 2.83Å; I282-S285 WeakPolarHBondContact CA-OG 3.46Å; I282-S285 PolarHBondContact O-N 3.24Å; I282-S285 PolarHBondContact O-OG 3.32Å; S285-L288 PolarHBondContact O-N 2.76Å; S285-T289 WeakPolarHBondContact O-CB 3.32Å; S285-T289 PolarHBondContact O-N 2.7Å; S285-T289 PolarHBondContact O-OG1 3.13Å
286	V	59.6	Low	52.6	Low	61 Å²	61	91 Å²	91	37%	0.37	52%	0.515	S	S	.	.	H	α-helix	trans	-69.6	-41.9	-179.3	170.6	0	0	0	0	110.9	I282 F283 T289 G290	I282-V286 HydrophobicContact CG2-CG2 4.23Å; I282-V286 WeakPolarHBondContact O-CB 3.32Å; I282-V286 VanDerWaalsContact O-CG2 3.29Å; I282-V286 WeakPolarHBondContact O-CG2 3.5Å; I282-V286 PolarHBondContact O-N 3.49Å; F283-V286 PolarHBondContact O-N 2.8Å; V286-T289 PolarHBondContact O-N 3.31Å; V286-G290 PolarHBondContact O-N 2.86Å
287	N	56.2	Low	52.2	Low	92 Å²	92	91.7 Å²	91.7	49%	0.492	52%	0.524	S	S	.	.	H	α-helix	trans	-66.1	-37.2	175.7	-78.6	-78.2	0	0	0	112.1	F283 I284 A291	F283-N287 WeakPolarHBondContact CE1-ND2 3.09Å; F283-N287 WeakPolarHBondContact CZ-ND2 3.37Å; F283-N287 WeakPolarHBondContact O-CB 3.42Å; F283-N287 PolarHBondContact O-N 2.75Å; F283-N287 VanDerWaalsContact O-N 3.07Å; F283-N287 PolarHBondContact O-ND2 3.05Å; I284-N287 PolarHBondContact O-N 3.16Å; N287-A291 PolarHBondContact O-N 3.32Å; N287-A291 VanDerWaalsContact O-N 3.15Å
288	L	48.2	Very low	51.7	Low	107 Å²	107	94.9 Å²	94.9	56%	0.56	55%	0.545	S	S	*	.	H	α-helix	trans	-73.9	-31.3	175.3	-79.3	159.2	0	0	0	113.1	I284 S285 A291 G292	I284-L288 HydrophobicContact CG2-CD1 3.55Å; I284-L288 WeakPolarHBondContact O-CB 3.45Å; I284-L288 WeakPolarHBondContact O-CD1 3.47Å; I284-L288 WeakPolarHBondContact O-CG 3.41Å; I284-L288 PolarHBondContact O-N 3.11Å; S285-L288 PolarHBondContact O-N 2.76Å; L288-A291 PolarHBondContact O-N 2.92Å; L288-G292 PolarHBondContact O-N 2.62Å
289	T	45.7	Very low	51.4	Low	64 Å²	64	100 Å²	100	39%	0.393	57%	0.573	S	S	.	*	H	α-helix	trans	-73.1	-35.1	174.9	-47.8	0	0	0	0	111.2	W217 S285 V286 G292 L293	W217-T289 HydrophobicContact CH2-CG2 3.93Å; W217-T289 HydrophobicContact CZ2-CG2 4.44Å; S285-T289 WeakPolarHBondContact O-CB 3.32Å; S285-T289 PolarHBondContact O-N 2.7Å; S285-T289 PolarHBondContact O-OG1 3.13Å; V286-T289 PolarHBondContact O-N 3.31Å; T289-G292 PolarHBondContact O-N 3.11Å; T289-L293 PolarHBondContact O-N 3.29Å
290	G	53.1	Low	51	Low	47 Å²	47	103.6 Å²	103.6	49%	0.485	58%	0.579	S	S	.	*	H	α-helix	trans	-64.7	-34.9	170.6	0	0	0	0	0	113.5	V286	V286-G290 PolarHBondContact O-N 2.86Å
291	A	51.2	Low	50.4	Low	75 Å²	75	109.2 Å²	109.2	62%	0.62	60%	0.598	S	S	*	*	H	α-helix	trans	-75.7	-23.8	172.6	0	0	0	0	0	113.3	N287 L288	N287-A291 PolarHBondContact O-N 3.32Å; N287-A291 VanDerWaalsContact O-N 3.15Å; L288-A291 PolarHBondContact O-N 2.92Å
292	G	44.6	Very low	50.2	Low	48 Å²	48	112.3 Å²	112.3	50%	0.495	61%	0.614	S	S	.	*	H	α-helix	trans	-80.8	-17.6	-179.5	0	0	0	0	0	115.6	L288 T289 I294	L288-G292 PolarHBondContact O-N 2.62Å; T289-G292 PolarHBondContact O-N 3.11Å; G292-I294 PolarHBondContact O-N 3.29Å
293	L	49.8	Very low	49.6	Very low	135 Å²	135	116 Å²	116	71%	0.707	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	-5.4	-175.1	-105.6	141.4	0	0	0	114.9	T289	T289-L293 PolarHBondContact O-N 3.29Å
294	I	55.5	Low	49.1	Very low	142 Å²	142	112.3 Å²	112.3	73%	0.728	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	-8.8	-179.6	-65	171.9	0	0	0	112.9	G292	G292-I294 PolarHBondContact O-N 3.29Å
295	H	41.1	Very low	48.9	Very low	170 Å²	170	113.9 Å²	113.9	79%	0.787	63%	0.626	S	S	*	*			trans	-129.9	94.4	-177.2	-95.2	-80.9	0	0	0	114.2	V297	H295-V297 PolarHBondContact O-N 2.92Å
296	L	41.9	Very low	48.6	Very low	169 Å²	169	121.2 Å²	121.2	89%	0.885	65%	0.648	S	S	*	*			trans	-81.1	12.7	-166.5	-129	148.5	0	0	0	117.3
297	V	47.2	Very low	48	Very low	130 Å²	130	121.8 Å²	121.8	79%	0.788	65%	0.649	S	S	*	*	S	Bend	trans	-138.2	11.6	-162.6	-173.2	0	0	0	0	118.2	H295	H295-V297 PolarHBondContact O-N 2.92Å
298	S	42.5	Very low	47.9	Very low	94 Å²	94	121.8 Å²	121.8	66%	0.657	65%	0.647	S	S	*	*			trans	-151.6	109.9	-178.9	-74.2	0	0	0	0	118.1	R300	S298-R300 PolarHBondContact O-N 3.09Å
299	L	48.4	Very low	48.1	Very low	177 Å²	177	119 Å²	119	93%	0.927	64%	0.636	S	S	*	*			trans	39.7	11	135	-82.5	149.5	0	0	0	121.8
300	R	49.1	Very low	48.3	Very low	192 Å²	192	118.1 Å²	118.1	73%	0.725	63%	0.631	S	S	*	*			trans	-98.9	-0.2	-173.3	-73.2	-178.3	170	179.2	-1.3	116	S298 V302 R303	S298-R300 PolarHBondContact O-N 3.09Å; R300-V302 PolarHBondContact O-N 2.91Å; R300-V302 VanDerWaalsContact O-N 3.08Å; R300-R303 PolarHBondContact O-N 2.87Å
301	F	47.2	Very low	48.2	Very low	190 Å²	190	118.2 Å²	118.2	83%	0.833	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-53.1	-29.3	176.2	-171.6	-102.7	0	0	0	113.1	R303 A304	F301-R303 VanDerWaalsContact C-N 3.29Å; F301-R303 PolarHBondContact O-N 3.48Å; F301-A304 PolarHBondContact O-N 3.41Å
302	V	48.6	Very low	48	Very low	108 Å²	108	118.1 Å²	118.1	66%	0.655	61%	0.612	S	S	*	*	G	3₁₀ helix	trans	-70.1	-18.3	179.6	-174.4	0	0	0	0	113.2	R300	R300-V302 PolarHBondContact O-N 2.91Å; R300-V302 VanDerWaalsContact O-N 3.08Å
303	R	46.1	Very low	48.5	Very low	179 Å²	179	120.5 Å²	120.5	68%	0.675	61%	0.612	S	S	*	*	G	3₁₀ helix	trans	-85.3	-18.6	176.8	-78.6	-174.8	179.2	178.6	-0.2	114.1	R300 F301 L305 R306	R300-R303 PolarHBondContact O-N 2.87Å; F301-R303 VanDerWaalsContact C-N 3.29Å; F301-R303 PolarHBondContact O-N 3.48Å; R303-L305 PolarHBondContact O-N 2.67Å; R303-R306 WeakPolarHBondContact O-CB 3.27Å; R303-R306 PolarHBondContact O-N 2.89Å; R303-R306 VanDerWaalsContact O-N 3.09Å
304	A	48.2	Very low	48.4	Very low	64 Å²	64	118 Å²	118	53%	0.529	60%	0.599	S	S	.	*	G	3₁₀ helix	trans	-66.8	-20.9	174.1	0	0	0	0	0	112.6	F301 R306 L307	F301-A304 PolarHBondContact O-N 3.41Å; A304-R306 PolarHBondContact O-N 3.32Å; A304-L307 PolarHBondContact O-N 3.17Å; A304-L307 VanDerWaalsContact O-N 3.15Å
305	L	50.5	Low	48.1	Very low	110 Å²	110	115.7 Å²	115.7	58%	0.576	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-59.9	-22.3	169.2	-81.9	153.6	0	0	0	113.3	R303 L307 M308	R303-L305 PolarHBondContact O-N 2.67Å; L305-L307 PolarHBondContact O-N 3.29Å; L305-M308 WeakPolarHBondContact O-CB 3.44Å; L305-M308 PolarHBondContact O-N 2.83Å
306	R	45.8	Very low	48.5	Very low	191 Å²	191	117.3 Å²	117.3	72%	0.721	59%	0.586	S	S	*	*	G	3₁₀ helix	trans	-69.8	-11.9	175.4	-72.7	-168.1	-179.4	-172.6	-1.5	113.8	R303 A304 M308 S309	R303-R306 WeakPolarHBondContact O-CB 3.27Å; R303-R306 PolarHBondContact O-N 2.89Å; R303-R306 VanDerWaalsContact O-N 3.09Å; A304-R306 PolarHBondContact O-N 3.32Å; R306-M308 PolarHBondContact O-N 2.85Å; R306-S309 PolarHBondContact O-N 2.92Å; R306-S309 PolarHBondContact O-OG 2.84Å
307	L	48	Very low	48.8	Very low	74 Å²	74	114.4 Å²	114.4	39%	0.387	57%	0.57	S	S	.	*	G	3₁₀ helix	trans	-74.1	-10.2	172.2	-78.2	160.6	0	0	0	112.9	A304 L305 S309 V310	A304-L307 PolarHBondContact O-N 3.17Å; A304-L307 VanDerWaalsContact O-N 3.15Å; L305-L307 PolarHBondContact O-N 3.29Å; L307-S309 PolarHBondContact O-N 3.45Å; L307-V310 HydrophobicContact CD2-CG2 4.22Å
308	M	53	Low	48.9	Very low	92 Å²	92	115.6 Å²	115.6	45%	0.453	57%	0.572	S	S	.	*	G	3₁₀ helix	trans	-65.6	-12.2	166.2	-84.6	-170.2	178.2	0	0	113.8	L305 R306 P311 Y411	L305-M308 WeakPolarHBondContact O-CB 3.44Å; L305-M308 PolarHBondContact O-N 2.83Å; R306-M308 PolarHBondContact O-N 2.85Å; M308-P311 VanDerWaalsContact O-CD 3.31Å; M308-P311 WeakPolarHBondContact O-CD 3.24Å; M308-Y411 WeakPolarHBondContact CE-OH 3.43Å; M308-Y411 HydrophobicContact SD-CE1 4.45Å
309	S	51.8	Low	49	Very low	48 Å²	48	116.4 Å²	116.4	34%	0.336	57%	0.573	S	S	.	*	G	3₁₀ helix	trans	-92.2	-1.2	-177.9	74.3	0	0	0	0	114.8	R306 L307 D312 I313	R306-S309 PolarHBondContact O-N 2.92Å; R306-S309 PolarHBondContact O-OG 2.84Å; L307-S309 PolarHBondContact O-N 3.45Å; S309-D312 VanDerWaalsContact CA-OD2 3.24Å; S309-D312 WeakPolarHBondContact CA-OD2 3.44Å; S309-D312 WeakPolarHBondContact CB-OD2 3.4Å; S309-D312 WeakPolarHBondContact O-CA 3.43Å; S309-D312 VanDerWaalsContact O-CB 3.23Å; S309-D312 WeakPolarHBondContact O-CB 3.38Å; S309-D312 PolarHBondContact O-N 3.47Å; S309-D312 VanDerWaalsContact O-N 3.08Å; S309-I313 PolarHBondContact O-N 2.84Å
310	V	50	Low	49	Very low	45 Å²	45	110.7 Å²	110.7	27%	0.273	54%	0.543	S	S	.	.	H	α-helix	trans	-66.5	-38.1	174.8	-179.9	0	0	0	0	112.5	L307 D312 I313 L314	L307-V310 HydrophobicContact CD2-CG2 4.22Å; V310-D312 PolarHBondContact O-N 2.91Å; V310-I313 PolarHBondContact O-N 2.86Å; V310-L314 HydrophobicContact CG1-CD1 4.42Å; V310-L314 PolarHBondContact O-N 3.35Å
311	P	52.7	Low	48.8	Very low	50 Å²	50	111.2 Å²	111.2	33%	0.325	55%	0.551	S	S	.	*	H	α-helix	trans	-51.4	-39.3	163.6	-28.3	36.3	0	0	0	113	M308 I313 L314 Q315	M308-P311 VanDerWaalsContact O-CD 3.31Å; M308-P311 WeakPolarHBondContact O-CD 3.24Å; P311-I313 VanDerWaalsContact C-N 3.33Å; P311-I313 PolarHBondContact O-N 3.46Å; P311-L314 PolarHBondContact O-N 2.87Å; P311-Q315 WeakPolarHBondContact O-CB 3.36Å; P311-Q315 PolarHBondContact O-N 3.45Å
312	D	46.1	Very low	49.2	Very low	72 Å²	72	103.8 Å²	103.8	39%	0.385	52%	0.521	S	S	.	.	H	α-helix	trans	-65.8	-36.3	-179.8	-46.2	-14.7	0	0	0	111.4	S309 V310 Q315 Y316 R327	S309-D312 VanDerWaalsContact CA-OD2 3.24Å; S309-D312 WeakPolarHBondContact CA-OD2 3.44Å; S309-D312 WeakPolarHBondContact CB-OD2 3.4Å; S309-D312 WeakPolarHBondContact O-CA 3.43Å; S309-D312 VanDerWaalsContact O-CB 3.23Å; S309-D312 WeakPolarHBondContact O-CB 3.38Å; S309-D312 PolarHBondContact O-N 3.47Å; S309-D312 VanDerWaalsContact O-N 3.08Å; V310-D312 PolarHBondContact O-N 2.91Å; D312-Q315 PolarHBondContact O-N 3.04Å; D312-Y316 WeakPolarHBondContact O-CB 3.12Å; D312-Y316 PolarHBondContact O-N 3.04Å; D312-R327 IonicContact OD1-NH2 2.8Å
313	I	54	Low	49.7	Very low	99 Å²	99	100.6 Å²	100.6	51%	0.508	50%	0.503	S	S	.	.	H	α-helix	trans	-66.4	-39.7	174.4	-61.1	169.5	0	0	0	110.9	S309 V310 P311 Y316 L317	S309-I313 PolarHBondContact O-N 2.84Å; V310-I313 PolarHBondContact O-N 2.86Å; P311-I313 VanDerWaalsContact C-N 3.33Å; P311-I313 PolarHBondContact O-N 3.46Å; I313-Y316 WeakPolarHBondContact O-CB 3.28Å; I313-Y316 PolarHBondContact O-N 3.36Å; I313-L317 WeakPolarHBondContact O-CG 3.35Å; I313-L317 PolarHBondContact O-N 3.1Å; I313-L317 VanDerWaalsContact O-N 3.17Å
314	L	48.8	Very low	50.6	Low	81 Å²	81	98.1 Å²	98.1	42%	0.424	49%	0.494	S	S	.	.	H	α-helix	trans	-73.8	-29.2	179.1	-71.1	161.1	0	0	0	112.2	A277 V310 P311 L317	A277-L314 HydrophobicContact CB-CD1 3.59Å; V310-L314 HydrophobicContact CG1-CD1 4.42Å; V310-L314 PolarHBondContact O-N 3.35Å; P311-L314 PolarHBondContact O-N 2.87Å; L314-L317 PolarHBondContact O-N 3.11Å
315	Q	49.2	Very low	51.5	Low	94 Å²	94	97.7 Å²	97.7	44%	0.439	49%	0.487	S	S	.	.	H	α-helix	trans	-68.5	-38.9	169.1	-174.7	170.1	-13	0	0	111.3	P311 D312 L317 N318	P311-Q315 WeakPolarHBondContact O-CB 3.36Å; P311-Q315 PolarHBondContact O-N 3.45Å; D312-Q315 PolarHBondContact O-N 3.04Å; Q315-L317 PolarHBondContact O-N 3.38Å; Q315-N318 PolarHBondContact O-N 2.82Å
316	Y	48.5	Very low	52.3	Low	205 Å²	205	92.7 Å²	92.7	80%	0.804	46%	0.461	S	S	*	.	H	α-helix	trans	-61.8	-30.7	174.7	-169.6	-95	0	0	0	112.8	D312 I313 N318	D312-Y316 WeakPolarHBondContact O-CB 3.12Å; D312-Y316 PolarHBondContact O-N 3.04Å; I313-Y316 WeakPolarHBondContact O-CB 3.28Å; I313-Y316 PolarHBondContact O-N 3.36Å; Y316-N318 PolarHBondContact O-N 3.14Å
317	L	50.1	Low	53.6	Low	107 Å²	107	85.1 Å²	85.1	56%	0.56	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	1.7	177.8	-68.1	170.5	0	0	0	114.4	I313 L314 Q315 V319	I313-L317 WeakPolarHBondContact O-CG 3.35Å; I313-L317 PolarHBondContact O-N 3.1Å; I313-L317 VanDerWaalsContact O-N 3.17Å; L314-L317 PolarHBondContact O-N 3.11Å; Q315-L317 PolarHBondContact O-N 3.38Å; L317-V319 VanDerWaalsContact C-N 3.28Å; L317-V319 WeakPolarHBondContact O-CG2 3.41Å; L317-V319 PolarHBondContact O-N 3.13Å; L317-V319 VanDerWaalsContact O-N 3.11Å
318	N	48.1	Very low	55	Low	155 Å²	155	83.7 Å²	83.7	83%	0.829	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.1	17.5	165.3	-125.6	-0.6	0	0	0	117.3	Q315 Y316	Q315-N318 PolarHBondContact O-N 2.82Å; Y316-N318 PolarHBondContact O-N 3.14Å
319	V	45.8	Very low	56	Low	111 Å²	111	81 Å²	81	67%	0.673	41%	0.413	S	S	*	.			trans	-81.2	-24.2	-166.3	163.5	0	0	0	0	115.3	L317	L317-V319 VanDerWaalsContact C-N 3.28Å; L317-V319 WeakPolarHBondContact O-CG2 3.41Å; L317-V319 PolarHBondContact O-N 3.13Å; L317-V319 VanDerWaalsContact O-N 3.11Å
320	L	46.7	Very low	57.3	Low	58 Å²	58	80.8 Å²	80.8	30%	0.304	41%	0.407	S	S	.	.			trans	-149.8	116.1	-170.4	-68.3	153.8	0	0	0	115.8	S271 T322 C323	S271-L320 WeakPolarHBondContact OG-CD1 3.27Å; L320-T322 PolarHBondContact O-N 3.43Å; L320-C323 PolarHBondContact O-N 2.97Å; L320-C323 VanDerWaalsContact O-N 3.08Å
321	K	46.7	Very low	58.7	Low	203 Å²	203	78.8 Å²	78.8	88%	0.883	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	-21.4	168.8	-77.3	177.3	176.9	174	0	113.8
322	T	54.7	Low	60.1	Low	33 Å²	33	80 Å²	80	20%	0.202	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-21.2	179.8	-31.9	0	0	0	0	114.1	K269 L320 R324 S325 I326	K269-T322 HydrophobicContact CB-CG2 4.04Å; K269-T322 VanDerWaalsContact O-CB 3.25Å; K269-T322 WeakPolarHBondContact O-CB 3.33Å; K269-T322 WeakPolarHBondContact O-CG2 3.47Å; K269-T322 PolarHBondContact O-OG1 2.89Å; L320-T322 PolarHBondContact O-N 3.43Å; T322-R324 VanDerWaalsContact C-N 3.26Å; T322-R324 PolarHBondContact O-N 3.14Å; T322-S325 PolarHBondContact O-N 2.9Å; T322-S325 PolarHBondContact O-OG 2.55Å; T322-S325 VanDerWaalsContact O-OG 3.13Å; T322-I326 HydrophobicContact CG2-CD1 3.99Å; T322-I326 WeakPolarHBondContact O-CD1 3.49Å
323	C	59.7	Low	61.6	Low	41 Å²	41	77 Å²	77	28%	0.277	38%	0.382	S	S	.	.	H	α-helix	trans	-63.2	-31.7	-174.6	-72.5	0	0	0	0	113.1	L320 S325 I326 R327	L320-C323 PolarHBondContact O-N 2.97Å; L320-C323 VanDerWaalsContact O-N 3.08Å; C323-S325 PolarHBondContact O-N 3.4Å; C323-I326 PolarHBondContact O-N 3.43Å; C323-R327 VanDerWaalsContact O-CB 3.28Å; C323-R327 WeakPolarHBondContact O-CB 3.34Å; C323-R327 PolarHBondContact O-N 3.43Å
324	R	64.4	Low	62.8	Low	128 Å²	128	74.6 Å²	74.6	48%	0.483	37%	0.37	S	S	.	.	H	α-helix	trans	-62.2	-45.3	-178.4	-65.1	-174.7	-176.7	-179.4	-1	112.4	T322 L328 L418 A421	T322-R324 VanDerWaalsContact C-N 3.26Å; T322-R324 PolarHBondContact O-N 3.14Å; R324-L328 VanDerWaalsContact O-CB 3.26Å; R324-L328 WeakPolarHBondContact O-CB 3.34Å; R324-L328 PolarHBondContact O-N 2.91Å; R324-L418 HydrophobicContact CB-CD2 4.08Å; R324-L418 HydrophobicContact CG-CD2 4.01Å; R324-A421 PolarHBondContact NH1-O 3.03Å
325	S	66.4	Low	64.5	Low	55 Å²	55	72.2 Å²	72.2	39%	0.385	36%	0.356	S	S	.	.	H	α-helix	trans	-70.6	-35.5	-179.1	63.1	0	0	0	0	112.3	T322 C323 T329	T322-S325 PolarHBondContact O-N 2.9Å; T322-S325 PolarHBondContact O-OG 2.55Å; T322-S325 VanDerWaalsContact O-OG 3.13Å; C323-S325 PolarHBondContact O-N 3.4Å; S325-T329 WeakPolarHBondContact O-CB 3.39Å; S325-T329 PolarHBondContact O-N 3.14Å; S325-T329 PolarHBondContact O-OG1 3.32Å
326	I	67.6	Low	66.1	Low	5 Å²	5	72 Å²	72	3%	0.026	36%	0.358	C	S	.	.	H	α-helix	trans	-67.2	-47.5	176.8	-62.5	148.4	0	0	0	109.8	M268 T270 I274 T322 C323 L328 T329 Q330	M268-I326 HydrophobicContact CB-CG1 4.04Å; M268-I326 HydrophobicContact CE-CG1 4.3Å; M268-I326 HydrophobicContact CG-CG1 4.45Å; M268-I326 HydrophobicContact SD-CB 4.37Å; M268-I326 HydrophobicContact SD-CG1 3.82Å; T270-I326 HydrophobicContact CG2-CD1 3.02Å; T270-I326 HydrophobicContact CG2-CG1 3.89Å; I274-I326 HydrophobicContact CD1-CD1 3.97Å; T322-I326 HydrophobicContact CG2-CD1 3.99Å; T322-I326 WeakPolarHBondContact O-CD1 3.49Å; C323-I326 PolarHBondContact O-N 3.43Å; I326-L328 VanDerWaalsContact C-N 3.34Å; I326-L328 PolarHBondContact O-N 2.95Å; I326-T329 PolarHBondContact O-N 3.24Å; I326-Q330 HydrophobicContact CG2-CG 4.32Å; I326-Q330 WeakPolarHBondContact O-CB 3.04Å; I326-Q330 VanDerWaalsContact O-CG 3.3Å; I326-Q330 WeakPolarHBondContact O-CG 3.48Å; I326-Q330 PolarHBondContact O-N 3.42Å
327	R	73.3	Confident	67.8	Low	32 Å²	32	62.3 Å²	62.3	12%	0.121	32%	0.32	C	S	.	.	H	α-helix	trans	-61.1	-45.3	178.2	-173.1	60.8	174.4	-165.6	-8.8	110.9	D312 C323 T329 Q330 L331 E414 L418	D312-R327 IonicContact OD1-NH2 2.8Å; C323-R327 VanDerWaalsContact O-CB 3.28Å; C323-R327 WeakPolarHBondContact O-CB 3.34Å; C323-R327 PolarHBondContact O-N 3.43Å; R327-T329 VanDerWaalsContact C-N 3.34Å; R327-T329 PolarHBondContact O-N 3.43Å; R327-Q330 PolarHBondContact O-N 2.88Å; R327-L331 HydrophobicContact CG-CD1 4.16Å; R327-L331 HydrophobicContact CG-CG 4.48Å; R327-L331 VanDerWaalsContact O-CG 3.3Å; R327-L331 WeakPolarHBondContact O-CG 3.39Å; R327-L331 PolarHBondContact O-N 3.49Å; R327-E414 IonicContact CZ-OE1 2.65Å; R327-E414 IonicContact NE-OE1 2.83Å; R327-E414 PolarHBondContact NE-OE1 3.18Å; R327-E414 IonicContact NH2-OE1 3.76Å; R327-E414 PolarHBondContact NH2-OE1 2.83Å; R327-E414 VanDerWaalsContact NH2-OE1 3.16Å; R327-E414 IonicContact NH2-OE2 2.78Å; R327-L418 HydrophobicContact CB-CD1 4.24Å; R327-L418 HydrophobicContact CG-CD1 3.97Å
328	L	78.5	Confident	69.4	Low	44 Å²	44	58.9 Å²	58.9	23%	0.23	30%	0.303	C	S	.	.	H	α-helix	trans	-56.5	-47.1	173.7	-179	63.9	0	0	0	111.7	R324 I326 Q330 L331 L332 I415 L418 I419	R324-L328 VanDerWaalsContact O-CB 3.26Å; R324-L328 WeakPolarHBondContact O-CB 3.34Å; R324-L328 PolarHBondContact O-N 2.91Å; I326-L328 VanDerWaalsContact C-N 3.34Å; I326-L328 PolarHBondContact O-N 2.95Å; L328-Q330 PolarHBondContact O-N 3.43Å; L328-L331 PolarHBondContact O-N 2.78Å; L328-L332 HydrophobicContact CD1-CD1 4.08Å; L328-L332 HydrophobicContact CD1-CG 4.37Å; L328-L332 HydrophobicContact CG-CD1 4.02Å; L328-L332 WeakPolarHBondContact O-CB 3.36Å; L328-L332 VanDerWaalsContact O-CG 3.26Å; L328-L332 WeakPolarHBondContact O-CG 3.41Å; L328-L332 PolarHBondContact O-N 2.88Å; L328-I415 HydrophobicContact CD1-CB 4.47Å; L328-I415 HydrophobicContact CD1-CG1 4.27Å; L328-I415 HydrophobicContact CD1-CG2 3.94Å; L328-L418 HydrophobicContact CB-CD1 4.38Å; L328-I419 HydrophobicContact CD1-CG1 4.43Å
329	T	72.9	Confident	71.2	Confident	34 Å²	34	52 Å²	52	21%	0.209	27%	0.268	C	S	.	.	H	α-helix	trans	-66	-38.3	179.3	-55	0	0	0	0	112.2	L258 P259 L262 M268 S325 I326 R327 S333	L258-T329 HydrophobicContact CD2-CG2 3.42Å; L258-T329 VanDerWaalsContact CD2-CG2 3.42Å; P259-T329 HydrophobicContact CG-CG2 4.48Å; L262-T329 HydrophobicContact CD1-CG2 4.14Å; M268-T329 HydrophobicContact SD-CG2 4.5Å; S325-T329 WeakPolarHBondContact O-CB 3.39Å; S325-T329 PolarHBondContact O-N 3.14Å; S325-T329 PolarHBondContact O-OG1 3.32Å; I326-T329 PolarHBondContact O-N 3.24Å; R327-T329 VanDerWaalsContact C-N 3.34Å; R327-T329 PolarHBondContact O-N 3.43Å; T329-S333 VanDerWaalsContact O-CB 3.23Å; T329-S333 WeakPolarHBondContact O-CB 3.15Å; T329-S333 PolarHBondContact O-N 3.36Å
330	Q	78.5	Confident	73.3	Confident	45 Å²	45	48 Å²	48	21%	0.21	24%	0.242	C	C	.	.	H	α-helix	trans	-63.4	-51.1	175.3	-76.4	174.5	-18.2	0	0	111.5	P259 I326 R327 L328 L332 S333 I334	P259-Q330 HydrophobicContact CB-CG 3.61Å; P259-Q330 HydrophobicContact CG-CB 4.36Å; P259-Q330 HydrophobicContact CG-CG 3.74Å; I326-Q330 HydrophobicContact CG2-CG 4.32Å; I326-Q330 WeakPolarHBondContact O-CB 3.04Å; I326-Q330 VanDerWaalsContact O-CG 3.3Å; I326-Q330 WeakPolarHBondContact O-CG 3.48Å; I326-Q330 PolarHBondContact O-N 3.42Å; R327-Q330 PolarHBondContact O-N 2.88Å; L328-Q330 PolarHBondContact O-N 3.43Å; Q330-L332 VanDerWaalsContact C-N 3.34Å; Q330-L332 PolarHBondContact O-N 2.8Å; Q330-S333 PolarHBondContact O-N 3.02Å; Q330-I334 WeakPolarHBondContact O-CB 3.37Å; Q330-I334 VanDerWaalsContact O-CG1 3.3Å; Q330-I334 WeakPolarHBondContact O-CG1 3.49Å; Q330-I334 PolarHBondContact O-N 3.14Å
331	L	81.2	Confident	75.3	Confident	3 Å²	3	46.2 Å²	46.2	2%	0.016	23%	0.234	C	C	.	.	H	α-helix	trans	-59.3	-46.3	179	-68.7	171.8	0	0	0	111	R327 L328 F335 Y411 E414 I415 L418	R327-L331 HydrophobicContact CG-CD1 4.16Å; R327-L331 HydrophobicContact CG-CG 4.48Å; R327-L331 VanDerWaalsContact O-CG 3.3Å; R327-L331 WeakPolarHBondContact O-CG 3.39Å; R327-L331 PolarHBondContact O-N 3.49Å; L328-L331 PolarHBondContact O-N 2.78Å; L331-F335 WeakPolarHBondContact O-CB 3.22Å; L331-F335 PolarHBondContact O-N 3.35Å; L331-Y411 HydrophobicContact CD2-CD1 3.72Å; L331-Y411 HydrophobicContact CD2-CD2 4.13Å; L331-Y411 HydrophobicContact CD2-CE1 3.84Å; L331-Y411 HydrophobicContact CD2-CE2 4.24Å; L331-Y411 HydrophobicContact CD2-CG 3.88Å; L331-E414 HydrophobicContact CD1-CB 4.14Å; L331-E414 HydrophobicContact CD1-CG 3.8Å; L331-I415 HydrophobicContact CB-CD1 4.19Å; L331-I415 HydrophobicContact CB-CG1 4.08Å; L331-I415 HydrophobicContact CD1-CG1 4.04Å; L331-L418 HydrophobicContact CD1-CD1 4.06Å
332	L	81.1	Confident	77.3	Confident	75 Å²	75	36.8 Å²	36.8	39%	0.393	19%	0.194	S	C	.	.	H	α-helix	trans	-63.1	-45.2	177.8	-72.3	172.1	0	0	0	112.3	L328 Q330 F335 L336 I415	L328-L332 HydrophobicContact CD1-CD1 4.08Å; L328-L332 HydrophobicContact CD1-CG 4.37Å; L328-L332 HydrophobicContact CG-CD1 4.02Å; L328-L332 WeakPolarHBondContact O-CB 3.36Å; L328-L332 VanDerWaalsContact O-CG 3.26Å; L328-L332 WeakPolarHBondContact O-CG 3.41Å; L328-L332 PolarHBondContact O-N 2.88Å; Q330-L332 VanDerWaalsContact C-N 3.34Å; Q330-L332 PolarHBondContact O-N 2.8Å; L332-F335 PolarHBondContact O-N 2.95Å; L332-L336 WeakPolarHBondContact O-CB 3.32Å; L332-L336 VanDerWaalsContact O-CG 3.24Å; L332-L336 WeakPolarHBondContact O-CG 3.45Å; L332-L336 PolarHBondContact O-N 3.31Å; L332-I415 HydrophobicContact CD2-CD1 4.07Å
333	S	76.5	Confident	79.1	Confident	8 Å²	8	35.2 Å²	35.2	6%	0.056	18%	0.184	C	C	.	.	H	α-helix	trans	-64.5	-45.5	179.7	169.4	0	0	0	0	112.4	L255 M256 T329 Q330 S337	L255-S333 VanDerWaalsContact C-OG 3.27Å; L255-S333 PolarHBondContact O-OG 3.41Å; M256-S333 WeakPolarHBondContact CA-OG 3.26Å; T329-S333 VanDerWaalsContact O-CB 3.23Å; T329-S333 WeakPolarHBondContact O-CB 3.15Å; T329-S333 PolarHBondContact O-N 3.36Å; Q330-S333 PolarHBondContact O-N 3.02Å; S333-S337 VanDerWaalsContact O-CB 3.26Å; S333-S337 WeakPolarHBondContact O-CB 3.15Å; S333-S337 PolarHBondContact O-N 2.82Å; S333-S337 PolarHBondContact O-OG 3.43Å
334	I	80.7	Confident	80.4	Confident	50 Å²	50	33.2 Å²	33.2	26%	0.256	17%	0.171	S	C	.	.	H	α-helix	trans	-64.7	-46.4	177.9	-65.4	168.4	0	0	0	109.9	Q330 L336 S337 V338 Y411	Q330-I334 WeakPolarHBondContact O-CB 3.37Å; Q330-I334 VanDerWaalsContact O-CG1 3.3Å; Q330-I334 WeakPolarHBondContact O-CG1 3.49Å; Q330-I334 PolarHBondContact O-N 3.14Å; I334-L336 PolarHBondContact O-N 2.91Å; I334-S337 WeakPolarHBondContact CA-OG 3.42Å; I334-S337 PolarHBondContact O-N 3.43Å; I334-S337 PolarHBondContact O-OG 2.97Å; I334-V338 HydrophobicContact CG2-CG2 4.28Å; I334-V338 WeakPolarHBondContact O-CG2 3.41Å; I334-V338 PolarHBondContact O-N 3.43Å; I334-Y411 HydrophobicContact CB-CE2 4.24Å; I334-Y411 HydrophobicContact CG2-CE2 3.87Å
335	F	83.1	Confident	81.7	Confident	30 Å²	30	30.4 Å²	30.4	13%	0.132	16%	0.163	C	C	.	.	H	α-helix	trans	-57.9	-48.7	179	-177.1	-100.4	0	0	0	112.1	L331 L332 S339 M378 F408 Y411	L331-F335 WeakPolarHBondContact O-CB 3.22Å; L331-F335 PolarHBondContact O-N 3.35Å; L332-F335 PolarHBondContact O-N 2.95Å; F335-S339 VanDerWaalsContact O-CB 3.29Å; F335-S339 WeakPolarHBondContact O-CB 3.22Å; F335-S339 PolarHBondContact O-N 2.87Å; F335-S339 VanDerWaalsContact O-N 3.11Å; F335-S339 PolarHBondContact O-OG 2.87Å; F335-M378 HydrophobicContact CD2-CE 4.32Å; F335-M378 HydrophobicContact CE2-CE 3.65Å; F335-M378 HydrophobicContact CZ-CE 4.33Å; F335-F408 HydrophobicContact CE2-CD2 4.02Å; F335-F408 HydrophobicContact CZ-CD2 4.15Å; F335-F408 HydrophobicContact CZ-CE2 4.43Å; F335-Y411 HydrophobicContact CB-CD2 4.24Å; F335-Y411 HydrophobicContact CD2-CD2 4.47Å
336	L	84.2	Confident	82.9	Confident	91 Å²	91	27.9 Å²	27.9	48%	0.476	15%	0.145	S	C	.	.	H	α-helix	trans	-66.9	-45.9	179.9	-71.3	170.9	0	0	0	112	L332 I334 S339 L340	L332-L336 WeakPolarHBondContact O-CB 3.32Å; L332-L336 VanDerWaalsContact O-CG 3.24Å; L332-L336 WeakPolarHBondContact O-CG 3.45Å; L332-L336 PolarHBondContact O-N 3.31Å; I334-L336 PolarHBondContact O-N 2.91Å; L336-S339 PolarHBondContact O-N 3.4Å; L336-L340 WeakPolarHBondContact O-CB 3.11Å; L336-L340 WeakPolarHBondContact O-CG 3.49Å; L336-L340 PolarHBondContact O-N 3.33Å
337	S	83	Confident	83.9	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-62.9	-44.3	-178.6	57.1	0	0	0	0	112.6	A252 M256 S333 I334 T341	A252-S337 WeakPolarHBondContact O-CB 3.32Å; M256-S337 WeakPolarHBondContact CE-OG 3.29Å; M256-S337 WeakPolarHBondContact CG-OG 3.4Å; S333-S337 VanDerWaalsContact O-CB 3.26Å; S333-S337 WeakPolarHBondContact O-CB 3.15Å; S333-S337 PolarHBondContact O-N 2.82Å; S333-S337 PolarHBondContact O-OG 3.43Å; I334-S337 WeakPolarHBondContact CA-OG 3.42Å; I334-S337 PolarHBondContact O-N 3.43Å; I334-S337 PolarHBondContact O-OG 2.97Å; S337-T341 VanDerWaalsContact O-CB 3.28Å; S337-T341 WeakPolarHBondContact O-CB 3.49Å; S337-T341 PolarHBondContact O-N 2.84Å; S337-T341 PolarHBondContact O-OG1 3.23Å
338	V	84.2	Confident	84.6	Confident	35 Å²	35	27.6 Å²	27.6	21%	0.212	15%	0.145	C	C	.	.	H	α-helix	trans	-67.2	-41.6	177.5	179.7	0	0	0	0	111.1	M256 I334 T341 G342 F400 M407	M256-V338 HydrophobicContact CE-CG2 3.56Å; I334-V338 HydrophobicContact CG2-CG2 4.28Å; I334-V338 WeakPolarHBondContact O-CG2 3.41Å; I334-V338 PolarHBondContact O-N 3.43Å; V338-T341 PolarHBondContact O-N 3.38Å; V338-G342 PolarHBondContact O-N 3.24Å; V338-F400 HydrophobicContact CG1-CE2 4.26Å; V338-M407 HydrophobicContact CB-CE 3.93Å; V338-M407 HydrophobicContact CG1-CE 3.46Å; V338-M407 VanDerWaalsContact CG1-CE 3.46Å; V338-M407 HydrophobicContact CG1-SD 4.48Å; V338-M407 HydrophobicContact CG2-CE 4.38Å
339	S	86.8	Confident	85.2	Confident	12 Å²	12	26.8 Å²	26.8	8%	0.084	14%	0.141	C	C	.	.	H	α-helix	trans	-63.7	-46.2	179	-58.1	0	0	0	0	112.1	F335 L336 G342 A343	F335-S339 VanDerWaalsContact O-CB 3.29Å; F335-S339 WeakPolarHBondContact O-CB 3.22Å; F335-S339 PolarHBondContact O-N 2.87Å; F335-S339 VanDerWaalsContact O-N 3.11Å; F335-S339 PolarHBondContact O-OG 2.87Å; L336-S339 PolarHBondContact O-N 3.4Å; S339-G342 PolarHBondContact O-N 3.45Å; S339-A343 WeakPolarHBondContact O-CB 3.48Å; S339-A343 PolarHBondContact O-N 2.79Å
340	L	89.3	Confident	86	Confident	25 Å²	25	25.1 Å²	25.1	13%	0.131	13%	0.131	C	C	.	.	H	α-helix	trans	-66.2	-38	177.9	-69.8	172.3	0	0	0	112.3	F169 A252 L255 L336 G344 Y367 V371	F169-L340 HydrophobicContact CZ-CD1 4.24Å; F169-L340 HydrophobicContact CZ-CD2 4.17Å; A252-L340 HydrophobicContact CB-CB 3.85Å; L255-L340 HydrophobicContact CD1-CD1 4.11Å; L336-L340 WeakPolarHBondContact O-CB 3.11Å; L336-L340 WeakPolarHBondContact O-CG 3.49Å; L336-L340 PolarHBondContact O-N 3.33Å; L340-G344 PolarHBondContact O-N 3.06Å; L340-Y367 WeakPolarHBondContact CA-OH 3.35Å; L340-Y367 WeakPolarHBondContact CB-OH 3.33Å; L340-Y367 HydrophobicContact CD2-CE1 4.33Å; L340-Y367 WeakPolarHBondContact CD2-OH 3.48Å; L340-Y367 PolarHBondContact O-OH 3.43Å; L340-V371 HydrophobicContact CD2-CG2 4.19Å
341	T	87.8	Confident	86.4	Confident	22 Å²	22	24.7 Å²	24.7	14%	0.135	13%	0.13	C	C	.	.	H	α-helix	trans	-67.6	-44.3	176.2	-55.2	0	0	0	0	110.8	F249 L253 S337 V338 A343 G344 F345	F249-T341 HydrophobicContact CD2-CG2 3.89Å; F249-T341 HydrophobicContact CE2-CG2 4.05Å; L253-T341 HydrophobicContact CD1-CG2 4.3Å; L253-T341 HydrophobicContact CD2-CG2 4.16Å; L253-T341 WeakPolarHBondContact CD2-OG1 3.45Å; L253-T341 HydrophobicContact CG-CG2 4.09Å; S337-T341 VanDerWaalsContact O-CB 3.28Å; S337-T341 WeakPolarHBondContact O-CB 3.49Å; S337-T341 PolarHBondContact O-N 2.84Å; S337-T341 PolarHBondContact O-OG1 3.23Å; V338-T341 PolarHBondContact O-N 3.38Å; T341-A343 VanDerWaalsContact C-N 3.34Å; T341-A343 PolarHBondContact O-N 3.4Å; T341-G344 PolarHBondContact O-N 3.46Å; T341-F345 PolarHBondContact O-N 3.35Å
342	G	89.9	Confident	86.6	Confident	4 Å²	4	25.8 Å²	25.8	4%	0.041	14%	0.138	C	C	.	.	H	α-helix	trans	-61.2	-41.8	175.8	0	0	0	0	0	112.4	V338 S339 G344 F345 I346 L374	V338-G342 PolarHBondContact O-N 3.24Å; S339-G342 PolarHBondContact O-N 3.45Å; G342-G344 VanDerWaalsContact C-N 3.33Å; G342-G344 PolarHBondContact O-N 3.16Å; G342-F345 PolarHBondContact O-N 3.42Å; G342-I346 WeakPolarHBondContact O-CG1 2.96Å; G342-I346 PolarHBondContact O-N 3.12Å; G342-L374 VanDerWaalsContact C-CD1 3.45Å
343	A	91	Very high	86.7	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-64.5	-39.4	175.9	0	0	0	0	0	111.6	S339 T341 F345 I346 H347 Y367 C370 V371 L374	S339-A343 WeakPolarHBondContact O-CB 3.48Å; S339-A343 PolarHBondContact O-N 2.79Å; T341-A343 VanDerWaalsContact C-N 3.34Å; T341-A343 PolarHBondContact O-N 3.4Å; A343-F345 VanDerWaalsContact C-N 3.34Å; A343-I346 PolarHBondContact O-N 3.19Å; A343-H347 VanDerWaalsContact O-CB 3.24Å; A343-H347 WeakPolarHBondContact O-CB 3.49Å; A343-H347 PolarHBondContact O-N 3.32Å; A343-Y367 HydrophobicContact CB-CE2 4.21Å; A343-C370 HydrophobicContact CB-CB 4.23Å; A343-V371 HydrophobicContact CB-CB 4.26Å; A343-V371 HydrophobicContact CB-CG2 3.52Å; A343-L374 HydrophobicContact CB-CD1 4.49Å
344	G	88.6	Confident	87.2	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-65.9	-35.8	175.8	0	0	0	0	0	113.5	F249 L340 T341 G342 H347 L348	F249-G344 WeakPolarHBondContact CD1-O 3.38Å; L340-G344 PolarHBondContact O-N 3.06Å; T341-G344 PolarHBondContact O-N 3.46Å; G342-G344 VanDerWaalsContact C-N 3.33Å; G342-G344 PolarHBondContact O-N 3.16Å; G344-H347 PolarHBondContact O-N 2.97Å; G344-L348 WeakPolarHBondContact O-CB 3.15Å; G344-L348 PolarHBondContact O-N 3.03Å
345	F	91	Very high	87.3	Confident	69 Å²	69	22.3 Å²	22.3	30%	0.303	12%	0.124	S	C	.	.	H	α-helix	trans	-66.2	-45.4	174.4	-162.3	-93.6	0	0	0	111.5	F249 T341 G342 A343 L348 L349 F396	F249-F345 HydrophobicContact CE2-CB 4.19Å; F249-F345 HydrophobicContact CE2-CD2 4.07Å; F249-F345 HydrophobicContact CZ-CB 4.18Å; F249-F345 AromaticContact CZ-CD2 3.61Å; F249-F345 HydrophobicContact CZ-CD2 3.61Å; F249-F345 HydrophobicContact CZ-CG 4.36Å; T341-F345 PolarHBondContact O-N 3.35Å; G342-F345 PolarHBondContact O-N 3.42Å; A343-F345 VanDerWaalsContact C-N 3.34Å; F345-L348 PolarHBondContact O-N 2.96Å; F345-L349 HydrophobicContact CD1-CD1 3.69Å; F345-L349 HydrophobicContact CD1-CG 4.23Å; F345-L349 HydrophobicContact CE1-CD1 3.4Å; F345-L349 VanDerWaalsContact CE1-CD1 3.4Å; F345-L349 HydrophobicContact CE1-CG 4.09Å; F345-L349 HydrophobicContact CZ-CD1 4.31Å; F345-L349 WeakPolarHBondContact O-CG 3.19Å; F345-L349 PolarHBondContact O-N 3.34Å; F345-F396 HydrophobicContact CB-CE1 4.31Å; F345-F396 HydrophobicContact CB-CE2 4.37Å; F345-F396 HydrophobicContact CB-CZ 4.02Å; F345-F396 HydrophobicContact CD1-CB 4.23Å; F345-F396 AromaticContact CD1-CD1 3.84Å; F345-F396 HydrophobicContact CD1-CD1 3.84Å; F345-F396 AromaticContact CD1-CD2 3.32Å; F345-F396 HydrophobicContact CD1-CD2 3.32Å; F345-F396 AromaticContact CD1-CE1 3.98Å; F345-F396 HydrophobicContact CD1-CE1 3.98Å; F345-F396 AromaticContact CD1-CE2 3.47Å; F345-F396 HydrophobicContact CD1-CE2 3.47Å; F345-F396 VanDerWaalsContact CD1-CE2 3.47Å; F345-F396 AromaticContact CD1-CG 3.51Å; F345-F396 HydrophobicContact CD1-CG 3.51Å; F345-F396 AromaticContact CD1-CZ 3.8Å; F345-F396 HydrophobicContact CD1-CZ 3.8Å; F345-F396 HydrophobicContact CE1-CB 4.04Å; F345-F396 HydrophobicContact CE1-CD1 4.47Å; F345-F396 AromaticContact CE1-CD2 3.35Å; F345-F396 HydrophobicContact CE1-CD2 3.35Å; F345-F396 AromaticContact CE1-CE2 3.86Å; F345-F396 HydrophobicContact CE1-CE2 3.86Å; F345-F396 AromaticContact CE1-CG 3.7Å; F345-F396 HydrophobicContact CE1-CG 3.7Å; F345-F396 HydrophobicContact CG-CD2 4.26Å; F345-F396 AromaticContact CG-CE2 3.97Å; F345-F396 HydrophobicContact CG-CE2 3.97Å; F345-F396 HydrophobicContact CG-CZ 4.11Å; F345-F396 HydrophobicContact CZ-CD2 4.35Å
346	I	91.1	Very high	87.4	Confident	1 Å²	1	29.4 Å²	29.4	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-62.4	-45.5	175	-64.5	164.3	0	0	0	110.6	G342 A343 L348 L349 E350 C370 F373 L374 F396 M397	G342-I346 WeakPolarHBondContact O-CG1 2.96Å; G342-I346 PolarHBondContact O-N 3.12Å; A343-I346 PolarHBondContact O-N 3.19Å; I346-L348 VanDerWaalsContact C-N 3.28Å; I346-L348 PolarHBondContact O-N 2.88Å; I346-L349 PolarHBondContact O-N 3.43Å; I346-L349 VanDerWaalsContact O-N 3.16Å; I346-E350 HydrophobicContact CG2-CG 4.05Å; I346-E350 WeakPolarHBondContact O-CB 3.45Å; I346-E350 PolarHBondContact O-N 3.24Å; I346-C370 HydrophobicContact CG2-CB 4.44Å; I346-F373 HydrophobicContact CD1-CD1 4.26Å; I346-F373 HydrophobicContact CD1-CE1 4.24Å; I346-L374 HydrophobicContact CD1-CD1 3.83Å; I346-F396 HydrophobicContact CD1-CD1 4.4Å; I346-F396 HydrophobicContact CD1-CE1 4.15Å; I346-F396 HydrophobicContact CG1-CD1 3.75Å; I346-F396 HydrophobicContact CG1-CE1 3.74Å; I346-M397 HydrophobicContact CD1-SD 3.35Å; I346-M397 WeakPolarHBondContact CD1-SD 3.03Å; I346-M397 HydrophobicContact CG1-SD 4.09Å
347	H	90	Very high	87.2	Confident	7 Å²	7	29.4 Å²	29.4	3%	0.032	15%	0.152	C	C	.	.	H	α-helix	trans	-57.5	-41.1	177.7	-177.3	-120.6	0	0	0	111.8	A343 G344 N351 I365 Y367 C370	A343-H347 VanDerWaalsContact O-CB 3.24Å; A343-H347 WeakPolarHBondContact O-CB 3.49Å; A343-H347 PolarHBondContact O-N 3.32Å; G344-H347 PolarHBondContact O-N 2.97Å; H347-N351 PolarHBondContact CD2-ND2 3.19Å; H347-N351 PolarHBondContact NE2-ND2 2.9Å; H347-N351 VanDerWaalsContact O-CB 3.26Å; H347-N351 WeakPolarHBondContact O-CB 3.49Å; H347-N351 PolarHBondContact O-N 3.49Å; H347-N351 PolarHBondContact O-ND2 2.77Å; H347-I365 PolarHBondContact CD2-O 3.12Å; H347-I365 PolarHBondContact NE2-O 3.35Å; H347-Y367 HydrophobicContact CB-CD2 4.17Å; H347-Y367 PolarHBondContact CD2-N 3.18Å; H347-Y367 VanDerWaalsContact CD2-N 3.33Å; H347-Y367 PolarHBondContact NE2-N 2.99Å; H347-C370 HydrophobicContact CB-CB 4.42Å
348	L	87.9	Confident	87	Confident	25 Å²	25	35.6 Å²	35.6	13%	0.131	19%	0.185	C	C	.	.	H	α-helix	trans	-64.1	-49.2	174.5	176.6	65.5	0	0	0	111.6	V179 L247 F249 G344 F345 I346 S352	V179-L348 HydrophobicContact CG1-CD1 4.43Å; L247-L348 HydrophobicContact CD2-CD2 4.19Å; F249-L348 HydrophobicContact CE1-CB 4.26Å; F249-L348 HydrophobicContact CE1-CD2 3.92Å; G344-L348 WeakPolarHBondContact O-CB 3.15Å; G344-L348 PolarHBondContact O-N 3.03Å; F345-L348 PolarHBondContact O-N 2.96Å; I346-L348 VanDerWaalsContact C-N 3.28Å; I346-L348 PolarHBondContact O-N 2.88Å; L348-S352 WeakPolarHBondContact O-CB 3.19Å; L348-S352 PolarHBondContact O-N 3.01Å; L348-S352 PolarHBondContact O-OG 2.92Å
349	L	90.2	Very high	86.7	Confident	26 Å²	26	36.4 Å²	36.4	14%	0.136	19%	0.186	C	C	.	.	H	α-helix	trans	-66.9	-46.8	-175.5	-70.1	-178.4	0	0	0	112.6	F345 I346 S352 G353 L392 A393 F396	F345-L349 HydrophobicContact CD1-CD1 3.69Å; F345-L349 HydrophobicContact CD1-CG 4.23Å; F345-L349 HydrophobicContact CE1-CD1 3.4Å; F345-L349 VanDerWaalsContact CE1-CD1 3.4Å; F345-L349 HydrophobicContact CE1-CG 4.09Å; F345-L349 HydrophobicContact CZ-CD1 4.31Å; F345-L349 WeakPolarHBondContact O-CG 3.19Å; F345-L349 PolarHBondContact O-N 3.34Å; I346-L349 PolarHBondContact O-N 3.43Å; I346-L349 VanDerWaalsContact O-N 3.16Å; L349-S352 PolarHBondContact O-N 3.45Å; L349-G353 PolarHBondContact O-N 2.62Å; L349-L392 HydrophobicContact CD1-CB 4.18Å; L349-L392 HydrophobicContact CD2-CB 4.06Å; L349-L392 HydrophobicContact CD2-CD1 4.26Å; L349-A393 HydrophobicContact CB-CB 3.94Å; L349-A393 HydrophobicContact CD1-CB 4.17Å; L349-F396 HydrophobicContact CD1-CB 4.21Å
350	E	89.9	Confident	86.3	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-67.1	-40.9	-178.7	-73.6	-66.6	139.5	0	0	112.1	I346 P362 Q363 I365 C388 K389 T390 A393	I346-E350 HydrophobicContact CG2-CG 4.05Å; I346-E350 WeakPolarHBondContact O-CB 3.45Å; I346-E350 PolarHBondContact O-N 3.24Å; E350-P362 WeakPolarHBondContact O-CA 3.43Å; E350-Q363 CarbonylContact C-O 3.59Å; E350-Q363 HydrophobicContact CB-CB 4.48Å; E350-Q363 PolarHBondContact O-N 3.47Å; E350-Q363 VanDerWaalsContact OE2-CB 3.23Å; E350-Q363 WeakPolarHBondContact OE2-CB 3.14Å; E350-Q363 PolarHBondContact OE2-OE1 3.05Å; E350-I365 HydrophobicContact CB-CD1 4.01Å; E350-I365 HydrophobicContact CG-CD1 3.95Å; E350-C388 WeakPolarHBondContact OE1-CA 3.44Å; E350-C388 WeakPolarHBondContact OE1-CB 3.42Å; E350-K389 PolarHBondContact OE1-N 3.45Å; E350-K389 PolarHBondContact OE2-N 3.17Å; E350-K389 VanDerWaalsContact OE2-N 3.15Å; E350-T390 PolarHBondContact OE1-N 2.58Å; E350-T390 PolarHBondContact OE1-OG1 2.91Å; E350-A393 HydrophobicContact CG-CB 4.07Å; E350-A393 WeakPolarHBondContact OE1-CB 3.25Å
351	N	87.3	Confident	86.1	Confident	36 Å²	36	43.9 Å²	43.9	19%	0.193	22%	0.22	C	C	.	.	H	α-helix	trans	-76.4	-26	178.9	-73.2	-29.9	0	0	0	113.6	V179 H347 Q363 R364 I365	V179-N351 HydrophobicContact CG2-CB 4.01Å; H347-N351 PolarHBondContact CD2-ND2 3.19Å; H347-N351 PolarHBondContact NE2-ND2 2.9Å; H347-N351 VanDerWaalsContact O-CB 3.26Å; H347-N351 WeakPolarHBondContact O-CB 3.49Å; H347-N351 PolarHBondContact O-N 3.49Å; H347-N351 PolarHBondContact O-ND2 2.77Å; N351-Q363 PolarHBondContact OD1-O 3.24Å; N351-R364 WeakPolarHBondContact OD1-CA 3.35Å; N351-I365 PolarHBondContact ND2-O 2.9Å; N351-I365 PolarHBondContact OD1-N 3.29Å; N351-I365 PolarHBondContact OD1-O 3.37Å
352	S	84.1	Confident	85.9	Confident	26 Å²	26	45.8 Å²	45.8	18%	0.182	23%	0.233	C	C	.	.	H	α-helix	trans	-78.3	-38.7	176.8	-58.3	0	0	0	0	112	L348 L349 F359	L348-S352 WeakPolarHBondContact O-CB 3.19Å; L348-S352 PolarHBondContact O-N 3.01Å; L348-S352 PolarHBondContact O-OG 2.92Å; L349-S352 PolarHBondContact O-N 3.45Å; S352-F359 VanDerWaalsContact O-CD1 3.22Å; S352-F359 WeakPolarHBondContact O-CD1 3.41Å
353	G	84.5	Confident	85.6	Confident	4 Å²	4	47.3 Å²	47.3	4%	0.041	24%	0.239	C	C	.	.			trans	83.6	171.4	-168.9	0	0	0	0	0	112.9	L349 F359 N361	L349-G353 PolarHBondContact O-N 2.62Å; G353-F359 WeakPolarHBondContact O-CD1 2.93Å; G353-N361 WeakPolarHBondContact CA-OD1 3.35Å
354	D	86.4	Confident	85.1	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.011	26%	0.262	C	S	.	.			trans	-80.9	129.7	-179.7	-69.3	-43	0	0	0	111.2	F356 Q357 F359 N361 T391 L392	D354-F356 VanDerWaalsContact C-N 3.26Å; D354-F356 PolarHBondContact O-N 2.69Å; D354-Q357 HydrophobicContact CB-CB 4.43Å; D354-Q357 HydrophobicContact CB-CG 4.44Å; D354-Q357 PolarHBondContact O-N 3.04Å; D354-Q357 VanDerWaalsContact O-N 3.15Å; D354-F359 WeakPolarHBondContact O-CA 3.3Å; D354-F359 PolarHBondContact O-N 3.49Å; D354-N361 PolarHBondContact N-OD1 3.18Å; D354-N361 PolarHBondContact OD2-ND2 3.35Å; D354-T391 PolarHBondContact OD1-N 2.96Å; D354-T391 WeakPolarHBondContact OD2-CB 3.42Å; D354-T391 PolarHBondContact OD2-N 3.5Å; D354-T391 PolarHBondContact OD2-OG1 3.19Å; D354-L392 WeakPolarHBondContact OD1-CG 3.35Å; D354-L392 PolarHBondContact OD1-N 2.98Å
355	P	82	Confident	85	Confident	54 Å²	54	54 Å²	54	35%	0.351	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-64.7	-30.4	178.6	24.6	-32.4	0	0	0	112.6	Q357 N358 F359 L392	P355-Q357 PolarHBondContact O-N 3.1Å; P355-N358 PolarHBondContact O-N 2.93Å; P355-F359 HydrophobicContact CB-CE1 3.92Å; P355-F359 HydrophobicContact CB-CE2 4.34Å; P355-F359 HydrophobicContact CB-CZ 3.69Å; P355-L392 VanDerWaalsContact CD-CD1 3.47Å; P355-L392 HydrophobicContact CG-CD1 4.11Å
356	F	85.6	Confident	84.9	Confident	179 Å²	179	53.5 Å²	53.5	79%	0.785	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-72.5	-12.4	178.9	-50.6	-73.1	0	0	0	113.5	D354	D354-F356 VanDerWaalsContact C-N 3.26Å; D354-F356 PolarHBondContact O-N 2.69Å
357	Q	80.8	Confident	84.8	Confident	91 Å²	91	53.5 Å²	53.5	43%	0.425	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-110.9	27.9	174.5	-62.5	-174	1.6	0	0	111	D354 P355 F359 E360 N361	D354-Q357 HydrophobicContact CB-CB 4.43Å; D354-Q357 HydrophobicContact CB-CG 4.44Å; D354-Q357 PolarHBondContact O-N 3.04Å; D354-Q357 VanDerWaalsContact O-N 3.15Å; P355-Q357 PolarHBondContact O-N 3.1Å; Q357-F359 PolarHBondContact O-N 3.03Å; Q357-E360 WeakPolarHBondContact O-CB 3.39Å; Q357-E360 WeakPolarHBondContact O-CG 3.43Å; Q357-E360 PolarHBondContact O-N 2.67Å; Q357-N361 VanDerWaalsContact OE1-CG 3.26Å; Q357-N361 PolarHBondContact OE1-ND2 3.18Å
358	N	78.2	Confident	84.8	Confident	130 Å²	130	59.5 Å²	59.5	70%	0.695	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.2	29	-176.2	-65	-26.3	0	0	0	113.8	P355 E360	P355-N358 PolarHBondContact O-N 2.93Å; N358-E360 VanDerWaalsContact C-N 3.26Å; N358-E360 HydrophobicContact CB-CG 4.46Å; N358-E360 PolarHBondContact O-N 3.45Å
359	F	78.9	Confident	85	Confident	52 Å²	52	61.8 Å²	61.8	23%	0.228	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.1	30.5	-175.6	-50.9	-81.5	0	0	0	114.5	S352 G353 D354 P355 Q357 P362	S352-F359 VanDerWaalsContact O-CD1 3.22Å; S352-F359 WeakPolarHBondContact O-CD1 3.41Å; G353-F359 WeakPolarHBondContact O-CD1 2.93Å; D354-F359 WeakPolarHBondContact O-CA 3.3Å; D354-F359 PolarHBondContact O-N 3.49Å; P355-F359 HydrophobicContact CB-CE1 3.92Å; P355-F359 HydrophobicContact CB-CE2 4.34Å; P355-F359 HydrophobicContact CB-CZ 3.69Å; Q357-F359 PolarHBondContact O-N 3.03Å; F359-P362 WeakPolarHBondContact O-CD 3.45Å
360	E	77.7	Confident	85	Confident	159 Å²	159	60.6 Å²	60.6	74%	0.743	29%	0.294	S	S	*	.			trans	-80	-13.6	179.5	-70.2	-176.7	176	0	0	114.2	Q357 N358 P362	Q357-E360 WeakPolarHBondContact O-CB 3.39Å; Q357-E360 WeakPolarHBondContact O-CG 3.43Å; Q357-E360 PolarHBondContact O-N 2.67Å; N358-E360 VanDerWaalsContact C-N 3.26Å; N358-E360 HydrophobicContact CB-CG 4.46Å; N358-E360 PolarHBondContact O-N 3.45Å; E360-P362 WeakPolarHBondContact O-CD 3.34Å
361	N	85.4	Confident	85.1	Confident	35 Å²	35	62.2 Å²	62.2	19%	0.187	30%	0.304	C	S	.	.			trans	-107.9	39	-176.1	71	-20.7	0	0	0	116.1	G353 D354 Q357 Q363	G353-N361 WeakPolarHBondContact CA-OD1 3.35Å; D354-N361 PolarHBondContact N-OD1 3.18Å; D354-N361 PolarHBondContact OD2-ND2 3.35Å; Q357-N361 VanDerWaalsContact OE1-CG 3.26Å; Q357-N361 PolarHBondContact OE1-ND2 3.18Å; N361-Q363 PolarHBondContact O-N 3.36Å
362	P	82.6	Confident	85.4	Confident	62 Å²	62	64.8 Å²	64.8	40%	0.403	31%	0.311	S	S	.	.			trans	-71.6	132.2	179.6	32	-32.8	0	0	0	110.5	E350 F359 E360	E350-P362 WeakPolarHBondContact O-CA 3.43Å; F359-P362 WeakPolarHBondContact O-CD 3.45Å; E360-P362 WeakPolarHBondContact O-CD 3.34Å
363	Q	83.9	Confident	85.8	Confident	36 Å²	36	64.8 Å²	64.8	17%	0.168	31%	0.308	C	S	.	.			trans	-100.6	110.7	167.7	-169	178.1	-32.7	0	0	107.7	E350 N351 N361 I365 Y387 K389	E350-Q363 CarbonylContact C-O 3.59Å; E350-Q363 HydrophobicContact CB-CB 4.48Å; E350-Q363 PolarHBondContact O-N 3.47Å; E350-Q363 VanDerWaalsContact OE2-CB 3.23Å; E350-Q363 WeakPolarHBondContact OE2-CB 3.14Å; E350-Q363 PolarHBondContact OE2-OE1 3.05Å; N351-Q363 PolarHBondContact OD1-O 3.24Å; N361-Q363 PolarHBondContact O-N 3.36Å; Q363-I365 HydrophobicContact CB-CD1 4.3Å; Q363-I365 HydrophobicContact CB-CG1 4.13Å; Q363-I365 VanDerWaalsContact CD-CD1 3.49Å; Q363-I365 HydrophobicContact CG-CD1 3.85Å; Q363-I365 HydrophobicContact CG-CG1 3.56Å; Q363-I365 VanDerWaalsContact NE2-CD1 3.28Å; Q363-I365 PolarHBondContact O-N 2.85Å; Q363-Y387 PolarHBondContact NE2-O 3.32Å; Q363-Y387 PolarHBondContact OE1-O 3.06Å; Q363-K389 HydrophobicContact CG-CD 4.31Å; Q363-K389 VanDerWaalsContact OE1-CB 3.28Å
364	R	82.1	Confident	86.2	Confident	128 Å²	128	64.7 Å²	64.7	48%	0.483	31%	0.307	S	S	.	.			trans	-72	90.8	177.1	-68.5	-170.4	175.6	-164.1	-4.5	110	F27 N351	F27-R364 VanDerWaalsContact CE2-CZ 3.44Å; F27-R364 VanDerWaalsContact CZ-NH2 3.3Å; N351-R364 WeakPolarHBondContact OD1-CA 3.35Å
365	I	84.9	Confident	86.4	Confident	12 Å²	12	69 Å²	69	6%	0.062	33%	0.329	C	S	.	.			trans	-111.2	139.9	176.6	-48.2	177.1	0	0	0	107.8	H347 E350 N351 Q363 E369 I386	H347-I365 PolarHBondContact CD2-O 3.12Å; H347-I365 PolarHBondContact NE2-O 3.35Å; E350-I365 HydrophobicContact CB-CD1 4.01Å; E350-I365 HydrophobicContact CG-CD1 3.95Å; N351-I365 PolarHBondContact ND2-O 2.9Å; N351-I365 PolarHBondContact OD1-N 3.29Å; N351-I365 PolarHBondContact OD1-O 3.37Å; Q363-I365 HydrophobicContact CB-CD1 4.3Å; Q363-I365 HydrophobicContact CB-CG1 4.13Å; Q363-I365 VanDerWaalsContact CD-CD1 3.49Å; Q363-I365 HydrophobicContact CG-CD1 3.85Å; Q363-I365 HydrophobicContact CG-CG1 3.56Å; Q363-I365 VanDerWaalsContact NE2-CD1 3.28Å; Q363-I365 PolarHBondContact O-N 2.85Å; I365-E369 HydrophobicContact CG2-CB 3.4Å; I365-E369 VanDerWaalsContact CG2-CB 3.4Å; I365-E369 HydrophobicContact CG2-CG 4.4Å; I365-E369 WeakPolarHBondContact CG2-OE2 3.39Å; I365-I386 HydrophobicContact CD1-CG2 4.45Å
366	T	89.3	Confident	86.9	Confident	59 Å²	59	66.9 Å²	66.9	36%	0.362	32%	0.315	S	S	.	.			trans	-76.1	155.1	173.3	63.3	0	0	0	0	111.3	W368 E369 C370	T366-W368 PolarHBondContact O-N 3.27Å; T366-E369 WeakPolarHBondContact CB-OE2 3.29Å; T366-E369 PolarHBondContact N-OE2 3.37Å; T366-E369 PolarHBondContact O-N 2.97Å; T366-E369 WeakPolarHBondContact OG1-CB 3.38Å; T366-E369 VanDerWaalsContact OG1-CD 3.25Å; T366-E369 VanDerWaalsContact OG1-CG 3.23Å; T366-E369 WeakPolarHBondContact OG1-CG 3.38Å; T366-E369 PolarHBondContact OG1-N 3.42Å; T366-E369 PolarHBondContact OG1-OE2 2.96Å; T366-C370 PolarHBondContact O-N 2.97Å
367	Y	89.3	Confident	87.2	Confident	1 Å²	1	59.6 Å²	59.6	0%	0.004	29%	0.285	C	S	.	.	H	α-helix	trans	-54.8	-39.9	176.9	179.1	-100	0	0	0	112.9	Y168 F169 L340 A343 H347 C370 V371	Y168-Y367 HydrophobicContact CE1-CD2 4.05Å; Y168-Y367 AromaticContact CE1-CE2 3.67Å; Y168-Y367 HydrophobicContact CE1-CE2 3.67Å; Y168-Y367 AromaticContact CE1-CZ 3.97Å; Y168-Y367 AromaticContact CZ-CE2 3.96Å; Y168-Y367 VanDerWaalsContact OH-CD2 3.26Å; Y168-Y367 WeakPolarHBondContact OH-CD2 3.34Å; Y168-Y367 WeakPolarHBondContact OH-CE2 3.17Å; F169-Y367 AromaticContact CD1-CD1 3.99Å; F169-Y367 HydrophobicContact CD1-CD1 3.99Å; F169-Y367 AromaticContact CD1-CE1 3.58Å; F169-Y367 HydrophobicContact CD1-CE1 3.58Å; F169-Y367 HydrophobicContact CE1-CD1 4.19Å; F169-Y367 AromaticContact CE1-CE1 3.32Å; F169-Y367 HydrophobicContact CE1-CE1 3.32Å; F169-Y367 AromaticContact CE1-CZ 3.61Å; F169-Y367 HydrophobicContact CZ-CE1 4.27Å; L340-Y367 WeakPolarHBondContact CA-OH 3.35Å; L340-Y367 WeakPolarHBondContact CB-OH 3.33Å; L340-Y367 HydrophobicContact CD2-CE1 4.33Å; L340-Y367 WeakPolarHBondContact CD2-OH 3.48Å; L340-Y367 PolarHBondContact O-OH 3.43Å; A343-Y367 HydrophobicContact CB-CE2 4.21Å; H347-Y367 HydrophobicContact CB-CD2 4.17Å; H347-Y367 PolarHBondContact CD2-N 3.18Å; H347-Y367 VanDerWaalsContact CD2-N 3.33Å; H347-Y367 PolarHBondContact NE2-N 2.99Å; Y367-C370 WeakPolarHBondContact O-CB 3.08Å; Y367-C370 PolarHBondContact O-N 3.26Å; Y367-V371 HydrophobicContact CD1-CG2 4.07Å; Y367-V371 HydrophobicContact CE1-CG2 3.59Å; Y367-V371 WeakPolarHBondContact O-CG2 3.42Å; Y367-V371 PolarHBondContact O-N 2.89Å
368	W	90	Very high	87.5	Confident	132 Å²	132	55.4 Å²	55.4	50%	0.5	27%	0.266	S	S	.	.	H	α-helix	trans	-69.9	-33.5	-178.5	-60.7	118.6	0	0	0	113.4	F169 T366 C370 V371 Y372	F169-W368 HydrophobicContact CB-CZ2 4.13Å; F169-W368 HydrophobicContact CD1-CH2 4.38Å; F169-W368 HydrophobicContact CD2-CH2 4.06Å; F169-W368 HydrophobicContact CD2-CZ2 4.36Å; F169-W368 HydrophobicContact CE2-CH2 4.27Å; F169-W368 HydrophobicContact CG-CH2 4.12Å; F169-W368 HydrophobicContact CG-CZ2 4.12Å; T366-W368 PolarHBondContact O-N 3.27Å; W368-C370 VanDerWaalsContact C-N 3.32Å; W368-V371 HydrophobicContact CE3-CG2 4.3Å; W368-V371 PolarHBondContact O-N 3.47Å; W368-Y372 PolarHBondContact O-N 3.12Å
369	E	91.7	Very high	88.1	Confident	73 Å²	73	50.6 Å²	50.6	34%	0.341	24%	0.242	S	C	.	.	H	α-helix	trans	-65	-37.2	170.7	-77.3	167.4	143.1	0	0	111.4	I365 T366 Y372 F373 I386	I365-E369 HydrophobicContact CG2-CB 3.4Å; I365-E369 VanDerWaalsContact CG2-CB 3.4Å; I365-E369 HydrophobicContact CG2-CG 4.4Å; I365-E369 WeakPolarHBondContact CG2-OE2 3.39Å; T366-E369 WeakPolarHBondContact CB-OE2 3.29Å; T366-E369 PolarHBondContact N-OE2 3.37Å; T366-E369 PolarHBondContact O-N 2.97Å; T366-E369 WeakPolarHBondContact OG1-CB 3.38Å; T366-E369 VanDerWaalsContact OG1-CD 3.25Å; T366-E369 VanDerWaalsContact OG1-CG 3.23Å; T366-E369 WeakPolarHBondContact OG1-CG 3.38Å; T366-E369 PolarHBondContact OG1-N 3.42Å; T366-E369 PolarHBondContact OG1-OE2 2.96Å; E369-Y372 PolarHBondContact O-N 3.18Å; E369-F373 WeakPolarHBondContact O-CB 3.44Å; E369-F373 PolarHBondContact O-N 3.14Å; E369-I386 HydrophobicContact CB-CD1 3.83Å; E369-I386 HydrophobicContact CG-CD1 3.94Å
370	C	91.5	Very high	88.7	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.007	26%	0.263	C	S	.	.	H	α-helix	trans	-65.8	-40.1	173	-62	0	0	0	0	112.4	A343 I346 H347 T366 Y367 W368 F373 L374	A343-C370 HydrophobicContact CB-CB 4.23Å; I346-C370 HydrophobicContact CG2-CB 4.44Å; H347-C370 HydrophobicContact CB-CB 4.42Å; T366-C370 PolarHBondContact O-N 2.97Å; Y367-C370 WeakPolarHBondContact O-CB 3.08Å; Y367-C370 PolarHBondContact O-N 3.26Å; W368-C370 VanDerWaalsContact C-N 3.32Å; C370-F373 PolarHBondContact O-N 3.34Å; C370-L374 VanDerWaalsContact O-CB 3.29Å; C370-L374 WeakPolarHBondContact O-CB 3.49Å; C370-L374 PolarHBondContact O-N 2.93Å
371	V	91.6	Very high	89.5	Confident	34 Å²	34	49.4 Å²	49.4	21%	0.206	25%	0.25	C	S	.	.	H	α-helix	trans	-61.1	-47.2	174.8	172.9	0	0	0	0	110.6	L340 A343 Y367 W368 L374 L375	L340-V371 HydrophobicContact CD2-CG2 4.19Å; A343-V371 HydrophobicContact CB-CB 4.26Å; A343-V371 HydrophobicContact CB-CG2 3.52Å; Y367-V371 HydrophobicContact CD1-CG2 4.07Å; Y367-V371 HydrophobicContact CE1-CG2 3.59Å; Y367-V371 WeakPolarHBondContact O-CG2 3.42Å; Y367-V371 PolarHBondContact O-N 2.89Å; W368-V371 HydrophobicContact CE3-CG2 4.3Å; W368-V371 PolarHBondContact O-N 3.47Å; V371-L374 PolarHBondContact O-N 3.3Å; V371-L375 WeakPolarHBondContact O-CB 3.47Å; V371-L375 PolarHBondContact O-N 3.41Å
372	Y	93.5	Very high	89.6	Confident	91 Å²	91	50 Å²	50	36%	0.357	27%	0.265	S	S	.	.	H	α-helix	trans	-58.7	-51.2	175.9	164	-100.8	0	0	0	111.6	W368 E369 L374 L375 V376 Y383 D385 I386	W368-Y372 PolarHBondContact O-N 3.12Å; E369-Y372 PolarHBondContact O-N 3.18Å; Y372-L374 VanDerWaalsContact C-N 3.31Å; Y372-L374 PolarHBondContact O-N 3.14Å; Y372-L375 PolarHBondContact O-N 3.45Å; Y372-V376 HydrophobicContact CD2-CG2 4.03Å; Y372-V376 HydrophobicContact CE1-CG2 4.38Å; Y372-V376 HydrophobicContact CE2-CG2 3.64Å; Y372-V376 WeakPolarHBondContact O-CG2 3.45Å; Y372-V376 PolarHBondContact O-N 3.26Å; Y372-Y383 WeakPolarHBondContact OH-CD2 3.47Å; Y372-D385 VanDerWaalsContact CE1-OD2 3.25Å; Y372-D385 WeakPolarHBondContact CE1-OD2 3.16Å; Y372-D385 PolarHBondContact OH-OD2 2.97Å; Y372-I386 HydrophobicContact CD1-CD1 3.94Å; Y372-I386 HydrophobicContact CE1-CD1 4.21Å
373	F	92.9	Very high	90.1	Very high	25 Å²	25	54.6 Å²	54.6	11%	0.11	28%	0.276	C	S	.	.	H	α-helix	trans	-56.1	-44.6	178.7	167.5	-111.3	0	0	0	112.4	I346 E369 C370 V376 T377 I386 C388 M397	I346-F373 HydrophobicContact CD1-CD1 4.26Å; I346-F373 HydrophobicContact CD1-CE1 4.24Å; E369-F373 WeakPolarHBondContact O-CB 3.44Å; E369-F373 PolarHBondContact O-N 3.14Å; C370-F373 PolarHBondContact O-N 3.34Å; F373-V376 PolarHBondContact O-N 3.14Å; F373-T377 WeakPolarHBondContact O-CB 3.23Å; F373-T377 PolarHBondContact O-N 3.31Å; F373-T377 PolarHBondContact O-OG1 3.41Å; F373-I386 HydrophobicContact CB-CB 4.38Å; F373-I386 HydrophobicContact CB-CG2 4.16Å; F373-I386 HydrophobicContact CD2-CB 4.44Å; F373-I386 WeakPolarHBondContact CD2-O 3.41Å; F373-I386 VanDerWaalsContact CE2-O 3.25Å; F373-I386 WeakPolarHBondContact CE2-O 3.26Å; F373-I386 HydrophobicContact CG-CG2 4.41Å; F373-C388 VanDerWaalsContact CE1-SG 3.55Å; F373-M397 HydrophobicContact CE1-CE 3.58Å; F373-M397 HydrophobicContact CE1-CG 4.12Å; F373-M397 HydrophobicContact CE1-SD 3.71Å; F373-M397 HydrophobicContact CZ-CE 3.77Å; F373-M397 HydrophobicContact CZ-CG 4.4Å; F373-M397 HydrophobicContact CZ-SD 4.35Å
374	L	91.6	Very high	90.3	Very high	2 Å²	2	55.3 Å²	55.3	1%	0.01	29%	0.292	C	S	.	.	H	α-helix	trans	-67.3	-40.9	-179.1	-174.1	144.6	0	0	0	111.8	G342 A343 I346 C370 V371 Y372 T377 M378 F400	G342-L374 VanDerWaalsContact C-CD1 3.45Å; A343-L374 HydrophobicContact CB-CD1 4.49Å; I346-L374 HydrophobicContact CD1-CD1 3.83Å; C370-L374 VanDerWaalsContact O-CB 3.29Å; C370-L374 WeakPolarHBondContact O-CB 3.49Å; C370-L374 PolarHBondContact O-N 2.93Å; V371-L374 PolarHBondContact O-N 3.3Å; Y372-L374 VanDerWaalsContact C-N 3.31Å; Y372-L374 PolarHBondContact O-N 3.14Å; L374-T377 PolarHBondContact O-N 3.14Å; L374-M378 HydrophobicContact CD2-CG 4.16Å; L374-M378 HydrophobicContact CD2-SD 3.4Å; L374-M378 WeakPolarHBondContact CD2-SD 3.15Å; L374-M378 HydrophobicContact CG-SD 4.36Å; L374-M378 WeakPolarHBondContact O-CB 3.33Å; L374-M378 WeakPolarHBondContact O-CG 3.39Å; L374-M378 PolarHBondContact O-N 3.04Å; L374-F400 HydrophobicContact CD1-CD1 4.07Å; L374-F400 HydrophobicContact CD1-CE1 3.48Å; L374-F400 VanDerWaalsContact CD1-CE1 3.48Å; L374-F400 HydrophobicContact CD1-CE2 4.12Å; L374-F400 HydrophobicContact CD1-CZ 3.53Å; L374-F400 HydrophobicContact CD2-CE1 3.7Å; L374-F400 HydrophobicContact CD2-CZ 3.75Å; L374-F400 HydrophobicContact CG-CD1 4.21Å; L374-F400 HydrophobicContact CG-CE1 3.44Å; L374-F400 VanDerWaalsContact CG-CE1 3.44Å; L374-F400 HydrophobicContact CG-CZ 3.83Å
375	L	90.3	Very high	90.7	Very high	92 Å²	92	53.5 Å²	53.5	48%	0.482	29%	0.292	S	S	.	.	H	α-helix	trans	-65.6	-41.1	176.7	-169.9	122.6	0	0	0	112.3	V371 Y372 T377 S379	V371-L375 WeakPolarHBondContact O-CB 3.47Å; V371-L375 PolarHBondContact O-N 3.41Å; Y372-L375 PolarHBondContact O-N 3.45Å; L375-T377 VanDerWaalsContact C-N 3.29Å; L375-T377 PolarHBondContact O-N 3.18Å; L375-S379 WeakPolarHBondContact O-CB 3.4Å; L375-S379 PolarHBondContact O-N 2.63Å; L375-S379 VanDerWaalsContact O-N 3.12Å; L375-S379 PolarHBondContact O-OG 2.85Å
376	V	92.4	Very high	90.9	Very high	11 Å²	11	54.3 Å²	54.3	7%	0.067	30%	0.296	C	S	.	.	H	α-helix	trans	-63.8	-35.4	173.9	168.1	0	0	0	0	111.6	Y372 F373 S379 V381 G382 Y383	Y372-V376 HydrophobicContact CD2-CG2 4.03Å; Y372-V376 HydrophobicContact CE1-CG2 4.38Å; Y372-V376 HydrophobicContact CE2-CG2 3.64Å; Y372-V376 WeakPolarHBondContact O-CG2 3.45Å; Y372-V376 PolarHBondContact O-N 3.26Å; F373-V376 PolarHBondContact O-N 3.14Å; V376-S379 WeakPolarHBondContact CA-OG 3.35Å; V376-S379 PolarHBondContact O-OG 3.39Å; V376-S379 VanDerWaalsContact O-OG 3.07Å; V376-V381 HydrophobicContact CG1-CB 4.16Å; V376-V381 HydrophobicContact CG1-CG1 4.44Å; V376-V381 PolarHBondContact O-N 2.96Å; V376-V381 VanDerWaalsContact O-N 3.08Å; V376-G382 PolarHBondContact O-N 2.94Å; V376-Y383 HydrophobicContact CB-CD2 4.49Å; V376-Y383 HydrophobicContact CG1-CD2 3.63Å; V376-Y383 HydrophobicContact CG1-CE2 4.22Å; V376-Y383 HydrophobicContact CG1-CG 4.33Å; V376-Y383 HydrophobicContact CG2-CD2 3.96Å; V376-Y383 HydrophobicContact CG2-CE2 4.04Å
377	T	92.1	Very high	91	Very high	25 Å²	25	57.1 Å²	57.1	15%	0.153	30%	0.301	C	S	.	.	H	α-helix	trans	-75.9	-43.6	179	-55.6	0	0	0	0	112	F373 L374 L375 S379 T380 M397 I401	F373-T377 WeakPolarHBondContact O-CB 3.23Å; F373-T377 PolarHBondContact O-N 3.31Å; F373-T377 PolarHBondContact O-OG1 3.41Å; L374-T377 PolarHBondContact O-N 3.14Å; L375-T377 VanDerWaalsContact C-N 3.29Å; L375-T377 PolarHBondContact O-N 3.18Å; T377-S379 VanDerWaalsContact C-N 3.27Å; T377-S379 PolarHBondContact O-N 2.77Å; T377-T380 PolarHBondContact O-N 3.07Å; T377-M397 HydrophobicContact CG2-CE 3.6Å; T377-I401 HydrophobicContact CG2-CD1 3.97Å; T377-I401 HydrophobicContact CG2-CG1 3.67Å
378	M	88.2	Confident	91	Very high	4 Å²	4	57.5 Å²	57.5	2%	0.02	30%	0.304	C	S	.	.	H	α-helix	trans	-62.4	-34.3	177	-74.8	-179.8	69	0	0	112.7	F335 L374 T380 F400 M407 F408	F335-M378 HydrophobicContact CD2-CE 4.32Å; F335-M378 HydrophobicContact CE2-CE 3.65Å; F335-M378 HydrophobicContact CZ-CE 4.33Å; L374-M378 HydrophobicContact CD2-CG 4.16Å; L374-M378 HydrophobicContact CD2-SD 3.4Å; L374-M378 WeakPolarHBondContact CD2-SD 3.15Å; L374-M378 HydrophobicContact CG-SD 4.36Å; L374-M378 WeakPolarHBondContact O-CB 3.33Å; L374-M378 WeakPolarHBondContact O-CG 3.39Å; L374-M378 PolarHBondContact O-N 3.04Å; M378-T380 PolarHBondContact O-N 2.97Å; M378-F400 HydrophobicContact CG-CE1 3.74Å; M378-F400 HydrophobicContact SD-CE1 3.76Å; M378-F400 HydrophobicContact SD-CZ 3.96Å; M378-M407 HydrophobicContact CE-CE 4.24Å; M378-F408 HydrophobicContact CB-CD2 4.27Å; M378-F408 WeakPolarHBondContact O-CG 3.48Å
379	S	90.6	Very high	91	Very high	28 Å²	28	56 Å²	56	20%	0.196	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	3.9	175.5	54.9	0	0	0	0	113.9	L375 V376 T377 V381	L375-S379 WeakPolarHBondContact O-CB 3.4Å; L375-S379 PolarHBondContact O-N 2.63Å; L375-S379 VanDerWaalsContact O-N 3.12Å; L375-S379 PolarHBondContact O-OG 2.85Å; V376-S379 WeakPolarHBondContact CA-OG 3.35Å; V376-S379 PolarHBondContact O-OG 3.39Å; V376-S379 VanDerWaalsContact O-OG 3.07Å; T377-S379 VanDerWaalsContact C-N 3.27Å; T377-S379 PolarHBondContact O-N 2.77Å; S379-V381 PolarHBondContact O-N 3.03Å; S379-V381 VanDerWaalsContact O-N 3.17Å
380	T	92.2	Very high	90.9	Very high	108 Å²	108	52.6 Å²	52.6	66%	0.663	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	11.4	-176.5	63.6	0	0	0	0	115.8	T377 M378 L405	T377-T380 PolarHBondContact O-N 3.07Å; M378-T380 PolarHBondContact O-N 2.97Å; T380-L405 HydrophobicContact CG2-CD2 3.1Å; T380-L405 HydrophobicContact CG2-CG 4.49Å
381	V	92.9	Very high	90.8	Very high	78 Å²	78	56.5 Å²	56.5	47%	0.473	31%	0.309	S	S	.	.			trans	-72.6	-50	-178.2	177.8	0	0	0	0	111	V376 S379 Y383	V376-V381 HydrophobicContact CG1-CB 4.16Å; V376-V381 HydrophobicContact CG1-CG1 4.44Å; V376-V381 PolarHBondContact O-N 2.96Å; V376-V381 VanDerWaalsContact O-N 3.08Å; S379-V381 PolarHBondContact O-N 3.03Å; S379-V381 VanDerWaalsContact O-N 3.17Å; V381-Y383 HydrophobicContact CG1-CD1 4.04Å; V381-Y383 HydrophobicContact CG1-CD2 4.14Å; V381-Y383 HydrophobicContact CG1-CE1 3.65Å; V381-Y383 HydrophobicContact CG1-CE2 3.76Å; V381-Y383 HydrophobicContact CG1-CG 4.26Å; V381-Y383 VanDerWaalsContact CG1-CZ 3.5Å
382	G	88.7	Confident	90.8	Very high	49 Å²	49	57.5 Å²	57.5	51%	0.505	31%	0.312	S	S	.	.			trans	57.1	55.9	170.1	0	0	0	0	0	116.1	V376 G384	V376-G382 PolarHBondContact O-N 2.94Å; G382-G384 PolarHBondContact O-N 2.88Å; G382-G384 VanDerWaalsContact O-N 3.15Å
383	Y	92.3	Very high	90.7	Very high	158 Å²	158	53.1 Å²	53.1	62%	0.62	30%	0.295	S	S	*	.			trans	-55.1	-33.2	-178.1	-67.6	-61.6	0	0	0	114.9	Y372 V376 V381 D385	Y372-Y383 WeakPolarHBondContact OH-CD2 3.47Å; V376-Y383 HydrophobicContact CB-CD2 4.49Å; V376-Y383 HydrophobicContact CG1-CD2 3.63Å; V376-Y383 HydrophobicContact CG1-CE2 4.22Å; V376-Y383 HydrophobicContact CG1-CG 4.33Å; V376-Y383 HydrophobicContact CG2-CD2 3.96Å; V376-Y383 HydrophobicContact CG2-CE2 4.04Å; V381-Y383 HydrophobicContact CG1-CD1 4.04Å; V381-Y383 HydrophobicContact CG1-CD2 4.14Å; V381-Y383 HydrophobicContact CG1-CE1 3.65Å; V381-Y383 HydrophobicContact CG1-CE2 3.76Å; V381-Y383 HydrophobicContact CG1-CG 4.26Å; V381-Y383 VanDerWaalsContact CG1-CZ 3.5Å; Y383-D385 VanDerWaalsContact C-N 3.28Å; Y383-D385 PolarHBondContact O-N 2.82Å
384	G	87.5	Confident	90.6	Very high	50 Å²	50	58.2 Å²	58.2	52%	0.515	31%	0.314	S	S	.	.	S	Bend	trans	77.8	9.6	-178.4	0	0	0	0	0	114.7	G382	G382-G384 PolarHBondContact O-N 2.88Å; G382-G384 VanDerWaalsContact O-N 3.15Å
385	D	91.4	Very high	90.6	Very high	90 Å²	90	62.9 Å²	62.9	48%	0.481	34%	0.338	S	S	.	.	S	Bend	trans	-67.6	-40.7	171.7	55.4	-15.7	0	0	0	112	Y372 Y383	Y372-D385 VanDerWaalsContact CE1-OD2 3.25Å; Y372-D385 WeakPolarHBondContact CE1-OD2 3.16Å; Y372-D385 PolarHBondContact OH-OD2 2.97Å; Y383-D385 VanDerWaalsContact C-N 3.28Å; Y383-D385 PolarHBondContact O-N 2.82Å
386	I	89.4	Confident	90.7	Very high	30 Å²	30	60.7 Å²	60.7	15%	0.154	33%	0.325	C	S	.	.	S	Bend	trans	-119.7	134.5	172.1	-52.7	-174.2	0	0	0	108.2	I365 E369 Y372 F373	I365-I386 HydrophobicContact CD1-CG2 4.45Å; E369-I386 HydrophobicContact CB-CD1 3.83Å; E369-I386 HydrophobicContact CG-CD1 3.94Å; Y372-I386 HydrophobicContact CD1-CD1 3.94Å; Y372-I386 HydrophobicContact CE1-CD1 4.21Å; F373-I386 HydrophobicContact CB-CB 4.38Å; F373-I386 HydrophobicContact CB-CG2 4.16Å; F373-I386 HydrophobicContact CD2-CB 4.44Å; F373-I386 WeakPolarHBondContact CD2-O 3.41Å; F373-I386 VanDerWaalsContact CE2-O 3.25Å; F373-I386 WeakPolarHBondContact CE2-O 3.26Å; F373-I386 HydrophobicContact CG-CG2 4.41Å
387	Y	90	Very high	90.6	Very high	118 Å²	118	60.7 Å²	60.7	46%	0.463	33%	0.325	S	S	.	.			trans	-151.3	154.2	178.1	57.6	-89.2	0	0	0	110.5	Q363 K389	Q363-Y387 PolarHBondContact NE2-O 3.32Å; Q363-Y387 PolarHBondContact OE1-O 3.06Å; Y387-K389 HydrophobicContact CD2-CG 4.33Å; Y387-K389 HydrophobicContact CE2-CG 3.9Å
388	C	90.5	Very high	90.5	Very high	8 Å²	8	63.7 Å²	63.7	5%	0.054	34%	0.343	C	S	.	.			trans	-72.9	123	177.5	-61.3	0	0	0	0	111.2	E350 F373 A393 R394	E350-C388 WeakPolarHBondContact OE1-CA 3.44Å; E350-C388 WeakPolarHBondContact OE1-CB 3.42Å; F373-C388 VanDerWaalsContact CE1-SG 3.55Å; C388-A393 HydrophobicContact CB-CB 3.84Å; C388-R394 HydrophobicContact CB-CG 4.09Å; C388-R394 PolarHBondContact O-NE 3.22Å
389	K	88.9	Confident	90.5	Very high	102 Å²	102	70.1 Å²	70.1	44%	0.443	37%	0.371	S	S	.	.			trans	-88.9	-32.9	173.5	-79.3	176	-166.2	179.1	0	112.5	E350 Q363 Y387 R394	E350-K389 PolarHBondContact OE1-N 3.45Å; E350-K389 PolarHBondContact OE2-N 3.17Å; E350-K389 VanDerWaalsContact OE2-N 3.15Å; Q363-K389 HydrophobicContact CG-CD 4.31Å; Q363-K389 VanDerWaalsContact OE1-CB 3.28Å; Y387-K389 HydrophobicContact CD2-CG 4.33Å; Y387-K389 HydrophobicContact CE2-CG 3.9Å; K389-R394 PolarHBondContact O-NH2 3Å
390	T	90.5	Very high	90.4	Very high	0 Å²	0	69.9 Å²	69.9	0%	0	37%	0.366	C	S	.	.	S	Bend	trans	-70.9	143.5	-176.6	64.2	0	0	0	0	111.4	E350 L392 A393 R394	E350-T390 PolarHBondContact OE1-N 2.58Å; E350-T390 PolarHBondContact OE1-OG1 2.91Å; T390-L392 VanDerWaalsContact C-N 3.32Å; T390-L392 PolarHBondContact O-N 2.92Å; T390-A393 PolarHBondContact O-N 3.5Å; T390-A393 WeakPolarHBondContact OG1-CB 3.42Å; T390-A393 PolarHBondContact OG1-N 3.47Å; T390-R394 VanDerWaalsContact O-CG 3.32Å; T390-R394 WeakPolarHBondContact O-CG 3.44Å; T390-R394 PolarHBondContact O-N 3.35Å
391	T	90.4	Very high	90.4	Very high	83 Å²	83	67.8 Å²	67.8	51%	0.509	35%	0.35	S	S	.	.	H	α-helix	trans	-64.9	-40.7	-179.6	-47.3	0	0	0	0	110.3	D354 R394 L395	D354-T391 PolarHBondContact OD1-N 2.96Å; D354-T391 WeakPolarHBondContact OD2-CB 3.42Å; D354-T391 PolarHBondContact OD2-N 3.5Å; D354-T391 PolarHBondContact OD2-OG1 3.19Å; T391-R394 PolarHBondContact O-N 3.43Å; T391-L395 PolarHBondContact O-N 2.82Å
392	L	90.3	Very high	90.1	Very high	55 Å²	55	70 Å²	70	29%	0.288	36%	0.359	S	S	.	.	H	α-helix	trans	-64.5	-43.4	177.2	-70.2	179.2	0	0	0	112.5	L349 D354 P355 T390 L395 F396	L349-L392 HydrophobicContact CD1-CB 4.18Å; L349-L392 HydrophobicContact CD2-CB 4.06Å; L349-L392 HydrophobicContact CD2-CD1 4.26Å; D354-L392 WeakPolarHBondContact OD1-CG 3.35Å; D354-L392 PolarHBondContact OD1-N 2.98Å; P355-L392 VanDerWaalsContact CD-CD1 3.47Å; P355-L392 HydrophobicContact CG-CD1 4.11Å; T390-L392 VanDerWaalsContact C-N 3.32Å; T390-L392 PolarHBondContact O-N 2.92Å; L392-L395 PolarHBondContact O-N 3.45Å; L392-F396 PolarHBondContact O-N 3.15Å
393	A	91.2	Very high	89.8	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-70.4	-34.7	178.9	0	0	0	0	0	112	L349 E350 C388 T390 F396 M397	L349-A393 HydrophobicContact CB-CB 3.94Å; L349-A393 HydrophobicContact CD1-CB 4.17Å; E350-A393 HydrophobicContact CG-CB 4.07Å; E350-A393 WeakPolarHBondContact OE1-CB 3.25Å; C388-A393 HydrophobicContact CB-CB 3.84Å; T390-A393 PolarHBondContact O-N 3.5Å; T390-A393 WeakPolarHBondContact OG1-CB 3.42Å; T390-A393 PolarHBondContact OG1-N 3.47Å; A393-F396 PolarHBondContact O-N 3.45Å; A393-M397 WeakPolarHBondContact O-CB 3.28Å; A393-M397 VanDerWaalsContact O-CG 3.31Å; A393-M397 WeakPolarHBondContact O-CG 3.47Å; A393-M397 PolarHBondContact O-N 3.13Å
394	R	91.8	Very high	89.5	Confident	131 Å²	131	62 Å²	62	49%	0.494	32%	0.324	S	S	.	.	H	α-helix	trans	-60.9	-43.6	172.1	-73.2	175	-175	171.4	2.8	111.9	C388 K389 T390 T391 M397 V398	C388-R394 HydrophobicContact CB-CG 4.09Å; C388-R394 PolarHBondContact O-NE 3.22Å; K389-R394 PolarHBondContact O-NH2 3Å; T390-R394 VanDerWaalsContact O-CG 3.32Å; T390-R394 WeakPolarHBondContact O-CG 3.44Å; T390-R394 PolarHBondContact O-N 3.35Å; T391-R394 PolarHBondContact O-N 3.43Å; R394-M397 PolarHBondContact O-N 3.45Å; R394-V398 PolarHBondContact O-N 2.86Å
395	L	91.9	Very high	89.5	Confident	101 Å²	101	62.5 Å²	62.5	53%	0.529	32%	0.315	S	S	.	.	H	α-helix	trans	-61.6	-45.3	175.7	-177.4	66.9	0	0	0	111.3	T391 L392 M397 V398 F399	T391-L395 PolarHBondContact O-N 2.82Å; L392-L395 PolarHBondContact O-N 3.45Å; L395-M397 VanDerWaalsContact C-N 3.32Å; L395-M397 PolarHBondContact O-N 3.25Å; L395-V398 PolarHBondContact O-N 2.95Å; L395-F399 HydrophobicContact CD1-CE2 3.93Å; L395-F399 HydrophobicContact CG-CE2 4.12Å; L395-F399 VanDerWaalsContact O-CD2 3.3Å; L395-F399 WeakPolarHBondContact O-CD2 3.42Å
396	F	91.3	Very high	89.2	Confident	45 Å²	45	61.2 Å²	61.2	20%	0.197	32%	0.317	C	S	.	.	H	α-helix	trans	-58.3	-44.4	174.8	174.7	-102	0	0	0	111.9	F345 I346 L349 L392 A393 V398 F399 F400	F345-F396 HydrophobicContact CB-CE1 4.31Å; F345-F396 HydrophobicContact CB-CE2 4.37Å; F345-F396 HydrophobicContact CB-CZ 4.02Å; F345-F396 HydrophobicContact CD1-CB 4.23Å; F345-F396 AromaticContact CD1-CD1 3.84Å; F345-F396 HydrophobicContact CD1-CD1 3.84Å; F345-F396 AromaticContact CD1-CD2 3.32Å; F345-F396 HydrophobicContact CD1-CD2 3.32Å; F345-F396 AromaticContact CD1-CE1 3.98Å; F345-F396 HydrophobicContact CD1-CE1 3.98Å; F345-F396 AromaticContact CD1-CE2 3.47Å; F345-F396 HydrophobicContact CD1-CE2 3.47Å; F345-F396 VanDerWaalsContact CD1-CE2 3.47Å; F345-F396 AromaticContact CD1-CG 3.51Å; F345-F396 HydrophobicContact CD1-CG 3.51Å; F345-F396 AromaticContact CD1-CZ 3.8Å; F345-F396 HydrophobicContact CD1-CZ 3.8Å; F345-F396 HydrophobicContact CE1-CB 4.04Å; F345-F396 HydrophobicContact CE1-CD1 4.47Å; F345-F396 AromaticContact CE1-CD2 3.35Å; F345-F396 HydrophobicContact CE1-CD2 3.35Å; F345-F396 AromaticContact CE1-CE2 3.86Å; F345-F396 HydrophobicContact CE1-CE2 3.86Å; F345-F396 AromaticContact CE1-CG 3.7Å; F345-F396 HydrophobicContact CE1-CG 3.7Å; F345-F396 HydrophobicContact CG-CD2 4.26Å; F345-F396 AromaticContact CG-CE2 3.97Å; F345-F396 HydrophobicContact CG-CE2 3.97Å; F345-F396 HydrophobicContact CG-CZ 4.11Å; F345-F396 HydrophobicContact CZ-CD2 4.35Å; I346-F396 HydrophobicContact CD1-CD1 4.4Å; I346-F396 HydrophobicContact CD1-CE1 4.15Å; I346-F396 HydrophobicContact CG1-CD1 3.75Å; I346-F396 HydrophobicContact CG1-CE1 3.74Å; L349-F396 HydrophobicContact CD1-CB 4.21Å; L392-F396 PolarHBondContact O-N 3.15Å; A393-F396 PolarHBondContact O-N 3.45Å; F396-V398 VanDerWaalsContact C-N 3.3Å; F396-V398 PolarHBondContact O-N 3.48Å; F396-F399 PolarHBondContact O-N 3.45Å; F396-F400 HydrophobicContact CD1-CB 4.34Å; F396-F400 HydrophobicContact CE1-CB 4Å; F396-F400 AromaticContact CE1-CD2 3.94Å; F396-F400 HydrophobicContact CE1-CD2 3.94Å; F396-F400 HydrophobicContact CE1-CG 4.08Å; F396-F400 HydrophobicContact CE2-CD2 4.5Å; F396-F400 HydrophobicContact CZ-CB 4.23Å; F396-F400 AromaticContact CZ-CD2 3.65Å; F396-F400 HydrophobicContact CZ-CD2 3.65Å; F396-F400 HydrophobicContact CZ-CE2 4.46Å; F396-F400 HydrophobicContact CZ-CG 4.21Å; F396-F400 WeakPolarHBondContact O-CB 3.49Å; F396-F400 PolarHBondContact O-N 3.2Å
397	M	90.3	Very high	88.9	Confident	12 Å²	12	61.5 Å²	61.5	6%	0.059	32%	0.318	C	S	.	.	H	α-helix	trans	-60.9	-35.3	179.4	-75.6	-54.4	-64.4	0	0	113.1	I346 F373 T377 A393 R394 L395 F399 F400 I401	I346-M397 HydrophobicContact CD1-SD 3.35Å; I346-M397 WeakPolarHBondContact CD1-SD 3.03Å; I346-M397 HydrophobicContact CG1-SD 4.09Å; F373-M397 HydrophobicContact CE1-CE 3.58Å; F373-M397 HydrophobicContact CE1-CG 4.12Å; F373-M397 HydrophobicContact CE1-SD 3.71Å; F373-M397 HydrophobicContact CZ-CE 3.77Å; F373-M397 HydrophobicContact CZ-CG 4.4Å; F373-M397 HydrophobicContact CZ-SD 4.35Å; T377-M397 HydrophobicContact CG2-CE 3.6Å; A393-M397 WeakPolarHBondContact O-CB 3.28Å; A393-M397 VanDerWaalsContact O-CG 3.31Å; A393-M397 WeakPolarHBondContact O-CG 3.47Å; A393-M397 PolarHBondContact O-N 3.13Å; R394-M397 PolarHBondContact O-N 3.45Å; L395-M397 VanDerWaalsContact C-N 3.32Å; L395-M397 PolarHBondContact O-N 3.25Å; M397-F399 PolarHBondContact O-N 2.87Å; M397-F400 PolarHBondContact O-N 3.46Å; M397-I401 HydrophobicContact CE-CD1 4.49Å; M397-I401 HydrophobicContact CE-CG1 4.31Å; M397-I401 WeakPolarHBondContact O-CB 3.28Å; M397-I401 WeakPolarHBondContact O-CD1 3.32Å; M397-I401 WeakPolarHBondContact O-CG1 3.4Å; M397-I401 PolarHBondContact O-N 3.08Å
398	V	90.5	Very high	88.7	Confident	88 Å²	88	58.6 Å²	58.6	53%	0.533	31%	0.308	S	S	.	.	H	α-helix	trans	-60	-46.2	175.7	173.2	0	0	0	0	111.2	R394 L395 F396 L402	R394-V398 PolarHBondContact O-N 2.86Å; L395-V398 PolarHBondContact O-N 2.95Å; F396-V398 VanDerWaalsContact C-N 3.3Å; F396-V398 PolarHBondContact O-N 3.48Å; V398-L402 PolarHBondContact O-N 2.86Å
399	F	88.4	Confident	88.6	Confident	139 Å²	139	61.7 Å²	61.7	61%	0.61	33%	0.334	S	S	*	.	H	α-helix	trans	-70.4	-39.6	176.5	-67.9	-70.1	0	0	0	112.2	L395 F396 M397 I401 L402 G403	L395-F399 HydrophobicContact CD1-CE2 3.93Å; L395-F399 HydrophobicContact CG-CE2 4.12Å; L395-F399 VanDerWaalsContact O-CD2 3.3Å; L395-F399 WeakPolarHBondContact O-CD2 3.42Å; F396-F399 PolarHBondContact O-N 3.45Å; M397-F399 PolarHBondContact O-N 2.87Å; F399-I401 VanDerWaalsContact C-N 3.33Å; F399-I401 PolarHBondContact O-N 3.25Å; F399-L402 PolarHBondContact O-N 3.24Å; F399-G403 PolarHBondContact O-N 3.02Å
400	F	88.5	Confident	88.5	Confident	22 Å²	22	59.5 Å²	59.5	10%	0.096	33%	0.331	C	S	.	.	H	α-helix	trans	-66.1	-35.9	179.9	-167.3	-89.8	0	0	0	111.9	V338 L374 M378 F396 M397 G403 G404	V338-F400 HydrophobicContact CG1-CE2 4.26Å; L374-F400 HydrophobicContact CD1-CD1 4.07Å; L374-F400 HydrophobicContact CD1-CE1 3.48Å; L374-F400 VanDerWaalsContact CD1-CE1 3.48Å; L374-F400 HydrophobicContact CD1-CE2 4.12Å; L374-F400 HydrophobicContact CD1-CZ 3.53Å; L374-F400 HydrophobicContact CD2-CE1 3.7Å; L374-F400 HydrophobicContact CD2-CZ 3.75Å; L374-F400 HydrophobicContact CG-CD1 4.21Å; L374-F400 HydrophobicContact CG-CE1 3.44Å; L374-F400 VanDerWaalsContact CG-CE1 3.44Å; L374-F400 HydrophobicContact CG-CZ 3.83Å; M378-F400 HydrophobicContact CG-CE1 3.74Å; M378-F400 HydrophobicContact SD-CE1 3.76Å; M378-F400 HydrophobicContact SD-CZ 3.96Å; F396-F400 HydrophobicContact CD1-CB 4.34Å; F396-F400 HydrophobicContact CE1-CB 4Å; F396-F400 AromaticContact CE1-CD2 3.94Å; F396-F400 HydrophobicContact CE1-CD2 3.94Å; F396-F400 HydrophobicContact CE1-CG 4.08Å; F396-F400 HydrophobicContact CE2-CD2 4.5Å; F396-F400 HydrophobicContact CZ-CB 4.23Å; F396-F400 AromaticContact CZ-CD2 3.65Å; F396-F400 HydrophobicContact CZ-CD2 3.65Å; F396-F400 HydrophobicContact CZ-CE2 4.46Å; F396-F400 HydrophobicContact CZ-CG 4.21Å; F396-F400 WeakPolarHBondContact O-CB 3.49Å; F396-F400 PolarHBondContact O-N 3.2Å; M397-F400 PolarHBondContact O-N 3.46Å; F400-G403 PolarHBondContact O-N 3.49Å; F400-G404 VanDerWaalsContact O-CA 3.31Å; F400-G404 WeakPolarHBondContact O-CA 3.32Å; F400-G404 PolarHBondContact O-N 2.93Å
401	I	90.9	Very high	88.3	Confident	64 Å²	64	60 Å²	60	33%	0.328	33%	0.333	S	S	.	.	H	α-helix	trans	-63	-46.4	174.9	-72.7	163.7	0	0	0	110.3	T377 M397 F399 G403 G404 L405	T377-I401 HydrophobicContact CG2-CD1 3.97Å; T377-I401 HydrophobicContact CG2-CG1 3.67Å; M397-I401 HydrophobicContact CE-CD1 4.49Å; M397-I401 HydrophobicContact CE-CG1 4.31Å; M397-I401 WeakPolarHBondContact O-CB 3.28Å; M397-I401 WeakPolarHBondContact O-CD1 3.32Å; M397-I401 WeakPolarHBondContact O-CG1 3.4Å; M397-I401 PolarHBondContact O-N 3.08Å; F399-I401 VanDerWaalsContact C-N 3.33Å; F399-I401 PolarHBondContact O-N 3.25Å; I401-G403 VanDerWaalsContact C-N 3.34Å; I401-G403 PolarHBondContact O-N 2.84Å; I401-G404 PolarHBondContact O-N 2.86Å; I401-L405 HydrophobicContact CG2-CD1 3.55Å; I401-L405 HydrophobicContact CG2-CG 3.97Å; I401-L405 VanDerWaalsContact O-CB 3.3Å; I401-L405 WeakPolarHBondContact O-CB 3.12Å; I401-L405 WeakPolarHBondContact O-CG 3.37Å; I401-L405 PolarHBondContact O-N 3.18Å
402	L	86.6	Confident	88.1	Confident	124 Å²	124	58.9 Å²	58.9	65%	0.649	33%	0.326	S	S	*	.	H	α-helix	trans	-58.6	-43.4	179.6	-69.6	173.8	0	0	0	112.6	V398 F399	V398-L402 PolarHBondContact O-N 2.86Å; F399-L402 PolarHBondContact O-N 3.24Å
403	G	83.8	Confident	88	Confident	38 Å²	38	59.4 Å²	59.4	39%	0.392	33%	0.333	S	S	.	.	H	α-helix	trans	-76.8	-43.4	176.7	0	0	0	0	0	113.4	F399 F400 I401 L405 A406 M407	F399-G403 PolarHBondContact O-N 3.02Å; F400-G403 PolarHBondContact O-N 3.49Å; I401-G403 VanDerWaalsContact C-N 3.34Å; I401-G403 PolarHBondContact O-N 2.84Å; G403-L405 PolarHBondContact O-N 3.24Å; G403-A406 PolarHBondContact O-N 2.78Å; G403-M407 WeakPolarHBondContact O-CG 3.25Å; G403-M407 PolarHBondContact O-N 3.01Å
404	G	84.4	Confident	87.8	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.01	34%	0.342	C	S	.	.	H	α-helix	trans	-64.4	-39	-176.6	0	0	0	0	0	112.9	F400 I401 M407 F408	F400-G404 VanDerWaalsContact O-CA 3.31Å; F400-G404 WeakPolarHBondContact O-CA 3.32Å; F400-G404 PolarHBondContact O-N 2.93Å; I401-G404 PolarHBondContact O-N 2.86Å; G404-M407 PolarHBondContact O-N 3.48Å; G404-F408 VanDerWaalsContact O-CB 3.3Å; G404-F408 WeakPolarHBondContact O-CB 3.13Å; G404-F408 PolarHBondContact O-N 2.66Å
405	L	87.7	Confident	87.4	Confident	61 Å²	61	56.5 Å²	56.5	32%	0.319	33%	0.326	S	S	.	.	H	α-helix	trans	-63.9	-45.6	174	-69.6	177.8	0	0	0	112.1	T380 I401 G403 M407 F408 A409	T380-L405 HydrophobicContact CG2-CD2 3.1Å; T380-L405 HydrophobicContact CG2-CG 4.49Å; I401-L405 HydrophobicContact CG2-CD1 3.55Å; I401-L405 HydrophobicContact CG2-CG 3.97Å; I401-L405 VanDerWaalsContact O-CB 3.3Å; I401-L405 WeakPolarHBondContact O-CB 3.12Å; I401-L405 WeakPolarHBondContact O-CG 3.37Å; I401-L405 PolarHBondContact O-N 3.18Å; G403-L405 PolarHBondContact O-N 3.24Å; L405-M407 VanDerWaalsContact C-N 3.34Å; L405-M407 PolarHBondContact O-N 2.94Å; L405-F408 PolarHBondContact O-N 2.94Å; L405-A409 WeakPolarHBondContact O-CB 3.41Å; L405-A409 PolarHBondContact O-N 2.81Å
406	A	85.5	Confident	87	Confident	63 Å²	63	54.5 Å²	54.5	52%	0.521	32%	0.323	S	S	.	.	H	α-helix	trans	-63.8	-40.2	178.8	0	0	0	0	0	111.9	G403 S410	G403-A406 PolarHBondContact O-N 2.78Å; A406-S410 WeakPolarHBondContact O-CB 3.28Å; A406-S410 PolarHBondContact O-N 2.93Å; A406-S410 PolarHBondContact O-OG 2.96Å
407	M	83.3	Confident	86.7	Confident	36 Å²	36	57.9 Å²	57.9	18%	0.177	34%	0.344	C	S	.	.	H	α-helix	trans	-67.7	-46.1	175.2	-70.7	-157.9	-54	0	0	112.3	V338 M378 G403 G404 L405 A409 S410 Y411	V338-M407 HydrophobicContact CB-CE 3.93Å; V338-M407 HydrophobicContact CG1-CE 3.46Å; V338-M407 VanDerWaalsContact CG1-CE 3.46Å; V338-M407 HydrophobicContact CG1-SD 4.48Å; V338-M407 HydrophobicContact CG2-CE 4.38Å; M378-M407 HydrophobicContact CE-CE 4.24Å; G403-M407 WeakPolarHBondContact O-CG 3.25Å; G403-M407 PolarHBondContact O-N 3.01Å; G404-M407 PolarHBondContact O-N 3.48Å; L405-M407 VanDerWaalsContact C-N 3.34Å; L405-M407 PolarHBondContact O-N 2.94Å; M407-A409 PolarHBondContact O-N 2.86Å; M407-S410 PolarHBondContact O-N 2.93Å; M407-S410 PolarHBondContact O-OG 3.49Å; M407-Y411 VanDerWaalsContact O-CB 3.3Å; M407-Y411 WeakPolarHBondContact O-CB 3.02Å; M407-Y411 PolarHBondContact O-N 2.83Å
408	F	86.7	Confident	86.2	Confident	58 Å²	58	58.4 Å²	58.4	25%	0.254	35%	0.346	S	S	.	.	H	α-helix	trans	-63.6	-43.6	-179.7	-168.3	-88.2	0	0	0	111.5	F335 M378 G404 L405 S410 V412	F335-F408 HydrophobicContact CE2-CD2 4.02Å; F335-F408 HydrophobicContact CZ-CD2 4.15Å; F335-F408 HydrophobicContact CZ-CE2 4.43Å; M378-F408 HydrophobicContact CB-CD2 4.27Å; M378-F408 WeakPolarHBondContact O-CG 3.48Å; G404-F408 VanDerWaalsContact O-CB 3.3Å; G404-F408 WeakPolarHBondContact O-CB 3.13Å; G404-F408 PolarHBondContact O-N 2.66Å; L405-F408 PolarHBondContact O-N 2.94Å; F408-S410 VanDerWaalsContact C-N 3.29Å; F408-S410 PolarHBondContact O-N 3.13Å; F408-V412 HydrophobicContact CD1-CG2 4.18Å; F408-V412 HydrophobicContact CD2-CG2 3.92Å; F408-V412 HydrophobicContact CE1-CG2 4.06Å; F408-V412 HydrophobicContact CE2-CG2 3.79Å; F408-V412 HydrophobicContact CG-CG2 4.11Å; F408-V412 HydrophobicContact CZ-CG2 3.87Å; F408-V412 WeakPolarHBondContact O-CB 3.2Å; F408-V412 WeakPolarHBondContact O-CG2 3.47Å; F408-V412 PolarHBondContact O-N 2.77Å
409	A	87	Confident	85.7	Confident	72 Å²	72	59.4 Å²	59.4	60%	0.595	35%	0.348	S	S	*	.	H	α-helix	trans	-67.4	-24.2	-180	0	0	0	0	0	114	L405 M407 P413	L405-A409 WeakPolarHBondContact O-CB 3.41Å; L405-A409 PolarHBondContact O-N 2.81Å; M407-A409 PolarHBondContact O-N 2.86Å; A409-P413 WeakPolarHBondContact O-CD 3.45Å; A409-P413 WeakPolarHBondContact O-CG 3.3Å
410	S	87.2	Confident	85.2	Confident	56 Å²	56	55.6 Å²	55.6	39%	0.392	35%	0.348	S	S	.	.	H	α-helix	trans	-93.9	-46.2	177.5	51	0	0	0	0	112.5	A406 M407 F408 E414	A406-S410 WeakPolarHBondContact O-CB 3.28Å; A406-S410 PolarHBondContact O-N 2.93Å; A406-S410 PolarHBondContact O-OG 2.96Å; M407-S410 PolarHBondContact O-N 2.93Å; M407-S410 PolarHBondContact O-OG 3.49Å; F408-S410 VanDerWaalsContact C-N 3.29Å; F408-S410 PolarHBondContact O-N 3.13Å; S410-E414 PolarHBondContact O-N 2.88Å
411	Y	85.7	Confident	84.3	Confident	10 Å²	10	56.6 Å²	56.6	4%	0.039	36%	0.36	C	S	.	.	H	α-helix	trans	-76.3	-36.7	-170.4	-70.9	9.5	0	0	0	112.4	M308 L331 I334 F335 M407 E414 I415	M308-Y411 WeakPolarHBondContact CE-OH 3.43Å; M308-Y411 HydrophobicContact SD-CE1 4.45Å; L331-Y411 HydrophobicContact CD2-CD1 3.72Å; L331-Y411 HydrophobicContact CD2-CD2 4.13Å; L331-Y411 HydrophobicContact CD2-CE1 3.84Å; L331-Y411 HydrophobicContact CD2-CE2 4.24Å; L331-Y411 HydrophobicContact CD2-CG 3.88Å; I334-Y411 HydrophobicContact CB-CE2 4.24Å; I334-Y411 HydrophobicContact CG2-CE2 3.87Å; F335-Y411 HydrophobicContact CB-CD2 4.24Å; F335-Y411 HydrophobicContact CD2-CD2 4.47Å; M407-Y411 VanDerWaalsContact O-CB 3.3Å; M407-Y411 WeakPolarHBondContact O-CB 3.02Å; M407-Y411 PolarHBondContact O-N 2.83Å; Y411-E414 PolarHBondContact O-N 2.84Å; Y411-I415 WeakPolarHBondContact O-CB 3.31Å; Y411-I415 WeakPolarHBondContact O-CD1 3.48Å; Y411-I415 WeakPolarHBondContact O-CG1 3.21Å; Y411-I415 PolarHBondContact O-N 2.91Å
412	V	86.5	Confident	83.4	Confident	60 Å²	60	64 Å²	64	36%	0.364	38%	0.384	S	S	.	.	H	α-helix	trans	-66.5	-47.5	-176.7	176.8	0	0	0	0	112.1	F408 E414 I415 A416	F408-V412 HydrophobicContact CD1-CG2 4.18Å; F408-V412 HydrophobicContact CD2-CG2 3.92Å; F408-V412 HydrophobicContact CE1-CG2 4.06Å; F408-V412 HydrophobicContact CE2-CG2 3.79Å; F408-V412 HydrophobicContact CG-CG2 4.11Å; F408-V412 HydrophobicContact CZ-CG2 3.87Å; F408-V412 WeakPolarHBondContact O-CB 3.2Å; F408-V412 WeakPolarHBondContact O-CG2 3.47Å; F408-V412 PolarHBondContact O-N 2.77Å; V412-E414 PolarHBondContact O-N 3.11Å; V412-I415 PolarHBondContact O-N 3.24Å; V412-A416 WeakPolarHBondContact O-CB 3.42Å; V412-A416 PolarHBondContact O-N 3.02Å
413	P	88.8	Confident	82.7	Confident	67 Å²	67	64 Å²	64	44%	0.435	38%	0.381	S	S	.	.	H	α-helix	trans	-60.6	-41.8	173.8	-25.1	36.2	0	0	0	113	A409 I415 A416 D417	A409-P413 WeakPolarHBondContact O-CD 3.45Å; A409-P413 WeakPolarHBondContact O-CG 3.3Å; P413-I415 PolarHBondContact O-N 2.99Å; P413-A416 WeakPolarHBondContact O-CB 3.03Å; P413-A416 PolarHBondContact O-N 3.46Å; P413-A416 VanDerWaalsContact O-N 3.14Å; P413-D417 PolarHBondContact O-N 2.73Å
414	E	86.5	Confident	82.7	Confident	42 Å²	42	68.6 Å²	68.6	20%	0.196	39%	0.39	C	S	.	.	H	α-helix	trans	-65.1	-40.9	179.7	-168.5	-179.6	164.5	0	0	111.9	R327 L331 S410 Y411 V412 A416 D417 L418	R327-E414 IonicContact CZ-OE1 2.65Å; R327-E414 IonicContact NE-OE1 2.83Å; R327-E414 PolarHBondContact NE-OE1 3.18Å; R327-E414 IonicContact NH2-OE1 3.76Å; R327-E414 PolarHBondContact NH2-OE1 2.83Å; R327-E414 VanDerWaalsContact NH2-OE1 3.16Å; R327-E414 IonicContact NH2-OE2 2.78Å; L331-E414 HydrophobicContact CD1-CB 4.14Å; L331-E414 HydrophobicContact CD1-CG 3.8Å; S410-E414 PolarHBondContact O-N 2.88Å; Y411-E414 PolarHBondContact O-N 2.84Å; V412-E414 PolarHBondContact O-N 3.11Å; E414-A416 VanDerWaalsContact C-N 3.32Å; E414-A416 PolarHBondContact O-N 3.04Å; E414-D417 PolarHBondContact O-N 2.77Å; E414-L418 HydrophobicContact CG-CD1 4.29Å; E414-L418 WeakPolarHBondContact O-CB 3.49Å; E414-L418 VanDerWaalsContact O-CG 3.22Å; E414-L418 WeakPolarHBondContact O-CG 3.38Å; E414-L418 PolarHBondContact O-N 3.19Å
415	I	83.4	Confident	82.9	Confident	28 Å²	28	70.4 Å²	70.4	14%	0.144	40%	0.396	C	S	.	.	H	α-helix	trans	-61.6	-42.9	172.8	-70.5	166	0	0	0	110.4	L328 L331 L332 Y411 V412 P413 L418 I419	L328-I415 HydrophobicContact CD1-CB 4.47Å; L328-I415 HydrophobicContact CD1-CG1 4.27Å; L328-I415 HydrophobicContact CD1-CG2 3.94Å; L331-I415 HydrophobicContact CB-CD1 4.19Å; L331-I415 HydrophobicContact CB-CG1 4.08Å; L331-I415 HydrophobicContact CD1-CG1 4.04Å; L332-I415 HydrophobicContact CD2-CD1 4.07Å; Y411-I415 WeakPolarHBondContact O-CB 3.31Å; Y411-I415 WeakPolarHBondContact O-CD1 3.48Å; Y411-I415 WeakPolarHBondContact O-CG1 3.21Å; Y411-I415 PolarHBondContact O-N 2.91Å; V412-I415 PolarHBondContact O-N 3.24Å; P413-I415 PolarHBondContact O-N 2.99Å; I415-L418 PolarHBondContact O-N 3.24Å; I415-I419 HydrophobicContact CG2-CD1 3.74Å; I415-I419 VanDerWaalsContact O-CG1 3.28Å; I415-I419 WeakPolarHBondContact O-CG1 3.2Å; I415-I419 PolarHBondContact O-N 2.7Å
416	A	84.7	Confident	82.7	Confident	58 Å²	58	68.7 Å²	68.7	48%	0.479	39%	0.393	S	S	.	.	H	α-helix	trans	-62.8	-44.5	178.5	0	0	0	0	0	112	V412 P413 E414 I419 G420	V412-A416 WeakPolarHBondContact O-CB 3.42Å; V412-A416 PolarHBondContact O-N 3.02Å; P413-A416 WeakPolarHBondContact O-CB 3.03Å; P413-A416 PolarHBondContact O-N 3.46Å; P413-A416 VanDerWaalsContact O-N 3.14Å; E414-A416 VanDerWaalsContact C-N 3.32Å; E414-A416 PolarHBondContact O-N 3.04Å; A416-I419 PolarHBondContact O-N 2.82Å; A416-G420 PolarHBondContact O-N 2.92Å
417	D	84.9	Confident	82.8	Confident	117 Å²	117	68.2 Å²	68.2	63%	0.626	40%	0.395	S	S	*	.	H	α-helix	trans	-64.8	-41.8	177.3	-72.6	-18.3	0	0	0	112	P413 E414 I419 G420 A421	P413-D417 PolarHBondContact O-N 2.73Å; E414-D417 PolarHBondContact O-N 2.77Å; D417-I419 VanDerWaalsContact C-N 3.33Å; D417-I419 PolarHBondContact O-N 3.18Å; D417-G420 PolarHBondContact O-N 3.15Å; D417-A421 WeakPolarHBondContact O-CB 3.49Å; D417-A421 PolarHBondContact O-N 2.9Å
418	L	79	Confident	83.2	Confident	22 Å²	22	73.5 Å²	73.5	12%	0.115	42%	0.419	C	S	.	.	H	α-helix	trans	-64.6	-36.3	178	-73.7	172.2	0	0	0	112.5	R324 R327 L328 L331 E414 I415	R324-L418 HydrophobicContact CB-CD2 4.08Å; R324-L418 HydrophobicContact CG-CD2 4.01Å; R327-L418 HydrophobicContact CB-CD1 4.24Å; R327-L418 HydrophobicContact CG-CD1 3.97Å; L328-L418 HydrophobicContact CB-CD1 4.38Å; L331-L418 HydrophobicContact CD1-CD1 4.06Å; E414-L418 HydrophobicContact CG-CD1 4.29Å; E414-L418 WeakPolarHBondContact O-CB 3.49Å; E414-L418 VanDerWaalsContact O-CG 3.22Å; E414-L418 WeakPolarHBondContact O-CG 3.38Å; E414-L418 PolarHBondContact O-N 3.19Å; I415-L418 PolarHBondContact O-N 3.24Å
419	I	80.4	Confident	83.5	Confident	110 Å²	110	70.9 Å²	70.9	56%	0.564	41%	0.407	S	S	*	.	H	α-helix	trans	-75.4	-37.8	174.6	-66	169.7	0	0	0	110.7	L328 I415 A416 D417	L328-I419 HydrophobicContact CD1-CG1 4.43Å; I415-I419 HydrophobicContact CG2-CD1 3.74Å; I415-I419 VanDerWaalsContact O-CG1 3.28Å; I415-I419 WeakPolarHBondContact O-CG1 3.2Å; I415-I419 PolarHBondContact O-N 2.7Å; A416-I419 PolarHBondContact O-N 2.82Å; D417-I419 VanDerWaalsContact C-N 3.33Å; D417-I419 PolarHBondContact O-N 3.18Å
420	G	77.1	Confident	83.7	Confident	59 Å²	59	76 Å²	76	61%	0.608	42%	0.416	S	S	*	.	H	α-helix	trans	-71.8	-25.8	-178.3	0	0	0	0	0	114.6	A416 D417 R422	A416-G420 PolarHBondContact O-N 2.92Å; D417-G420 PolarHBondContact O-N 3.15Å; G420-R422 PolarHBondContact O-N 2.54Å
421	A	69.5	Low	83.5	Confident	42 Å²	42	75.5 Å²	75.5	35%	0.347	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	21.1	-179.2	0	0	0	0	0	115.1	R324 D417	R324-A421 PolarHBondContact NH1-O 3.03Å; D417-A421 WeakPolarHBondContact O-CB 3.49Å; D417-A421 PolarHBondContact O-N 2.9Å
422	R	72.1	Confident	83.4	Confident	221 Å²	221	80 Å²	80	83%	0.834	43%	0.434	S	S	*	.			trans	-68.6	126.6	173.1	-176.2	176.8	177.6	177.8	-1.1	109.1	G420 K424	G420-R422 PolarHBondContact O-N 2.54Å; R422-K424 PolarHBondContact O-N 2.98Å
423	Q	72.2	Confident	83	Confident	124 Å²	124	86.7 Å²	86.7	58%	0.579	46%	0.461	S	S	*	.			trans	-61.6	112.5	175.4	-71.2	179.5	-38.1	0	0	109.7
424	K	84.3	Confident	82.5	Confident	134 Å²	134	87 Å²	87	58%	0.583	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-42.2	179.4	-178.8	178.9	173.4	-173.9	0	112	R422 E481	R422-K424 PolarHBondContact O-N 2.98Å; K424-E481 IonicContact NZ-OE1 3.39Å; K424-E481 PolarHBondContact NZ-OE1 3.47Å; K424-E481 IonicContact NZ-OE2 2.83Å; K424-E481 PolarHBondContact NZ-OE2 2.9Å
425	Y	88.8	Confident	82.4	Confident	38 Å²	38	88.6 Å²	88.6	15%	0.149	48%	0.482	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	30.6	-175.5	-56.1	-68	0	0	0	113.2	P475 P476 E481 F493 Q495	Y425-P475 HydrophobicContact CD2-CB 4.5Å; Y425-P476 HydrophobicContact CD2-CG 4.27Å; Y425-P476 HydrophobicContact CE1-CG 4.29Å; Y425-P476 VanDerWaalsContact CE2-CD 3.47Å; Y425-P476 HydrophobicContact CE2-CG 3.58Å; Y425-E481 WeakPolarHBondContact OH-CG 3.4Å; Y425-E481 PolarHBondContact OH-OE2 2.87Å; Y425-F493 HydrophobicContact CD1-CB 4.46Å; Y425-F493 AromaticContact CD1-CD1 3.77Å; Y425-F493 HydrophobicContact CD1-CD1 3.77Å; Y425-F493 HydrophobicContact CD2-CD1 4.24Å; Y425-F493 HydrophobicContact CD2-CE1 4.36Å; Y425-F493 HydrophobicContact CE1-CD1 4.41Å; Y425-F493 AromaticContact CG-CD1 3.67Å; Y425-F493 HydrophobicContact CG-CD1 3.67Å; Y425-F493 HydrophobicContact CG-CE1 4.11Å; Y425-Q495 PolarHBondContact O-N 2.91Å
426	G	84.3	Confident	82.8	Confident	25 Å²	25	91.2 Å²	91.2	26%	0.258	49%	0.49	S	S	.	.			trans	-88	-157.4	169.5	0	0	0	0	0	111.7
427	G	87.1	Confident	83.2	Confident	53 Å²	53	88.7 Å²	88.7	55%	0.546	47%	0.468	S	S	.	.	S	Bend	trans	83.5	178.7	179.2	0	0	0	0	0	113	R506	G427-R506 WeakPolarHBondContact O-CD 3.21Å; G427-R506 WeakPolarHBondContact O-CG 3.44Å
428	Q	90.5	Very high	83.7	Confident	148 Å²	148	83.1 Å²	83.1	69%	0.692	44%	0.439	S	S	*	.			trans	-113.5	145	-178.8	-72.7	174.4	-7.3	0	0	110	R506	Q428-R506 HydrophobicContact CB-CG 4.27Å; Q428-R506 HydrophobicContact CG-CB 4.33Å; Q428-R506 HydrophobicContact CG-CG 3.73Å
429	Y	93.7	Very high	84.5	Confident	3 Å²	3	82 Å²	82	1%	0.012	43%	0.433	C	S	.	.			trans	-65.4	132.9	171.7	174.1	-116	0	0	0	110.4	H437 E467 L469 F494 R506 K508	Y429-H437 HydrophobicContact CE1-CB 4.16Å; Y429-H437 AromaticContact CE1-CD2 3.79Å; Y429-H437 AromaticContact CE1-CE1 3.66Å; Y429-H437 AromaticContact CE1-CG 3.55Å; Y429-H437 AromaticContact CE1-ND1 3.48Å; Y429-H437 WeakPolarHBondContact CE1-ND1 3.37Å; Y429-H437 AromaticContact CE1-NE2 3.83Å; Y429-H437 AromaticContact CZ-CG 3.89Å; Y429-H437 WeakPolarHBondContact OH-CB 3.41Å; Y429-E467 PolarHBondContact OH-OE2 3.2Å; Y429-L469 HydrophobicContact CD1-CD2 3.74Å; Y429-L469 HydrophobicContact CD2-CD1 4.34Å; Y429-L469 HydrophobicContact CD2-CD2 3.6Å; Y429-L469 HydrophobicContact CD2-CG 4.12Å; Y429-L469 HydrophobicContact CE1-CD2 4.2Å; Y429-L469 HydrophobicContact CE2-CD1 4.03Å; Y429-L469 HydrophobicContact CE2-CD2 4.08Å; Y429-L469 HydrophobicContact CE2-CG 4.31Å; Y429-L469 HydrophobicContact CG-CD2 3.42Å; Y429-L469 VanDerWaalsContact CG-CD2 3.42Å; Y429-L469 HydrophobicContact CG-CG 4.42Å; Y429-F494 HydrophobicContact CD2-CE2 4.5Å; Y429-F494 HydrophobicContact CD2-CZ 4.48Å; Y429-R506 PolarHBondContact N-O 3.12Å; Y429-K508 HydrophobicContact CD1-CB 4.39Å; Y429-K508 HydrophobicContact CD1-CD 4.08Å; Y429-K508 HydrophobicContact CD1-CG 4.38Å
430	K	90.9	Very high	85.3	Confident	179 Å²	179	76.8 Å²	76.8	78%	0.778	41%	0.406	S	S	*	.			trans	-104.4	100.6	178.2	-69.3	-177	-179	177.8	0	108.3	E432	K430-E432 PolarHBondContact O-N 2.79Å
431	S	83.1	Confident	86.2	Confident	45 Å²	45	74 Å²	74	32%	0.315	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-61.7	126	177.3	48.3	0	0	0	0	111.4	K508 E511	S431-K508 PolarHBondContact OG-NZ 3.27Å; S431-E511 VanDerWaalsContact CB-OE2 3.29Å; S431-E511 WeakPolarHBondContact CB-OE2 3.33Å; S431-E511 PolarHBondContact OG-OE2 3.45Å
432	E	82.8	Confident	87.4	Confident	105 Å²	105	72.3 Å²	72.3	49%	0.491	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-84.2	138.2	170.6	-67	-167.5	165.3	0	0	110.2	K430 G434 K435	K430-E432 PolarHBondContact O-N 2.79Å; E432-G434 PolarHBondContact O-N 3.12Å; E432-G434 VanDerWaalsContact O-N 3.12Å; E432-K435 HydrophobicContact CB-CB 4.41Å; E432-K435 HydrophobicContact CB-CD 4.26Å; E432-K435 HydrophobicContact CB-CG 4.49Å; E432-K435 PolarHBondContact O-N 2.66Å; E432-K435 WeakPolarHBondContact OE2-CD 3.33Å; E432-K435 WeakPolarHBondContact OE2-CE 3.31Å; E432-K435 IonicContact OE2-NZ 2.81Å; E432-K435 PolarHBondContact OE2-NZ 3.23Å
433	H	79.4	Confident	88.4	Confident	201 Å²	201	65.5 Å²	65.5	93%	0.931	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	116.4	-177.6	-168.5	68.7	0	0	0	111.1
434	G	78.9	Confident	89.5	Confident	72 Å²	72	60 Å²	60	74%	0.742	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.7	-15.7	175.7	0	0	0	0	0	114.8	E432	E432-G434 PolarHBondContact O-N 3.12Å; E432-G434 VanDerWaalsContact O-N 3.12Å
435	K	84.2	Confident	89.8	Confident	77 Å²	77	55.4 Å²	55.4	34%	0.335	30%	0.296	S	S	.	.			trans	-86.5	140.6	169.7	-69.9	-172.2	-179	166.2	0	110.2	E432 E467	E432-K435 HydrophobicContact CB-CB 4.41Å; E432-K435 HydrophobicContact CB-CD 4.26Å; E432-K435 HydrophobicContact CB-CG 4.49Å; E432-K435 PolarHBondContact O-N 2.66Å; E432-K435 WeakPolarHBondContact OE2-CD 3.33Å; E432-K435 WeakPolarHBondContact OE2-CE 3.31Å; E432-K435 IonicContact OE2-NZ 2.81Å; E432-K435 PolarHBondContact OE2-NZ 3.23Å; K435-E467 HydrophobicContact CD-CG 4.26Å; K435-E467 WeakPolarHBondContact CD-OE1 3.41Å; K435-E467 WeakPolarHBondContact CE-OE1 3.46Å; K435-E467 IonicContact NZ-OE1 2.7Å; K435-E467 PolarHBondContact NZ-OE1 2.88Å
436	R	90.2	Very high	89.9	Confident	83 Å²	83	57.3 Å²	57.3	31%	0.313	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	155	171.8	-68.9	177.8	-70.1	151.9	-0.5	108.5	V466 E467 D513	R436-V466 WeakPolarHBondContact O-CA 3.47Å; R436-E467 PolarHBondContact O-N 3.11Å; R436-D513 HydrophobicContact CB-CB 4.4Å; R436-D513 IonicContact CZ-OD2 2.92Å; R436-D513 IonicContact NH1-OD2 2.77Å; R436-D513 PolarHBondContact NH1-OD2 3.22Å
437	H	93.7	Very high	89.9	Confident	4 Å²	4	60.6 Å²	60.6	2%	0.019	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	153.4	175.1	71.9	-78.4	0	0	0	112.1	Y429 E467 L469 V507 K508 D513	Y429-H437 HydrophobicContact CE1-CB 4.16Å; Y429-H437 AromaticContact CE1-CD2 3.79Å; Y429-H437 AromaticContact CE1-CE1 3.66Å; Y429-H437 AromaticContact CE1-CG 3.55Å; Y429-H437 AromaticContact CE1-ND1 3.48Å; Y429-H437 WeakPolarHBondContact CE1-ND1 3.37Å; Y429-H437 AromaticContact CE1-NE2 3.83Å; Y429-H437 AromaticContact CZ-CG 3.89Å; Y429-H437 WeakPolarHBondContact OH-CB 3.41Å; H437-E467 CarbonylContact C-O 3.59Å; H437-E467 WeakPolarHBondContact CA-O 3.36Å; H437-E467 HydrophobicContact CB-CB 4.22Å; H437-L469 HydrophobicContact CB-CD1 3.5Å; H437-L469 VanDerWaalsContact CB-CD1 3.5Å; H437-V507 PolarHBondContact NE2-O 2.99Å; H437-K508 PolarHBondContact NE2-O 3.11Å; H437-K508 VanDerWaalsContact NE2-O 3.15Å; H437-D513 PolarHBondContact O-N 3.4Å
438	I	95.3	Very high	90	Very high	0 Å²	0	59 Å²	59	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	148.3	173.5	61.2	159.4	0	0	0	109.9	V440 F452 F456 V466 E467 V468 L469 A514 L516 Y1069	I438-V440 HydrophobicContact CD1-CG2 3.99Å; I438-V440 HydrophobicContact CG1-CG2 4.48Å; I438-F452 HydrophobicContact CD1-CZ 4.09Å; I438-F456 HydrophobicContact CD1-CD2 4.39Å; I438-F456 HydrophobicContact CD1-CE1 3.9Å; I438-F456 HydrophobicContact CD1-CE2 3.61Å; I438-F456 HydrophobicContact CD1-CZ 3.33Å; I438-F456 HydrophobicContact CG1-CZ 4.15Å; I438-V466 HydrophobicContact CG1-CG1 4.27Å; I438-V466 HydrophobicContact CG2-CG1 3.84Å; I438-E467 PolarHBondContact N-O 3.32Å; I438-V468 HydrophobicContact CD1-CB 4.49Å; I438-V468 HydrophobicContact CD1-CG1 4.1Å; I438-V468 HydrophobicContact CD1-CG2 4.05Å; I438-V468 HydrophobicContact CG1-CB 4.27Å; I438-V468 HydrophobicContact CG1-CG1 4.19Å; I438-V468 HydrophobicContact CG1-CG2 4.08Å; I438-L469 PolarHBondContact O-N 3.02Å; I438-A514 WeakPolarHBondContact CA-O 3.48Å; I438-A514 HydrophobicContact CG2-CB 4.47Å; I438-L516 HydrophobicContact CD1-CD1 3.75Å; I438-L516 HydrophobicContact CD1-CG 4.42Å; I438-Y1069 HydrophobicContact CG2-CD2 4.32Å; I438-Y1069 HydrophobicContact CG2-CE2 3.56Å
439	V	96.8	Very high	90	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	117	177.6	179.6	0	0	0	0	109	L469 I471 V507 V509 A512 A514 C515 L516	V439-L469 CarbonylContact C-O 3.24Å; V439-L469 WeakPolarHBondContact CA-O 3.13Å; V439-I471 HydrophobicContact CG1-CG2 3.75Å; V439-V507 HydrophobicContact CG1-CG2 4.12Å; V439-V507 HydrophobicContact CG2-CB 4.44Å; V439-V507 HydrophobicContact CG2-CG2 4.12Å; V439-V509 HydrophobicContact CG2-CG2 4.34Å; V439-A512 HydrophobicContact CG2-CB 4.04Å; V439-A514 PolarHBondContact N-O 3.03Å; V439-A514 VanDerWaalsContact N-O 3.08Å; V439-C515 CarbonylContact O-C 3.57Å; V439-C515 VanDerWaalsContact O-CA 3.25Å; V439-C515 WeakPolarHBondContact O-CA 3.36Å; V439-C515 PolarHBondContact O-SG 3.21Å; V439-L516 PolarHBondContact O-N 2.93Å
440	V	96.8	Very high	89.7	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	126	178.6	-171.2	0	0	0	0	109.6	I438 I444 F452 V468 L469 F470 I471 L516 L518	I438-V440 HydrophobicContact CD1-CG2 3.99Å; I438-V440 HydrophobicContact CG1-CG2 4.48Å; V440-I444 HydrophobicContact CG1-CD1 4.12Å; V440-F452 HydrophobicContact CG2-CE1 4.05Å; V440-F452 HydrophobicContact CG2-CZ 4.13Å; V440-V468 HydrophobicContact CG2-CG1 3.65Å; V440-L469 PolarHBondContact N-O 3.42Å; V440-F470 HydrophobicContact CB-CD1 3.73Å; V440-F470 HydrophobicContact CB-CE1 3.71Å; V440-F470 HydrophobicContact CB-CZ 4.48Å; V440-F470 HydrophobicContact CG1-CD1 3.91Å; V440-F470 HydrophobicContact CG1-CE1 3.61Å; V440-F470 HydrophobicContact CG2-CE1 4.23Å; V440-F470 WeakPolarHBondContact O-CA 3.49Å; V440-I471 PolarHBondContact O-N 2.78Å; V440-L516 WeakPolarHBondContact CA-O 3.44Å; V440-L516 HydrophobicContact CG1-CB 4.39Å; V440-L516 HydrophobicContact CG2-CB 4.24Å; V440-L516 HydrophobicContact CG2-CD1 4.2Å; V440-L516 HydrophobicContact CG2-CG 4.48Å; V440-L518 HydrophobicContact CG1-CD1 3.79Å; V440-L518 HydrophobicContact CG1-CG 4.01Å
441	C	96.5	Very high	89.4	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.007	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	-180	-178.6	73.9	0	0	0	0	111.5	I471 V498 L516 V517 L518	C441-I471 HydrophobicContact CB-CG2 3.58Å; C441-V498 HydrophobicContact CB-CG1 3.57Å; C441-L516 PolarHBondContact N-O 3.17Å; C441-V517 WeakPolarHBondContact O-CA 3.48Å; C441-L518 PolarHBondContact O-N 2.75Å
442	G	94.3	Very high	89.6	Confident	5 Å²	5	44.9 Å²	44.9	5%	0.052	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	99.2	-131.2	-177.2	0	0	0	0	0	111.8	I444 H472 L518	G442-I444 PolarHBondContact O-N 2.86Å; G442-H472 PolarHBondContact O-ND1 2.77Å; G442-L518 WeakPolarHBondContact CA-O 3.27Å
443	Y	93.6	Very high	89.9	Confident	78 Å²	78	40 Å²	40	31%	0.306	21%	0.206	S	C	.	.	S	Bend	trans	-84.1	96.5	-179.5	-171.2	-108.6	0	0	0	112.1	T445 S448 L518 N520	Y443-T445 HydrophobicContact CD1-CG2 4.24Å; Y443-T445 HydrophobicContact CD2-CG2 4.49Å; Y443-T445 HydrophobicContact CE1-CG2 3.61Å; Y443-T445 HydrophobicContact CE2-CG2 3.91Å; Y443-T445 VanDerWaalsContact CZ-CG2 3.43Å; Y443-S448 PolarHBondContact O-OG 3.38Å; Y443-L518 PolarHBondContact N-O 3.19Å; Y443-N520 HydrophobicContact CD1-CB 3.96Å; Y443-N520 HydrophobicContact CD2-CB 3.58Å; Y443-N520 HydrophobicContact CE1-CB 4.23Å; Y443-N520 HydrophobicContact CE2-CB 3.88Å; Y443-N520 HydrophobicContact CG-CB 3.61Å
444	I	94.3	Very high	90.2	Very high	10 Å²	10	35.2 Å²	35.2	5%	0.051	18%	0.184	C	C	.	.			trans	-105.4	104.6	-177.1	-53	-51.8	0	0	0	109.3	V440 G442 V449 F470 H472 L480 L518	V440-I444 HydrophobicContact CG1-CD1 4.12Å; G442-I444 PolarHBondContact O-N 2.86Å; I444-V449 HydrophobicContact CG2-CG2 3.68Å; I444-F470 HydrophobicContact CD1-CD1 3.87Å; I444-F470 HydrophobicContact CD1-CE1 4.31Å; I444-F470 HydrophobicContact CG1-CD1 4.49Å; I444-F470 HydrophobicContact CG2-CD1 4.2Å; I444-H472 HydrophobicContact CB-CB 4.05Å; I444-H472 HydrophobicContact CG1-CB 3.94Å; I444-L480 HydrophobicContact CG2-CD2 4.11Å; I444-L518 HydrophobicContact CD1-CD1 4.05Å
445	T	91.6	Very high	90.3	Very high	37 Å²	37	32.6 Å²	32.6	23%	0.227	15%	0.153	C	C	.	.			trans	-132.7	171	174.2	60.2	0	0	0	0	110.2	Y443 E447 S448 V449	Y443-T445 HydrophobicContact CD1-CG2 4.24Å; Y443-T445 HydrophobicContact CD2-CG2 4.49Å; Y443-T445 HydrophobicContact CE1-CG2 3.61Å; Y443-T445 HydrophobicContact CE2-CG2 3.91Å; Y443-T445 VanDerWaalsContact CZ-CG2 3.43Å; T445-E447 VanDerWaalsContact C-N 3.33Å; T445-E447 PolarHBondContact O-N 3.28Å; T445-S448 PolarHBondContact N-OG 3.43Å; T445-S448 VanDerWaalsContact N-OG 3.13Å; T445-S448 PolarHBondContact O-OG 2.94Å; T445-S448 PolarHBondContact OG1-N 3.38Å; T445-S448 PolarHBondContact OG1-OG 2.73Å; T445-V449 VanDerWaalsContact O-CB 3.26Å; T445-V449 WeakPolarHBondContact O-CB 3.38Å; T445-V449 WeakPolarHBondContact O-CG2 3.23Å; T445-V449 PolarHBondContact O-N 3.5Å; T445-V449 VanDerWaalsContact O-N 3.08Å
446	F	90.4	Very high	90.4	Very high	77 Å²	77	28.9 Å²	28.9	34%	0.338	14%	0.137	S	C	.	.	H	α-helix	trans	-55.7	-47.6	176.5	175	-99.8	0	0	0	112.2	S450 E479 L483	F446-S450 WeakPolarHBondContact O-CB 3.3Å; F446-S450 PolarHBondContact O-N 3.22Å; F446-E479 HydrophobicContact CD2-CB 3.91Å; F446-E479 HydrophobicContact CE2-CB 4.35Å; F446-E479 HydrophobicContact CG-CB 4.28Å; F446-L483 HydrophobicContact CD2-CD2 4.39Å; F446-L483 HydrophobicContact CE2-CB 4.41Å; F446-L483 HydrophobicContact CE2-CD2 4.4Å
447	E	84.5	Confident	90.2	Very high	95 Å²	95	25.9 Å²	25.9	44%	0.444	13%	0.127	S	C	.	.	H	α-helix	trans	-62.9	-52.9	-178.6	-172.6	178.2	-172.9	0	0	112.1	T445 V449 S450 H451	T445-E447 VanDerWaalsContact C-N 3.33Å; T445-E447 PolarHBondContact O-N 3.28Å; E447-V449 VanDerWaalsContact C-N 3.32Å; E447-V449 PolarHBondContact O-N 2.9Å; E447-S450 PolarHBondContact O-N 2.76Å; E447-H451 PolarHBondContact O-CD2 3.23Å; E447-H451 PolarHBondContact O-N 2.96Å
448	S	87.7	Confident	89.7	Confident	18 Å²	18	27.3 Å²	27.3	13%	0.126	13%	0.134	C	C	.	.	H	α-helix	trans	-63.6	-38.1	-178.1	70.2	0	0	0	0	112.5	Y443 T445 F452	Y443-S448 PolarHBondContact O-OG 3.38Å; T445-S448 PolarHBondContact N-OG 3.43Å; T445-S448 VanDerWaalsContact N-OG 3.13Å; T445-S448 PolarHBondContact O-OG 2.94Å; T445-S448 PolarHBondContact OG1-N 3.38Å; T445-S448 PolarHBondContact OG1-OG 2.73Å; S448-F452 VanDerWaalsContact O-CB 3.31Å; S448-F452 WeakPolarHBondContact O-CB 3.26Å; S448-F452 PolarHBondContact O-N 3.02Å
449	V	90.9	Very high	88.7	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-75.1	-35.9	178.9	176.7	0	0	0	0	111.6	I444 T445 E447 F452 L453 F470 L480 L483 F484	I444-V449 HydrophobicContact CG2-CG2 3.68Å; T445-V449 VanDerWaalsContact O-CB 3.26Å; T445-V449 WeakPolarHBondContact O-CB 3.38Å; T445-V449 WeakPolarHBondContact O-CG2 3.23Å; T445-V449 PolarHBondContact O-N 3.5Å; T445-V449 VanDerWaalsContact O-N 3.08Å; E447-V449 VanDerWaalsContact C-N 3.32Å; E447-V449 PolarHBondContact O-N 2.9Å; V449-F452 PolarHBondContact O-N 3.21Å; V449-L453 HydrophobicContact CG1-CD1 3.61Å; V449-L453 HydrophobicContact CG1-CG 3.9Å; V449-L453 VanDerWaalsContact O-CB 3.32Å; V449-L453 WeakPolarHBondContact O-CB 3.5Å; V449-L453 VanDerWaalsContact O-CG 3.28Å; V449-L453 WeakPolarHBondContact O-CG 3.27Å; V449-L453 PolarHBondContact O-N 3.34Å; V449-F470 HydrophobicContact CG1-CE1 4.1Å; V449-F470 HydrophobicContact CG1-CE2 4.22Å; V449-F470 HydrophobicContact CG1-CZ 3.7Å; V449-F470 HydrophobicContact CG2-CD1 4.33Å; V449-F470 HydrophobicContact CG2-CE1 3.82Å; V449-F470 HydrophobicContact CG2-CZ 4.27Å; V449-L480 HydrophobicContact CB-CD1 3.84Å; V449-L480 HydrophobicContact CG1-CD1 3.87Å; V449-L480 HydrophobicContact CG2-CD1 4.01Å; V449-L483 HydrophobicContact CB-CD2 4.31Å; V449-L483 HydrophobicContact CG1-CD2 3.8Å; V449-F484 HydrophobicContact CG1-CE1 3.94Å
450	S	88.1	Confident	87.5	Confident	23 Å²	23	40.4 Å²	40.4	16%	0.161	20%	0.198	C	C	.	.	H	α-helix	trans	-62.1	-52.2	178.4	-174.2	0	0	0	0	111	F446 E447 F452 L453 Q454	F446-S450 WeakPolarHBondContact O-CB 3.3Å; F446-S450 PolarHBondContact O-N 3.22Å; E447-S450 PolarHBondContact O-N 2.76Å; S450-F452 PolarHBondContact O-N 2.91Å; S450-L453 PolarHBondContact O-N 3.27Å; S450-Q454 WeakPolarHBondContact O-CB 3.32Å; S450-Q454 VanDerWaalsContact O-CG 3.28Å; S450-Q454 WeakPolarHBondContact O-CG 3.46Å; S450-Q454 PolarHBondContact O-N 3.09Å
451	H	83.8	Confident	86.5	Confident	53 Å²	53	42.5 Å²	42.5	25%	0.245	21%	0.205	C	C	.	.	H	α-helix	trans	-59.8	-45.6	176.6	-71.7	-65.4	0	0	0	111.7	E447 L453 D455 D1062	E447-H451 PolarHBondContact O-CD2 3.23Å; E447-H451 PolarHBondContact O-N 2.96Å; H451-L453 PolarHBondContact O-N 3.4Å; H451-D455 PolarHBondContact O-N 3.05Å; H451-D1062 HydrophobicContact CB-CB 4.43Å
452	F	88.4	Confident	85	Confident	3 Å²	3	47.4 Å²	47.4	1%	0.013	23%	0.228	C	C	.	.	H	α-helix	trans	-60.4	-45.6	177.7	174.7	-100.4	0	0	0	112.8	I438 V440 S448 V449 S450 F456 V468 F470 L516 M1065	I438-F452 HydrophobicContact CD1-CZ 4.09Å; V440-F452 HydrophobicContact CG2-CE1 4.05Å; V440-F452 HydrophobicContact CG2-CZ 4.13Å; S448-F452 VanDerWaalsContact O-CB 3.31Å; S448-F452 WeakPolarHBondContact O-CB 3.26Å; S448-F452 PolarHBondContact O-N 3.02Å; V449-F452 PolarHBondContact O-N 3.21Å; S450-F452 PolarHBondContact O-N 2.91Å; F452-F456 HydrophobicContact CD1-CB 4.47Å; F452-F456 HydrophobicContact CE1-CB 4.07Å; F452-F456 HydrophobicContact CE1-CD2 4.34Å; F452-F456 HydrophobicContact CE1-CG 4.09Å; F452-F456 HydrophobicContact CE2-CB 4.26Å; F452-F456 AromaticContact CE2-CD2 3.89Å; F452-F456 HydrophobicContact CE2-CD2 3.89Å; F452-F456 HydrophobicContact CE2-CG 4.31Å; F452-F456 HydrophobicContact CZ-CB 3.95Å; F452-F456 HydrophobicContact CZ-CD1 4.47Å; F452-F456 AromaticContact CZ-CD2 3.52Å; F452-F456 HydrophobicContact CZ-CD2 3.52Å; F452-F456 HydrophobicContact CZ-CE2 4.14Å; F452-F456 AromaticContact CZ-CG 3.73Å; F452-F456 HydrophobicContact CZ-CG 3.73Å; F452-F456 WeakPolarHBondContact O-CB 3.1Å; F452-F456 PolarHBondContact O-N 3Å; F452-V468 HydrophobicContact CE1-CG1 4.03Å; F452-F470 HydrophobicContact CD1-CZ 4.13Å; F452-F470 HydrophobicContact CE1-CZ 4.31Å; F452-L516 HydrophobicContact CE2-CD1 3.54Å; F452-L516 HydrophobicContact CZ-CD1 3.51Å; F452-M1065 HydrophobicContact CD2-CB 4.41Å; F452-M1065 HydrophobicContact CE2-CB 4.48Å
453	L	89.1	Confident	83.4	Confident	4 Å²	4	51.4 Å²	51.4	2%	0.021	25%	0.248	C	C	.	.	H	α-helix	trans	-73.3	-33.9	-177.1	-71.3	-178.4	0	0	0	113	V449 S450 H451 D455 F456 L457 F470 L483 V491	V449-L453 HydrophobicContact CG1-CD1 3.61Å; V449-L453 HydrophobicContact CG1-CG 3.9Å; V449-L453 VanDerWaalsContact O-CB 3.32Å; V449-L453 WeakPolarHBondContact O-CB 3.5Å; V449-L453 VanDerWaalsContact O-CG 3.28Å; V449-L453 WeakPolarHBondContact O-CG 3.27Å; V449-L453 PolarHBondContact O-N 3.34Å; S450-L453 PolarHBondContact O-N 3.27Å; H451-L453 PolarHBondContact O-N 3.4Å; L453-D455 VanDerWaalsContact C-N 3.29Å; L453-D455 PolarHBondContact O-N 3.14Å; L453-F456 PolarHBondContact O-N 2.88Å; L453-L457 HydrophobicContact CD2-CD1 3.91Å; L453-L457 HydrophobicContact CD2-CG 4.26Å; L453-L457 WeakPolarHBondContact O-CB 3.4Å; L453-L457 PolarHBondContact O-N 3.45Å; L453-F470 HydrophobicContact CD2-CE2 4.25Å; L453-F470 HydrophobicContact CD2-CZ 4.16Å; L453-F470 HydrophobicContact CG-CZ 4.42Å; L453-L483 HydrophobicContact CD1-CD2 4.14Å; L453-L483 HydrophobicContact CD1-CG 4.14Å; L453-V491 HydrophobicContact CD1-CG2 4.29Å; L453-V491 HydrophobicContact CD2-CG2 4Å
454	Q	84.3	Confident	81.9	Confident	100 Å²	100	48.7 Å²	48.7	47%	0.467	24%	0.24	S	C	.	.	H	α-helix	trans	-56.5	-45.1	175.3	-80.1	173.1	-22.7	0	0	111.2	S450 H458	S450-Q454 WeakPolarHBondContact O-CB 3.32Å; S450-Q454 VanDerWaalsContact O-CG 3.28Å; S450-Q454 WeakPolarHBondContact O-CG 3.46Å; S450-Q454 PolarHBondContact O-N 3.09Å; Q454-H458 WeakPolarHBondContact O-CB 3.42Å
455	D	82.5	Confident	81	Confident	16 Å²	16	54.1 Å²	54.1	9%	0.086	27%	0.269	C	S	.	.	H	α-helix	trans	-78.1	-47.7	176.4	-73.1	-47.2	0	0	0	112.1	H451 L453 L457 H458 R461 M606 S1063	H451-D455 PolarHBondContact O-N 3.05Å; L453-D455 VanDerWaalsContact C-N 3.29Å; L453-D455 PolarHBondContact O-N 3.14Å; D455-L457 VanDerWaalsContact C-N 3.34Å; D455-L457 PolarHBondContact O-N 3.17Å; D455-H458 PolarHBondContact O-N 3.1Å; D455-R461 PolarHBondContact O-NE 3.34Å; D455-M606 HydrophobicContact CB-CE 3.63Å; D455-M606 WeakPolarHBondContact O-CE 3.33Å; D455-M606 PolarHBondContact OD1-N 3.22Å; D455-S1063 VanDerWaalsContact OD2-CA 3.22Å; D455-S1063 WeakPolarHBondContact OD2-CA 3.4Å; D455-S1063 WeakPolarHBondContact OD2-CB 3.49Å; D455-S1063 PolarHBondContact OD2-OG 3Å
456	F	86.5	Confident	80.8	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-66.4	-35.2	-172.2	-167.1	-88	0	0	0	113.1	I438 F452 L453 R461 V466 V468 Y1069 F1070	I438-F456 HydrophobicContact CD1-CD2 4.39Å; I438-F456 HydrophobicContact CD1-CE1 3.9Å; I438-F456 HydrophobicContact CD1-CE2 3.61Å; I438-F456 HydrophobicContact CD1-CZ 3.33Å; I438-F456 HydrophobicContact CG1-CZ 4.15Å; F452-F456 HydrophobicContact CD1-CB 4.47Å; F452-F456 HydrophobicContact CE1-CB 4.07Å; F452-F456 HydrophobicContact CE1-CD2 4.34Å; F452-F456 HydrophobicContact CE1-CG 4.09Å; F452-F456 HydrophobicContact CE2-CB 4.26Å; F452-F456 AromaticContact CE2-CD2 3.89Å; F452-F456 HydrophobicContact CE2-CD2 3.89Å; F452-F456 HydrophobicContact CE2-CG 4.31Å; F452-F456 HydrophobicContact CZ-CB 3.95Å; F452-F456 HydrophobicContact CZ-CD1 4.47Å; F452-F456 AromaticContact CZ-CD2 3.52Å; F452-F456 HydrophobicContact CZ-CD2 3.52Å; F452-F456 HydrophobicContact CZ-CE2 4.14Å; F452-F456 AromaticContact CZ-CG 3.73Å; F452-F456 HydrophobicContact CZ-CG 3.73Å; F452-F456 WeakPolarHBondContact O-CB 3.1Å; F452-F456 PolarHBondContact O-N 3Å; L453-F456 PolarHBondContact O-N 2.88Å; F456-R461 WeakPolarHBondContact O-CD 3.26Å; F456-V466 HydrophobicContact CE1-CG1 4.4Å; F456-V466 HydrophobicContact CZ-CG1 4.2Å; F456-V468 HydrophobicContact CD1-CG2 3.72Å; F456-V468 HydrophobicContact CE1-CG2 3.53Å; F456-V468 HydrophobicContact CZ-CG2 4.43Å; F456-Y1069 AromaticContact CE2-CD1 3.43Å; F456-Y1069 HydrophobicContact CE2-CD1 3.43Å; F456-Y1069 VanDerWaalsContact CE2-CD1 3.43Å; F456-Y1069 AromaticContact CE2-CE1 3.81Å; F456-Y1069 HydrophobicContact CE2-CE1 3.81Å; F456-Y1069 HydrophobicContact CE2-CG 4.07Å; F456-Y1069 AromaticContact CZ-CD1 3.88Å; F456-Y1069 HydrophobicContact CZ-CD1 3.88Å; F456-Y1069 AromaticContact CZ-CE1 3.73Å; F456-Y1069 HydrophobicContact CZ-CE1 3.73Å; F456-F1070 AromaticContact CD2-CE2 3.91Å; F456-F1070 HydrophobicContact CD2-CE2 3.91Å; F456-F1070 AromaticContact CE2-CE2 3.77Å; F456-F1070 HydrophobicContact CE2-CE2 3.77Å; F456-F1070 HydrophobicContact CE2-CZ 4.2Å; F456-F1070 HydrophobicContact CG-CE2 4.46Å; F456-F1070 HydrophobicContact CZ-CE2 4.19Å; F456-F1070 HydrophobicContact CZ-CZ 4.16Å
457	L	86.2	Confident	80.9	Confident	20 Å²	20	49.7 Å²	49.7	11%	0.105	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	18.3	-178.6	-60	-177.9	0	0	0	113.5	L453 D455 V464 H487 K490 V491	L453-L457 HydrophobicContact CD2-CD1 3.91Å; L453-L457 HydrophobicContact CD2-CG 4.26Å; L453-L457 WeakPolarHBondContact O-CB 3.4Å; L453-L457 PolarHBondContact O-N 3.45Å; D455-L457 VanDerWaalsContact C-N 3.34Å; D455-L457 PolarHBondContact O-N 3.17Å; L457-V464 HydrophobicContact CD2-CG1 3.67Å; L457-H487 HydrophobicContact CD1-CB 4.36Å; L457-K490 HydrophobicContact CD1-CB 4.32Å; L457-K490 HydrophobicContact CD1-CD 4.33Å; L457-K490 HydrophobicContact CD2-CB 4.47Å; L457-K490 HydrophobicContact CD2-CD 3.79Å; L457-V491 HydrophobicContact CD1-CG2 4Å
458	H	82.6	Confident	81.3	Confident	34 Å²	34	45.2 Å²	45.2	16%	0.157	23%	0.226	C	C	.	.			trans	-56.8	145.1	-179	-162.4	-97.1	0	0	0	112.8	Q454 D455 D460 R461 M606	Q454-H458 WeakPolarHBondContact O-CB 3.42Å; D455-H458 PolarHBondContact O-N 3.1Å; H458-D460 VanDerWaalsContact C-N 3.28Å; H458-D460 IonicContact CE1-OD2 2.9Å; H458-D460 PolarHBondContact CE1-OD2 3.48Å; H458-D460 PolarHBondContact ND1-N 3.42Å; H458-D460 IonicContact ND1-OD2 2.74Å; H458-D460 PolarHBondContact O-N 3.1Å; H458-R461 HydrophobicContact CB-CG 4.48Å; H458-R461 PolarHBondContact O-N 3.42Å; H458-M606 HydrophobicContact CB-CB 4.14Å; H458-M606 HydrophobicContact CB-SD 3.91Å
459	E	74.5	Confident	81.7	Confident	188 Å²	188	44.4 Å²	44.4	88%	0.879	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64	-31.5	-175.4	-63.3	-173.3	169.2	0	0	113	R461	E459-R461 PolarHBondContact O-N 3.09Å
460	D	71.4	Confident	82	Confident	87 Å²	87	44.4 Å²	44.4	47%	0.465	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-7	-179.5	-65.1	-30.9	0	0	0	113.5	H458 E462	H458-D460 VanDerWaalsContact C-N 3.28Å; H458-D460 IonicContact CE1-OD2 2.9Å; H458-D460 PolarHBondContact CE1-OD2 3.48Å; H458-D460 PolarHBondContact ND1-N 3.42Å; H458-D460 IonicContact ND1-OD2 2.74Å; H458-D460 PolarHBondContact O-N 3.1Å; D460-E462 PolarHBondContact O-N 3.09Å
461	R	75.1	Confident	82.4	Confident	43 Å²	43	43.5 Å²	43.5	16%	0.162	21%	0.214	C	C	.	.			trans	-80.2	113.5	173.7	-67.1	-170.1	176.8	-77.3	7.4	110.4	D455 F456 H458 E459 D463 V464 M606 S1066 F1070	D455-R461 PolarHBondContact O-NE 3.34Å; F456-R461 WeakPolarHBondContact O-CD 3.26Å; H458-R461 HydrophobicContact CB-CG 4.48Å; H458-R461 PolarHBondContact O-N 3.42Å; E459-R461 PolarHBondContact O-N 3.09Å; R461-D463 VanDerWaalsContact C-N 3.26Å; R461-D463 PolarHBondContact O-N 3.23Å; R461-V464 HydrophobicContact CB-CG2 3.54Å; R461-V464 WeakPolarHBondContact O-CG2 3.38Å; R461-M606 HydrophobicContact CG-SD 3.4Å; R461-M606 WeakPolarHBondContact CG-SD 3.32Å; R461-M606 VanDerWaalsContact NE-CE 3.32Å; R461-M606 PolarHBondContact NE-SD 3.26Å; R461-M606 PolarHBondContact NH2-SD 3.34Å; R461-S1066 PolarHBondContact NH2-OG 3.05Å; R461-F1070 VanDerWaalsContact NH1-CG 3.34Å
462	E	64.6	Low	82.9	Confident	104 Å²	104	43.2 Å²	43.2	49%	0.486	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-17.3	179.5	-69.1	177.7	-157.8	0	0	114.8	D460 K701	D460-E462 PolarHBondContact O-N 3.09Å; E462-K701 IonicContact OE1-NZ 3.39Å; E462-K701 IonicContact OE2-NZ 3.02Å; E462-K701 PolarHBondContact OE2-NZ 3.17Å
463	D	61	Low	83.2	Confident	89 Å²	89	52.6 Å²	52.6	48%	0.476	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.6	22.5	-158.4	-92.8	-24	0	0	0	116	R461 D465 R781	R461-D463 VanDerWaalsContact C-N 3.26Å; R461-D463 PolarHBondContact O-N 3.23Å; D463-D465 VanDerWaalsContact C-N 3.3Å; D463-D465 PolarHBondContact O-N 2.72Å; D463-R781 IonicContact OD1-NH2 3.76Å; D463-R781 IonicContact OD2-CZ 2.7Å; D463-R781 IonicContact OD2-NH2 2.8Å; D463-R781 PolarHBondContact OD2-NH2 2.93Å
464	V	62.2	Low	83.3	Confident	21 Å²	21	56.4 Å²	56.4	13%	0.127	27%	0.271	C	S	.	.			trans	-90.3	50.4	-164.2	-155.9	0	0	0	0	114.4	L457 R461 V466	L457-V464 HydrophobicContact CD2-CG1 3.67Å; R461-V464 HydrophobicContact CB-CG2 3.54Å; R461-V464 WeakPolarHBondContact O-CG2 3.38Å; V464-V466 PolarHBondContact O-N 3.32Å
465	D	76	Confident	83.7	Confident	125 Å²	125	55 Å²	55	67%	0.668	27%	0.27	S	S	*	.			trans	-88.5	47.4	159.9	-74.2	-23.1	0	0	0	110.1	D463	D463-D465 VanDerWaalsContact C-N 3.3Å; D463-D465 PolarHBondContact O-N 2.72Å
466	V	86.9	Confident	84.2	Confident	3 Å²	3	55 Å²	55	2%	0.018	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	124.6	178.5	-175.9	0	0	0	0	109	R436 I438 F456 V464	R436-V466 WeakPolarHBondContact O-CA 3.47Å; I438-V466 HydrophobicContact CG1-CG1 4.27Å; I438-V466 HydrophobicContact CG2-CG1 3.84Å; F456-V466 HydrophobicContact CE1-CG1 4.4Å; F456-V466 HydrophobicContact CZ-CG1 4.2Å; V464-V466 PolarHBondContact O-N 3.32Å
467	E	91.8	Very high	84.5	Confident	18 Å²	18	58.9 Å²	58.9	8%	0.084	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	141.4	174.7	-66.8	-179.2	179.2	0	0	110.8	Y429 K435 R436 H437 I438 L469 K490	Y429-E467 PolarHBondContact OH-OE2 3.2Å; K435-E467 HydrophobicContact CD-CG 4.26Å; K435-E467 WeakPolarHBondContact CD-OE1 3.41Å; K435-E467 WeakPolarHBondContact CE-OE1 3.46Å; K435-E467 IonicContact NZ-OE1 2.7Å; K435-E467 PolarHBondContact NZ-OE1 2.88Å; R436-E467 PolarHBondContact O-N 3.11Å; H437-E467 CarbonylContact C-O 3.59Å; H437-E467 WeakPolarHBondContact CA-O 3.36Å; H437-E467 HydrophobicContact CB-CB 4.22Å; I438-E467 PolarHBondContact N-O 3.32Å; E467-L469 HydrophobicContact CB-CD1 4.38Å; E467-K490 CarbonylContact C-O 3.57Å; E467-K490 WeakPolarHBondContact CA-O 3.32Å
468	V	94.4	Very high	84.9	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	114.5	-177.2	-173.2	0	0	0	0	109.4	I438 V440 F452 F456 F470 K490 V491 E492	I438-V468 HydrophobicContact CD1-CB 4.49Å; I438-V468 HydrophobicContact CD1-CG1 4.1Å; I438-V468 HydrophobicContact CD1-CG2 4.05Å; I438-V468 HydrophobicContact CG1-CB 4.27Å; I438-V468 HydrophobicContact CG1-CG1 4.19Å; I438-V468 HydrophobicContact CG1-CG2 4.08Å; V440-V468 HydrophobicContact CG2-CG1 3.65Å; F452-V468 HydrophobicContact CE1-CG1 4.03Å; F456-V468 HydrophobicContact CD1-CG2 3.72Å; F456-V468 HydrophobicContact CE1-CG2 3.53Å; F456-V468 HydrophobicContact CZ-CG2 4.43Å; V468-F470 HydrophobicContact CB-CE2 4.41Å; V468-F470 HydrophobicContact CG1-CD2 4.18Å; V468-F470 HydrophobicContact CG1-CE2 3.55Å; V468-F470 HydrophobicContact CG1-CZ 3.78Å; V468-K490 PolarHBondContact N-O 2.63Å; V468-V491 HydrophobicContact CB-CG2 4.34Å; V468-V491 WeakPolarHBondContact O-CA 3.43Å; V468-E492 PolarHBondContact O-N 2.8Å
469	L	95.5	Very high	85.4	Confident	2 Å²	2	69.9 Å²	69.9	1%	0.01	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	118.4	178.1	-69.6	68.1	0	0	0	109.5	Y429 H437 I438 V439 V440 E467 E492 F494 V507	Y429-L469 HydrophobicContact CD1-CD2 3.74Å; Y429-L469 HydrophobicContact CD2-CD1 4.34Å; Y429-L469 HydrophobicContact CD2-CD2 3.6Å; Y429-L469 HydrophobicContact CD2-CG 4.12Å; Y429-L469 HydrophobicContact CE1-CD2 4.2Å; Y429-L469 HydrophobicContact CE2-CD1 4.03Å; Y429-L469 HydrophobicContact CE2-CD2 4.08Å; Y429-L469 HydrophobicContact CE2-CG 4.31Å; Y429-L469 HydrophobicContact CG-CD2 3.42Å; Y429-L469 VanDerWaalsContact CG-CD2 3.42Å; Y429-L469 HydrophobicContact CG-CG 4.42Å; H437-L469 HydrophobicContact CB-CD1 3.5Å; H437-L469 VanDerWaalsContact CB-CD1 3.5Å; I438-L469 PolarHBondContact O-N 3.02Å; V439-L469 CarbonylContact C-O 3.24Å; V439-L469 WeakPolarHBondContact CA-O 3.13Å; V440-L469 PolarHBondContact N-O 3.42Å; E467-L469 HydrophobicContact CB-CD1 4.38Å; L469-E492 CarbonylContact C-O 3.46Å; L469-E492 WeakPolarHBondContact CA-O 3.36Å; L469-F494 HydrophobicContact CD2-CD2 4.48Å; L469-F494 HydrophobicContact CD2-CE2 4.01Å; L469-F494 HydrophobicContact CG-CE2 4.2Å; L469-V507 HydrophobicContact CD2-CB 4.21Å
470	F	96.8	Very high	86.3	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	131.2	172.6	-70.3	-83.3	0	0	0	110.7	V440 I444 V449 F452 L453 V468 F484 V491 E492 F493 F494	V440-F470 HydrophobicContact CB-CD1 3.73Å; V440-F470 HydrophobicContact CB-CE1 3.71Å; V440-F470 HydrophobicContact CB-CZ 4.48Å; V440-F470 HydrophobicContact CG1-CD1 3.91Å; V440-F470 HydrophobicContact CG1-CE1 3.61Å; V440-F470 HydrophobicContact CG2-CE1 4.23Å; V440-F470 WeakPolarHBondContact O-CA 3.49Å; I444-F470 HydrophobicContact CD1-CD1 3.87Å; I444-F470 HydrophobicContact CD1-CE1 4.31Å; I444-F470 HydrophobicContact CG1-CD1 4.49Å; I444-F470 HydrophobicContact CG2-CD1 4.2Å; V449-F470 HydrophobicContact CG1-CE1 4.1Å; V449-F470 HydrophobicContact CG1-CE2 4.22Å; V449-F470 HydrophobicContact CG1-CZ 3.7Å; V449-F470 HydrophobicContact CG2-CD1 4.33Å; V449-F470 HydrophobicContact CG2-CE1 3.82Å; V449-F470 HydrophobicContact CG2-CZ 4.27Å; F452-F470 HydrophobicContact CD1-CZ 4.13Å; F452-F470 HydrophobicContact CE1-CZ 4.31Å; L453-F470 HydrophobicContact CD2-CE2 4.25Å; L453-F470 HydrophobicContact CD2-CZ 4.16Å; L453-F470 HydrophobicContact CG-CZ 4.42Å; V468-F470 HydrophobicContact CB-CE2 4.41Å; V468-F470 HydrophobicContact CG1-CD2 4.18Å; V468-F470 HydrophobicContact CG1-CE2 3.55Å; V468-F470 HydrophobicContact CG1-CZ 3.78Å; F470-F484 HydrophobicContact CB-CZ 4.33Å; F470-F484 HydrophobicContact CD2-CD1 4.46Å; F470-F484 AromaticContact CD2-CE1 3.57Å; F470-F484 HydrophobicContact CD2-CE1 3.57Å; F470-F484 AromaticContact CD2-CZ 3.94Å; F470-F484 HydrophobicContact CD2-CZ 3.94Å; F470-F484 AromaticContact CE2-CE1 3.77Å; F470-F484 HydrophobicContact CE2-CE1 3.77Å; F470-F484 HydrophobicContact CE2-CZ 4.49Å; F470-F484 HydrophobicContact CG-CE1 4.17Å; F470-F484 HydrophobicContact CG-CZ 4.1Å; F470-V491 HydrophobicContact CD2-CG1 3.58Å; F470-V491 HydrophobicContact CE2-CG1 3.5Å; F470-V491 VanDerWaalsContact CE2-CG1 3.5Å; F470-E492 PolarHBondContact N-O 3.18Å; F470-F493 HydrophobicContact CB-CD2 3.69Å; F470-F493 HydrophobicContact CB-CE2 4.36Å; F470-F494 PolarHBondContact O-N 3.13Å
471	I	96.1	Very high	87.3	Confident	4 Å²	4	58.3 Å²	58.3	2%	0.021	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	117.1	171.4	-177.1	171.4	0	0	0	110.6	V439 V440 C441 F494 V498 D503 V507	V439-I471 HydrophobicContact CG1-CG2 3.75Å; V440-I471 PolarHBondContact O-N 2.78Å; C441-I471 HydrophobicContact CB-CG2 3.58Å; I471-F494 WeakPolarHBondContact CA-O 3.41Å; I471-V498 HydrophobicContact CD1-CG1 4.28Å; I471-V498 HydrophobicContact CG2-CG1 3.61Å; I471-D503 HydrophobicContact CD1-CB 3.94Å; I471-V507 HydrophobicContact CD1-CG1 4.21Å
472	H	95.7	Very high	88.2	Confident	46 Å²	46	57.6 Å²	57.6	21%	0.213	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	148.6	179.6	-165.7	68.7	0	0	0	112.3	G442 I444 V474 F493 F494 Q495 G496	G442-H472 PolarHBondContact O-ND1 2.77Å; I444-H472 HydrophobicContact CB-CB 4.05Å; I444-H472 HydrophobicContact CG1-CB 3.94Å; H472-V474 PolarHBondContact CD2-N 2.83Å; H472-V474 PolarHBondContact CD2-O 3.24Å; H472-F493 HydrophobicContact CB-CE2 3.89Å; H472-F493 HydrophobicContact CB-CZ 3.96Å; H472-F494 PolarHBondContact N-O 3.43Å; H472-Q495 CarbonylContact O-C 3.54Å; H472-Q495 WeakPolarHBondContact O-CA 3.37Å; H472-G496 CarbonylContact C-O 3.6Å; H472-G496 WeakPolarHBondContact CA-O 3.31Å; H472-G496 PolarHBondContact O-N 3.09Å
473	R	93.3	Very high	89.6	Confident	200 Å²	200	53.1 Å²	53.1	76%	0.755	28%	0.276	S	S	*	.	S	Bend	trans	-70.4	-38.2	-173.7	-178.7	-178.1	176.2	-169.9	-0.7	111.9	Q495 G496	R473-Q495 WeakPolarHBondContact O-CG 3.39Å; R473-Q495 PolarHBondContact O-NE2 3.36Å; R473-G496 WeakPolarHBondContact CA-O 3.37Å; R473-G496 PolarHBondContact N-O 2.92Å
474	V	92.8	Very high	91.1	Very high	85 Å²	85	49.7 Å²	49.7	52%	0.515	26%	0.256	S	S	.	.	S	Bend	trans	-87.2	135.9	-178.2	-172.4	0	0	0	0	108.8	H472 F493	H472-V474 PolarHBondContact CD2-N 2.83Å; H472-V474 PolarHBondContact CD2-O 3.24Å; V474-F493 WeakPolarHBondContact O-CZ 3.47Å
475	P	91.9	Very high	92.5	Very high	69 Å²	69	55 Å²	55	45%	0.448	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-62.4	150	172	28.5	-35.3	0	0	0	110.8	Y425	Y425-P475 HydrophobicContact CD2-CB 4.5Å
476	P	93.2	Very high	93.2	Very high	16 Å²	16	58.5 Å²	58.5	10%	0.104	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-64.9	145.5	178.5	29.3	-35.6	0	0	0	110.4	Y425 L480 F484 F493	Y425-P476 HydrophobicContact CD2-CG 4.27Å; Y425-P476 HydrophobicContact CE1-CG 4.29Å; Y425-P476 VanDerWaalsContact CE2-CD 3.47Å; Y425-P476 HydrophobicContact CE2-CG 3.58Å; P476-L480 HydrophobicContact CB-CB 4.05Å; P476-L480 HydrophobicContact CB-CD2 3.75Å; P476-L480 HydrophobicContact CB-CG 3.88Å; P476-F484 HydrophobicContact CB-CD2 4.41Å; P476-F484 HydrophobicContact CB-CE2 4Å; P476-F484 HydrophobicContact CG-CE2 4.38Å; P476-F493 VanDerWaalsContact CD-CE1 3.45Å; P476-F493 HydrophobicContact CG-CD1 4.22Å; P476-F493 HydrophobicContact CG-CE1 4.31Å; P476-F493 HydrophobicContact CG-CG 4.48Å
477	D	93.4	Very high	93.2	Very high	82 Å²	82	61.3 Å²	61.3	44%	0.439	30%	0.295	S	S	.	.			trans	-68.6	175.5	167.4	58.4	28.2	0	0	0	111	E479 L480 E481	D477-E479 VanDerWaalsContact C-N 3.28Å; D477-E479 PolarHBondContact O-N 2.92Å; D477-E479 PolarHBondContact OD1-N 2.74Å; D477-L480 WeakPolarHBondContact OD1-CA 3.16Å; D477-L480 WeakPolarHBondContact OD1-CB 3.36Å; D477-L480 PolarHBondContact OD1-N 2.8Å; D477-E481 VanDerWaalsContact O-CB 3.26Å; D477-E481 WeakPolarHBondContact O-CB 3.5Å; D477-E481 PolarHBondContact O-N 2.85Å
478	L	94	Very high	92.7	Very high	152 Å²	152	68.1 Å²	68.1	80%	0.796	32%	0.324	S	S	*	.	H	α-helix	trans	-66.8	-30.9	-176.4	-66.4	174.4	0	0	0	112.6	G482	L478-G482 PolarHBondContact O-N 3.16Å
479	E	92.7	Very high	92.2	Very high	133 Å²	133	73.4 Å²	73.4	62%	0.621	36%	0.356	S	S	*	.	H	α-helix	trans	-72.6	-47.3	-180	-65.7	-179.7	176	0	0	110.9	F446 D477 G482 L483	F446-E479 HydrophobicContact CD2-CB 3.91Å; F446-E479 HydrophobicContact CE2-CB 4.35Å; F446-E479 HydrophobicContact CG-CB 4.28Å; D477-E479 VanDerWaalsContact C-N 3.28Å; D477-E479 PolarHBondContact O-N 2.92Å; D477-E479 PolarHBondContact OD1-N 2.74Å; E479-G482 CarbonylContact O-C 3.54Å; E479-G482 WeakPolarHBondContact O-CA 3.31Å; E479-G482 PolarHBondContact O-N 3.39Å; E479-G482 VanDerWaalsContact O-N 3.11Å; E479-L483 PolarHBondContact O-N 3.26Å
480	L	93.2	Very high	91.8	Very high	4 Å²	4	76.8 Å²	76.8	2%	0.021	37%	0.371	C	S	.	.	H	α-helix	trans	-65.9	-39	174.1	-175.4	60.1	0	0	0	111.6	I444 V449 P476 D477 G482 L483 F484	I444-L480 HydrophobicContact CG2-CD2 4.11Å; V449-L480 HydrophobicContact CB-CD1 3.84Å; V449-L480 HydrophobicContact CG1-CD1 3.87Å; V449-L480 HydrophobicContact CG2-CD1 4.01Å; P476-L480 HydrophobicContact CB-CB 4.05Å; P476-L480 HydrophobicContact CB-CD2 3.75Å; P476-L480 HydrophobicContact CB-CG 3.88Å; D477-L480 WeakPolarHBondContact OD1-CA 3.16Å; D477-L480 WeakPolarHBondContact OD1-CB 3.36Å; D477-L480 PolarHBondContact OD1-N 2.8Å; L480-G482 VanDerWaalsContact C-N 3.27Å; L480-G482 PolarHBondContact O-N 2.89Å; L480-L483 HydrophobicContact CD1-CD2 4.27Å; L480-L483 WeakPolarHBondContact O-CB 3.36Å; L480-L483 PolarHBondContact O-N 3.19Å; L480-F484 HydrophobicContact CD1-CD1 4.47Å; L480-F484 HydrophobicContact CD1-CE1 3.82Å; L480-F484 HydrophobicContact CD1-CE2 4.01Å; L480-F484 HydrophobicContact CD1-CZ 3.55Å; L480-F484 HydrophobicContact CD2-CE2 4.03Å; L480-F484 HydrophobicContact CD2-CZ 4.01Å; L480-F484 HydrophobicContact CG-CD2 4.24Å; L480-F484 HydrophobicContact CG-CE1 4.32Å; L480-F484 HydrophobicContact CG-CE2 3.58Å; L480-F484 HydrophobicContact CG-CZ 3.64Å; L480-F484 WeakPolarHBondContact O-CD2 3.08Å; L480-F484 WeakPolarHBondContact O-CG 2.89Å; L480-F484 PolarHBondContact O-N 3.47Å
481	E	93.4	Very high	91.6	Very high	29 Å²	29	77 Å²	77	14%	0.136	37%	0.372	C	S	.	.	H	α-helix	trans	-60.9	-39.3	170.1	-178	177.6	154.4	0	0	111.2	K424 Y425 D477 F484 K485	K424-E481 IonicContact NZ-OE1 3.39Å; K424-E481 PolarHBondContact NZ-OE1 3.47Å; K424-E481 IonicContact NZ-OE2 2.83Å; K424-E481 PolarHBondContact NZ-OE2 2.9Å; Y425-E481 WeakPolarHBondContact OH-CG 3.4Å; Y425-E481 PolarHBondContact OH-OE2 2.87Å; D477-E481 VanDerWaalsContact O-CB 3.26Å; D477-E481 WeakPolarHBondContact O-CB 3.5Å; D477-E481 PolarHBondContact O-N 2.85Å; E481-F484 PolarHBondContact O-N 3.35Å; E481-K485 HydrophobicContact CG-CD 4.45Å; E481-K485 WeakPolarHBondContact O-CG 3.14Å; E481-K485 PolarHBondContact O-N 3.33Å; E481-K485 WeakPolarHBondContact OE1-CE 3.26Å; E481-K485 IonicContact OE1-NZ 3.81Å; E481-K485 PolarHBondContact OE1-NZ 3.06Å
482	G	93.5	Very high	91.5	Very high	27 Å²	27	80.9 Å²	80.9	28%	0.278	39%	0.39	S	S	.	.	H	α-helix	trans	-59.5	-44.2	172.5	0	0	0	0	0	112.3	L478 E479 L480 K485 R486	L478-G482 PolarHBondContact O-N 3.16Å; E479-G482 CarbonylContact O-C 3.54Å; E479-G482 WeakPolarHBondContact O-CA 3.31Å; E479-G482 PolarHBondContact O-N 3.39Å; E479-G482 VanDerWaalsContact O-N 3.11Å; L480-G482 VanDerWaalsContact C-N 3.27Å; L480-G482 PolarHBondContact O-N 2.89Å; G482-K485 PolarHBondContact O-N 3.19Å; G482-R486 WeakPolarHBondContact O-CG 3.28Å; G482-R486 PolarHBondContact O-N 2.85Å; G482-R486 VanDerWaalsContact O-N 3.16Å
483	L	93.1	Very high	91.4	Very high	11 Å²	11	79.5 Å²	79.5	6%	0.058	38%	0.384	C	S	.	.	H	α-helix	trans	-63.7	-42.8	177.2	-175.1	61.7	0	0	0	112.3	F446 V449 L453 E479 L480 R486 H487	F446-L483 HydrophobicContact CD2-CD2 4.39Å; F446-L483 HydrophobicContact CE2-CB 4.41Å; F446-L483 HydrophobicContact CE2-CD2 4.4Å; V449-L483 HydrophobicContact CB-CD2 4.31Å; V449-L483 HydrophobicContact CG1-CD2 3.8Å; L453-L483 HydrophobicContact CD1-CD2 4.14Å; L453-L483 HydrophobicContact CD1-CG 4.14Å; E479-L483 PolarHBondContact O-N 3.26Å; L480-L483 HydrophobicContact CD1-CD2 4.27Å; L480-L483 WeakPolarHBondContact O-CB 3.36Å; L480-L483 PolarHBondContact O-N 3.19Å; L483-R486 WeakPolarHBondContact O-CB 3.41Å; L483-R486 PolarHBondContact O-N 2.61Å; L483-H487 PolarHBondContact O-N 2.85Å; L483-H487 PolarHBondContact O-ND1 2.99Å
484	F	93.1	Very high	91.6	Very high	16 Å²	16	70.5 Å²	70.5	7%	0.07	35%	0.35	C	S	.	.	H	α-helix	trans	-65.9	-38.8	176.1	-64.4	-30.1	0	0	0	112.6	V449 F470 P476 L480 E481 R486 H487 F488 V491 F493	V449-F484 HydrophobicContact CG1-CE1 3.94Å; F470-F484 HydrophobicContact CB-CZ 4.33Å; F470-F484 HydrophobicContact CD2-CD1 4.46Å; F470-F484 AromaticContact CD2-CE1 3.57Å; F470-F484 HydrophobicContact CD2-CE1 3.57Å; F470-F484 AromaticContact CD2-CZ 3.94Å; F470-F484 HydrophobicContact CD2-CZ 3.94Å; F470-F484 AromaticContact CE2-CE1 3.77Å; F470-F484 HydrophobicContact CE2-CE1 3.77Å; F470-F484 HydrophobicContact CE2-CZ 4.49Å; F470-F484 HydrophobicContact CG-CE1 4.17Å; F470-F484 HydrophobicContact CG-CZ 4.1Å; P476-F484 HydrophobicContact CB-CD2 4.41Å; P476-F484 HydrophobicContact CB-CE2 4Å; P476-F484 HydrophobicContact CG-CE2 4.38Å; L480-F484 HydrophobicContact CD1-CD1 4.47Å; L480-F484 HydrophobicContact CD1-CE1 3.82Å; L480-F484 HydrophobicContact CD1-CE2 4.01Å; L480-F484 HydrophobicContact CD1-CZ 3.55Å; L480-F484 HydrophobicContact CD2-CE2 4.03Å; L480-F484 HydrophobicContact CD2-CZ 4.01Å; L480-F484 HydrophobicContact CG-CD2 4.24Å; L480-F484 HydrophobicContact CG-CE1 4.32Å; L480-F484 HydrophobicContact CG-CE2 3.58Å; L480-F484 HydrophobicContact CG-CZ 3.64Å; L480-F484 WeakPolarHBondContact O-CD2 3.08Å; L480-F484 WeakPolarHBondContact O-CG 2.89Å; L480-F484 PolarHBondContact O-N 3.47Å; E481-F484 PolarHBondContact O-N 3.35Å; F484-R486 VanDerWaalsContact C-N 3.3Å; F484-R486 PolarHBondContact O-N 2.93Å; F484-H487 CarbonylContact O-C 3.56Å; F484-H487 VanDerWaalsContact O-C 3.28Å; F484-H487 PolarHBondContact O-N 3.44Å; F484-H487 VanDerWaalsContact O-N 3.13Å; F484-F488 PolarHBondContact O-N 2.93Å; F484-F488 VanDerWaalsContact O-N 3.15Å; F484-V491 HydrophobicContact CD1-CG1 3.47Å; F484-V491 VanDerWaalsContact CD1-CG1 3.47Å; F484-V491 HydrophobicContact CE1-CG1 3.84Å; F484-V491 HydrophobicContact CG-CG1 4.31Å; F484-F493 HydrophobicContact CD2-CB 3.91Å; F484-F493 HydrophobicContact CD2-CD2 4.42Å; F484-F493 HydrophobicContact CD2-CG 4.35Å; F484-F493 HydrophobicContact CE2-CB 3.69Å; F484-F493 AromaticContact CE2-CD2 3.41Å; F484-F493 HydrophobicContact CE2-CD2 3.41Å; F484-F493 VanDerWaalsContact CE2-CD2 3.41Å; F484-F493 HydrophobicContact CE2-CE2 4.3Å; F484-F493 AromaticContact CE2-CG 3.74Å; F484-F493 HydrophobicContact CE2-CG 3.74Å; F484-F493 HydrophobicContact CZ-CB 4.34Å; F484-F493 AromaticContact CZ-CD2 3.75Å; F484-F493 HydrophobicContact CZ-CD2 3.75Å; F484-F493 HydrophobicContact CZ-CG 4.41Å
485	K	91.8	Very high	91.6	Very high	133 Å²	133	69 Å²	69	58%	0.578	34%	0.338	S	S	*	.	H	α-helix	trans	-65.3	-31.4	175.7	-77.1	178.4	-175.5	165.2	0	113.2	E481 G482 H487	E481-K485 HydrophobicContact CG-CD 4.45Å; E481-K485 WeakPolarHBondContact O-CG 3.14Å; E481-K485 PolarHBondContact O-N 3.33Å; E481-K485 WeakPolarHBondContact OE1-CE 3.26Å; E481-K485 IonicContact OE1-NZ 3.81Å; E481-K485 PolarHBondContact OE1-NZ 3.06Å; G482-K485 PolarHBondContact O-N 3.19Å; K485-H487 PolarHBondContact O-N 3.4Å
486	R	91.2	Very high	91.7	Very high	198 Å²	198	66.1 Å²	66.1	75%	0.747	32%	0.32	S	S	*	.	H	α-helix	trans	-63.6	-33.3	173.4	-70.1	173.3	-174.3	177.3	2.5	111.7	G482 L483 F484	G482-R486 WeakPolarHBondContact O-CG 3.28Å; G482-R486 PolarHBondContact O-N 2.85Å; G482-R486 VanDerWaalsContact O-N 3.16Å; L483-R486 WeakPolarHBondContact O-CB 3.41Å; L483-R486 PolarHBondContact O-N 2.61Å; F484-R486 VanDerWaalsContact C-N 3.3Å; F484-R486 PolarHBondContact O-N 2.93Å
487	H	86	Confident	91.8	Very high	63 Å²	63	67.9 Å²	67.9	29%	0.292	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	34.6	-178.5	-58.9	94.8	0	0	0	113.2	L457 L483 F484 K485 T489 K490 V491	L457-H487 HydrophobicContact CD1-CB 4.36Å; L483-H487 PolarHBondContact O-N 2.85Å; L483-H487 PolarHBondContact O-ND1 2.99Å; F484-H487 CarbonylContact O-C 3.56Å; F484-H487 VanDerWaalsContact O-C 3.28Å; F484-H487 PolarHBondContact O-N 3.44Å; F484-H487 VanDerWaalsContact O-N 3.13Å; K485-H487 PolarHBondContact O-N 3.4Å; H487-T489 PolarHBondContact O-N 3.44Å; H487-K490 PolarHBondContact O-N 3.08Å; H487-V491 HydrophobicContact CB-CB 4.13Å; H487-V491 HydrophobicContact CB-CG2 3.66Å; H487-V491 PolarHBondContact O-N 3.31Å
488	F	81.5	Confident	91.8	Very high	160 Å²	160	64.2 Å²	64.2	70%	0.702	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-29.5	-169.7	-177.1	-100.5	0	0	0	115.1	F484	F484-F488 PolarHBondContact O-N 2.93Å; F484-F488 VanDerWaalsContact O-N 3.15Å
489	T	83.8	Confident	91.9	Very high	111 Å²	111	61.5 Å²	61.5	68%	0.681	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-14.2	-179.1	58.1	0	0	0	0	114.2	H487	H487-T489 PolarHBondContact O-N 3.44Å
490	K	87.4	Confident	92	Very high	73 Å²	73	58.5 Å²	58.5	32%	0.317	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.6	-20.7	-175	-63.9	-168.3	-178.8	-177.7	0	112.8	L457 E467 V468 H487	L457-K490 HydrophobicContact CD1-CB 4.32Å; L457-K490 HydrophobicContact CD1-CD 4.33Å; L457-K490 HydrophobicContact CD2-CB 4.47Å; L457-K490 HydrophobicContact CD2-CD 3.79Å; E467-K490 CarbonylContact C-O 3.57Å; E467-K490 WeakPolarHBondContact CA-O 3.32Å; V468-K490 PolarHBondContact N-O 2.63Å; H487-K490 PolarHBondContact O-N 3.08Å
491	V	92.6	Very high	92	Very high	5 Å²	5	61.6 Å²	61.6	3%	0.03	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	125.6	-171.9	-177.9	0	0	0	0	111	L453 L457 V468 F470 F484 H487	L453-V491 HydrophobicContact CD1-CG2 4.29Å; L453-V491 HydrophobicContact CD2-CG2 4Å; L457-V491 HydrophobicContact CD1-CG2 4Å; V468-V491 HydrophobicContact CB-CG2 4.34Å; V468-V491 WeakPolarHBondContact O-CA 3.43Å; F470-V491 HydrophobicContact CD2-CG1 3.58Å; F470-V491 HydrophobicContact CE2-CG1 3.5Å; F470-V491 VanDerWaalsContact CE2-CG1 3.5Å; F484-V491 HydrophobicContact CD1-CG1 3.47Å; F484-V491 VanDerWaalsContact CD1-CG1 3.47Å; F484-V491 HydrophobicContact CE1-CG1 3.84Å; F484-V491 HydrophobicContact CG-CG1 4.31Å; H487-V491 HydrophobicContact CB-CB 4.13Å; H487-V491 HydrophobicContact CB-CG2 3.66Å; H487-V491 PolarHBondContact O-N 3.31Å
492	E	93.4	Very high	92.1	Very high	85 Å²	85	64.7 Å²	64.7	40%	0.397	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	148.3	172.6	-66	-164.1	170.4	0	0	111.2	V468 L469 F470 F494	V468-E492 PolarHBondContact O-N 2.8Å; L469-E492 CarbonylContact C-O 3.46Å; L469-E492 WeakPolarHBondContact CA-O 3.36Å; F470-E492 PolarHBondContact N-O 3.18Å; E492-F494 HydrophobicContact CB-CE2 3.98Å; E492-F494 WeakPolarHBondContact OE2-CZ 3.41Å
493	F	95.1	Very high	92.2	Very high	18 Å²	18	64.3 Å²	64.3	8%	0.079	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	131.5	179.2	179.9	-83.3	0	0	0	111.4	Y425 F470 H472 V474 P476 F484 Q495	Y425-F493 HydrophobicContact CD1-CB 4.46Å; Y425-F493 AromaticContact CD1-CD1 3.77Å; Y425-F493 HydrophobicContact CD1-CD1 3.77Å; Y425-F493 HydrophobicContact CD2-CD1 4.24Å; Y425-F493 HydrophobicContact CD2-CE1 4.36Å; Y425-F493 HydrophobicContact CE1-CD1 4.41Å; Y425-F493 AromaticContact CG-CD1 3.67Å; Y425-F493 HydrophobicContact CG-CD1 3.67Å; Y425-F493 HydrophobicContact CG-CE1 4.11Å; F470-F493 HydrophobicContact CB-CD2 3.69Å; F470-F493 HydrophobicContact CB-CE2 4.36Å; H472-F493 HydrophobicContact CB-CE2 3.89Å; H472-F493 HydrophobicContact CB-CZ 3.96Å; V474-F493 WeakPolarHBondContact O-CZ 3.47Å; P476-F493 VanDerWaalsContact CD-CE1 3.45Å; P476-F493 HydrophobicContact CG-CD1 4.22Å; P476-F493 HydrophobicContact CG-CE1 4.31Å; P476-F493 HydrophobicContact CG-CG 4.48Å; F484-F493 HydrophobicContact CD2-CB 3.91Å; F484-F493 HydrophobicContact CD2-CD2 4.42Å; F484-F493 HydrophobicContact CD2-CG 4.35Å; F484-F493 HydrophobicContact CE2-CB 3.69Å; F484-F493 AromaticContact CE2-CD2 3.41Å; F484-F493 HydrophobicContact CE2-CD2 3.41Å; F484-F493 VanDerWaalsContact CE2-CD2 3.41Å; F484-F493 HydrophobicContact CE2-CE2 4.3Å; F484-F493 AromaticContact CE2-CG 3.74Å; F484-F493 HydrophobicContact CE2-CG 3.74Å; F484-F493 HydrophobicContact CZ-CB 4.34Å; F484-F493 AromaticContact CZ-CD2 3.75Å; F484-F493 HydrophobicContact CZ-CD2 3.75Å; F484-F493 HydrophobicContact CZ-CG 4.41Å; F493-Q495 HydrophobicContact CE1-CB 4.29Å
494	F	95.6	Very high	92.3	Very high	10 Å²	10	63.9 Å²	63.9	4%	0.044	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	126.7	177.7	-67.9	-86.9	0	0	0	111.2	Y429 L469 F470 I471 H472 E492 G496 V507	Y429-F494 HydrophobicContact CD2-CE2 4.5Å; Y429-F494 HydrophobicContact CD2-CZ 4.48Å; L469-F494 HydrophobicContact CD2-CD2 4.48Å; L469-F494 HydrophobicContact CD2-CE2 4.01Å; L469-F494 HydrophobicContact CG-CE2 4.2Å; F470-F494 PolarHBondContact O-N 3.13Å; I471-F494 WeakPolarHBondContact CA-O 3.41Å; H472-F494 PolarHBondContact N-O 3.43Å; E492-F494 HydrophobicContact CB-CE2 3.98Å; E492-F494 WeakPolarHBondContact OE2-CZ 3.41Å; F494-G496 PolarHBondContact O-N 3.47Å; F494-V507 HydrophobicContact CB-CG1 4.06Å; F494-V507 HydrophobicContact CD2-CG1 4.01Å; F494-V507 HydrophobicContact CG-CG1 4Å
495	Q	94.2	Very high	92.5	Very high	55 Å²	55	66.4 Å²	66.4	26%	0.257	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	108.2	176.7	-175.4	-177.9	12.5	0	0	110.9	Y425 H472 R473 F493 R506	Y425-Q495 PolarHBondContact O-N 2.91Å; H472-Q495 CarbonylContact O-C 3.54Å; H472-Q495 WeakPolarHBondContact O-CA 3.37Å; R473-Q495 WeakPolarHBondContact O-CG 3.39Å; R473-Q495 PolarHBondContact O-NE2 3.36Å; F493-Q495 HydrophobicContact CE1-CB 4.29Å; Q495-R506 VanDerWaalsContact O-CZ 3.26Å; Q495-R506 PolarHBondContact O-NH1 3.37Å; Q495-R506 PolarHBondContact O-NH2 2.84Å
496	G	93.1	Very high	92.6	Very high	8 Å²	8	61.6 Å²	61.6	8%	0.082	31%	0.311	C	S	.	.			trans	-177.9	-177.9	-176.9	0	0	0	0	0	114	H472 R473 F494 D503	H472-G496 CarbonylContact C-O 3.6Å; H472-G496 WeakPolarHBondContact CA-O 3.31Å; H472-G496 PolarHBondContact O-N 3.09Å; R473-G496 WeakPolarHBondContact CA-O 3.37Å; R473-G496 PolarHBondContact N-O 2.92Å; F494-G496 PolarHBondContact O-N 3.47Å; G496-D503 WeakPolarHBondContact CA-OD2 3.42Å
497	T	95.1	Very high	92.8	Very high	53 Å²	53	52.1 Å²	52.1	33%	0.325	28%	0.276	S	S	.	.			trans	-124.3	139.1	176.5	-179.6	0	0	0	0	111	M499 D500 D503	T497-M499 HydrophobicContact CG2-CB 4.3Å; T497-M499 PolarHBondContact O-N 3.16Å; T497-M499 PolarHBondContact OG1-N 2.94Å; T497-D500 HydrophobicContact CG2-CB 3.82Å; T497-D500 PolarHBondContact O-N 2.95Å; T497-D503 PolarHBondContact N-OD2 2.84Å; T497-D503 WeakPolarHBondContact O-CB 3.3Å
498	V	95.1	Very high	93.2	Very high	5 Å²	5	51.6 Å²	51.6	3%	0.03	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-9.3	174.1	-64.2	0	0	0	0	113.2	C441 I471 D500 L504 R536 S539 I540	C441-V498 HydrophobicContact CB-CG1 3.57Å; I471-V498 HydrophobicContact CD1-CG1 4.28Å; I471-V498 HydrophobicContact CG2-CG1 3.61Å; V498-D500 VanDerWaalsContact C-N 3.31Å; V498-L504 HydrophobicContact CB-CD2 3.99Å; V498-L504 HydrophobicContact CG1-CD2 4.17Å; V498-R536 HydrophobicContact CG2-CB 3.72Å; V498-R536 HydrophobicContact CG2-CG 3.53Å; V498-S539 WeakPolarHBondContact O-CB 3.28Å; V498-S539 PolarHBondContact O-OG 3.31Å; V498-I540 HydrophobicContact CB-CG1 4.5Å
499	M	94.8	Very high	93.8	Very high	95 Å²	95	44 Å²	44	47%	0.468	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-17.6	174	-56.7	-56.7	-66.3	0	0	112.9	T497 M535 R536 S539	T497-M499 HydrophobicContact CG2-CB 4.3Å; T497-M499 PolarHBondContact O-N 3.16Å; T497-M499 PolarHBondContact OG1-N 2.94Å; M499-M535 HydrophobicContact CE-CB 4.12Å; M499-M535 HydrophobicContact CE-CE 4.07Å; M499-M535 HydrophobicContact SD-CB 4.43Å; M499-R536 HydrophobicContact SD-CG 4.45Å; M499-S539 WeakPolarHBondContact CA-OG 3.28Å
500	D	94.3	Very high	94.3	Very high	69 Å²	69	43.2 Å²	43.2	37%	0.369	23%	0.231	S	C	.	.	S	Bend	trans	-101.3	124.6	179.4	-172.8	0.6	0	0	0	110	T497 V498 V502 D503 L504	T497-D500 HydrophobicContact CG2-CB 3.82Å; T497-D500 PolarHBondContact O-N 2.95Å; V498-D500 VanDerWaalsContact C-N 3.31Å; D500-V502 PolarHBondContact O-N 3.02Å; D500-V502 PolarHBondContact OD1-N 3.29Å; D500-V502 VanDerWaalsContact OD1-N 3.13Å; D500-D503 HydrophobicContact CB-CB 4.37Å; D500-D503 PolarHBondContact O-N 2.96Å; D500-D503 VanDerWaalsContact O-N 3.15Å; D500-L504 PolarHBondContact O-N 3.37Å; D500-L504 VanDerWaalsContact O-N 3.16Å
501	S	94.1	Very high	94.5	Very high	70 Å²	70	44.5 Å²	44.5	49%	0.49	24%	0.238	S	C	.	.	H	α-helix	trans	-65.6	-25.5	-179.9	61.4	0	0	0	0	112.8	D503 L504 T505	S501-D503 VanDerWaalsContact C-N 3.34Å; S501-L504 PolarHBondContact O-N 3.47Å; S501-T505 PolarHBondContact O-N 3.19Å; S501-T505 PolarHBondContact O-OG1 3.33Å
502	V	94.9	Very high	94.6	Very high	93 Å²	93	44.9 Å²	44.9	56%	0.564	24%	0.241	S	C	*	.	H	α-helix	trans	-65.6	-41.2	175	-179.6	0	0	0	0	110.5	D500 T505 R506	D500-V502 PolarHBondContact O-N 3.02Å; D500-V502 PolarHBondContact OD1-N 3.29Å; D500-V502 VanDerWaalsContact OD1-N 3.13Å; V502-T505 PolarHBondContact O-N 2.98Å; V502-R506 WeakPolarHBondContact O-CB 3.25Å; V502-R506 PolarHBondContact O-N 3Å
503	D	95.8	Very high	94.6	Very high	19 Å²	19	42.2 Å²	42.2	10%	0.102	23%	0.23	C	C	.	.	H	α-helix	trans	-73.1	-34.9	179.2	-76.4	-22	0	0	0	111.7	I471 G496 T497 D500 S501 R506 V507	I471-D503 HydrophobicContact CD1-CB 3.94Å; G496-D503 WeakPolarHBondContact CA-OD2 3.42Å; T497-D503 PolarHBondContact N-OD2 2.84Å; T497-D503 WeakPolarHBondContact O-CB 3.3Å; D500-D503 HydrophobicContact CB-CB 4.37Å; D500-D503 PolarHBondContact O-N 2.96Å; D500-D503 VanDerWaalsContact O-N 3.15Å; S501-D503 VanDerWaalsContact C-N 3.34Å; D503-R506 WeakPolarHBondContact O-CB 3.39Å; D503-R506 PolarHBondContact O-N 3.48Å; D503-R506 IonicContact OD1-CZ 2.73Å; D503-R506 IonicContact OD1-NE 3.91Å; D503-R506 IonicContact OD1-NH1 2.61Å; D503-R506 PolarHBondContact OD1-NH1 2.87Å; D503-R506 IonicContact OD1-NH2 3.7Å; D503-R506 PolarHBondContact OD1-NH2 3.23Å; D503-V507 PolarHBondContact O-N 3.05Å
504	L	96.1	Very high	94.6	Very high	2 Å²	2	41.3 Å²	41.3	1%	0.01	23%	0.226	C	C	.	.	H	α-helix	trans	-62.9	-40.8	171.7	-63.6	176.3	0	0	0	112	V498 D500 S501 R506 V507 K508 V509 I540 Y543	V498-L504 HydrophobicContact CB-CD2 3.99Å; V498-L504 HydrophobicContact CG1-CD2 4.17Å; D500-L504 PolarHBondContact O-N 3.37Å; D500-L504 VanDerWaalsContact O-N 3.16Å; S501-L504 PolarHBondContact O-N 3.47Å; L504-R506 VanDerWaalsContact C-N 3.28Å; L504-R506 PolarHBondContact O-N 2.84Å; L504-V507 PolarHBondContact O-N 2.86Å; L504-K508 PolarHBondContact O-N 2.73Å; L504-V509 HydrophobicContact CB-CB 4.48Å; L504-V509 HydrophobicContact CB-CG2 4.06Å; L504-V509 HydrophobicContact CD2-CG2 3.71Å; L504-V509 HydrophobicContact CG-CG2 4.49Å; L504-V509 PolarHBondContact O-N 3.32Å; L504-I540 HydrophobicContact CD2-CG1 4.36Å; L504-Y543 HydrophobicContact CB-CD1 4.13Å; L504-Y543 HydrophobicContact CB-CD2 4.14Å; L504-Y543 HydrophobicContact CB-CE1 4.24Å; L504-Y543 HydrophobicContact CB-CE2 4.23Å; L504-Y543 HydrophobicContact CB-CG 4.09Å; L504-Y543 HydrophobicContact CD1-CD1 4.38Å; L504-Y543 HydrophobicContact CD1-CD2 4.1Å; L504-Y543 HydrophobicContact CD1-CG 3.77Å
505	T	96.2	Very high	94.6	Very high	70 Å²	70	40.9 Å²	40.9	43%	0.429	22%	0.224	S	C	.	.	H	α-helix	trans	-64.6	-36.1	174.3	-53.7	0	0	0	0	111.3	S501 V502 V507 K508 Y543	S501-T505 PolarHBondContact O-N 3.19Å; S501-T505 PolarHBondContact O-OG1 3.33Å; V502-T505 PolarHBondContact O-N 2.98Å; T505-V507 PolarHBondContact O-N 2.88Å; T505-K508 PolarHBondContact O-N 3.32Å; T505-Y543 VanDerWaalsContact CA-OH 3.31Å; T505-Y543 WeakPolarHBondContact CA-OH 3.43Å; T505-Y543 WeakPolarHBondContact CB-OH 3.41Å; T505-Y543 PolarHBondContact OG1-OH 3.46Å
506	R	94.5	Very high	94.8	Very high	31 Å²	31	38.3 Å²	38.3	12%	0.117	21%	0.212	C	C	.	.	H	α-helix	trans	-68	-33.1	-177.5	-171.2	-179.2	77.9	-174.6	3.6	113.3	G427 Q428 Y429 Q495 V502 D503 L504	G427-R506 WeakPolarHBondContact O-CD 3.21Å; G427-R506 WeakPolarHBondContact O-CG 3.44Å; Q428-R506 HydrophobicContact CB-CG 4.27Å; Q428-R506 HydrophobicContact CG-CB 4.33Å; Q428-R506 HydrophobicContact CG-CG 3.73Å; Y429-R506 PolarHBondContact N-O 3.12Å; Q495-R506 VanDerWaalsContact O-CZ 3.26Å; Q495-R506 PolarHBondContact O-NH1 3.37Å; Q495-R506 PolarHBondContact O-NH2 2.84Å; V502-R506 WeakPolarHBondContact O-CB 3.25Å; V502-R506 PolarHBondContact O-N 3Å; D503-R506 WeakPolarHBondContact O-CB 3.39Å; D503-R506 PolarHBondContact O-N 3.48Å; D503-R506 IonicContact OD1-CZ 2.73Å; D503-R506 IonicContact OD1-NE 3.91Å; D503-R506 IonicContact OD1-NH1 2.61Å; D503-R506 PolarHBondContact OD1-NH1 2.87Å; D503-R506 IonicContact OD1-NH2 3.7Å; D503-R506 PolarHBondContact OD1-NH2 3.23Å; L504-R506 VanDerWaalsContact C-N 3.28Å; L504-R506 PolarHBondContact O-N 2.84Å
507	V	95.1	Very high	95	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95	4	175	-55.4	0	0	0	0	112.9	H437 V439 L469 I471 F494 D503 L504 T505 V509	H437-V507 PolarHBondContact NE2-O 2.99Å; V439-V507 HydrophobicContact CG1-CG2 4.12Å; V439-V507 HydrophobicContact CG2-CB 4.44Å; V439-V507 HydrophobicContact CG2-CG2 4.12Å; L469-V507 HydrophobicContact CD2-CB 4.21Å; I471-V507 HydrophobicContact CD1-CG1 4.21Å; F494-V507 HydrophobicContact CB-CG1 4.06Å; F494-V507 HydrophobicContact CD2-CG1 4.01Å; F494-V507 HydrophobicContact CG-CG1 4Å; D503-V507 PolarHBondContact O-N 3.05Å; L504-V507 PolarHBondContact O-N 2.86Å; T505-V507 PolarHBondContact O-N 2.88Å; V507-V509 HydrophobicContact CG2-CG2 3.46Å; V507-V509 VanDerWaalsContact CG2-CG2 3.46Å
508	K	94.6	Very high	95	Very high	51 Å²	51	35.6 Å²	35.6	22%	0.222	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.5	56.1	179.7	-57.9	-175.8	157.5	-143.8	0	113	Y429 S431 H437 L504 T505 D510 E511 A512	Y429-K508 HydrophobicContact CD1-CB 4.39Å; Y429-K508 HydrophobicContact CD1-CD 4.08Å; Y429-K508 HydrophobicContact CD1-CG 4.38Å; S431-K508 PolarHBondContact OG-NZ 3.27Å; H437-K508 PolarHBondContact NE2-O 3.11Å; H437-K508 VanDerWaalsContact NE2-O 3.15Å; L504-K508 PolarHBondContact O-N 2.73Å; T505-K508 PolarHBondContact O-N 3.32Å; K508-D510 VanDerWaalsContact C-OD1 3.27Å; K508-D510 WeakPolarHBondContact CA-OD1 3.47Å; K508-D510 PolarHBondContact O-N 3.03Å; K508-E511 HydrophobicContact CB-CB 4.25Å; K508-E511 IonicContact NZ-OE1 3.46Å; K508-E511 PolarHBondContact NZ-OE1 2.82Å; K508-E511 IonicContact NZ-OE2 2.73Å; K508-E511 PolarHBondContact NZ-OE2 3.15Å; K508-E511 PolarHBondContact O-N 3.28Å; K508-E511 VanDerWaalsContact O-N 3.12Å; K508-A512 PolarHBondContact O-N 3.08Å
509	V	94.9	Very high	94.9	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.006	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-59.2	-30.9	178.2	174.3	0	0	0	0	111.9	V439 L504 V507 E511 A512 I540 Y543 I547	V439-V509 HydrophobicContact CG2-CG2 4.34Å; L504-V509 HydrophobicContact CB-CB 4.48Å; L504-V509 HydrophobicContact CB-CG2 4.06Å; L504-V509 HydrophobicContact CD2-CG2 3.71Å; L504-V509 HydrophobicContact CG-CG2 4.49Å; L504-V509 PolarHBondContact O-N 3.32Å; V507-V509 HydrophobicContact CG2-CG2 3.46Å; V507-V509 VanDerWaalsContact CG2-CG2 3.46Å; V509-E511 VanDerWaalsContact C-N 3.34Å; V509-E511 PolarHBondContact O-N 3.27Å; V509-A512 WeakPolarHBondContact O-CB 3.48Å; V509-A512 PolarHBondContact O-N 2.89Å; V509-I540 HydrophobicContact CG1-CG2 4.2Å; V509-Y543 HydrophobicContact CB-CD1 4.19Å; V509-Y543 HydrophobicContact CB-CE1 4.2Å; V509-Y543 HydrophobicContact CG1-CD1 4.32Å; V509-I547 HydrophobicContact CG1-CD1 3.45Å; V509-I547 VanDerWaalsContact CG1-CD1 3.45Å; V509-I547 WeakPolarHBondContact O-CD1 3.17Å
510	D	92.9	Very high	94.7	Very high	94 Å²	94	32.3 Å²	32.3	50%	0.503	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-63.5	-33.5	175.1	60.8	-42.1	0	0	0	113.8	K508 Y543	K508-D510 VanDerWaalsContact C-OD1 3.27Å; K508-D510 WeakPolarHBondContact CA-OD1 3.47Å; K508-D510 PolarHBondContact O-N 3.03Å; D510-Y543 HydrophobicContact CB-CE1 4.3Å
511	E	92.8	Very high	94.4	Very high	100 Å²	100	30.1 Å²	30.1	47%	0.467	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-90.3	-8.7	176	-66.4	177.9	-153.8	0	0	113.1	S431 K508 V509	S431-E511 VanDerWaalsContact CB-OE2 3.29Å; S431-E511 WeakPolarHBondContact CB-OE2 3.33Å; S431-E511 PolarHBondContact OG-OE2 3.45Å; K508-E511 HydrophobicContact CB-CB 4.25Å; K508-E511 IonicContact NZ-OE1 3.46Å; K508-E511 PolarHBondContact NZ-OE1 2.82Å; K508-E511 IonicContact NZ-OE2 2.73Å; K508-E511 PolarHBondContact NZ-OE2 3.15Å; K508-E511 PolarHBondContact O-N 3.28Å; K508-E511 VanDerWaalsContact O-N 3.12Å; V509-E511 VanDerWaalsContact C-N 3.34Å; V509-E511 PolarHBondContact O-N 3.27Å
512	A	94	Very high	93.8	Very high	13 Å²	13	30.8 Å²	30.8	11%	0.107	16%	0.158	C	C	.	.			trans	-72.4	148.3	-174.7	0	0	0	0	0	112.8	V439 K508 V509 I547	V439-A512 HydrophobicContact CG2-CB 4.04Å; K508-A512 PolarHBondContact O-N 3.08Å; V509-A512 WeakPolarHBondContact O-CB 3.48Å; V509-A512 PolarHBondContact O-N 2.89Å; A512-I547 HydrophobicContact CB-CD1 4.25Å
513	D	93.1	Very high	93.3	Very high	29 Å²	29	27.3 Å²	27.3	16%	0.155	14%	0.138	C	C	.	.	S	Bend	trans	-75.9	-38.6	179.2	-163.1	34.6	0	0	0	112.1	R436 H437 R783 Y1069	R436-D513 HydrophobicContact CB-CB 4.4Å; R436-D513 IonicContact CZ-OD2 2.92Å; R436-D513 IonicContact NH1-OD2 2.77Å; R436-D513 PolarHBondContact NH1-OD2 3.22Å; H437-D513 PolarHBondContact O-N 3.4Å; D513-R783 IonicContact OD1-CZ 3.03Å; D513-R783 IonicContact OD1-NH2 2.67Å; D513-R783 PolarHBondContact OD1-NH2 3.11Å; D513-Y1069 PolarHBondContact OD2-OH 3.45Å
514	A	95	Very high	92.7	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	157.5	175.7	0	0	0	0	0	111.3	I438 V439 R548 Y1069	I438-A514 WeakPolarHBondContact CA-O 3.48Å; I438-A514 HydrophobicContact CG2-CB 4.47Å; V439-A514 PolarHBondContact N-O 3.03Å; V439-A514 VanDerWaalsContact N-O 3.08Å; A514-R548 CarbonylContact C-O 3.57Å; A514-R548 VanDerWaalsContact CA-O 3.27Å; A514-R548 WeakPolarHBondContact CA-O 3.33Å; A514-R548 HydrophobicContact CB-CB 4.17Å; A514-R548 HydrophobicContact CB-CG 4.47Å; A514-Y1069 HydrophobicContact CB-CD2 3.88Å; A514-Y1069 HydrophobicContact CB-CE2 3.82Å
515	C	97	Very high	92.3	Very high	1 Å²	1	34 Å²	34	1%	0.007	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	128	167	-169.5	0	0	0	0	110.6	V439 I540 I547 R548 V549 I550	V439-C515 CarbonylContact O-C 3.57Å; V439-C515 VanDerWaalsContact O-CA 3.25Å; V439-C515 WeakPolarHBondContact O-CA 3.36Å; V439-C515 PolarHBondContact O-SG 3.21Å; C515-I540 HydrophobicContact CB-CD1 4.34Å; C515-I540 HydrophobicContact CB-CG2 4.36Å; C515-I540 WeakPolarHBondContact SG-CD1 3.35Å; C515-I547 HydrophobicContact CB-CD1 3.96Å; C515-R548 PolarHBondContact N-O 2.76Å; C515-V549 HydrophobicContact CB-CG2 4.49Å; C515-V549 WeakPolarHBondContact O-CA 3.48Å; C515-I550 PolarHBondContact O-N 2.86Å
516	L	96.9	Very high	92.1	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	127.2	178.8	-51.8	-174.8	0	0	0	109.4	I438 V439 V440 C441 F452 I550 M1065	I438-L516 HydrophobicContact CD1-CD1 3.75Å; I438-L516 HydrophobicContact CD1-CG 4.42Å; V439-L516 PolarHBondContact O-N 2.93Å; V440-L516 WeakPolarHBondContact CA-O 3.44Å; V440-L516 HydrophobicContact CG1-CB 4.39Å; V440-L516 HydrophobicContact CG2-CB 4.24Å; V440-L516 HydrophobicContact CG2-CD1 4.2Å; V440-L516 HydrophobicContact CG2-CG 4.48Å; C441-L516 PolarHBondContact N-O 3.17Å; F452-L516 HydrophobicContact CE2-CD1 3.54Å; F452-L516 HydrophobicContact CZ-CD1 3.51Å; L516-I550 CarbonylContact C-O 3.53Å; L516-I550 WeakPolarHBondContact CA-O 3.46Å; L516-I550 HydrophobicContact CD2-CB 3.74Å; L516-I550 HydrophobicContact CD2-CD1 3.72Å; L516-I550 HydrophobicContact CD2-CG1 4.04Å; L516-M1065 HydrophobicContact CB-CE 3.86Å; L516-M1065 HydrophobicContact CD2-CE 4.35Å
517	V	97.1	Very high	92	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	107.4	-179.5	-171	0	0	0	0	109.2	C441 N533 R536 V537 I540 V549 I550 V551 Q552	C441-V517 WeakPolarHBondContact O-CA 3.48Å; V517-N533 HydrophobicContact CG1-CB 4.21Å; V517-N533 VanDerWaalsContact CG1-OD1 3.23Å; V517-N533 WeakPolarHBondContact CG1-OD1 3.36Å; V517-R536 HydrophobicContact CG1-CB 4.46Å; V517-V537 HydrophobicContact CG2-CG2 4.34Å; V517-I540 HydrophobicContact CG2-CD1 4.29Å; V517-V549 HydrophobicContact CG2-CG1 4.14Å; V517-I550 PolarHBondContact N-O 2.64Å; V517-V551 HydrophobicContact CB-CB 4.08Å; V517-V551 HydrophobicContact CB-CG2 3.91Å; V517-V551 HydrophobicContact CG1-CG2 4.12Å; V517-V551 HydrophobicContact CG2-CB 4.43Å; V517-Q552 PolarHBondContact O-N 2.88Å
518	L	95.2	Very high	92	Very high	5 Å²	5	34.8 Å²	34.8	3%	0.026	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	142.4	179.5	-58.5	178.9	0	0	0	111.4	V440 C441 G442 Y443 I444 M1065	V440-L518 HydrophobicContact CG1-CD1 3.79Å; V440-L518 HydrophobicContact CG1-CG 4.01Å; C441-L518 PolarHBondContact O-N 2.75Å; G442-L518 WeakPolarHBondContact CA-O 3.27Å; Y443-L518 PolarHBondContact N-O 3.19Å; I444-L518 HydrophobicContact CD1-CD1 4.05Å; L518-M1065 HydrophobicContact CD2-CE 4.02Å; L518-M1065 HydrophobicContact CD2-CG 4.18Å
519	A	93.8	Very high	92	Very high	5 Å²	5	33.6 Å²	33.6	4%	0.041	19%	0.185	C	C	.	.			trans	-106.9	147.9	179.3	0	0	0	0	0	112.2	K521 N533 Q552	A519-K521 PolarHBondContact O-N 3.11Å; A519-N533 WeakPolarHBondContact CB-ND2 3.4Å; A519-Q552 HydrophobicContact CB-CB 3.75Å
520	N	90.9	Very high	92.1	Very high	25 Å²	25	33.6 Å²	33.6	13%	0.134	18%	0.184	C	C	.	.			trans	-76.5	102.9	167.2	-176.9	8.2	0	0	0	110.9	Y443 Y522 S523 E529	Y443-N520 HydrophobicContact CD1-CB 3.96Å; Y443-N520 HydrophobicContact CD2-CB 3.58Å; Y443-N520 HydrophobicContact CE1-CB 4.23Å; Y443-N520 HydrophobicContact CE2-CB 3.88Å; Y443-N520 HydrophobicContact CG-CB 3.61Å; N520-Y522 PolarHBondContact O-N 3.03Å; N520-Y522 PolarHBondContact OD1-N 3.34Å; N520-Y522 VanDerWaalsContact OD1-N 3.07Å; N520-S523 PolarHBondContact O-N 3.17Å; N520-E529 HydrophobicContact CB-CG 4.18Å; N520-E529 PolarHBondContact N-OE1 3.32Å
521	K	86.7	Confident	92.3	Very high	23 Å²	23	31.5 Å²	31.5	10%	0.1	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-21.4	-179.6	-50.9	-176	-171.5	172.2	0	114.2	A519 M554 L579 I1058 D1062	A519-K521 PolarHBondContact O-N 3.11Å; K521-M554 WeakPolarHBondContact O-CE 3.37Å; K521-L579 HydrophobicContact CD-CD1 4.18Å; K521-L579 HydrophobicContact CG-CD1 3.79Å; K521-I1058 HydrophobicContact CD-CD1 4.48Å; K521-I1058 HydrophobicContact CD-CG1 4.23Å; K521-I1058 HydrophobicContact CD-CG2 3.9Å; K521-I1058 PolarHBondContact NZ-O 2.95Å; K521-D1062 VanDerWaalsContact CE-CG 3.49Å; K521-D1062 WeakPolarHBondContact CE-OD1 2.99Å; K521-D1062 WeakPolarHBondContact CE-OD2 3.42Å; K521-D1062 IonicContact NZ-OD1 3.07Å; K521-D1062 PolarHBondContact NZ-OD1 2.83Å; K521-D1062 IonicContact NZ-OD2 3.84Å; K521-D1062 PolarHBondContact NZ-OD2 2.95Å
522	Y	81.8	Confident	92.5	Very high	84 Å²	84	28.3 Å²	28.3	33%	0.329	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104	18.9	-176.4	-48.3	-66	0	0	0	111.8	N520 V1024 I1058	N520-Y522 PolarHBondContact O-N 3.03Å; N520-Y522 PolarHBondContact OD1-N 3.34Å; N520-Y522 VanDerWaalsContact OD1-N 3.07Å; Y522-V1024 HydrophobicContact CD1-CG1 3.51Å; Y522-V1024 HydrophobicContact CE1-CG1 3.41Å; Y522-V1024 VanDerWaalsContact CE1-CG1 3.41Å; Y522-V1024 WeakPolarHBondContact CE1-O 3.41Å; Y522-V1024 PolarHBondContact OH-O 3.47Å; Y522-I1058 HydrophobicContact CE1-CG2 4.47Å
523	S	85	Confident	92.7	Very high	21 Å²	21	27.7 Å²	27.7	15%	0.147	17%	0.166	C	C	.	.			trans	-61.4	133.4	176.4	-174.6	0	0	0	0	110.5	N520 D525	N520-S523 PolarHBondContact O-N 3.17Å; S523-D525 PolarHBondContact O-N 3.04Å; S523-D525 PolarHBondContact OG-N 3.45Å; S523-D525 PolarHBondContact OG-O 2.83Å
524	P	82.4	Confident	92.9	Very high	78 Å²	78	27.1 Å²	27.1	51%	0.506	16%	0.163	S	C	.	.	S	Bend	trans	-66.6	-25.2	174	28.8	-35.6	0	0	0	112.5	V955	P524-V955 HydrophobicContact CB-CG1 3.6Å
525	D	89.2	Confident	93	Very high	82 Å²	82	31.6 Å²	31.6	44%	0.439	19%	0.185	S	C	.	.			trans	-121.9	98	173.5	-173.6	-14	0	0	0	108.7	S523 D527 A528 E529	S523-D525 PolarHBondContact O-N 3.04Å; S523-D525 PolarHBondContact OG-N 3.45Å; S523-D525 PolarHBondContact OG-O 2.83Å; D525-D527 VanDerWaalsContact C-N 3.29Å; D525-D527 PolarHBondContact O-N 3.27Å; D525-D527 PolarHBondContact OD1-N 3.2Å; D525-D527 VanDerWaalsContact OD1-N 3.1Å; D525-A528 HydrophobicContact CB-CB 3.99Å; D525-A528 PolarHBondContact OD1-N 3.25Å; D525-A528 VanDerWaalsContact OD1-N 3.13Å; D525-E529 PolarHBondContact O-N 2.68Å
526	P	91.4	Very high	93	Very high	5 Å²	5	34.1 Å²	34.1	3%	0.032	19%	0.194	C	C	.	.	H	α-helix	trans	-68.7	-28	-179.5	27.4	-34.6	0	0	0	112.9	D530 M554 Q555 P878	P526-D530 WeakPolarHBondContact O-CB 3.49Å; P526-D530 PolarHBondContact O-N 2.91Å; P526-D530 VanDerWaalsContact O-N 3.07Å; P526-M554 HydrophobicContact CB-CB 3.87Å; P526-M554 HydrophobicContact CB-CE 3.71Å; P526-M554 HydrophobicContact CB-CG 4.34Å; P526-M554 HydrophobicContact CB-SD 3.56Å; P526-M554 VanDerWaalsContact CB-SD 3.56Å; P526-Q555 HydrophobicContact CB-CG 4.15Å; P526-Q555 HydrophobicContact CG-CG 4.35Å; P526-P878 HydrophobicContact CG-CB 3.76Å
527	D	93.3	Very high	93	Very high	63 Å²	63	34.1 Å²	34.1	34%	0.337	19%	0.194	S	C	.	.	H	α-helix	trans	-72	-38.4	179.4	-73.7	-45.8	0	0	0	111.3	D525 D530 A531 H557 N558	D525-D527 VanDerWaalsContact C-N 3.29Å; D525-D527 PolarHBondContact O-N 3.27Å; D525-D527 PolarHBondContact OD1-N 3.2Å; D525-D527 VanDerWaalsContact OD1-N 3.1Å; D527-D530 PolarHBondContact O-N 2.73Å; D527-A531 WeakPolarHBondContact O-CB 3.36Å; D527-A531 PolarHBondContact O-N 2.85Å; D527-H557 IonicContact OD1-CD2 2.75Å; D527-H557 IonicContact OD1-CE1 3.17Å; D527-H557 IonicContact OD1-NE2 2.66Å; D527-H557 PolarHBondContact OD1-NE2 3.44Å; D527-H557 IonicContact OD2-NE2 3.05Å; D527-N558 PolarHBondContact OD1-ND2 3.22Å
528	A	94.7	Very high	93	Very high	50 Å²	50	37.5 Å²	37.5	41%	0.413	21%	0.211	S	C	.	.	H	α-helix	trans	-66	-38.2	175.1	0	0	0	0	0	112.9	D525 A531 A532	D525-A528 HydrophobicContact CB-CB 3.99Å; D525-A528 PolarHBondContact OD1-N 3.25Å; D525-A528 VanDerWaalsContact OD1-N 3.13Å; A528-A531 PolarHBondContact O-N 2.65Å; A528-A532 PolarHBondContact O-N 2.68Å
529	E	95	Very high	93.1	Very high	27 Å²	27	38.2 Å²	38.2	13%	0.126	22%	0.217	C	C	.	.	H	α-helix	trans	-67.6	-43.5	176.4	-178.3	59.1	-161	0	0	111.3	N520 D525 A531 A532 N533 R536 M554	N520-E529 HydrophobicContact CB-CG 4.18Å; N520-E529 PolarHBondContact N-OE1 3.32Å; D525-E529 PolarHBondContact O-N 2.68Å; E529-A531 PolarHBondContact O-N 3.41Å; E529-A532 WeakPolarHBondContact O-CB 3.29Å; E529-A532 PolarHBondContact O-N 3.47Å; E529-N533 PolarHBondContact O-N 3.12Å; E529-R536 IonicContact OE1-NH1 3.9Å; E529-R536 PolarHBondContact OE1-NH1 3.09Å; E529-M554 HydrophobicContact CB-SD 4.35Å; E529-M554 HydrophobicContact CG-SD 4.46Å
530	D	97	Very high	93.3	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.4	-43	174.4	-78.7	-10	0	0	0	112	P526 D527 A532 N533 I534 L553 M554 Q555 N558	P526-D530 WeakPolarHBondContact O-CB 3.49Å; P526-D530 PolarHBondContact O-N 2.91Å; P526-D530 VanDerWaalsContact O-N 3.07Å; D527-D530 PolarHBondContact O-N 2.73Å; D530-A532 VanDerWaalsContact C-N 3.29Å; D530-A532 PolarHBondContact O-N 2.99Å; D530-N533 PolarHBondContact O-N 3.48Å; D530-N533 VanDerWaalsContact O-N 3.14Å; D530-I534 WeakPolarHBondContact O-CD1 3.35Å; D530-I534 VanDerWaalsContact O-CG1 3.28Å; D530-I534 WeakPolarHBondContact O-CG1 3.39Å; D530-I534 PolarHBondContact O-N 2.92Å; D530-L553 HydrophobicContact CB-CD2 4.15Å; D530-L553 VanDerWaalsContact OD1-CA 3.3Å; D530-L553 WeakPolarHBondContact OD1-CA 2.98Å; D530-M554 PolarHBondContact OD1-N 3.11Å; D530-M554 PolarHBondContact OD2-N 2.87Å; D530-Q555 PolarHBondContact OD2-N 2.75Å; D530-N558 HydrophobicContact CB-CB 3.95Å; D530-N558 VanDerWaalsContact CB-ND2 3.3Å; D530-N558 WeakPolarHBondContact CB-ND2 3.46Å; D530-N558 PolarHBondContact OD2-ND2 3.07Å
531	A	97.1	Very high	93.5	Very high	50 Å²	50	37 Å²	37	41%	0.413	21%	0.21	S	C	.	.	H	α-helix	trans	-59.8	-40.5	175.3	0	0	0	0	0	111.7	D527 A528 E529 I534 M535	D527-A531 WeakPolarHBondContact O-CB 3.36Å; D527-A531 PolarHBondContact O-N 2.85Å; A528-A531 PolarHBondContact O-N 2.65Å; E529-A531 PolarHBondContact O-N 3.41Å; A531-I534 PolarHBondContact O-N 3.29Å; A531-M535 VanDerWaalsContact O-CG 3.32Å; A531-M535 WeakPolarHBondContact O-CG 3.4Å; A531-M535 PolarHBondContact O-N 3.34Å
532	A	97	Very high	93.9	Very high	34 Å²	34	42.8 Å²	42.8	28%	0.281	24%	0.241	S	C	.	.	H	α-helix	trans	-63.6	-42.5	174.2	0	0	0	0	0	111.7	A528 E529 D530 M535 R536	A528-A532 PolarHBondContact O-N 2.68Å; E529-A532 WeakPolarHBondContact O-CB 3.29Å; E529-A532 PolarHBondContact O-N 3.47Å; D530-A532 VanDerWaalsContact C-N 3.29Å; D530-A532 PolarHBondContact O-N 2.99Å; A532-M535 PolarHBondContact O-N 2.8Å; A532-R536 VanDerWaalsContact O-CG 3.27Å; A532-R536 WeakPolarHBondContact O-CG 3.4Å; A532-R536 PolarHBondContact O-N 2.87Å
533	N	97.4	Very high	94.6	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-63.5	-44.4	175.3	-82.9	-18	0	0	0	112.9	V517 A519 E529 D530 M535 R536 V537 V551 Q552 L553	V517-N533 HydrophobicContact CG1-CB 4.21Å; V517-N533 VanDerWaalsContact CG1-OD1 3.23Å; V517-N533 WeakPolarHBondContact CG1-OD1 3.36Å; A519-N533 WeakPolarHBondContact CB-ND2 3.4Å; E529-N533 PolarHBondContact O-N 3.12Å; D530-N533 PolarHBondContact O-N 3.48Å; D530-N533 VanDerWaalsContact O-N 3.14Å; N533-M535 VanDerWaalsContact C-N 3.3Å; N533-M535 PolarHBondContact O-N 2.68Å; N533-R536 WeakPolarHBondContact O-CB 3.11Å; N533-R536 PolarHBondContact O-N 3.39Å; N533-R536 VanDerWaalsContact O-N 3.1Å; N533-R536 PolarHBondContact OD1-NH1 3.27Å; N533-V537 WeakPolarHBondContact O-CG2 3.47Å; N533-V537 PolarHBondContact O-N 3.5Å; N533-V551 HydrophobicContact CB-CG2 4.11Å; N533-Q552 PolarHBondContact ND2-O 3.43Å; N533-Q552 VanDerWaalsContact ND2-O 3.07Å; N533-L553 HydrophobicContact CB-CD2 4.19Å
534	I	97.3	Very high	95.1	Very high	16 Å²	16	42.4 Å²	42.4	8%	0.082	24%	0.24	C	C	.	.	H	α-helix	trans	-59.2	-43	175.6	-68.2	160.2	0	0	0	110.3	D530 A531 R536 V537 I538 L553 N558 Y561 L562	D530-I534 WeakPolarHBondContact O-CD1 3.35Å; D530-I534 VanDerWaalsContact O-CG1 3.28Å; D530-I534 WeakPolarHBondContact O-CG1 3.39Å; D530-I534 PolarHBondContact O-N 2.92Å; A531-I534 PolarHBondContact O-N 3.29Å; I534-R536 VanDerWaalsContact C-N 3.33Å; I534-R536 PolarHBondContact O-N 2.85Å; I534-V537 PolarHBondContact O-N 3.12Å; I534-I538 HydrophobicContact CG2-CD1 4.03Å; I534-I538 WeakPolarHBondContact O-CG1 3.47Å; I534-I538 PolarHBondContact O-N 3.44Å; I534-L553 HydrophobicContact CG1-CD2 4.26Å; I534-N558 HydrophobicContact CD1-CB 4.24Å; I534-Y561 HydrophobicContact CD1-CD2 3.92Å; I534-Y561 HydrophobicContact CD1-CG 4.42Å; I534-L562 HydrophobicContact CB-CD2 4.49Å; I534-L562 HydrophobicContact CG1-CD2 4.03Å; I534-L562 HydrophobicContact CG1-CG 4.31Å; I534-L562 HydrophobicContact CG2-CD2 4.34Å
535	M	97	Very high	95.6	Very high	95 Å²	95	40.8 Å²	40.8	47%	0.468	23%	0.233	S	C	.	.	H	α-helix	trans	-63.3	-36.4	175.3	-72.1	-58.7	-59.8	0	0	113.1	M499 A531 A532 N533 I538 S539	M499-M535 HydrophobicContact CE-CB 4.12Å; M499-M535 HydrophobicContact CE-CE 4.07Å; M499-M535 HydrophobicContact SD-CB 4.43Å; A531-M535 VanDerWaalsContact O-CG 3.32Å; A531-M535 WeakPolarHBondContact O-CG 3.4Å; A531-M535 PolarHBondContact O-N 3.34Å; A532-M535 PolarHBondContact O-N 2.8Å; N533-M535 VanDerWaalsContact C-N 3.3Å; N533-M535 PolarHBondContact O-N 2.68Å; M535-I538 PolarHBondContact O-N 3.36Å; M535-I538 HydrophobicContact SD-CD1 4.07Å; M535-S539 PolarHBondContact O-N 2.73Å
536	R	97.4	Very high	95.7	Very high	54 Å²	54	42.8 Å²	42.8	20%	0.204	24%	0.244	C	C	.	.	H	α-helix	trans	-62.6	-45.5	172.9	-66.6	168	-172.8	135.5	4.1	110.7	V498 M499 V517 E529 A532 N533 I534 S539 I540	V498-R536 HydrophobicContact CG2-CB 3.72Å; V498-R536 HydrophobicContact CG2-CG 3.53Å; M499-R536 HydrophobicContact SD-CG 4.45Å; V517-R536 HydrophobicContact CG1-CB 4.46Å; E529-R536 IonicContact OE1-NH1 3.9Å; E529-R536 PolarHBondContact OE1-NH1 3.09Å; A532-R536 VanDerWaalsContact O-CG 3.27Å; A532-R536 WeakPolarHBondContact O-CG 3.4Å; A532-R536 PolarHBondContact O-N 2.87Å; N533-R536 WeakPolarHBondContact O-CB 3.11Å; N533-R536 PolarHBondContact O-N 3.39Å; N533-R536 VanDerWaalsContact O-N 3.1Å; N533-R536 PolarHBondContact OD1-NH1 3.27Å; I534-R536 VanDerWaalsContact C-N 3.33Å; I534-R536 PolarHBondContact O-N 2.85Å; R536-S539 WeakPolarHBondContact O-CB 3.41Å; R536-S539 PolarHBondContact O-N 2.73Å; R536-I540 WeakPolarHBondContact O-CD1 3.38Å; R536-I540 WeakPolarHBondContact O-CG1 3.02Å; R536-I540 PolarHBondContact O-N 3.11Å
537	V	97.2	Very high	95.9	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-60.4	-46.3	176.3	176.2	0	0	0	0	111.1	V517 N533 I534 S539 I540 K541 V549 V551 L562 I565 W568	V517-V537 HydrophobicContact CG2-CG2 4.34Å; N533-V537 WeakPolarHBondContact O-CG2 3.47Å; N533-V537 PolarHBondContact O-N 3.5Å; I534-V537 PolarHBondContact O-N 3.12Å; V537-S539 VanDerWaalsContact C-N 3.3Å; V537-S539 PolarHBondContact O-N 3.1Å; V537-I540 PolarHBondContact O-N 3.37Å; V537-K541 HydrophobicContact CG1-CG 4.12Å; V537-K541 WeakPolarHBondContact O-CB 3.46Å; V537-K541 WeakPolarHBondContact O-CG 3.41Å; V537-K541 PolarHBondContact O-N 2.98Å; V537-V549 HydrophobicContact CG1-CG1 4.33Å; V537-V549 HydrophobicContact CG2-CG1 4.02Å; V537-V551 HydrophobicContact CG2-CB 4.04Å; V537-V551 HydrophobicContact CG2-CG1 4.28Å; V537-V551 HydrophobicContact CG2-CG2 4.02Å; V537-L562 HydrophobicContact CB-CD2 4.14Å; V537-L562 HydrophobicContact CG1-CD2 3.99Å; V537-L562 HydrophobicContact CG2-CD2 4.25Å; V537-I565 HydrophobicContact CG1-CD1 4.18Å; V537-W568 HydrophobicContact CG1-CE3 3.91Å; V537-W568 HydrophobicContact CG1-CZ3 3.81Å
538	I	97.1	Very high	96	Very high	70 Å²	70	41.3 Å²	41.3	36%	0.359	23%	0.234	S	C	.	.	H	α-helix	trans	-57.2	-45.2	176.4	-68.7	166.9	0	0	0	110.6	I534 M535 N542 I565	I534-I538 HydrophobicContact CG2-CD1 4.03Å; I534-I538 WeakPolarHBondContact O-CG1 3.47Å; I534-I538 PolarHBondContact O-N 3.44Å; M535-I538 PolarHBondContact O-N 3.36Å; M535-I538 HydrophobicContact SD-CD1 4.07Å; I538-N542 WeakPolarHBondContact O-CB 3.26Å; I538-N542 PolarHBondContact O-N 3.12Å; I538-I565 HydrophobicContact CG1-CD1 3.67Å; I538-I565 HydrophobicContact CG1-CG1 4.25Å
539	S	96.8	Very high	96.1	Very high	20 Å²	20	39 Å²	39	14%	0.14	21%	0.214	C	C	.	.	H	α-helix	trans	-61.5	-45	178.6	-169.3	0	0	0	0	112.4	V498 M499 M535 R536 V537 Y543	V498-S539 WeakPolarHBondContact O-CB 3.28Å; V498-S539 PolarHBondContact O-OG 3.31Å; M499-S539 WeakPolarHBondContact CA-OG 3.28Å; M535-S539 PolarHBondContact O-N 2.73Å; R536-S539 WeakPolarHBondContact O-CB 3.41Å; R536-S539 PolarHBondContact O-N 2.73Å; V537-S539 VanDerWaalsContact C-N 3.3Å; V537-S539 PolarHBondContact O-N 3.1Å; S539-Y543 PolarHBondContact O-N 3.47Å; S539-Y543 VanDerWaalsContact O-N 3.11Å
540	I	97	Very high	96.1	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-64.5	-49.2	178.8	-67	157.3	0	0	0	110.9	V498 L504 V509 C515 V517 R536 V537 N542 Y543 S544 I547 V549	V498-I540 HydrophobicContact CB-CG1 4.5Å; L504-I540 HydrophobicContact CD2-CG1 4.36Å; V509-I540 HydrophobicContact CG1-CG2 4.2Å; C515-I540 HydrophobicContact CB-CD1 4.34Å; C515-I540 HydrophobicContact CB-CG2 4.36Å; C515-I540 WeakPolarHBondContact SG-CD1 3.35Å; V517-I540 HydrophobicContact CG2-CD1 4.29Å; R536-I540 WeakPolarHBondContact O-CD1 3.38Å; R536-I540 WeakPolarHBondContact O-CG1 3.02Å; R536-I540 PolarHBondContact O-N 3.11Å; V537-I540 PolarHBondContact O-N 3.37Å; I540-N542 VanDerWaalsContact C-N 3.33Å; I540-N542 PolarHBondContact O-N 3.5Å; I540-Y543 PolarHBondContact O-N 2.78Å; I540-Y543 VanDerWaalsContact O-N 3.14Å; I540-S544 PolarHBondContact O-N 3.41Å; I540-I547 HydrophobicContact CG2-CD1 4.44Å; I540-I547 HydrophobicContact CG2-CG2 3.66Å; I540-V549 HydrophobicContact CG2-CG2 3.87Å
541	K	96.1	Very high	96.1	Very high	6 Å²	6	37.7 Å²	37.7	3%	0.026	21%	0.208	C	C	.	.	H	α-helix	trans	-67.1	-32.4	-179.4	-72.3	-63.7	-166.2	172.8	0	112.9	V537 Y543 S544 A545 I547 V549 S567 D574	V537-K541 HydrophobicContact CG1-CG 4.12Å; V537-K541 WeakPolarHBondContact O-CB 3.46Å; V537-K541 WeakPolarHBondContact O-CG 3.41Å; V537-K541 PolarHBondContact O-N 2.98Å; K541-Y543 VanDerWaalsContact C-N 3.32Å; K541-S544 WeakPolarHBondContact CA-O 3.45Å; K541-S544 CarbonylContact O-C 3.58Å; K541-A545 PolarHBondContact NZ-O 3.38Å; K541-A545 WeakPolarHBondContact O-CA 3.4Å; K541-A545 PolarHBondContact O-N 2.8Å; K541-I547 PolarHBondContact NZ-O 2.81Å; K541-V549 HydrophobicContact CD-CG2 4.17Å; K541-V549 HydrophobicContact CG-CG2 4.49Å; K541-S567 PolarHBondContact NZ-O 2.93Å; K541-D574 WeakPolarHBondContact CE-OD2 3.37Å; K541-D574 IonicContact NZ-OD1 4Å; K541-D574 PolarHBondContact NZ-OD1 2.84Å; K541-D574 IonicContact NZ-OD2 2.74Å; K541-D574 PolarHBondContact NZ-OD2 2.89Å
542	N	95.5	Very high	96	Very high	143 Å²	143	35.4 Å²	35.4	77%	0.765	19%	0.189	S	C	*	.	H	α-helix	trans	-69.7	-30.1	173.2	-173	43.6	0	0	0	112.2	I538 I540	I538-N542 WeakPolarHBondContact O-CB 3.26Å; I538-N542 PolarHBondContact O-N 3.12Å; I540-N542 VanDerWaalsContact C-N 3.33Å; I540-N542 PolarHBondContact O-N 3.5Å
543	Y	96	Very high	96	Very high	76 Å²	76	33.8 Å²	33.8	30%	0.298	18%	0.176	S	C	.	.	H	α-helix	trans	-79	-46.4	174.2	-176.4	-94.2	0	0	0	112.4	L504 T505 V509 D510 S539 I540 K541	L504-Y543 HydrophobicContact CB-CD1 4.13Å; L504-Y543 HydrophobicContact CB-CD2 4.14Å; L504-Y543 HydrophobicContact CB-CE1 4.24Å; L504-Y543 HydrophobicContact CB-CE2 4.23Å; L504-Y543 HydrophobicContact CB-CG 4.09Å; L504-Y543 HydrophobicContact CD1-CD1 4.38Å; L504-Y543 HydrophobicContact CD1-CD2 4.1Å; L504-Y543 HydrophobicContact CD1-CG 3.77Å; T505-Y543 VanDerWaalsContact CA-OH 3.31Å; T505-Y543 WeakPolarHBondContact CA-OH 3.43Å; T505-Y543 WeakPolarHBondContact CB-OH 3.41Å; T505-Y543 PolarHBondContact OG1-OH 3.46Å; V509-Y543 HydrophobicContact CB-CD1 4.19Å; V509-Y543 HydrophobicContact CB-CE1 4.2Å; V509-Y543 HydrophobicContact CG1-CD1 4.32Å; D510-Y543 HydrophobicContact CB-CE1 4.3Å; S539-Y543 PolarHBondContact O-N 3.47Å; S539-Y543 VanDerWaalsContact O-N 3.11Å; I540-Y543 PolarHBondContact O-N 2.78Å; I540-Y543 VanDerWaalsContact O-N 3.14Å; K541-Y543 VanDerWaalsContact C-N 3.32Å
544	S	94.5	Very high	95.7	Very high	22 Å²	22	34.9 Å²	34.9	15%	0.154	18%	0.181	C	C	.	.			trans	-138.3	107.9	177.1	-178.6	0	0	0	0	109.9	I540 K541 D546 I547	I540-S544 PolarHBondContact O-N 3.41Å; K541-S544 WeakPolarHBondContact CA-O 3.45Å; K541-S544 CarbonylContact O-C 3.58Å; S544-D546 VanDerWaalsContact C-N 3.34Å; S544-D546 PolarHBondContact O-N 2.94Å; S544-I547 WeakPolarHBondContact O-CG2 3.32Å
545	A	93.3	Very high	95.5	Very high	44 Å²	44	34.8 Å²	34.8	36%	0.364	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-29.2	-177.8	0	0	0	0	0	113	K541	K541-A545 PolarHBondContact NZ-O 3.38Å; K541-A545 WeakPolarHBondContact O-CA 3.4Å; K541-A545 PolarHBondContact O-N 2.8Å
546	D	92.8	Very high	95.2	Very high	123 Å²	123	31.5 Å²	31.5	66%	0.658	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-9.7	-173.1	-69.6	-23.4	0	0	0	114	S544 R572	S544-D546 VanDerWaalsContact C-N 3.34Å; S544-D546 PolarHBondContact O-N 2.94Å; D546-R572 IonicContact OD1-CZ 3.96Å; D546-R572 IonicContact OD1-NH1 3.02Å; D546-R572 PolarHBondContact OD1-NH1 2.91Å
547	I	94.2	Very high	94.7	Very high	9 Å²	9	32.9 Å²	32.9	5%	0.046	17%	0.171	C	C	.	.	S	Bend	trans	-67.9	139	-179.8	-167.5	177.6	0	0	0	111.3	V509 A512 C515 I540 K541 S544 V549	V509-I547 HydrophobicContact CG1-CD1 3.45Å; V509-I547 VanDerWaalsContact CG1-CD1 3.45Å; V509-I547 WeakPolarHBondContact O-CD1 3.17Å; A512-I547 HydrophobicContact CB-CD1 4.25Å; C515-I547 HydrophobicContact CB-CD1 3.96Å; I540-I547 HydrophobicContact CG2-CD1 4.44Å; I540-I547 HydrophobicContact CG2-CG2 3.66Å; K541-I547 PolarHBondContact NZ-O 2.81Å; S544-I547 WeakPolarHBondContact O-CG2 3.32Å; I547-V549 HydrophobicContact CG2-CG2 3.93Å
548	R	95.4	Very high	94.5	Very high	29 Å²	29	33.4 Å²	33.4	11%	0.109	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	126.6	170.5	-173.2	-176.7	176.7	-173.5	3.9	110.5	A514 C515 G573 D574 D575 T1068 Y1069 D1072	A514-R548 CarbonylContact C-O 3.57Å; A514-R548 VanDerWaalsContact CA-O 3.27Å; A514-R548 WeakPolarHBondContact CA-O 3.33Å; A514-R548 HydrophobicContact CB-CB 4.17Å; A514-R548 HydrophobicContact CB-CG 4.47Å; C515-R548 PolarHBondContact N-O 2.76Å; R548-G573 WeakPolarHBondContact CD-O 3.44Å; R548-G573 WeakPolarHBondContact CG-O 3.41Å; R548-G573 PolarHBondContact NE-O 2.96Å; R548-D574 WeakPolarHBondContact CA-OD1 3.3Å; R548-D575 IonicContact CZ-OD2 3.97Å; R548-D575 IonicContact NH2-OD2 3.04Å; R548-D575 PolarHBondContact NH2-OD2 3.25Å; R548-T1068 PolarHBondContact NH2-O 3.16Å; R548-Y1069 PolarHBondContact NH1-O 2.86Å; R548-Y1069 VanDerWaalsContact NH1-O 3.1Å; R548-D1072 IonicContact CZ-OD1 3.59Å; R548-D1072 IonicContact NH1-OD1 2.89Å; R548-D1072 PolarHBondContact NH1-OD1 2.84Å; R548-D1072 IonicContact NH1-OD2 3.12Å; R548-D1072 IonicContact NH2-OD1 3.24Å; R548-D1072 PolarHBondContact NH2-OD1 3.2Å
549	V	96.7	Very high	94.3	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	124.5	177.1	-176	0	0	0	0	110.6	C515 V517 V537 I540 K541 I547 W568 D574 D575	C515-V549 HydrophobicContact CB-CG2 4.49Å; C515-V549 WeakPolarHBondContact O-CA 3.48Å; V517-V549 HydrophobicContact CG2-CG1 4.14Å; V537-V549 HydrophobicContact CG1-CG1 4.33Å; V537-V549 HydrophobicContact CG2-CG1 4.02Å; I540-V549 HydrophobicContact CG2-CG2 3.87Å; K541-V549 HydrophobicContact CD-CG2 4.17Å; K541-V549 HydrophobicContact CG-CG2 4.49Å; I547-V549 HydrophobicContact CG2-CG2 3.93Å; V549-W568 HydrophobicContact CB-CZ3 4.27Å; V549-W568 HydrophobicContact CG1-CZ3 4.42Å; V549-D574 PolarHBondContact N-OD1 3.5Å; V549-D574 WeakPolarHBondContact O-CA 3.07Å; V549-D575 PolarHBondContact O-N 2.68Å; V549-D575 VanDerWaalsContact O-N 3.17Å
550	I	96	Very high	93.9	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	120.9	172.3	-54.9	172.8	0	0	0	107.6	C515 L516 V517 D575 I577 M1065 T1068	C515-I550 PolarHBondContact O-N 2.86Å; L516-I550 CarbonylContact C-O 3.53Å; L516-I550 WeakPolarHBondContact CA-O 3.46Å; L516-I550 HydrophobicContact CD2-CB 3.74Å; L516-I550 HydrophobicContact CD2-CD1 3.72Å; L516-I550 HydrophobicContact CD2-CG1 4.04Å; V517-I550 PolarHBondContact N-O 2.64Å; I550-D575 WeakPolarHBondContact CA-O 3.26Å; I550-D575 HydrophobicContact CG1-CB 4.37Å; I550-D575 HydrophobicContact CG2-CB 4.39Å; I550-I577 HydrophobicContact CG2-CD1 4.24Å; I550-I577 HydrophobicContact CG2-CG1 4.29Å; I550-M1065 HydrophobicContact CB-CE 4.34Å; I550-M1065 HydrophobicContact CG2-CE 3.87Å; I550-M1065 HydrophobicContact CG2-SD 3.75Å; I550-T1068 HydrophobicContact CD1-CG2 4.01Å; I550-T1068 HydrophobicContact CG1-CG2 4.47Å; I550-T1068 HydrophobicContact CG2-CG2 4.22Å
551	V	96.6	Very high	93.6	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	135.6	-174.6	57.9	0	0	0	0	111.5	V517 N533 V537 L553 L562 W568 D575 V576 I577	V517-V551 HydrophobicContact CB-CB 4.08Å; V517-V551 HydrophobicContact CB-CG2 3.91Å; V517-V551 HydrophobicContact CG1-CG2 4.12Å; V517-V551 HydrophobicContact CG2-CB 4.43Å; N533-V551 HydrophobicContact CB-CG2 4.11Å; V537-V551 HydrophobicContact CG2-CB 4.04Å; V537-V551 HydrophobicContact CG2-CG1 4.28Å; V537-V551 HydrophobicContact CG2-CG2 4.02Å; V551-L553 HydrophobicContact CG2-CD2 4.09Å; V551-L553 HydrophobicContact CG2-CG 4.49Å; V551-L562 HydrophobicContact CG1-CD1 3.58Å; V551-W568 HydrophobicContact CG1-CH2 3.85Å; V551-W568 HydrophobicContact CG1-CZ3 4.31Å; V551-D575 PolarHBondContact N-O 2.91Å; V551-V576 HydrophobicContact CG1-CB 4.49Å; V551-V576 HydrophobicContact CG1-CG1 4.28Å; V551-V576 HydrophobicContact CG1-CG2 4.18Å; V551-I577 PolarHBondContact O-N 2.97Å
552	Q	95.7	Very high	93.4	Very high	3 Å²	3	36.7 Å²	36.7	1%	0.014	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	129.1	166.2	-66.2	-178.6	-37	0	0	109.8	V517 A519 N533 I577 D1062 M1065	V517-Q552 PolarHBondContact O-N 2.88Å; A519-Q552 HydrophobicContact CB-CB 3.75Å; N533-Q552 PolarHBondContact ND2-O 3.43Å; N533-Q552 VanDerWaalsContact ND2-O 3.07Å; Q552-I577 WeakPolarHBondContact CA-O 3.43Å; Q552-I577 HydrophobicContact CG-CB 4.47Å; Q552-D1062 PolarHBondContact NE2-OD1 3.46Å; Q552-M1065 HydrophobicContact CG-CE 4.21Å; Q552-M1065 HydrophobicContact CG-CG 3.89Å; Q552-M1065 HydrophobicContact CG-SD 3.41Å; Q552-M1065 WeakPolarHBondContact CG-SD 3.27Å; Q552-M1065 VanDerWaalsContact NE2-CG 3.29Å
553	L	95.4	Very high	92.9	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	145.4	167.4	-64.1	-174.7	0	0	0	109.6	D530 N533 I534 V551 N558 K559 L562 V576 I577 C578 L579	D530-L553 HydrophobicContact CB-CD2 4.15Å; D530-L553 VanDerWaalsContact OD1-CA 3.3Å; D530-L553 WeakPolarHBondContact OD1-CA 2.98Å; N533-L553 HydrophobicContact CB-CD2 4.19Å; I534-L553 HydrophobicContact CG1-CD2 4.26Å; V551-L553 HydrophobicContact CG2-CD2 4.09Å; V551-L553 HydrophobicContact CG2-CG 4.49Å; L553-N558 HydrophobicContact CD1-CB 4.46Å; L553-K559 HydrophobicContact CD1-CB 4.27Å; L553-L562 HydrophobicContact CD1-CD1 3.74Å; L553-L562 HydrophobicContact CD1-CG 4.48Å; L553-L562 HydrophobicContact CG-CD1 4.35Å; L553-V576 HydrophobicContact CB-CG1 4.27Å; L553-V576 HydrophobicContact CD1-CG1 3.7Å; L553-V576 HydrophobicContact CG-CG1 3.82Å; L553-I577 PolarHBondContact N-O 3.07Å; L553-C578 CarbonylContact O-C 2.92Å; L553-C578 WeakPolarHBondContact O-CA 3.12Å; L553-L579 PolarHBondContact O-N 3.3Å
554	M	92.8	Very high	92.5	Very high	23 Å²	23	35.3 Å²	35.3	11%	0.113	18%	0.182	C	C	.	.	S	Bend	trans	-77.8	-50.7	176	-62.5	-167.6	70.5	0	0	110.7	K521 P526 E529 D530 A580	K521-M554 WeakPolarHBondContact O-CE 3.37Å; P526-M554 HydrophobicContact CB-CB 3.87Å; P526-M554 HydrophobicContact CB-CE 3.71Å; P526-M554 HydrophobicContact CB-CG 4.34Å; P526-M554 HydrophobicContact CB-SD 3.56Å; P526-M554 VanDerWaalsContact CB-SD 3.56Å; E529-M554 HydrophobicContact CB-SD 4.35Å; E529-M554 HydrophobicContact CG-SD 4.46Å; D530-M554 PolarHBondContact OD1-N 3.11Å; D530-M554 PolarHBondContact OD2-N 2.87Å; M554-A580 WeakPolarHBondContact O-CB 3.47Å; M554-A580 PolarHBondContact O-N 2.79Å; M554-A580 VanDerWaalsContact O-N 3.13Å
555	Q	91.9	Very high	92.4	Very high	13 Å²	13	35.3 Å²	35.3	6%	0.061	18%	0.18	C	C	.	.			trans	-104.5	147.1	-171.4	-63.5	-68	-28.6	0	0	113.1	P526 D530 H557 L879	P526-Q555 HydrophobicContact CB-CG 4.15Å; P526-Q555 HydrophobicContact CG-CG 4.35Å; D530-Q555 PolarHBondContact OD2-N 2.75Å; Q555-H557 VanDerWaalsContact CB-CE1 3.44Å; Q555-H557 WeakPolarHBondContact CB-CE1 3.15Å; Q555-L879 PolarHBondContact NE2-O 2.94Å; Q555-L879 PolarHBondContact OE1-O 3.39Å
556	Y	90.5	Very high	92.3	Very high	27 Å²	27	39.4 Å²	39.4	11%	0.106	20%	0.203	C	C	.	.	S	Bend	trans	-73.8	-38	-178	-178.8	-98.7	0	0	0	113.1	N558 K559 C578 E581 N884 E1091 L1094	Y556-N558 PolarHBondContact O-N 3.4Å; Y556-K559 HydrophobicContact CD2-CD 4.28Å; Y556-K559 HydrophobicContact CE2-CD 4.09Å; Y556-K559 WeakPolarHBondContact O-CB 3.42Å; Y556-K559 PolarHBondContact O-N 2.96Å; Y556-K559 VanDerWaalsContact O-N 3.13Å; Y556-C578 VanDerWaalsContact CA-SG 3.56Å; Y556-E581 HydrophobicContact CD2-CB 4.12Å; Y556-E581 HydrophobicContact CD2-CG 4.2Å; Y556-E581 HydrophobicContact CE2-CG 4.4Å; Y556-N884 WeakPolarHBondContact CB-ND2 3.26Å; Y556-E1091 PolarHBondContact OH-OE1 3.25Å; Y556-L1094 HydrophobicContact CE1-CD1 4.15Å
557	H	88.3	Confident	92.3	Very high	82 Å²	82	35.6 Å²	35.6	38%	0.38	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-29.5	-179.8	52.5	-92.1	0	0	0	112.8	D527 Q555 K559 A560	D527-H557 IonicContact OD1-CD2 2.75Å; D527-H557 IonicContact OD1-CE1 3.17Å; D527-H557 IonicContact OD1-NE2 2.66Å; D527-H557 PolarHBondContact OD1-NE2 3.44Å; D527-H557 IonicContact OD2-NE2 3.05Å; Q555-H557 VanDerWaalsContact CB-CE1 3.44Å; Q555-H557 WeakPolarHBondContact CB-CE1 3.15Å; H557-K559 PolarHBondContact O-N 3.04Å; H557-A560 PolarHBondContact O-N 3.42Å
558	N	92.7	Very high	92.2	Very high	11 Å²	11	36.2 Å²	36.2	6%	0.059	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-20.5	177.9	-68	-28.5	0	0	0	112.9	D527 D530 I534 L553 Y556 A560 Y561	D527-N558 PolarHBondContact OD1-ND2 3.22Å; D530-N558 HydrophobicContact CB-CB 3.95Å; D530-N558 VanDerWaalsContact CB-ND2 3.3Å; D530-N558 WeakPolarHBondContact CB-ND2 3.46Å; D530-N558 PolarHBondContact OD2-ND2 3.07Å; I534-N558 HydrophobicContact CD1-CB 4.24Å; L553-N558 HydrophobicContact CD1-CB 4.46Å; Y556-N558 PolarHBondContact O-N 3.4Å; N558-A560 PolarHBondContact O-N 3.44Å; N558-Y561 HydrophobicContact CB-CD2 4.31Å; N558-Y561 WeakPolarHBondContact O-CD2 3.34Å; N558-Y561 PolarHBondContact O-N 3.35Å; N558-Y561 WeakPolarHBondContact OD1-CE2 3.47Å
559	K	91.3	Very high	91.8	Very high	10 Å²	10	37 Å²	37	4%	0.043	19%	0.194	C	C	.	.	H	α-helix	trans	-59.9	-33.9	176.2	-171.2	178.1	-173	-177.9	0	112.8	L553 Y556 H557 Y561 L562 V576 E581 E1091	L553-K559 HydrophobicContact CD1-CB 4.27Å; Y556-K559 HydrophobicContact CD2-CD 4.28Å; Y556-K559 HydrophobicContact CE2-CD 4.09Å; Y556-K559 WeakPolarHBondContact O-CB 3.42Å; Y556-K559 PolarHBondContact O-N 2.96Å; Y556-K559 VanDerWaalsContact O-N 3.13Å; H557-K559 PolarHBondContact O-N 3.04Å; K559-Y561 PolarHBondContact O-N 3.49Å; K559-L562 PolarHBondContact O-N 2.95Å; K559-L562 VanDerWaalsContact O-N 3.15Å; K559-V576 HydrophobicContact CD-CG1 4.5Å; K559-V576 HydrophobicContact CG-CB 4.31Å; K559-V576 HydrophobicContact CG-CG1 4.07Å; K559-V576 HydrophobicContact CG-CG2 4.4Å; K559-E581 IonicContact NZ-OE1 3.82Å; K559-E581 IonicContact NZ-OE2 3.65Å; K559-E581 PolarHBondContact NZ-OE2 2.88Å; K559-E1091 WeakPolarHBondContact CE-OE1 3.4Å; K559-E1091 IonicContact NZ-OE1 3.5Å; K559-E1091 PolarHBondContact NZ-OE1 3.18Å; K559-E1091 IonicContact NZ-OE2 3.84Å
560	A	88.5	Confident	91.1	Very high	24 Å²	24	42.4 Å²	42.4	20%	0.198	22%	0.215	C	C	.	.	H	α-helix	trans	-61.1	-29.9	-179.8	0	0	0	0	0	112.6	H557 N558 L562 L563 N564 A1095	H557-A560 PolarHBondContact O-N 3.42Å; N558-A560 PolarHBondContact O-N 3.44Å; A560-L562 VanDerWaalsContact C-N 3.28Å; A560-L562 PolarHBondContact O-N 3.33Å; A560-L563 PolarHBondContact O-N 3.27Å; A560-N564 PolarHBondContact O-ND2 3.13Å; A560-A1095 HydrophobicContact CB-CB 3.83Å
561	Y	91.4	Very high	90.4	Very high	132 Å²	132	49.2 Å²	49.2	52%	0.518	24%	0.24	S	C	.	.	H	α-helix	trans	-66.2	-30	178.7	-60.9	-56	0	0	0	113.1	I534 N558 K559 N564	I534-Y561 HydrophobicContact CD1-CD2 3.92Å; I534-Y561 HydrophobicContact CD1-CG 4.42Å; N558-Y561 HydrophobicContact CB-CD2 4.31Å; N558-Y561 WeakPolarHBondContact O-CD2 3.34Å; N558-Y561 PolarHBondContact O-N 3.35Å; N558-Y561 WeakPolarHBondContact OD1-CE2 3.47Å; K559-Y561 PolarHBondContact O-N 3.49Å; Y561-N564 PolarHBondContact O-N 2.91Å
562	L	92	Very high	89.7	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-71.2	-36.8	177.4	-66.2	175.2	0	0	0	111.8	I534 V537 V551 L553 K559 A560 N564 I565 W568 V576	I534-L562 HydrophobicContact CB-CD2 4.49Å; I534-L562 HydrophobicContact CG1-CD2 4.03Å; I534-L562 HydrophobicContact CG1-CG 4.31Å; I534-L562 HydrophobicContact CG2-CD2 4.34Å; V537-L562 HydrophobicContact CB-CD2 4.14Å; V537-L562 HydrophobicContact CG1-CD2 3.99Å; V537-L562 HydrophobicContact CG2-CD2 4.25Å; V551-L562 HydrophobicContact CG1-CD1 3.58Å; L553-L562 HydrophobicContact CD1-CD1 3.74Å; L553-L562 HydrophobicContact CD1-CG 4.48Å; L553-L562 HydrophobicContact CG-CD1 4.35Å; K559-L562 PolarHBondContact O-N 2.95Å; K559-L562 VanDerWaalsContact O-N 3.15Å; A560-L562 VanDerWaalsContact C-N 3.28Å; A560-L562 PolarHBondContact O-N 3.33Å; L562-N564 PolarHBondContact O-N 3.36Å; L562-I565 HydrophobicContact CD2-CD1 3.83Å; L562-I565 WeakPolarHBondContact O-CB 3.17Å; L562-I565 PolarHBondContact O-N 3.23Å; L562-W568 HydrophobicContact CB-CD2 4.23Å; L562-W568 HydrophobicContact CB-CE3 4.49Å; L562-W568 HydrophobicContact CD1-CH2 4.32Å; L562-W568 HydrophobicContact CD2-CE3 4.49Å; L562-W568 HydrophobicContact CD2-CZ3 4.49Å; L562-W568 WeakPolarHBondContact O-CB 3.08Å; L562-V576 HydrophobicContact CD1-CB 4.39Å; L562-V576 HydrophobicContact CD1-CG1 4.03Å; L562-V576 HydrophobicContact CD1-CG2 3.44Å; L562-V576 VanDerWaalsContact CD1-CG2 3.44Å
563	L	85.2	Confident	89.1	Confident	67 Å²	67	55.5 Å²	55.5	35%	0.351	27%	0.266	S	S	.	.	H	α-helix	trans	-64.5	-21.6	176.5	-62.5	175.8	0	0	0	112.8	A560 I565	A560-L563 PolarHBondContact O-N 3.27Å; L563-I565 VanDerWaalsContact C-N 3.33Å
564	N	87.3	Confident	89	Confident	122 Å²	122	55.7 Å²	55.7	65%	0.652	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-7.7	176.4	-65.1	-30	0	0	0	113.4	A560 Y561 L562	A560-N564 PolarHBondContact O-ND2 3.13Å; Y561-N564 PolarHBondContact O-N 2.91Å; L562-N564 PolarHBondContact O-N 3.36Å
565	I	92	Very high	89	Confident	22 Å²	22	55.3 Å²	55.3	11%	0.113	27%	0.265	C	S	.	.			trans	-79.6	122.4	177.2	-60.7	172.9	0	0	0	108.3	V537 I538 L562 L563 S567 W568	V537-I565 HydrophobicContact CG1-CD1 4.18Å; I538-I565 HydrophobicContact CG1-CD1 3.67Å; I538-I565 HydrophobicContact CG1-CG1 4.25Å; L562-I565 HydrophobicContact CD2-CD1 3.83Å; L562-I565 WeakPolarHBondContact O-CB 3.17Å; L562-I565 PolarHBondContact O-N 3.23Å; L563-I565 VanDerWaalsContact C-N 3.33Å; I565-S567 PolarHBondContact O-N 2.99Å; I565-W568 HydrophobicContact CB-CB 3.94Å; I565-W568 HydrophobicContact CG2-CB 4.29Å; I565-W568 VanDerWaalsContact O-CB 3.27Å; I565-W568 WeakPolarHBondContact O-CB 3.38Å; I565-W568 PolarHBondContact O-N 2.89Å
566	P	91.5	Very high	89	Confident	131 Å²	131	55.2 Å²	55.2	85%	0.851	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-26.7	-172.9	25.3	-35.3	0	0	0	113.9
567	S	92.6	Very high	89.2	Confident	42 Å²	42	53.9 Å²	53.9	29%	0.294	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	1.7	177.9	-51.8	0	0	0	0	113.6	K541 I565	K541-S567 PolarHBondContact NZ-O 2.93Å; I565-S567 PolarHBondContact O-N 2.99Å
568	W	91.9	Very high	89.5	Confident	23 Å²	23	50 Å²	50	9%	0.087	24%	0.242	C	C	.	.			trans	-84	115.9	177	-177.1	-88.9	0	0	0	109.8	V537 V549 V551 L562 I565 D574 V576	V537-W568 HydrophobicContact CG1-CE3 3.91Å; V537-W568 HydrophobicContact CG1-CZ3 3.81Å; V549-W568 HydrophobicContact CB-CZ3 4.27Å; V549-W568 HydrophobicContact CG1-CZ3 4.42Å; V551-W568 HydrophobicContact CG1-CH2 3.85Å; V551-W568 HydrophobicContact CG1-CZ3 4.31Å; L562-W568 HydrophobicContact CB-CD2 4.23Å; L562-W568 HydrophobicContact CB-CE3 4.49Å; L562-W568 HydrophobicContact CD1-CH2 4.32Å; L562-W568 HydrophobicContact CD2-CE3 4.49Å; L562-W568 HydrophobicContact CD2-CZ3 4.49Å; L562-W568 WeakPolarHBondContact O-CB 3.08Å; I565-W568 HydrophobicContact CB-CB 3.94Å; I565-W568 HydrophobicContact CG2-CB 4.29Å; I565-W568 VanDerWaalsContact O-CB 3.27Å; I565-W568 WeakPolarHBondContact O-CB 3.38Å; I565-W568 PolarHBondContact O-N 2.89Å; W568-D574 HydrophobicContact CD2-CB 3.94Å; W568-D574 HydrophobicContact CE3-CB 4.09Å; W568-D574 HydrophobicContact CH2-CB 3.83Å; W568-D574 HydrophobicContact CZ2-CB 3.67Å; W568-D574 WeakPolarHBondContact CZ2-O 3.4Å; W568-D574 HydrophobicContact CZ3-CB 4.05Å; W568-V576 HydrophobicContact CH2-CG2 3.83Å; W568-V576 HydrophobicContact CZ2-CG2 3.34Å
569	D	88	Confident	89.5	Confident	45 Å²	45	49.7 Å²	49.7	24%	0.241	24%	0.24	C	C	.	.			trans	-133.2	98.5	-176.2	-172.9	1.3	0	0	0	110.9	R571 R572 D574	D569-R571 PolarHBondContact O-N 2.79Å; D569-R571 VanDerWaalsContact O-N 3.11Å; D569-R571 VanDerWaalsContact OD1-CB 3.26Å; D569-R571 WeakPolarHBondContact OD1-CB 3.42Å; D569-R571 PolarHBondContact OD1-N 3.05Å; D569-R572 HydrophobicContact CB-CB 4.39Å; D569-R572 HydrophobicContact CB-CG 4.11Å; D569-R572 PolarHBondContact O-N 2.91Å; D569-R572 WeakPolarHBondContact OD2-CD 3.28Å; D569-R572 VanDerWaalsContact OD2-CG 3.3Å; D569-R572 WeakPolarHBondContact OD2-CG 3.31Å; D569-R572 IonicContact OD2-NE 3.66Å; D569-R572 PolarHBondContact OD2-NE 2.95Å; D569-D574 PolarHBondContact N-OD2 2.99Å; D569-D574 WeakPolarHBondContact O-CB 3.49Å; D569-D574 PolarHBondContact O-N 2.82Å
570	W	82.3	Confident	89.6	Confident	113 Å²	113	49.6 Å²	49.6	43%	0.428	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-59.3	-23.1	177.3	61.4	-92.3	0	0	0	112.7	R572 G573 E671	W570-R572 VanDerWaalsContact C-N 3.26Å; W570-R572 PolarHBondContact O-N 2.99Å; W570-G573 PolarHBondContact O-N 3.07Å; W570-E671 HydrophobicContact CH2-CG 4.25Å
571	R	80.1	Confident	89.8	Confident	143 Å²	143	48.7 Å²	48.7	54%	0.54	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-72.8	-20.3	177.4	-57.5	175.9	172.1	-178.2	-6.4	112.5	D569 G573 E671	D569-R571 PolarHBondContact O-N 2.79Å; D569-R571 VanDerWaalsContact O-N 3.11Å; D569-R571 VanDerWaalsContact OD1-CB 3.26Å; D569-R571 WeakPolarHBondContact OD1-CB 3.42Å; D569-R571 PolarHBondContact OD1-N 3.05Å; R571-G573 VanDerWaalsContact C-N 3.34Å; R571-E671 IonicContact NH2-OE1 3.46Å
572	R	82.1	Confident	89.9	Confident	131 Å²	131	42.5 Å²	42.5	49%	0.494	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-89.1	-2.3	174.5	-65.5	176.4	-169.4	-154.7	-2.7	113.1	D546 D569 W570	D546-R572 IonicContact OD1-CZ 3.96Å; D546-R572 IonicContact OD1-NH1 3.02Å; D546-R572 PolarHBondContact OD1-NH1 2.91Å; D569-R572 HydrophobicContact CB-CB 4.39Å; D569-R572 HydrophobicContact CB-CG 4.11Å; D569-R572 PolarHBondContact O-N 2.91Å; D569-R572 WeakPolarHBondContact OD2-CD 3.28Å; D569-R572 VanDerWaalsContact OD2-CG 3.3Å; D569-R572 WeakPolarHBondContact OD2-CG 3.31Å; D569-R572 IonicContact OD2-NE 3.66Å; D569-R572 PolarHBondContact OD2-NE 2.95Å; W570-R572 VanDerWaalsContact C-N 3.26Å; W570-R572 PolarHBondContact O-N 2.99Å
573	G	84.4	Confident	90	Very high	5 Å²	5	43.3 Å²	43.3	5%	0.052	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.2	20.9	-175.5	0	0	0	0	0	113.9	R548 W570 R571 D575	R548-G573 WeakPolarHBondContact CD-O 3.44Å; R548-G573 WeakPolarHBondContact CG-O 3.41Å; R548-G573 PolarHBondContact NE-O 2.96Å; W570-G573 PolarHBondContact O-N 3.07Å; R571-G573 VanDerWaalsContact C-N 3.34Å; G573-D575 PolarHBondContact O-N 3Å; G573-D575 VanDerWaalsContact O-OD2 3.07Å
574	D	92.5	Very high	90.4	Very high	3 Å²	3	40.1 Å²	40.1	2%	0.016	20%	0.196	C	C	.	.			trans	-71.5	105.6	166	-68.5	-30.9	0	0	0	109.2	K541 R548 V549 W568 D569	K541-D574 WeakPolarHBondContact CE-OD2 3.37Å; K541-D574 IonicContact NZ-OD1 4Å; K541-D574 PolarHBondContact NZ-OD1 2.84Å; K541-D574 IonicContact NZ-OD2 2.74Å; K541-D574 PolarHBondContact NZ-OD2 2.89Å; R548-D574 WeakPolarHBondContact CA-OD1 3.3Å; V549-D574 PolarHBondContact N-OD1 3.5Å; V549-D574 WeakPolarHBondContact O-CA 3.07Å; W568-D574 HydrophobicContact CD2-CB 3.94Å; W568-D574 HydrophobicContact CE3-CB 4.09Å; W568-D574 HydrophobicContact CH2-CB 3.83Å; W568-D574 HydrophobicContact CZ2-CB 3.67Å; W568-D574 WeakPolarHBondContact CZ2-O 3.4Å; W568-D574 HydrophobicContact CZ3-CB 4.05Å; D569-D574 PolarHBondContact N-OD2 2.99Å; D569-D574 WeakPolarHBondContact O-CB 3.49Å; D569-D574 PolarHBondContact O-N 2.82Å
575	D	92.2	Very high	90.8	Very high	16 Å²	16	34.4 Å²	34.4	9%	0.086	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	137.6	-168.6	-68.7	-54	0	0	0	111.1	R548 V549 I550 V551 G573 T1068 L1075	R548-D575 IonicContact CZ-OD2 3.97Å; R548-D575 IonicContact NH2-OD2 3.04Å; R548-D575 PolarHBondContact NH2-OD2 3.25Å; V549-D575 PolarHBondContact O-N 2.68Å; V549-D575 VanDerWaalsContact O-N 3.17Å; I550-D575 WeakPolarHBondContact CA-O 3.26Å; I550-D575 HydrophobicContact CG1-CB 4.37Å; I550-D575 HydrophobicContact CG2-CB 4.39Å; V551-D575 PolarHBondContact N-O 2.91Å; G573-D575 PolarHBondContact O-N 3Å; G573-D575 VanDerWaalsContact O-OD2 3.07Å; D575-T1068 HydrophobicContact CB-CG2 3.65Å; D575-T1068 WeakPolarHBondContact OD2-CG2 3.09Å; D575-L1075 HydrophobicContact CB-CD2 3.94Å
576	V	93.4	Very high	90.9	Very high	10 Å²	10	33.4 Å²	33.4	6%	0.061	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	117.9	173.5	-170	0	0	0	0	109.4	V551 L553 K559 L562 W568 C578	V551-V576 HydrophobicContact CG1-CB 4.49Å; V551-V576 HydrophobicContact CG1-CG1 4.28Å; V551-V576 HydrophobicContact CG1-CG2 4.18Å; L553-V576 HydrophobicContact CB-CG1 4.27Å; L553-V576 HydrophobicContact CD1-CG1 3.7Å; L553-V576 HydrophobicContact CG-CG1 3.82Å; K559-V576 HydrophobicContact CD-CG1 4.5Å; K559-V576 HydrophobicContact CG-CB 4.31Å; K559-V576 HydrophobicContact CG-CG1 4.07Å; K559-V576 HydrophobicContact CG-CG2 4.4Å; L562-V576 HydrophobicContact CD1-CB 4.39Å; L562-V576 HydrophobicContact CD1-CG1 4.03Å; L562-V576 HydrophobicContact CD1-CG2 3.44Å; L562-V576 VanDerWaalsContact CD1-CG2 3.44Å; W568-V576 HydrophobicContact CH2-CG2 3.83Å; W568-V576 HydrophobicContact CZ2-CG2 3.34Å; V576-C578 PolarHBondContact O-N 3.28Å
577	I	94.1	Very high	91.1	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	95.1	171.1	-52.8	-167.1	0	0	0	107.7	I550 V551 Q552 L553 L579 L582 L1064 M1065 L1075	I550-I577 HydrophobicContact CG2-CD1 4.24Å; I550-I577 HydrophobicContact CG2-CG1 4.29Å; V551-I577 PolarHBondContact O-N 2.97Å; Q552-I577 WeakPolarHBondContact CA-O 3.43Å; Q552-I577 HydrophobicContact CG-CB 4.47Å; L553-I577 PolarHBondContact N-O 3.07Å; I577-L579 HydrophobicContact CG2-CD2 4.4Å; I577-L579 PolarHBondContact O-N 2.84Å; I577-L582 HydrophobicContact CG2-CD1 3.72Å; I577-L1064 HydrophobicContact CD1-CB 3.99Å; I577-M1065 HydrophobicContact CD1-CG 4.12Å; I577-M1065 HydrophobicContact CD1-SD 3.47Å; I577-M1065 WeakPolarHBondContact CD1-SD 3.4Å; I577-M1065 HydrophobicContact CG1-SD 4.16Å; I577-L1075 HydrophobicContact CG1-CD2 4.07Å
578	C	93.8	Very high	91.3	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.007	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	111.1	174.5	-178	0	0	0	0	110	L553 Y556 V576 E581 L582	L553-C578 CarbonylContact O-C 2.92Å; L553-C578 WeakPolarHBondContact O-CA 3.12Å; Y556-C578 VanDerWaalsContact CA-SG 3.56Å; V576-C578 PolarHBondContact O-N 3.28Å; C578-E581 HydrophobicContact CB-CB 3.73Å; C578-E581 PolarHBondContact O-N 2.72Å; C578-L582 WeakPolarHBondContact O-CG 3.48Å; C578-L582 PolarHBondContact O-N 3.32Å; C578-L582 VanDerWaalsContact O-N 3.13Å
579	L	93.5	Very high	91.4	Very high	3 Å²	3	24.6 Å²	24.6	2%	0.016	10%	0.104	C	C	.	.	H	α-helix	trans	-65.1	-43.8	-175.7	-61.9	178.8	0	0	0	111.7	K521 L553 I577 E581 L582 K583 I1058 L1061	K521-L579 HydrophobicContact CD-CD1 4.18Å; K521-L579 HydrophobicContact CG-CD1 3.79Å; L553-L579 PolarHBondContact O-N 3.3Å; I577-L579 HydrophobicContact CG2-CD2 4.4Å; I577-L579 PolarHBondContact O-N 2.84Å; L579-E581 PolarHBondContact O-N 3.3Å; L579-L582 PolarHBondContact O-N 2.97Å; L579-K583 WeakPolarHBondContact O-CB 3.41Å; L579-K583 PolarHBondContact O-N 3.13Å; L579-I1058 HydrophobicContact CB-CD1 4.3Å; L579-I1058 HydrophobicContact CD1-CD1 4.31Å; L579-L1061 HydrophobicContact CD2-CB 3.96Å; L579-L1061 HydrophobicContact CD2-CD1 4.06Å
580	A	92.7	Very high	91.7	Very high	8 Å²	8	22.4 Å²	22.4	7%	0.066	9%	0.092	C	C	.	.	H	α-helix	trans	-63.8	-38.4	177.4	0	0	0	0	0	112.8	M554 L584	M554-A580 WeakPolarHBondContact O-CB 3.47Å; M554-A580 PolarHBondContact O-N 2.79Å; M554-A580 VanDerWaalsContact O-N 3.13Å; A580-L584 VanDerWaalsContact O-CB 3.28Å; A580-L584 WeakPolarHBondContact O-CB 3.4Å; A580-L584 WeakPolarHBondContact O-CG 3.46Å; A580-L584 PolarHBondContact O-N 3.29Å
581	E	93.1	Very high	92.3	Very high	6 Å²	6	17.1 Å²	17.1	3%	0.028	7%	0.072	C	C	.	.	H	α-helix	trans	-59.9	-51.7	176.2	-177.4	-174.3	166.6	0	0	110.7	Y556 K559 C578 L579 G585 R1079 T1083	Y556-E581 HydrophobicContact CD2-CB 4.12Å; Y556-E581 HydrophobicContact CD2-CG 4.2Å; Y556-E581 HydrophobicContact CE2-CG 4.4Å; K559-E581 IonicContact NZ-OE1 3.82Å; K559-E581 IonicContact NZ-OE2 3.65Å; K559-E581 PolarHBondContact NZ-OE2 2.88Å; C578-E581 HydrophobicContact CB-CB 3.73Å; C578-E581 PolarHBondContact O-N 2.72Å; L579-E581 PolarHBondContact O-N 3.3Å; E581-G585 PolarHBondContact O-N 3.42Å; E581-R1079 IonicContact OE1-CZ 3.45Å; E581-R1079 IonicContact OE1-NE 3.88Å; E581-R1079 PolarHBondContact OE1-NE 2.9Å; E581-R1079 IonicContact OE1-NH2 3.61Å; E581-R1079 PolarHBondContact OE1-NH2 3.4Å; E581-R1079 IonicContact OE2-NE 2.73Å; E581-T1083 HydrophobicContact CG-CG2 4.1Å
582	L	93.5	Very high	92.9	Very high	1 Å²	1	11.5 Å²	11.5	1%	0.005	5%	0.053	C	C	.	.	H	α-helix	trans	-73.4	-47.2	-175.7	-67.2	172	0	0	0	112.2	I577 C578 L579 L584 G585 F586 L1061 L1064 L1075 I1078 R1079	I577-L582 HydrophobicContact CG2-CD1 3.72Å; C578-L582 WeakPolarHBondContact O-CG 3.48Å; C578-L582 PolarHBondContact O-N 3.32Å; C578-L582 VanDerWaalsContact O-N 3.13Å; L579-L582 PolarHBondContact O-N 2.97Å; L582-L584 PolarHBondContact O-N 3.39Å; L582-G585 PolarHBondContact O-N 3.46Å; L582-F586 HydrophobicContact CB-CD2 4.42Å; L582-F586 HydrophobicContact CB-CE2 4.14Å; L582-F586 WeakPolarHBondContact O-CD2 3.18Å; L582-F586 PolarHBondContact O-N 3.31Å; L582-L1061 HydrophobicContact CB-CD1 4.22Å; L582-L1061 HydrophobicContact CB-CD2 4.36Å; L582-L1064 HydrophobicContact CD1-CD1 3.65Å; L582-L1075 HydrophobicContact CD1-CD1 4.29Å; L582-I1078 HydrophobicContact CD2-CG2 4.17Å; L582-R1079 HydrophobicContact CD2-CG 4.06Å
583	K	93.9	Very high	93.4	Very high	18 Å²	18	5.3 Å²	5.3	8%	0.078	3%	0.03	C	C	.	.	H	α-helix	trans	-53.6	-57.2	178.3	177.6	-171.4	74.4	161.8	0	110.8	L579 G585 F586 I587 E1022 F1056 I1058 L1061	L579-K583 WeakPolarHBondContact O-CB 3.41Å; L579-K583 PolarHBondContact O-N 3.13Å; K583-G585 VanDerWaalsContact C-N 3.3Å; K583-G585 PolarHBondContact O-N 3.39Å; K583-F586 PolarHBondContact O-N 3.3Å; K583-I587 HydrophobicContact CG-CD1 4.2Å; K583-I587 VanDerWaalsContact O-CG1 3.32Å; K583-I587 WeakPolarHBondContact O-CG1 3.49Å; K583-I587 PolarHBondContact O-N 3.24Å; K583-E1022 HydrophobicContact CD-CG 4.28Å; K583-E1022 WeakPolarHBondContact CD-OE1 3.36Å; K583-E1022 WeakPolarHBondContact CE-OE1 3.32Å; K583-E1022 IonicContact NZ-OE1 2.75Å; K583-E1022 PolarHBondContact NZ-OE1 3.26Å; K583-E1022 IonicContact NZ-OE2 3.54Å; K583-E1022 PolarHBondContact NZ-OE2 2.91Å; K583-F1056 HydrophobicContact CB-CE1 4.17Å; K583-F1056 HydrophobicContact CG-CD1 4.09Å; K583-F1056 HydrophobicContact CG-CE1 3.78Å; K583-I1058 HydrophobicContact CD-CD1 4.45Å; K583-L1061 HydrophobicContact CB-CD1 4.18Å
584	L	94.9	Very high	93.8	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-67.6	-33.7	-178.2	-70.5	-176.7	0	0	0	112.1	A580 L582 I587 A588 I880 G881 N884 F885 L951	A580-L584 VanDerWaalsContact O-CB 3.28Å; A580-L584 WeakPolarHBondContact O-CB 3.4Å; A580-L584 WeakPolarHBondContact O-CG 3.46Å; A580-L584 PolarHBondContact O-N 3.29Å; L582-L584 PolarHBondContact O-N 3.39Å; L584-I587 PolarHBondContact O-N 3.42Å; L584-A588 VanDerWaalsContact O-CB 3.25Å; L584-A588 WeakPolarHBondContact O-CB 3.44Å; L584-A588 PolarHBondContact O-N 3.44Å; L584-I880 HydrophobicContact CD1-CG2 3.85Å; L584-I880 HydrophobicContact CD2-CG2 4Å; L584-I880 HydrophobicContact CG-CG2 4.25Å; L584-G881 WeakPolarHBondContact CD1-O 3.37Å; L584-N884 HydrophobicContact CB-CB 4.06Å; L584-N884 HydrophobicContact CD1-CB 4Å; L584-F885 HydrophobicContact CB-CB 3.97Å; L584-F885 HydrophobicContact CD1-CB 4.21Å; L584-F885 HydrophobicContact CD2-CB 4.25Å; L584-F885 HydrophobicContact CG-CB 4.38Å; L584-L951 HydrophobicContact CD2-CD1 4.01Å; L584-L951 HydrophobicContact CD2-CD2 4.24Å
585	G	94.5	Very high	93.9	Very high	1 Å²	1	6.3 Å²	6.3	1%	0.01	4%	0.036	C	C	.	.	H	α-helix	trans	-63.7	-44.7	174.6	0	0	0	0	0	113.1	E581 L582 K583 I587 A588 Q589	E581-G585 PolarHBondContact O-N 3.42Å; L582-G585 PolarHBondContact O-N 3.46Å; K583-G585 VanDerWaalsContact C-N 3.3Å; K583-G585 PolarHBondContact O-N 3.39Å; G585-I587 VanDerWaalsContact C-N 3.33Å; G585-I587 PolarHBondContact O-N 3.13Å; G585-A588 WeakPolarHBondContact O-CB 3.41Å; G585-A588 PolarHBondContact O-N 3.11Å; G585-Q589 WeakPolarHBondContact O-CG 3.34Å; G585-Q589 PolarHBondContact O-N 2.86Å
586	F	94.7	Very high	94	Very high	2 Å²	2	5.5 Å²	5.5	1%	0.009	3%	0.032	C	C	.	.	H	α-helix	trans	-63	-41.4	177.4	-76.6	-59.3	0	0	0	111.8	L582 K583 S590 M600 F604 F1056 L1061 I1078 V1082	L582-F586 HydrophobicContact CB-CD2 4.42Å; L582-F586 HydrophobicContact CB-CE2 4.14Å; L582-F586 WeakPolarHBondContact O-CD2 3.18Å; L582-F586 PolarHBondContact O-N 3.31Å; K583-F586 PolarHBondContact O-N 3.3Å; F586-S590 WeakPolarHBondContact O-CB 3.39Å; F586-S590 PolarHBondContact O-N 3.15Å; F586-S590 PolarHBondContact O-OG 3.2Å; F586-M600 HydrophobicContact CD1-CB 4Å; F586-M600 HydrophobicContact CD1-CG 4.42Å; F586-M600 HydrophobicContact CE1-CB 3.48Å; F586-M600 VanDerWaalsContact CE1-CB 3.48Å; F586-M600 HydrophobicContact CE1-CG 4.05Å; F586-M600 HydrophobicContact CZ-CB 4.39Å; F586-F604 HydrophobicContact CE1-CE2 4.2Å; F586-F604 AromaticContact CZ-CE2 3.8Å; F586-F604 HydrophobicContact CZ-CE2 3.8Å; F586-F1056 HydrophobicContact CB-CE2 3.89Å; F586-F1056 HydrophobicContact CB-CZ 3.97Å; F586-F1056 HydrophobicContact CD2-CE2 4.22Å; F586-F1056 AromaticContact CD2-CZ 3.83Å; F586-F1056 HydrophobicContact CD2-CZ 3.83Å; F586-F1056 HydrophobicContact CG-CE2 4.23Å; F586-F1056 HydrophobicContact CG-CZ 4.21Å; F586-L1061 HydrophobicContact CD2-CD2 3.98Å; F586-L1061 HydrophobicContact CE2-CD2 3.62Å; F586-I1078 HydrophobicContact CE1-CG2 4.29Å; F586-I1078 HydrophobicContact CZ-CG2 3.7Å; F586-V1082 HydrophobicContact CD1-CG1 4.47Å; F586-V1082 HydrophobicContact CD1-CG2 3.74Å; F586-V1082 HydrophobicContact CE1-CG2 3.39Å; F586-V1082 HydrophobicContact CZ-CG2 3.96Å
587	I	95.7	Very high	94	Very high	1 Å²	1	5 Å²	5	1%	0.005	3%	0.029	C	C	.	.	H	α-helix	trans	-64.4	-42.6	174.9	-62.9	172.4	0	0	0	110	K583 L584 G585 S590 C591 F885 V949 L951 I1020 F1056	K583-I587 HydrophobicContact CG-CD1 4.2Å; K583-I587 VanDerWaalsContact O-CG1 3.32Å; K583-I587 WeakPolarHBondContact O-CG1 3.49Å; K583-I587 PolarHBondContact O-N 3.24Å; L584-I587 PolarHBondContact O-N 3.42Å; G585-I587 VanDerWaalsContact C-N 3.33Å; G585-I587 PolarHBondContact O-N 3.13Å; I587-S590 WeakPolarHBondContact O-CB 3.39Å; I587-S590 PolarHBondContact O-N 3.32Å; I587-S590 VanDerWaalsContact O-N 3.13Å; I587-C591 PolarHBondContact O-N 3.18Å; I587-C591 VanDerWaalsContact O-N 3.11Å; I587-C591 PolarHBondContact O-SG 3.18Å; I587-C591 VanDerWaalsContact O-SG 3.36Å; I587-F885 HydrophobicContact CG2-CD2 4.28Å; I587-F885 HydrophobicContact CG2-CE2 3.87Å; I587-V949 HydrophobicContact CG2-CB 4.46Å; I587-V949 HydrophobicContact CG2-CG1 3.42Å; I587-V949 VanDerWaalsContact CG2-CG1 3.42Å; I587-V949 HydrophobicContact CG2-CG2 4.17Å; I587-L951 HydrophobicContact CD1-CD2 3.95Å; I587-I1020 HydrophobicContact CG1-CD1 4.18Å; I587-I1020 HydrophobicContact CG2-CD1 4.35Å; I587-I1020 HydrophobicContact CG2-CG2 3.82Å; I587-F1056 HydrophobicContact CD1-CD1 4.18Å; I587-F1056 HydrophobicContact CG1-CB 4.38Å; I587-F1056 HydrophobicContact CG1-CD1 4.17Å; I587-F1056 HydrophobicContact CG1-CG 4.26Å
588	A	95.4	Very high	94	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-62.2	-45	177.4	0	0	0	0	0	112.8	L584 G585 S590 C591 F885 P888 L889	L584-A588 VanDerWaalsContact O-CB 3.25Å; L584-A588 WeakPolarHBondContact O-CB 3.44Å; L584-A588 PolarHBondContact O-N 3.44Å; G585-A588 WeakPolarHBondContact O-CB 3.41Å; G585-A588 PolarHBondContact O-N 3.11Å; A588-S590 PolarHBondContact O-N 2.9Å; A588-C591 VanDerWaalsContact O-CB 3.29Å; A588-C591 WeakPolarHBondContact O-CB 3.41Å; A588-C591 PolarHBondContact O-N 3.28Å; A588-C591 VanDerWaalsContact O-N 3.14Å; A588-F885 HydrophobicContact CB-CD2 3.75Å; A588-F885 HydrophobicContact CB-CE2 4.02Å; A588-F885 HydrophobicContact CB-CG 4.49Å; A588-F885 VanDerWaalsContact CB-O 3.3Å; A588-F885 WeakPolarHBondContact CB-O 3.34Å; A588-P888 HydrophobicContact CB-CB 3.96Å; A588-P888 HydrophobicContact CB-CG 4Å; A588-L889 HydrophobicContact CB-CG 4.25Å; A588-L889 WeakPolarHBondContact O-CD2 3.27Å
589	Q	94.3	Very high	94	Very high	9 Å²	9	5 Å²	5	4%	0.042	3%	0.028	C	C	.	.	H	α-helix	trans	-63.7	-32.3	174	-68.3	-60.5	-33.2	0	0	111.9	G585 C591 L592 A593 F596 L1081 V1082	G585-Q589 WeakPolarHBondContact O-CG 3.34Å; G585-Q589 PolarHBondContact O-N 2.86Å; Q589-C591 VanDerWaalsContact C-N 3.28Å; Q589-C591 PolarHBondContact O-N 2.92Å; Q589-L592 WeakPolarHBondContact O-CA 3.44Å; Q589-L592 WeakPolarHBondContact O-CB 3.29Å; Q589-L592 PolarHBondContact O-N 3.49Å; Q589-A593 PolarHBondContact O-N 3.36Å; Q589-F596 HydrophobicContact CB-CD1 3.46Å; Q589-F596 VanDerWaalsContact CB-CD1 3.46Å; Q589-F596 HydrophobicContact CB-CE1 3.76Å; Q589-F596 HydrophobicContact CB-CG 4.4Å; Q589-F596 HydrophobicContact CG-CD1 4.28Å; Q589-F596 HydrophobicContact CG-CE1 4.07Å; Q589-L1081 PolarHBondContact NE2-O 3.05Å; Q589-V1082 PolarHBondContact NE2-O 3.27Å
590	S	94.7	Very high	94	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-68.6	-25.6	175.4	-57.7	0	0	0	0	113	F586 I587 A588 L592 A593 P594 S597 M947	F586-S590 WeakPolarHBondContact O-CB 3.39Å; F586-S590 PolarHBondContact O-N 3.15Å; F586-S590 PolarHBondContact O-OG 3.2Å; I587-S590 WeakPolarHBondContact O-CB 3.39Å; I587-S590 PolarHBondContact O-N 3.32Å; I587-S590 VanDerWaalsContact O-N 3.13Å; A588-S590 PolarHBondContact O-N 2.9Å; S590-L592 PolarHBondContact O-N 3.49Å; S590-A593 WeakPolarHBondContact CA-O 3.49Å; S590-A593 CarbonylContact O-C 3.55Å; S590-A593 PolarHBondContact O-N 3.02Å; S590-P594 VanDerWaalsContact O-CA 3.31Å; S590-P594 WeakPolarHBondContact O-CA 3.34Å; S590-P594 VanDerWaalsContact O-N 3.07Å; S590-S597 WeakPolarHBondContact OG-CB 3.39Å; S590-S597 PolarHBondContact OG-N 2.59Å; S590-S597 PolarHBondContact OG-OG 3.09Å; S590-S597 VanDerWaalsContact OG-OG 3.1Å; S590-M947 WeakPolarHBondContact O-CE 3.46Å
591	C	94.6	Very high	93.9	Very high	1 Å²	1	5 Å²	5	1%	0.007	3%	0.029	C	C	.	.	H	α-helix	trans	-67.1	-24.4	169.3	-60.5	0	0	0	0	112.9	I587 A588 Q589 V867 L889 K900 M947 V949	I587-C591 PolarHBondContact O-N 3.18Å; I587-C591 VanDerWaalsContact O-N 3.11Å; I587-C591 PolarHBondContact O-SG 3.18Å; I587-C591 VanDerWaalsContact O-SG 3.36Å; A588-C591 VanDerWaalsContact O-CB 3.29Å; A588-C591 WeakPolarHBondContact O-CB 3.41Å; A588-C591 PolarHBondContact O-N 3.28Å; A588-C591 VanDerWaalsContact O-N 3.14Å; Q589-C591 VanDerWaalsContact C-N 3.28Å; Q589-C591 PolarHBondContact O-N 2.92Å; C591-V867 HydrophobicContact CB-CG2 4.16Å; C591-L889 HydrophobicContact CB-CD2 4.1Å; C591-K900 PolarHBondContact O-NZ 3.14Å; C591-M947 HydrophobicContact CB-CB 4.17Å; C591-M947 HydrophobicContact CB-CG 4.36Å; C591-V949 WeakPolarHBondContact SG-CG2 3.35Å
592	L	92.5	Very high	93.8	Very high	26 Å²	26	4.8 Å²	4.8	14%	0.136	3%	0.027	C	C	.	.	H	α-helix	trans	-85.2	-43.6	174.1	-58.7	171.4	0	0	0	110.7	Q589 S590 L889 F894	Q589-L592 WeakPolarHBondContact O-CA 3.44Å; Q589-L592 WeakPolarHBondContact O-CB 3.29Å; Q589-L592 PolarHBondContact O-N 3.49Å; S590-L592 PolarHBondContact O-N 3.49Å; L592-L889 HydrophobicContact CD1-CD2 4.3Å; L592-L889 HydrophobicContact CD2-CD2 3.73Å; L592-L889 HydrophobicContact CG-CD2 3.77Å; L592-F894 HydrophobicContact CD1-CE2 3.91Å; L592-F894 HydrophobicContact CD1-CZ 3.66Å; L592-F894 HydrophobicContact CD2-CE1 4.28Å; L592-F894 HydrophobicContact CD2-CE2 4.34Å; L592-F894 HydrophobicContact CD2-CZ 3.83Å; L592-F894 HydrophobicContact CG-CZ 4.32Å
593	A	93.1	Very high	93.6	Very high	0 Å²	0	4.9 Å²	4.9	0%	0	3%	0.028	C	C	.	.	S	Bend	trans	-136.1	93.3	-178.5	0	0	0	0	0	110.8	Q589 S590 G595 F596 V1118 Q1120 Y1188	Q589-A593 PolarHBondContact O-N 3.36Å; S590-A593 WeakPolarHBondContact CA-O 3.49Å; S590-A593 CarbonylContact O-C 3.55Å; S590-A593 PolarHBondContact O-N 3.02Å; A593-G595 PolarHBondContact O-N 2.74Å; A593-F596 HydrophobicContact CB-CB 4.15Å; A593-F596 WeakPolarHBondContact O-CB 3.38Å; A593-F596 PolarHBondContact O-N 3.29Å; A593-V1118 HydrophobicContact CB-CG1 3.76Å; A593-Q1120 HydrophobicContact CB-CG 3.74Å; A593-Y1188 HydrophobicContact CB-CD1 4.16Å; A593-Y1188 HydrophobicContact CB-CE1 4.15Å
594	P	93.6	Very high	93.2	Very high	28 Å²	28	4.5 Å²	4.5	18%	0.182	3%	0.026	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46.3	130	-179.7	-29.5	31.3	0	0	0	114.3	S590 F596 M947 Q1120 Y1156 Y1188	S590-P594 VanDerWaalsContact O-CA 3.31Å; S590-P594 WeakPolarHBondContact O-CA 3.34Å; S590-P594 VanDerWaalsContact O-N 3.07Å; P594-F596 VanDerWaalsContact C-N 3.31Å; P594-F596 PolarHBondContact O-N 3.18Å; P594-M947 HydrophobicContact CB-CE 3.84Å; P594-M947 HydrophobicContact CG-CE 3.68Å; P594-Q1120 VanDerWaalsContact N-NE2 3.15Å; P594-Q1120 PolarHBondContact O-NE2 3.06Å; P594-Y1156 HydrophobicContact CB-CE1 4.06Å; P594-Y1188 PolarHBondContact O-OH 3.22Å
595	G	92.8	Very high	92.6	Very high	1 Å²	1	4.7 Å²	4.7	1%	0.01	3%	0.028	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.6	0.8	-177.4	0	0	0	0	0	116.3	A593 S597 T598 M599 V1171	A593-G595 PolarHBondContact O-N 2.74Å; G595-S597 VanDerWaalsContact C-N 3.26Å; G595-S597 PolarHBondContact O-N 2.85Å; G595-T598 PolarHBondContact O-N 2.7Å; G595-M599 PolarHBondContact O-N 3.45Å; G595-M599 VanDerWaalsContact O-N 3.15Å; G595-V1171 WeakPolarHBondContact O-CG2 3.27Å
596	F	94.3	Very high	91.7	Very high	0 Å²	0	5.3 Å²	5.3	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-59.9	-35.4	171.8	-177	-96.9	0	0	0	112.7	Q589 A593 P594 T598 M599 M600 L1081 V1118 Y1188	Q589-F596 HydrophobicContact CB-CD1 3.46Å; Q589-F596 VanDerWaalsContact CB-CD1 3.46Å; Q589-F596 HydrophobicContact CB-CE1 3.76Å; Q589-F596 HydrophobicContact CB-CG 4.4Å; Q589-F596 HydrophobicContact CG-CD1 4.28Å; Q589-F596 HydrophobicContact CG-CE1 4.07Å; A593-F596 HydrophobicContact CB-CB 4.15Å; A593-F596 WeakPolarHBondContact O-CB 3.38Å; A593-F596 PolarHBondContact O-N 3.29Å; P594-F596 VanDerWaalsContact C-N 3.31Å; P594-F596 PolarHBondContact O-N 3.18Å; F596-T598 PolarHBondContact O-N 3.37Å; F596-M599 HydrophobicContact CD2-CE 3.36Å; F596-M599 HydrophobicContact CE2-CE 3.61Å; F596-M599 HydrophobicContact CG-CE 4.44Å; F596-M599 PolarHBondContact O-N 3.19Å; F596-M600 HydrophobicContact CD1-CG 3.88Å; F596-M600 HydrophobicContact CD2-CG 4.47Å; F596-M600 HydrophobicContact CE1-CG 3.41Å; F596-M600 VanDerWaalsContact CE1-CG 3.41Å; F596-M600 HydrophobicContact CE1-SD 4.1Å; F596-M600 HydrophobicContact CE2-CG 4.05Å; F596-M600 HydrophobicContact CE2-SD 3.85Å; F596-M600 HydrophobicContact CG-CG 4.4Å; F596-M600 HydrophobicContact CZ-CG 3.5Å; F596-M600 VanDerWaalsContact CZ-CG 3.5Å; F596-M600 HydrophobicContact CZ-SD 3.53Å; F596-M600 VanDerWaalsContact CZ-SD 3.53Å; F596-M600 WeakPolarHBondContact O-CG 3.43Å; F596-M600 PolarHBondContact O-N 2.85Å; F596-L1081 HydrophobicContact CZ-CD2 3.77Å; F596-L1081 HydrophobicContact CZ-CG 3.98Å; F596-V1118 HydrophobicContact CD2-CG1 3.49Å; F596-V1118 VanDerWaalsContact CD2-CG1 3.49Å; F596-V1118 HydrophobicContact CE1-CG2 4.42Å; F596-V1118 HydrophobicContact CE2-CB 4.38Å; F596-V1118 HydrophobicContact CE2-CG1 3.58Å; F596-V1118 HydrophobicContact CE2-CG2 3.84Å; F596-V1118 HydrophobicContact CG-CG1 4.09Å; F596-V1118 HydrophobicContact CZ-CG1 4.23Å; F596-V1118 HydrophobicContact CZ-CG2 3.77Å; F596-Y1188 HydrophobicContact CB-CE1 4.24Å; F596-Y1188 HydrophobicContact CD2-CD1 4.49Å
597	S	94	Very high	91	Very high	0 Å²	0	6.2 Å²	6.2	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-55.4	-49.3	174.1	51.4	0	0	0	0	112.5	S590 G595 M600 A601	S590-S597 WeakPolarHBondContact OG-CB 3.39Å; S590-S597 PolarHBondContact OG-N 2.59Å; S590-S597 PolarHBondContact OG-OG 3.09Å; S590-S597 VanDerWaalsContact OG-OG 3.1Å; G595-S597 VanDerWaalsContact C-N 3.26Å; G595-S597 PolarHBondContact O-N 2.85Å; S597-M600 PolarHBondContact O-N 2.7Å; S597-A601 VanDerWaalsContact O-CB 3.32Å; S597-A601 WeakPolarHBondContact O-CB 3.3Å; S597-A601 PolarHBondContact O-N 2.89Å
598	T	94.2	Very high	89.7	Confident	0 Å²	0	9.6 Å²	9.6	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-62.2	-44.7	177.5	-57.4	0	0	0	0	111.6	G595 F596 M600 A601 N602 Y622 F1050 G1053 V1171	G595-T598 PolarHBondContact O-N 2.7Å; F596-T598 PolarHBondContact O-N 3.37Å; T598-M600 VanDerWaalsContact C-N 3.34Å; T598-M600 PolarHBondContact O-N 2.9Å; T598-A601 PolarHBondContact O-N 3.45Å; T598-N602 WeakPolarHBondContact O-CB 3.4Å; T598-N602 PolarHBondContact O-N 2.77Å; T598-N602 PolarHBondContact O-OD1 2.92Å; T598-Y622 HydrophobicContact CG2-CE2 4.16Å; T598-F1050 WeakPolarHBondContact CB-O 3.29Å; T598-F1050 HydrophobicContact CG2-CD1 3.83Å; T598-F1050 HydrophobicContact CG2-CE1 3.67Å; T598-F1050 HydrophobicContact CG2-CZ 4.29Å; T598-F1050 WeakPolarHBondContact CG2-O 3.38Å; T598-F1050 PolarHBondContact OG1-O 2.66Å; T598-G1053 WeakPolarHBondContact OG1-CA 3.36Å; T598-V1171 HydrophobicContact CG2-CG2 4.35Å
599	M	94	Very high	88.5	Confident	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-55.2	-50.4	175.8	174.5	159.1	71.9	0	0	111.1	G595 F596 N602 L603 I1153 V1171 T1173 Y1188	G595-M599 PolarHBondContact O-N 3.45Å; G595-M599 VanDerWaalsContact O-N 3.15Å; F596-M599 HydrophobicContact CD2-CE 3.36Å; F596-M599 HydrophobicContact CE2-CE 3.61Å; F596-M599 HydrophobicContact CG-CE 4.44Å; F596-M599 PolarHBondContact O-N 3.19Å; M599-N602 PolarHBondContact O-N 2.81Å; M599-L603 HydrophobicContact CG-CD1 4.38Å; M599-L603 WeakPolarHBondContact O-CG 3.45Å; M599-L603 PolarHBondContact O-N 3.22Å; M599-I1153 HydrophobicContact CE-CB 4.45Å; M599-I1153 HydrophobicContact CE-CG2 4.13Å; M599-I1153 HydrophobicContact SD-CB 4.45Å; M599-I1153 HydrophobicContact SD-CG2 3.83Å; M599-V1171 HydrophobicContact CB-CG1 3.75Å; M599-V1171 HydrophobicContact CG-CG1 4.47Å; M599-T1173 HydrophobicContact CB-CG2 4.01Å; M599-T1173 HydrophobicContact CG-CG2 3.5Å; M599-T1173 HydrophobicContact SD-CG2 4.11Å; M599-Y1188 HydrophobicContact CE-CD1 4.01Å; M599-Y1188 HydrophobicContact CE-CD2 4.43Å; M599-Y1188 HydrophobicContact CE-CE1 4.5Å; M599-Y1188 HydrophobicContact CE-CG 3.97Å; M599-Y1188 HydrophobicContact SD-CD2 4.38Å; M599-Y1188 HydrophobicContact SD-CG 4.46Å
600	M	92.6	Very high	87.4	Confident	4 Å²	4	20.1 Å²	20.1	2%	0.02	10%	0.104	C	C	.	.	H	α-helix	trans	-70.2	-40.7	-178.2	-61.8	-52.4	-56.2	0	0	112.3	F586 F596 S597 T598 N602 L603 F604 L1081	F586-M600 HydrophobicContact CD1-CB 4Å; F586-M600 HydrophobicContact CD1-CG 4.42Å; F586-M600 HydrophobicContact CE1-CB 3.48Å; F586-M600 VanDerWaalsContact CE1-CB 3.48Å; F586-M600 HydrophobicContact CE1-CG 4.05Å; F586-M600 HydrophobicContact CZ-CB 4.39Å; F596-M600 HydrophobicContact CD1-CG 3.88Å; F596-M600 HydrophobicContact CD2-CG 4.47Å; F596-M600 HydrophobicContact CE1-CG 3.41Å; F596-M600 VanDerWaalsContact CE1-CG 3.41Å; F596-M600 HydrophobicContact CE1-SD 4.1Å; F596-M600 HydrophobicContact CE2-CG 4.05Å; F596-M600 HydrophobicContact CE2-SD 3.85Å; F596-M600 HydrophobicContact CG-CG 4.4Å; F596-M600 HydrophobicContact CZ-CG 3.5Å; F596-M600 VanDerWaalsContact CZ-CG 3.5Å; F596-M600 HydrophobicContact CZ-SD 3.53Å; F596-M600 VanDerWaalsContact CZ-SD 3.53Å; F596-M600 WeakPolarHBondContact O-CG 3.43Å; F596-M600 PolarHBondContact O-N 2.85Å; S597-M600 PolarHBondContact O-N 2.7Å; T598-M600 VanDerWaalsContact C-N 3.34Å; T598-M600 PolarHBondContact O-N 2.9Å; M600-N602 PolarHBondContact O-N 3.34Å; M600-L603 HydrophobicContact CE-CD1 4.11Å; M600-L603 WeakPolarHBondContact O-CB 3.36Å; M600-L603 PolarHBondContact O-N 3.01Å; M600-L603 HydrophobicContact SD-CD1 3.99Å; M600-F604 HydrophobicContact CB-CE2 3.97Å; M600-F604 HydrophobicContact CB-CZ 4.09Å; M600-F604 HydrophobicContact CE-CE1 3.93Å; M600-F604 HydrophobicContact CE-CE2 4.32Å; M600-F604 HydrophobicContact CE-CZ 3.35Å; M600-F604 WeakPolarHBondContact O-CD2 3.32Å; M600-F604 WeakPolarHBondContact O-CE2 3.43Å; M600-L1081 HydrophobicContact CE-CD2 3.69Å; M600-L1081 HydrophobicContact SD-CD2 3.95Å
601	A	91.5	Very high	86.4	Confident	8 Å²	8	23.1 Å²	23.1	7%	0.066	12%	0.122	C	C	.	.	H	α-helix	trans	-58.3	-39	177	0	0	0	0	0	111.9	S597 T598 L603 A605 F1050 V1060	S597-A601 VanDerWaalsContact O-CB 3.32Å; S597-A601 WeakPolarHBondContact O-CB 3.3Å; S597-A601 PolarHBondContact O-N 2.89Å; T598-A601 PolarHBondContact O-N 3.45Å; A601-L603 VanDerWaalsContact C-N 3.32Å; A601-L603 PolarHBondContact O-N 3.25Å; A601-A605 PolarHBondContact O-N 2.8Å; A601-F1050 HydrophobicContact CB-CZ 3.94Å; A601-V1060 HydrophobicContact CB-CB 4.27Å; A601-V1060 HydrophobicContact CB-CG1 4.44Å; A601-V1060 HydrophobicContact CB-CG2 4.45Å
602	N	91.6	Very high	85.5	Confident	1 Å²	1	27.9 Å²	27.9	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-67.7	-30.2	176.1	-68.3	1.5	0	0	0	112.9	T598 M599 M600 F604 R607 Y622 F1050	T598-N602 WeakPolarHBondContact O-CB 3.4Å; T598-N602 PolarHBondContact O-N 2.77Å; T598-N602 PolarHBondContact O-OD1 2.92Å; M599-N602 PolarHBondContact O-N 2.81Å; M600-N602 PolarHBondContact O-N 3.34Å; N602-F604 VanDerWaalsContact C-N 3.33Å; N602-F604 PolarHBondContact O-N 3.27Å; N602-R607 VanDerWaalsContact OD1-CZ 3.25Å; N602-R607 PolarHBondContact OD1-NH1 3.24Å; N602-R607 PolarHBondContact OD1-NH2 3.49Å; N602-R607 VanDerWaalsContact OD1-NH2 3.12Å; N602-Y622 PolarHBondContact ND2-OH 2.89Å; N602-F1050 WeakPolarHBondContact OD1-CE1 3.49Å
603	L	89.5	Confident	84.8	Confident	3 Å²	3	32.6 Å²	32.6	2%	0.016	18%	0.179	C	C	.	.	H	α-helix	trans	-74.8	-15.5	-177	-74.5	173.8	0	0	0	114.8	M599 M600 A601 M628 M630 I693	M599-L603 HydrophobicContact CG-CD1 4.38Å; M599-L603 WeakPolarHBondContact O-CG 3.45Å; M599-L603 PolarHBondContact O-N 3.22Å; M600-L603 HydrophobicContact CE-CD1 4.11Å; M600-L603 WeakPolarHBondContact O-CB 3.36Å; M600-L603 PolarHBondContact O-N 3.01Å; M600-L603 HydrophobicContact SD-CD1 3.99Å; A601-L603 VanDerWaalsContact C-N 3.32Å; A601-L603 PolarHBondContact O-N 3.25Å; L603-M628 HydrophobicContact CD2-CB 4.11Å; L603-M630 HydrophobicContact CB-CG 4.08Å; L603-M630 PolarHBondContact O-N 3.36Å; L603-I693 HydrophobicContact CD1-CD1 3.83Å; L603-I693 HydrophobicContact CD1-CG1 4.46Å; L603-I693 HydrophobicContact CD2-CD1 4.09Å; L603-I693 HydrophobicContact CD2-CG1 4.09Å; L603-I693 HydrophobicContact CD2-CG2 3.66Å
604	F	83.9	Confident	84.3	Confident	9 Å²	9	40.4 Å²	40.4	4%	0.039	22%	0.221	C	C	.	.	H	α-helix	trans	-113.9	-14.6	-179.7	-36.3	-52.8	0	0	0	114.4	F586 M600 N602 M630 L1064 T1067 I1078	F586-F604 HydrophobicContact CE1-CE2 4.2Å; F586-F604 AromaticContact CZ-CE2 3.8Å; F586-F604 HydrophobicContact CZ-CE2 3.8Å; M600-F604 HydrophobicContact CB-CE2 3.97Å; M600-F604 HydrophobicContact CB-CZ 4.09Å; M600-F604 HydrophobicContact CE-CE1 3.93Å; M600-F604 HydrophobicContact CE-CE2 4.32Å; M600-F604 HydrophobicContact CE-CZ 3.35Å; M600-F604 WeakPolarHBondContact O-CD2 3.32Å; M600-F604 WeakPolarHBondContact O-CE2 3.43Å; N602-F604 VanDerWaalsContact C-N 3.33Å; N602-F604 PolarHBondContact O-N 3.27Å; F604-M630 HydrophobicContact CD1-CE 3.54Å; F604-M630 HydrophobicContact CD1-CG 4.37Å; F604-M630 HydrophobicContact CD1-SD 4.28Å; F604-M630 HydrophobicContact CE1-CE 3.18Å; F604-M630 HydrophobicContact CE1-CG 4.15Å; F604-M630 HydrophobicContact CE1-SD 3.59Å; F604-M630 VanDerWaalsContact CE1-SD 3.59Å; F604-M630 HydrophobicContact CZ-CE 4.34Å; F604-L1064 HydrophobicContact CB-CD2 3.8Å; F604-L1064 HydrophobicContact CD2-CD2 3.56Å; F604-L1064 HydrophobicContact CE2-CD2 4.29Å; F604-L1064 HydrophobicContact CG-CD2 3.73Å; F604-T1067 HydrophobicContact CB-CG2 4.4Å; F604-T1067 PolarHBondContact O-OG1 2.95Å; F604-I1078 HydrophobicContact CD1-CD1 3.53Å; F604-I1078 HydrophobicContact CD1-CG1 4.22Å; F604-I1078 HydrophobicContact CD2-CD1 3.86Å; F604-I1078 HydrophobicContact CE1-CD1 3.26Å; F604-I1078 HydrophobicContact CE1-CG1 3.43Å; F604-I1078 VanDerWaalsContact CE1-CG1 3.43Å; F604-I1078 HydrophobicContact CE2-CD1 3.58Å; F604-I1078 HydrophobicContact CE2-CG1 3.94Å; F604-I1078 HydrophobicContact CE2-CG2 4.15Å; F604-I1078 HydrophobicContact CG-CD1 3.82Å; F604-I1078 HydrophobicContact CZ-CB 4.26Å; F604-I1078 HydrophobicContact CZ-CD1 3.26Å; F604-I1078 HydrophobicContact CZ-CG1 3.24Å; F604-I1078 HydrophobicContact CZ-CG2 4.07Å
605	A	82.1	Confident	83.7	Confident	5 Å²	5	41 Å²	41	4%	0.041	22%	0.221	C	C	.	.	S	Bend	trans	-85.3	132.6	170.4	0	0	0	0	0	108.2	A601 R607	A601-A605 PolarHBondContact O-N 2.8Å; A605-R607 HydrophobicContact CB-CG 4.38Å
606	M	76.9	Confident	83.3	Confident	13 Å²	13	43.4 Å²	43.4	6%	0.064	24%	0.237	C	C	.	.			trans	-80.2	129.8	172.7	-72.8	145.1	-72.3	0	0	109.2	D455 H458 R461 E629	D455-M606 HydrophobicContact CB-CE 3.63Å; D455-M606 WeakPolarHBondContact O-CE 3.33Å; D455-M606 PolarHBondContact OD1-N 3.22Å; H458-M606 HydrophobicContact CB-CB 4.14Å; H458-M606 HydrophobicContact CB-SD 3.91Å; R461-M606 HydrophobicContact CG-SD 3.4Å; R461-M606 WeakPolarHBondContact CG-SD 3.32Å; R461-M606 VanDerWaalsContact NE-CE 3.32Å; R461-M606 PolarHBondContact NE-SD 3.26Å; R461-M606 PolarHBondContact NH2-SD 3.34Å; M606-E629 VanDerWaalsContact CA-OE1 3.32Å; M606-E629 WeakPolarHBondContact CA-OE1 3.36Å; M606-E629 WeakPolarHBondContact CB-OE1 3.42Å; M606-E629 WeakPolarHBondContact CG-OE1 3.28Å
607	R	79.8	Confident	82.9	Confident	21 Å²	21	49.2 Å²	49.2	8%	0.079	26%	0.264	C	S	.	.			trans	-138.6	118	-178	-62.3	-170.7	-173.8	156.6	8	110.3	N602 A605 F609 Y1045	N602-R607 VanDerWaalsContact OD1-CZ 3.25Å; N602-R607 PolarHBondContact OD1-NH1 3.24Å; N602-R607 PolarHBondContact OD1-NH2 3.49Å; N602-R607 VanDerWaalsContact OD1-NH2 3.12Å; A605-R607 HydrophobicContact CB-CG 4.38Å; R607-F609 PolarHBondContact O-N 3.39Å; R607-Y1045 VanDerWaalsContact NH2-CB 3.27Å
608	S	68.5	Low	82.7	Confident	72 Å²	72	50.4 Å²	50.4	50%	0.503	27%	0.268	S	S	.	.			trans	-71.6	122.7	165.8	73.5	0	0	0	0	109.1
609	F	70.3	Confident	82.4	Confident	61 Å²	61	51.9 Å²	51.9	27%	0.268	28%	0.276	S	S	.	.			trans	-105.2	138.2	172.1	77.3	-85.5	0	0	0	110.1	R607 T611 L623	R607-F609 PolarHBondContact O-N 3.39Å; F609-T611 HydrophobicContact CD2-CG2 4.06Å; F609-T611 HydrophobicContact CE2-CG2 4.29Å; F609-L623 WeakPolarHBondContact CB-O 3.43Å
610	K	71.6	Confident	82.2	Confident	170 Å²	170	53 Å²	53	74%	0.739	28%	0.283	S	S	*	.			trans	-126.1	104.7	167.8	-71.7	177.6	-176.8	165.4	0	108	M615	K610-M615 VanDerWaalsContact O-CE 3.24Å; K610-M615 WeakPolarHBondContact O-CE 3.47Å
611	T	72.8	Confident	82.1	Confident	62 Å²	62	53.5 Å²	53.5	38%	0.38	29%	0.285	S	S	.	.			trans	-71.8	133.8	172.1	50.9	0	0	0	0	109.4	F609 N620	F609-T611 HydrophobicContact CD2-CG2 4.06Å; F609-T611 HydrophobicContact CE2-CG2 4.29Å; T611-N620 WeakPolarHBondContact CB-OD1 3.3Å
612	L	76.6	Confident	82.2	Confident	102 Å²	102	53.1 Å²	53.1	53%	0.534	28%	0.282	S	S	.	.			trans	-120.9	136.2	179	-74	157.5	0	0	0	107.7	N614 M615 N620	L612-N614 PolarHBondContact O-N 3.4Å; L612-N614 VanDerWaalsContact O-N 3.09Å; L612-M615 HydrophobicContact CB-CE 3.85Å; L612-M615 HydrophobicContact CB-CG 4.08Å; L612-M615 HydrophobicContact CD1-CE 4.35Å; L612-M615 HydrophobicContact CG-CE 4.31Å; L612-M615 PolarHBondContact O-N 3.1Å; L612-M615 VanDerWaalsContact O-N 3.13Å; L612-N620 PolarHBondContact N-OD1 3.5Å; L612-N620 PolarHBondContact O-ND2 3.46Å; L612-N620 VanDerWaalsContact O-ND2 3.11Å; L612-N620 PolarHBondContact O-OD1 3.07Å
613	P	76.9	Confident	82.2	Confident	125 Å²	125	53.8 Å²	53.8	81%	0.812	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-23.9	179.5	-24.7	33.6	0	0	0	114.3
614	N	82	Confident	82.2	Confident	163 Å²	163	57.7 Å²	57.7	87%	0.872	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-9.3	-177.5	-65.1	-5.5	0	0	0	113.7	L612	L612-N614 PolarHBondContact O-N 3.4Å; L612-N614 VanDerWaalsContact O-N 3.09Å
615	M	81.8	Confident	82.6	Confident	41 Å²	41	57.3 Å²	57.3	20%	0.202	30%	0.298	C	S	.	.	S	Bend	trans	-77.1	148.7	178.8	-74.7	-168.5	-66	0	0	111.4	K610 L612 L619 N620 L623	K610-M615 VanDerWaalsContact O-CE 3.24Å; K610-M615 WeakPolarHBondContact O-CE 3.47Å; L612-M615 HydrophobicContact CB-CE 3.85Å; L612-M615 HydrophobicContact CB-CG 4.08Å; L612-M615 HydrophobicContact CD1-CE 4.35Å; L612-M615 HydrophobicContact CG-CE 4.31Å; L612-M615 PolarHBondContact O-N 3.1Å; L612-M615 VanDerWaalsContact O-N 3.13Å; M615-L619 HydrophobicContact CB-CD2 4.49Å; M615-L619 HydrophobicContact CG-CD2 4.39Å; M615-L619 HydrophobicContact SD-CD2 3.85Å; M615-L619 HydrophobicContact SD-CG 4.34Å; M615-N620 WeakPolarHBondContact CE-OD1 3.49Å; M615-N620 PolarHBondContact O-ND2 3.48Å; M615-N620 VanDerWaalsContact O-ND2 3.11Å; M615-L623 HydrophobicContact CE-CD1 3.62Å; M615-L623 HydrophobicContact SD-CD1 3.9Å
616	P	84.8	Confident	83	Confident	51 Å²	51	57.1 Å²	57.1	33%	0.331	30%	0.297	S	S	.	.			trans	-50.5	144.4	171	-25.9	34.4	0	0	0	111.8	W618 L619 N620	P616-W618 VanDerWaalsContact C-N 3.3Å; P616-W618 VanDerWaalsContact CB-CD1 3.46Å; P616-W618 HydrophobicContact CB-CG 4.41Å; P616-W618 PolarHBondContact O-N 2.79Å; P616-L619 HydrophobicContact CB-CB 4.43Å; P616-L619 PolarHBondContact O-N 2.85Å; P616-N620 PolarHBondContact O-N 3.49Å
617	Q	86.4	Confident	83.5	Confident	122 Å²	122	56.7 Å²	56.7	57%	0.57	30%	0.296	S	S	*	.	H	α-helix	trans	-60	-41	-176.5	-177	176.1	-12.2	0	0	112.2	L619 N620 D621	Q617-L619 VanDerWaalsContact C-N 3.29Å; Q617-L619 PolarHBondContact O-N 2.9Å; Q617-N620 PolarHBondContact O-N 2.93Å; Q617-D621 PolarHBondContact O-N 3.29Å
618	W	88.4	Confident	84.1	Confident	25 Å²	25	56.1 Å²	56.1	10%	0.095	29%	0.294	C	S	.	.	H	α-helix	trans	-58	-42.9	178.4	77.2	-97.1	0	0	0	111.8	P616 D621 Y622 A1051 H1159 Y1170	P616-W618 VanDerWaalsContact C-N 3.3Å; P616-W618 VanDerWaalsContact CB-CD1 3.46Å; P616-W618 HydrophobicContact CB-CG 4.41Å; P616-W618 PolarHBondContact O-N 2.79Å; W618-D621 PolarHBondContact O-N 3.25Å; W618-Y622 WeakPolarHBondContact O-CB 3.23Å; W618-Y622 PolarHBondContact O-N 3.2Å; W618-A1051 HydrophobicContact CZ3-CB 4.22Å; W618-H1159 AromaticContact CD1-CE1 3.83Å; W618-H1159 AromaticContact CD1-NE2 3.4Å; W618-H1159 AromaticContact CD2-CD2 3.71Å; W618-H1159 AromaticContact CD2-NE2 3.21Å; W618-H1159 AromaticContact CE2-NE2 3.21Å; W618-H1159 AromaticContact CE3-NE2 3.86Å; W618-H1159 AromaticContact CG-CD2 3.77Å; W618-H1159 AromaticContact CG-NE2 3.38Å; W618-H1159 AromaticContact CZ2-NE2 3.84Å; W618-H1159 AromaticContact NE1-CE1 3.76Å; W618-H1159 AromaticContact NE1-NE2 3.29Å; W618-H1159 PolarHBondContact NE1-NE2 3.21Å; W618-Y1170 HydrophobicContact CB-CD1 4.16Å; W618-Y1170 HydrophobicContact CB-CE1 3.67Å; W618-Y1170 HydrophobicContact CB-CE2 4.28Å; W618-Y1170 HydrophobicContact CE3-CG 4.46Å; W618-Y1170 VanDerWaalsContact O-CE2 3.31Å; W618-Y1170 WeakPolarHBondContact O-CE2 3.49Å
619	L	88.6	Confident	85	Confident	31 Å²	31	53.6 Å²	53.6	16%	0.162	27%	0.274	C	S	.	.	H	α-helix	trans	-70.3	-39.9	-179.4	-177.7	60.7	0	0	0	110.9	M615 P616 Q617 D621 Y622 L623	M615-L619 HydrophobicContact CB-CD2 4.49Å; M615-L619 HydrophobicContact CG-CD2 4.39Å; M615-L619 HydrophobicContact SD-CD2 3.85Å; M615-L619 HydrophobicContact SD-CG 4.34Å; P616-L619 HydrophobicContact CB-CB 4.43Å; P616-L619 PolarHBondContact O-N 2.85Å; Q617-L619 VanDerWaalsContact C-N 3.29Å; Q617-L619 PolarHBondContact O-N 2.9Å; L619-D621 PolarHBondContact O-N 2.64Å; L619-Y622 HydrophobicContact CD1-CD1 4.39Å; L619-Y622 PolarHBondContact O-N 3.46Å; L619-L623 HydrophobicContact CD1-CD1 4.12Å; L619-L623 HydrophobicContact CD1-CG 4.03Å; L619-L623 HydrophobicContact CG-CD1 3.9Å; L619-L623 HydrophobicContact CG-CG 4.26Å; L619-L623 VanDerWaalsContact O-CB 3.25Å; L619-L623 WeakPolarHBondContact O-CB 3.44Å; L619-L623 WeakPolarHBondContact O-CG 3.49Å; L619-L623 PolarHBondContact O-N 3.48Å
620	N	89.6	Confident	85.8	Confident	25 Å²	25	51.7 Å²	51.7	13%	0.134	27%	0.267	C	S	.	.	H	α-helix	trans	-61.2	-42.5	173.8	-89.6	-45.8	0	0	0	112.4	T611 L612 M615 P616 Q617 R624	T611-N620 WeakPolarHBondContact CB-OD1 3.3Å; L612-N620 PolarHBondContact N-OD1 3.5Å; L612-N620 PolarHBondContact O-ND2 3.46Å; L612-N620 VanDerWaalsContact O-ND2 3.11Å; L612-N620 PolarHBondContact O-OD1 3.07Å; M615-N620 WeakPolarHBondContact CE-OD1 3.49Å; M615-N620 PolarHBondContact O-ND2 3.48Å; M615-N620 VanDerWaalsContact O-ND2 3.11Å; P616-N620 PolarHBondContact O-N 3.49Å; Q617-N620 PolarHBondContact O-N 2.93Å; N620-R624 PolarHBondContact O-N 2.75Å
621	D	91	Very high	86.6	Confident	13 Å²	13	45.4 Å²	45.4	7%	0.07	24%	0.238	C	C	.	.	H	α-helix	trans	-69	-41.4	177.3	-77	-13.8	0	0	0	111.5	Q617 W618 L619 G625 R1157 Y1170 I1172	Q617-D621 PolarHBondContact O-N 3.29Å; W618-D621 PolarHBondContact O-N 3.25Å; L619-D621 PolarHBondContact O-N 2.64Å; D621-G625 PolarHBondContact O-N 3.2Å; D621-R1157 IonicContact OD2-NH1 2.73Å; D621-Y1170 HydrophobicContact CB-CE2 4.03Å; D621-I1172 HydrophobicContact CB-CD1 3.91Å; D621-I1172 HydrophobicContact CB-CG1 4.25Å
622	Y	92.7	Very high	87.3	Confident	1 Å²	1	44.6 Å²	44.6	0%	0.004	23%	0.233	C	C	.	.	H	α-helix	trans	-61.2	-51.6	174.6	174.4	-100.3	0	0	0	111.7	T598 N602 W618 L619 R624 G625 A626 Y1045 A1051 V1171	T598-Y622 HydrophobicContact CG2-CE2 4.16Å; N602-Y622 PolarHBondContact ND2-OH 2.89Å; W618-Y622 WeakPolarHBondContact O-CB 3.23Å; W618-Y622 PolarHBondContact O-N 3.2Å; L619-Y622 HydrophobicContact CD1-CD1 4.39Å; L619-Y622 PolarHBondContact O-N 3.46Å; Y622-R624 VanDerWaalsContact C-N 3.27Å; Y622-R624 PolarHBondContact O-N 2.71Å; Y622-G625 CarbonylContact O-C 3.54Å; Y622-G625 WeakPolarHBondContact O-CA 3.44Å; Y622-G625 PolarHBondContact O-N 2.96Å; Y622-A626 HydrophobicContact CE1-CB 4.19Å; Y622-A626 PolarHBondContact O-N 2.9Å; Y622-Y1045 HydrophobicContact CE1-CD2 4.39Å; Y622-Y1045 WeakPolarHBondContact CE1-O 3.44Å; Y622-Y1045 VanDerWaalsContact CZ-O 3.29Å; Y622-Y1045 PolarHBondContact OH-O 3.09Å; Y622-A1051 HydrophobicContact CD1-CB 4.4Å; Y622-A1051 HydrophobicContact CD2-CB 3.82Å; Y622-A1051 HydrophobicContact CE1-CB 4.22Å; Y622-A1051 HydrophobicContact CE2-CB 3.59Å; Y622-A1051 HydrophobicContact CG-CB 4.23Å; Y622-V1171 WeakPolarHBondContact CD2-O 3.23Å
623	L	91.6	Very high	87.9	Confident	14 Å²	14	42.1 Å²	42.1	7%	0.073	22%	0.219	C	C	.	.	H	α-helix	trans	-60.9	-35	-178.7	-76.9	174.3	0	0	0	112.6	F609 M615 L619 G625 A626 G627 Y1045 L1046	F609-L623 WeakPolarHBondContact CB-O 3.43Å; M615-L623 HydrophobicContact CE-CD1 3.62Å; M615-L623 HydrophobicContact SD-CD1 3.9Å; L619-L623 HydrophobicContact CD1-CD1 4.12Å; L619-L623 HydrophobicContact CD1-CG 4.03Å; L619-L623 HydrophobicContact CG-CD1 3.9Å; L619-L623 HydrophobicContact CG-CG 4.26Å; L619-L623 VanDerWaalsContact O-CB 3.25Å; L619-L623 WeakPolarHBondContact O-CB 3.44Å; L619-L623 WeakPolarHBondContact O-CG 3.49Å; L619-L623 PolarHBondContact O-N 3.48Å; L623-G625 VanDerWaalsContact C-N 3.29Å; L623-G625 PolarHBondContact O-N 3.5Å; L623-A626 PolarHBondContact O-N 3.03Å; L623-G627 PolarHBondContact O-N 3.42Å; L623-G627 VanDerWaalsContact O-N 3.1Å; L623-Y1045 HydrophobicContact CD2-CE2 4.32Å; L623-L1046 HydrophobicContact CD2-CD2 3.52Å
624	R	89.8	Confident	88.5	Confident	85 Å²	85	40.2 Å²	40.2	32%	0.321	20%	0.198	S	C	.	.	H	α-helix	trans	-62.3	-38	173.6	-176	-179	-66.6	152.6	2.2	111.8	N620 Y622	N620-R624 PolarHBondContact O-N 2.75Å; Y622-R624 VanDerWaalsContact C-N 3.27Å; Y622-R624 PolarHBondContact O-N 2.71Å
625	G	91.8	Very high	88.9	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.01	16%	0.157	C	C	.	.	H	α-helix	trans	-75.1	-35.9	173.1	0	0	0	0	0	112.9	D621 Y622 L623 G627 M628 T1173	D621-G625 PolarHBondContact O-N 3.2Å; Y622-G625 CarbonylContact O-C 3.54Å; Y622-G625 WeakPolarHBondContact O-CA 3.44Å; Y622-G625 PolarHBondContact O-N 2.96Å; L623-G625 VanDerWaalsContact C-N 3.29Å; L623-G625 PolarHBondContact O-N 3.5Å; G625-G627 PolarHBondContact O-N 2.95Å; G625-M628 WeakPolarHBondContact O-CB 2.89Å; G625-M628 PolarHBondContact O-N 3.1Å; G625-T1173 WeakPolarHBondContact CA-OG1 3.27Å; G625-T1173 PolarHBondContact O-OG1 2.88Å
626	A	90.4	Very high	89.3	Confident	2 Å²	2	30.9 Å²	30.9	2%	0.017	15%	0.149	C	C	.	.	H	α-helix	trans	-62.8	-26.2	177.6	0	0	0	0	0	113.1	Y622 L623 M628	Y622-A626 HydrophobicContact CE1-CB 4.19Å; Y622-A626 PolarHBondContact O-N 2.9Å; L623-A626 PolarHBondContact O-N 3.03Å; A626-M628 VanDerWaalsContact C-N 3.33Å
627	G	88.8	Confident	89.4	Confident	3 Å²	3	31.8 Å²	31.8	3%	0.031	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	11.6	173.4	0	0	0	0	0	115.5	L623 G625	L623-G627 PolarHBondContact O-N 3.42Å; L623-G627 VanDerWaalsContact O-N 3.1Å; G625-G627 PolarHBondContact O-N 2.95Å
628	M	91.4	Very high	89.4	Confident	9 Å²	9	26.9 Å²	26.9	4%	0.044	13%	0.133	C	C	.	.			trans	-90.7	140	171.9	-62.8	-73.5	178.5	0	0	109.6	L603 G625 A626 I693 Q695 N1174	L603-M628 HydrophobicContact CD2-CB 4.11Å; G625-M628 WeakPolarHBondContact O-CB 2.89Å; G625-M628 PolarHBondContact O-N 3.1Å; A626-M628 VanDerWaalsContact C-N 3.33Å; M628-I693 HydrophobicContact CB-CG2 3.85Å; M628-I693 HydrophobicContact CG-CG2 4.48Å; M628-Q695 HydrophobicContact CE-CG 3.84Å; M628-Q695 HydrophobicContact SD-CG 3.63Å; M628-N1174 HydrophobicContact CE-CB 4.27Å; M628-N1174 WeakPolarHBondContact CE-O 3.42Å; M628-N1174 HydrophobicContact CG-CB 4.13Å; M628-N1174 HydrophobicContact SD-CB 4.11Å
629	E	88.2	Confident	89.6	Confident	20 Å²	20	25.7 Å²	25.7	9%	0.093	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	162	-177.6	-65.3	177.8	-174.4	0	0	111.4	M606 Y631 I693 A694	M606-E629 VanDerWaalsContact CA-OE1 3.32Å; M606-E629 WeakPolarHBondContact CA-OE1 3.36Å; M606-E629 WeakPolarHBondContact CB-OE1 3.42Å; M606-E629 WeakPolarHBondContact CG-OE1 3.28Å; E629-Y631 HydrophobicContact CB-CD2 4.44Å; E629-Y631 HydrophobicContact CB-CE2 3.67Å; E629-Y631 VanDerWaalsContact OE2-CZ 3.28Å; E629-Y631 PolarHBondContact OE2-OH 3.02Å; E629-I693 WeakPolarHBondContact O-CA 3.27Å; E629-A694 PolarHBondContact N-O 3.39Å; E629-A694 PolarHBondContact O-N 3.39Å; E629-A694 VanDerWaalsContact O-N 3.12Å
630	M	87.5	Confident	89.6	Confident	21 Å²	21	28.8 Å²	28.8	10%	0.103	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	132.3	172.8	-63.1	-158.4	-44.4	0	0	113.2	L603 F604 F692 I693 A1074 L1077 I1078	L603-M630 HydrophobicContact CB-CG 4.08Å; L603-M630 PolarHBondContact O-N 3.36Å; F604-M630 HydrophobicContact CD1-CE 3.54Å; F604-M630 HydrophobicContact CD1-CG 4.37Å; F604-M630 HydrophobicContact CD1-SD 4.28Å; F604-M630 HydrophobicContact CE1-CE 3.18Å; F604-M630 HydrophobicContact CE1-CG 4.15Å; F604-M630 HydrophobicContact CE1-SD 3.59Å; F604-M630 VanDerWaalsContact CE1-SD 3.59Å; F604-M630 HydrophobicContact CZ-CE 4.34Å; M630-F692 WeakPolarHBondContact CA-O 3.22Å; M630-I693 HydrophobicContact CG-CG1 4.48Å; M630-A1074 HydrophobicContact CE-CB 4.12Å; M630-L1077 HydrophobicContact CE-CD2 3.95Å; M630-L1077 HydrophobicContact SD-CD2 3.69Å; M630-I1078 HydrophobicContact CE-CD1 4.23Å; M630-I1078 HydrophobicContact CE-CG1 4.08Å
631	Y	86.8	Confident	89.6	Confident	37 Å²	37	30.1 Å²	30.1	15%	0.145	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	157.3	177.5	-63.7	-74.4	0	0	0	112	E629 F691 F692 A694 S696 A697 V700	E629-Y631 HydrophobicContact CB-CD2 4.44Å; E629-Y631 HydrophobicContact CB-CE2 3.67Å; E629-Y631 VanDerWaalsContact OE2-CZ 3.28Å; E629-Y631 PolarHBondContact OE2-OH 3.02Å; Y631-F691 CarbonylContact O-C 3.53Å; Y631-F691 WeakPolarHBondContact O-CA 3.38Å; Y631-F692 PolarHBondContact N-O 3.18Å; Y631-F692 PolarHBondContact O-N 3.28Å; Y631-A694 HydrophobicContact CD2-CB 4.25Å; Y631-S696 VanDerWaalsContact CE2-C 3.49Å; Y631-S696 WeakPolarHBondContact OH-CA 3.25Å; Y631-A697 HydrophobicContact CD1-CB 3.97Å; Y631-A697 HydrophobicContact CE1-CB 3.74Å; Y631-A697 VanDerWaalsContact CZ-N 3.33Å; Y631-A697 PolarHBondContact OH-N 3.37Å; Y631-V700 HydrophobicContact CD2-CG2 3.69Å; Y631-V700 HydrophobicContact CG-CG2 3.94Å
632	T	87.9	Confident	89.6	Confident	45 Å²	45	30.4 Å²	30.4	28%	0.276	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	132.9	173.3	47	0	0	0	0	109.9	G690 F691 N1071	T632-G690 WeakPolarHBondContact CA-O 3.28Å; T632-F691 HydrophobicContact CG2-CD1 3.37Å; T632-F691 HydrophobicContact CG2-CE1 3.32Å; T632-F691 HydrophobicContact CG2-CG 4.15Å; T632-F691 HydrophobicContact CG2-CZ 4.04Å; T632-N1071 WeakPolarHBondContact CG2-ND2 3.24Å; T632-N1071 PolarHBondContact OG1-ND2 3.15Å
633	E	88.8	Confident	89.6	Confident	50 Å²	50	31.4 Å²	31.4	23%	0.234	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	154.9	178.8	-170.5	57.3	-87.7	0	0	111.8	G690 F692 V700 F704	E633-G690 PolarHBondContact N-O 2.82Å; E633-G690 PolarHBondContact O-N 3.47Å; E633-F692 HydrophobicContact CB-CD2 4.22Å; E633-F692 HydrophobicContact CB-CE2 3.98Å; E633-V700 HydrophobicContact CB-CG1 3.49Å; E633-V700 VanDerWaalsContact CB-CG1 3.49Å; E633-V700 HydrophobicContact CG-CG1 4.14Å; E633-F704 HydrophobicContact CG-CB 4.18Å
634	K	90	Very high	89.7	Confident	85 Å²	85	30.8 Å²	30.8	37%	0.37	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	144.1	177	-68.8	-178.5	-177.8	-178.8	0	111.6	Q689 F704	K634-Q689 HydrophobicContact CG-CG 4.2Å; K634-F704 HydrophobicContact CB-CD2 4.14Å; K634-F704 WeakPolarHBondContact O-CA 3.33Å; K634-F704 WeakPolarHBondContact O-CB 3.48Å
635	F	90.3	Very high	89.8	Confident	2 Å²	2	27.7 Å²	27.7	1%	0.009	15%	0.154	C	C	.	.	P	Polyproline II helix	trans	-73.4	145	174.7	-60.2	-82.2	0	0	0	112.3	F639 Y640 L651 L659 I662 I684 T688 F692	F635-F639 HydrophobicContact CB-CB 4.07Å; F635-F639 HydrophobicContact CB-CD2 4.13Å; F635-F639 HydrophobicContact CB-CG 4.43Å; F635-F639 HydrophobicContact CD1-CB 4.33Å; F635-F639 HydrophobicContact CD1-CD2 4.21Å; F635-F639 HydrophobicContact CD1-CG 4.22Å; F635-F639 HydrophobicContact CG-CB 4.47Å; F635-Y640 HydrophobicContact CB-CE1 4.43Å; F635-L651 HydrophobicContact CD1-CD1 4.42Å; F635-L651 HydrophobicContact CE1-CD1 3.89Å; F635-L659 HydrophobicContact CE1-CD1 4.07Å; F635-L659 HydrophobicContact CE1-CD2 4.02Å; F635-L659 HydrophobicContact CZ-CD1 3.71Å; F635-L659 HydrophobicContact CZ-CD2 3.98Å; F635-I662 HydrophobicContact CE2-CG2 3.88Å; F635-I662 HydrophobicContact CZ-CG2 3.82Å; F635-I684 HydrophobicContact CB-CG2 4.12Å; F635-I684 HydrophobicContact CD1-CD1 4.37Å; F635-I684 HydrophobicContact CD2-CG2 3.69Å; F635-I684 HydrophobicContact CE1-CD1 4.12Å; F635-I684 HydrophobicContact CE2-CD1 4.47Å; F635-I684 HydrophobicContact CE2-CG2 4.2Å; F635-I684 HydrophobicContact CG-CG2 3.86Å; F635-I684 HydrophobicContact CZ-CD1 4.17Å; F635-T688 WeakPolarHBondContact CD2-OG1 3.49Å; F635-F692 HydrophobicContact CD1-CZ 4.21Å; F635-F692 HydrophobicContact CE1-CE1 4.23Å; F635-F692 AromaticContact CE1-CZ 3.61Å; F635-F692 HydrophobicContact CE1-CZ 3.61Å; F635-F692 HydrophobicContact CZ-CZ 4.05Å
636	S	89.8	Confident	89.8	Confident	6 Å²	6	33.2 Å²	33.2	4%	0.042	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-62.8	159.1	164.9	78	0	0	0	0	111.5	S638 F639 Y640 A703 F704 Y706	S636-S638 PolarHBondContact O-N 3.14Å; S636-S638 WeakPolarHBondContact OG-CB 2.94Å; S636-S638 PolarHBondContact OG-N 3.22Å; S636-S638 PolarHBondContact OG-OG 3.19Å; S636-F639 PolarHBondContact O-N 3.47Å; S636-F639 VanDerWaalsContact O-N 3.1Å; S636-F639 WeakPolarHBondContact OG-CD2 2.84Å; S636-F639 WeakPolarHBondContact OG-CE2 3.35Å; S636-Y640 WeakPolarHBondContact O-CE1 3.36Å; S636-A703 WeakPolarHBondContact CB-O 3.34Å; S636-A703 PolarHBondContact N-O 3.48Å; S636-A703 VanDerWaalsContact N-O 3.07Å; S636-F704 WeakPolarHBondContact CB-O 3.29Å; S636-Y706 WeakPolarHBondContact CB-O 3.46Å; S636-Y706 PolarHBondContact OG-O 3.41Å
637	T	86.9	Confident	90	Very high	71 Å²	71	33.1 Å²	33.1	44%	0.436	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	-55.7	-17.7	172.2	51.6	0	0	0	0	113.9	F639 Y640	T637-F639 PolarHBondContact O-N 3.49Å; T637-Y640 HydrophobicContact CG2-CD2 4.32Å; T637-Y640 HydrophobicContact CG2-CE2 3.78Å; T637-Y640 PolarHBondContact O-N 3.16Å
638	S	88.3	Confident	90.2	Very high	19 Å²	19	33 Å²	33	13%	0.133	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-70.4	-21.3	179.9	-52	0	0	0	0	113.6	S636 M642 Y706 C707 K708	S636-S638 PolarHBondContact O-N 3.14Å; S636-S638 WeakPolarHBondContact OG-CB 2.94Å; S636-S638 PolarHBondContact OG-N 3.22Å; S636-S638 PolarHBondContact OG-OG 3.19Å; S638-M642 VanDerWaalsContact O-CE 3.28Å; S638-M642 WeakPolarHBondContact O-CE 3.41Å; S638-Y706 PolarHBondContact OG-O 2.88Å; S638-C707 WeakPolarHBondContact OG-CA 3.5Å; S638-K708 PolarHBondContact OG-N 3.05Å
639	F	90.7	Very high	90.3	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-95.2	-8.1	-178.7	-62.3	-79.7	0	0	0	112.8	F635 S636 T637 G641 M642 A647 L650 L651 L655 I684 A703 Y706	F635-F639 HydrophobicContact CB-CB 4.07Å; F635-F639 HydrophobicContact CB-CD2 4.13Å; F635-F639 HydrophobicContact CB-CG 4.43Å; F635-F639 HydrophobicContact CD1-CB 4.33Å; F635-F639 HydrophobicContact CD1-CD2 4.21Å; F635-F639 HydrophobicContact CD1-CG 4.22Å; F635-F639 HydrophobicContact CG-CB 4.47Å; S636-F639 PolarHBondContact O-N 3.47Å; S636-F639 VanDerWaalsContact O-N 3.1Å; S636-F639 WeakPolarHBondContact OG-CD2 2.84Å; S636-F639 WeakPolarHBondContact OG-CE2 3.35Å; T637-F639 PolarHBondContact O-N 3.49Å; F639-G641 PolarHBondContact O-N 3.2Å; F639-M642 HydrophobicContact CB-SD 4.34Å; F639-M642 HydrophobicContact CD1-SD 3.7Å; F639-M642 HydrophobicContact CG-SD 4.43Å; F639-M642 WeakPolarHBondContact O-CB 3.34Å; F639-M642 PolarHBondContact O-N 3.47Å; F639-M642 VanDerWaalsContact O-N 3.09Å; F639-A647 HydrophobicContact CD1-CB 4.16Å; F639-L650 HydrophobicContact CD1-CD2 4.5Å; F639-L650 HydrophobicContact CE1-CD2 3.86Å; F639-L650 HydrophobicContact CE1-CG 4.45Å; F639-L651 HydrophobicContact CE1-CD1 4.13Å; F639-L651 HydrophobicContact CE1-CD2 4.19Å; F639-L651 HydrophobicContact CE1-CG 3.81Å; F639-L651 HydrophobicContact CE2-CD2 4.46Å; F639-L651 HydrophobicContact CZ-CD1 4.47Å; F639-L651 HydrophobicContact CZ-CD2 3.78Å; F639-L651 HydrophobicContact CZ-CG 3.93Å; F639-L655 HydrophobicContact CZ-CD1 4.24Å; F639-I684 HydrophobicContact CB-CD1 4.49Å; F639-I684 HydrophobicContact CB-CG2 4.24Å; F639-A703 WeakPolarHBondContact CE2-O 3.33Å; F639-Y706 AromaticContact CE2-CD1 3.91Å; F639-Y706 HydrophobicContact CE2-CD1 3.91Å; F639-Y706 HydrophobicContact CE2-CG 4.4Å; F639-Y706 AromaticContact CZ-CD1 3.76Å; F639-Y706 HydrophobicContact CZ-CD1 3.76Å; F639-Y706 HydrophobicContact CZ-CE1 4.42Å; F639-Y706 HydrophobicContact CZ-CG 4.36Å
640	Y	90.3	Very high	90.4	Very high	96 Å²	96	34.5 Å²	34.5	38%	0.376	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	128.4	-176.7	-63.7	-5.5	0	0	0	110.6	F635 S636 T637 M642 I684 G686	F635-Y640 HydrophobicContact CB-CE1 4.43Å; S636-Y640 WeakPolarHBondContact O-CE1 3.36Å; T637-Y640 HydrophobicContact CG2-CD2 4.32Å; T637-Y640 HydrophobicContact CG2-CE2 3.78Å; T637-Y640 PolarHBondContact O-N 3.16Å; Y640-M642 VanDerWaalsContact C-N 3.32Å; Y640-I684 WeakPolarHBondContact CA-O 3.38Å; Y640-I684 HydrophobicContact CD1-CG2 4.48Å; Y640-G686 WeakPolarHBondContact OH-CA 3.36Å
641	G	88.6	Confident	90.7	Very high	53 Å²	53	33.5 Å²	33.5	55%	0.546	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.4	1.3	-175.8	0	0	0	0	0	115.1	F639 I684	F639-G641 PolarHBondContact O-N 3.2Å; G641-I684 PolarHBondContact N-O 3.06Å
642	M	91	Very high	90.9	Very high	19 Å²	19	31.9 Å²	31.9	9%	0.094	18%	0.175	C	C	.	.			trans	-76	151.2	168	-67.7	-178.1	174.1	0	0	111	S638 F639 Y640 A647 L650 I684	S638-M642 VanDerWaalsContact O-CE 3.28Å; S638-M642 WeakPolarHBondContact O-CE 3.41Å; F639-M642 HydrophobicContact CB-SD 4.34Å; F639-M642 HydrophobicContact CD1-SD 3.7Å; F639-M642 HydrophobicContact CG-SD 4.43Å; F639-M642 WeakPolarHBondContact O-CB 3.34Å; F639-M642 PolarHBondContact O-N 3.47Å; F639-M642 VanDerWaalsContact O-N 3.09Å; Y640-M642 VanDerWaalsContact C-N 3.32Å; M642-A647 HydrophobicContact CB-CB 4.36Å; M642-A647 HydrophobicContact SD-CB 4.41Å; M642-L650 HydrophobicContact CE-CD2 3.99Å; M642-L650 HydrophobicContact SD-CD2 4.38Å; M642-I684 PolarHBondContact O-N 3.03Å
643	T	92.8	Very high	90.9	Very high	22 Å²	22	33 Å²	33	14%	0.135	18%	0.182	C	C	.	.	B	Isolated β-bridge	trans	-73.4	155.8	166.9	68	0	0	0	0	110.3	E646 A647 P680 L683	T643-E646 PolarHBondContact O-N 3.02Å; T643-E646 WeakPolarHBondContact OG1-CB 3.49Å; T643-E646 WeakPolarHBondContact OG1-CG 3.35Å; T643-E646 PolarHBondContact OG1-N 3.38Å; T643-A647 WeakPolarHBondContact O-CB 3.49Å; T643-A647 PolarHBondContact O-N 3.03Å; T643-P680 HydrophobicContact CG2-CB 4.34Å; T643-P680 WeakPolarHBondContact CG2-O 3.46Å; T643-L683 HydrophobicContact CG2-CD2 3.95Å
644	F	92.8	Very high	90.8	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-56.1	-47.3	177.4	177.3	-84.9	0	0	0	113.2	E646 A647 A648 L659 I662 N677 P678	F644-E646 PolarHBondContact O-N 3.24Å; F644-A647 PolarHBondContact O-N 3.45Å; F644-A648 HydrophobicContact CE1-CB 4.3Å; F644-A648 WeakPolarHBondContact O-CB 3.31Å; F644-A648 PolarHBondContact O-N 2.92Å; F644-L659 HydrophobicContact CD2-CD2 3.86Å; F644-L659 HydrophobicContact CD2-CG 4.43Å; F644-L659 HydrophobicContact CE2-CD1 4.41Å; F644-L659 HydrophobicContact CE2-CD2 3.54Å; F644-L659 HydrophobicContact CE2-CG 3.62Å; F644-L659 HydrophobicContact CZ-CD2 4.13Å; F644-L659 HydrophobicContact CZ-CG 3.96Å; F644-I662 HydrophobicContact CD2-CD1 4.24Å; F644-I662 HydrophobicContact CD2-CG1 4.23Å; F644-I662 HydrophobicContact CD2-CG2 3.9Å; F644-I662 HydrophobicContact CE2-CG2 4.02Å; F644-N677 HydrophobicContact CE1-CB 4.32Å; F644-N677 VanDerWaalsContact CE1-OD1 3.29Å; F644-N677 WeakPolarHBondContact CE1-OD1 3.36Å; F644-P678 HydrophobicContact CB-CG 3.85Å; F644-P678 HydrophobicContact CD1-CG 4.24Å; F644-P678 WeakPolarHBondContact CD1-O 3.44Å; F644-P678 HydrophobicContact CD2-CG 3.68Å; F644-P678 HydrophobicContact CE2-CG 4.28Å; F644-P678 HydrophobicContact CG-CG 3.65Å
645	P	92.8	Very high	90.8	Very high	21 Å²	21	31.4 Å²	31.4	14%	0.136	17%	0.174	C	C	.	.	H	α-helix	trans	-61.1	-41.2	178.2	-25.9	36.7	0	0	0	113.5	A647 A648 D649 L1145	P645-A647 PolarHBondContact O-N 3.25Å; P645-A648 PolarHBondContact O-N 2.88Å; P645-D649 WeakPolarHBondContact O-CB 3.11Å; P645-D649 PolarHBondContact O-N 3.2Å; P645-L1145 HydrophobicContact CB-CD1 4.07Å; P645-L1145 HydrophobicContact CB-CD2 4.49Å; P645-L1145 HydrophobicContact CB-CG 3.97Å; P645-L1145 WeakPolarHBondContact O-CD2 3.43Å
646	E	92.9	Very high	90.7	Very high	116 Å²	116	32.7 Å²	32.7	54%	0.542	19%	0.188	S	C	.	.	H	α-helix	trans	-63.9	-41.3	177.2	-74.3	170.6	-171.4	0	0	112.1	T643 F644 L650	T643-E646 PolarHBondContact O-N 3.02Å; T643-E646 WeakPolarHBondContact OG1-CB 3.49Å; T643-E646 WeakPolarHBondContact OG1-CG 3.35Å; T643-E646 PolarHBondContact OG1-N 3.38Å; F644-E646 PolarHBondContact O-N 3.24Å; E646-L650 WeakPolarHBondContact O-CB 3.38Å; E646-L650 PolarHBondContact O-N 3.37Å
647	A	93.2	Very high	90.9	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-68.8	-44.8	178.3	0	0	0	0	0	111.6	F639 M642 T643 F644 P645 L650 L651 I684	F639-A647 HydrophobicContact CD1-CB 4.16Å; M642-A647 HydrophobicContact CB-CB 4.36Å; M642-A647 HydrophobicContact SD-CB 4.41Å; T643-A647 WeakPolarHBondContact O-CB 3.49Å; T643-A647 PolarHBondContact O-N 3.03Å; F644-A647 PolarHBondContact O-N 3.45Å; P645-A647 PolarHBondContact O-N 3.25Å; A647-L650 PolarHBondContact O-N 3.4Å; A647-L651 HydrophobicContact CB-CD1 4.45Å; A647-L651 VanDerWaalsContact O-CB 3.3Å; A647-L651 WeakPolarHBondContact O-CB 3.48Å; A647-L651 VanDerWaalsContact O-CD1 3.31Å; A647-L651 WeakPolarHBondContact O-CD1 3.36Å; A647-L651 VanDerWaalsContact O-CG 3.3Å; A647-L651 WeakPolarHBondContact O-CG 3.41Å; A647-L651 PolarHBondContact O-N 3.2Å; A647-I684 HydrophobicContact CB-CD1 3.27Å
648	A	93.9	Very high	91.2	Very high	2 Å²	2	29.1 Å²	29.1	2%	0.017	17%	0.165	C	C	.	.	H	α-helix	trans	-62.1	-43.1	178.8	0	0	0	0	0	112.1	F644 P645 L650 L651 Y652 L659 L1145	F644-A648 HydrophobicContact CE1-CB 4.3Å; F644-A648 WeakPolarHBondContact O-CB 3.31Å; F644-A648 PolarHBondContact O-N 2.92Å; P645-A648 PolarHBondContact O-N 2.88Å; A648-L650 PolarHBondContact O-N 3.4Å; A648-L651 PolarHBondContact O-N 3.41Å; A648-Y652 WeakPolarHBondContact O-CB 3.04Å; A648-Y652 PolarHBondContact O-N 3.44Å; A648-L659 HydrophobicContact CB-CB 4.19Å; A648-L659 HydrophobicContact CB-CD2 4.27Å; A648-L1145 HydrophobicContact CB-CD2 3.79Å
649	D	92.5	Very high	91.6	Very high	23 Å²	23	28.2 Å²	28.2	12%	0.123	16%	0.159	C	C	.	.	H	α-helix	trans	-60.4	-45.1	174	-175.6	43.8	0	0	0	111.7	P645 T653 S1142 L1145 K1146	P645-D649 WeakPolarHBondContact O-CB 3.11Å; P645-D649 PolarHBondContact O-N 3.2Å; D649-T653 WeakPolarHBondContact O-CB 3.46Å; D649-T653 WeakPolarHBondContact O-CG2 3.33Å; D649-T653 PolarHBondContact O-N 2.82Å; D649-T653 PolarHBondContact O-OG1 2.89Å; D649-S1142 VanDerWaalsContact CG-OG 3.28Å; D649-S1142 VanDerWaalsContact OD1-CB 3.26Å; D649-S1142 WeakPolarHBondContact OD1-CB 3.4Å; D649-S1142 PolarHBondContact OD1-OG 2.77Å; D649-S1142 PolarHBondContact OD2-OG 3.45Å; D649-L1145 HydrophobicContact CB-CD2 4.24Å; D649-K1146 IonicContact OD1-NZ 3.88Å; D649-K1146 WeakPolarHBondContact OD2-CE 3.43Å; D649-K1146 IonicContact OD2-NZ 2.72Å; D649-K1146 PolarHBondContact OD2-NZ 3.25Å
650	L	90.9	Very high	91.7	Very high	36 Å²	36	28.4 Å²	28.4	19%	0.188	16%	0.16	C	C	.	.	H	α-helix	trans	-66	-43.3	179	-174.1	67.6	0	0	0	112	F639 M642 E646 A647 A648 K654 Y706	F639-L650 HydrophobicContact CD1-CD2 4.5Å; F639-L650 HydrophobicContact CE1-CD2 3.86Å; F639-L650 HydrophobicContact CE1-CG 4.45Å; M642-L650 HydrophobicContact CE-CD2 3.99Å; M642-L650 HydrophobicContact SD-CD2 4.38Å; E646-L650 WeakPolarHBondContact O-CB 3.38Å; E646-L650 PolarHBondContact O-N 3.37Å; A647-L650 PolarHBondContact O-N 3.4Å; A648-L650 PolarHBondContact O-N 3.4Å; L650-K654 HydrophobicContact CD1-CB 4.45Å; L650-K654 HydrophobicContact CD1-CG 3.68Å; L650-K654 VanDerWaalsContact O-CB 3.23Å; L650-K654 WeakPolarHBondContact O-CB 3.37Å; L650-K654 PolarHBondContact O-N 3.01Å; L650-Y706 HydrophobicContact CD2-CE1 4.16Å
651	L	92.9	Very high	91.8	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-63.3	-43.3	178.8	-81.1	155.8	0	0	0	111.3	F635 F639 A647 A648 L655 G656 L657 L659 F692 A703	F635-L651 HydrophobicContact CD1-CD1 4.42Å; F635-L651 HydrophobicContact CE1-CD1 3.89Å; F639-L651 HydrophobicContact CE1-CD1 4.13Å; F639-L651 HydrophobicContact CE1-CD2 4.19Å; F639-L651 HydrophobicContact CE1-CG 3.81Å; F639-L651 HydrophobicContact CE2-CD2 4.46Å; F639-L651 HydrophobicContact CZ-CD1 4.47Å; F639-L651 HydrophobicContact CZ-CD2 3.78Å; F639-L651 HydrophobicContact CZ-CG 3.93Å; A647-L651 HydrophobicContact CB-CD1 4.45Å; A647-L651 VanDerWaalsContact O-CB 3.3Å; A647-L651 WeakPolarHBondContact O-CB 3.48Å; A647-L651 VanDerWaalsContact O-CD1 3.31Å; A647-L651 WeakPolarHBondContact O-CD1 3.36Å; A647-L651 VanDerWaalsContact O-CG 3.3Å; A647-L651 WeakPolarHBondContact O-CG 3.41Å; A647-L651 PolarHBondContact O-N 3.2Å; A648-L651 PolarHBondContact O-N 3.41Å; L651-L655 HydrophobicContact CD2-CD1 3.68Å; L651-L655 CarbonylContact O-C 3.43Å; L651-L655 VanDerWaalsContact O-CA 3.26Å; L651-L655 WeakPolarHBondContact O-CA 3.48Å; L651-L655 VanDerWaalsContact O-CB 3.25Å; L651-L655 WeakPolarHBondContact O-CB 3.44Å; L651-L655 PolarHBondContact O-N 2.85Å; L651-G656 PolarHBondContact O-N 3.11Å; L651-G656 VanDerWaalsContact O-N 3.07Å; L651-L657 CarbonylContact C-O 3.35Å; L651-L657 VanDerWaalsContact C-O 3.27Å; L651-L657 HydrophobicContact CD2-CD1 4.28Å; L651-L657 PolarHBondContact O-N 2.88Å; L651-L657 VanDerWaalsContact O-N 3.13Å; L651-L659 HydrophobicContact CD1-CB 4.14Å; L651-L659 HydrophobicContact CD1-CD2 3.9Å; L651-F692 HydrophobicContact CD1-CE1 3.89Å; L651-F692 HydrophobicContact CD2-CE1 4.01Å; L651-A703 HydrophobicContact CD2-CB 3.89Å
652	Y	92.1	Very high	91.9	Very high	4 Å²	4	21.3 Å²	21.3	2%	0.016	12%	0.116	C	C	.	.	H	α-helix	trans	-70.7	-51.2	-179.4	-172.6	-98	0	0	0	111.6	A648 G656 L657 L658 Y1137 L1141 N1174 P1175 P1177	A648-Y652 WeakPolarHBondContact O-CB 3.04Å; A648-Y652 PolarHBondContact O-N 3.44Å; Y652-G656 VanDerWaalsContact O-CA 3.32Å; Y652-G656 WeakPolarHBondContact O-CA 3.32Å; Y652-G656 PolarHBondContact O-N 3.45Å; Y652-G656 VanDerWaalsContact O-N 3.1Å; Y652-L657 WeakPolarHBondContact CA-O 3.37Å; Y652-L657 PolarHBondContact N-O 2.78Å; Y652-L658 HydrophobicContact CD2-CB 4.28Å; Y652-L658 HydrophobicContact CD2-CD1 4.26Å; Y652-Y1137 WeakPolarHBondContact OH-CD1 3.35Å; Y652-Y1137 WeakPolarHBondContact OH-CE1 3.41Å; Y652-L1141 HydrophobicContact CD1-CD1 3.94Å; Y652-L1141 HydrophobicContact CD1-CD2 3.89Å; Y652-L1141 HydrophobicContact CD1-CG 4.41Å; Y652-L1141 HydrophobicContact CD2-CD1 4.04Å; Y652-L1141 HydrophobicContact CE1-CD1 3.91Å; Y652-L1141 HydrophobicContact CE2-CD1 4.01Å; Y652-L1141 HydrophobicContact CG-CD1 4.01Å; Y652-L1141 HydrophobicContact CG-CD2 4.11Å; Y652-N1174 WeakPolarHBondContact CE2-OD1 3.36Å; Y652-P1175 PolarHBondContact OH-O 2.83Å; Y652-P1177 HydrophobicContact CE1-CB 3.9Å
653	T	87.2	Confident	91.7	Very high	68 Å²	68	21 Å²	21	42%	0.417	11%	0.114	S	C	.	.	H	α-helix	trans	-72.8	-33.1	-175.1	58.3	0	0	0	0	114.3	D649	D649-T653 WeakPolarHBondContact O-CB 3.46Å; D649-T653 WeakPolarHBondContact O-CG2 3.33Å; D649-T653 PolarHBondContact O-N 2.82Å; D649-T653 PolarHBondContact O-OG1 2.89Å
654	K	87.1	Confident	90.8	Very high	101 Å²	101	21.9 Å²	21.9	44%	0.439	12%	0.12	S	C	.	.	H	α-helix	trans	-100.3	-34.3	-178	-65.1	-67.8	-172.8	169.4	0	114	L650	L650-K654 HydrophobicContact CD1-CB 4.45Å; L650-K654 HydrophobicContact CD1-CG 3.68Å; L650-K654 VanDerWaalsContact O-CB 3.23Å; L650-K654 WeakPolarHBondContact O-CB 3.37Å; L650-K654 PolarHBondContact O-N 3.01Å
655	L	88.9	Confident	89.7	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-110.1	-7	-173.4	-57	178.9	0	0	0	113.1	F639 L651 L657 R702 Y706 V717 I720	F639-L655 HydrophobicContact CZ-CD1 4.24Å; L651-L655 HydrophobicContact CD2-CD1 3.68Å; L651-L655 CarbonylContact O-C 3.43Å; L651-L655 VanDerWaalsContact O-CA 3.26Å; L651-L655 WeakPolarHBondContact O-CA 3.48Å; L651-L655 VanDerWaalsContact O-CB 3.25Å; L651-L655 WeakPolarHBondContact O-CB 3.44Å; L651-L655 PolarHBondContact O-N 2.85Å; L655-L657 HydrophobicContact CB-CD1 4.08Å; L655-L657 HydrophobicContact CB-CG 4.02Å; L655-L657 PolarHBondContact O-N 3.14Å; L655-R702 HydrophobicContact CD2-CB 4.42Å; L655-R702 VanDerWaalsContact O-CZ 3.29Å; L655-R702 PolarHBondContact O-NH2 2.98Å; L655-Y706 HydrophobicContact CD1-CD2 4.22Å; L655-Y706 HydrophobicContact CD1-CG 4.14Å; L655-Y706 HydrophobicContact CD2-CD2 3.89Å; L655-Y706 HydrophobicContact CD2-CE2 4.35Å; L655-Y706 HydrophobicContact CG-CD2 4.49Å; L655-V717 WeakPolarHBondContact O-CG1 3.43Å; L655-I720 HydrophobicContact CD2-CD1 3.26Å; L655-I720 HydrophobicContact CD2-CG2 4.36Å
656	G	89.1	Confident	88.3	Confident	29 Å²	29	27.4 Å²	27.4	30%	0.299	14%	0.144	S	C	.	.			trans	63.4	24.7	-176.3	0	0	0	0	0	113	L651 Y652	L651-G656 PolarHBondContact O-N 3.11Å; L651-G656 VanDerWaalsContact O-N 3.07Å; Y652-G656 VanDerWaalsContact O-CA 3.32Å; Y652-G656 WeakPolarHBondContact O-CA 3.32Å; Y652-G656 PolarHBondContact O-N 3.45Å; Y652-G656 VanDerWaalsContact O-N 3.1Å
657	L	93.1	Very high	86.7	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.158	C	C	.	.			trans	-110.7	125.7	-177.5	-59.6	178.3	0	0	0	109.9	L651 Y652 L655 F692 A694 E699 V700 R702 A703	L651-L657 CarbonylContact C-O 3.35Å; L651-L657 VanDerWaalsContact C-O 3.27Å; L651-L657 HydrophobicContact CD2-CD1 4.28Å; L651-L657 PolarHBondContact O-N 2.88Å; L651-L657 VanDerWaalsContact O-N 3.13Å; Y652-L657 WeakPolarHBondContact CA-O 3.37Å; Y652-L657 PolarHBondContact N-O 2.78Å; L655-L657 HydrophobicContact CB-CD1 4.08Å; L655-L657 HydrophobicContact CB-CG 4.02Å; L655-L657 PolarHBondContact O-N 3.14Å; L657-F692 HydrophobicContact CB-CD1 4.18Å; L657-A694 HydrophobicContact CD2-CB 3.79Å; L657-E699 HydrophobicContact CD2-CB 4.27Å; L657-V700 HydrophobicContact CD2-CG2 4.29Å; L657-R702 HydrophobicContact CD1-CB 4.45Å; L657-A703 HydrophobicContact CD1-CB 3.97Å
658	L	94.8	Very high	84.9	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.01	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	110.6	176.3	178.1	64.3	0	0	0	109.8	Y652 F692 I693 L1141 L1151 I1153 N1174	Y652-L658 HydrophobicContact CD2-CB 4.28Å; Y652-L658 HydrophobicContact CD2-CD1 4.26Å; L658-F692 CarbonylContact O-C 3.58Å; L658-F692 VanDerWaalsContact O-CA 3.25Å; L658-F692 WeakPolarHBondContact O-CA 3.25Å; L658-I693 HydrophobicContact CB-CB 4.23Å; L658-I693 HydrophobicContact CD2-CB 4.27Å; L658-I693 HydrophobicContact CD2-CD1 4.02Å; L658-I693 PolarHBondContact N-O 2.65Å; L658-I693 PolarHBondContact O-N 3.17Å; L658-L1141 HydrophobicContact CD1-CD1 4.17Å; L658-L1151 HydrophobicContact CD1-CD1 4.04Å; L658-L1151 HydrophobicContact CD1-CG 4.41Å; L658-I1153 HydrophobicContact CD2-CG2 4.19Å; L658-N1174 HydrophobicContact CD2-CB 4.24Å
659	L	95.2	Very high	83.1	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	117.7	175.5	177.1	67.2	0	0	0	110.1	F635 F644 A648 L651 I662 F692 L1151	F635-L659 HydrophobicContact CE1-CD1 4.07Å; F635-L659 HydrophobicContact CE1-CD2 4.02Å; F635-L659 HydrophobicContact CZ-CD1 3.71Å; F635-L659 HydrophobicContact CZ-CD2 3.98Å; F644-L659 HydrophobicContact CD2-CD2 3.86Å; F644-L659 HydrophobicContact CD2-CG 4.43Å; F644-L659 HydrophobicContact CE2-CD1 4.41Å; F644-L659 HydrophobicContact CE2-CD2 3.54Å; F644-L659 HydrophobicContact CE2-CG 3.62Å; F644-L659 HydrophobicContact CZ-CD2 4.13Å; F644-L659 HydrophobicContact CZ-CG 3.96Å; A648-L659 HydrophobicContact CB-CB 4.19Å; A648-L659 HydrophobicContact CB-CD2 4.27Å; L651-L659 HydrophobicContact CD1-CB 4.14Å; L651-L659 HydrophobicContact CD1-CD2 3.9Å; L659-I662 HydrophobicContact CD1-CG2 4.42Å; L659-F692 HydrophobicContact CB-CD1 4.24Å; L659-F692 HydrophobicContact CB-CE1 4.13Å; L659-F692 HydrophobicContact CD1-CD1 4.07Å; L659-F692 HydrophobicContact CD1-CE1 3.67Å; L659-F692 HydrophobicContact CD1-CE2 4.45Å; L659-F692 HydrophobicContact CD1-CZ 3.89Å; L659-F692 HydrophobicContact CG-CE1 4.43Å; L659-L1151 VanDerWaalsContact O-CD2 3.25Å; L659-L1151 WeakPolarHBondContact O-CD2 3.29Å
660	L	93.4	Very high	81.4	Confident	5 Å²	5	51.1 Å²	51.1	3%	0.026	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	-43.2	-175.4	-174.1	134.8	0	0	0	113.4	I676 N677 F691 I693 L1077 I1153 L1190	L660-I676 HydrophobicContact CD2-CG2 4.35Å; L660-N677 PolarHBondContact O-N 2.78Å; L660-F691 PolarHBondContact N-O 2.97Å; L660-I693 HydrophobicContact CD1-CD1 3.86Å; L660-L1077 HydrophobicContact CD2-CD1 3.85Å; L660-L1077 HydrophobicContact CD2-CD2 4.08Å; L660-L1077 HydrophobicContact CD2-CG 4.46Å; L660-I1153 HydrophobicContact CD1-CD1 4.27Å; L660-I1153 HydrophobicContact CD1-CG1 4.48Å; L660-L1190 HydrophobicContact CD1-CD1 4.48Å; L660-L1190 HydrophobicContact CG-CD1 4.25Å
661	A	92.3	Very high	79.9	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	164.9	-176.4	0	0	0	0	0	111.8	I674 A675 I676 F691 L1077	A661-I674 HydrophobicContact CB-CG2 3.94Å; A661-A675 VanDerWaalsContact CA-O 3.29Å; A661-A675 WeakPolarHBondContact CA-O 3.45Å; A661-A675 VanDerWaalsContact CB-O 3.31Å; A661-A675 WeakPolarHBondContact CB-O 3.43Å; A661-I676 HydrophobicContact CB-CG1 4.18Å; A661-F691 HydrophobicContact CB-CB 4.09Å; A661-F691 HydrophobicContact CB-CD2 3.84Å; A661-F691 HydrophobicContact CB-CG 4.24Å; A661-F691 PolarHBondContact O-N 3.44Å; A661-L1077 HydrophobicContact CB-CD1 3.96Å
662	I	91.8	Very high	78.5	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	142.9	170.3	53.5	172.9	0	0	0	110.9	F635 F644 L659 T664 A675 P678 V682 Q689	F635-I662 HydrophobicContact CE2-CG2 3.88Å; F635-I662 HydrophobicContact CZ-CG2 3.82Å; F644-I662 HydrophobicContact CD2-CD1 4.24Å; F644-I662 HydrophobicContact CD2-CG1 4.23Å; F644-I662 HydrophobicContact CD2-CG2 3.9Å; F644-I662 HydrophobicContact CE2-CG2 4.02Å; L659-I662 HydrophobicContact CD1-CG2 4.42Å; I662-T664 HydrophobicContact CD1-CG2 4.35Å; I662-T664 HydrophobicContact CG1-CG2 4.47Å; I662-A675 HydrophobicContact CG1-CB 4.34Å; I662-A675 PolarHBondContact N-O 2.84Å; I662-A675 PolarHBondContact O-N 2.73Å; I662-P678 HydrophobicContact CD1-CG 3.77Å; I662-P678 HydrophobicContact CG1-CG 3.79Å; I662-V682 HydrophobicContact CD1-CG1 3.64Å; I662-Q689 CarbonylContact C-O 3.5Å; I662-Q689 WeakPolarHBondContact CA-O 3.23Å
663	E	86.1	Confident	77.6	Confident	11 Å²	11	58.4 Å²	58.4	5%	0.051	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	116.5	169.3	-169.7	-165.1	165.4	0	0	109.1	C672 Q689 F691	E663-C672 HydrophobicContact CG-CB 4.18Å; E663-C672 WeakPolarHBondContact OE1-CB 3.11Å; E663-C672 PolarHBondContact OE1-SG 3.35Å; E663-Q689 HydrophobicContact CB-CB 4.13Å; E663-Q689 PolarHBondContact N-O 3.15Å; E663-Q689 VanDerWaalsContact OE2-CD 3.23Å; E663-Q689 WeakPolarHBondContact OE2-CG 3.17Å; E663-Q689 PolarHBondContact OE2-NE2 3.03Å; E663-F691 HydrophobicContact CB-CE2 4.27Å
664	T	74.6	Confident	77.5	Confident	42 Å²	42	56.3 Å²	56.3	26%	0.258	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	124.7	171	54.6	0	0	0	0	108.8	I662 N673 V682	I662-T664 HydrophobicContact CD1-CG2 4.35Å; I662-T664 HydrophobicContact CG1-CG2 4.47Å; T664-N673 PolarHBondContact N-O 3.43Å; T664-N673 PolarHBondContact O-N 3.2Å; T664-N673 VanDerWaalsContact O-O 3.14Å; T664-N673 PolarHBondContact OG1-O 3.31Å; T664-N673 VanDerWaalsContact OG1-O 3.14Å; T664-V682 HydrophobicContact CG2-CG1 4.14Å
665	K	69.1	Low	77.5	Confident	85 Å²	85	52.7 Å²	52.7	37%	0.37	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	122.4	174.7	-64.4	-170.5	177.2	-164.1	0	108.7
666	D	63.9	Low	77.6	Confident	52 Å²	52	53.9 Å²	53.9	28%	0.278	27%	0.272	S	S	.	.			trans	-85.5	110.8	169.4	-166.5	-16.9	0	0	0	108.3	E668 R670 E671	D666-E668 PolarHBondContact O-N 3.06Å; D666-E668 PolarHBondContact OD1-N 3.48Å; D666-R670 PolarHBondContact O-N 3.11Å; D666-R670 VanDerWaalsContact O-N 3.11Å; D666-E671 PolarHBondContact N-O 2.73Å; D666-E671 VanDerWaalsContact N-O 3.16Å
667	D	57.6	Low	77.8	Confident	154 Å²	154	52.8 Å²	52.8	82%	0.824	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-25.6	-176.9	-75.5	-30.8	0	0	0	111.8
668	E	57.1	Low	77.7	Confident	176 Å²	176	53.4 Å²	53.4	82%	0.822	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-50	-177.4	-63.9	-169.5	164.3	0	0	112.3	D666	D666-E668 PolarHBondContact O-N 3.06Å; D666-E668 PolarHBondContact OD1-N 3.48Å
669	K	56	Low	77.2	Confident	119 Å²	119	55 Å²	55	52%	0.517	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-12.3	-175.6	-65	-177.4	-178.3	178.5	0	113.4	E671	K669-E671 HydrophobicContact CB-CB 4.2Å; K669-E671 HydrophobicContact CB-CG 4.03Å; K669-E671 PolarHBondContact O-N 2.9Å
670	R	55.2	Low	76.8	Confident	189 Å²	189	59.5 Å²	59.5	71%	0.713	31%	0.309	S	S	*	.			trans	54.5	26.7	-168.8	-59.3	-179	176.6	171.9	0.5	112.6	D666	D666-R670 PolarHBondContact O-N 3.11Å; D666-R670 VanDerWaalsContact O-N 3.11Å
671	E	60.4	Low	76.4	Confident	59 Å²	59	64.4 Å²	64.4	28%	0.276	34%	0.344	S	S	.	.			trans	-100	137.7	179.3	-68.7	179.2	170.8	0	0	109.3	W570 R571 D666 K669 N673	W570-E671 HydrophobicContact CH2-CG 4.25Å; R571-E671 IonicContact NH2-OE1 3.46Å; D666-E671 PolarHBondContact N-O 2.73Å; D666-E671 VanDerWaalsContact N-O 3.16Å; K669-E671 HydrophobicContact CB-CB 4.2Å; K669-E671 HydrophobicContact CB-CG 4.03Å; K669-E671 PolarHBondContact O-N 2.9Å; E671-N673 PolarHBondContact O-N 2.76Å
672	C	63.7	Low	76	Confident	62 Å²	62	66.4 Å²	66.4	42%	0.419	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	101.6	174.5	-61.8	0	0	0	0	106.9	E663	E663-C672 HydrophobicContact CG-CB 4.18Å; E663-C672 WeakPolarHBondContact OE1-CB 3.11Å; E663-C672 PolarHBondContact OE1-SG 3.35Å
673	N	73.9	Confident	75.9	Confident	72 Å²	72	70.6 Å²	70.6	39%	0.385	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	132.4	178.5	-71.3	-28.6	0	0	0	109.1	T664 E671	T664-N673 PolarHBondContact N-O 3.43Å; T664-N673 PolarHBondContact O-N 3.2Å; T664-N673 VanDerWaalsContact O-O 3.14Å; T664-N673 PolarHBondContact OG1-O 3.31Å; T664-N673 VanDerWaalsContact OG1-O 3.14Å; E671-N673 PolarHBondContact O-N 2.76Å
674	I	85.1	Confident	76	Confident	25 Å²	25	70.1 Å²	70.1	13%	0.128	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	114.7	176.5	-59.4	178	0	0	0	107.7	A661 I676 F691 T1076 L1077	A661-I674 HydrophobicContact CB-CG2 3.94Å; I674-I676 HydrophobicContact CG2-CG1 4.36Å; I674-F691 HydrophobicContact CD1-CE2 4.26Å; I674-F691 HydrophobicContact CD1-CZ 3.77Å; I674-F691 HydrophobicContact CG1-CE2 4.21Å; I674-F691 HydrophobicContact CG1-CZ 4.17Å; I674-F691 HydrophobicContact CG2-CD2 4.39Å; I674-F691 HydrophobicContact CG2-CE2 3.95Å; I674-F691 HydrophobicContact CG2-CZ 4.42Å; I674-T1076 HydrophobicContact CD1-CG2 3.72Å; I674-T1076 HydrophobicContact CG1-CG2 4.49Å; I674-L1077 HydrophobicContact CD1-CB 4.08Å; I674-L1077 HydrophobicContact CG2-CD1 3.78Å
675	A	86.9	Confident	76.6	Confident	25 Å²	25	71.6 Å²	71.6	21%	0.207	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	112.8	175.6	0	0	0	0	0	109.5	A661 I662 P678	A661-A675 VanDerWaalsContact CA-O 3.29Å; A661-A675 WeakPolarHBondContact CA-O 3.45Å; A661-A675 VanDerWaalsContact CB-O 3.31Å; A661-A675 WeakPolarHBondContact CB-O 3.43Å; I662-A675 HydrophobicContact CG1-CB 4.34Å; I662-A675 PolarHBondContact N-O 2.84Å; I662-A675 PolarHBondContact O-N 2.73Å; A675-P678 HydrophobicContact CB-CB 4.16Å; A675-P678 HydrophobicContact CB-CG 4.19Å
676	I	91	Very high	77.1	Confident	24 Å²	24	69.2 Å²	69.2	12%	0.123	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	122.3	180	-58.1	176.8	0	0	0	109.4	L660 A661 I674 L1077 T1080 L1081 C1116 L1190	L660-I676 HydrophobicContact CD2-CG2 4.35Å; A661-I676 HydrophobicContact CB-CG1 4.18Å; I674-I676 HydrophobicContact CG2-CG1 4.36Å; I676-L1077 HydrophobicContact CD1-CD1 3.82Å; I676-L1077 HydrophobicContact CG1-CD1 3.78Å; I676-T1080 HydrophobicContact CD1-CG2 3.91Å; I676-L1081 HydrophobicContact CD1-CB 4.01Å; I676-L1081 HydrophobicContact CD1-CD1 4.16Å; I676-C1116 PolarHBondContact O-SG 3.4Å; I676-C1116 VanDerWaalsContact O-SG 3.37Å; I676-L1190 HydrophobicContact CG2-CD1 3.65Å
677	N	92.8	Very high	77.8	Confident	6 Å²	6	73.8 Å²	73.8	3%	0.032	40%	0.404	C	S	.	.	S	Bend	trans	40.3	59.6	-174.5	-175.9	38.6	0	0	0	113.5	F644 L660 C1116 G1149 L1151 L1190	F644-N677 HydrophobicContact CE1-CB 4.32Å; F644-N677 VanDerWaalsContact CE1-OD1 3.29Å; F644-N677 WeakPolarHBondContact CE1-OD1 3.36Å; L660-N677 PolarHBondContact O-N 2.78Å; N677-C1116 PolarHBondContact O-SG 3.37Å; N677-G1149 PolarHBondContact ND2-O 3.3Å; N677-L1151 HydrophobicContact CB-CB 4.37Å; N677-L1190 HydrophobicContact CB-CB 4.14Å; N677-L1190 HydrophobicContact CB-CD1 4.02Å; N677-L1190 PolarHBondContact ND2-O 2.84Å
678	P	89.7	Confident	79.1	Confident	14 Å²	14	66.9 Å²	66.9	9%	0.091	37%	0.367	C	S	.	.			trans	-65.8	149.4	-179.8	26.5	-31.7	0	0	0	111.5	F644 I662 A675 V682	F644-P678 HydrophobicContact CB-CG 3.85Å; F644-P678 HydrophobicContact CD1-CG 4.24Å; F644-P678 WeakPolarHBondContact CD1-O 3.44Å; F644-P678 HydrophobicContact CD2-CG 3.68Å; F644-P678 HydrophobicContact CE2-CG 4.28Å; F644-P678 HydrophobicContact CG-CG 3.65Å; I662-P678 HydrophobicContact CD1-CG 3.77Å; I662-P678 HydrophobicContact CG1-CG 3.79Å; A675-P678 HydrophobicContact CB-CB 4.16Å; A675-P678 HydrophobicContact CB-CG 4.19Å; P678-V682 HydrophobicContact CB-CB 3.98Å; P678-V682 HydrophobicContact CB-CG2 3.8Å; P678-V682 HydrophobicContact CG-CB 4.38Å
679	G	85.7	Confident	80.6	Confident	35 Å²	35	60.4 Å²	60.4	36%	0.361	34%	0.337	S	S	.	.			trans	-65.7	178.8	175.6	0	0	0	0	0	113.8	S681 V682	G679-S681 PolarHBondContact O-N 3.13Å; G679-V682 PolarHBondContact O-N 3.05Å
680	P	86.3	Confident	82.3	Confident	94 Å²	94	54.7 Å²	54.7	61%	0.61	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-8.9	-177.1	27.6	-35.6	0	0	0	114.4	T643 V682	T643-P680 HydrophobicContact CG2-CB 4.34Å; T643-P680 WeakPolarHBondContact CG2-O 3.46Å; P680-V682 VanDerWaalsContact C-N 3.28Å; P680-V682 PolarHBondContact O-N 3.28Å
681	S	84.9	Confident	84	Confident	108 Å²	108	46 Å²	46	76%	0.755	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-23	175.7	53.5	0	0	0	0	113.5	G679	G679-S681 PolarHBondContact O-N 3.13Å
682	V	84.6	Confident	85.6	Confident	42 Å²	42	43.2 Å²	43.2	26%	0.255	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-96.2	120.4	-178.4	-172.2	0	0	0	0	110	I662 T664 P678 G679 P680	I662-V682 HydrophobicContact CD1-CG1 3.64Å; T664-V682 HydrophobicContact CG2-CG1 4.14Å; P678-V682 HydrophobicContact CB-CB 3.98Å; P678-V682 HydrophobicContact CB-CG2 3.8Å; P678-V682 HydrophobicContact CG-CB 4.38Å; G679-V682 PolarHBondContact O-N 3.05Å; P680-V682 VanDerWaalsContact C-N 3.28Å; P680-V682 PolarHBondContact O-N 3.28Å
683	L	89.4	Confident	87	Confident	89 Å²	89	40.3 Å²	40.3	47%	0.466	25%	0.247	S	C	.	.	B	Isolated β-bridge	trans	-98.7	143	179.4	-60.9	177.3	0	0	0	111.4	T643 T685	T643-L683 HydrophobicContact CG2-CD2 3.95Å; L683-T685 PolarHBondContact O-N 3.39Å
684	I	88.8	Confident	87.8	Confident	1 Å²	1	37 Å²	37	1%	0.005	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-73.8	123.8	175.1	-62.5	-178.9	0	0	0	109.6	F635 F639 Y640 G641 M642 A647 T688	F635-I684 HydrophobicContact CB-CG2 4.12Å; F635-I684 HydrophobicContact CD1-CD1 4.37Å; F635-I684 HydrophobicContact CD2-CG2 3.69Å; F635-I684 HydrophobicContact CE1-CD1 4.12Å; F635-I684 HydrophobicContact CE2-CD1 4.47Å; F635-I684 HydrophobicContact CE2-CG2 4.2Å; F635-I684 HydrophobicContact CG-CG2 3.86Å; F635-I684 HydrophobicContact CZ-CD1 4.17Å; F639-I684 HydrophobicContact CB-CD1 4.49Å; F639-I684 HydrophobicContact CB-CG2 4.24Å; Y640-I684 WeakPolarHBondContact CA-O 3.38Å; Y640-I684 HydrophobicContact CD1-CG2 4.48Å; G641-I684 PolarHBondContact N-O 3.06Å; M642-I684 PolarHBondContact O-N 3.03Å; A647-I684 HydrophobicContact CB-CD1 3.27Å; I684-T688 WeakPolarHBondContact CG2-OG1 3.42Å
685	T	85.9	Confident	87.9	Confident	72 Å²	72	39.4 Å²	39.4	44%	0.442	24%	0.24	S	C	.	.			trans	-114.8	169.6	178	76.6	0	0	0	0	111.7	L683 H687 T688	L683-T685 PolarHBondContact O-N 3.39Å; T685-H687 PolarHBondContact O-N 2.98Å; T685-H687 VanDerWaalsContact O-N 3.08Å; T685-T688 PolarHBondContact N-OG1 2.83Å; T685-T688 PolarHBondContact O-N 2.74Å; T685-T688 VanDerWaalsContact O-N 3.12Å; T685-T688 PolarHBondContact O-OG1 3.29Å
686	G	79.5	Confident	87.9	Confident	35 Å²	35	40.1 Å²	40.1	36%	0.361	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-11.4	-178.1	0	0	0	0	0	116.4	Y640	Y640-G686 WeakPolarHBondContact OH-CA 3.36Å
687	H	79	Confident	87.5	Confident	149 Å²	149	40.6 Å²	40.6	69%	0.69	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-5.8	177.2	-60.6	-60.1	0	0	0	113.6	T685	T685-H687 PolarHBondContact O-N 2.98Å; T685-H687 VanDerWaalsContact O-N 3.08Å
688	T	85.4	Confident	87.1	Confident	8 Å²	8	44.8 Å²	44.8	5%	0.049	27%	0.273	C	S	.	.			trans	-73.3	139.7	179.3	57.8	0	0	0	0	111.7	F635 I684 T685	F635-T688 WeakPolarHBondContact CD2-OG1 3.49Å; I684-T688 WeakPolarHBondContact CG2-OG1 3.42Å; T685-T688 PolarHBondContact N-OG1 2.83Å; T685-T688 PolarHBondContact O-N 2.74Å; T685-T688 VanDerWaalsContact O-N 3.12Å; T685-T688 PolarHBondContact O-OG1 3.29Å
689	Q	88.1	Confident	87	Confident	40 Å²	40	46.4 Å²	46.4	19%	0.187	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	135.3	169.4	-57.7	-168.1	69.6	0	0	108.3	K634 I662 E663	K634-Q689 HydrophobicContact CG-CG 4.2Å; I662-Q689 CarbonylContact C-O 3.5Å; I662-Q689 WeakPolarHBondContact CA-O 3.23Å; E663-Q689 HydrophobicContact CB-CB 4.13Å; E663-Q689 PolarHBondContact N-O 3.15Å; E663-Q689 VanDerWaalsContact OE2-CD 3.23Å; E663-Q689 WeakPolarHBondContact OE2-CG 3.17Å; E663-Q689 PolarHBondContact OE2-NE2 3.03Å
690	G	91.3	Very high	87.2	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	143	176.2	0	0	0	0	0	110.9	T632 E633 F692	T632-G690 WeakPolarHBondContact CA-O 3.28Å; E633-G690 PolarHBondContact N-O 2.82Å; E633-G690 PolarHBondContact O-N 3.47Å; G690-F692 VanDerWaalsContact O-CD2 3.3Å; G690-F692 WeakPolarHBondContact O-CD2 3.39Å; G690-F692 VanDerWaalsContact O-CE2 3.32Å; G690-F692 WeakPolarHBondContact O-CE2 3.26Å
691	F	92.6	Very high	87.3	Confident	5 Å²	5	43 Å²	43	2%	0.022	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	119.8	168.3	-67.2	-95	0	0	0	108.9	Y631 T632 L660 A661 E663 I674 L1077	Y631-F691 CarbonylContact O-C 3.53Å; Y631-F691 WeakPolarHBondContact O-CA 3.38Å; T632-F691 HydrophobicContact CG2-CD1 3.37Å; T632-F691 HydrophobicContact CG2-CE1 3.32Å; T632-F691 HydrophobicContact CG2-CG 4.15Å; T632-F691 HydrophobicContact CG2-CZ 4.04Å; L660-F691 PolarHBondContact N-O 2.97Å; A661-F691 HydrophobicContact CB-CB 4.09Å; A661-F691 HydrophobicContact CB-CD2 3.84Å; A661-F691 HydrophobicContact CB-CG 4.24Å; A661-F691 PolarHBondContact O-N 3.44Å; E663-F691 HydrophobicContact CB-CE2 4.27Å; I674-F691 HydrophobicContact CD1-CE2 4.26Å; I674-F691 HydrophobicContact CD1-CZ 3.77Å; I674-F691 HydrophobicContact CG1-CE2 4.21Å; I674-F691 HydrophobicContact CG1-CZ 4.17Å; I674-F691 HydrophobicContact CG2-CD2 4.39Å; I674-F691 HydrophobicContact CG2-CE2 3.95Å; I674-F691 HydrophobicContact CG2-CZ 4.42Å; F691-L1077 HydrophobicContact CB-CD2 4.13Å; F691-L1077 HydrophobicContact CD1-CD2 3.58Å; F691-L1077 HydrophobicContact CE1-CB 4.29Å; F691-L1077 HydrophobicContact CE1-CD2 4.18Å; F691-L1077 HydrophobicContact CG-CD2 3.95Å
692	F	93.1	Very high	87.6	Confident	1 Å²	1	38.9 Å²	38.9	0%	0.004	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	145.5	-173.2	-59.8	-86.9	0	0	0	111.1	M630 Y631 E633 F635 L651 L657 L658 L659 G690 V700 A703	M630-F692 WeakPolarHBondContact CA-O 3.22Å; Y631-F692 PolarHBondContact N-O 3.18Å; Y631-F692 PolarHBondContact O-N 3.28Å; E633-F692 HydrophobicContact CB-CD2 4.22Å; E633-F692 HydrophobicContact CB-CE2 3.98Å; F635-F692 HydrophobicContact CD1-CZ 4.21Å; F635-F692 HydrophobicContact CE1-CE1 4.23Å; F635-F692 AromaticContact CE1-CZ 3.61Å; F635-F692 HydrophobicContact CE1-CZ 3.61Å; F635-F692 HydrophobicContact CZ-CZ 4.05Å; L651-F692 HydrophobicContact CD1-CE1 3.89Å; L651-F692 HydrophobicContact CD2-CE1 4.01Å; L657-F692 HydrophobicContact CB-CD1 4.18Å; L658-F692 CarbonylContact O-C 3.58Å; L658-F692 VanDerWaalsContact O-CA 3.25Å; L658-F692 WeakPolarHBondContact O-CA 3.25Å; L659-F692 HydrophobicContact CB-CD1 4.24Å; L659-F692 HydrophobicContact CB-CE1 4.13Å; L659-F692 HydrophobicContact CD1-CD1 4.07Å; L659-F692 HydrophobicContact CD1-CE1 3.67Å; L659-F692 HydrophobicContact CD1-CE2 4.45Å; L659-F692 HydrophobicContact CD1-CZ 3.89Å; L659-F692 HydrophobicContact CG-CE1 4.43Å; G690-F692 VanDerWaalsContact O-CD2 3.3Å; G690-F692 WeakPolarHBondContact O-CD2 3.39Å; G690-F692 VanDerWaalsContact O-CE2 3.32Å; G690-F692 WeakPolarHBondContact O-CE2 3.26Å; F692-V700 HydrophobicContact CB-CG1 3.92Å; F692-V700 HydrophobicContact CB-CG2 4.19Å; F692-V700 HydrophobicContact CD2-CG1 3.49Å; F692-V700 VanDerWaalsContact CD2-CG1 3.49Å; F692-V700 HydrophobicContact CE2-CG1 4.16Å; F692-V700 HydrophobicContact CG-CG1 3.79Å; F692-A703 HydrophobicContact CE1-CB 4.23Å; F692-A703 HydrophobicContact CE2-CB 4.49Å; F692-A703 HydrophobicContact CZ-CB 3.91Å
693	I	93.3	Very high	87.8	Confident	2 Å²	2	36.9 Å²	36.9	1%	0.01	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	123.1	162.6	-63	171.1	0	0	0	107.7	L603 M628 E629 M630 L658 L660 I1153 N1174	L603-I693 HydrophobicContact CD1-CD1 3.83Å; L603-I693 HydrophobicContact CD1-CG1 4.46Å; L603-I693 HydrophobicContact CD2-CD1 4.09Å; L603-I693 HydrophobicContact CD2-CG1 4.09Å; L603-I693 HydrophobicContact CD2-CG2 3.66Å; M628-I693 HydrophobicContact CB-CG2 3.85Å; M628-I693 HydrophobicContact CG-CG2 4.48Å; E629-I693 WeakPolarHBondContact O-CA 3.27Å; M630-I693 HydrophobicContact CG-CG1 4.48Å; L658-I693 HydrophobicContact CB-CB 4.23Å; L658-I693 HydrophobicContact CD2-CB 4.27Å; L658-I693 HydrophobicContact CD2-CD1 4.02Å; L658-I693 PolarHBondContact N-O 2.65Å; L658-I693 PolarHBondContact O-N 3.17Å; L660-I693 HydrophobicContact CD1-CD1 3.86Å; I693-I1153 HydrophobicContact CD1-CG2 4.01Å; I693-N1174 HydrophobicContact CG2-CB 3.84Å; I693-N1174 PolarHBondContact O-ND2 2.6Å
694	A	90.9	Very high	87.8	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.008	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	173.2	-179	0	0	0	0	0	110.9	E629 Y631 L657 E699 V700	E629-A694 PolarHBondContact N-O 3.39Å; E629-A694 PolarHBondContact O-N 3.39Å; E629-A694 VanDerWaalsContact O-N 3.12Å; Y631-A694 HydrophobicContact CD2-CB 4.25Å; L657-A694 HydrophobicContact CD2-CB 3.79Å; A694-E699 HydrophobicContact CB-CB 4.42Å; A694-V700 HydrophobicContact CB-CG2 3.43Å; A694-V700 VanDerWaalsContact CB-CG2 3.43Å
695	Q	87.5	Confident	87.8	Confident	76 Å²	76	38.9 Å²	38.9	36%	0.355	21%	0.206	S	C	.	.	S	Bend	trans	-80.2	-27.5	179.1	-66.2	180	0.3	0	0	113.3	M628	M628-Q695 HydrophobicContact CE-CG 3.84Å; M628-Q695 HydrophobicContact SD-CG 3.63Å
696	S	85.6	Confident	87.9	Confident	41 Å²	41	36 Å²	36	29%	0.287	19%	0.187	S	C	.	.			trans	-153.8	158.8	179.6	75.5	0	0	0	0	112.9	Y631 D698 E699 V700	Y631-S696 VanDerWaalsContact CE2-C 3.49Å; Y631-S696 WeakPolarHBondContact OH-CA 3.25Å; S696-D698 PolarHBondContact O-N 3.26Å; S696-E699 WeakPolarHBondContact O-CB 3.12Å; S696-E699 PolarHBondContact O-N 2.82Å; S696-E699 VanDerWaalsContact O-N 3.16Å; S696-E699 WeakPolarHBondContact OG-CG 3.39Å; S696-E699 PolarHBondContact OG-N 2.94Å; S696-V700 PolarHBondContact O-N 3.44Å
697	A	82.5	Confident	88.3	Confident	33 Å²	33	35.1 Å²	35.1	27%	0.273	18%	0.175	S	C	.	.	H	α-helix	trans	-59.3	-36.6	175.3	0	0	0	0	0	112.5	Y631 E699 V700 K701	Y631-A697 HydrophobicContact CD1-CB 3.97Å; Y631-A697 HydrophobicContact CE1-CB 3.74Å; Y631-A697 VanDerWaalsContact CZ-N 3.33Å; Y631-A697 PolarHBondContact OH-N 3.37Å; A697-E699 VanDerWaalsContact C-N 3.3Å; A697-E699 PolarHBondContact O-N 3.13Å; A697-V700 PolarHBondContact O-N 2.85Å; A697-V700 VanDerWaalsContact O-N 3.14Å; A697-K701 PolarHBondContact O-N 3.06Å; A697-K701 VanDerWaalsContact O-N 3.17Å
698	D	84.6	Confident	88.5	Confident	95 Å²	95	33 Å²	33	51%	0.508	16%	0.164	S	C	.	.	H	α-helix	trans	-61.8	-35.9	176.8	-97.6	-13.4	0	0	0	113	S696 V700 K701	S696-D698 PolarHBondContact O-N 3.26Å; D698-V700 VanDerWaalsContact C-N 3.34Å; D698-K701 IonicContact OD1-NZ 3.39Å; D698-K701 PolarHBondContact OD1-NZ 3.07Å
699	E	88.2	Confident	88.5	Confident	48 Å²	48	37.8 Å²	37.8	22%	0.224	20%	0.198	C	C	.	.	H	α-helix	trans	-64.8	-39.2	173.5	-72	-143.2	119.9	0	0	112.2	L657 A694 S696 A697 K701 R702	L657-E699 HydrophobicContact CD2-CB 4.27Å; A694-E699 HydrophobicContact CB-CB 4.42Å; S696-E699 WeakPolarHBondContact O-CB 3.12Å; S696-E699 PolarHBondContact O-N 2.82Å; S696-E699 VanDerWaalsContact O-N 3.16Å; S696-E699 WeakPolarHBondContact OG-CG 3.39Å; S696-E699 PolarHBondContact OG-N 2.94Å; A697-E699 VanDerWaalsContact C-N 3.3Å; A697-E699 PolarHBondContact O-N 3.13Å; E699-K701 VanDerWaalsContact C-N 3.33Å; E699-K701 PolarHBondContact O-N 3.15Å; E699-R702 VanDerWaalsContact O-CB 3.22Å; E699-R702 WeakPolarHBondContact O-CB 3.22Å; E699-R702 WeakPolarHBondContact O-CG 3.33Å; E699-R702 PolarHBondContact O-N 2.77Å; E699-R702 PolarHBondContact O-NE 3.33Å; E699-R702 IonicContact OE1-CZ 2.68Å; E699-R702 IonicContact OE1-NH1 2.77Å; E699-R702 PolarHBondContact OE1-NH1 3.24Å; E699-R702 IonicContact OE1-NH2 2.64Å; E699-R702 PolarHBondContact OE1-NH2 3.47Å; E699-R702 IonicContact OE2-NH2 2.98Å; E699-R702 PolarHBondContact OE2-NH2 3.46Å
700	V	88.9	Confident	88.2	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.012	21%	0.205	C	C	.	.	H	α-helix	trans	-70.5	-30.8	-177.7	-175.5	0	0	0	0	111.7	Y631 E633 L657 F692 A694 S696 A697 D698 R702 A703	Y631-V700 HydrophobicContact CD2-CG2 3.69Å; Y631-V700 HydrophobicContact CG-CG2 3.94Å; E633-V700 HydrophobicContact CB-CG1 3.49Å; E633-V700 VanDerWaalsContact CB-CG1 3.49Å; E633-V700 HydrophobicContact CG-CG1 4.14Å; L657-V700 HydrophobicContact CD2-CG2 4.29Å; F692-V700 HydrophobicContact CB-CG1 3.92Å; F692-V700 HydrophobicContact CB-CG2 4.19Å; F692-V700 HydrophobicContact CD2-CG1 3.49Å; F692-V700 VanDerWaalsContact CD2-CG1 3.49Å; F692-V700 HydrophobicContact CE2-CG1 4.16Å; F692-V700 HydrophobicContact CG-CG1 3.79Å; A694-V700 HydrophobicContact CB-CG2 3.43Å; A694-V700 VanDerWaalsContact CB-CG2 3.43Å; S696-V700 PolarHBondContact O-N 3.44Å; A697-V700 PolarHBondContact O-N 2.85Å; A697-V700 VanDerWaalsContact O-N 3.14Å; D698-V700 VanDerWaalsContact C-N 3.34Å; V700-R702 PolarHBondContact O-N 3.42Å; V700-A703 WeakPolarHBondContact O-CB 3.5Å; V700-A703 PolarHBondContact O-N 3.19Å
701	K	89.2	Confident	88	Confident	55 Å²	55	39 Å²	39	24%	0.239	21%	0.208	C	C	.	.	H	α-helix	trans	-55.9	-20.7	173.6	-69.7	174.3	-166.7	151.7	0	113.2	E462 A697 D698 E699 A703 F704 F705	E462-K701 IonicContact OE1-NZ 3.39Å; E462-K701 IonicContact OE2-NZ 3.02Å; E462-K701 PolarHBondContact OE2-NZ 3.17Å; A697-K701 PolarHBondContact O-N 3.06Å; A697-K701 VanDerWaalsContact O-N 3.17Å; D698-K701 IonicContact OD1-NZ 3.39Å; D698-K701 PolarHBondContact OD1-NZ 3.07Å; E699-K701 VanDerWaalsContact C-N 3.33Å; E699-K701 PolarHBondContact O-N 3.15Å; K701-A703 PolarHBondContact O-N 2.72Å; K701-F704 PolarHBondContact O-N 3.28Å; K701-F704 VanDerWaalsContact O-N 3.14Å; K701-F705 HydrophobicContact CB-CD2 4.25Å; K701-F705 HydrophobicContact CB-CE2 3.73Å; K701-F705 HydrophobicContact CB-CZ 4.3Å; K701-F705 VanDerWaalsContact O-CD2 3.29Å; K701-F705 WeakPolarHBondContact O-CD2 3.3Å; K701-F705 WeakPolarHBondContact O-CG 3.4Å; K701-F705 PolarHBondContact O-N 3.08Å; K701-F705 VanDerWaalsContact O-N 3.07Å
702	R	90.3	Very high	87.5	Confident	21 Å²	21	40.9 Å²	40.9	8%	0.079	23%	0.225	C	C	.	.	H	α-helix	trans	-57.9	-34.9	172.7	-62.1	-177.9	-66.5	-151.7	3.8	112	L655 L657 E699 V700 F704 F705 Y706 V717 I720	L655-R702 HydrophobicContact CD2-CB 4.42Å; L655-R702 VanDerWaalsContact O-CZ 3.29Å; L655-R702 PolarHBondContact O-NH2 2.98Å; L657-R702 HydrophobicContact CD1-CB 4.45Å; E699-R702 VanDerWaalsContact O-CB 3.22Å; E699-R702 WeakPolarHBondContact O-CB 3.22Å; E699-R702 WeakPolarHBondContact O-CG 3.33Å; E699-R702 PolarHBondContact O-N 2.77Å; E699-R702 PolarHBondContact O-NE 3.33Å; E699-R702 IonicContact OE1-CZ 2.68Å; E699-R702 IonicContact OE1-NH1 2.77Å; E699-R702 PolarHBondContact OE1-NH1 3.24Å; E699-R702 IonicContact OE1-NH2 2.64Å; E699-R702 PolarHBondContact OE1-NH2 3.47Å; E699-R702 IonicContact OE2-NH2 2.98Å; E699-R702 PolarHBondContact OE2-NH2 3.46Å; V700-R702 PolarHBondContact O-N 3.42Å; R702-F704 VanDerWaalsContact C-N 3.3Å; R702-F704 PolarHBondContact O-N 3.47Å; R702-F705 PolarHBondContact O-N 3.44Å; R702-Y706 WeakPolarHBondContact O-CB 3.3Å; R702-Y706 PolarHBondContact O-N 2.99Å; R702-V717 VanDerWaalsContact NH1-CG1 3.31Å; R702-I720 HydrophobicContact CB-CG2 4.29Å; R702-I720 HydrophobicContact CG-CG2 4.47Å
703	A	90.2	Very high	87	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-62.6	-35.8	176.7	0	0	0	0	0	112.5	S636 F639 L651 L657 F692 V700 K701	S636-A703 WeakPolarHBondContact CB-O 3.34Å; S636-A703 PolarHBondContact N-O 3.48Å; S636-A703 VanDerWaalsContact N-O 3.07Å; F639-A703 WeakPolarHBondContact CE2-O 3.33Å; L651-A703 HydrophobicContact CD2-CB 3.89Å; L657-A703 HydrophobicContact CD1-CB 3.97Å; F692-A703 HydrophobicContact CE1-CB 4.23Å; F692-A703 HydrophobicContact CE2-CB 4.49Å; F692-A703 HydrophobicContact CZ-CB 3.91Å; V700-A703 WeakPolarHBondContact O-CB 3.5Å; V700-A703 PolarHBondContact O-N 3.19Å; K701-A703 PolarHBondContact O-N 2.72Å
704	F	89.1	Confident	86.5	Confident	90 Å²	90	50.8 Å²	50.8	40%	0.395	28%	0.277	S	S	.	.	H	α-helix	trans	-77.6	-36.4	176.5	-178.5	-107.3	0	0	0	112.7	E633 K634 S636 K701 R702	E633-F704 HydrophobicContact CG-CB 4.18Å; K634-F704 HydrophobicContact CB-CD2 4.14Å; K634-F704 WeakPolarHBondContact O-CA 3.33Å; K634-F704 WeakPolarHBondContact O-CB 3.48Å; S636-F704 WeakPolarHBondContact CB-O 3.29Å; K701-F704 PolarHBondContact O-N 3.28Å; K701-F704 VanDerWaalsContact O-N 3.14Å; R702-F704 VanDerWaalsContact C-N 3.3Å; R702-F704 PolarHBondContact O-N 3.47Å
705	F	88	Confident	86	Confident	43 Å²	43	60.5 Å²	60.5	19%	0.189	32%	0.32	C	S	.	.	H	α-helix	trans	-84.1	-12	-178.2	-60.3	-34.6	0	0	0	115.1	K701 R702 C707 H711 K722	K701-F705 HydrophobicContact CB-CD2 4.25Å; K701-F705 HydrophobicContact CB-CE2 3.73Å; K701-F705 HydrophobicContact CB-CZ 4.3Å; K701-F705 VanDerWaalsContact O-CD2 3.29Å; K701-F705 WeakPolarHBondContact O-CD2 3.3Å; K701-F705 WeakPolarHBondContact O-CG 3.4Å; K701-F705 PolarHBondContact O-N 3.08Å; K701-F705 VanDerWaalsContact O-N 3.07Å; R702-F705 PolarHBondContact O-N 3.44Å; F705-C707 PolarHBondContact O-N 3.14Å; F705-H711 PolarHBondContact O-CE1 2.97Å; F705-K722 HydrophobicContact CD1-CB 4.29Å; F705-K722 HydrophobicContact CD1-CD 4.45Å; F705-K722 HydrophobicContact CD1-CG 3.38Å; F705-K722 HydrophobicContact CD2-CG 4.07Å; F705-K722 HydrophobicContact CE1-CD 3.88Å; F705-K722 HydrophobicContact CE1-CG 3.26Å; F705-K722 HydrophobicContact CE2-CG 3.95Å; F705-K722 HydrophobicContact CG-CG 3.82Å; F705-K722 HydrophobicContact CZ-CD 4.02Å; F705-K722 HydrophobicContact CZ-CG 3.59Å
706	Y	88.4	Confident	85.8	Confident	11 Å²	11	60.7 Å²	60.7	4%	0.043	32%	0.323	C	S	.	.			trans	-61.4	131.1	-175.2	-173.7	-109.2	0	0	0	112.8	S636 S638 F639 L650 L655 R702 K708 H711	S636-Y706 WeakPolarHBondContact CB-O 3.46Å; S636-Y706 PolarHBondContact OG-O 3.41Å; S638-Y706 PolarHBondContact OG-O 2.88Å; F639-Y706 AromaticContact CE2-CD1 3.91Å; F639-Y706 HydrophobicContact CE2-CD1 3.91Å; F639-Y706 HydrophobicContact CE2-CG 4.4Å; F639-Y706 AromaticContact CZ-CD1 3.76Å; F639-Y706 HydrophobicContact CZ-CD1 3.76Å; F639-Y706 HydrophobicContact CZ-CE1 4.42Å; F639-Y706 HydrophobicContact CZ-CG 4.36Å; L650-Y706 HydrophobicContact CD2-CE1 4.16Å; L655-Y706 HydrophobicContact CD1-CD2 4.22Å; L655-Y706 HydrophobicContact CD1-CG 4.14Å; L655-Y706 HydrophobicContact CD2-CD2 3.89Å; L655-Y706 HydrophobicContact CD2-CE2 4.35Å; L655-Y706 HydrophobicContact CG-CD2 4.49Å; R702-Y706 WeakPolarHBondContact O-CB 3.3Å; R702-Y706 PolarHBondContact O-N 2.99Å; Y706-K708 HydrophobicContact CE1-CG 4.02Å; Y706-H711 HydrophobicContact CD2-CB 3.96Å; Y706-H711 HydrophobicContact CE2-CB 3.84Å
707	C	87.6	Confident	85.7	Confident	16 Å²	16	60.6 Å²	60.6	11%	0.108	32%	0.321	C	S	.	.			trans	-135.4	119.7	173.9	177.8	0	0	0	0	108.6	S638 F705 S709 C710 H711 C723	S638-C707 WeakPolarHBondContact OG-CA 3.5Å; F705-C707 PolarHBondContact O-N 3.14Å; C707-S709 PolarHBondContact O-N 3.47Å; C707-S709 VanDerWaalsContact O-N 3.16Å; C707-C710 HydrophobicContact CB-CB 3.98Å; C707-C710 PolarHBondContact O-N 3.49Å; C707-H711 PolarHBondContact N-ND1 2.91Å; C707-H711 PolarHBondContact O-N 3.43Å; C707-C723 HydrophobicContact CB-CB 3.74Å; C707-C723 WeakPolarHBondContact CB-SG 3.49Å
708	K	84.3	Confident	85.8	Confident	106 Å²	106	63.4 Å²	63.4	46%	0.461	33%	0.334	S	S	.	.	H	α-helix	trans	-51.2	-40.8	178.3	-74.8	179.8	178.8	-177.4	0	112	S638 Y706 A712	S638-K708 PolarHBondContact OG-N 3.05Å; Y706-K708 HydrophobicContact CE1-CG 4.02Å; K708-A712 WeakPolarHBondContact O-CB 3.48Å; K708-A712 PolarHBondContact O-N 3.47Å
709	S	83.8	Confident	85.7	Confident	108 Å²	108	64.1 Å²	64.1	76%	0.755	34%	0.337	S	S	*	.	H	α-helix	trans	-71.6	-27.8	179.8	-47.7	0	0	0	0	114.3	C707	C707-S709 PolarHBondContact O-N 3.47Å; C707-S709 VanDerWaalsContact O-N 3.16Å
710	C	83.5	Confident	85.4	Confident	49 Å²	49	62.3 Å²	62.3	33%	0.331	33%	0.329	S	S	.	.	H	α-helix	trans	-91	-37.7	179.8	-82	0	0	0	0	112.5	C707 C723 C725	C707-C710 HydrophobicContact CB-CB 3.98Å; C707-C710 PolarHBondContact O-N 3.49Å; C710-C723 HydrophobicContact CB-CB 3.85Å; C710-C723 WeakPolarHBondContact CB-SG 3.4Å; C710-C723 WeakPolarHBondContact SG-CB 3.47Å; C710-C723 CovalentContact SG-SG 2.07Å; C710-C723 PolarHBondContact SG-SG 3.45Å; C710-C725 PolarHBondContact SG-SG 2.88Å
711	H	86.1	Confident	84.8	Confident	16 Å²	16	69.4 Å²	69.4	7%	0.074	36%	0.36	C	S	.	.	H	α-helix	trans	-121.8	0.5	-158.4	-54.6	154.8	0	0	0	114.7	F705 Y706 C707 D713 I714 K721	F705-H711 PolarHBondContact O-CE1 2.97Å; Y706-H711 HydrophobicContact CD2-CB 3.96Å; Y706-H711 HydrophobicContact CE2-CB 3.84Å; C707-H711 PolarHBondContact N-ND1 2.91Å; C707-H711 PolarHBondContact O-N 3.43Å; H711-D713 PolarHBondContact O-N 3.42Å; H711-I714 HydrophobicContact CB-CD1 4.15Å; H711-I714 PolarHBondContact O-N 2.86Å; H711-K721 PolarHBondContact CE1-O 3.41Å; H711-K721 PolarHBondContact NE2-O 3.43Å
712	A	81.6	Confident	84.2	Confident	44 Å²	44	74.1 Å²	74.1	36%	0.364	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-33.9	-177.2	0	0	0	0	0	113.8	K708	K708-A712 WeakPolarHBondContact O-CB 3.48Å; K708-A712 PolarHBondContact O-N 3.47Å
713	D	84.3	Confident	83.3	Confident	160 Å²	160	74.3 Å²	74.3	86%	0.856	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-2.1	-174.9	-58.2	-37.5	0	0	0	114	H711 K715	H711-D713 PolarHBondContact O-N 3.42Å; D713-K715 PolarHBondContact O-N 2.77Å
714	I	82.4	Confident	82.2	Confident	52 Å²	52	84 Å²	84	27%	0.267	43%	0.427	S	S	.	.			trans	-79.3	122	-178.5	-60.7	179.4	0	0	0	109.2	H711 D716 L719 I720	H711-I714 HydrophobicContact CB-CD1 4.15Å; H711-I714 PolarHBondContact O-N 2.86Å; I714-D716 WeakPolarHBondContact CG2-O 3.39Å; I714-L719 HydrophobicContact CG2-CB 3.98Å; I714-L719 HydrophobicContact CG2-CD1 4.46Å; I714-I720 HydrophobicContact CG2-CG1 4.32Å
715	K	79.8	Confident	81.1	Confident	205 Å²	205	81.6 Å²	81.6	89%	0.891	42%	0.421	S	S	*	.			trans	-85.9	-38.7	175.2	-65.7	-174.6	178.9	-177.1	0	112.9	D713 V717	D713-K715 PolarHBondContact O-N 2.77Å; K715-V717 PolarHBondContact O-N 3.05Å
716	D	83	Confident	79.3	Confident	80 Å²	80	88.2 Å²	88.2	43%	0.428	45%	0.45	S	S	.	.			trans	-83.9	109.3	179.7	-175.7	-7.7	0	0	0	110	I714 T718 L719	I714-D716 WeakPolarHBondContact CG2-O 3.39Å; D716-T718 PolarHBondContact O-N 3.37Å; D716-T718 VanDerWaalsContact O-N 3.17Å; D716-T718 WeakPolarHBondContact OD1-CB 3.29Å; D716-T718 WeakPolarHBondContact OD1-CG2 3.16Å; D716-T718 PolarHBondContact OD1-N 3.46Å; D716-T718 PolarHBondContact OD1-OG1 2.95Å; D716-T718 PolarHBondContact OD2-OG1 3.37Å; D716-L719 HydrophobicContact CB-CD1 3.99Å; D716-L719 HydrophobicContact CB-CG 4.14Å; D716-L719 PolarHBondContact O-N 3.26Å; D716-L719 VanDerWaalsContact O-N 3.14Å
717	V	84.5	Confident	77.6	Confident	39 Å²	39	93.6 Å²	93.6	24%	0.236	48%	0.479	C	S	.	.	G	3₁₀ helix	trans	-61.1	-26.1	-175.7	-167.1	0	0	0	0	111.8	L655 R702 K715 L719 I720	L655-V717 WeakPolarHBondContact O-CG1 3.43Å; R702-V717 VanDerWaalsContact NH1-CG1 3.31Å; K715-V717 PolarHBondContact O-N 3.05Å; V717-L719 PolarHBondContact O-N 2.93Å; V717-I720 HydrophobicContact CG1-CD1 4.29Å; V717-I720 WeakPolarHBondContact O-CB 3.3Å; V717-I720 PolarHBondContact O-N 2.96Å
718	T	83.3	Confident	75.8	Confident	92 Å²	92	96.9 Å²	96.9	56%	0.564	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-69	-20.6	-179.9	68.8	0	0	0	0	113.3	D716 I720	D716-T718 PolarHBondContact O-N 3.37Å; D716-T718 VanDerWaalsContact O-N 3.17Å; D716-T718 WeakPolarHBondContact OD1-CB 3.29Å; D716-T718 WeakPolarHBondContact OD1-CG2 3.16Å; D716-T718 PolarHBondContact OD1-N 3.46Å; D716-T718 PolarHBondContact OD1-OG1 2.95Å; D716-T718 PolarHBondContact OD2-OG1 3.37Å; T718-I720 VanDerWaalsContact C-N 3.27Å; T718-I720 PolarHBondContact O-N 3.12Å
719	L	82.8	Confident	74	Confident	109 Å²	109	95 Å²	95	57%	0.571	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-79.9	-9.4	178.6	-62.1	177.3	0	0	0	113	I714 D716 V717 K721	I714-L719 HydrophobicContact CG2-CB 3.98Å; I714-L719 HydrophobicContact CG2-CD1 4.46Å; D716-L719 HydrophobicContact CB-CD1 3.99Å; D716-L719 HydrophobicContact CB-CG 4.14Å; D716-L719 PolarHBondContact O-N 3.26Å; D716-L719 VanDerWaalsContact O-N 3.14Å; V717-L719 PolarHBondContact O-N 2.93Å; L719-K721 PolarHBondContact O-N 3.49Å
720	I	82	Confident	72.3	Confident	10 Å²	10	95.1 Å²	95.1	5%	0.051	49%	0.491	C	S	.	.			trans	-75.4	89.2	-178.7	-60.5	179.2	0	0	0	109.6	L655 R702 I714 V717 T718	L655-I720 HydrophobicContact CD2-CD1 3.26Å; L655-I720 HydrophobicContact CD2-CG2 4.36Å; R702-I720 HydrophobicContact CB-CG2 4.29Å; R702-I720 HydrophobicContact CG-CG2 4.47Å; I714-I720 HydrophobicContact CG2-CG1 4.32Å; V717-I720 HydrophobicContact CG1-CD1 4.29Å; V717-I720 WeakPolarHBondContact O-CB 3.3Å; V717-I720 PolarHBondContact O-N 2.96Å; T718-I720 VanDerWaalsContact C-N 3.27Å; T718-I720 PolarHBondContact O-N 3.12Å
721	K	77.3	Confident	70.7	Confident	152 Å²	152	97.8 Å²	97.8	66%	0.661	50%	0.497	S	S	*	.			trans	-108.2	179.1	175.1	-64.5	-174.8	179.3	-178.2	0	110.6	H711 L719 C723	H711-K721 PolarHBondContact CE1-O 3.41Å; H711-K721 PolarHBondContact NE2-O 3.43Å; L719-K721 PolarHBondContact O-N 3.49Å; K721-C723 PolarHBondContact O-N 2.91Å
722	K	76.2	Confident	69.2	Low	153 Å²	153	105.5 Å²	105.5	67%	0.665	53%	0.525	S	S	*	.			trans	-46.4	110.4	176.1	-76.1	172	-176.2	172.5	0	111.6	F705	F705-K722 HydrophobicContact CD1-CB 4.29Å; F705-K722 HydrophobicContact CD1-CD 4.45Å; F705-K722 HydrophobicContact CD1-CG 3.38Å; F705-K722 HydrophobicContact CD2-CG 4.07Å; F705-K722 HydrophobicContact CE1-CD 3.88Å; F705-K722 HydrophobicContact CE1-CG 3.26Å; F705-K722 HydrophobicContact CE2-CG 3.95Å; F705-K722 HydrophobicContact CG-CG 3.82Å; F705-K722 HydrophobicContact CZ-CD 4.02Å; F705-K722 HydrophobicContact CZ-CG 3.59Å
723	C	71.3	Confident	67.6	Low	25 Å²	25	110.3 Å²	110.3	17%	0.169	54%	0.538	C	S	.	.			trans	-63.3	136.4	178.3	168	0	0	0	0	110.9	C707 C710 K721 C725	C707-C723 HydrophobicContact CB-CB 3.74Å; C707-C723 WeakPolarHBondContact CB-SG 3.49Å; C710-C723 HydrophobicContact CB-CB 3.85Å; C710-C723 WeakPolarHBondContact CB-SG 3.4Å; C710-C723 WeakPolarHBondContact SG-CB 3.47Å; C710-C723 CovalentContact SG-SG 2.07Å; C710-C723 PolarHBondContact SG-SG 3.45Å; K721-C723 PolarHBondContact O-N 2.91Å; C723-C725 VanDerWaalsContact C-N 3.34Å; C723-C725 WeakPolarHBondContact SG-CB 3.24Å; C723-C725 PolarHBondContact SG-N 3.45Å; C723-C725 VanDerWaalsContact SG-N 3.42Å; C723-C725 PolarHBondContact SG-SG 3.14Å
724	K	67.7	Low	65.9	Low	204 Å²	204	107.2 Å²	107.2	89%	0.887	52%	0.519	S	S	*	.			trans	-90.4	11.1	179.8	-65.2	-177.8	-178.7	175.6	0	113.4	K726	K724-K726 PolarHBondContact O-N 3.03Å
725	C	64.6	Low	64.6	Low	39 Å²	39	109.2 Å²	109.2	26%	0.264	53%	0.529	S	S	.	.			trans	-53.7	125.6	-179.6	-88.8	0	0	0	0	111.4	C710 C723 N727 L728	C710-C725 PolarHBondContact SG-SG 2.88Å; C723-C725 VanDerWaalsContact C-N 3.34Å; C723-C725 WeakPolarHBondContact SG-CB 3.24Å; C723-C725 PolarHBondContact SG-N 3.45Å; C723-C725 VanDerWaalsContact SG-N 3.42Å; C723-C725 PolarHBondContact SG-SG 3.14Å; C725-N727 PolarHBondContact O-N 3.25Å; C725-L728 PolarHBondContact O-N 3.34Å
726	K	51.3	Low	63.1	Low	183 Å²	183	106.3 Å²	106.3	80%	0.796	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-26.7	178.9	-75.7	-178.4	175.9	177.7	0	113	K724 L728 A729	K724-K726 PolarHBondContact O-N 3.03Å; K726-L728 VanDerWaalsContact C-N 3.31Å; K726-L728 PolarHBondContact O-N 3.35Å; K726-A729 PolarHBondContact O-N 2.89Å
727	N	51.8	Low	61.3	Low	123 Å²	123	107.8 Å²	107.8	66%	0.658	52%	0.52	S	S	*	.	H	α-helix	trans	-63.6	-27.7	-178	-72.2	-9.7	0	0	0	114.2	C725 A729 F731	C725-N727 PolarHBondContact O-N 3.25Å; N727-A729 VanDerWaalsContact C-N 3.3Å; N727-A729 PolarHBondContact O-N 3.27Å; N727-F731 PolarHBondContact O-N 3.19Å
728	L	51.3	Low	59.7	Low	86 Å²	86	111.4 Å²	111.4	45%	0.45	54%	0.537	S	S	.	.	H	α-helix	trans	-70.4	-26.8	177.3	-124.5	103.7	0	0	0	112.9	C725 K726 R732	C725-L728 PolarHBondContact O-N 3.34Å; K726-L728 VanDerWaalsContact C-N 3.31Å; K726-L728 PolarHBondContact O-N 3.35Å; L728-R732 PolarHBondContact O-N 3.27Å
729	A	45.6	Very low	57.9	Low	67 Å²	67	109.8 Å²	109.8	55%	0.554	53%	0.533	S	S	*	.	H	α-helix	trans	-79.1	-32.9	-179.3	0	0	0	0	0	112.7	K726 N727 K733	K726-A729 PolarHBondContact O-N 2.89Å; N727-A729 VanDerWaalsContact C-N 3.3Å; N727-A729 PolarHBondContact O-N 3.27Å; A729-K733 PolarHBondContact O-N 2.8Å
730	L	47.1	Very low	55.9	Low	109 Å²	109	110.8 Å²	110.8	57%	0.571	54%	0.537	S	S	*	.	H	α-helix	trans	-70.5	-42.6	175.4	-78.4	162.6	0	0	0	111.1	R732 K733 E734	L730-R732 PolarHBondContact O-N 2.98Å; L730-K733 WeakPolarHBondContact O-CA 3.35Å; L730-K733 VanDerWaalsContact O-CB 3.31Å; L730-K733 WeakPolarHBondContact O-CB 3.26Å; L730-K733 PolarHBondContact O-N 2.77Å; L730-E734 PolarHBondContact O-N 3.19Å
731	F	51.2	Low	53.8	Low	105 Å²	105	116.4 Å²	116.4	46%	0.461	56%	0.564	S	S	.	*	H	α-helix	trans	-69.5	-33	178.3	-158	-108.8	0	0	0	113.2	N727 K733 E734 I735	N727-F731 PolarHBondContact O-N 3.19Å; F731-K733 PolarHBondContact O-N 3.38Å; F731-E734 WeakPolarHBondContact CD2-OE2 3.39Å; F731-E734 PolarHBondContact O-N 3.19Å; F731-E734 VanDerWaalsContact O-N 3.11Å; F731-I735 HydrophobicContact CD1-CD1 3.65Å; F731-I735 HydrophobicContact CD1-CG1 4.02Å; F731-I735 HydrophobicContact CE1-CD1 3.58Å; F731-I735 HydrophobicContact CE1-CG1 3.89Å; F731-I735 PolarHBondContact O-N 3.22Å
732	R	54.5	Low	52.2	Low	178 Å²	178	113.1 Å²	113.1	67%	0.672	56%	0.561	S	S	*	*	H	α-helix	trans	-62.8	-29.4	169.7	-98.3	-176.2	175.5	177.4	-0	113.1	L728 L730 K736	L728-R732 PolarHBondContact O-N 3.27Å; L730-R732 PolarHBondContact O-N 2.98Å; R732-K736 WeakPolarHBondContact O-CB 3.28Å; R732-K736 WeakPolarHBondContact O-CG 3.29Å; R732-K736 PolarHBondContact O-N 3.33Å
733	K	48.1	Very low	50.5	Low	145 Å²	145	111.5 Å²	111.5	63%	0.63	56%	0.559	S	S	*	*	H	α-helix	trans	-72.2	-39.4	171.2	-93.2	-177.4	174.5	-178	0	110.8	A729 L730 F731 K736 Q737	A729-K733 PolarHBondContact O-N 2.8Å; L730-K733 WeakPolarHBondContact O-CA 3.35Å; L730-K733 VanDerWaalsContact O-CB 3.31Å; L730-K733 WeakPolarHBondContact O-CB 3.26Å; L730-K733 PolarHBondContact O-N 2.77Å; F731-K733 PolarHBondContact O-N 3.38Å; K733-K736 PolarHBondContact O-N 3.01Å; K733-Q737 WeakPolarHBondContact O-CB 3.22Å; K733-Q737 WeakPolarHBondContact O-CG 3.49Å; K733-Q737 PolarHBondContact O-N 2.71Å
734	E	47.7	Very low	48.9	Very low	96 Å²	96	114.1 Å²	114.1	45%	0.449	58%	0.578	S	S	.	*	H	α-helix	trans	-68.3	-43.1	177.2	-73.3	176.1	163	0	0	112.7	L730 F731 K736 Q737 I738	L730-E734 PolarHBondContact O-N 3.19Å; F731-E734 WeakPolarHBondContact CD2-OE2 3.39Å; F731-E734 PolarHBondContact O-N 3.19Å; F731-E734 VanDerWaalsContact O-N 3.11Å; E734-K736 VanDerWaalsContact C-N 3.32Å; E734-K736 PolarHBondContact O-N 3.16Å; E734-Q737 CarbonylContact O-C 3.53Å; E734-Q737 PolarHBondContact O-N 2.74Å; E734-Q737 VanDerWaalsContact O-N 3.09Å; E734-I738 WeakPolarHBondContact O-CB 3.23Å; E734-I738 VanDerWaalsContact O-CG1 3.25Å; E734-I738 WeakPolarHBondContact O-CG1 3.39Å; E734-I738 PolarHBondContact O-N 3.31Å
735	I	55.3	Low	47.4	Very low	94 Å²	94	110.1 Å²	110.1	48%	0.482	57%	0.571	S	S	.	*	H	α-helix	trans	-63	-39.6	173.6	-65.8	172.7	0	0	0	110.9	F731 Q737 I738 A739	F731-I735 HydrophobicContact CD1-CD1 3.65Å; F731-I735 HydrophobicContact CD1-CG1 4.02Å; F731-I735 HydrophobicContact CE1-CD1 3.58Å; F731-I735 HydrophobicContact CE1-CG1 3.89Å; F731-I735 PolarHBondContact O-N 3.22Å; I735-Q737 VanDerWaalsContact C-N 3.34Å; I735-I738 PolarHBondContact O-N 3.27Å; I735-A739 VanDerWaalsContact O-CB 3.26Å; I735-A739 WeakPolarHBondContact O-CB 3.21Å; I735-A739 PolarHBondContact O-N 3.43Å
736	K	48.3	Very low	45.8	Very low	144 Å²	144	117.2 Å²	117.2	63%	0.626	59%	0.592	S	S	*	*	H	α-helix	trans	-67.3	-34.7	173.1	-81.5	-175.5	175.3	-174.9	0	112.2	R732 K733 E734 M740	R732-K736 WeakPolarHBondContact O-CB 3.28Å; R732-K736 WeakPolarHBondContact O-CG 3.29Å; R732-K736 PolarHBondContact O-N 3.33Å; K733-K736 PolarHBondContact O-N 3.01Å; E734-K736 VanDerWaalsContact C-N 3.32Å; E734-K736 PolarHBondContact O-N 3.16Å; K736-M740 WeakPolarHBondContact O-CB 2.98Å; K736-M740 WeakPolarHBondContact O-CG 3.25Å; K736-M740 PolarHBondContact O-N 2.97Å
737	Q	45.2	Very low	44.9	Very low	110 Å²	110	117.3 Å²	117.3	51%	0.514	59%	0.592	S	S	.	*	H	α-helix	trans	-71.7	-36.4	174.8	-83.6	176.3	-29	0	0	111.7	K733 E734 I735 M740 M741	K733-Q737 WeakPolarHBondContact O-CB 3.22Å; K733-Q737 WeakPolarHBondContact O-CG 3.49Å; K733-Q737 PolarHBondContact O-N 2.71Å; E734-Q737 CarbonylContact O-C 3.53Å; E734-Q737 PolarHBondContact O-N 2.74Å; E734-Q737 VanDerWaalsContact O-N 3.09Å; I735-Q737 VanDerWaalsContact C-N 3.34Å; Q737-M740 CarbonylContact O-C 3.6Å; Q737-M740 PolarHBondContact O-N 2.92Å; Q737-M741 HydrophobicContact CB-SD 4.45Å; Q737-M741 WeakPolarHBondContact O-CA 3.3Å; Q737-M741 WeakPolarHBondContact O-CB 3.46Å; Q737-M741 WeakPolarHBondContact O-CG 3.39Å; Q737-M741 PolarHBondContact O-N 2.93Å
738	I	50.4	Low	43.8	Very low	115 Å²	115	117.9 Å²	117.9	59%	0.59	60%	0.6	S	S	*	*	H	α-helix	trans	-70	-40.2	175	-66.5	163.3	0	0	0	110.1	E734 I735 M740 M741 S742	E734-I738 WeakPolarHBondContact O-CB 3.23Å; E734-I738 VanDerWaalsContact O-CG1 3.25Å; E734-I738 WeakPolarHBondContact O-CG1 3.39Å; E734-I738 PolarHBondContact O-N 3.31Å; I735-I738 PolarHBondContact O-N 3.27Å; I738-M740 VanDerWaalsContact C-N 3.34Å; I738-M740 PolarHBondContact O-N 3.5Å; I738-M741 PolarHBondContact O-N 3.47Å; I738-S742 WeakPolarHBondContact O-CB 3.41Å; I738-S742 PolarHBondContact O-N 3.31Å
739	A	47.1	Very low	42.7	Very low	58 Å²	58	119.4 Å²	119.4	48%	0.479	62%	0.618	S	S	.	*	H	α-helix	trans	-68.6	-28.4	171.7	0	0	0	0	0	113.4	I735	I735-A739 VanDerWaalsContact O-CB 3.26Å; I735-A739 WeakPolarHBondContact O-CB 3.21Å; I735-A739 PolarHBondContact O-N 3.43Å
740	M	40.2	Very low	42	Very low	130 Å²	130	125.2 Å²	125.2	64%	0.64	64%	0.636	S	S	*	*	H	α-helix	trans	-85.4	-29.8	174.6	-76.6	-179.7	174.2	0	0	113	K736 Q737 I738 N743 S744	K736-M740 WeakPolarHBondContact O-CB 2.98Å; K736-M740 WeakPolarHBondContact O-CG 3.25Å; K736-M740 PolarHBondContact O-N 2.97Å; Q737-M740 CarbonylContact O-C 3.6Å; Q737-M740 PolarHBondContact O-N 2.92Å; I738-M740 VanDerWaalsContact C-N 3.34Å; I738-M740 PolarHBondContact O-N 3.5Å; M740-N743 CarbonylContact O-C 3.52Å; M740-N743 PolarHBondContact O-N 3.44Å; M740-S744 VanDerWaalsContact O-CB 3.25Å; M740-S744 WeakPolarHBondContact O-CB 3.18Å; M740-S744 PolarHBondContact O-N 3.01Å
741	M	38.7	Very low	41.1	Very low	129 Å²	129	124.5 Å²	124.5	64%	0.635	65%	0.645	S	S	*	*	H	α-helix	trans	-80.5	-34	178.2	-73.2	171.1	70.6	0	0	111.2	Q737 I738 N743 S744 T745	Q737-M741 HydrophobicContact CB-SD 4.45Å; Q737-M741 WeakPolarHBondContact O-CA 3.3Å; Q737-M741 WeakPolarHBondContact O-CB 3.46Å; Q737-M741 WeakPolarHBondContact O-CG 3.39Å; Q737-M741 PolarHBondContact O-N 2.93Å; I738-M741 PolarHBondContact O-N 3.47Å; M741-N743 PolarHBondContact O-N 2.9Å; M741-S744 PolarHBondContact O-N 3.5Å; M741-S744 VanDerWaalsContact O-N 3.1Å; M741-T745 PolarHBondContact O-N 3.24Å; M741-T745 PolarHBondContact O-OG1 3.41Å; M741-T745 VanDerWaalsContact O-OG1 3.06Å
742	S	43.4	Very low	40.2	Very low	83 Å²	83	126.3 Å²	126.3	58%	0.58	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	-26.5	166.3	-179.9	0	0	0	0	112.4	I738	I738-S742 WeakPolarHBondContact O-CB 3.41Å; I738-S742 PolarHBondContact O-N 3.31Å
743	N	39.4	Very low	39.1	Very low	118 Å²	118	127 Å²	127	63%	0.631	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-6.8	173	-95.4	-25.9	0	0	0	114.8	M740 M741	M740-N743 CarbonylContact O-C 3.52Å; M740-N743 PolarHBondContact O-N 3.44Å; M741-N743 PolarHBondContact O-N 2.9Å
744	S	37.2	Very low	38.3	Very low	80 Å²	80	131.7 Å²	131.7	56%	0.559	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.4	-8.9	-176.3	-155.3	0	0	0	0	114	M740 M741 R746	M740-S744 VanDerWaalsContact O-CB 3.25Å; M740-S744 WeakPolarHBondContact O-CB 3.18Å; M740-S744 PolarHBondContact O-N 3.01Å; M741-S744 PolarHBondContact O-N 3.5Å; M741-S744 VanDerWaalsContact O-N 3.1Å; S744-R746 VanDerWaalsContact C-N 3.32Å
745	T	36.1	Very low	37.7	Very low	121 Å²	121	132.1 Å²	132.1	74%	0.742	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	2.7	166.3	33.7	0	0	0	0	113.8	M741	M741-T745 PolarHBondContact O-N 3.24Å; M741-T745 PolarHBondContact O-OG1 3.41Å; M741-T745 VanDerWaalsContact O-OG1 3.06Å
746	R	33.1	Very low	36.8	Very low	188 Å²	188	134.3 Å²	134.3	71%	0.709	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	17.2	172	-87	-177.6	171.8	171.4	-3.5	114.8	S744	S744-R746 VanDerWaalsContact C-N 3.32Å
747	K	31.9	Very low	35.9	Very low	184 Å²	184	134.2 Å²	134.2	80%	0.8	73%	0.727	S	S	*	*	S	Bend	trans	-127.2	17.3	-179.8	-81.8	-174.7	175.4	176.8	0	115.7
748	V	28.9	Very low	35.4	Very low	135 Å²	135	140.7 Å²	140.7	82%	0.818	75%	0.747	S	S	*	*	S	Bend	trans	-134.8	68.9	176.6	-170.9	0	0	0	0	109.6
749	S	28	Very low	34.4	Very low	119 Å²	119	146 Å²	146	83%	0.832	76%	0.76	S	S	*	*	S	Bend	trans	-164.8	139.8	153.3	-144.6	0	0	0	0	109
750	M	31	Very low	33.7	Very low	188 Å²	188	151.3 Å²	151.3	93%	0.926	78%	0.776	S	S	*	*			trans	78.2	60.6	-171.1	-63.9	-156.7	-80.5	0	0	117.2
751	A	27.4	Very low	33.3	Very low	94 Å²	94	148.8 Å²	148.8	78%	0.777	77%	0.772	S	S	*	*			trans	-94.4	148.6	135.6	0	0	0	0	0	108
752	V	32.1	Very low	33	Very low	143 Å²	143	151.3 Å²	151.3	87%	0.867	78%	0.782	S	S	*	*			trans	92.7	87	176.4	-165.6	0	0	0	0	115.4
753	M	31.4	Very low	32.6	Very low	193 Å²	193	153 Å²	153	95%	0.951	79%	0.789	S	S	*	*				-166.6	148.8	110	-135.5	142.1	163	0	0	110.6
754	R	31	Very low	32.1	Very low	243 Å²	243	156.9 Å²	156.9	92%	0.917	80%	0.795	S	S	*	*			trans	-104.2	175.5	-155.7	-101.8	-167.6	-173.1	176.1	3.2	113
755	P	36.6	Very low	31.9	Very low	106 Å²	106	157.7 Å²	157.7	69%	0.688	79%	0.792	S	S	*	*			trans	-109.9	173.4	-142	42.6	-35.8	0	0	0	114.9
756	T	35.7	Very low	31.6	Very low	139 Å²	139	160.5 Å²	160.5	85%	0.853	79%	0.79	S	S	*	*			trans	-173	110.7	138.4	37	0	0	0	0	112.6
757	D	29.8	Very low	31.6	Very low	143 Å²	143	158.5 Å²	158.5	77%	0.765	79%	0.788	S	S	*	*				38.5	116.2	121.7	-139	-1.1	0	0	0	121.1
758	R	35	Very low	31.4	Very low	246 Å²	246	159.5 Å²	159.5	93%	0.928	79%	0.786	S	S	*	*				-176.5	136	117.6	-101.7	174.3	179.4	-175	0.3	114.7
759	R	28.5	Very low	31.4	Very low	226 Å²	226	160.4 Å²	160.4	85%	0.853	78%	0.782	S	S	*	*			trans	-55.2	154	177.3	-62.2	166.1	173.2	-176	-3.9	116.7
760	M	33.2	Very low	31.5	Very low	169 Å²	169	164.5 Å²	164.5	83%	0.833	79%	0.788	S	S	*	*				169.8	113.2	109	-102.6	172.7	58.6	0	0	110.6
761	S	31.6	Very low	31.6	Very low	78 Å²	78	159.1 Å²	159.1	55%	0.545	78%	0.781	S	S	.	*				89.1	105.8	94.6	71.9	0	0	0	0	113.9
762	E	32.1	Very low	31.5	Very low	182 Å²	182	166.1 Å²	166.1	85%	0.85	79%	0.787	S	S	*	*				87.7	128.4	114.6	-68.5	-175.3	154.8	0	0	112.4
763	V	34.5	Very low	31.5	Very low	119 Å²	119	163.8 Å²	163.8	72%	0.721	78%	0.782	S	S	*	*				-177.3	118.2	66.9	160.7	0	0	0	0	105.8
764	R	29.5	Very low	31.3	Very low	199 Å²	199	165.3 Å²	165.3	75%	0.751	78%	0.778	S	S	*	*				71.4	127.2	107.5	-155.9	173.2	-175.1	-173.4	2.5	113.5
765	N	33	Very low	31.1	Very low	96 Å²	96	165.5 Å²	165.5	51%	0.513	78%	0.778	S	S	.	*			cis	-177.2	143.3	34	-128.2	-3.2	0	0	0	110.2
766	R	28.7	Very low	30.8	Very low	181 Å²	181	165.1 Å²	165.1	68%	0.683	78%	0.784	S	S	*	*				62.2	134.7	129.8	-72.8	173.7	-163.8	-167.2	-2.4	119.5
767	H	34.5	Very low	30.3	Very low	145 Å²	145	165.8 Å²	165.8	67%	0.671	78%	0.783	S	S	*	*			cis	-162.1	133.8	34.2	-102.4	-62.6	0	0	0	108.9
768	R	26.9	Very low	30.2	Very low	205 Å²	205	169.9 Å²	169.9	77%	0.774	79%	0.787	S	S	*	*				60.4	126.1	106.7	-99.2	-165.7	166	164.7	-3.9	113.9
769	E	28.9	Very low	29.8	Very low	154 Å²	154	169 Å²	169	72%	0.72	79%	0.786	S	S	*	*			cis	-166.1	129.9	28.7	-93.6	158.3	176.7	0	0	108.9
770	E	30	Very low	29.7	Very low	206 Å²	206	167 Å²	167	96%	0.963	78%	0.783	S	S	*	*			trans	-141.3	117.1	155.6	-83	-168.2	165.2	0	0	110.7
771	G	32.3	Very low	29.5	Very low	75 Å²	75	164.4 Å²	164.4	77%	0.773	76%	0.764	S	S	*	*			trans	-100.3	116.7	177.7	0	0	0	0	0	112.2
772	R	27.4	Very low	29.1	Very low	241 Å²	241	165.9 Å²	165.9	91%	0.909	77%	0.772	S	S	*	*				32.3	120.7	128.3	-103.6	176.9	177.6	171.7	0.8	119.3
773	A	31.6	Very low	29	Very low	93 Å²	93	165.9 Å²	165.9	77%	0.769	76%	0.764	S	S	*	*				159.7	107.4	110.5	0	0	0	0	0	110.9
774	R	26.8	Very low	28.7	Very low	226 Å²	226	164.7 Å²	164.7	85%	0.853	76%	0.757	S	S	*	*				68.7	119.4	93.1	-80.4	-171	175.5	-175.4	-0.8	117
775	R	27	Very low	28.4	Very low	247 Å²	247	163.4 Å²	163.4	93%	0.932	75%	0.752	S	S	*	*			trans	79.3	136	157.6	-71.1	173.3	163.7	164.4	-6.4	115.4
776	A	29.4	Very low	28.1	Very low	98 Å²	98	163.8 Å²	163.8	81%	0.81	76%	0.761	S	S	*	*			cis	-156.2	148.1	35.7	0	0	0	0	0	114.5
777	D	26.6	Very low	27.9	Very low	153 Å²	153	160.8 Å²	160.8	82%	0.818	76%	0.758	S	S	*	*			trans	-65.2	128.9	166.6	-65.6	-63.7	0	0	0	113.4
778	R	26.5	Very low	27.7	Very low	229 Å²	229	158.7 Å²	158.7	86%	0.864	76%	0.76	S	S	*	*			trans	174.8	149.4	132.3	-107.2	167.2	-110.5	-146.9	-5.6	112.6
779	Y	26.6	Very low	27.8	Very low	227 Å²	227	155.5 Å²	155.5	89%	0.89	76%	0.757	S	S	*	*			trans	85.5	67.8	-179.8	-68.3	-89.3	0	0	0	116.7
780	K	27.1	Very low	27.6	Very low	185 Å²	185	157.1 Å²	157.1	80%	0.804	77%	0.765	S	S	*	*			trans	-94.1	118.1	149.3	-86.8	-177.5	174.5	-179	0	108.3
781	R	28.5	Very low	27.5	Very low	113 Å²	113	152.1 Å²	152.1	43%	0.426	75%	0.753	S	S	.	*			trans	-52.6	145	152.5	-78.1	-175.6	177.8	173.2	1.2	107.4	D463 R783	D463-R781 IonicContact OD1-NH2 3.76Å; D463-R781 IonicContact OD2-CZ 2.7Å; D463-R781 IonicContact OD2-NH2 2.8Å; D463-R781 PolarHBondContact OD2-NH2 2.93Å; R781-R783 PolarHBondContact O-N 3.48Å
782	P	24.2	Very low	27	Very low	110 Å²	110	154.5 Å²	154.5	71%	0.714	75%	0.753	S	S	*	*			trans	-71.3	80.8	170.2	31.4	-29.7	0	0	0	107.6	V784	P782-V784 PolarHBondContact O-N 3.4Å
783	R	30	Very low	27.1	Very low	181 Å²	181	151 Å²	151	68%	0.683	75%	0.751	S	S	*	*			trans	-56.2	128.9	155.4	-78	-173.2	173.8	164.8	3.1	105.2	D513 R781 R785	D513-R783 IonicContact OD1-CZ 3.03Å; D513-R783 IonicContact OD1-NH2 2.67Å; D513-R783 PolarHBondContact OD1-NH2 3.11Å; R781-R783 PolarHBondContact O-N 3.48Å; R783-R785 PolarHBondContact O-N 3.17Å
784	V	27.4	Very low	26.8	Very low	94 Å²	94	153.6 Å²	153.6	57%	0.57	75%	0.752	S	S	*	*			trans	-65.1	81.9	164.6	179.1	0	0	0	0	105.6	P782 C786	P782-V784 PolarHBondContact O-N 3.4Å; V784-C786 PolarHBondContact O-N 3.12Å
785	R	23.8	Very low	26.9	Very low	173 Å²	173	148.2 Å²	148.2	65%	0.653	75%	0.749	S	S	*	*			trans	-85.5	107.5	172.9	-155.5	173.7	-165.7	-155.8	7.6	104.9	R783 D787	R783-R785 PolarHBondContact O-N 3.17Å; R785-D787 WeakPolarHBondContact CD-OD1 3.16Å; R785-D787 WeakPolarHBondContact CG-OD1 3.17Å; R785-D787 IonicContact CZ-OD1 3.09Å; R785-D787 IonicContact NE-OD1 2.75Å; R785-D787 IonicContact NH1-OD1 2.67Å; R785-D787 PolarHBondContact O-N 3.18Å
786	C	25.5	Very low	27	Very low	103 Å²	103	145.7 Å²	145.7	70%	0.696	75%	0.748	S	S	*	*			trans	-63.9	84.6	158.1	-84.8	0	0	0	0	107.1	V784 S788	V784-C786 PolarHBondContact O-N 3.12Å; C786-S788 VanDerWaalsContact C-N 3.32Å; C786-S788 PolarHBondContact O-N 3.5Å
787	D	25.7	Very low	26.8	Very low	118 Å²	118	147.4 Å²	147.4	63%	0.631	75%	0.749	S	S	*	*			trans	-72.7	90.3	168.7	-78.7	-28.3	0	0	0	107.4	R785	R785-D787 WeakPolarHBondContact CD-OD1 3.16Å; R785-D787 WeakPolarHBondContact CG-OD1 3.17Å; R785-D787 IonicContact CZ-OD1 3.09Å; R785-D787 IonicContact NE-OD1 2.75Å; R785-D787 IonicContact NH1-OD1 2.67Å; R785-D787 PolarHBondContact O-N 3.18Å
788	S	29.7	Very low	27	Very low	101 Å²	101	146.7 Å²	146.7	71%	0.706	75%	0.75	S	S	*	*			trans	-81.2	111	165.5	42.8	0	0	0	0	109.2	C786 E790	C786-S788 VanDerWaalsContact C-N 3.32Å; C786-S788 PolarHBondContact O-N 3.5Å; S788-E790 PolarHBondContact O-N 3.12Å
789	L	28.1	Very low	27	Very low	138 Å²	138	143.9 Å²	143.9	72%	0.723	75%	0.752	S	S	*	*			trans	-63.6	120.9	162.7	-104.7	98.8	0	0	0	109	S791	L789-S791 PolarHBondContact O-N 2.75Å
790	E	24.6	Very low	27.2	Very low	189 Å²	189	136.9 Å²	136.9	88%	0.883	75%	0.749	S	S	*	*			trans	-58.4	125.2	158.4	-71.4	170.6	146.1	0	0	109.5	S788	S788-E790 PolarHBondContact O-N 3.12Å
791	S	28	Very low	27.3	Very low	101 Å²	101	133.8 Å²	133.8	71%	0.706	75%	0.751	S	S	*	*			trans	-131	99.4	154.9	63.3	0	0	0	0	108.3	L789 L793	L789-S791 PolarHBondContact O-N 2.75Å; S791-L793 PolarHBondContact O-N 3.37Å
792	T	23.3	Very low	27.6	Very low	125 Å²	125	134 Å²	134	77%	0.767	77%	0.766	S	S	*	*			trans	-38.2	125.3	154.5	43.1	0	0	0	0	111.7
793	L	28.6	Very low	27.8	Very low	166 Å²	166	135.6 Å²	135.6	87%	0.869	77%	0.774	S	S	*	*			trans	-136.4	107.9	154.7	-106.7	151	0	0	0	107	S791	S791-L793 PolarHBondContact O-N 3.37Å
794	D	24.7	Very low	27.7	Very low	149 Å²	149	134.9 Å²	134.9	80%	0.797	78%	0.784	S	S	*	*			trans	-61.4	135.7	173.6	-58.2	-58.1	0	0	0	111
795	S	29.1	Very low	27.7	Very low	113 Å²	113	135.1 Å²	135.1	79%	0.79	80%	0.796	S	S	*	*			trans	-152	91.6	147	63.3	0	0	0	0	109.6
796	E	29.2	Very low	27.9	Very low	193 Å²	193	134.3 Å²	134.3	90%	0.902	81%	0.805	S	S	*	*			trans	32.9	112.5	143.9	-66.3	179.9	145.6	0	0	119.8
797	T	25	Very low	28.3	Very low	135 Å²	135	134.2 Å²	134.2	83%	0.828	80%	0.803	S	S	*	*			trans	-62.6	136.7	156.7	44.8	0	0	0	0	113.3
798	T	30.8	Very low	28.3	Very low	138 Å²	138	138 Å²	138	85%	0.847	81%	0.814	S	S	*	*			trans	-144.4	108.1	142.1	42.5	0	0	0	0	110.8
799	D	28.1	Very low	28.2	Very low	170 Å²	170	139.7 Å²	139.7	91%	0.909	81%	0.814	S	S	*	*			trans	30.4	128.4	140.9	-70.9	-22	0	0	0	122.3
800	G	30.2	Very low	28.2	Very low	80 Å²	80	142.7 Å²	142.7	83%	0.825	82%	0.817	S	S	*	*			trans	166.4	102.7	156	0	0	0	0	0	114.6
801	S	29.7	Very low	28.5	Very low	120 Å²	120	140.7 Å²	140.7	84%	0.839	81%	0.811	S	S	*	*			trans	-66.3	170.2	-173.9	58.8	0	0	0	0	116.8
802	P	33.5	Very low	28.5	Very low	116 Å²	116	140.2 Å²	140.2	75%	0.753	81%	0.807	S	S	*	*			trans	-101	156.1	-152.6	39.1	-32.6	0	0	0	114.6
803	T	29.3	Very low	28.9	Very low	144 Å²	144	142 Å²	142	88%	0.883	81%	0.813	S	S	*	*			trans	-155	135	159	47.2	0	0	0	0	112.5
804	D	27.9	Very low	28.9	Very low	166 Å²	166	139.5 Å²	139.5	89%	0.888	81%	0.809	S	S	*	*			trans	-43.6	139.6	171.4	-66.8	-54.4	0	0	0	115.4
805	A	27.7	Very low	29.2	Very low	99 Å²	99	137 Å²	137	82%	0.818	81%	0.809	S	S	*	*			trans	-179.5	120.2	139.7	0	0	0	0	0	111.4
806	D	28	Very low	29.1	Very low	156 Å²	156	138.6 Å²	138.6	83%	0.834	81%	0.814	S	S	*	*			trans	-48.2	172	145.7	-85.4	-32.9	0	0	0	111.1
807	P	33.7	Very low	29.2	Very low	102 Å²	102	136.8 Å²	136.8	66%	0.662	81%	0.809	S	S	*	*			cis	-137.2	-172.1	-15.7	33.2	-10.5	0	0	0	113.3
808	K	25.3	Very low	29.4	Very low	197 Å²	197	139.8 Å²	139.8	86%	0.857	81%	0.814	S	S	*	*			trans	64.5	118.9	150.2	-76.1	170.9	-177.4	178.1	0	121
809	L	27.1	Very low	29.3	Very low	137 Å²	137	139 Å²	139	72%	0.717	81%	0.809	S	S	*	*			trans	46.4	120.8	133.9	-146	83.9	0	0	0	119
810	Y	27.4	Very low	29.5	Very low	201 Å²	201	136.6 Å²	136.6	79%	0.788	80%	0.803	S	S	*	*				172.2	131.9	118.6	-95.5	-75.2	0	0	0	112.3
811	I	30.8	Very low	29.4	Very low	147 Å²	147	139.6 Å²	139.6	75%	0.754	81%	0.805	S	S	*	*			trans	-23	142.5	146.8	-61.8	154.5	0	0	0	112.4
812	S	29.3	Very low	29.8	Very low	90 Å²	90	140.5 Å²	140.5	63%	0.629	80%	0.799	S	S	*	*			cis	-169.7	153.3	41.1	36.9	0	0	0	0	108.8
813	D	30.7	Very low	29.7	Very low	164 Å²	164	142.7 Å²	142.7	88%	0.877	80%	0.797	S	S	*	*				-159.8	150.3	125.2	-107.9	-19.6	0	0	0	113.2
814	S	28.6	Very low	29.7	Very low	112 Å²	112	144.2 Å²	144.2	78%	0.783	80%	0.796	S	S	*	*			trans	-100.8	129.8	-152.7	-46.7	0	0	0	0	111.4
815	A	31.4	Very low	30.1	Very low	98 Å²	98	139.3 Å²	139.3	81%	0.81	79%	0.785	S	S	*	*			trans	-136.4	111.3	158.1	0	0	0	0	0	108.9	I817	A815-I817 PolarHBondContact O-N 2.95Å
816	T	26.5	Very low	30.4	Very low	145 Å²	145	140.4 Å²	140.4	89%	0.89	78%	0.777	S	S	*	*			trans	-59.9	112.5	-177.3	26.7	0	0	0	0	112.8
817	I	32.1	Very low	30.8	Very low	156 Å²	156	138.9 Å²	138.9	80%	0.8	77%	0.766	S	S	*	*			trans	-132.4	123.3	154.9	-61.2	-179.9	0	0	0	106.5	A815 T819	A815-I817 PolarHBondContact O-N 2.95Å; I817-T819 PolarHBondContact O-N 3.48Å; I817-T819 VanDerWaalsContact O-N 3.12Å
818	E	28.8	Very low	31	Very low	198 Å²	198	142.3 Å²	142.3	93%	0.925	77%	0.773	S	S	*	*			trans	-65.2	102.9	-173.2	-63.2	175.8	160.6	0	0	111.7
819	T	28.4	Very low	31.9	Very low	122 Å²	122	141.2 Å²	141.2	75%	0.748	77%	0.771	S	S	*	*			trans	-98.1	137.3	163.8	34.1	0	0	0	0	110.5	I817 T821	I817-T819 PolarHBondContact O-N 3.48Å; I817-T819 VanDerWaalsContact O-N 3.12Å; T819-T821 PolarHBondContact O-N 3.45Å
820	P	33.1	Very low	33.2	Very low	119 Å²	119	140.9 Å²	140.9	77%	0.773	77%	0.766	S	S	*	*			trans	-67.2	124.3	-177	28.2	-31.9	0	0	0	110.2	I822	P820-I822 PolarHBondContact O-N 3.47Å
821	T	28.8	Very low	35.3	Very low	143 Å²	143	138.3 Å²	138.3	88%	0.877	76%	0.761	S	S	*	*			trans	-64.4	100.7	174.6	24.3	0	0	0	0	110.6	T819	T819-T821 PolarHBondContact O-N 3.45Å
822	I	36.6	Very low	37.7	Very low	139 Å²	139	134.1 Å²	134.1	71%	0.713	74%	0.739	S	S	*	*			trans	-72	126.1	162.3	-61.1	176.4	0	0	0	107.4	P820 M824	P820-I822 PolarHBondContact O-N 3.47Å; I822-M824 PolarHBondContact O-N 3.28Å
823	K	32.9	Very low	40.4	Very low	162 Å²	162	135.3 Å²	135.3	70%	0.704	73%	0.733	S	S	*	*			trans	-60.4	127.1	180	-70.5	175.5	177.6	174.4	0	110.1	G825 D826	K823-G825 PolarHBondContact O-N 2.84Å; K823-D826 PolarHBondContact O-N 2.82Å
824	M	29.6	Very low	43.3	Very low	176 Å²	176	128.9 Å²	128.9	87%	0.867	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.9	-5.7	176.2	-99	166.2	145.2	0	0	115.5	I822	I822-M824 PolarHBondContact O-N 3.28Å
825	G	35.4	Very low	46.2	Very low	63 Å²	63	123.6 Å²	123.6	65%	0.649	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	-8.7	-179.8	0	0	0	0	0	115.9	K823	K823-G825 PolarHBondContact O-N 2.84Å
826	D	34.6	Very low	49	Very low	122 Å²	122	119.8 Å²	119.8	65%	0.652	63%	0.627	S	S	*	*	S	Bend	trans	-103.1	2.2	-176.9	-65.7	-36.4	0	0	0	113.4	K823	K823-D826 PolarHBondContact O-N 2.82Å
827	M	35.9	Very low	51.9	Low	124 Å²	124	113 Å²	113	61%	0.611	59%	0.586	S	S	*	*	S	Bend	trans	-86.8	-13	-176.1	-65.8	-159	-57.7	0	0	114.6	H829	M827-H829 VanDerWaalsContact C-N 3.26Å; M827-H829 PolarHBondContact O-N 2.75Å
828	E	37	Very low	54.6	Low	173 Å²	173	105.7 Å²	105.7	81%	0.808	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	0.4	-172.9	-74.3	-173.7	158.7	0	0	114.7
829	H	44.7	Very low	57.5	Low	174 Å²	174	96.8 Å²	96.8	81%	0.806	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.7	10.7	-175.1	-78.6	35.6	0	0	0	115.4	M827 E831	M827-H829 VanDerWaalsContact C-N 3.26Å; M827-H829 PolarHBondContact O-N 2.75Å; H829-E831 PolarHBondContact O-N 3.19Å
830	Q	55.5	Low	60.5	Low	131 Å²	131	91 Å²	91	61%	0.612	47%	0.472	S	S	*	.			trans	-90.2	101.2	170.5	-82.1	-173.9	2.5	0	0	110.9	F1104	Q830-F1104 HydrophobicContact CB-CD1 4.26Å; Q830-F1104 HydrophobicContact CB-CE1 4.41Å
831	E	70.8	Confident	63.4	Low	147 Å²	147	85.5 Å²	85.5	69%	0.687	44%	0.436	S	S	*	.			trans	-65.7	134.6	172.8	-65.3	175.9	161.9	0	0	111.3	H829 K833	H829-E831 PolarHBondContact O-N 3.19Å; E831-K833 HydrophobicContact CB-CG 4.43Å; E831-K833 PolarHBondContact O-N 2.95Å; E831-K833 WeakPolarHBondContact OE2-CE 3.35Å; E831-K833 IonicContact OE2-NZ 2.93Å
832	I	81.3	Confident	66.5	Low	59 Å²	59	80.5 Å²	80.5	30%	0.303	40%	0.401	S	S	.	.			trans	-72.3	109.4	172.9	-60.7	173.3	0	0	0	108.5	W842 F1104	I832-W842 HydrophobicContact CB-CE3 4.21Å; I832-W842 HydrophobicContact CB-CZ3 3.92Å; I832-W842 HydrophobicContact CG2-CD2 4.31Å; I832-W842 HydrophobicContact CG2-CE3 3.53Å; I832-W842 HydrophobicContact CG2-CH2 4.43Å; I832-W842 HydrophobicContact CG2-CZ3 3.6Å; I832-F1104 HydrophobicContact CG1-CD1 4.44Å; I832-F1104 HydrophobicContact CG1-CE1 4.34Å
833	K	86.4	Confident	69.1	Low	115 Å²	115	74.8 Å²	74.8	50%	0.5	37%	0.373	S	S	.	.			trans	-109.2	-20.5	-175.8	-67.6	-179.5	-176.1	-175.7	0	114.3	E831 W842	E831-K833 HydrophobicContact CB-CG 4.43Å; E831-K833 PolarHBondContact O-N 2.95Å; E831-K833 WeakPolarHBondContact OE2-CE 3.35Å; E831-K833 IonicContact OE2-NZ 2.93Å; K833-W842 PolarHBondContact O-N 3.21Å
834	Y	90.7	Very high	71.9	Confident	28 Å²	28	71 Å²	71	11%	0.11	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	161.8	-175.5	-59.4	-75.8	0	0	0	110.3	F840 H841 W842 D1103 S1105 L1110 R1113	Y834-F840 WeakPolarHBondContact CA-O 3.31Å; Y834-H841 AromaticContact CE1-CE1 3.68Å; Y834-H841 AromaticContact CE1-ND1 3.81Å; Y834-W842 VanDerWaalsContact C-CB 3.48Å; Y834-D1103 PolarHBondContact O-N 2.89Å; Y834-S1105 WeakPolarHBondContact CD2-OG 3.31Å; Y834-L1110 HydrophobicContact CD2-CD2 4.34Å; Y834-L1110 HydrophobicContact CE2-CD2 3.99Å; Y834-R1113 PolarHBondContact OH-NE 3.43Å; Y834-R1113 PolarHBondContact OH-NH2 2.91Å; Y834-R1113 VanDerWaalsContact OH-NH2 3.12Å
835	D	90.6	Very high	74.8	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.005	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	171.3	172.7	80.3	-62.6	0	0	0	111.7	T837 G838 M839 F840 L1100 R1101	D835-T837 PolarHBondContact O-N 2.99Å; D835-T837 VanDerWaalsContact O-N 3.12Å; D835-T837 WeakPolarHBondContact OD2-CB 3.38Å; D835-T837 PolarHBondContact OD2-N 3.25Å; D835-T837 PolarHBondContact OD2-OG1 3.41Å; D835-G838 PolarHBondContact O-N 2.81Å; D835-G838 PolarHBondContact OD1-N 3.38Å; D835-M839 PolarHBondContact OD1-N 3.13Å; D835-F840 PolarHBondContact N-O 3.45Å; D835-F840 VanDerWaalsContact N-O 3.11Å; D835-F840 PolarHBondContact OD1-N 3.36Å; D835-L1100 HydrophobicContact CB-CD1 3.68Å; D835-L1100 HydrophobicContact CB-CD2 4.06Å; D835-L1100 HydrophobicContact CB-CG 3.78Å; D835-R1101 CarbonylContact C-O 3.51Å; D835-R1101 VanDerWaalsContact CA-O 3.23Å; D835-R1101 WeakPolarHBondContact CA-O 3.5Å
836	S	88.5	Confident	77.4	Confident	18 Å²	18	67 Å²	67	13%	0.126	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-21.4	-178.4	56.3	0	0	0	0	114.3	R1101 R1109	S836-R1101 PolarHBondContact N-O 3.08Å; S836-R1109 PolarHBondContact O-NE 3.04Å; S836-R1109 PolarHBondContact O-NH2 2.83Å
837	T	87.6	Confident	80.2	Confident	3 Å²	3	63.9 Å²	63.9	2%	0.018	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-14.4	175.7	70.8	0	0	0	0	113.1	D835 M839 E1089 L1090 I1093 N1112	D835-T837 PolarHBondContact O-N 2.99Å; D835-T837 VanDerWaalsContact O-N 3.12Å; D835-T837 WeakPolarHBondContact OD2-CB 3.38Å; D835-T837 PolarHBondContact OD2-N 3.25Å; D835-T837 PolarHBondContact OD2-OG1 3.41Å; T837-M839 PolarHBondContact O-N 3Å; T837-M839 WeakPolarHBondContact OG1-CB 3.33Å; T837-M839 WeakPolarHBondContact OG1-CG 3.3Å; T837-M839 PolarHBondContact OG1-N 3.4Å; T837-E1089 HydrophobicContact CG2-CG 4.39Å; T837-L1090 HydrophobicContact CG2-CB 4.22Å; T837-L1090 HydrophobicContact CG2-CD1 4.32Å; T837-I1093 HydrophobicContact CG2-CD1 3.85Å; T837-N1112 PolarHBondContact O-ND2 3.14Å
838	G	88.5	Confident	82.9	Confident	3 Å²	3	58.6 Å²	58.6	3%	0.031	29%	0.292	C	S	.	.	S	Bend	trans	73.6	12.5	-173.7	0	0	0	0	0	114.2	D835 S892	D835-G838 PolarHBondContact O-N 2.81Å; D835-G838 PolarHBondContact OD1-N 3.38Å; G838-S892 WeakPolarHBondContact O-CB 3.44Å; G838-S892 PolarHBondContact O-OG 2.97Å
839	M	89.8	Confident	85.6	Confident	10 Å²	10	56.6 Å²	56.6	5%	0.049	28%	0.283	C	S	.	.	S	Bend	trans	-90.4	-23.8	-174.4	-58.4	-63.1	-80.1	0	0	113	D835 T837 S892 G1085 T1087 N1112 R1115	D835-M839 PolarHBondContact OD1-N 3.13Å; T837-M839 PolarHBondContact O-N 3Å; T837-M839 WeakPolarHBondContact OG1-CB 3.33Å; T837-M839 WeakPolarHBondContact OG1-CG 3.3Å; T837-M839 PolarHBondContact OG1-N 3.4Å; M839-S892 WeakPolarHBondContact CA-OG 3.13Å; M839-S892 WeakPolarHBondContact O-CB 3.15Å; M839-S892 PolarHBondContact O-N 3.01Å; M839-S892 PolarHBondContact O-OG 3.08Å; M839-G1085 WeakPolarHBondContact CE-O 3.22Å; M839-T1087 HydrophobicContact CE-CG2 3.91Å; M839-N1112 HydrophobicContact SD-CB 3.75Å; M839-R1115 VanDerWaalsContact CE-NH1 3.33Å; M839-R1115 PolarHBondContact O-NH2 2.84Å; M839-R1115 PolarHBondContact SD-NH1 2.59Å
840	F	93.3	Very high	87.8	Confident	1 Å²	1	55 Å²	55	0%	0.004	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-135.1	151.3	-175.4	-61.6	-80.2	0	0	0	112.2	Y834 D835 M887 R890 A891 L1090 L1100	Y834-F840 WeakPolarHBondContact CA-O 3.31Å; D835-F840 PolarHBondContact N-O 3.45Å; D835-F840 VanDerWaalsContact N-O 3.11Å; D835-F840 PolarHBondContact OD1-N 3.36Å; F840-M887 HydrophobicContact CD1-CB 4.28Å; F840-M887 WeakPolarHBondContact CD1-O 3.21Å; F840-M887 HydrophobicContact CE1-CB 3.93Å; F840-M887 WeakPolarHBondContact CE1-O 3.41Å; F840-M887 HydrophobicContact CZ-CB 4.43Å; F840-R890 WeakPolarHBondContact CA-O 3.48Å; F840-A891 HydrophobicContact CD1-CB 4.4Å; F840-A891 HydrophobicContact CE1-CB 4.32Å; F840-L1090 HydrophobicContact CD2-CD2 3.85Å; F840-L1090 HydrophobicContact CE2-CD2 3.36Å; F840-L1090 HydrophobicContact CZ-CD2 4.4Å; F840-L1100 HydrophobicContact CB-CD2 4.48Å
841	H	93.3	Very high	89.6	Confident	3 Å²	3	48.9 Å²	48.9	1%	0.014	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-70.1	137	169.2	-73.8	-96.7	0	0	0	110.3	Y834 R890 A891 F894 Y896 L899 P922	Y834-H841 AromaticContact CE1-CE1 3.68Å; Y834-H841 AromaticContact CE1-ND1 3.81Å; H841-R890 PolarHBondContact CD2-O 3.05Å; H841-R890 PolarHBondContact N-O 3.34Å; H841-A891 PolarHBondContact CD2-O 2.92Å; H841-F894 PolarHBondContact NE2-O 2.91Å; H841-Y896 AromaticContact ND1-CD2 3.73Å; H841-L899 HydrophobicContact CB-CD1 4.25Å; H841-P922 HydrophobicContact CB-CG 4.02Å
842	W	93.6	Very high	90.7	Very high	39 Å²	39	43.1 Å²	43.1	15%	0.148	22%	0.223	C	C	.	.			trans	-127	146.8	-175.8	-177.3	93.9	0	0	0	110.9	I832 K833 Y834 P844 N920 L1100	I832-W842 HydrophobicContact CB-CE3 4.21Å; I832-W842 HydrophobicContact CB-CZ3 3.92Å; I832-W842 HydrophobicContact CG2-CD2 4.31Å; I832-W842 HydrophobicContact CG2-CE3 3.53Å; I832-W842 HydrophobicContact CG2-CH2 4.43Å; I832-W842 HydrophobicContact CG2-CZ3 3.6Å; K833-W842 PolarHBondContact O-N 3.21Å; Y834-W842 VanDerWaalsContact C-CB 3.48Å; W842-P844 HydrophobicContact CH2-CB 4.44Å; W842-P844 HydrophobicContact CH2-CG 4.3Å; W842-P844 HydrophobicContact CZ3-CG 4.1Å; W842-N920 PolarHBondContact NE1-ND2 3.19Å; W842-L1100 PolarHBondContact NE1-O 3.04Å
843	C	91.6	Very high	91.2	Very high	19 Å²	19	41.6 Å²	41.6	13%	0.128	22%	0.215	C	C	.	.			trans	-133.2	159	168.6	71.4	0	0	0	0	111.5	N920 L921 P922	C843-N920 PolarHBondContact N-O 3.43Å; C843-N920 WeakPolarHBondContact O-CA 3.13Å; C843-N920 PolarHBondContact O-ND2 3.15Å; C843-N920 PolarHBondContact SG-O 3.09Å; C843-L921 VanDerWaalsContact SG-C 3.58Å; C843-P922 HydrophobicContact CB-CB 4.48Å
844	P	90.5	Very high	91.4	Very high	83 Å²	83	40.8 Å²	40.8	54%	0.539	22%	0.216	S	C	.	.			trans	-53.2	149.7	168.8	-25.1	34.6	0	0	0	111.6	W842 R846	W842-P844 HydrophobicContact CH2-CB 4.44Å; W842-P844 HydrophobicContact CH2-CG 4.3Å; W842-P844 HydrophobicContact CZ3-CG 4.1Å; P844-R846 PolarHBondContact O-N 3.38Å
845	P	90.6	Very high	91.4	Very high	85 Å²	85	45 Å²	45	55%	0.552	23%	0.232	S	C	*	.			trans	-60.7	125.7	-179.6	25.7	-34.6	0	0	0	111.3	Y919	P845-Y919 HydrophobicContact CB-CD2 3.47Å; P845-Y919 VanDerWaalsContact CB-CD2 3.47Å; P845-Y919 HydrophobicContact CB-CE2 3.85Å; P845-Y919 HydrophobicContact CB-CG 4.3Å
846	R	91.2	Very high	91.4	Very high	68 Å²	68	51 Å²	51	26%	0.257	26%	0.264	S	S	.	.			trans	-106	135.1	178.2	-63.2	-177.6	-68.8	150	7	111.5	P844 C851 W915 Y919 L921	P844-R846 PolarHBondContact O-N 3.38Å; R846-C851 PolarHBondContact NH1-SG 3.48Å; R846-W915 PolarHBondContact O-NE1 3.41Å; R846-Y919 PolarHBondContact N-O 3.29Å; R846-L921 PolarHBondContact NH2-O 2.91Å
847	P	93	Very high	91.6	Very high	58 Å²	58	54.5 Å²	54.5	38%	0.377	28%	0.278	S	S	.	.			trans	-62.7	149.5	170	29.4	-34.4	0	0	0	110.1	E849 E850	P847-E849 PolarHBondContact O-N 2.98Å; P847-E850 HydrophobicContact CG-CB 4.3Å; P847-E850 VanDerWaalsContact CG-CD 3.41Å; P847-E850 HydrophobicContact CG-CG 3.75Å; P847-E850 VanDerWaalsContact CG-OE1 3.28Å; P847-E850 WeakPolarHBondContact CG-OE1 3.23Å; P847-E850 PolarHBondContact O-N 2.81Å
848	I	93.2	Very high	91.7	Very high	12 Å²	12	54.4 Å²	54.4	6%	0.062	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-64.7	-34.4	-174.4	-169.8	173.2	0	0	0	111.2	E850 C851 V852 L911 K912 W915 I926	I848-E850 PolarHBondContact O-N 2.71Å; I848-C851 PolarHBondContact O-N 3.48Å; I848-V852 HydrophobicContact CG1-CG2 4.29Å; I848-V852 WeakPolarHBondContact O-CG2 3.43Å; I848-V852 PolarHBondContact O-N 3.35Å; I848-L911 HydrophobicContact CD1-CB 4.4Å; I848-K912 HydrophobicContact CD1-CG 3.91Å; I848-W915 HydrophobicContact CB-CD2 4.16Å; I848-W915 HydrophobicContact CB-CG 3.93Å; I848-W915 HydrophobicContact CD1-CB 4.06Å; I848-W915 HydrophobicContact CD1-CD2 4.37Å; I848-W915 HydrophobicContact CD1-CG 4.11Å; I848-W915 HydrophobicContact CG1-CD2 3.98Å; I848-W915 HydrophobicContact CG1-CE3 4.39Å; I848-W915 HydrophobicContact CG1-CG 4.03Å; I848-I926 HydrophobicContact CD1-CD1 4.04Å; I848-I926 HydrophobicContact CG1-CD1 3.86Å
849	E	92.4	Very high	91.6	Very high	132 Å²	132	61.3 Å²	61.3	62%	0.617	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-60.3	-31.9	-177.2	-64.1	73.6	-160.5	0	0	112.7	P847 C851 V852	P847-E849 PolarHBondContact O-N 2.98Å; E849-C851 VanDerWaalsContact C-N 3.25Å; E849-C851 PolarHBondContact O-N 2.92Å; E849-V852 PolarHBondContact O-N 3.39Å
850	E	92.1	Very high	91.4	Very high	139 Å²	139	68.5 Å²	68.5	65%	0.65	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-71.1	-21.8	176	-75.8	175.5	-163.5	0	0	113.1	P847 I848	P847-E850 HydrophobicContact CG-CB 4.3Å; P847-E850 VanDerWaalsContact CG-CD 3.41Å; P847-E850 HydrophobicContact CG-CG 3.75Å; P847-E850 VanDerWaalsContact CG-OE1 3.28Å; P847-E850 WeakPolarHBondContact CG-OE1 3.23Å; P847-E850 PolarHBondContact O-N 2.81Å; I848-E850 PolarHBondContact O-N 2.71Å
851	C	92.8	Very high	91	Very high	3 Å²	3	70.9 Å²	70.9	2%	0.02	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-12	-178.5	-61.4	0	0	0	0	112.4	R846 I848 E849 W915 S925 I926	R846-C851 PolarHBondContact NH1-SG 3.48Å; I848-C851 PolarHBondContact O-N 3.48Å; E849-C851 VanDerWaalsContact C-N 3.25Å; E849-C851 PolarHBondContact O-N 2.92Å; C851-W915 HydrophobicContact CB-CH2 3.66Å; C851-W915 HydrophobicContact CB-CZ2 3.97Å; C851-W915 VanDerWaalsContact SG-CH2 3.51Å; C851-W915 WeakPolarHBondContact SG-CZ2 3.39Å; C851-S925 CarbonylContact O-C 3.34Å; C851-S925 WeakPolarHBondContact O-CA 3.46Å; C851-I926 PolarHBondContact O-N 3.32Å
852	V	94	Very high	90.4	Very high	27 Å²	27	77.4 Å²	77.4	16%	0.164	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	127.4	179	176.4	0	0	0	0	109.6	I848 E849 I908 I926	I848-V852 HydrophobicContact CG1-CG2 4.29Å; I848-V852 WeakPolarHBondContact O-CG2 3.43Å; I848-V852 PolarHBondContact O-N 3.35Å; E849-V852 PolarHBondContact O-N 3.39Å; V852-I908 HydrophobicContact CG1-CD1 4.28Å; V852-I908 HydrophobicContact CG2-CD1 3.71Å; V852-I908 HydrophobicContact CG2-CG1 4.49Å; V852-I926 CarbonylContact C-O 3.42Å; V852-I926 WeakPolarHBondContact CA-O 3.42Å; V852-I926 HydrophobicContact CG2-CB 4.2Å; V852-I926 HydrophobicContact CG2-CG2 4.31Å
853	L	91.9	Very high	89.7	Confident	27 Å²	27	76.1 Å²	76.1	14%	0.141	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	135.2	177.1	-58.8	177.5	0	0	0	109.5	Q857 A858 I926 L927	L853-Q857 HydrophobicContact CB-CB 4.39Å; L853-Q857 HydrophobicContact CD2-CB 4.41Å; L853-A858 HydrophobicContact CB-CB 4.4Å; L853-I926 PolarHBondContact N-O 3.11Å; L853-L927 VanDerWaalsContact O-CD1 3.26Å; L853-L927 WeakPolarHBondContact O-CD1 3.35Å
854	D	90.4	Very high	89.4	Confident	97 Å²	97	77.8 Å²	77.8	52%	0.519	40%	0.4	S	S	.	.			trans	-72	157.9	164	-70	-33.7	0	0	0	110.7	N856 Q857 A858	D854-N856 PolarHBondContact O-N 3.49Å; D854-N856 VanDerWaalsContact O-N 3.1Å; D854-Q857 HydrophobicContact CB-CB 4.42Å; D854-Q857 HydrophobicContact CB-CG 4.12Å; D854-Q857 CarbonylContact O-C 3.59Å; D854-Q857 WeakPolarHBondContact O-CA 3.33Å; D854-Q857 WeakPolarHBondContact O-CB 3.49Å; D854-Q857 PolarHBondContact O-N 2.71Å; D854-A858 PolarHBondContact O-N 3.3Å
855	R	91.3	Very high	89.1	Confident	118 Å²	118	74.9 Å²	74.9	45%	0.445	39%	0.385	S	S	.	.	H	α-helix	trans	-51.3	-39.6	177.1	-170.2	-175.3	-68.9	159.6	-0.3	113.2	K859 D936 A939	R855-K859 WeakPolarHBondContact O-CB 3.33Å; R855-K859 PolarHBondContact O-N 3.4Å; R855-K859 VanDerWaalsContact O-N 3.09Å; R855-D936 IonicContact CZ-OD1 3.89Å; R855-D936 IonicContact NE-OD1 3.51Å; R855-D936 PolarHBondContact NE-OD1 2.78Å; R855-D936 IonicContact NH2-OD1 3.96Å; R855-D936 PolarHBondContact NH2-OD1 3.17Å; R855-D936 IonicContact NH2-OD2 3.9Å; R855-D936 PolarHBondContact NH2-OD2 3.5Å; R855-A939 HydrophobicContact CG-CB 3.5Å; R855-A939 VanDerWaalsContact CG-CB 3.5Å
856	N	90.9	Very high	89.3	Confident	127 Å²	127	70.9 Å²	70.9	68%	0.679	36%	0.359	S	S	*	.	H	α-helix	trans	-70.9	-38.6	177.6	-69.7	-28.7	0	0	0	112	D854 K859 M860	D854-N856 PolarHBondContact O-N 3.49Å; D854-N856 VanDerWaalsContact O-N 3.1Å; N856-K859 PolarHBondContact O-N 2.92Å; N856-M860 VanDerWaalsContact O-CG 3.26Å; N856-M860 WeakPolarHBondContact O-CG 3.24Å; N856-M860 PolarHBondContact O-N 2.89Å; N856-M860 VanDerWaalsContact O-N 3.09Å
857	Q	91.5	Very high	89.5	Confident	91 Å²	91	67.7 Å²	67.7	43%	0.425	35%	0.347	S	S	.	.	H	α-helix	trans	-67.6	-41.6	176.8	-65.5	171.1	-9	0	0	111	L853 D854 K859 M860 T861	L853-Q857 HydrophobicContact CB-CB 4.39Å; L853-Q857 HydrophobicContact CD2-CB 4.41Å; D854-Q857 HydrophobicContact CB-CB 4.42Å; D854-Q857 HydrophobicContact CB-CG 4.12Å; D854-Q857 CarbonylContact O-C 3.59Å; D854-Q857 WeakPolarHBondContact O-CA 3.33Å; D854-Q857 WeakPolarHBondContact O-CB 3.49Å; D854-Q857 PolarHBondContact O-N 2.71Å; Q857-K859 PolarHBondContact O-N 2.98Å; Q857-M860 PolarHBondContact O-N 3.48Å; Q857-T861 PolarHBondContact O-N 2.75Å; Q857-T861 PolarHBondContact O-OG1 3.25Å
858	A	89.6	Confident	89.7	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.008	33%	0.329	C	S	.	.	H	α-helix	trans	-58.2	-46.7	173.6	0	0	0	0	0	111.3	L853 D854 M860 T861 L927 A939	L853-A858 HydrophobicContact CB-CB 4.4Å; D854-A858 PolarHBondContact O-N 3.3Å; A858-M860 VanDerWaalsContact C-N 3.3Å; A858-M860 PolarHBondContact O-N 3.01Å; A858-T861 WeakPolarHBondContact O-CB 3.24Å; A858-T861 PolarHBondContact O-N 3.47Å; A858-T861 VanDerWaalsContact O-N 3.07Å; A858-L927 HydrophobicContact CB-CD1 4.3Å; A858-A939 CarbonylContact C-O 3.53Å; A858-A939 VanDerWaalsContact C-O 3.24Å; A858-A939 HydrophobicContact CB-CB 4.37Å
859	K	87.1	Confident	89.9	Confident	148 Å²	148	64.4 Å²	64.4	64%	0.643	33%	0.326	S	S	*	.	H	α-helix	trans	-62.4	-34.2	177.5	-172.6	178.8	179.2	-177.6	0	113.4	R855 N856 Q857 T861 A939	R855-K859 WeakPolarHBondContact O-CB 3.33Å; R855-K859 PolarHBondContact O-N 3.4Å; R855-K859 VanDerWaalsContact O-N 3.09Å; N856-K859 PolarHBondContact O-N 2.92Å; Q857-K859 PolarHBondContact O-N 2.98Å; K859-T861 VanDerWaalsContact C-N 3.32Å; K859-A939 WeakPolarHBondContact CA-O 3.03Å; K859-A939 PolarHBondContact N-O 3.01Å
860	M	85.8	Confident	90.1	Very high	160 Å²	160	58.1 Å²	58.1	79%	0.788	30%	0.297	S	S	*	.	H	α-helix	trans	-77.2	-19.5	177	-69.1	-63.9	-66.4	0	0	112.7	N856 Q857 A858 V862	N856-M860 VanDerWaalsContact O-CG 3.26Å; N856-M860 WeakPolarHBondContact O-CG 3.24Å; N856-M860 PolarHBondContact O-N 2.89Å; N856-M860 VanDerWaalsContact O-N 3.09Å; Q857-M860 PolarHBondContact O-N 3.48Å; A858-M860 VanDerWaalsContact C-N 3.3Å; A858-M860 PolarHBondContact O-N 3.01Å; M860-V862 PolarHBondContact O-N 3.04Å
861	T	85.2	Confident	90.3	Very high	52 Å²	52	51.6 Å²	51.6	32%	0.319	27%	0.267	S	S	.	.	S	Bend	trans	-81.8	113.2	179	-52.6	0	0	0	0	108.8	Q857 A858 K859 L863	Q857-T861 PolarHBondContact O-N 2.75Å; Q857-T861 PolarHBondContact O-OG1 3.25Å; A858-T861 WeakPolarHBondContact O-CB 3.24Å; A858-T861 PolarHBondContact O-N 3.47Å; A858-T861 VanDerWaalsContact O-N 3.07Å; K859-T861 VanDerWaalsContact C-N 3.32Å; T861-L863 HydrophobicContact CG2-CD1 4.48Å; T861-L863 HydrophobicContact CG2-CD2 3.76Å; T861-L863 HydrophobicContact CG2-CG 3.84Å; T861-L863 PolarHBondContact O-N 3.29Å
862	V	78.9	Confident	90.4	Very high	139 Å²	139	51.8 Å²	51.8	84%	0.842	27%	0.267	S	S	*	.			trans	-72.9	93.1	177.5	-176.2	0	0	0	0	108.9	M860	M860-V862 PolarHBondContact O-N 3.04Å
863	L	80.6	Confident	90.4	Very high	13 Å²	13	50.8 Å²	50.8	7%	0.068	26%	0.262	C	S	.	.			trans	-100.2	121.3	175.8	-61.5	172.1	0	0	0	109.3	T861 H866 H901 V903	T861-L863 HydrophobicContact CG2-CD1 4.48Å; T861-L863 HydrophobicContact CG2-CD2 3.76Å; T861-L863 HydrophobicContact CG2-CG 3.84Å; T861-L863 PolarHBondContact O-N 3.29Å; L863-H866 HydrophobicContact CB-CB 4.48Å; L863-H866 PolarHBondContact O-CE1 3.27Å; L863-H901 HydrophobicContact CD2-CB 4.48Å; L863-V903 HydrophobicContact CD1-CG2 3.57Å
864	N	84.1	Confident	90.3	Very high	54 Å²	54	52.8 Å²	52.8	29%	0.289	27%	0.273	S	S	.	.			trans	-139.8	141.9	171.1	-164.9	-13.6	0	0	0	108.3	H866 N944 L1007	N864-H866 VanDerWaalsContact C-N 3.29Å; N864-H866 PolarHBondContact O-N 3.06Å; N864-N944 PolarHBondContact OD1-O 3.17Å; N864-L1007 WeakPolarHBondContact ND2-CD2 3.3Å; N864-L1007 VanDerWaalsContact ND2-CG 3.32Å; N864-L1007 WeakPolarHBondContact ND2-CG 3.47Å
865	G	85.6	Confident	90.2	Very high	21 Å²	21	54 Å²	54	22%	0.216	27%	0.273	C	S	.	.	S	Bend	trans	65.4	33.2	-176.2	0	0	0	0	0	113	N944	G865-N944 PolarHBondContact N-O 3.32Å; G865-N944 VanDerWaalsContact N-O 3.17Å
866	H	93.5	Very high	90.1	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.005	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	164.3	-179.9	61.7	-69.7	0	0	0	111.9	L863 N864 H901 V940 N941 C945 D946	L863-H866 HydrophobicContact CB-CB 4.48Å; L863-H866 PolarHBondContact O-CE1 3.27Å; N864-H866 VanDerWaalsContact C-N 3.29Å; N864-H866 PolarHBondContact O-N 3.06Å; H866-H901 CarbonylContact C-O 3.59Å; H866-H901 VanDerWaalsContact CA-O 3.32Å; H866-H901 WeakPolarHBondContact CA-O 3.41Å; H866-H901 HydrophobicContact CB-CB 4.19Å; H866-H901 WeakPolarHBondContact CB-O 3.22Å; H866-V940 PolarHBondContact CE1-O 2.91Å; H866-V940 PolarHBondContact NE2-O 3.05Å; H866-N941 PolarHBondContact CE1-O 3.31Å; H866-C945 CarbonylContact O-C 3.51Å; H866-C945 WeakPolarHBondContact O-CA 3.42Å; H866-C945 WeakPolarHBondContact O-CB 3.44Å; H866-D946 PolarHBondContact O-N 3.05Å
867	V	96.2	Very high	90.1	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.006	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	128.2	175.1	178.4	0	0	0	0	108.9	C591 V869 F885 K900 H901 M902 V903 M947 V949	C591-V867 HydrophobicContact CB-CG2 4.16Å; V867-V869 HydrophobicContact CG1-CG2 4.29Å; V867-F885 HydrophobicContact CG1-CZ 4.15Å; V867-K900 HydrophobicContact CG2-CB 4.1Å; V867-K900 HydrophobicContact CG2-CD 4.01Å; V867-H901 PolarHBondContact N-O 3.02Å; V867-M902 WeakPolarHBondContact O-CA 3.23Å; V867-V903 PolarHBondContact O-N 3.33Å; V867-M947 WeakPolarHBondContact CA-O 3.49Å; V867-V949 HydrophobicContact CG1-CG2 4.21Å
868	V	96.5	Very high	90	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	119.7	176.2	179.3	0	0	0	0	108.7	V903 V905 V940 C945 M947 C948 V949	V868-V903 CarbonylContact C-O 3.55Å; V868-V903 WeakPolarHBondContact CA-O 3.48Å; V868-V905 HydrophobicContact CG1-CG2 4.14Å; V868-V940 HydrophobicContact CG1-CG2 4.07Å; V868-V940 HydrophobicContact CG2-CG2 4.1Å; V868-C945 HydrophobicContact CG2-CB 3.88Å; V868-M947 PolarHBondContact N-O 2.87Å; V868-C948 CarbonylContact O-C 3.41Å; V868-C948 WeakPolarHBondContact O-CA 3.34Å; V868-V949 PolarHBondContact O-N 3.16Å
869	V	97.1	Very high	90.1	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.006	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	107.5	177.6	-175.1	0	0	0	0	109	V867 L871 F885 M902 V903 I904 V905 V949 L951	V867-V869 HydrophobicContact CG1-CG2 4.29Å; V869-L871 PolarHBondContact O-N 3.5Å; V869-F885 HydrophobicContact CG2-CD1 4.33Å; V869-F885 HydrophobicContact CG2-CE1 3.47Å; V869-F885 VanDerWaalsContact CG2-CE1 3.47Å; V869-F885 HydrophobicContact CG2-CZ 4.05Å; V869-M902 HydrophobicContact CG2-CG 3.99Å; V869-M902 HydrophobicContact CG2-SD 4.08Å; V869-V903 PolarHBondContact N-O 2.66Å; V869-I904 HydrophobicContact CB-CG1 4.24Å; V869-I904 HydrophobicContact CB-CG2 4.43Å; V869-I904 CarbonylContact O-C 3.56Å; V869-I904 WeakPolarHBondContact O-CA 3.49Å; V869-V905 PolarHBondContact O-N 3.12Å; V869-V949 CarbonylContact C-O 3.58Å; V869-V949 WeakPolarHBondContact CA-O 3.31Å; V869-L951 HydrophobicContact CG1-CD1 4.02Å
870	C	97.2	Very high	90.3	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	105.3	172.3	-69.5	0	0	0	0	109.2	P931 C948 V949 I950 L951	C870-P931 HydrophobicContact CB-CB 3.66Å; C870-P931 HydrophobicContact CB-CG 3.93Å; C870-C948 VanDerWaalsContact SG-SG 3.65Å; C870-V949 PolarHBondContact N-O 3.35Å; C870-I950 HydrophobicContact CB-CB 4.47Å; C870-I950 HydrophobicContact CB-CG1 4.04Å; C870-L951 PolarHBondContact O-N 3.25Å
871	L	96.5	Very high	90.6	Very high	3 Å²	3	35.4 Å²	35.4	2%	0.016	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	116.4	-175.1	179.6	65.8	0	0	0	111.1	V869 A873 I880 L882 I904 V905 Y910 L911 L951	V869-L871 PolarHBondContact O-N 3.5Å; L871-A873 HydrophobicContact CG-CB 4.23Å; L871-I880 HydrophobicContact CD1-CD1 3.59Å; L871-L882 HydrophobicContact CD2-CD1 4.16Å; L871-I904 HydrophobicContact CB-CG2 4.27Å; L871-I904 HydrophobicContact CD2-CG2 4.27Å; L871-V905 PolarHBondContact N-O 2.95Å; L871-Y910 HydrophobicContact CD1-CE1 4.44Å; L871-Y910 HydrophobicContact CD2-CD1 3.7Å; L871-Y910 HydrophobicContact CD2-CE1 3.76Å; L871-Y910 HydrophobicContact CG-CE1 4.5Å; L871-L911 HydrophobicContact CD2-CD2 3.72Å; L871-L911 HydrophobicContact CD2-CG 4.27Å; L871-L951 HydrophobicContact CD1-CB 4.28Å
872	F	94.8	Very high	91	Very high	7 Å²	7	33 Å²	33	3%	0.031	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	105.8	169.9	-69.2	-78.6	0	0	0	110.1	P931 L932 I950 L951 A953 E968 A972	F872-P931 HydrophobicContact CE1-CB 4.21Å; F872-P931 HydrophobicContact CE1-CG 4.22Å; F872-P931 HydrophobicContact CE2-CB 4Å; F872-P931 HydrophobicContact CE2-CG 4.24Å; F872-P931 HydrophobicContact CZ-CB 3.64Å; F872-P931 HydrophobicContact CZ-CG 4.02Å; F872-L932 HydrophobicContact CE1-CD1 4.09Å; F872-L932 HydrophobicContact CE1-CD2 4.34Å; F872-L932 HydrophobicContact CE1-CG 3.81Å; F872-L932 HydrophobicContact CZ-CD2 4.03Å; F872-L932 HydrophobicContact CZ-CG 3.93Å; F872-I950 HydrophobicContact CD2-CG2 4.32Å; F872-I950 HydrophobicContact CE2-CG2 4.04Å; F872-L951 PolarHBondContact N-O 3.38Å; F872-A953 PolarHBondContact O-N 3.26Å; F872-E968 HydrophobicContact CD1-CB 3.9Å; F872-E968 HydrophobicContact CD2-CB 4.34Å; F872-E968 HydrophobicContact CE1-CB 3.98Å; F872-E968 HydrophobicContact CE2-CB 4.4Å; F872-E968 HydrophobicContact CG-CB 4.09Å; F872-E968 HydrophobicContact CZ-CB 4.23Å; F872-A972 HydrophobicContact CE2-CB 3.65Å; F872-A972 HydrophobicContact CZ-CB 3.66Å
873	A	93.2	Very high	91.6	Very high	6 Å²	6	27.8 Å²	27.8	5%	0.05	15%	0.151	C	C	.	.			trans	-151.8	147.7	178.6	0	0	0	0	0	110.4	L871 Y910 A953	L871-A873 HydrophobicContact CG-CB 4.23Å; A873-Y910 HydrophobicContact CB-CD1 3.62Å; A873-Y910 HydrophobicContact CB-CD2 3.57Å; A873-Y910 HydrophobicContact CB-CE1 3.93Å; A873-Y910 HydrophobicContact CB-CE2 3.86Å; A873-Y910 HydrophobicContact CB-CG 3.41Å; A873-Y910 VanDerWaalsContact CB-CG 3.41Å; A873-A953 HydrophobicContact CB-CB 3.65Å
874	D	89.7	Confident	92.2	Very high	69 Å²	69	27.6 Å²	27.6	37%	0.369	15%	0.15	S	C	.	.			trans	-103.8	166.6	168.1	-57.1	-45.9	0	0	0	109.8	D876 S877 Y910 R954	D874-D876 PolarHBondContact O-N 2.85Å; D874-D876 VanDerWaalsContact O-N 3.11Å; D874-S877 PolarHBondContact N-OG 3.39Å; D874-S877 WeakPolarHBondContact O-CB 3.45Å; D874-S877 PolarHBondContact O-N 3.47Å; D874-S877 PolarHBondContact O-OG 3.05Å; D874-Y910 WeakPolarHBondContact O-CD2 3.38Å; D874-R954 VanDerWaalsContact CG-NE 3.25Å; D874-R954 IonicContact OD1-CZ 3.74Å; D874-R954 VanDerWaalsContact OD1-CZ 3.24Å; D874-R954 IonicContact OD1-NE 3.88Å; D874-R954 PolarHBondContact OD1-NE 3.19Å; D874-R954 VanDerWaalsContact OD1-NE 3.09Å; D874-R954 IonicContact OD1-NH2 2.9Å; D874-R954 PolarHBondContact OD1-NH2 3.23Å; D874-R954 WeakPolarHBondContact OD2-CD 3.33Å; D874-R954 IonicContact OD2-CZ 2.88Å; D874-R954 IonicContact OD2-NE 2.7Å; D874-R954 PolarHBondContact OD2-NE 3.02Å; D874-R954 IonicContact OD2-NH2 3.89Å
875	K	89.7	Confident	92.8	Very high	122 Å²	122	25 Å²	25	53%	0.53	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.3	-38.2	177	-178.3	-179.8	176.1	-177.7	0	113.6	E909 R913	K875-E909 HydrophobicContact CB-CB 4.35Å; K875-E909 HydrophobicContact CG-CB 4.32Å; K875-R913 PolarHBondContact O-NH1 2.79Å
876	D	89.1	Confident	93.2	Very high	146 Å²	146	24 Å²	24	78%	0.781	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-0.3	-175.6	-58.9	-38.6	0	0	0	113.4	D874	D874-D876 PolarHBondContact O-N 2.85Å; D874-D876 VanDerWaalsContact O-N 3.11Å
877	S	90.4	Very high	93.2	Very high	8 Å²	8	24.7 Å²	24.7	6%	0.056	13%	0.13	C	C	.	.	S	Bend	trans	-61.5	148.4	177.2	-62	0	0	0	0	111.7	D874 R913	D874-S877 PolarHBondContact N-OG 3.39Å; D874-S877 WeakPolarHBondContact O-CB 3.45Å; D874-S877 PolarHBondContact O-N 3.47Å; D874-S877 PolarHBondContact O-OG 3.05Å; S877-R913 PolarHBondContact O-NH1 3.23Å; S877-R913 PolarHBondContact O-NH2 3.01Å
878	P	89.7	Confident	93	Very high	30 Å²	30	24.8 Å²	24.8	20%	0.195	13%	0.13	C	C	.	.	P	Polyproline II helix	trans	-60.8	153.3	173.5	26.1	-35.2	0	0	0	111.6	P526 Y910 A953 V955	P526-P878 HydrophobicContact CG-CB 3.76Å; P878-Y910 WeakPolarHBondContact O-CE2 3.43Å; P878-Y910 PolarHBondContact O-OH 3.28Å; P878-A953 WeakPolarHBondContact CD-O 3.39Å; P878-V955 HydrophobicContact CG-CG2 3.62Å
879	L	91	Very high	92.9	Very high	45 Å²	45	25 Å²	25	24%	0.236	13%	0.131	C	C	.	.	P	Polyproline II helix	trans	-67.5	133.8	174.5	-61.4	179.4	0	0	0	109	Q555 Y910 R913 E914	Q555-L879 PolarHBondContact NE2-O 2.94Å; Q555-L879 PolarHBondContact OE1-O 3.39Å; L879-Y910 WeakPolarHBondContact CA-OH 3.07Å; L879-R913 HydrophobicContact CD2-CB 3.87Å; L879-E914 WeakPolarHBondContact CA-OE1 2.99Å; L879-E914 WeakPolarHBondContact CB-OE1 3.5Å; L879-E914 HydrophobicContact CD2-CG 3.98Å
880	I	91.3	Very high	92.8	Very high	11 Å²	11	25 Å²	25	6%	0.056	13%	0.131	C	C	.	.			trans	-81.8	-29	170.7	-57.6	175.8	0	0	0	108.7	L584 L871 Y910 E914 L951 A953	L584-I880 HydrophobicContact CD1-CG2 3.85Å; L584-I880 HydrophobicContact CD2-CG2 4Å; L584-I880 HydrophobicContact CG-CG2 4.25Å; L871-I880 HydrophobicContact CD1-CD1 3.59Å; I880-Y910 WeakPolarHBondContact CG1-OH 3.45Å; I880-Y910 PolarHBondContact N-OH 3.48Å; I880-E914 PolarHBondContact N-OE1 3.41Å; I880-L951 HydrophobicContact CD1-CB 4.23Å; I880-A953 HydrophobicContact CD1-CB 3.67Å; I880-A953 HydrophobicContact CG1-CB 3.62Å
881	G	91.6	Very high	92.6	Very high	14 Å²	14	25 Å²	25	14%	0.144	13%	0.131	C	C	.	.			trans	81.8	56.5	-172.2	0	0	0	0	0	111.2	L584 R883 N884 E914	L584-G881 WeakPolarHBondContact CD1-O 3.37Å; G881-R883 PolarHBondContact O-N 3.41Å; G881-N884 PolarHBondContact O-N 3.11Å; G881-E914 PolarHBondContact N-OE1 3.33Å
882	L	93.8	Very high	92.4	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.01	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-25.2	-176.6	-75	177.4	0	0	0	112.9	L871 N884 F885 V886 I904 L911 E914 L918 L951	L871-L882 HydrophobicContact CD2-CD1 4.16Å; L882-N884 PolarHBondContact O-N 3.37Å; L882-N884 VanDerWaalsContact O-N 3.16Å; L882-F885 WeakPolarHBondContact O-CA 3.44Å; L882-F885 WeakPolarHBondContact O-CB 3.21Å; L882-F885 PolarHBondContact O-N 3.33Å; L882-V886 WeakPolarHBondContact O-CG2 3.4Å; L882-V886 PolarHBondContact O-N 2.86Å; L882-I904 HydrophobicContact CD1-CD1 4.35Å; L882-L911 HydrophobicContact CD1-CD2 3.8Å; L882-E914 HydrophobicContact CD1-CB 4.39Å; L882-E914 HydrophobicContact CD1-CG 4.28Å; L882-E914 HydrophobicContact CG-CG 4.47Å; L882-E914 PolarHBondContact N-OE2 3Å; L882-L918 HydrophobicContact CB-CD1 4.16Å; L882-L918 HydrophobicContact CD1-CD1 4.49Å; L882-L951 HydrophobicContact CD2-CD1 4.03Å
883	R	92.6	Very high	92.2	Very high	30 Å²	30	24.9 Å²	24.9	11%	0.113	13%	0.131	C	C	.	.	H	α-helix	trans	-45.6	-42.3	170.7	-163	-159.5	165	177.9	-8.6	113.5	G881 F885 V886 M887 L918 L1094	G881-R883 PolarHBondContact O-N 3.41Å; R883-F885 PolarHBondContact O-N 3.08Å; R883-V886 PolarHBondContact O-N 3.29Å; R883-M887 HydrophobicContact CB-CE 4.49Å; R883-M887 HydrophobicContact CG-CE 3.73Å; R883-M887 HydrophobicContact CG-CG 4.19Å; R883-M887 HydrophobicContact CG-SD 4.02Å; R883-M887 VanDerWaalsContact NE-CE 3.32Å; R883-M887 PolarHBondContact NE-SD 3.17Å; R883-M887 PolarHBondContact NH2-SD 3.18Å; R883-M887 WeakPolarHBondContact O-CB 3.19Å; R883-M887 VanDerWaalsContact O-CG 3.3Å; R883-M887 WeakPolarHBondContact O-CG 3.33Å; R883-M887 PolarHBondContact O-N 2.94Å; R883-L918 HydrophobicContact CB-CD2 4.29Å; R883-L1094 VanDerWaalsContact CZ-CD1 3.49Å; R883-L1094 VanDerWaalsContact CZ-CD2 3.49Å; R883-L1094 VanDerWaalsContact NH1-CD2 3.32Å
884	N	93.4	Very high	92	Very high	8 Å²	8	25.7 Å²	25.7	4%	0.043	13%	0.133	C	C	.	.	H	α-helix	trans	-69.8	-22.6	-179.2	-62.8	-34.3	0	0	0	112.9	Y556 L584 G881 L882 P888	Y556-N884 WeakPolarHBondContact CB-ND2 3.26Å; L584-N884 HydrophobicContact CB-CB 4.06Å; L584-N884 HydrophobicContact CD1-CB 4Å; G881-N884 PolarHBondContact O-N 3.11Å; L882-N884 PolarHBondContact O-N 3.37Å; L882-N884 VanDerWaalsContact O-N 3.16Å; N884-P888 WeakPolarHBondContact O-CD 3.3Å; N884-P888 WeakPolarHBondContact O-CG 3.26Å
885	F	95.3	Very high	92.1	Very high	1 Å²	1	24.3 Å²	24.3	0%	0.004	12%	0.124	C	C	.	.	H	α-helix	trans	-82.2	-40.9	172.1	176.7	-104.8	0	0	0	111.9	L584 I587 A588 V867 V869 L882 R883 L889 M902 V949	L584-F885 HydrophobicContact CB-CB 3.97Å; L584-F885 HydrophobicContact CD1-CB 4.21Å; L584-F885 HydrophobicContact CD2-CB 4.25Å; L584-F885 HydrophobicContact CG-CB 4.38Å; I587-F885 HydrophobicContact CG2-CD2 4.28Å; I587-F885 HydrophobicContact CG2-CE2 3.87Å; A588-F885 HydrophobicContact CB-CD2 3.75Å; A588-F885 HydrophobicContact CB-CE2 4.02Å; A588-F885 HydrophobicContact CB-CG 4.49Å; A588-F885 VanDerWaalsContact CB-O 3.3Å; A588-F885 WeakPolarHBondContact CB-O 3.34Å; V867-F885 HydrophobicContact CG1-CZ 4.15Å; V869-F885 HydrophobicContact CG2-CD1 4.33Å; V869-F885 HydrophobicContact CG2-CE1 3.47Å; V869-F885 VanDerWaalsContact CG2-CE1 3.47Å; V869-F885 HydrophobicContact CG2-CZ 4.05Å; L882-F885 WeakPolarHBondContact O-CA 3.44Å; L882-F885 WeakPolarHBondContact O-CB 3.21Å; L882-F885 PolarHBondContact O-N 3.33Å; R883-F885 PolarHBondContact O-N 3.08Å; F885-L889 HydrophobicContact CE1-CD1 4.01Å; F885-L889 HydrophobicContact CE2-CD1 4.45Å; F885-L889 HydrophobicContact CZ-CD1 3.92Å; F885-M902 HydrophobicContact CD1-CE 3.7Å; F885-M902 HydrophobicContact CD1-SD 4.16Å; F885-M902 HydrophobicContact CE1-CE 3.35Å; F885-M902 HydrophobicContact CE1-SD 3.92Å; F885-M902 HydrophobicContact CZ-CE 4.37Å; F885-V949 HydrophobicContact CE2-CG1 4.3Å; F885-V949 HydrophobicContact CE2-CG2 4.07Å; F885-V949 HydrophobicContact CZ-CB 4.36Å; F885-V949 HydrophobicContact CZ-CG1 4.43Å; F885-V949 HydrophobicContact CZ-CG2 3.79Å
886	V	95.1	Very high	92	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-76.5	-38.5	-175.7	-171.9	0	0	0	0	112.4	L882 R883 L889 R890 M902 L918 L921 I924	L882-V886 WeakPolarHBondContact O-CG2 3.4Å; L882-V886 PolarHBondContact O-N 2.86Å; R883-V886 PolarHBondContact O-N 3.29Å; V886-L889 PolarHBondContact O-N 3.2Å; V886-L889 VanDerWaalsContact O-N 3.14Å; V886-R890 HydrophobicContact CG1-CG 3.97Å; V886-R890 WeakPolarHBondContact O-CG 3.33Å; V886-R890 PolarHBondContact O-N 3.41Å; V886-M902 HydrophobicContact CB-CE 4.27Å; V886-M902 HydrophobicContact CG1-CE 4.16Å; V886-M902 HydrophobicContact CG2-CE 3.82Å; V886-M902 HydrophobicContact CG2-SD 3.74Å; V886-L918 HydrophobicContact CB-CD2 4.07Å; V886-L918 HydrophobicContact CG2-CD2 3.7Å; V886-L921 HydrophobicContact CB-CD1 3.95Å; V886-L921 HydrophobicContact CG1-CB 4.28Å; V886-L921 HydrophobicContact CG1-CD1 3.62Å; V886-I924 HydrophobicContact CG1-CD1 3.83Å; V886-I924 HydrophobicContact CG1-CG1 4.42Å
887	M	92.6	Very high	92	Very high	15 Å²	15	23.8 Å²	23.8	7%	0.074	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-49.2	-176.1	-78	-172.7	-63.8	0	0	113.4	F840 R883 L889 R890 A891 L921	F840-M887 HydrophobicContact CD1-CB 4.28Å; F840-M887 WeakPolarHBondContact CD1-O 3.21Å; F840-M887 HydrophobicContact CE1-CB 3.93Å; F840-M887 WeakPolarHBondContact CE1-O 3.41Å; F840-M887 HydrophobicContact CZ-CB 4.43Å; R883-M887 HydrophobicContact CB-CE 4.49Å; R883-M887 HydrophobicContact CG-CE 3.73Å; R883-M887 HydrophobicContact CG-CG 4.19Å; R883-M887 HydrophobicContact CG-SD 4.02Å; R883-M887 VanDerWaalsContact NE-CE 3.32Å; R883-M887 PolarHBondContact NE-SD 3.17Å; R883-M887 PolarHBondContact NH2-SD 3.18Å; R883-M887 WeakPolarHBondContact O-CB 3.19Å; R883-M887 VanDerWaalsContact O-CG 3.3Å; R883-M887 WeakPolarHBondContact O-CG 3.33Å; R883-M887 PolarHBondContact O-N 2.94Å; M887-L889 VanDerWaalsContact C-N 3.25Å; M887-L889 PolarHBondContact O-N 3.44Å; M887-R890 CarbonylContact O-C 3.54Å; M887-R890 WeakPolarHBondContact O-CA 3.28Å; M887-R890 PolarHBondContact O-N 3.48Å; M887-A891 PolarHBondContact O-N 2.99Å; M887-L921 HydrophobicContact CG-CD1 4.31Å
888	P	93.4	Very high	91.9	Very high	3 Å²	3	26.3 Å²	26.3	2%	0.019	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-58.8	-35.3	177.9	-23.6	33.1	0	0	0	113.5	A588 N884 R890 A891	A588-P888 HydrophobicContact CB-CB 3.96Å; A588-P888 HydrophobicContact CB-CG 4Å; N884-P888 WeakPolarHBondContact O-CD 3.3Å; N884-P888 WeakPolarHBondContact O-CG 3.26Å; P888-R890 PolarHBondContact O-N 3.17Å; P888-A891 WeakPolarHBondContact O-CB 3.39Å; P888-A891 PolarHBondContact O-N 3.19Å
889	L	94.4	Very high	92	Very high	5 Å²	5	25.1 Å²	25.1	3%	0.026	12%	0.117	C	C	.	.	G	3₁₀ helix	trans	-76.5	-4.3	177.3	-64	176.8	0	0	0	113.7	A588 C591 L592 F885 V886 M887 M902	A588-L889 HydrophobicContact CB-CG 4.25Å; A588-L889 WeakPolarHBondContact O-CD2 3.27Å; C591-L889 HydrophobicContact CB-CD2 4.1Å; L592-L889 HydrophobicContact CD1-CD2 4.3Å; L592-L889 HydrophobicContact CD2-CD2 3.73Å; L592-L889 HydrophobicContact CG-CD2 3.77Å; F885-L889 HydrophobicContact CE1-CD1 4.01Å; F885-L889 HydrophobicContact CE2-CD1 4.45Å; F885-L889 HydrophobicContact CZ-CD1 3.92Å; V886-L889 PolarHBondContact O-N 3.2Å; V886-L889 VanDerWaalsContact O-N 3.14Å; M887-L889 VanDerWaalsContact C-N 3.25Å; M887-L889 PolarHBondContact O-N 3.44Å; L889-M902 HydrophobicContact CD1-CE 3.56Å
890	R	94.6	Very high	92.1	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	-121.6	18.1	177.5	-60.1	-63.7	177.5	-95.7	3.4	111.7	F840 H841 V886 M887 P888 K900 L921 P922 K923	F840-R890 WeakPolarHBondContact CA-O 3.48Å; H841-R890 PolarHBondContact CD2-O 3.05Å; H841-R890 PolarHBondContact N-O 3.34Å; V886-R890 HydrophobicContact CG1-CG 3.97Å; V886-R890 WeakPolarHBondContact O-CG 3.33Å; V886-R890 PolarHBondContact O-N 3.41Å; M887-R890 CarbonylContact O-C 3.54Å; M887-R890 WeakPolarHBondContact O-CA 3.28Å; M887-R890 PolarHBondContact O-N 3.48Å; P888-R890 PolarHBondContact O-N 3.17Å; R890-K900 PolarHBondContact NH1-O 3.11Å; R890-K900 PolarHBondContact NH2-O 3.45Å; R890-L921 HydrophobicContact CB-CD2 4.2Å; R890-L921 HydrophobicContact CG-CD2 4.4Å; R890-P922 PolarHBondContact NE-O 3.45Å; R890-P922 PolarHBondContact NH2-O 2.79Å; R890-K923 PolarHBondContact NH2-O 2.89Å
891	A	92.8	Very high	92.3	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	12%	0.123	C	C	.	.	B	Isolated β-bridge	trans	-61.2	145.1	175.2	0	0	0	0	0	111.6	F840 H841 M887 P888 N893 F894	F840-A891 HydrophobicContact CD1-CB 4.4Å; F840-A891 HydrophobicContact CE1-CB 4.32Å; H841-A891 PolarHBondContact CD2-O 2.92Å; M887-A891 PolarHBondContact O-N 2.99Å; P888-A891 WeakPolarHBondContact O-CB 3.39Å; P888-A891 PolarHBondContact O-N 3.19Å; A891-N893 WeakPolarHBondContact CB-OD1 3.35Å; A891-N893 PolarHBondContact O-N 2.79Å; A891-F894 HydrophobicContact CB-CD2 4.47Å; A891-F894 PolarHBondContact O-N 2.66Å
892	S	91.7	Very high	92.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-5.8	-173.7	63.9	0	0	0	0	114.7	G838 M839 F894 R1113	G838-S892 WeakPolarHBondContact O-CB 3.44Å; G838-S892 PolarHBondContact O-OG 2.97Å; M839-S892 WeakPolarHBondContact CA-OG 3.13Å; M839-S892 WeakPolarHBondContact O-CB 3.15Å; M839-S892 PolarHBondContact O-N 3.01Å; M839-S892 PolarHBondContact O-OG 3.08Å; S892-F894 PolarHBondContact O-N 3.42Å; S892-R1113 PolarHBondContact O-NE 3.33Å
893	N	90.2	Very high	92.6	Very high	8 Å²	8	26.2 Å²	26.2	4%	0.043	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	0.2	169.8	64.1	-11.4	0	0	0	113.3	A891 C1116 R1117 Y1193	A891-N893 WeakPolarHBondContact CB-OD1 3.35Å; A891-N893 PolarHBondContact O-N 2.79Å; N893-C1116 PolarHBondContact ND2-O 2.9Å; N893-R1117 PolarHBondContact O-NH1 3.07Å; N893-Y1193 WeakPolarHBondContact O-CD2 3.39Å
894	F	90.6	Very high	92.7	Very high	23 Å²	23	24.9 Å²	24.9	10%	0.101	11%	0.112	C	C	.	.	S	Bend	trans	-105.6	142.2	164.1	-65.6	-79.5	0	0	0	110.2	L592 H841 A891 S892 L899 R1117	L592-F894 HydrophobicContact CD1-CE2 3.91Å; L592-F894 HydrophobicContact CD1-CZ 3.66Å; L592-F894 HydrophobicContact CD2-CE1 4.28Å; L592-F894 HydrophobicContact CD2-CE2 4.34Å; L592-F894 HydrophobicContact CD2-CZ 3.83Å; L592-F894 HydrophobicContact CG-CZ 4.32Å; H841-F894 PolarHBondContact NE2-O 2.91Å; A891-F894 HydrophobicContact CB-CD2 4.47Å; A891-F894 PolarHBondContact O-N 2.66Å; S892-F894 PolarHBondContact O-N 3.42Å; F894-L899 HydrophobicContact CB-CD2 3.76Å; F894-R1117 HydrophobicContact CE1-CB 4.41Å; F894-R1117 HydrophobicContact CE1-CG 4.5Å; F894-R1117 HydrophobicContact CZ-CB 4.03Å
895	H	90.2	Very high	92.9	Very high	39 Å²	39	24.5 Å²	24.5	18%	0.181	11%	0.11	C	C	.	.			trans	-69.8	151.6	167.9	-66.9	-76.5	0	0	0	110.1	H897 E898 L899 Y1193 D1194	H895-H897 WeakPolarHBondContact CB-CE1 3.35Å; H895-H897 AromaticContact CG-CE1 3.88Å; H895-H897 PolarHBondContact O-N 2.93Å; H895-H897 VanDerWaalsContact O-N 3.11Å; H895-E898 HydrophobicContact CB-CG 4.08Å; H895-E898 IonicContact CD2-OE1 3.2Å; H895-E898 IonicContact CD2-OE2 3.45Å; H895-E898 PolarHBondContact CD2-OE2 2.88Å; H895-E898 IonicContact CG-OE2 2.59Å; H895-E898 PolarHBondContact N-OE2 3.42Å; H895-E898 WeakPolarHBondContact O-CB 3.45Å; H895-E898 PolarHBondContact O-N 2.82Å; H895-L899 PolarHBondContact O-N 2.94Å; H895-Y1193 AromaticContact CE1-CE2 3.82Å; H895-Y1193 AromaticContact CE1-CZ 3.61Å; H895-Y1193 PolarHBondContact CE1-OH 2.84Å; H895-Y1193 PolarHBondContact ND1-OH 2.88Å; H895-Y1193 AromaticContact NE2-CE2 3.77Å; H895-Y1193 AromaticContact NE2-CZ 3.93Å; H895-D1194 PolarHBondContact CE1-O 3.32Å; H895-D1194 VanDerWaalsContact CE1-O 3.31Å; H895-D1194 PolarHBondContact NE2-O 3.47Å
896	Y	88.9	Confident	92.8	Very high	131 Å²	131	24.5 Å²	24.5	51%	0.514	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-34.3	-176.1	-170.3	-92.3	0	0	0	113.2	H841 L899 P922 K923	H841-Y896 AromaticContact ND1-CD2 3.73Å; Y896-L899 HydrophobicContact CD2-CD1 3.98Å; Y896-L899 HydrophobicContact CE2-CD1 4.39Å; Y896-L899 HydrophobicContact CG-CD1 4.47Å; Y896-L899 WeakPolarHBondContact O-CB 3.13Å; Y896-L899 PolarHBondContact O-N 2.95Å; Y896-P922 HydrophobicContact CE2-CB 4.02Å; Y896-P922 HydrophobicContact CE2-CG 4.16Å; Y896-K923 PolarHBondContact O-NZ 3.45Å
897	H	88.8	Confident	92.8	Very high	126 Å²	126	27.3 Å²	27.3	58%	0.583	13%	0.125	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-27.3	177.6	62.4	-91	0	0	0	113.1	H895 L899	H895-H897 WeakPolarHBondContact CB-CE1 3.35Å; H895-H897 AromaticContact CG-CE1 3.88Å; H895-H897 PolarHBondContact O-N 2.93Å; H895-H897 VanDerWaalsContact O-N 3.11Å; H897-L899 VanDerWaalsContact C-N 3.32Å
898	E	88.8	Confident	92.8	Very high	61 Å²	61	27.7 Å²	27.7	29%	0.285	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-16.8	176.1	-63.3	175.7	140.6	0	0	112.8	H895 K900 R1117	H895-E898 HydrophobicContact CB-CG 4.08Å; H895-E898 IonicContact CD2-OE1 3.2Å; H895-E898 IonicContact CD2-OE2 3.45Å; H895-E898 PolarHBondContact CD2-OE2 2.88Å; H895-E898 IonicContact CG-OE2 2.59Å; H895-E898 PolarHBondContact N-OE2 3.42Å; H895-E898 WeakPolarHBondContact O-CB 3.45Å; H895-E898 PolarHBondContact O-N 2.82Å; E898-K900 PolarHBondContact O-N 3.48Å; E898-K900 VanDerWaalsContact O-N 3.14Å; E898-R1117 VanDerWaalsContact CD-NH1 3.3Å; E898-R1117 IonicContact OE1-CZ 2.72Å; E898-R1117 IonicContact OE1-NH1 3.57Å; E898-R1117 PolarHBondContact OE1-NH1 3Å; E898-R1117 IonicContact OE1-NH2 3.55Å; E898-R1117 PolarHBondContact OE1-NH2 2.89Å; E898-R1117 IonicContact OE2-CZ 2.71Å; E898-R1117 IonicContact OE2-NH1 3.6Å; E898-R1117 PolarHBondContact OE2-NH1 3.47Å; E898-R1117 IonicContact OE2-NH2 3.14Å
899	L	91.7	Very high	92.7	Very high	6 Å²	6	31 Å²	31	3%	0.031	14%	0.142	C	C	.	.	S	Bend	trans	-60.7	118.4	179	-63.8	179.6	0	0	0	111.1	H841 F894 H895 Y896 H897 H901 P922 K923	H841-L899 HydrophobicContact CB-CD1 4.25Å; F894-L899 HydrophobicContact CB-CD2 3.76Å; H895-L899 PolarHBondContact O-N 2.94Å; Y896-L899 HydrophobicContact CD2-CD1 3.98Å; Y896-L899 HydrophobicContact CE2-CD1 4.39Å; Y896-L899 HydrophobicContact CG-CD1 4.47Å; Y896-L899 WeakPolarHBondContact O-CB 3.13Å; Y896-L899 PolarHBondContact O-N 2.95Å; H897-L899 VanDerWaalsContact C-N 3.32Å; L899-H901 PolarHBondContact O-N 3.26Å; L899-P922 HydrophobicContact CD1-CG 4.31Å; L899-K923 HydrophobicContact CB-CD 3.87Å; L899-K923 WeakPolarHBondContact O-CD 3.36Å; L899-K923 PolarHBondContact O-NZ 3.17Å
900	K	92.9	Very high	92.7	Very high	41 Å²	41	30.8 Å²	30.8	18%	0.178	14%	0.141	C	C	.	.	P	Polyproline II helix	trans	-65.4	126.1	175.4	-55.3	-169	-175.7	-162.8	0	110.6	C591 V867 R890 E898 D946	C591-K900 PolarHBondContact O-NZ 3.14Å; V867-K900 HydrophobicContact CG2-CB 4.1Å; V867-K900 HydrophobicContact CG2-CD 4.01Å; R890-K900 PolarHBondContact NH1-O 3.11Å; R890-K900 PolarHBondContact NH2-O 3.45Å; E898-K900 PolarHBondContact O-N 3.48Å; E898-K900 VanDerWaalsContact O-N 3.14Å; K900-D946 HydrophobicContact CD-CB 4.29Å; K900-D946 WeakPolarHBondContact CD-OD2 3.26Å; K900-D946 WeakPolarHBondContact CE-OD2 3.18Å; K900-D946 IonicContact NZ-OD2 3.65Å; K900-D946 PolarHBondContact NZ-OD2 3.45Å
901	H	94.6	Very high	92.7	Very high	51 Å²	51	30.9 Å²	30.9	24%	0.236	14%	0.141	C	C	.	.	P	Polyproline II helix	trans	-65.7	137	174.2	-159.7	92.9	0	0	0	109.5	L863 H866 V867 L899 S925	L863-H901 HydrophobicContact CD2-CB 4.48Å; H866-H901 CarbonylContact C-O 3.59Å; H866-H901 VanDerWaalsContact CA-O 3.32Å; H866-H901 WeakPolarHBondContact CA-O 3.41Å; H866-H901 HydrophobicContact CB-CB 4.19Å; H866-H901 WeakPolarHBondContact CB-O 3.22Å; V867-H901 PolarHBondContact N-O 3.02Å; L899-H901 PolarHBondContact O-N 3.26Å; H901-S925 PolarHBondContact NE2-OG 3.04Å
902	M	95.6	Very high	92.8	Very high	2 Å²	2	35 Å²	35	1%	0.01	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	128.7	-179.3	-177.1	-178.3	-62.2	0	0	110	V867 V869 F885 V886 L889 I904 K923 S925	V867-M902 WeakPolarHBondContact O-CA 3.23Å; V869-M902 HydrophobicContact CG2-CG 3.99Å; V869-M902 HydrophobicContact CG2-SD 4.08Å; F885-M902 HydrophobicContact CD1-CE 3.7Å; F885-M902 HydrophobicContact CD1-SD 4.16Å; F885-M902 HydrophobicContact CE1-CE 3.35Å; F885-M902 HydrophobicContact CE1-SD 3.92Å; F885-M902 HydrophobicContact CZ-CE 4.37Å; V886-M902 HydrophobicContact CB-CE 4.27Å; V886-M902 HydrophobicContact CG1-CE 4.16Å; V886-M902 HydrophobicContact CG2-CE 3.82Å; V886-M902 HydrophobicContact CG2-SD 3.74Å; L889-M902 HydrophobicContact CD1-CE 3.56Å; M902-I904 HydrophobicContact CG-CG1 4.25Å; M902-I904 HydrophobicContact SD-CD1 4.36Å; M902-I904 HydrophobicContact SD-CG1 4.21Å; M902-K923 PolarHBondContact N-O 3.47Å; M902-S925 PolarHBondContact O-N 2.99Å
903	V	95.7	Very high	92.9	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.006	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	114.8	173.2	-173.5	0	0	0	0	109.6	L863 V867 V868 V869 S925 L927 V940	L863-V903 HydrophobicContact CD1-CG2 3.57Å; V867-V903 PolarHBondContact O-N 3.33Å; V868-V903 CarbonylContact C-O 3.55Å; V868-V903 WeakPolarHBondContact CA-O 3.48Å; V869-V903 PolarHBondContact N-O 2.66Å; V903-S925 CarbonylContact C-O 3.2Å; V903-S925 VanDerWaalsContact CA-O 3.31Å; V903-S925 WeakPolarHBondContact CA-O 3.49Å; V903-L927 HydrophobicContact CG1-CB 4.4Å; V903-V940 HydrophobicContact CG1-CB 4.43Å; V903-V940 HydrophobicContact CG1-CG1 3.77Å
904	I	96.5	Very high	93	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.01	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	122.8	177.7	-53.1	172.4	0	0	0	108.7	V869 L871 L882 M902 L911 I924 S925 I926 L927	V869-I904 HydrophobicContact CB-CG1 4.24Å; V869-I904 HydrophobicContact CB-CG2 4.43Å; V869-I904 CarbonylContact O-C 3.56Å; V869-I904 WeakPolarHBondContact O-CA 3.49Å; L871-I904 HydrophobicContact CB-CG2 4.27Å; L871-I904 HydrophobicContact CD2-CG2 4.27Å; L882-I904 HydrophobicContact CD1-CD1 4.35Å; M902-I904 HydrophobicContact CG-CG1 4.25Å; M902-I904 HydrophobicContact SD-CD1 4.36Å; M902-I904 HydrophobicContact SD-CG1 4.21Å; I904-L911 HydrophobicContact CD1-CD2 4.42Å; I904-L911 HydrophobicContact CG2-CD1 4Å; I904-L911 HydrophobicContact CG2-CD2 4Å; I904-I924 HydrophobicContact CD1-CG2 4.19Å; I904-S925 PolarHBondContact N-O 3.19Å; I904-I926 CarbonylContact O-C 3.44Å; I904-I926 WeakPolarHBondContact O-CA 3.23Å; I904-L927 PolarHBondContact O-N 3.41Å
905	V	96.1	Very high	93.1	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	113.8	176	-174.4	0	0	0	0	108.1	V868 V869 L871 L927 P931 D936 V940	V868-V905 HydrophobicContact CG1-CG2 4.14Å; V869-V905 PolarHBondContact O-N 3.12Å; L871-V905 PolarHBondContact N-O 2.95Å; V905-L927 HydrophobicContact CG2-CB 4.33Å; V905-L927 HydrophobicContact CG2-CD2 4.36Å; V905-P931 HydrophobicContact CG1-CG 4.37Å; V905-D936 HydrophobicContact CG1-CB 4.49Å; V905-V940 HydrophobicContact CG2-CG1 4.13Å
906	G	94.2	Very high	93.1	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.01	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.2	-168.5	-179	0	0	0	0	0	114.1	L927 G929	G906-L927 PolarHBondContact N-O 3.2Å; G906-G929 CarbonylContact C-O 3.57Å; G906-G929 WeakPolarHBondContact CA-O 3.33Å; G906-G929 PolarHBondContact N-O 2.91Å; G906-G929 PolarHBondContact O-N 3.06Å
907	D	93.6	Very high	93.1	Very high	59 Å²	59	43.2 Å²	43.2	32%	0.316	19%	0.193	S	C	.	.			trans	-74.2	125.1	178.2	-169.1	-11.7	0	0	0	111.4	E909 Y910 L911	D907-E909 VanDerWaalsContact C-N 3.31Å; D907-E909 PolarHBondContact O-N 3.44Å; D907-E909 PolarHBondContact OD1-N 3.24Å; D907-Y910 PolarHBondContact O-N 3.31Å; D907-L911 WeakPolarHBondContact O-CG 3.46Å; D907-L911 PolarHBondContact O-N 2.99Å
908	I	93	Very high	93.3	Very high	23 Å²	23	37.2 Å²	37.2	12%	0.118	17%	0.166	C	C	.	.	H	α-helix	trans	-65.7	-32	178	-167.1	168.3	0	0	0	112.5	V852 Y910 L911 K912 Q928	V852-I908 HydrophobicContact CG1-CD1 4.28Å; V852-I908 HydrophobicContact CG2-CD1 3.71Å; V852-I908 HydrophobicContact CG2-CG1 4.49Å; I908-Y910 VanDerWaalsContact C-N 3.33Å; I908-Y910 PolarHBondContact O-N 3.05Å; I908-L911 PolarHBondContact O-N 3.11Å; I908-K912 WeakPolarHBondContact O-CG 3.34Å; I908-K912 PolarHBondContact O-N 3.39Å; I908-Q928 HydrophobicContact CB-CG 4.32Å; I908-Q928 HydrophobicContact CG2-CG 4.24Å
909	E	93	Very high	93.5	Very high	73 Å²	73	37.6 Å²	37.6	34%	0.341	17%	0.165	S	C	.	.	H	α-helix	trans	-67.1	-36.5	-179.3	-70	-60.9	128.8	0	0	111.6	K875 D907 K912	K875-E909 HydrophobicContact CB-CB 4.35Å; K875-E909 HydrophobicContact CG-CB 4.32Å; D907-E909 VanDerWaalsContact C-N 3.31Å; D907-E909 PolarHBondContact O-N 3.44Å; D907-E909 PolarHBondContact OD1-N 3.24Å; E909-K912 IonicContact OE1-NZ 3.88Å; E909-K912 PolarHBondContact OE1-NZ 2.9Å
910	Y	94.4	Very high	93.5	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-66.7	-48.9	170.2	179.4	-96.1	0	0	0	111.3	L871 A873 D874 P878 L879 I880 D907 I908 K912 R913 E914 A953	L871-Y910 HydrophobicContact CD1-CE1 4.44Å; L871-Y910 HydrophobicContact CD2-CD1 3.7Å; L871-Y910 HydrophobicContact CD2-CE1 3.76Å; L871-Y910 HydrophobicContact CG-CE1 4.5Å; A873-Y910 HydrophobicContact CB-CD1 3.62Å; A873-Y910 HydrophobicContact CB-CD2 3.57Å; A873-Y910 HydrophobicContact CB-CE1 3.93Å; A873-Y910 HydrophobicContact CB-CE2 3.86Å; A873-Y910 HydrophobicContact CB-CG 3.41Å; A873-Y910 VanDerWaalsContact CB-CG 3.41Å; D874-Y910 WeakPolarHBondContact O-CD2 3.38Å; P878-Y910 WeakPolarHBondContact O-CE2 3.43Å; P878-Y910 PolarHBondContact O-OH 3.28Å; L879-Y910 WeakPolarHBondContact CA-OH 3.07Å; I880-Y910 WeakPolarHBondContact CG1-OH 3.45Å; I880-Y910 PolarHBondContact N-OH 3.48Å; D907-Y910 PolarHBondContact O-N 3.31Å; I908-Y910 VanDerWaalsContact C-N 3.33Å; I908-Y910 PolarHBondContact O-N 3.05Å; Y910-K912 VanDerWaalsContact C-N 3.27Å; Y910-K912 PolarHBondContact O-N 2.83Å; Y910-R913 WeakPolarHBondContact O-CB 3.49Å; Y910-R913 PolarHBondContact O-N 3.39Å; Y910-E914 HydrophobicContact CD1-CG 4.43Å; Y910-E914 HydrophobicContact CE1-CG 3.79Å; Y910-E914 PolarHBondContact OH-OE1 3.35Å; Y910-A953 HydrophobicContact CE2-CB 4.07Å
911	L	94.5	Very high	93.5	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-63.1	-29.7	-176.3	-71.8	170.3	0	0	0	113.5	I848 L871 L882 I904 D907 I908 R913 E914 W915 I926	I848-L911 HydrophobicContact CD1-CB 4.4Å; L871-L911 HydrophobicContact CD2-CD2 3.72Å; L871-L911 HydrophobicContact CD2-CG 4.27Å; L882-L911 HydrophobicContact CD1-CD2 3.8Å; I904-L911 HydrophobicContact CD1-CD2 4.42Å; I904-L911 HydrophobicContact CG2-CD1 4Å; I904-L911 HydrophobicContact CG2-CD2 4Å; D907-L911 WeakPolarHBondContact O-CG 3.46Å; D907-L911 PolarHBondContact O-N 2.99Å; I908-L911 PolarHBondContact O-N 3.11Å; L911-R913 PolarHBondContact O-N 3.12Å; L911-E914 PolarHBondContact O-N 3.12Å; L911-W915 VanDerWaalsContact O-CB 3.3Å; L911-W915 WeakPolarHBondContact O-CB 3.25Å; L911-W915 PolarHBondContact O-N 3.39Å; L911-I926 HydrophobicContact CB-CD1 4.45Å; L911-I926 HydrophobicContact CD1-CB 4.46Å; L911-I926 HydrophobicContact CD1-CD1 4.16Å; L911-I926 HydrophobicContact CD1-CG1 4.2Å; L911-I926 HydrophobicContact CD1-CG2 3.46Å; L911-I926 VanDerWaalsContact CD1-CG2 3.46Å
912	K	94.3	Very high	93.5	Very high	87 Å²	87	33.9 Å²	33.9	38%	0.378	15%	0.149	S	C	.	.	H	α-helix	trans	-55.8	-32.8	172.2	-78.5	172	-177.5	170.9	0	113.1	I848 I908 E909 Y910	I848-K912 HydrophobicContact CD1-CG 3.91Å; I908-K912 WeakPolarHBondContact O-CG 3.34Å; I908-K912 PolarHBondContact O-N 3.39Å; E909-K912 IonicContact OE1-NZ 3.88Å; E909-K912 PolarHBondContact OE1-NZ 2.9Å; Y910-K912 VanDerWaalsContact C-N 3.27Å; Y910-K912 PolarHBondContact O-N 2.83Å
913	R	92.8	Very high	93.4	Very high	95 Å²	95	35.9 Å²	35.9	36%	0.358	16%	0.158	S	C	.	.	H	α-helix	trans	-74.5	-45.8	177.6	-63.8	165.8	56	-154.1	-9.1	111.2	K875 S877 L879 Y910 L911	K875-R913 PolarHBondContact O-NH1 2.79Å; S877-R913 PolarHBondContact O-NH1 3.23Å; S877-R913 PolarHBondContact O-NH2 3.01Å; L879-R913 HydrophobicContact CD2-CB 3.87Å; Y910-R913 WeakPolarHBondContact O-CB 3.49Å; Y910-R913 PolarHBondContact O-N 3.39Å; L911-R913 PolarHBondContact O-N 3.12Å
914	E	92.6	Very high	93.3	Very high	4 Å²	4	35.9 Å²	35.9	2%	0.019	16%	0.158	C	C	.	.	H	α-helix	trans	-68.8	-31.4	177.9	-74.2	-78.4	173.6	0	0	112.9	L879 I880 G881 L882 Y910 L911 R916 T917	L879-E914 WeakPolarHBondContact CA-OE1 2.99Å; L879-E914 WeakPolarHBondContact CB-OE1 3.5Å; L879-E914 HydrophobicContact CD2-CG 3.98Å; I880-E914 PolarHBondContact N-OE1 3.41Å; G881-E914 PolarHBondContact N-OE1 3.33Å; L882-E914 HydrophobicContact CD1-CB 4.39Å; L882-E914 HydrophobicContact CD1-CG 4.28Å; L882-E914 HydrophobicContact CG-CG 4.47Å; L882-E914 PolarHBondContact N-OE2 3Å; Y910-E914 HydrophobicContact CD1-CG 4.43Å; Y910-E914 HydrophobicContact CE1-CG 3.79Å; Y910-E914 PolarHBondContact OH-OE1 3.35Å; L911-E914 PolarHBondContact O-N 3.12Å; E914-R916 PolarHBondContact O-N 3.1Å; E914-T917 PolarHBondContact O-N 3.22Å; E914-T917 PolarHBondContact O-OG1 3.02Å
915	W	93.6	Very high	93.3	Very high	18 Å²	18	36.5 Å²	36.5	7%	0.068	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-58	-27.8	-173.6	-166.8	-108.3	0	0	0	113.7	R846 I848 C851 L911 T917 L918 Y919 I924 I926	R846-W915 PolarHBondContact O-NE1 3.41Å; I848-W915 HydrophobicContact CB-CD2 4.16Å; I848-W915 HydrophobicContact CB-CG 3.93Å; I848-W915 HydrophobicContact CD1-CB 4.06Å; I848-W915 HydrophobicContact CD1-CD2 4.37Å; I848-W915 HydrophobicContact CD1-CG 4.11Å; I848-W915 HydrophobicContact CG1-CD2 3.98Å; I848-W915 HydrophobicContact CG1-CE3 4.39Å; I848-W915 HydrophobicContact CG1-CG 4.03Å; C851-W915 HydrophobicContact CB-CH2 3.66Å; C851-W915 HydrophobicContact CB-CZ2 3.97Å; C851-W915 VanDerWaalsContact SG-CH2 3.51Å; C851-W915 WeakPolarHBondContact SG-CZ2 3.39Å; L911-W915 VanDerWaalsContact O-CB 3.3Å; L911-W915 WeakPolarHBondContact O-CB 3.25Å; L911-W915 PolarHBondContact O-N 3.39Å; W915-T917 PolarHBondContact O-N 3.49Å; W915-L918 HydrophobicContact CE3-CB 4.05Å; W915-L918 HydrophobicContact CE3-CD1 4.39Å; W915-L918 HydrophobicContact CZ3-CB 4.3Å; W915-L918 PolarHBondContact O-N 3.41Å; W915-Y919 VanDerWaalsContact O-CD1 3.31Å; W915-Y919 WeakPolarHBondContact O-CD1 3.42Å; W915-Y919 PolarHBondContact O-N 2.99Å; W915-I924 HydrophobicContact CH2-CB 4.44Å; W915-I924 HydrophobicContact CH2-CG2 4.33Å; W915-I924 HydrophobicContact CZ3-CG2 3.99Å; W915-I926 HydrophobicContact CE3-CD1 3.86Å; W915-I926 HydrophobicContact CZ3-CD1 3.76Å; W915-I926 HydrophobicContact CZ3-CG1 4.47Å
916	R	89.2	Confident	93.2	Very high	198 Å²	198	36.5 Å²	36.5	75%	0.747	16%	0.162	S	C	*	.	G	3₁₀ helix	trans	-55.5	-18.6	173.1	-67	-175.1	-179.8	179.1	0.8	113.8	E914 Y919	E914-R916 PolarHBondContact O-N 3.1Å; R916-Y919 WeakPolarHBondContact O-CD1 3.42Å; R916-Y919 WeakPolarHBondContact O-CE1 3.46Å
917	T	89.5	Confident	93.3	Very high	58 Å²	58	36.5 Å²	36.5	36%	0.356	16%	0.162	S	C	.	.	G	3₁₀ helix	trans	-106.7	-11	178.3	67.6	0	0	0	0	113.3	E914 W915	E914-T917 PolarHBondContact O-N 3.22Å; E914-T917 PolarHBondContact O-OG1 3.02Å; W915-T917 PolarHBondContact O-N 3.49Å
918	L	92.8	Very high	93.2	Very high	1 Å²	1	39 Å²	39	1%	0.005	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.4	-18.2	-172.3	-61.8	-179.8	0	0	0	113.9	L882 R883 V886 W915 N920 L921 I924	L882-L918 HydrophobicContact CB-CD1 4.16Å; L882-L918 HydrophobicContact CD1-CD1 4.49Å; R883-L918 HydrophobicContact CB-CD2 4.29Å; V886-L918 HydrophobicContact CB-CD2 4.07Å; V886-L918 HydrophobicContact CG2-CD2 3.7Å; W915-L918 HydrophobicContact CE3-CB 4.05Å; W915-L918 HydrophobicContact CE3-CD1 4.39Å; W915-L918 HydrophobicContact CZ3-CB 4.3Å; W915-L918 PolarHBondContact O-N 3.41Å; L918-N920 PolarHBondContact O-N 2.79Å; L918-L921 HydrophobicContact CD2-CD1 4.28Å; L918-L921 PolarHBondContact O-N 3.32Å; L918-I924 HydrophobicContact CB-CD1 4.41Å
919	Y	92.2	Very high	93	Very high	69 Å²	69	39 Å²	39	27%	0.271	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-18.1	-170.1	61.1	-113.7	0	0	0	115.3	P845 R846 W915 R916	P845-Y919 HydrophobicContact CB-CD2 3.47Å; P845-Y919 VanDerWaalsContact CB-CD2 3.47Å; P845-Y919 HydrophobicContact CB-CE2 3.85Å; P845-Y919 HydrophobicContact CB-CG 4.3Å; R846-Y919 PolarHBondContact N-O 3.29Å; W915-Y919 VanDerWaalsContact O-CD1 3.31Å; W915-Y919 WeakPolarHBondContact O-CD1 3.42Å; W915-Y919 PolarHBondContact O-N 2.99Å; R916-Y919 WeakPolarHBondContact O-CD1 3.42Å; R916-Y919 WeakPolarHBondContact O-CE1 3.46Å
920	N	92.6	Very high	93	Very high	12 Å²	12	38 Å²	38	6%	0.064	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	1.7	176.5	-66.2	118.1	0	0	0	114.4	W842 C843 L918 L1100	W842-N920 PolarHBondContact NE1-ND2 3.19Å; C843-N920 PolarHBondContact N-O 3.43Å; C843-N920 WeakPolarHBondContact O-CA 3.13Å; C843-N920 PolarHBondContact O-ND2 3.15Å; C843-N920 PolarHBondContact SG-O 3.09Å; L918-N920 PolarHBondContact O-N 2.79Å; N920-L1100 HydrophobicContact CB-CB 4.48Å; N920-L1100 PolarHBondContact OD1-O 3.35Å
921	L	93.5	Very high	93	Very high	3 Å²	3	38.1 Å²	38.1	2%	0.016	18%	0.179	C	C	.	.	S	Bend	trans	-105.6	135.7	-175.9	-64.1	172.5	0	0	0	111.1	C843 R846 V886 M887 R890 L918 I924 L1100	C843-L921 VanDerWaalsContact SG-C 3.58Å; R846-L921 PolarHBondContact NH2-O 2.91Å; V886-L921 HydrophobicContact CB-CD1 3.95Å; V886-L921 HydrophobicContact CG1-CB 4.28Å; V886-L921 HydrophobicContact CG1-CD1 3.62Å; M887-L921 HydrophobicContact CG-CD1 4.31Å; R890-L921 HydrophobicContact CB-CD2 4.2Å; R890-L921 HydrophobicContact CG-CD2 4.4Å; L918-L921 HydrophobicContact CD2-CD1 4.28Å; L918-L921 PolarHBondContact O-N 3.32Å; L921-I924 HydrophobicContact CB-CD1 3.85Å; L921-L1100 HydrophobicContact CD2-CD2 4.05Å
922	P	93.5	Very high	93	Very high	4 Å²	4	41.2 Å²	41.2	3%	0.026	20%	0.195	C	C	.	.	S	Bend	trans	-80.6	166.2	-175.1	31.7	-35.4	0	0	0	113.1	H841 C843 R890 Y896 L899 I924	H841-P922 HydrophobicContact CB-CG 4.02Å; C843-P922 HydrophobicContact CB-CB 4.48Å; R890-P922 PolarHBondContact NE-O 3.45Å; R890-P922 PolarHBondContact NH2-O 2.79Å; Y896-P922 HydrophobicContact CE2-CB 4.02Å; Y896-P922 HydrophobicContact CE2-CG 4.16Å; L899-P922 HydrophobicContact CD1-CG 4.31Å; P922-I924 PolarHBondContact O-N 3.39Å
923	K	93.5	Very high	93.1	Very high	45 Å²	45	38.7 Å²	38.7	20%	0.196	19%	0.188	C	C	.	.	S	Bend	trans	54.9	48.2	171.8	-65.3	-178.1	168.2	-177.8	0	114.8	R890 Y896 L899 M902	R890-K923 PolarHBondContact NH2-O 2.89Å; Y896-K923 PolarHBondContact O-NZ 3.45Å; L899-K923 HydrophobicContact CB-CD 3.87Å; L899-K923 WeakPolarHBondContact O-CD 3.36Å; L899-K923 PolarHBondContact O-NZ 3.17Å; M902-K923 PolarHBondContact N-O 3.47Å
924	I	95	Very high	93.2	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	131.4	174	-53	172.2	0	0	0	107.7	V886 I904 W915 L918 L921 P922	V886-I924 HydrophobicContact CG1-CD1 3.83Å; V886-I924 HydrophobicContact CG1-CG1 4.42Å; I904-I924 HydrophobicContact CD1-CG2 4.19Å; W915-I924 HydrophobicContact CH2-CB 4.44Å; W915-I924 HydrophobicContact CH2-CG2 4.33Å; W915-I924 HydrophobicContact CZ3-CG2 3.99Å; L918-I924 HydrophobicContact CB-CD1 4.41Å; L921-I924 HydrophobicContact CB-CD1 3.85Å; P922-I924 PolarHBondContact O-N 3.39Å
925	S	94.9	Very high	93.3	Very high	15 Å²	15	41.5 Å²	41.5	11%	0.105	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	151	171.3	-63.1	0	0	0	0	109.9	C851 H901 M902 V903 I904	C851-S925 CarbonylContact O-C 3.34Å; C851-S925 WeakPolarHBondContact O-CA 3.46Å; H901-S925 PolarHBondContact NE2-OG 3.04Å; M902-S925 PolarHBondContact O-N 2.99Å; V903-S925 CarbonylContact C-O 3.2Å; V903-S925 VanDerWaalsContact CA-O 3.31Å; V903-S925 WeakPolarHBondContact CA-O 3.49Å; I904-S925 PolarHBondContact N-O 3.19Å
926	I	95.7	Very high	93.3	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	128	-179.2	-64	168.9	0	0	0	107.5	I848 C851 V852 L853 I904 L911 W915	I848-I926 HydrophobicContact CD1-CD1 4.04Å; I848-I926 HydrophobicContact CG1-CD1 3.86Å; C851-I926 PolarHBondContact O-N 3.32Å; V852-I926 CarbonylContact C-O 3.42Å; V852-I926 WeakPolarHBondContact CA-O 3.42Å; V852-I926 HydrophobicContact CG2-CB 4.2Å; V852-I926 HydrophobicContact CG2-CG2 4.31Å; L853-I926 PolarHBondContact N-O 3.11Å; I904-I926 CarbonylContact O-C 3.44Å; I904-I926 WeakPolarHBondContact O-CA 3.23Å; L911-I926 HydrophobicContact CB-CD1 4.45Å; L911-I926 HydrophobicContact CD1-CB 4.46Å; L911-I926 HydrophobicContact CD1-CD1 4.16Å; L911-I926 HydrophobicContact CD1-CG1 4.2Å; L911-I926 HydrophobicContact CD1-CG2 3.46Å; L911-I926 VanDerWaalsContact CD1-CG2 3.46Å; W915-I926 HydrophobicContact CE3-CD1 3.86Å; W915-I926 HydrophobicContact CZ3-CD1 3.76Å; W915-I926 HydrophobicContact CZ3-CG1 4.47Å
927	L	95	Very high	93.6	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	116	167.5	175.8	63.2	0	0	0	108.1	L853 A858 V903 I904 V905 G906 G929 D936 V940	L853-L927 VanDerWaalsContact O-CD1 3.26Å; L853-L927 WeakPolarHBondContact O-CD1 3.35Å; A858-L927 HydrophobicContact CB-CD1 4.3Å; V903-L927 HydrophobicContact CG1-CB 4.4Å; I904-L927 PolarHBondContact O-N 3.41Å; V905-L927 HydrophobicContact CG2-CB 4.33Å; V905-L927 HydrophobicContact CG2-CD2 4.36Å; G906-L927 PolarHBondContact N-O 3.2Å; L927-G929 PolarHBondContact O-N 3.24Å; L927-G929 VanDerWaalsContact O-N 3.12Å; L927-D936 HydrophobicContact CD2-CB 3.91Å; L927-V940 HydrophobicContact CB-CG1 4.38Å; L927-V940 HydrophobicContact CD2-CG1 3.43Å; L927-V940 VanDerWaalsContact CD2-CG1 3.43Å
928	Q	91.7	Very high	93.7	Very high	112 Å²	112	34 Å²	34	52%	0.523	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	107.5	172.1	-175.1	-179.9	1.7	0	0	108.9	I908	I908-Q928 HydrophobicContact CB-CG 4.32Å; I908-Q928 HydrophobicContact CG2-CG 4.24Å
929	G	89.5	Confident	93.7	Very high	23 Å²	23	34.1 Å²	34.1	24%	0.237	18%	0.176	C	C	.	.	S	Bend	trans	-179.5	-177.4	-174.7	0	0	0	0	0	112.3	G906 L927	G906-G929 CarbonylContact C-O 3.57Å; G906-G929 WeakPolarHBondContact CA-O 3.33Å; G906-G929 PolarHBondContact N-O 2.91Å; G906-G929 PolarHBondContact O-N 3.06Å; L927-G929 PolarHBondContact O-N 3.24Å; L927-G929 VanDerWaalsContact O-N 3.12Å
930	S	93	Very high	93.7	Very high	51 Å²	51	30.9 Å²	30.9	36%	0.357	16%	0.163	S	C	.	.			trans	-107.8	134.9	176.7	177.2	0	0	0	0	110.1	L932 S933 D936	S930-L932 PolarHBondContact O-N 2.95Å; S930-L932 VanDerWaalsContact O-N 3.12Å; S930-L932 PolarHBondContact OG-N 3.19Å; S930-S933 VanDerWaalsContact O-CB 3.28Å; S930-S933 WeakPolarHBondContact O-CB 3.33Å; S930-S933 PolarHBondContact O-N 2.88Å; S930-D936 PolarHBondContact N-OD2 3.38Å
931	P	94	Very high	93.7	Very high	3 Å²	3	32.1 Å²	32.1	2%	0.019	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-18.4	171.9	-23.7	33.6	0	0	0	114.5	C870 F872 V905 S933 L937	C870-P931 HydrophobicContact CB-CB 3.66Å; C870-P931 HydrophobicContact CB-CG 3.93Å; F872-P931 HydrophobicContact CE1-CB 4.21Å; F872-P931 HydrophobicContact CE1-CG 4.22Å; F872-P931 HydrophobicContact CE2-CB 4Å; F872-P931 HydrophobicContact CE2-CG 4.24Å; F872-P931 HydrophobicContact CZ-CB 3.64Å; F872-P931 HydrophobicContact CZ-CG 4.02Å; V905-P931 HydrophobicContact CG1-CG 4.37Å; P931-S933 VanDerWaalsContact C-N 3.32Å; P931-L937 VanDerWaalsContact O-CD1 3.32Å; P931-L937 WeakPolarHBondContact O-CD1 3.4Å
932	L	95.3	Very high	93.6	Very high	65 Å²	65	32 Å²	32	34%	0.34	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-17.5	175.1	-63.1	171.7	0	0	0	112.7	F872 S930 R934 L971 A972 N975	F872-L932 HydrophobicContact CE1-CD1 4.09Å; F872-L932 HydrophobicContact CE1-CD2 4.34Å; F872-L932 HydrophobicContact CE1-CG 3.81Å; F872-L932 HydrophobicContact CZ-CD2 4.03Å; F872-L932 HydrophobicContact CZ-CG 3.93Å; S930-L932 PolarHBondContact O-N 2.95Å; S930-L932 VanDerWaalsContact O-N 3.12Å; S930-L932 PolarHBondContact OG-N 3.19Å; L932-R934 PolarHBondContact O-N 3.05Å; L932-L971 HydrophobicContact CD2-CB 4.17Å; L932-A972 HydrophobicContact CD2-CB 4.15Å; L932-N975 PolarHBondContact O-ND2 2.98Å
933	S	96	Very high	93.5	Very high	34 Å²	34	32.9 Å²	32.9	24%	0.238	17%	0.173	C	C	.	.			trans	-79	106.9	179.9	171.5	0	0	0	0	110.4	S930 P931 A935 D936 L937	S930-S933 VanDerWaalsContact O-CB 3.28Å; S930-S933 WeakPolarHBondContact O-CB 3.33Å; S930-S933 PolarHBondContact O-N 2.88Å; P931-S933 VanDerWaalsContact C-N 3.32Å; S933-A935 PolarHBondContact O-N 3.43Å; S933-A935 VanDerWaalsContact O-N 3.09Å; S933-D936 WeakPolarHBondContact CB-OD2 3.37Å; S933-D936 PolarHBondContact O-N 2.81Å; S933-D936 PolarHBondContact OG-N 2.8Å; S933-D936 PolarHBondContact OG-OD2 3.05Å; S933-L937 PolarHBondContact O-N 3.45Å; S933-L937 VanDerWaalsContact O-N 3.14Å
934	R	94.6	Very high	93.4	Very high	114 Å²	114	31.9 Å²	31.9	43%	0.43	17%	0.17	S	C	.	.	H	α-helix	trans	-55.4	-29.1	174.6	-68.1	-176.7	177.3	-171.7	-5.4	112.8	L932 R938 N975 M979	L932-R934 PolarHBondContact O-N 3.05Å; R934-R938 WeakPolarHBondContact O-CB 3.49Å; R934-R938 VanDerWaalsContact O-CG 3.29Å; R934-R938 WeakPolarHBondContact O-CG 3.16Å; R934-R938 PolarHBondContact O-N 3.46Å; R934-N975 PolarHBondContact NE-OD1 3.36Å; R934-N975 PolarHBondContact NH2-OD1 3.29Å; R934-M979 HydrophobicContact CB-CE 4.49Å; R934-M979 HydrophobicContact CG-CG 4.35Å; R934-M979 HydrophobicContact CG-SD 4.34Å
935	A	93.8	Very high	93.3	Very high	45 Å²	45	31.9 Å²	31.9	37%	0.372	17%	0.17	S	C	.	.	H	α-helix	trans	-67.1	-38	177.8	0	0	0	0	0	112.1	S933 A939	S933-A935 PolarHBondContact O-N 3.43Å; S933-A935 VanDerWaalsContact O-N 3.09Å; A935-A939 WeakPolarHBondContact O-CB 3.43Å; A935-A939 PolarHBondContact O-N 3.44Å; A935-A939 VanDerWaalsContact O-N 3.1Å
936	D	94.5	Very high	93.1	Very high	6 Å²	6	32.8 Å²	32.8	3%	0.032	17%	0.174	C	C	.	.	H	α-helix	trans	-72.8	-43	177.7	-62.8	-37	0	0	0	110.6	R855 V905 L927 S930 S933 R938 A939 V940	R855-D936 IonicContact CZ-OD1 3.89Å; R855-D936 IonicContact NE-OD1 3.51Å; R855-D936 PolarHBondContact NE-OD1 2.78Å; R855-D936 IonicContact NH2-OD1 3.96Å; R855-D936 PolarHBondContact NH2-OD1 3.17Å; R855-D936 IonicContact NH2-OD2 3.9Å; R855-D936 PolarHBondContact NH2-OD2 3.5Å; V905-D936 HydrophobicContact CG1-CB 4.49Å; L927-D936 HydrophobicContact CD2-CB 3.91Å; S930-D936 PolarHBondContact N-OD2 3.38Å; S933-D936 WeakPolarHBondContact CB-OD2 3.37Å; S933-D936 PolarHBondContact O-N 2.81Å; S933-D936 PolarHBondContact OG-N 2.8Å; S933-D936 PolarHBondContact OG-OD2 3.05Å; D936-R938 PolarHBondContact O-N 3.27Å; D936-A939 WeakPolarHBondContact O-CB 3.38Å; D936-A939 PolarHBondContact O-N 3.32Å; D936-A939 VanDerWaalsContact O-N 3.1Å; D936-V940 PolarHBondContact O-N 3.35Å
937	L	94.2	Very high	93	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-62.5	-37.8	175.6	-62.4	178.7	0	0	0	113.2	P931 S933 V940 I942 I976 M979	P931-L937 VanDerWaalsContact O-CD1 3.32Å; P931-L937 WeakPolarHBondContact O-CD1 3.4Å; S933-L937 PolarHBondContact O-N 3.45Å; S933-L937 VanDerWaalsContact O-N 3.14Å; L937-V940 VanDerWaalsContact O-CG2 3.23Å; L937-V940 WeakPolarHBondContact O-CG2 3.32Å; L937-I942 HydrophobicContact CB-CG2 4.28Å; L937-I942 HydrophobicContact CD2-CD1 4.04Å; L937-I942 WeakPolarHBondContact O-CB 3.37Å; L937-I942 WeakPolarHBondContact O-CG2 3.45Å; L937-I942 PolarHBondContact O-N 2.83Å; L937-I976 HydrophobicContact CD1-CD1 4.45Å; L937-I976 HydrophobicContact CD1-CG1 3.71Å; L937-M979 HydrophobicContact CB-CE 4.14Å; L937-M979 HydrophobicContact CB-SD 4.12Å; L937-M979 HydrophobicContact CD1-SD 3.9Å
938	R	93	Very high	93.1	Very high	109 Å²	109	33 Å²	33	41%	0.411	18%	0.175	S	C	.	.	H	α-helix	trans	-68.2	-36.8	172.3	-74.3	-175.2	-172.7	-78	3.2	112.1	R934 D936 V940 N941 M979 Q980	R934-R938 WeakPolarHBondContact O-CB 3.49Å; R934-R938 VanDerWaalsContact O-CG 3.29Å; R934-R938 WeakPolarHBondContact O-CG 3.16Å; R934-R938 PolarHBondContact O-N 3.46Å; D936-R938 PolarHBondContact O-N 3.27Å; R938-V940 VanDerWaalsContact C-N 3.27Å; R938-V940 PolarHBondContact O-N 2.88Å; R938-N941 PolarHBondContact O-N 3.17Å; R938-N941 VanDerWaalsContact O-N 3.14Å; R938-M979 HydrophobicContact CG-CE 3.49Å; R938-M979 VanDerWaalsContact CG-CE 3.49Å; R938-Q980 VanDerWaalsContact CZ-O 3.26Å; R938-Q980 PolarHBondContact NH1-O 3.42Å; R938-Q980 PolarHBondContact NH2-O 3.41Å
939	A	92.5	Very high	93.3	Very high	5 Å²	5	27.6 Å²	27.6	4%	0.041	15%	0.15	C	C	.	.	H	α-helix	trans	-66.2	-29.2	-179.4	0	0	0	0	0	113	R855 A858 K859 A935 D936 N941	R855-A939 HydrophobicContact CG-CB 3.5Å; R855-A939 VanDerWaalsContact CG-CB 3.5Å; A858-A939 CarbonylContact C-O 3.53Å; A858-A939 VanDerWaalsContact C-O 3.24Å; A858-A939 HydrophobicContact CB-CB 4.37Å; K859-A939 WeakPolarHBondContact CA-O 3.03Å; K859-A939 PolarHBondContact N-O 3.01Å; A935-A939 WeakPolarHBondContact O-CB 3.43Å; A935-A939 PolarHBondContact O-N 3.44Å; A935-A939 VanDerWaalsContact O-N 3.1Å; D936-A939 WeakPolarHBondContact O-CB 3.38Å; D936-A939 PolarHBondContact O-N 3.32Å; D936-A939 VanDerWaalsContact O-N 3.1Å; A939-N941 VanDerWaalsContact C-N 3.3Å
940	V	92.7	Very high	93.7	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	7.3	175	-56.9	0	0	0	0	113.7	H866 V868 V903 V905 L927 D936 L937 R938 I942	H866-V940 PolarHBondContact CE1-O 2.91Å; H866-V940 PolarHBondContact NE2-O 3.05Å; V868-V940 HydrophobicContact CG1-CG2 4.07Å; V868-V940 HydrophobicContact CG2-CG2 4.1Å; V903-V940 HydrophobicContact CG1-CB 4.43Å; V903-V940 HydrophobicContact CG1-CG1 3.77Å; V905-V940 HydrophobicContact CG2-CG1 4.13Å; L927-V940 HydrophobicContact CB-CG1 4.38Å; L927-V940 HydrophobicContact CD2-CG1 3.43Å; L927-V940 VanDerWaalsContact CD2-CG1 3.43Å; D936-V940 PolarHBondContact O-N 3.35Å; L937-V940 VanDerWaalsContact O-CG2 3.23Å; L937-V940 WeakPolarHBondContact O-CG2 3.32Å; R938-V940 VanDerWaalsContact C-N 3.27Å; R938-V940 PolarHBondContact O-N 2.88Å; V940-I942 HydrophobicContact CG2-CB 4.43Å; V940-I942 PolarHBondContact O-N 3.46Å
941	N	91.7	Very high	93.8	Very high	38 Å²	38	24.1 Å²	24.1	20%	0.203	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.6	52.7	-176.8	-57.8	-43.2	0	0	0	112.6	H866 R938 A939 N943 N944	H866-N941 PolarHBondContact CE1-O 3.31Å; R938-N941 PolarHBondContact O-N 3.17Å; R938-N941 VanDerWaalsContact O-N 3.14Å; A939-N941 VanDerWaalsContact C-N 3.3Å; N941-N943 PolarHBondContact O-N 3.29Å; N941-N943 VanDerWaalsContact O-N 3.09Å; N941-N944 HydrophobicContact CB-CB 4.45Å; N941-N944 PolarHBondContact O-N 3.26Å
942	I	92.7	Very high	93.7	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-56.7	-25.1	-178.7	-168.1	165	0	0	0	113.6	L937 V940 N944 C945 C948 I976 M979 F981 V1017	L937-I942 HydrophobicContact CB-CG2 4.28Å; L937-I942 HydrophobicContact CD2-CD1 4.04Å; L937-I942 WeakPolarHBondContact O-CB 3.37Å; L937-I942 WeakPolarHBondContact O-CG2 3.45Å; L937-I942 PolarHBondContact O-N 2.83Å; V940-I942 HydrophobicContact CG2-CB 4.43Å; V940-I942 PolarHBondContact O-N 3.46Å; I942-N944 PolarHBondContact O-N 3.19Å; I942-C945 PolarHBondContact O-N 3.44Å; I942-C945 PolarHBondContact O-SG 3.33Å; I942-C948 HydrophobicContact CD1-CB 4.28Å; I942-I976 HydrophobicContact CD1-CD1 3.84Å; I942-I976 HydrophobicContact CD1-CG1 3.93Å; I942-I976 HydrophobicContact CD1-CG2 3.96Å; I942-M979 HydrophobicContact CG2-CE 4.33Å; I942-F981 HydrophobicContact CG2-CE1 3.84Å; I942-F981 HydrophobicContact CG2-CZ 3.57Å; I942-V1017 HydrophobicContact CG1-CG1 4.05Å
943	N	90.9	Very high	93.4	Very high	23 Å²	23	22.2 Å²	22.2	12%	0.123	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	-68.4	-14.6	174.6	59.6	-42	0	0	0	114.6	N941 F981 V1011	N941-N943 PolarHBondContact O-N 3.29Å; N941-N943 VanDerWaalsContact O-N 3.09Å; N943-F981 HydrophobicContact CB-CB 4.29Å; N943-F981 HydrophobicContact CB-CD1 3.65Å; N943-F981 HydrophobicContact CB-CD2 3.66Å; N943-F981 HydrophobicContact CB-CE1 3.81Å; N943-F981 HydrophobicContact CB-CE2 3.83Å; N943-F981 HydrophobicContact CB-CG 3.58Å; N943-F981 HydrophobicContact CB-CZ 3.92Å; N943-V1011 PolarHBondContact O-N 3.4Å
944	N	90.4	Very high	92.9	Very high	24 Å²	24	24.9 Å²	24.9	13%	0.128	12%	0.119	C	C	.	.	G	3₁₀ helix	trans	-110.9	8	178.2	-61.2	-6.4	0	0	0	112.1	N864 G865 N941 I942 S1010	N864-N944 PolarHBondContact OD1-O 3.17Å; G865-N944 PolarHBondContact N-O 3.32Å; G865-N944 VanDerWaalsContact N-O 3.17Å; N941-N944 HydrophobicContact CB-CB 4.45Å; N941-N944 PolarHBondContact O-N 3.26Å; I942-N944 PolarHBondContact O-N 3.19Å; N944-S1010 WeakPolarHBondContact OD1-CA 3.49Å; N944-S1010 VanDerWaalsContact OD1-CB 3.28Å; N944-S1010 WeakPolarHBondContact OD1-CB 3.28Å; N944-S1010 PolarHBondContact OD1-OG 3.19Å
945	C	92.3	Very high	91.9	Very high	1 Å²	1	22 Å²	22	1%	0.007	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	150.5	179.2	81.3	0	0	0	0	111.2	H866 V868 I942	H866-C945 CarbonylContact O-C 3.51Å; H866-C945 WeakPolarHBondContact O-CA 3.42Å; H866-C945 WeakPolarHBondContact O-CB 3.44Å; V868-C945 HydrophobicContact CG2-CB 3.88Å; I942-C945 PolarHBondContact O-N 3.44Å; I942-C945 PolarHBondContact O-SG 3.33Å
946	D	91.4	Very high	90.9	Very high	35 Å²	35	22.4 Å²	22.4	19%	0.187	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	-33.5	172.6	-91.5	0.7	0	0	0	112.2	H866 K900 R1008 P1018	H866-D946 PolarHBondContact O-N 3.05Å; K900-D946 HydrophobicContact CD-CB 4.29Å; K900-D946 WeakPolarHBondContact CD-OD2 3.26Å; K900-D946 WeakPolarHBondContact CE-OD2 3.18Å; K900-D946 IonicContact NZ-OD2 3.65Å; K900-D946 PolarHBondContact NZ-OD2 3.45Å; D946-R1008 PolarHBondContact O-NH1 3.33Å; D946-P1018 WeakPolarHBondContact O-CG 3.46Å
947	M	94.2	Very high	89.8	Confident	4 Å²	4	26.4 Å²	26.4	2%	0.02	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	134	177.8	-170.3	59.6	71.2	0	0	110.2	S590 C591 P594 V867 V868 V949 P1018 I1020	S590-M947 WeakPolarHBondContact O-CE 3.46Å; C591-M947 HydrophobicContact CB-CB 4.17Å; C591-M947 HydrophobicContact CB-CG 4.36Å; P594-M947 HydrophobicContact CB-CE 3.84Å; P594-M947 HydrophobicContact CG-CE 3.68Å; V867-M947 WeakPolarHBondContact CA-O 3.49Å; V868-M947 PolarHBondContact N-O 2.87Å; M947-V949 HydrophobicContact CG-CG2 4.03Å; M947-P1018 HydrophobicContact CE-CB 4.24Å; M947-P1018 HydrophobicContact SD-CB 4.06Å; M947-I1020 HydrophobicContact CG-CG2 4.14Å; M947-I1020 HydrophobicContact SD-CB 4.41Å; M947-I1020 HydrophobicContact SD-CG2 4.15Å
948	C	96.3	Very high	88.6	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	121.8	164.5	-174.5	0	0	0	0	109.6	V868 C870 I942 V1017 P1018 M1019 I1020	V868-C948 CarbonylContact O-C 3.41Å; V868-C948 WeakPolarHBondContact O-CA 3.34Å; C870-C948 VanDerWaalsContact SG-SG 3.65Å; I942-C948 HydrophobicContact CD1-CB 4.28Å; C948-V1017 HydrophobicContact CB-CG1 4.4Å; C948-P1018 PolarHBondContact N-O 3.32Å; C948-M1019 HydrophobicContact CB-CB 4.07Å; C948-M1019 CarbonylContact O-C 3.57Å; C948-M1019 WeakPolarHBondContact O-CA 3.33Å; C948-I1020 PolarHBondContact O-N 2.92Å
949	V	97.4	Very high	87.7	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	124.3	179.2	-176.7	0	0	0	0	108.8	I587 C591 V867 V868 V869 C870 F885 M947 L951 I1020	I587-V949 HydrophobicContact CG2-CB 4.46Å; I587-V949 HydrophobicContact CG2-CG1 3.42Å; I587-V949 VanDerWaalsContact CG2-CG1 3.42Å; I587-V949 HydrophobicContact CG2-CG2 4.17Å; C591-V949 WeakPolarHBondContact SG-CG2 3.35Å; V867-V949 HydrophobicContact CG1-CG2 4.21Å; V868-V949 PolarHBondContact O-N 3.16Å; V869-V949 CarbonylContact C-O 3.58Å; V869-V949 WeakPolarHBondContact CA-O 3.31Å; C870-V949 PolarHBondContact N-O 3.35Å; F885-V949 HydrophobicContact CE2-CG1 4.3Å; F885-V949 HydrophobicContact CE2-CG2 4.07Å; F885-V949 HydrophobicContact CZ-CB 4.36Å; F885-V949 HydrophobicContact CZ-CG1 4.43Å; F885-V949 HydrophobicContact CZ-CG2 3.79Å; M947-V949 HydrophobicContact CG-CG2 4.03Å; V949-L951 HydrophobicContact CG1-CD1 4.31Å; V949-L951 HydrophobicContact CG1-CD2 3.77Å; V949-L951 HydrophobicContact CG1-CG 3.83Å; V949-I1020 HydrophobicContact CB-CG2 4.25Å; V949-I1020 HydrophobicContact CG1-CG2 4.16Å; V949-I1020 HydrophobicContact CG2-CG2 3.82Å
950	I	97.1	Very high	86.9	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	116.2	177.7	-57.4	171.7	0	0	0	108.6	C870 F872 A969 A972 I976 I1020 T1021 E1022	C870-I950 HydrophobicContact CB-CB 4.47Å; C870-I950 HydrophobicContact CB-CG1 4.04Å; F872-I950 HydrophobicContact CD2-CG2 4.32Å; F872-I950 HydrophobicContact CE2-CG2 4.04Å; I950-A969 HydrophobicContact CG2-CB 3.91Å; I950-A972 HydrophobicContact CD1-CB 4.16Å; I950-A972 HydrophobicContact CG2-CB 4.36Å; I950-I976 HydrophobicContact CD1-CD1 4.18Å; I950-I1020 PolarHBondContact N-O 3.21Å; I950-T1021 HydrophobicContact CB-CG2 4.18Å; I950-T1021 HydrophobicContact CG2-CG2 4.25Å; I950-E1022 PolarHBondContact O-N 3.44Å
951	L	95.1	Very high	86.3	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	144.8	-179.6	-56.2	177.3	0	0	0	110.4	L584 I587 V869 C870 L871 F872 I880 L882 V949 E1022	L584-L951 HydrophobicContact CD2-CD1 4.01Å; L584-L951 HydrophobicContact CD2-CD2 4.24Å; I587-L951 HydrophobicContact CD1-CD2 3.95Å; V869-L951 HydrophobicContact CG1-CD1 4.02Å; C870-L951 PolarHBondContact O-N 3.25Å; L871-L951 HydrophobicContact CD1-CB 4.28Å; F872-L951 PolarHBondContact N-O 3.38Å; I880-L951 HydrophobicContact CD1-CB 4.23Å; L882-L951 HydrophobicContact CD2-CD1 4.03Å; V949-L951 HydrophobicContact CG1-CD1 4.31Å; V949-L951 HydrophobicContact CG1-CD2 3.77Å; V949-L951 HydrophobicContact CG1-CG 3.83Å; L951-E1022 HydrophobicContact CD2-CB 4.12Å; L951-E1022 WeakPolarHBondContact CD2-OE2 3.34Å
952	S	91.1	Very high	85.6	Confident	22 Å²	22	42.1 Å²	42.1	15%	0.154	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	125.7	173.1	-173.6	0	0	0	0	110.8	R954	S952-R954 PolarHBondContact OG-N 2.83Å
953	A	89	Confident	85.2	Confident	7 Å²	7	45 Å²	45	6%	0.058	26%	0.262	C	S	.	.			trans	-95.4	-7.9	170.3	0	0	0	0	0	112.1	F872 A873 P878 I880 Y910	F872-A953 PolarHBondContact O-N 3.26Å; A873-A953 HydrophobicContact CB-CB 3.65Å; P878-A953 WeakPolarHBondContact CD-O 3.39Å; I880-A953 HydrophobicContact CD1-CB 3.67Å; I880-A953 HydrophobicContact CG1-CB 3.62Å; Y910-A953 HydrophobicContact CE2-CB 4.07Å
954	R	85.4	Confident	85	Confident	90 Å²	90	47.9 Å²	47.9	34%	0.34	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-74.3	133.4	-171.9	-73.6	-173.3	175.5	168.3	1.7	110.8	D874 S952 E968	D874-R954 VanDerWaalsContact CG-NE 3.25Å; D874-R954 IonicContact OD1-CZ 3.74Å; D874-R954 VanDerWaalsContact OD1-CZ 3.24Å; D874-R954 IonicContact OD1-NE 3.88Å; D874-R954 PolarHBondContact OD1-NE 3.19Å; D874-R954 VanDerWaalsContact OD1-NE 3.09Å; D874-R954 IonicContact OD1-NH2 2.9Å; D874-R954 PolarHBondContact OD1-NH2 3.23Å; D874-R954 WeakPolarHBondContact OD2-CD 3.33Å; D874-R954 IonicContact OD2-CZ 2.88Å; D874-R954 IonicContact OD2-NE 2.7Å; D874-R954 PolarHBondContact OD2-NE 3.02Å; D874-R954 IonicContact OD2-NH2 3.89Å; S952-R954 PolarHBondContact OG-N 2.83Å; R954-E968 VanDerWaalsContact CD-OE2 3.29Å; R954-E968 WeakPolarHBondContact CD-OE2 3.49Å; R954-E968 IonicContact CZ-OE1 3.36Å; R954-E968 IonicContact CZ-OE2 3.17Å; R954-E968 IonicContact NE-OE2 3.8Å; R954-E968 IonicContact NH1-OE1 3.34Å; R954-E968 PolarHBondContact NH1-OE1 3.05Å; R954-E968 IonicContact NH1-OE2 3.27Å; R954-E968 PolarHBondContact NH1-OE2 3.15Å
955	V	74.9	Confident	84.8	Confident	53 Å²	53	47.8 Å²	47.8	32%	0.321	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-80.6	124.9	175.4	174.4	0	0	0	0	108.2	P524 P878 N957	P524-V955 HydrophobicContact CB-CG1 3.6Å; P878-V955 HydrophobicContact CG-CG2 3.62Å; V955-N957 PolarHBondContact O-N 3.05Å
956	P	71.5	Confident	84.7	Confident	54 Å²	54	47.9 Å²	47.9	35%	0.351	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-59.2	135.5	171.8	-20.2	31.8	0	0	0	109.9	A965	P956-A965 HydrophobicContact CB-CB 4.25Å; P956-A965 HydrophobicContact CG-CB 3.73Å
957	N	72	Confident	84.7	Confident	89 Å²	89	50.5 Å²	50.5	48%	0.476	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-61.4	131.8	172.2	-75.6	-38.5	0	0	0	108.5	V955 S959 E960	V955-N957 PolarHBondContact O-N 3.05Å; N957-S959 PolarHBondContact O-N 2.66Å; N957-E960 HydrophobicContact CB-CB 4.16Å; N957-E960 HydrophobicContact CB-CG 3.86Å; N957-E960 PolarHBondContact ND2-OE1 2.98Å; N957-E960 WeakPolarHBondContact O-CB 3.48Å; N957-E960 PolarHBondContact O-N 3.33Å
958	P	69.8	Low	84.6	Confident	125 Å²	125	52 Å²	52	81%	0.812	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-17.4	-179.6	-23.8	32.1	0	0	0	114.2
959	S	74.2	Confident	84.4	Confident	114 Å²	114	52.1 Å²	52.1	80%	0.797	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-12.5	175.2	58.6	0	0	0	0	114	N957	N957-S959 PolarHBondContact O-N 2.66Å
960	E	75	Confident	84.3	Confident	67 Å²	67	53 Å²	53	31%	0.313	30%	0.302	S	S	.	.	S	Bend	trans	-81.4	150.4	174.8	-78	177.9	-146.2	0	0	110	N957 K967	N957-E960 HydrophobicContact CB-CB 4.16Å; N957-E960 HydrophobicContact CB-CG 3.86Å; N957-E960 PolarHBondContact ND2-OE1 2.98Å; N957-E960 WeakPolarHBondContact O-CB 3.48Å; N957-E960 PolarHBondContact O-N 3.33Å; E960-K967 IonicContact OE2-NZ 3.56Å; E960-K967 PolarHBondContact OE2-NZ 2.96Å
961	D	79.8	Confident	84.2	Confident	85 Å²	85	57.8 Å²	57.8	46%	0.455	33%	0.327	S	S	.	.			trans	-61.6	131.8	174.8	-170.6	-40.9	0	0	0	109.6	T963 L964	D961-T963 PolarHBondContact O-N 3.3Å; D961-T963 VanDerWaalsContact O-N 3.11Å; D961-T963 WeakPolarHBondContact OD1-CB 3.49Å; D961-T963 WeakPolarHBondContact OD1-CG2 3.14Å; D961-T963 PolarHBondContact OD1-N 3.27Å; D961-T963 PolarHBondContact OD1-OG1 3.05Å; D961-T963 PolarHBondContact OD2-OG1 3.18Å; D961-L964 HydrophobicContact CB-CD1 4.14Å; D961-L964 HydrophobicContact CB-CG 4.16Å; D961-L964 WeakPolarHBondContact O-CB 3.34Å; D961-L964 PolarHBondContact O-N 3.18Å
962	P	77.2	Confident	84.2	Confident	92 Å²	92	57.8 Å²	57.8	60%	0.597	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-57.6	-23.7	178.2	24.2	-35.8	0	0	0	113.4	L964 A965 N1025	P962-L964 PolarHBondContact O-N 2.98Å; P962-A965 WeakPolarHBondContact O-CB 3.18Å; P962-A965 PolarHBondContact O-N 3.49Å; P962-N1025 PolarHBondContact O-ND2 2.93Å
963	T	83.8	Confident	84.3	Confident	60 Å²	60	56.8 Å²	56.8	37%	0.368	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-66.9	-23.6	173.2	60.5	0	0	0	0	112.6	D961 A965 N1028	D961-T963 PolarHBondContact O-N 3.3Å; D961-T963 VanDerWaalsContact O-N 3.11Å; D961-T963 WeakPolarHBondContact OD1-CB 3.49Å; D961-T963 WeakPolarHBondContact OD1-CG2 3.14Å; D961-T963 PolarHBondContact OD1-N 3.27Å; D961-T963 PolarHBondContact OD1-OG1 3.05Å; D961-T963 PolarHBondContact OD2-OG1 3.18Å; T963-A965 VanDerWaalsContact C-N 3.34Å; T963-N1028 PolarHBondContact O-ND2 3.16Å; T963-N1028 PolarHBondContact O-OD1 3Å
964	L	87.4	Confident	84.6	Confident	84 Å²	84	58.7 Å²	58.7	44%	0.44	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-86.2	-1.7	179.2	-63.3	176.5	0	0	0	113.9	D961 P962 D966 K967	D961-L964 HydrophobicContact CB-CD1 4.14Å; D961-L964 HydrophobicContact CB-CG 4.16Å; D961-L964 WeakPolarHBondContact O-CB 3.34Å; D961-L964 PolarHBondContact O-N 3.18Å; P962-L964 PolarHBondContact O-N 2.98Å; L964-D966 VanDerWaalsContact C-N 3.26Å; L964-D966 PolarHBondContact O-N 3.06Å; L964-K967 WeakPolarHBondContact O-CB 3.23Å; L964-K967 WeakPolarHBondContact O-CD 3.19Å; L964-K967 WeakPolarHBondContact O-CG 3.3Å; L964-K967 PolarHBondContact O-N 3.08Å
965	A	85.4	Confident	85.1	Confident	22 Å²	22	55.7 Å²	55.7	18%	0.182	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-39.5	-178.7	0	0	0	0	0	112.7	P956 P962 T963 V1024	P956-A965 HydrophobicContact CB-CB 4.25Å; P956-A965 HydrophobicContact CG-CB 3.73Å; P962-A965 WeakPolarHBondContact O-CB 3.18Å; P962-A965 PolarHBondContact O-N 3.49Å; T963-A965 VanDerWaalsContact C-N 3.34Å; A965-V1024 HydrophobicContact CB-CB 4.26Å; A965-V1024 HydrophobicContact CB-CG1 4.28Å
966	D	90.1	Very high	86	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.011	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	10.6	-172.6	-57.8	-59	0	0	0	114	L964 E968 A969 I970 L1023 V1024 N1025 N1028	L964-D966 VanDerWaalsContact C-N 3.26Å; L964-D966 PolarHBondContact O-N 3.06Å; D966-E968 PolarHBondContact O-N 3.38Å; D966-E968 VanDerWaalsContact O-N 3.09Å; D966-A969 PolarHBondContact O-N 2.83Å; D966-A969 VanDerWaalsContact O-N 3.09Å; D966-I970 HydrophobicContact CB-CD1 3.92Å; D966-I970 HydrophobicContact CB-CG1 4.25Å; D966-I970 WeakPolarHBondContact O-CG1 3.29Å; D966-I970 PolarHBondContact O-N 3.18Å; D966-L1023 HydrophobicContact CB-CD2 4.13Å; D966-V1024 VanDerWaalsContact OD1-CB 3.32Å; D966-V1024 WeakPolarHBondContact OD1-CB 3.17Å; D966-V1024 WeakPolarHBondContact OD1-CG2 3.42Å; D966-V1024 PolarHBondContact OD1-N 3.04Å; D966-V1024 PolarHBondContact OD2-N 3.32Å; D966-N1025 PolarHBondContact OD2-N 3.15Å; D966-N1028 HydrophobicContact CB-CB 4.45Å; D966-N1028 PolarHBondContact OD2-ND2 2.98Å
967	K	91.6	Very high	86.9	Confident	91 Å²	91	52.2 Å²	52.2	40%	0.396	30%	0.295	S	S	.	.	H	α-helix	trans	-52	-40.5	-170.9	67.9	-166.8	172.5	-160	0	113.5	E960 L964 L971	E960-K967 IonicContact OE2-NZ 3.56Å; E960-K967 PolarHBondContact OE2-NZ 2.96Å; L964-K967 WeakPolarHBondContact O-CB 3.23Å; L964-K967 WeakPolarHBondContact O-CD 3.19Å; L964-K967 WeakPolarHBondContact O-CG 3.3Å; L964-K967 PolarHBondContact O-N 3.08Å; K967-L971 VanDerWaalsContact O-CB 3.28Å; K967-L971 WeakPolarHBondContact O-CB 3.34Å; K967-L971 WeakPolarHBondContact O-CD1 3.4Å; K967-L971 WeakPolarHBondContact O-CG 3.35Å; K967-L971 PolarHBondContact O-N 3.06Å
968	E	92	Very high	87.9	Confident	36 Å²	36	50.9 Å²	50.9	17%	0.168	30%	0.296	C	S	.	.	H	α-helix	trans	-77.5	-37.4	-177.5	-60.2	-169.3	118.1	0	0	113	F872 R954 D966 L971 A972	F872-E968 HydrophobicContact CD1-CB 3.9Å; F872-E968 HydrophobicContact CD2-CB 4.34Å; F872-E968 HydrophobicContact CE1-CB 3.98Å; F872-E968 HydrophobicContact CE2-CB 4.4Å; F872-E968 HydrophobicContact CG-CB 4.09Å; F872-E968 HydrophobicContact CZ-CB 4.23Å; R954-E968 VanDerWaalsContact CD-OE2 3.29Å; R954-E968 WeakPolarHBondContact CD-OE2 3.49Å; R954-E968 IonicContact CZ-OE1 3.36Å; R954-E968 IonicContact CZ-OE2 3.17Å; R954-E968 IonicContact NE-OE2 3.8Å; R954-E968 IonicContact NH1-OE1 3.34Å; R954-E968 PolarHBondContact NH1-OE1 3.05Å; R954-E968 IonicContact NH1-OE2 3.27Å; R954-E968 PolarHBondContact NH1-OE2 3.15Å; D966-E968 PolarHBondContact O-N 3.38Å; D966-E968 VanDerWaalsContact O-N 3.09Å; E968-L971 PolarHBondContact O-N 3.29Å; E968-A972 VanDerWaalsContact O-CB 3.27Å; E968-A972 WeakPolarHBondContact O-CB 3.46Å; E968-A972 PolarHBondContact O-N 3.04Å
969	A	93.6	Very high	89	Confident	2 Å²	2	45 Å²	45	2%	0.017	26%	0.258	C	S	.	.	H	α-helix	trans	-64.5	-45	177.6	0	0	0	0	0	110.7	I950 D966 A972 S973 T1021	I950-A969 HydrophobicContact CG2-CB 3.91Å; D966-A969 PolarHBondContact O-N 2.83Å; D966-A969 VanDerWaalsContact O-N 3.09Å; A969-A972 PolarHBondContact O-N 3.22Å; A969-S973 WeakPolarHBondContact O-CB 3.27Å; A969-S973 PolarHBondContact O-N 3.13Å; A969-T1021 HydrophobicContact CB-CG2 3.81Å
970	I	94.1	Very high	89.8	Confident	18 Å²	18	46.2 Å²	46.2	9%	0.092	25%	0.251	C	S	.	.	H	α-helix	trans	-63.3	-49.2	175.6	-62.6	164.4	0	0	0	110.5	D966 A972 S973 L974 N1028 F1031 L1032	D966-I970 HydrophobicContact CB-CD1 3.92Å; D966-I970 HydrophobicContact CB-CG1 4.25Å; D966-I970 WeakPolarHBondContact O-CG1 3.29Å; D966-I970 PolarHBondContact O-N 3.18Å; I970-A972 VanDerWaalsContact C-N 3.29Å; I970-A972 PolarHBondContact O-N 2.68Å; I970-S973 PolarHBondContact O-N 3.22Å; I970-L974 HydrophobicContact CG2-CD1 3.92Å; I970-L974 HydrophobicContact CG2-CG 4.34Å; I970-L974 WeakPolarHBondContact O-CG 3.22Å; I970-L974 PolarHBondContact O-N 3.11Å; I970-N1028 HydrophobicContact CD1-CB 4.04Å; I970-F1031 HydrophobicContact CD1-CB 4.28Å; I970-F1031 HydrophobicContact CD1-CD2 4.22Å; I970-F1031 HydrophobicContact CG2-CB 3.95Å; I970-L1032 HydrophobicContact CG1-CD2 4.38Å
971	L	94.8	Very high	90.3	Very high	101 Å²	101	43.9 Å²	43.9	53%	0.529	24%	0.24	S	C	.	.	H	α-helix	trans	-60.6	-38	178.7	-75.9	171.8	0	0	0	112.3	L932 K967 E968 N975	L932-L971 HydrophobicContact CD2-CB 4.17Å; K967-L971 VanDerWaalsContact O-CB 3.28Å; K967-L971 WeakPolarHBondContact O-CB 3.34Å; K967-L971 WeakPolarHBondContact O-CD1 3.4Å; K967-L971 WeakPolarHBondContact O-CG 3.35Å; K967-L971 PolarHBondContact O-N 3.06Å; E968-L971 PolarHBondContact O-N 3.29Å; L971-N975 WeakPolarHBondContact O-CB 3.46Å; L971-N975 PolarHBondContact O-N 3.44Å
972	A	95.4	Very high	90.3	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-65.2	-45.7	175.4	0	0	0	0	0	112	F872 L932 I950 E968 A969 I970 N975 I976	F872-A972 HydrophobicContact CE2-CB 3.65Å; F872-A972 HydrophobicContact CZ-CB 3.66Å; L932-A972 HydrophobicContact CD2-CB 4.15Å; I950-A972 HydrophobicContact CD1-CB 4.16Å; I950-A972 HydrophobicContact CG2-CB 4.36Å; E968-A972 VanDerWaalsContact O-CB 3.27Å; E968-A972 WeakPolarHBondContact O-CB 3.46Å; E968-A972 PolarHBondContact O-N 3.04Å; A969-A972 PolarHBondContact O-N 3.22Å; I970-A972 VanDerWaalsContact C-N 3.29Å; I970-A972 PolarHBondContact O-N 2.68Å; A972-N975 WeakPolarHBondContact O-CB 3.45Å; A972-N975 PolarHBondContact O-N 3.37Å; A972-I976 WeakPolarHBondContact O-CG1 3.04Å; A972-I976 PolarHBondContact O-N 3.34Å
973	S	94.6	Very high	89.5	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.007	26%	0.26	C	S	.	.	H	α-helix	trans	-58.4	-51.8	177	-174.3	0	0	0	0	111.3	A969 I970 N975 I976 K977 M1019	A969-S973 WeakPolarHBondContact O-CB 3.27Å; A969-S973 PolarHBondContact O-N 3.13Å; I970-S973 PolarHBondContact O-N 3.22Å; S973-N975 VanDerWaalsContact C-N 3.31Å; S973-N975 PolarHBondContact O-N 3.31Å; S973-I976 PolarHBondContact O-N 3.17Å; S973-K977 WeakPolarHBondContact O-CG 3.25Å; S973-K977 PolarHBondContact O-N 3.27Å; S973-M1019 PolarHBondContact OG-SD 3.39Å; S973-M1019 VanDerWaalsContact OG-SD 3.34Å
974	L	94.2	Very high	87.8	Confident	46 Å²	46	50.8 Å²	50.8	24%	0.241	28%	0.275	C	S	.	.	H	α-helix	trans	-62.2	-37.8	177.2	-66.6	177.3	0	0	0	112.2	I970 K977 A978	I970-L974 HydrophobicContact CG2-CD1 3.92Å; I970-L974 HydrophobicContact CG2-CG 4.34Å; I970-L974 WeakPolarHBondContact O-CG 3.22Å; I970-L974 PolarHBondContact O-N 3.11Å; L974-K977 PolarHBondContact O-N 2.9Å; L974-A978 WeakPolarHBondContact O-CB 3.27Å; L974-A978 PolarHBondContact O-N 3.31Å
975	N	95.3	Very high	85.3	Confident	27 Å²	27	52.5 Å²	52.5	14%	0.144	29%	0.289	C	S	.	.	H	α-helix	trans	-63.7	-43.6	177.6	-174.1	33	0	0	0	111.9	L932 R934 L971 A972 S973 A978 M979	L932-N975 PolarHBondContact O-ND2 2.98Å; R934-N975 PolarHBondContact NE-OD1 3.36Å; R934-N975 PolarHBondContact NH2-OD1 3.29Å; L971-N975 WeakPolarHBondContact O-CB 3.46Å; L971-N975 PolarHBondContact O-N 3.44Å; A972-N975 WeakPolarHBondContact O-CB 3.45Å; A972-N975 PolarHBondContact O-N 3.37Å; S973-N975 VanDerWaalsContact C-N 3.31Å; S973-N975 PolarHBondContact O-N 3.31Å; N975-A978 PolarHBondContact O-N 3.31Å; N975-M979 WeakPolarHBondContact O-CG 3.33Å; N975-M979 PolarHBondContact O-N 2.78Å
976	I	94.2	Very high	82.8	Confident	0 Å²	0	56 Å²	56	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-64.3	-48.1	175.6	-66	161.2	0	0	0	110.1	L937 I942 I950 A972 S973 A978 M979 G1014 V1017 M1019	L937-I976 HydrophobicContact CD1-CD1 4.45Å; L937-I976 HydrophobicContact CD1-CG1 3.71Å; I942-I976 HydrophobicContact CD1-CD1 3.84Å; I942-I976 HydrophobicContact CD1-CG1 3.93Å; I942-I976 HydrophobicContact CD1-CG2 3.96Å; I950-I976 HydrophobicContact CD1-CD1 4.18Å; A972-I976 WeakPolarHBondContact O-CG1 3.04Å; A972-I976 PolarHBondContact O-N 3.34Å; S973-I976 PolarHBondContact O-N 3.17Å; I976-A978 PolarHBondContact O-N 2.83Å; I976-M979 WeakPolarHBondContact O-CB 3.47Å; I976-M979 PolarHBondContact O-N 2.65Å; I976-G1014 WeakPolarHBondContact O-CA 3.25Å; I976-V1017 HydrophobicContact CG2-CB 4.12Å; I976-V1017 HydrophobicContact CG2-CG1 4.05Å; I976-V1017 HydrophobicContact CG2-CG2 4.39Å; I976-M1019 HydrophobicContact CB-CE 4.11Å; I976-M1019 HydrophobicContact CG2-CE 3.58Å
977	K	91.4	Very high	79.8	Confident	35 Å²	35	64.3 Å²	64.3	15%	0.152	35%	0.349	C	S	.	.	H	α-helix	trans	-56.6	-33.3	177.7	-72.3	-178.7	-178.3	178.9	0	112.4	S973 L974 G1014 T1015 M1019 L1032 D1033	S973-K977 WeakPolarHBondContact O-CG 3.25Å; S973-K977 PolarHBondContact O-N 3.27Å; L974-K977 PolarHBondContact O-N 2.9Å; K977-G1014 CarbonylContact O-C 3.28Å; K977-T1015 HydrophobicContact CB-CG2 4.35Å; K977-T1015 PolarHBondContact O-N 3.49Å; K977-M1019 HydrophobicContact CG-CE 3.79Å; K977-M1019 HydrophobicContact CG-SD 4.13Å; K977-L1032 PolarHBondContact NZ-O 3.32Å; K977-D1033 IonicContact NZ-OD1 3.68Å; K977-D1033 PolarHBondContact NZ-OD1 3.15Å
978	A	92.2	Very high	76.9	Confident	60 Å²	60	69.7 Å²	69.7	50%	0.496	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-1.1	177.8	0	0	0	0	0	115.2	L974 N975 I976	L974-A978 WeakPolarHBondContact O-CB 3.27Å; L974-A978 PolarHBondContact O-N 3.31Å; N975-A978 PolarHBondContact O-N 3.31Å; I976-A978 PolarHBondContact O-N 2.83Å
979	M	93	Very high	73.8	Confident	1 Å²	1	72.9 Å²	72.9	1%	0.005	39%	0.394	C	S	.	.			trans	-77.3	146.5	177.1	-69.1	177.2	67	0	0	111.7	R934 L937 R938 I942 N975 I976 F981 G1014	R934-M979 HydrophobicContact CB-CE 4.49Å; R934-M979 HydrophobicContact CG-CG 4.35Å; R934-M979 HydrophobicContact CG-SD 4.34Å; L937-M979 HydrophobicContact CB-CE 4.14Å; L937-M979 HydrophobicContact CB-SD 4.12Å; L937-M979 HydrophobicContact CD1-SD 3.9Å; R938-M979 HydrophobicContact CG-CE 3.49Å; R938-M979 VanDerWaalsContact CG-CE 3.49Å; I942-M979 HydrophobicContact CG2-CE 4.33Å; N975-M979 WeakPolarHBondContact O-CG 3.33Å; N975-M979 PolarHBondContact O-N 2.78Å; I976-M979 WeakPolarHBondContact O-CB 3.47Å; I976-M979 PolarHBondContact O-N 2.65Å; M979-F981 HydrophobicContact CB-CE2 4.02Å; M979-F981 HydrophobicContact CB-CZ 3.81Å; M979-F981 HydrophobicContact CE-CE1 3.74Å; M979-F981 HydrophobicContact CE-CZ 3.8Å; M979-F981 HydrophobicContact SD-CZ 4.36Å; M979-G1014 WeakPolarHBondContact O-CA 3.43Å; M979-G1014 PolarHBondContact O-N 2.85Å
980	Q	90.3	Very high	70.6	Confident	140 Å²	140	81.2 Å²	81.2	65%	0.654	43%	0.43	S	S	*	.	B	Isolated β-bridge	trans	-119.7	139.9	170.5	-68.6	177.1	-10	0	0	109.3	R938 L1013	R938-Q980 VanDerWaalsContact CZ-O 3.26Å; R938-Q980 PolarHBondContact NH1-O 3.42Å; R938-Q980 PolarHBondContact NH2-O 3.41Å; Q980-L1013 HydrophobicContact CG-CD1 4.05Å
981	F	87.1	Confident	67.4	Low	18 Å²	18	85.1 Å²	85.1	8%	0.079	46%	0.457	C	S	.	.			trans	-117	133.2	179.5	-54.2	-83.5	0	0	0	108.4	I942 N943 M979 S1012 V1017	I942-F981 HydrophobicContact CG2-CE1 3.84Å; I942-F981 HydrophobicContact CG2-CZ 3.57Å; N943-F981 HydrophobicContact CB-CB 4.29Å; N943-F981 HydrophobicContact CB-CD1 3.65Å; N943-F981 HydrophobicContact CB-CD2 3.66Å; N943-F981 HydrophobicContact CB-CE1 3.81Å; N943-F981 HydrophobicContact CB-CE2 3.83Å; N943-F981 HydrophobicContact CB-CG 3.58Å; N943-F981 HydrophobicContact CB-CZ 3.92Å; M979-F981 HydrophobicContact CB-CE2 4.02Å; M979-F981 HydrophobicContact CB-CZ 3.81Å; M979-F981 HydrophobicContact CE-CE1 3.74Å; M979-F981 HydrophobicContact CE-CZ 3.8Å; M979-F981 HydrophobicContact SD-CZ 4.36Å; F981-S1012 PolarHBondContact N-O 3.38Å; F981-V1017 HydrophobicContact CE2-CG2 4.31Å
982	E	79	Confident	64.3	Low	184 Å²	184	89 Å²	89	86%	0.86	47%	0.472	S	S	*	.			trans	-75	131.1	171.6	-67.7	178.6	177.1	0	0	108	A984	E982-A984 PolarHBondContact O-N 2.96Å
983	D	60.1	Low	61.3	Low	116 Å²	116	97.6 Å²	97.6	62%	0.62	51%	0.512	S	S	*	.			trans	-64.1	88.3	171.6	-70.7	-28.2	0	0	0	108.2	T985	D983-T985 PolarHBondContact O-N 2.66Å
984	A	48.8	Very low	58.3	Low	82 Å²	82	105.3 Å²	105.3	68%	0.678	55%	0.552	S	S	*	*			trans	-68.9	88.4	169.9	0	0	0	0	0	107.4	E982 S986	E982-A984 PolarHBondContact O-N 2.96Å; A984-S986 VanDerWaalsContact C-N 3.29Å; A984-S986 PolarHBondContact O-N 3.38Å; A984-S986 PolarHBondContact O-OG 3.47Å
985	T	33.3	Very low	55.3	Low	121 Å²	121	109.7 Å²	109.7	74%	0.742	58%	0.581	S	S	*	*			trans	-45.3	92.4	167.5	46.7	0	0	0	0	109.8	D983	D983-T985 PolarHBondContact O-N 2.66Å
986	S	34.1	Very low	52.1	Low	96 Å²	96	111 Å²	111	67%	0.671	60%	0.601	S	S	*	*			trans	-117.5	79.7	173.6	-53.8	0	0	0	0	106.7	A984 Y988	A984-S986 VanDerWaalsContact C-N 3.29Å; A984-S986 PolarHBondContact O-N 3.38Å; A984-S986 PolarHBondContact O-OG 3.47Å; S986-Y988 PolarHBondContact O-N 3.5Å
987	F	27.6	Very low	49	Very low	176 Å²	176	119.8 Å²	119.8	77%	0.772	65%	0.647	S	S	*	*			trans	-59.1	99.9	165.3	-88.1	-101.8	0	0	0	109
988	Y	30.7	Very low	46.1	Very low	204 Å²	204	121.1 Å²	121.1	80%	0.8	66%	0.661	S	S	*	*			trans	-113.1	85.6	139.1	-73.8	-74.9	0	0	0	106.6	S986 F990	S986-Y988 PolarHBondContact O-N 3.5Å; Y988-F990 VanDerWaalsContact C-N 3.26Å; Y988-F990 PolarHBondContact O-N 3Å
989	S	25.9	Very low	43.3	Very low	102 Å²	102	123.5 Å²	123.5	71%	0.713	67%	0.671	S	S	*	*			trans	-60.5	95.2	158	48	0	0	0	0	107.3
990	F	26.7	Very low	40.5	Very low	178 Å²	178	128.4 Å²	128.4	78%	0.781	69%	0.693	S	S	*	*			trans	-63.9	135.7	162.8	-86.8	-85.2	0	0	0	108	Y988 Q992	Y988-F990 VanDerWaalsContact C-N 3.26Å; Y988-F990 PolarHBondContact O-N 3Å; F990-Q992 PolarHBondContact O-N 2.94Å
991	P	26.9	Very low	37.5	Very low	99 Å²	99	123.6 Å²	123.6	64%	0.643	68%	0.681	S	S	*	*			trans	-57.4	124.8	178.5	-20.2	30.4	0	0	0	110	E993	P991-E993 PolarHBondContact O-N 3.31Å
992	Q	30.6	Very low	34.8	Very low	182 Å²	182	127.9 Å²	127.9	85%	0.85	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	19.5	-178.7	-156.2	166.5	0.3	0	0	113.3	F990	F990-Q992 PolarHBondContact O-N 2.94Å
993	E	31.4	Very low	32.5	Very low	181 Å²	181	123.8 Å²	123.8	85%	0.846	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	4.9	-171.5	-70.2	-168.8	157.3	0	0	114.8	P991	P991-E993 PolarHBondContact O-N 3.31Å
994	L	32.1	Very low	31.1	Very low	163 Å²	163	120 Å²	120	85%	0.853	68%	0.68	S	S	*	*	S	Bend	trans	-120.8	11.1	176.2	-95.8	125.7	0	0	0	115.3	G996	L994-G996 VanDerWaalsContact C-N 3.27Å; L994-G996 PolarHBondContact O-N 3.26Å
995	V	31.1	Very low	30.2	Very low	138 Å²	138	124.1 Å²	124.1	84%	0.836	69%	0.687	S	S	*	*	S	Bend	trans	-89.3	11.2	179.3	-175.1	0	0	0	0	112.6
996	G	27.5	Very low	30.3	Very low	55 Å²	55	124.2 Å²	124.2	57%	0.567	68%	0.682	S	S	*	*			trans	-125.5	107.7	172	0	0	0	0	0	109.4	L994	L994-G996 VanDerWaalsContact C-N 3.27Å; L994-G996 PolarHBondContact O-N 3.26Å
997	L	28.4	Very low	30.4	Very low	184 Å²	184	125.1 Å²	125.1	96%	0.963	68%	0.679	S	S	*	*	S	Bend	trans	158.3	50.2	152	-81.3	157.1	0	0	0	111.7
998	S	31.4	Very low	31.8	Very low	63 Å²	63	120.4 Å²	120.4	44%	0.441	66%	0.656	S	S	.	*			trans	-151.2	118.3	157.9	42.4	0	0	0	0	109	F1000 G1001	S998-F1000 PolarHBondContact O-N 3.44Å; S998-G1001 PolarHBondContact OG-O 3.15Å; S998-G1001 VanDerWaalsContact OG-O 3.14Å
999	P	33.7	Very low	33.1	Very low	110 Å²	110	115.8 Å²	115.8	71%	0.714	65%	0.651	S	S	*	*	S	Bend	trans	-69.3	-12.8	175.5	-9.8	24.8	0	0	0	112.3
1000	F	33.4	Very low	34.8	Very low	105 Å²	105	114 Å²	114	46%	0.461	64%	0.639	S	S	.	*	S	Bend	trans	-149.8	106.7	175.8	-65.6	-99.6	0	0	0	105.7	S998 Y1148	S998-F1000 PolarHBondContact O-N 3.44Å; F1000-Y1148 AromaticContact CD1-CD1 3.92Å; F1000-Y1148 HydrophobicContact CD1-CD1 3.92Å; F1000-Y1148 HydrophobicContact CD1-CE1 4.18Å; F1000-Y1148 AromaticContact CE1-CD1 3.15Å; F1000-Y1148 HydrophobicContact CE1-CD1 3.15Å; F1000-Y1148 AromaticContact CE1-CE1 3.53Å; F1000-Y1148 HydrophobicContact CE1-CE1 3.53Å; F1000-Y1148 HydrophobicContact CE1-CG 4.15Å; F1000-Y1148 AromaticContact CZ-CD1 3.72Å; F1000-Y1148 HydrophobicContact CZ-CD1 3.72Å; F1000-Y1148 AromaticContact CZ-CE1 3.74Å; F1000-Y1148 HydrophobicContact CZ-CE1 3.74Å
1001	G	28.4	Very low	37.4	Very low	39 Å²	39	106.1 Å²	106.1	40%	0.402	61%	0.605	S	S	.	*			trans	163.2	108.5	179.7	0	0	0	0	0	112	S998	S998-G1001 PolarHBondContact OG-O 3.15Å; S998-G1001 VanDerWaalsContact OG-O 3.14Å
1002	N	30.4	Very low	39.9	Very low	108 Å²	108	103.8 Å²	103.8	58%	0.578	59%	0.591	S	S	*	*			trans	60.2	86.2	163	-72.9	0.6	0	0	0	116.4	G1004	N1002-G1004 WeakPolarHBondContact O-CA 3.45Å; N1002-G1004 PolarHBondContact O-N 2.9Å
1003	T	30.7	Very low	42.5	Very low	98 Å²	98	97.5 Å²	97.5	60%	0.601	56%	0.563	S	S	*	*				-73.5	52.4	120.6	33	0	0	0	0	107.9	L1006	T1003-L1006 HydrophobicContact CG2-CD1 3.74Å; T1003-L1006 HydrophobicContact CG2-CG 4.36Å
1004	G	30.2	Very low	45.2	Very low	35 Å²	35	88.9 Å²	88.9	36%	0.361	52%	0.523	S	S	.	.				59.7	64	66.1	0	0	0	0	0	108.2	N1002 L1006	N1002-G1004 WeakPolarHBondContact O-CA 3.45Å; N1002-G1004 PolarHBondContact O-N 2.9Å; G1004-L1006 PolarHBondContact O-N 2.98Å
1005	M	30	Very low	47.7	Very low	170 Å²	170	83.3 Å²	83.3	84%	0.837	50%	0.496	S	S	*	.			trans	18.1	63.6	170.7	-78.2	176.8	56	0	0	111.6	L1007	M1005-L1007 PolarHBondContact O-N 3.47Å
1006	L	35.9	Very low	50.4	Low	122 Å²	122	79.2 Å²	79.2	64%	0.639	47%	0.467	S	S	*	.			trans	-73.3	94.2	171	-80.6	-179.2	0	0	0	101.8	T1003 G1004 R1008	T1003-L1006 HydrophobicContact CG2-CD1 3.74Å; T1003-L1006 HydrophobicContact CG2-CG 4.36Å; G1004-L1006 PolarHBondContact O-N 2.98Å; L1006-R1008 PolarHBondContact O-N 3.1Å
1007	L	36.4	Very low	53.4	Low	115 Å²	115	76.9 Å²	76.9	60%	0.602	44%	0.442	S	S	*	.			trans	-42.6	114.2	172.9	-94.4	93.4	0	0	0	105.5	N864 M1005 P1009	N864-L1007 WeakPolarHBondContact ND2-CD2 3.3Å; N864-L1007 VanDerWaalsContact ND2-CG 3.32Å; N864-L1007 WeakPolarHBondContact ND2-CG 3.47Å; M1005-L1007 PolarHBondContact O-N 3.47Å; L1007-P1009 WeakPolarHBondContact O-CD 3.18Å; L1007-P1009 VanDerWaalsContact O-N 3.12Å
1008	R	55.5	Low	56.4	Low	77 Å²	77	69.1 Å²	69.1	29%	0.291	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-55.4	125.7	170.2	-172	-178	-176	136.2	-3.7	105.7	D946 L1006 S1010 P1018	D946-R1008 PolarHBondContact O-NH1 3.33Å; L1006-R1008 PolarHBondContact O-N 3.1Å; R1008-S1010 PolarHBondContact O-N 3.31Å; R1008-P1018 VanDerWaalsContact NH2-CD 3.35Å
1009	P	57.8	Low	59.3	Low	108 Å²	108	66.6 Å²	66.6	70%	0.701	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-54.5	130.5	175.7	-22.9	31.9	0	0	0	108.3	L1007 V1011	L1007-P1009 WeakPolarHBondContact O-CD 3.18Å; L1007-P1009 VanDerWaalsContact O-N 3.12Å; P1009-V1011 PolarHBondContact O-N 2.91Å
1010	S	63.5	Low	62.3	Low	64 Å²	64	61.4 Å²	61.4	45%	0.448	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-54.4	130.6	174.7	-68.5	0	0	0	0	109.3	N944 R1008	N944-S1010 WeakPolarHBondContact OD1-CA 3.49Å; N944-S1010 VanDerWaalsContact OD1-CB 3.28Å; N944-S1010 WeakPolarHBondContact OD1-CB 3.28Å; N944-S1010 PolarHBondContact OD1-OG 3.19Å; R1008-S1010 PolarHBondContact O-N 3.31Å
1011	V	79.9	Confident	65.3	Low	12 Å²	12	56.4 Å²	56.4	7%	0.073	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-80.6	133.4	178.2	167	0	0	0	0	109.7	N943 P1009 L1013 Q1016 V1017	N943-V1011 PolarHBondContact O-N 3.4Å; P1009-V1011 PolarHBondContact O-N 2.91Å; V1011-L1013 WeakPolarHBondContact CG1-O 3.5Å; V1011-Q1016 HydrophobicContact CG1-CB 3.63Å; V1011-Q1016 HydrophobicContact CG1-CG 4.43Å; V1011-Q1016 HydrophobicContact CG2-CB 4.23Å; V1011-V1017 HydrophobicContact CG1-CG2 4.35Å
1012	S	79.9	Confident	68.4	Low	50 Å²	50	55.2 Å²	55.2	35%	0.35	31%	0.313	S	S	.	.	S	Bend	trans	-85	-32.4	176.9	59.6	0	0	0	0	112.9	F981	F981-S1012 PolarHBondContact N-O 3.38Å
1013	L	85.9	Confident	71.3	Confident	50 Å²	50	50.1 Å²	50.1	26%	0.262	29%	0.285	S	S	.	.	B	Isolated β-bridge	trans	-117.1	130.2	-177.6	-169.2	65.2	0	0	0	112.1	Q980 V1011 T1015 Q1016	Q980-L1013 HydrophobicContact CG-CD1 4.05Å; V1011-L1013 WeakPolarHBondContact CG1-O 3.5Å; L1013-T1015 HydrophobicContact CD2-CG2 4.29Å; L1013-T1015 WeakPolarHBondContact CD2-OG1 3.3Å; L1013-T1015 HydrophobicContact CG-CG2 4.37Å; L1013-T1015 WeakPolarHBondContact CG-OG1 3.48Å; L1013-T1015 PolarHBondContact O-N 3.21Å; L1013-Q1016 PolarHBondContact O-N 3.09Å
1014	G	86.7	Confident	74	Confident	0 Å²	0	47 Å²	47	0%	0	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-55.3	-25.3	-178.3	0	0	0	0	0	115.3	I976 K977 M979 Q1016 V1017	I976-G1014 WeakPolarHBondContact O-CA 3.25Å; K977-G1014 CarbonylContact O-C 3.28Å; M979-G1014 WeakPolarHBondContact O-CA 3.43Å; M979-G1014 PolarHBondContact O-N 2.85Å; G1014-Q1016 PolarHBondContact O-N 3.48Å; G1014-V1017 WeakPolarHBondContact O-CB 3.11Å; G1014-V1017 WeakPolarHBondContact O-CG2 3.22Å; G1014-V1017 PolarHBondContact O-N 3.31Å; G1014-V1017 VanDerWaalsContact O-N 3.13Å
1015	T	86.1	Confident	76.6	Confident	46 Å²	46	46.9 Å²	46.9	28%	0.282	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-63.2	-23.6	175.9	55.6	0	0	0	0	113.7	K977 L1013	K977-T1015 HydrophobicContact CB-CG2 4.35Å; K977-T1015 PolarHBondContact O-N 3.49Å; L1013-T1015 HydrophobicContact CD2-CG2 4.29Å; L1013-T1015 WeakPolarHBondContact CD2-OG1 3.3Å; L1013-T1015 HydrophobicContact CG-CG2 4.37Å; L1013-T1015 WeakPolarHBondContact CG-OG1 3.48Å; L1013-T1015 PolarHBondContact O-N 3.21Å
1016	Q	86.9	Confident	79.4	Confident	52 Å²	52	40.4 Å²	40.4	24%	0.243	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-92.4	-0.5	178.2	-49.3	174.4	-21.6	0	0	112.6	V1011 L1013 G1014 E1165	V1011-Q1016 HydrophobicContact CG1-CB 3.63Å; V1011-Q1016 HydrophobicContact CG1-CG 4.43Å; V1011-Q1016 HydrophobicContact CG2-CB 4.23Å; L1013-Q1016 PolarHBondContact O-N 3.09Å; G1014-Q1016 PolarHBondContact O-N 3.48Å; Q1016-E1165 PolarHBondContact NE2-O 3.47Å
1017	V	90.5	Very high	81.7	Confident	6 Å²	6	36.9 Å²	36.9	4%	0.036	21%	0.211	C	C	.	.	S	Bend	trans	-68.7	121.4	173.9	175.8	0	0	0	0	108.1	I942 C948 I976 F981 V1011 G1014 M1019	I942-V1017 HydrophobicContact CG1-CG1 4.05Å; C948-V1017 HydrophobicContact CB-CG1 4.4Å; I976-V1017 HydrophobicContact CG2-CB 4.12Å; I976-V1017 HydrophobicContact CG2-CG1 4.05Å; I976-V1017 HydrophobicContact CG2-CG2 4.39Å; F981-V1017 HydrophobicContact CE2-CG2 4.31Å; V1011-V1017 HydrophobicContact CG1-CG2 4.35Å; G1014-V1017 WeakPolarHBondContact O-CB 3.11Å; G1014-V1017 WeakPolarHBondContact O-CG2 3.22Å; G1014-V1017 PolarHBondContact O-N 3.31Å; G1014-V1017 VanDerWaalsContact O-N 3.13Å; V1017-M1019 HydrophobicContact CB-CE 4.09Å; V1017-M1019 HydrophobicContact CG1-CE 4.34Å; V1017-M1019 VanDerWaalsContact O-CE 3.27Å; V1017-M1019 WeakPolarHBondContact O-CE 3.33Å; V1017-M1019 PolarHBondContact O-N 3.28Å
1018	P	91.5	Very high	84.3	Confident	22 Å²	22	31.6 Å²	31.6	14%	0.143	18%	0.184	C	C	.	.			trans	-67.3	124.6	177.6	32.2	-37.7	0	0	0	108.9	D946 M947 C948 R1008	D946-P1018 WeakPolarHBondContact O-CG 3.46Å; M947-P1018 HydrophobicContact CE-CB 4.24Å; M947-P1018 HydrophobicContact SD-CB 4.06Å; C948-P1018 PolarHBondContact N-O 3.32Å; R1008-P1018 VanDerWaalsContact NH2-CD 3.35Å
1019	M	93.3	Very high	86	Confident	9 Å²	9	28.2 Å²	28.2	4%	0.044	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	148.5	179.3	65.3	-170.2	76.3	0	0	112	C948 S973 I976 K977 V1017 T1054	C948-M1019 HydrophobicContact CB-CB 4.07Å; C948-M1019 CarbonylContact O-C 3.57Å; C948-M1019 WeakPolarHBondContact O-CA 3.33Å; S973-M1019 PolarHBondContact OG-SD 3.39Å; S973-M1019 VanDerWaalsContact OG-SD 3.34Å; I976-M1019 HydrophobicContact CB-CE 4.11Å; I976-M1019 HydrophobicContact CG2-CE 3.58Å; K977-M1019 HydrophobicContact CG-CE 3.79Å; K977-M1019 HydrophobicContact CG-SD 4.13Å; V1017-M1019 HydrophobicContact CB-CE 4.09Å; V1017-M1019 HydrophobicContact CG1-CE 4.34Å; V1017-M1019 VanDerWaalsContact O-CE 3.27Å; V1017-M1019 WeakPolarHBondContact O-CE 3.33Å; V1017-M1019 PolarHBondContact O-N 3.28Å; M1019-T1054 WeakPolarHBondContact O-CA 3.25Å
1020	I	95.8	Very high	87.4	Confident	1 Å²	1	25.7 Å²	25.7	1%	0.005	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	125.3	171.4	-173.4	167.2	0	0	0	108.6	I587 M947 C948 V949 I950 T1054 F1056	I587-I1020 HydrophobicContact CG1-CD1 4.18Å; I587-I1020 HydrophobicContact CG2-CD1 4.35Å; I587-I1020 HydrophobicContact CG2-CG2 3.82Å; M947-I1020 HydrophobicContact CG-CG2 4.14Å; M947-I1020 HydrophobicContact SD-CB 4.41Å; M947-I1020 HydrophobicContact SD-CG2 4.15Å; C948-I1020 PolarHBondContact O-N 2.92Å; V949-I1020 HydrophobicContact CB-CG2 4.25Å; V949-I1020 HydrophobicContact CG1-CG2 4.16Å; V949-I1020 HydrophobicContact CG2-CG2 3.82Å; I950-I1020 PolarHBondContact N-O 3.21Å; I1020-T1054 CarbonylContact C-O 3.41Å; I1020-T1054 WeakPolarHBondContact CA-O 3.36Å; I1020-F1056 HydrophobicContact CD1-CB 4.26Å; I1020-F1056 HydrophobicContact CG1-CB 4.41Å
1021	T	95.9	Very high	88.6	Confident	1 Å²	1	27.5 Å²	27.5	1%	0.006	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	123.3	-176.7	-48.8	0	0	0	0	109	I950 A969 L1023 L1032 T1054 F1056	I950-T1021 HydrophobicContact CB-CG2 4.18Å; I950-T1021 HydrophobicContact CG2-CG2 4.25Å; A969-T1021 HydrophobicContact CB-CG2 3.81Å; T1021-L1023 HydrophobicContact CG2-CD2 4.3Å; T1021-L1032 HydrophobicContact CG2-CD2 4.12Å; T1021-T1054 PolarHBondContact N-O 3.22Å; T1021-F1056 PolarHBondContact O-N 2.88Å
1022	E	94.4	Very high	89.2	Confident	14 Å²	14	27 Å²	27	7%	0.065	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	133.1	167.9	-177	-175	163.9	0	0	109.7	K583 I950 L951 F1056	K583-E1022 HydrophobicContact CD-CG 4.28Å; K583-E1022 WeakPolarHBondContact CD-OE1 3.36Å; K583-E1022 WeakPolarHBondContact CE-OE1 3.32Å; K583-E1022 IonicContact NZ-OE1 2.75Å; K583-E1022 PolarHBondContact NZ-OE1 3.26Å; K583-E1022 IonicContact NZ-OE2 3.54Å; K583-E1022 PolarHBondContact NZ-OE2 2.91Å; I950-E1022 PolarHBondContact O-N 3.44Å; L951-E1022 HydrophobicContact CD2-CB 4.12Å; L951-E1022 WeakPolarHBondContact CD2-OE2 3.34Å; E1022-F1056 WeakPolarHBondContact CA-O 3.11Å
1023	L	91.5	Very high	89.4	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	138.6	173.9	-61.8	176.3	0	0	0	110.9	D966 T1021 V1029 L1032 A1055 F1056 A1057	D966-L1023 HydrophobicContact CB-CD2 4.13Å; T1021-L1023 HydrophobicContact CG2-CD2 4.3Å; L1023-V1029 HydrophobicContact CD1-CB 3.77Å; L1023-V1029 HydrophobicContact CD1-CG2 4Å; L1023-L1032 HydrophobicContact CD1-CD1 4.01Å; L1023-A1055 HydrophobicContact CD1-CB 4.1Å; L1023-F1056 PolarHBondContact N-O 3.29Å; L1023-A1057 WeakPolarHBondContact O-CA 3.46Å
1024	V	87	Confident	89.1	Confident	34 Å²	34	30.9 Å²	30.9	21%	0.206	16%	0.159	C	C	.	.	S	Bend	trans	-86.5	-42.9	173.4	179.8	0	0	0	0	110.1	Y522 A965 D966	Y522-V1024 HydrophobicContact CD1-CG1 3.51Å; Y522-V1024 HydrophobicContact CE1-CG1 3.41Å; Y522-V1024 VanDerWaalsContact CE1-CG1 3.41Å; Y522-V1024 WeakPolarHBondContact CE1-O 3.41Å; Y522-V1024 PolarHBondContact OH-O 3.47Å; A965-V1024 HydrophobicContact CB-CB 4.26Å; A965-V1024 HydrophobicContact CB-CG1 4.28Å; D966-V1024 VanDerWaalsContact OD1-CB 3.32Å; D966-V1024 WeakPolarHBondContact OD1-CB 3.17Å; D966-V1024 WeakPolarHBondContact OD1-CG2 3.42Å; D966-V1024 PolarHBondContact OD1-N 3.04Å; D966-V1024 PolarHBondContact OD2-N 3.32Å
1025	N	85	Confident	88.7	Confident	32 Å²	32	33.9 Å²	33.9	17%	0.171	18%	0.175	C	C	.	.	S	Bend	trans	-110.1	124.8	-179.2	-175.3	-14.6	0	0	0	111.2	P962 D966 S1027 N1028	P962-N1025 PolarHBondContact O-ND2 2.93Å; D966-N1025 PolarHBondContact OD2-N 3.15Å; N1025-S1027 VanDerWaalsContact C-N 3.29Å; N1025-S1027 VanDerWaalsContact CG-OG 3.25Å; N1025-S1027 PolarHBondContact ND2-OG 3.15Å; N1025-S1027 PolarHBondContact O-N 3.35Å; N1025-S1027 PolarHBondContact OD1-N 3.01Å; N1025-S1027 VanDerWaalsContact OD1-N 3.11Å; N1025-S1027 PolarHBondContact OD1-OG 2.94Å; N1025-N1028 WeakPolarHBondContact O-CB 3.45Å; N1025-N1028 PolarHBondContact O-N 2.94Å
1026	D	87.1	Confident	88.2	Confident	34 Å²	34	33 Å²	33	18%	0.182	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-61.1	-36.9	-176.7	-68.8	8.2	0	0	0	112.5	N1028 V1029 L1044 A1057 S1059	D1026-N1028 PolarHBondContact O-N 3.25Å; D1026-N1028 VanDerWaalsContact O-N 3.14Å; D1026-V1029 WeakPolarHBondContact O-CB 3.3Å; D1026-V1029 WeakPolarHBondContact O-CG1 3.42Å; D1026-V1029 PolarHBondContact O-N 3.32Å; D1026-L1044 HydrophobicContact CB-CB 4.39Å; D1026-A1057 VanDerWaalsContact OD1-CB 3.26Å; D1026-A1057 WeakPolarHBondContact OD1-CB 3.22Å; D1026-S1059 WeakPolarHBondContact OD1-CB 3.49Å; D1026-S1059 PolarHBondContact OD1-OG 2.92Å; D1026-S1059 WeakPolarHBondContact OD2-CB 3.43Å; D1026-S1059 PolarHBondContact OD2-OG 3.48Å
1027	S	86.1	Confident	87.6	Confident	47 Å²	47	38.2 Å²	38.2	33%	0.329	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-65	-18.1	-178.9	61.8	0	0	0	0	114	N1025 V1029 Q1030	N1025-S1027 VanDerWaalsContact C-N 3.29Å; N1025-S1027 VanDerWaalsContact CG-OG 3.25Å; N1025-S1027 PolarHBondContact ND2-OG 3.15Å; N1025-S1027 PolarHBondContact O-N 3.35Å; N1025-S1027 PolarHBondContact OD1-N 3.01Å; N1025-S1027 VanDerWaalsContact OD1-N 3.11Å; N1025-S1027 PolarHBondContact OD1-OG 2.94Å; S1027-V1029 VanDerWaalsContact C-N 3.28Å; S1027-V1029 PolarHBondContact O-N 3.41Å; S1027-Q1030 PolarHBondContact O-NE2 3.37Å
1028	N	89.9	Confident	86.7	Confident	4 Å²	4	40.3 Å²	40.3	2%	0.021	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-80.1	-9.2	179.7	-76.7	-20.6	0	0	0	113.5	T963 D966 I970 N1025 D1026 Q1030 F1031	T963-N1028 PolarHBondContact O-ND2 3.16Å; T963-N1028 PolarHBondContact O-OD1 3Å; D966-N1028 HydrophobicContact CB-CB 4.45Å; D966-N1028 PolarHBondContact OD2-ND2 2.98Å; I970-N1028 HydrophobicContact CD1-CB 4.04Å; N1025-N1028 WeakPolarHBondContact O-CB 3.45Å; N1025-N1028 PolarHBondContact O-N 2.94Å; D1026-N1028 PolarHBondContact O-N 3.25Å; D1026-N1028 VanDerWaalsContact O-N 3.14Å; N1028-Q1030 PolarHBondContact O-N 3Å; N1028-F1031 HydrophobicContact CB-CD2 4.26Å; N1028-F1031 WeakPolarHBondContact O-CD2 3.37Å; N1028-F1031 PolarHBondContact O-N 3.37Å; N1028-F1031 VanDerWaalsContact O-N 3.14Å
1029	V	90.5	Very high	86	Confident	6 Å²	6	45 Å²	45	4%	0.036	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-58.3	-36	-177.5	70.1	0	0	0	0	112.9	L1023 D1026 S1027 F1031 L1032 L1044 T1047 P1049 A1055	L1023-V1029 HydrophobicContact CD1-CB 3.77Å; L1023-V1029 HydrophobicContact CD1-CG2 4Å; D1026-V1029 WeakPolarHBondContact O-CB 3.3Å; D1026-V1029 WeakPolarHBondContact O-CG1 3.42Å; D1026-V1029 PolarHBondContact O-N 3.32Å; S1027-V1029 VanDerWaalsContact C-N 3.28Å; S1027-V1029 PolarHBondContact O-N 3.41Å; V1029-F1031 PolarHBondContact O-N 3.02Å; V1029-F1031 VanDerWaalsContact O-N 3.12Å; V1029-L1032 HydrophobicContact CG2-CD1 4.49Å; V1029-L1032 WeakPolarHBondContact O-CB 3.33Å; V1029-L1032 PolarHBondContact O-N 3.31Å; V1029-L1032 VanDerWaalsContact O-N 3.14Å; V1029-L1044 HydrophobicContact CB-CD1 3.86Å; V1029-L1044 HydrophobicContact CG1-CD1 3.91Å; V1029-L1044 HydrophobicContact CG2-CD1 3.9Å; V1029-T1047 HydrophobicContact CG1-CG2 3.71Å; V1029-P1049 HydrophobicContact CG2-CB 3.87Å; V1029-P1049 HydrophobicContact CG2-CG 4.11Å; V1029-A1055 HydrophobicContact CG2-CB 3.79Å
1030	Q	87.3	Confident	85.1	Confident	55 Å²	55	48.6 Å²	48.6	26%	0.257	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-59.6	-23.3	179.6	69.2	-172	-55.3	0	0	113.4	S1027 N1028 L1032	S1027-Q1030 PolarHBondContact O-NE2 3.37Å; N1028-Q1030 PolarHBondContact O-N 3Å; Q1030-L1032 VanDerWaalsContact C-N 3.3Å; Q1030-L1032 PolarHBondContact O-N 3.08Å
1031	F	90.4	Very high	84.3	Confident	103 Å²	103	56.1 Å²	56.1	45%	0.452	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-82.1	-7.7	-178.3	-57.1	-55.6	0	0	0	113.8	I970 N1028 V1029	I970-F1031 HydrophobicContact CD1-CB 4.28Å; I970-F1031 HydrophobicContact CD1-CD2 4.22Å; I970-F1031 HydrophobicContact CG2-CB 3.95Å; N1028-F1031 HydrophobicContact CB-CD2 4.26Å; N1028-F1031 WeakPolarHBondContact O-CD2 3.37Å; N1028-F1031 PolarHBondContact O-N 3.37Å; N1028-F1031 VanDerWaalsContact O-N 3.14Å; V1029-F1031 PolarHBondContact O-N 3.02Å; V1029-F1031 VanDerWaalsContact O-N 3.12Å
1032	L	90.6	Very high	83.7	Confident	1 Å²	1	58 Å²	58	1%	0.005	31%	0.309	C	S	.	.	S	Bend	trans	-74.7	-38.7	-179.8	-67.9	177.1	0	0	0	111.9	I970 K977 T1021 L1023 V1029 Q1030 P1049 A1055	I970-L1032 HydrophobicContact CG1-CD2 4.38Å; K977-L1032 PolarHBondContact NZ-O 3.32Å; T1021-L1032 HydrophobicContact CG2-CD2 4.12Å; L1023-L1032 HydrophobicContact CD1-CD1 4.01Å; V1029-L1032 HydrophobicContact CG2-CD1 4.49Å; V1029-L1032 WeakPolarHBondContact O-CB 3.33Å; V1029-L1032 PolarHBondContact O-N 3.31Å; V1029-L1032 VanDerWaalsContact O-N 3.14Å; Q1030-L1032 VanDerWaalsContact C-N 3.3Å; Q1030-L1032 PolarHBondContact O-N 3.08Å; L1032-P1049 HydrophobicContact CB-CB 4.32Å; L1032-P1049 HydrophobicContact CB-CG 4.31Å; L1032-P1049 HydrophobicContact CD1-CB 4.23Å; L1032-A1055 HydrophobicContact CD1-CB 3.62Å
1033	D	85.4	Confident	83.2	Confident	9 Å²	9	61.9 Å²	61.9	5%	0.048	33%	0.327	C	S	.	.			trans	-118.2	124.7	-177.7	-80.3	-12.6	0	0	0	110	K977 D1035 D1036 P1049 K1168	K977-D1033 IonicContact NZ-OD1 3.68Å; K977-D1033 PolarHBondContact NZ-OD1 3.15Å; D1033-D1035 VanDerWaalsContact C-N 3.34Å; D1033-D1036 HydrophobicContact CB-CB 4.16Å; D1033-P1049 HydrophobicContact CB-CG 4.07Å; D1033-K1168 IonicContact OD1-NZ 3.33Å; D1033-K1168 PolarHBondContact OD1-NZ 2.94Å; D1033-K1168 WeakPolarHBondContact OD2-CE 3.48Å; D1033-K1168 IonicContact OD2-NZ 3.99Å; D1033-K1168 PolarHBondContact OD2-NZ 2.76Å
1034	Q	78.7	Confident	83.1	Confident	173 Å²	173	62.7 Å²	62.7	81%	0.808	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-14.4	-176.1	-64.2	-179.1	-7.1	0	0	113.4	D1036	Q1034-D1036 VanDerWaalsContact C-N 3.32Å
1035	D	79.4	Confident	83.1	Confident	63 Å²	63	62.9 Å²	62.9	34%	0.337	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	4.6	176.6	57.2	-47	0	0	0	112.4	D1033 Q1048 K1168	D1033-D1035 VanDerWaalsContact C-N 3.34Å; D1035-Q1048 PolarHBondContact OD2-NE2 3.09Å; D1035-K1168 IonicContact OD1-NZ 2.85Å; D1035-K1168 PolarHBondContact OD1-NZ 3.22Å; D1035-K1168 IonicContact OD2-NZ 2.85Å; D1035-K1168 PolarHBondContact OD2-NZ 3.34Å
1036	D	74.9	Confident	83.3	Confident	26 Å²	26	63.5 Å²	63.5	14%	0.139	33%	0.331	C	S	.	.			trans	-84	120.7	177.3	-159.9	2.4	0	0	0	110.1	D1033 Q1034 D1038 P1049	D1033-D1036 HydrophobicContact CB-CB 4.16Å; Q1034-D1036 VanDerWaalsContact C-N 3.32Å; D1036-D1038 VanDerWaalsContact C-N 3.33Å; D1036-D1038 WeakPolarHBondContact OD1-CB 3.5Å; D1036-D1038 PolarHBondContact OD1-N 3.09Å; D1036-P1049 VanDerWaalsContact OD2-CD 3.28Å; D1036-P1049 WeakPolarHBondContact OD2-CD 3.46Å
1037	D	73.6	Confident	83.5	Confident	162 Å²	162	62.1 Å²	62.1	87%	0.866	32%	0.324	S	S	*	.			trans	-94.4	7.9	178.7	-73.3	-36	0	0	0	111.6
1038	D	72.1	Confident	83.7	Confident	50 Å²	50	60.6 Å²	60.6	27%	0.267	31%	0.312	S	S	.	.			trans	-63.4	134.6	-174.8	-73.3	-25.3	0	0	0	112.7	D1036 T1042 T1047 Q1048	D1036-D1038 VanDerWaalsContact C-N 3.33Å; D1036-D1038 WeakPolarHBondContact OD1-CB 3.5Å; D1036-D1038 PolarHBondContact OD1-N 3.09Å; D1038-T1042 HydrophobicContact CB-CG2 4.43Å; D1038-T1047 WeakPolarHBondContact OD2-CA 3.31Å; D1038-Q1048 PolarHBondContact OD2-N 3.16Å
1039	D	78.1	Confident	83.8	Confident	120 Å²	120	60.4 Å²	60.4	64%	0.642	31%	0.311	S	S	*	.			trans	-66.6	148.7	174.6	-75.8	-47.9	0	0	0	110.3	D1041 T1042	D1039-D1041 PolarHBondContact O-N 3.43Å; D1039-T1042 PolarHBondContact N-OG1 3.06Å; D1039-T1042 WeakPolarHBondContact O-CB 3.2Å; D1039-T1042 PolarHBondContact O-N 3.14Å; D1039-T1042 PolarHBondContact O-OG1 3.43Å
1040	P	74.4	Confident	84	Confident	85 Å²	85	60.1 Å²	60.1	55%	0.552	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-22.1	176.5	-25	33.5	0	0	0	114.8	T1042	P1040-T1042 VanDerWaalsContact C-N 3.26Å
1041	D	77.4	Confident	84.2	Confident	160 Å²	160	57.5 Å²	57.5	86%	0.856	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-2.6	177.8	-66.8	-27.8	0	0	0	112.8	D1039 E1043	D1039-D1041 PolarHBondContact O-N 3.43Å; D1041-E1043 PolarHBondContact O-N 3.41Å
1042	T	84	Confident	84.3	Confident	39 Å²	39	52.7 Å²	52.7	24%	0.239	28%	0.276	C	S	.	.	S	Bend	trans	-67.4	125.9	178.8	-56.3	0	0	0	0	110	D1038 D1039 P1040 L1044 L1046 T1047	D1038-T1042 HydrophobicContact CB-CG2 4.43Å; D1039-T1042 PolarHBondContact N-OG1 3.06Å; D1039-T1042 WeakPolarHBondContact O-CB 3.2Å; D1039-T1042 PolarHBondContact O-N 3.14Å; D1039-T1042 PolarHBondContact O-OG1 3.43Å; P1040-T1042 VanDerWaalsContact C-N 3.26Å; T1042-L1044 PolarHBondContact O-N 3.43Å; T1042-L1046 HydrophobicContact CG2-CB 3.57Å; T1042-L1046 HydrophobicContact CG2-CD1 4.41Å; T1042-T1047 HydrophobicContact CG2-CG2 3.99Å
1043	E	84.3	Confident	84.4	Confident	96 Å²	96	52.9 Å²	52.9	45%	0.449	28%	0.278	S	S	.	.			trans	-58.8	139.6	177.1	-64.1	179.2	151.5	0	0	110.1	D1041 Y1045 L1046	D1041-E1043 PolarHBondContact O-N 3.41Å; E1043-Y1045 HydrophobicContact CB-CD1 3.97Å; E1043-Y1045 HydrophobicContact CB-CE1 3.74Å; E1043-Y1045 HydrophobicContact CG-CE1 4.41Å; E1043-Y1045 PolarHBondContact O-N 2.88Å; E1043-Y1045 WeakPolarHBondContact OE2-CE1 3.49Å; E1043-Y1045 VanDerWaalsContact OE2-CZ 3.28Å; E1043-Y1045 PolarHBondContact OE2-OH 2.95Å; E1043-L1046 HydrophobicContact CB-CD1 4.34Å; E1043-L1046 WeakPolarHBondContact O-CB 2.99Å; E1043-L1046 PolarHBondContact O-N 3.38Å
1044	L	88.2	Confident	84.8	Confident	17 Å²	17	53.8 Å²	53.8	9%	0.089	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-45.5	-39.6	-174	175.1	64.9	0	0	0	113.5	D1026 V1029 T1042 L1046 T1047 F1050 A1057 V1060	D1026-L1044 HydrophobicContact CB-CB 4.39Å; V1029-L1044 HydrophobicContact CB-CD1 3.86Å; V1029-L1044 HydrophobicContact CG1-CD1 3.91Å; V1029-L1044 HydrophobicContact CG2-CD1 3.9Å; T1042-L1044 PolarHBondContact O-N 3.43Å; L1044-L1046 VanDerWaalsContact C-N 3.35Å; L1044-L1046 PolarHBondContact O-N 3.31Å; L1044-T1047 WeakPolarHBondContact O-CB 2.85Å; L1044-T1047 PolarHBondContact O-N 3.37Å; L1044-T1047 PolarHBondContact O-OG1 3.44Å; L1044-F1050 HydrophobicContact CD1-CB 4.45Å; L1044-F1050 HydrophobicContact CD1-CD2 4.36Å; L1044-F1050 HydrophobicContact CD2-CD2 4.3Å; L1044-F1050 HydrophobicContact CD2-CE2 4.39Å; L1044-F1050 HydrophobicContact CG-CD2 4.04Å; L1044-F1050 HydrophobicContact CG-CG 4.37Å; L1044-F1050 VanDerWaalsContact O-CB 3.26Å; L1044-F1050 WeakPolarHBondContact O-CB 3.44Å; L1044-A1057 HydrophobicContact CD2-CB 3.42Å; L1044-A1057 VanDerWaalsContact CD2-CB 3.42Å; L1044-V1060 HydrophobicContact CD2-CG1 4.14Å
1045	Y	88.8	Confident	85.6	Confident	38 Å²	38	45.5 Å²	45.5	15%	0.149	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-75.6	-21.5	-176.1	76.3	-91.1	0	0	0	115.6	R607 Y622 L623 E1043 F1050	R607-Y1045 VanDerWaalsContact NH2-CB 3.27Å; Y622-Y1045 HydrophobicContact CE1-CD2 4.39Å; Y622-Y1045 WeakPolarHBondContact CE1-O 3.44Å; Y622-Y1045 VanDerWaalsContact CZ-O 3.29Å; Y622-Y1045 PolarHBondContact OH-O 3.09Å; L623-Y1045 HydrophobicContact CD2-CE2 4.32Å; E1043-Y1045 HydrophobicContact CB-CD1 3.97Å; E1043-Y1045 HydrophobicContact CB-CE1 3.74Å; E1043-Y1045 HydrophobicContact CG-CE1 4.41Å; E1043-Y1045 PolarHBondContact O-N 2.88Å; E1043-Y1045 WeakPolarHBondContact OE2-CE1 3.49Å; E1043-Y1045 VanDerWaalsContact OE2-CZ 3.28Å; E1043-Y1045 PolarHBondContact OE2-OH 2.95Å; Y1045-F1050 VanDerWaalsContact CA-CD1 3.43Å
1046	L	89.2	Confident	86.3	Confident	45 Å²	45	42.6 Å²	42.6	24%	0.236	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-76.3	-19.4	174.8	-66.3	173.6	0	0	0	111.1	L623 T1042 E1043 L1044	L623-L1046 HydrophobicContact CD2-CD2 3.52Å; T1042-L1046 HydrophobicContact CG2-CB 3.57Å; T1042-L1046 HydrophobicContact CG2-CD1 4.41Å; E1043-L1046 HydrophobicContact CB-CD1 4.34Å; E1043-L1046 WeakPolarHBondContact O-CB 2.99Å; E1043-L1046 PolarHBondContact O-N 3.38Å; L1044-L1046 VanDerWaalsContact C-N 3.35Å; L1044-L1046 PolarHBondContact O-N 3.31Å
1047	T	90.9	Very high	87	Confident	5 Å²	5	41.4 Å²	41.4	3%	0.031	22%	0.224	C	C	.	.	S	Bend	trans	-68.3	142.2	-174.7	70.7	0	0	0	0	113.2	V1029 D1038 T1042 L1044 F1050 A1051	V1029-T1047 HydrophobicContact CG1-CG2 3.71Å; D1038-T1047 WeakPolarHBondContact OD2-CA 3.31Å; T1042-T1047 HydrophobicContact CG2-CG2 3.99Å; L1044-T1047 WeakPolarHBondContact O-CB 2.85Å; L1044-T1047 PolarHBondContact O-N 3.37Å; L1044-T1047 PolarHBondContact O-OG1 3.44Å; T1047-F1050 PolarHBondContact O-N 2.01Å; T1047-F1050 WeakPolarHBondContact OG1-CB 3.32Å; T1047-A1051 WeakPolarHBondContact O-CB 3.39Å; T1047-A1051 PolarHBondContact O-N 3.09Å
1048	Q	89.8	Confident	87.7	Confident	15 Å²	15	34.7 Å²	34.7	7%	0.07	19%	0.187	C	C	.	.	H	α-helix	trans	-57.8	-45	-178.6	-173.9	-178.9	-99.2	0	0	113.4	D1035 D1038 F1050 A1051 C1052	D1035-Q1048 PolarHBondContact OD2-NE2 3.09Å; D1038-Q1048 PolarHBondContact OD2-N 3.16Å; Q1048-F1050 VanDerWaalsContact C-N 3.29Å; Q1048-F1050 PolarHBondContact O-N 3.39Å; Q1048-A1051 PolarHBondContact O-N 2.82Å; Q1048-C1052 WeakPolarHBondContact O-CB 3.15Å; Q1048-C1052 PolarHBondContact O-N 3.39Å; Q1048-C1052 PolarHBondContact O-SG 3.35Å
1049	P	92.3	Very high	88.3	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62.8	-35.6	-178.5	-24.2	35.2	0	0	0	113	V1029 L1032 D1033 D1036 G1053 T1054 A1055	V1029-P1049 HydrophobicContact CG2-CB 3.87Å; V1029-P1049 HydrophobicContact CG2-CG 4.11Å; L1032-P1049 HydrophobicContact CB-CB 4.32Å; L1032-P1049 HydrophobicContact CB-CG 4.31Å; L1032-P1049 HydrophobicContact CD1-CB 4.23Å; D1033-P1049 HydrophobicContact CB-CG 4.07Å; D1036-P1049 VanDerWaalsContact OD2-CD 3.28Å; D1036-P1049 WeakPolarHBondContact OD2-CD 3.46Å; P1049-G1053 PolarHBondContact O-N 2.92Å; P1049-T1054 WeakPolarHBondContact CA-OG1 3.22Å; P1049-T1054 PolarHBondContact O-N 3.2Å; P1049-T1054 PolarHBondContact O-OG1 3.45Å; P1049-A1055 HydrophobicContact CB-CB 4.08Å; P1049-A1055 PolarHBondContact O-N 3.08Å
1050	F	93.5	Very high	88.7	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-72.7	-47.1	175.6	-176.5	-91.4	0	0	0	111.3	T598 A601 N602 L1044 Y1045 T1047 Q1048 C1052 G1053 V1060	T598-F1050 WeakPolarHBondContact CB-O 3.29Å; T598-F1050 HydrophobicContact CG2-CD1 3.83Å; T598-F1050 HydrophobicContact CG2-CE1 3.67Å; T598-F1050 HydrophobicContact CG2-CZ 4.29Å; T598-F1050 WeakPolarHBondContact CG2-O 3.38Å; T598-F1050 PolarHBondContact OG1-O 2.66Å; A601-F1050 HydrophobicContact CB-CZ 3.94Å; N602-F1050 WeakPolarHBondContact OD1-CE1 3.49Å; L1044-F1050 HydrophobicContact CD1-CB 4.45Å; L1044-F1050 HydrophobicContact CD1-CD2 4.36Å; L1044-F1050 HydrophobicContact CD2-CD2 4.3Å; L1044-F1050 HydrophobicContact CD2-CE2 4.39Å; L1044-F1050 HydrophobicContact CG-CD2 4.04Å; L1044-F1050 HydrophobicContact CG-CG 4.37Å; L1044-F1050 VanDerWaalsContact O-CB 3.26Å; L1044-F1050 WeakPolarHBondContact O-CB 3.44Å; Y1045-F1050 VanDerWaalsContact CA-CD1 3.43Å; T1047-F1050 PolarHBondContact O-N 2.01Å; T1047-F1050 WeakPolarHBondContact OG1-CB 3.32Å; Q1048-F1050 VanDerWaalsContact C-N 3.29Å; Q1048-F1050 PolarHBondContact O-N 3.39Å; F1050-C1052 PolarHBondContact O-N 3.12Å; F1050-G1053 PolarHBondContact O-N 2.66Å; F1050-V1060 HydrophobicContact CE2-CG1 4.05Å; F1050-V1060 HydrophobicContact CZ-CG1 4.03Å
1051	A	92.7	Very high	89.4	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-58.6	-31.8	176.8	0	0	0	0	0	112.7	W618 Y622 T1047 Q1048 V1171	W618-A1051 HydrophobicContact CZ3-CB 4.22Å; Y622-A1051 HydrophobicContact CD1-CB 4.4Å; Y622-A1051 HydrophobicContact CD2-CB 3.82Å; Y622-A1051 HydrophobicContact CE1-CB 4.22Å; Y622-A1051 HydrophobicContact CE2-CB 3.59Å; Y622-A1051 HydrophobicContact CG-CB 4.23Å; T1047-A1051 WeakPolarHBondContact O-CB 3.39Å; T1047-A1051 PolarHBondContact O-N 3.09Å; Q1048-A1051 PolarHBondContact O-N 2.82Å; A1051-V1171 PolarHBondContact O-N 2.94Å
1052	C	92.2	Very high	89.7	Confident	2 Å²	2	17.2 Å²	17.2	1%	0.014	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-12	175.8	-64.6	0	0	0	0	114.6	Q1048 F1050 T1054 Y1156 R1169	Q1048-C1052 WeakPolarHBondContact O-CB 3.15Å; Q1048-C1052 PolarHBondContact O-N 3.39Å; Q1048-C1052 PolarHBondContact O-SG 3.35Å; F1050-C1052 PolarHBondContact O-N 3.12Å; C1052-T1054 HydrophobicContact CB-CG2 4.13Å; C1052-Y1156 PolarHBondContact O-OH 2.89Å; C1052-R1169 WeakPolarHBondContact CA-O 3.42Å; C1052-R1169 VanDerWaalsContact CB-O 3.28Å; C1052-R1169 WeakPolarHBondContact CB-O 3.44Å; C1052-R1169 PolarHBondContact SG-O 3.46Å
1053	G	93.5	Very high	89.8	Confident	5 Å²	5	15.9 Å²	15.9	5%	0.052	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.1	21.8	-177.7	0	0	0	0	0	115.2	T598 P1049 F1050	T598-G1053 WeakPolarHBondContact OG1-CA 3.36Å; P1049-G1053 PolarHBondContact O-N 2.92Å; F1050-G1053 PolarHBondContact O-N 2.66Å
1054	T	93.4	Very high	90	Very high	28 Å²	28	11.3 Å²	11.3	17%	0.172	6%	0.062	C	C	.	.			trans	-97.9	-14.4	-178.7	66.1	0	0	0	0	113.4	M1019 I1020 T1021 P1049 C1052	M1019-T1054 WeakPolarHBondContact O-CA 3.25Å; I1020-T1054 CarbonylContact C-O 3.41Å; I1020-T1054 WeakPolarHBondContact CA-O 3.36Å; T1021-T1054 PolarHBondContact N-O 3.22Å; P1049-T1054 WeakPolarHBondContact CA-OG1 3.22Å; P1049-T1054 PolarHBondContact O-N 3.2Å; P1049-T1054 PolarHBondContact O-OG1 3.45Å; C1052-T1054 HydrophobicContact CB-CG2 4.13Å
1055	A	94.1	Very high	90.1	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.058	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	142.2	176	0	0	0	0	0	110.4	L1023 V1029 L1032 P1049	L1023-A1055 HydrophobicContact CD1-CB 4.1Å; V1029-A1055 HydrophobicContact CG2-CB 3.79Å; L1032-A1055 HydrophobicContact CD1-CB 3.62Å; P1049-A1055 HydrophobicContact CB-CB 4.08Å; P1049-A1055 PolarHBondContact O-N 3.08Å
1056	F	94.4	Very high	90.1	Very high	1 Å²	1	8.8 Å²	8.8	0%	0.004	5%	0.051	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	114.2	171.2	-172.6	-93	0	0	0	109.9	K583 F586 I587 I1020 T1021 E1022 L1023 V1060 L1061	K583-F1056 HydrophobicContact CB-CE1 4.17Å; K583-F1056 HydrophobicContact CG-CD1 4.09Å; K583-F1056 HydrophobicContact CG-CE1 3.78Å; F586-F1056 HydrophobicContact CB-CE2 3.89Å; F586-F1056 HydrophobicContact CB-CZ 3.97Å; F586-F1056 HydrophobicContact CD2-CE2 4.22Å; F586-F1056 AromaticContact CD2-CZ 3.83Å; F586-F1056 HydrophobicContact CD2-CZ 3.83Å; F586-F1056 HydrophobicContact CG-CE2 4.23Å; F586-F1056 HydrophobicContact CG-CZ 4.21Å; I587-F1056 HydrophobicContact CD1-CD1 4.18Å; I587-F1056 HydrophobicContact CG1-CB 4.38Å; I587-F1056 HydrophobicContact CG1-CD1 4.17Å; I587-F1056 HydrophobicContact CG1-CG 4.26Å; I1020-F1056 HydrophobicContact CD1-CB 4.26Å; I1020-F1056 HydrophobicContact CG1-CB 4.41Å; T1021-F1056 PolarHBondContact O-N 2.88Å; E1022-F1056 WeakPolarHBondContact CA-O 3.11Å; L1023-F1056 PolarHBondContact N-O 3.29Å; F1056-V1060 HydrophobicContact CE2-CG2 4.22Å; F1056-V1060 HydrophobicContact CZ-CG2 4.23Å; F1056-L1061 HydrophobicContact CZ-CD2 4.27Å
1057	A	91.2	Very high	90	Very high	1 Å²	1	7.6 Å²	7.6	1%	0.008	5%	0.045	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	159.1	174.7	0	0	0	0	0	111.6	L1023 D1026 L1044 V1060	L1023-A1057 WeakPolarHBondContact O-CA 3.46Å; D1026-A1057 VanDerWaalsContact OD1-CB 3.26Å; D1026-A1057 WeakPolarHBondContact OD1-CB 3.22Å; L1044-A1057 HydrophobicContact CD2-CB 3.42Å; L1044-A1057 VanDerWaalsContact CD2-CB 3.42Å; A1057-V1060 WeakPolarHBondContact O-CG2 3.45Å
1058	I	87.4	Confident	89.9	Confident	21 Å²	21	7.4 Å²	7.4	11%	0.108	4%	0.044	C	C	.	.	S	Bend	trans	-82.5	-15.4	176.7	-158.2	168.5	0	0	0	113.2	K521 Y522 L579 K583 V1060 L1061	K521-I1058 HydrophobicContact CD-CD1 4.48Å; K521-I1058 HydrophobicContact CD-CG1 4.23Å; K521-I1058 HydrophobicContact CD-CG2 3.9Å; K521-I1058 PolarHBondContact NZ-O 2.95Å; Y522-I1058 HydrophobicContact CE1-CG2 4.47Å; L579-I1058 HydrophobicContact CB-CD1 4.3Å; L579-I1058 HydrophobicContact CD1-CD1 4.31Å; K583-I1058 HydrophobicContact CD-CD1 4.45Å; I1058-V1060 PolarHBondContact O-N 2.95Å; I1058-L1061 HydrophobicContact CG1-CD1 4.34Å; I1058-L1061 PolarHBondContact O-N 3.49Å
1059	S	84.8	Confident	89.9	Confident	9 Å²	9	7.2 Å²	7.2	6%	0.063	4%	0.043	C	C	.	.	G	3₁₀ helix	trans	-61.5	-40.6	179.7	59.3	0	0	0	0	112.7	D1026 L1061 D1062	D1026-S1059 WeakPolarHBondContact OD1-CB 3.49Å; D1026-S1059 PolarHBondContact OD1-OG 2.92Å; D1026-S1059 WeakPolarHBondContact OD2-CB 3.43Å; D1026-S1059 PolarHBondContact OD2-OG 3.48Å; S1059-L1061 PolarHBondContact O-N 3.24Å; S1059-D1062 WeakPolarHBondContact O-CB 3.43Å; S1059-D1062 PolarHBondContact O-N 3.1Å
1060	V	86.4	Confident	89.6	Confident	19 Å²	19	9.3 Å²	9.3	12%	0.115	5%	0.052	C	C	.	.	G	3₁₀ helix	trans	-58.1	-16.8	178.5	-78	0	0	0	0	114.5	A601 L1044 F1050 F1056 A1057 I1058 D1062	A601-V1060 HydrophobicContact CB-CB 4.27Å; A601-V1060 HydrophobicContact CB-CG1 4.44Å; A601-V1060 HydrophobicContact CB-CG2 4.45Å; L1044-V1060 HydrophobicContact CD2-CG1 4.14Å; F1050-V1060 HydrophobicContact CE2-CG1 4.05Å; F1050-V1060 HydrophobicContact CZ-CG1 4.03Å; F1056-V1060 HydrophobicContact CE2-CG2 4.22Å; F1056-V1060 HydrophobicContact CZ-CG2 4.23Å; A1057-V1060 WeakPolarHBondContact O-CG2 3.45Å; I1058-V1060 PolarHBondContact O-N 2.95Å; V1060-D1062 VanDerWaalsContact C-N 3.35Å
1061	L	87.9	Confident	89.1	Confident	4 Å²	4	10.4 Å²	10.4	2%	0.021	6%	0.058	C	C	.	.	G	3₁₀ helix	trans	-80.4	-11.7	175.6	-58.9	-177.9	0	0	0	113.4	L579 L582 K583 F586 F1056 I1058 S1059 S1063 L1064	L579-L1061 HydrophobicContact CD2-CB 3.96Å; L579-L1061 HydrophobicContact CD2-CD1 4.06Å; L582-L1061 HydrophobicContact CB-CD1 4.22Å; L582-L1061 HydrophobicContact CB-CD2 4.36Å; K583-L1061 HydrophobicContact CB-CD1 4.18Å; F586-L1061 HydrophobicContact CD2-CD2 3.98Å; F586-L1061 HydrophobicContact CE2-CD2 3.62Å; F1056-L1061 HydrophobicContact CZ-CD2 4.27Å; I1058-L1061 HydrophobicContact CG1-CD1 4.34Å; I1058-L1061 PolarHBondContact O-N 3.49Å; S1059-L1061 PolarHBondContact O-N 3.24Å; L1061-S1063 VanDerWaalsContact C-N 3.32Å; L1061-S1063 PolarHBondContact O-N 3.43Å; L1061-L1064 HydrophobicContact CB-CD1 4.35Å; L1061-L1064 HydrophobicContact CD2-CD1 3.79Å; L1061-L1064 VanDerWaalsContact O-CB 3.28Å; L1061-L1064 WeakPolarHBondContact O-CB 3.25Å; L1061-L1064 PolarHBondContact O-N 2.99Å
1062	D	84.8	Confident	88.3	Confident	17 Å²	17	13.9 Å²	13.9	9%	0.091	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-34.4	176.6	-77.3	-23.5	0	0	0	112.6	H451 K521 Q552 S1059 V1060 L1064 M1065	H451-D1062 HydrophobicContact CB-CB 4.43Å; K521-D1062 VanDerWaalsContact CE-CG 3.49Å; K521-D1062 WeakPolarHBondContact CE-OD1 2.99Å; K521-D1062 WeakPolarHBondContact CE-OD2 3.42Å; K521-D1062 IonicContact NZ-OD1 3.07Å; K521-D1062 PolarHBondContact NZ-OD1 2.83Å; K521-D1062 IonicContact NZ-OD2 3.84Å; K521-D1062 PolarHBondContact NZ-OD2 2.95Å; Q552-D1062 PolarHBondContact NE2-OD1 3.46Å; S1059-D1062 WeakPolarHBondContact O-CB 3.43Å; S1059-D1062 PolarHBondContact O-N 3.1Å; V1060-D1062 VanDerWaalsContact C-N 3.35Å; D1062-L1064 PolarHBondContact O-N 3.38Å; D1062-L1064 VanDerWaalsContact O-N 3.08Å; D1062-M1065 WeakPolarHBondContact O-CB 3.35Å; D1062-M1065 PolarHBondContact O-N 3.32Å
1063	S	85.1	Confident	87.8	Confident	10 Å²	10	15.5 Å²	15.5	7%	0.07	9%	0.088	C	C	.	.	H	α-helix	trans	-56.2	-28.4	175.9	-49.6	0	0	0	0	111.9	D455 L1061 M1065 S1066 T1067	D455-S1063 VanDerWaalsContact OD2-CA 3.22Å; D455-S1063 WeakPolarHBondContact OD2-CA 3.4Å; D455-S1063 WeakPolarHBondContact OD2-CB 3.49Å; D455-S1063 PolarHBondContact OD2-OG 3Å; L1061-S1063 VanDerWaalsContact C-N 3.32Å; L1061-S1063 PolarHBondContact O-N 3.43Å; S1063-M1065 VanDerWaalsContact C-N 3.26Å; S1063-M1065 PolarHBondContact O-N 3.19Å; S1063-S1066 PolarHBondContact O-N 2.98Å; S1063-S1066 VanDerWaalsContact O-N 3.14Å; S1063-S1066 PolarHBondContact O-OG 3.24Å; S1063-T1067 PolarHBondContact O-N 3.25Å; S1063-T1067 PolarHBondContact O-OG1 3.12Å
1064	L	89.1	Confident	87.4	Confident	1 Å²	1	15.3 Å²	15.3	1%	0.005	9%	0.086	C	C	.	.	H	α-helix	trans	-63.5	-28	176.4	-66	173.9	0	0	0	113.3	I577 L582 F604 L1061 D1062 S1066 T1067 T1068 I1078	I577-L1064 HydrophobicContact CD1-CB 3.99Å; L582-L1064 HydrophobicContact CD1-CD1 3.65Å; F604-L1064 HydrophobicContact CB-CD2 3.8Å; F604-L1064 HydrophobicContact CD2-CD2 3.56Å; F604-L1064 HydrophobicContact CE2-CD2 4.29Å; F604-L1064 HydrophobicContact CG-CD2 3.73Å; L1061-L1064 HydrophobicContact CB-CD1 4.35Å; L1061-L1064 HydrophobicContact CD2-CD1 3.79Å; L1061-L1064 VanDerWaalsContact O-CB 3.28Å; L1061-L1064 WeakPolarHBondContact O-CB 3.25Å; L1061-L1064 PolarHBondContact O-N 2.99Å; D1062-L1064 PolarHBondContact O-N 3.38Å; D1062-L1064 VanDerWaalsContact O-N 3.08Å; L1064-S1066 VanDerWaalsContact C-N 3.31Å; L1064-S1066 PolarHBondContact O-N 2.9Å; L1064-T1067 PolarHBondContact O-N 3.22Å; L1064-T1068 WeakPolarHBondContact O-CB 3.41Å; L1064-T1068 PolarHBondContact O-N 3.37Å; L1064-T1068 PolarHBondContact O-OG1 2.94Å; L1064-I1078 HydrophobicContact CD2-CD1 3.59Å
1065	M	90.3	Very high	87.1	Confident	1 Å²	1	14 Å²	14	1%	0.005	8%	0.078	C	C	.	.	H	α-helix	trans	-61.1	-45.1	174.1	-74.4	-63.8	-73.7	0	0	110.7	F452 L516 L518 I550 Q552 I577 D1062 S1063 Y1069	F452-M1065 HydrophobicContact CD2-CB 4.41Å; F452-M1065 HydrophobicContact CE2-CB 4.48Å; L516-M1065 HydrophobicContact CB-CE 3.86Å; L516-M1065 HydrophobicContact CD2-CE 4.35Å; L518-M1065 HydrophobicContact CD2-CE 4.02Å; L518-M1065 HydrophobicContact CD2-CG 4.18Å; I550-M1065 HydrophobicContact CB-CE 4.34Å; I550-M1065 HydrophobicContact CG2-CE 3.87Å; I550-M1065 HydrophobicContact CG2-SD 3.75Å; Q552-M1065 HydrophobicContact CG-CE 4.21Å; Q552-M1065 HydrophobicContact CG-CG 3.89Å; Q552-M1065 HydrophobicContact CG-SD 3.41Å; Q552-M1065 WeakPolarHBondContact CG-SD 3.27Å; Q552-M1065 VanDerWaalsContact NE2-CG 3.29Å; I577-M1065 HydrophobicContact CD1-CG 4.12Å; I577-M1065 HydrophobicContact CD1-SD 3.47Å; I577-M1065 WeakPolarHBondContact CD1-SD 3.4Å; I577-M1065 HydrophobicContact CG1-SD 4.16Å; D1062-M1065 WeakPolarHBondContact O-CB 3.35Å; D1062-M1065 PolarHBondContact O-N 3.32Å; S1063-M1065 VanDerWaalsContact C-N 3.26Å; S1063-M1065 PolarHBondContact O-N 3.19Å; M1065-Y1069 PolarHBondContact O-N 3.25Å
1066	S	88.3	Confident	86.7	Confident	1 Å²	1	16.8 Å²	16.8	1%	0.007	10%	0.095	C	C	.	.	H	α-helix	trans	-67.5	-46.5	177.1	82.6	0	0	0	0	110.9	R461 S1063 L1064 T1068 Y1069 F1070	R461-S1066 PolarHBondContact NH2-OG 3.05Å; S1063-S1066 PolarHBondContact O-N 2.98Å; S1063-S1066 VanDerWaalsContact O-N 3.14Å; S1063-S1066 PolarHBondContact O-OG 3.24Å; L1064-S1066 VanDerWaalsContact C-N 3.31Å; L1064-S1066 PolarHBondContact O-N 2.9Å; S1066-T1068 PolarHBondContact O-N 3.4Å; S1066-Y1069 WeakPolarHBondContact O-CB 3.49Å; S1066-Y1069 PolarHBondContact O-N 3.15Å; S1066-F1070 VanDerWaalsContact O-CD2 3.25Å; S1066-F1070 WeakPolarHBondContact O-CD2 3.38Å; S1066-F1070 PolarHBondContact O-N 2.97Å; S1066-F1070 VanDerWaalsContact O-N 3.12Å
1067	T	87.3	Confident	86.4	Confident	19 Å²	19	16.9 Å²	16.9	12%	0.117	10%	0.095	C	C	.	.	H	α-helix	trans	-65	-37.9	-177.4	-64.5	0	0	0	0	112.4	F604 S1063 L1064 F1070 N1071 A1074	F604-T1067 HydrophobicContact CB-CG2 4.4Å; F604-T1067 PolarHBondContact O-OG1 2.95Å; S1063-T1067 PolarHBondContact O-N 3.25Å; S1063-T1067 PolarHBondContact O-OG1 3.12Å; L1064-T1067 PolarHBondContact O-N 3.22Å; T1067-F1070 PolarHBondContact O-N 3.12Å; T1067-N1071 PolarHBondContact O-N 3.25Å; T1067-A1074 HydrophobicContact CG2-CB 3.91Å
1068	T	89.3	Confident	86.3	Confident	1 Å²	1	16.8 Å²	16.8	1%	0.006	10%	0.095	C	C	.	.	H	α-helix	trans	-66.4	-38.8	175.4	-54.5	0	0	0	0	111.5	R548 I550 D575 L1064 S1066 N1071 L1075	R548-T1068 PolarHBondContact NH2-O 3.16Å; I550-T1068 HydrophobicContact CD1-CG2 4.01Å; I550-T1068 HydrophobicContact CG1-CG2 4.47Å; I550-T1068 HydrophobicContact CG2-CG2 4.22Å; D575-T1068 HydrophobicContact CB-CG2 3.65Å; D575-T1068 WeakPolarHBondContact OD2-CG2 3.09Å; L1064-T1068 WeakPolarHBondContact O-CB 3.41Å; L1064-T1068 PolarHBondContact O-N 3.37Å; L1064-T1068 PolarHBondContact O-OG1 2.94Å; S1066-T1068 PolarHBondContact O-N 3.4Å; T1068-N1071 CarbonylContact O-C 3.53Å; T1068-L1075 HydrophobicContact CG2-CB 4.16Å; T1068-L1075 HydrophobicContact CG2-CD2 4Å
1069	Y	90.2	Very high	86.4	Confident	11 Å²	11	17.8 Å²	17.8	4%	0.043	10%	0.097	C	C	.	.	H	α-helix	trans	-63	-43.6	175.9	170.5	-101	0	0	0	112.6	I438 F456 D513 A514 R548 M1065 S1066	I438-Y1069 HydrophobicContact CG2-CD2 4.32Å; I438-Y1069 HydrophobicContact CG2-CE2 3.56Å; F456-Y1069 AromaticContact CE2-CD1 3.43Å; F456-Y1069 HydrophobicContact CE2-CD1 3.43Å; F456-Y1069 VanDerWaalsContact CE2-CD1 3.43Å; F456-Y1069 AromaticContact CE2-CE1 3.81Å; F456-Y1069 HydrophobicContact CE2-CE1 3.81Å; F456-Y1069 HydrophobicContact CE2-CG 4.07Å; F456-Y1069 AromaticContact CZ-CD1 3.88Å; F456-Y1069 HydrophobicContact CZ-CD1 3.88Å; F456-Y1069 AromaticContact CZ-CE1 3.73Å; F456-Y1069 HydrophobicContact CZ-CE1 3.73Å; D513-Y1069 PolarHBondContact OD2-OH 3.45Å; A514-Y1069 HydrophobicContact CB-CD2 3.88Å; A514-Y1069 HydrophobicContact CB-CE2 3.82Å; R548-Y1069 PolarHBondContact NH1-O 2.86Å; R548-Y1069 VanDerWaalsContact NH1-O 3.1Å; M1065-Y1069 PolarHBondContact O-N 3.25Å; S1066-Y1069 WeakPolarHBondContact O-CB 3.49Å; S1066-Y1069 PolarHBondContact O-N 3.15Å
1070	F	86.1	Confident	86.6	Confident	45 Å²	45	19.4 Å²	19.4	20%	0.197	11%	0.107	C	C	.	.	H	α-helix	trans	-80.7	-29.6	-178.9	-74.3	-78.6	0	0	0	113.4	F456 R461 S1066 T1067	F456-F1070 AromaticContact CD2-CE2 3.91Å; F456-F1070 HydrophobicContact CD2-CE2 3.91Å; F456-F1070 AromaticContact CE2-CE2 3.77Å; F456-F1070 HydrophobicContact CE2-CE2 3.77Å; F456-F1070 HydrophobicContact CE2-CZ 4.2Å; F456-F1070 HydrophobicContact CG-CE2 4.46Å; F456-F1070 HydrophobicContact CZ-CE2 4.19Å; F456-F1070 HydrophobicContact CZ-CZ 4.16Å; R461-F1070 VanDerWaalsContact NH1-CG 3.34Å; S1066-F1070 VanDerWaalsContact O-CD2 3.25Å; S1066-F1070 WeakPolarHBondContact O-CD2 3.38Å; S1066-F1070 PolarHBondContact O-N 2.97Å; S1066-F1070 VanDerWaalsContact O-N 3.12Å; T1067-F1070 PolarHBondContact O-N 3.12Å
1071	N	81.6	Confident	86.7	Confident	22 Å²	22	19.2 Å²	19.2	12%	0.118	11%	0.105	C	C	.	.			trans	-138	95.8	-178.1	-172.7	-3.8	0	0	0	111.8	T632 T1067 T1068 S1073 A1074	T632-N1071 WeakPolarHBondContact CG2-ND2 3.24Å; T632-N1071 PolarHBondContact OG1-ND2 3.15Å; T1067-N1071 PolarHBondContact O-N 3.25Å; T1068-N1071 CarbonylContact O-C 3.53Å; N1071-S1073 PolarHBondContact O-N 3.31Å; N1071-S1073 VanDerWaalsContact O-N 3.16Å; N1071-S1073 PolarHBondContact OD1-N 3.3Å; N1071-A1074 HydrophobicContact CB-CB 3.96Å; N1071-A1074 WeakPolarHBondContact O-CB 3.44Å; N1071-A1074 PolarHBondContact O-N 2.96Å; N1071-A1074 PolarHBondContact OD1-N 3.5Å
1072	D	77.5	Confident	86.8	Confident	73 Å²	73	19 Å²	19	39%	0.39	10%	0.104	S	C	.	.	H	α-helix	trans	-58.1	-31	-177.9	-49.4	0.1	0	0	0	112.4	R548	R548-D1072 IonicContact CZ-OD1 3.59Å; R548-D1072 IonicContact NH1-OD1 2.89Å; R548-D1072 PolarHBondContact NH1-OD1 2.84Å; R548-D1072 IonicContact NH1-OD2 3.12Å; R548-D1072 IonicContact NH2-OD1 3.24Å; R548-D1072 PolarHBondContact NH2-OD1 3.2Å
1073	S	81.7	Confident	87.1	Confident	37 Å²	37	18.8 Å²	18.8	26%	0.259	10%	0.103	S	C	.	.	H	α-helix	trans	-86.5	-12.7	-178.1	-48.8	0	0	0	0	113.7	N1071 T1076 L1077	N1071-S1073 PolarHBondContact O-N 3.31Å; N1071-S1073 VanDerWaalsContact O-N 3.16Å; N1071-S1073 PolarHBondContact OD1-N 3.3Å; S1073-T1076 PolarHBondContact O-N 2.74Å; S1073-L1077 PolarHBondContact O-N 3.27Å
1074	A	84.1	Confident	86.7	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-63.8	-48.6	-179.9	0	0	0	0	0	110.8	M630 T1067 N1071 T1076 L1077 I1078	M630-A1074 HydrophobicContact CE-CB 4.12Å; T1067-A1074 HydrophobicContact CG2-CB 3.91Å; N1071-A1074 HydrophobicContact CB-CB 3.96Å; N1071-A1074 WeakPolarHBondContact O-CB 3.44Å; N1071-A1074 PolarHBondContact O-N 2.96Å; N1071-A1074 PolarHBondContact OD1-N 3.5Å; A1074-T1076 VanDerWaalsContact C-N 3.29Å; A1074-T1076 PolarHBondContact O-N 3.03Å; A1074-L1077 WeakPolarHBondContact O-CB 3.49Å; A1074-L1077 PolarHBondContact O-N 3.38Å; A1074-I1078 WeakPolarHBondContact O-CD1 3.34Å; A1074-I1078 WeakPolarHBondContact O-CG1 3.08Å; A1074-I1078 PolarHBondContact O-N 2.73Å
1075	L	87	Confident	86	Confident	2 Å²	2	18.8 Å²	18.8	1%	0.01	11%	0.105	C	C	.	.	H	α-helix	trans	-59.9	-41.5	179.3	-177.2	63.1	0	0	0	111.7	D575 I577 L582 T1068 I1078 R1079	D575-L1075 HydrophobicContact CB-CD2 3.94Å; I577-L1075 HydrophobicContact CG1-CD2 4.07Å; L582-L1075 HydrophobicContact CD1-CD1 4.29Å; T1068-L1075 HydrophobicContact CG2-CB 4.16Å; T1068-L1075 HydrophobicContact CG2-CD2 4Å; L1075-I1078 PolarHBondContact O-N 3.35Å; L1075-R1079 HydrophobicContact CD1-CG 4.25Å; L1075-R1079 HydrophobicContact CG-CG 4.41Å; L1075-R1079 WeakPolarHBondContact O-CB 3.34Å; L1075-R1079 VanDerWaalsContact O-CG 3.3Å; L1075-R1079 WeakPolarHBondContact O-CG 3.34Å; L1075-R1079 PolarHBondContact O-N 3.46Å
1076	T	85.8	Confident	85.4	Confident	58 Å²	58	19.6 Å²	19.6	36%	0.356	11%	0.112	S	C	.	.	H	α-helix	trans	-61	-46.7	176.5	-53.8	0	0	0	0	111.4	I674 S1073 A1074 I1078 R1079 T1080	I674-T1076 HydrophobicContact CD1-CG2 3.72Å; I674-T1076 HydrophobicContact CG1-CG2 4.49Å; S1073-T1076 PolarHBondContact O-N 2.74Å; A1074-T1076 VanDerWaalsContact C-N 3.29Å; A1074-T1076 PolarHBondContact O-N 3.03Å; T1076-I1078 VanDerWaalsContact C-N 3.34Å; T1076-I1078 PolarHBondContact O-N 2.86Å; T1076-R1079 PolarHBondContact O-N 2.85Å; T1076-T1080 PolarHBondContact O-N 3.06Å; T1076-T1080 PolarHBondContact O-OG1 3.37Å
1077	L	88	Confident	85	Confident	2 Å²	2	21.6 Å²	21.6	1%	0.01	12%	0.124	C	C	.	.	H	α-helix	trans	-57.8	-47.2	175.8	171.6	65.8	0	0	0	111.5	M630 L660 A661 I674 I676 F691 S1073 A1074 T1080 L1081	M630-L1077 HydrophobicContact CE-CD2 3.95Å; M630-L1077 HydrophobicContact SD-CD2 3.69Å; L660-L1077 HydrophobicContact CD2-CD1 3.85Å; L660-L1077 HydrophobicContact CD2-CD2 4.08Å; L660-L1077 HydrophobicContact CD2-CG 4.46Å; A661-L1077 HydrophobicContact CB-CD1 3.96Å; I674-L1077 HydrophobicContact CD1-CB 4.08Å; I674-L1077 HydrophobicContact CG2-CD1 3.78Å; I676-L1077 HydrophobicContact CD1-CD1 3.82Å; I676-L1077 HydrophobicContact CG1-CD1 3.78Å; F691-L1077 HydrophobicContact CB-CD2 4.13Å; F691-L1077 HydrophobicContact CD1-CD2 3.58Å; F691-L1077 HydrophobicContact CE1-CB 4.29Å; F691-L1077 HydrophobicContact CE1-CD2 4.18Å; F691-L1077 HydrophobicContact CG-CD2 3.95Å; S1073-L1077 PolarHBondContact O-N 3.27Å; A1074-L1077 WeakPolarHBondContact O-CB 3.49Å; A1074-L1077 PolarHBondContact O-N 3.38Å; L1077-T1080 PolarHBondContact O-N 3.47Å; L1077-L1081 WeakPolarHBondContact O-CB 3.46Å; L1077-L1081 PolarHBondContact O-N 2.64Å
1078	I	90	Very high	84.7	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-61.4	-49	-179.4	-63	167.7	0	0	0	110	L582 F586 F604 M630 L1064 A1074 L1075 T1076 T1080 L1081 V1082	L582-I1078 HydrophobicContact CD2-CG2 4.17Å; F586-I1078 HydrophobicContact CE1-CG2 4.29Å; F586-I1078 HydrophobicContact CZ-CG2 3.7Å; F604-I1078 HydrophobicContact CD1-CD1 3.53Å; F604-I1078 HydrophobicContact CD1-CG1 4.22Å; F604-I1078 HydrophobicContact CD2-CD1 3.86Å; F604-I1078 HydrophobicContact CE1-CD1 3.26Å; F604-I1078 HydrophobicContact CE1-CG1 3.43Å; F604-I1078 VanDerWaalsContact CE1-CG1 3.43Å; F604-I1078 HydrophobicContact CE2-CD1 3.58Å; F604-I1078 HydrophobicContact CE2-CG1 3.94Å; F604-I1078 HydrophobicContact CE2-CG2 4.15Å; F604-I1078 HydrophobicContact CG-CD1 3.82Å; F604-I1078 HydrophobicContact CZ-CB 4.26Å; F604-I1078 HydrophobicContact CZ-CD1 3.26Å; F604-I1078 HydrophobicContact CZ-CG1 3.24Å; F604-I1078 HydrophobicContact CZ-CG2 4.07Å; M630-I1078 HydrophobicContact CE-CD1 4.23Å; M630-I1078 HydrophobicContact CE-CG1 4.08Å; L1064-I1078 HydrophobicContact CD2-CD1 3.59Å; A1074-I1078 WeakPolarHBondContact O-CD1 3.34Å; A1074-I1078 WeakPolarHBondContact O-CG1 3.08Å; A1074-I1078 PolarHBondContact O-N 2.73Å; L1075-I1078 PolarHBondContact O-N 3.35Å; T1076-I1078 VanDerWaalsContact C-N 3.34Å; T1076-I1078 PolarHBondContact O-N 2.86Å; I1078-T1080 VanDerWaalsContact C-N 3.34Å; I1078-T1080 PolarHBondContact O-N 3.41Å; I1078-L1081 PolarHBondContact O-N 3.26Å; I1078-V1082 HydrophobicContact CG2-CG2 3.96Å; I1078-V1082 WeakPolarHBondContact O-CB 3.4Å; I1078-V1082 WeakPolarHBondContact O-CG2 3.42Å; I1078-V1082 PolarHBondContact O-N 2.66Å
1079	R	89.7	Confident	84.3	Confident	41 Å²	41	29.7 Å²	29.7	16%	0.155	17%	0.167	C	C	.	.	H	α-helix	trans	-60.4	-44.4	178.6	-73.2	178.2	64.9	-149.1	-14.9	111.1	E581 L582 L1075 T1076 L1081 V1082 T1083 E1091	E581-R1079 IonicContact OE1-CZ 3.45Å; E581-R1079 IonicContact OE1-NE 3.88Å; E581-R1079 PolarHBondContact OE1-NE 2.9Å; E581-R1079 IonicContact OE1-NH2 3.61Å; E581-R1079 PolarHBondContact OE1-NH2 3.4Å; E581-R1079 IonicContact OE2-NE 2.73Å; L582-R1079 HydrophobicContact CD2-CG 4.06Å; L1075-R1079 HydrophobicContact CD1-CG 4.25Å; L1075-R1079 HydrophobicContact CG-CG 4.41Å; L1075-R1079 WeakPolarHBondContact O-CB 3.34Å; L1075-R1079 VanDerWaalsContact O-CG 3.3Å; L1075-R1079 WeakPolarHBondContact O-CG 3.34Å; L1075-R1079 PolarHBondContact O-N 3.46Å; T1076-R1079 PolarHBondContact O-N 2.85Å; R1079-L1081 VanDerWaalsContact C-N 3.34Å; R1079-L1081 PolarHBondContact O-N 3.43Å; R1079-V1082 PolarHBondContact O-N 2.98Å; R1079-T1083 VanDerWaalsContact O-CB 3.31Å; R1079-T1083 WeakPolarHBondContact O-CB 3.4Å; R1079-T1083 WeakPolarHBondContact O-CG2 3.29Å; R1079-T1083 PolarHBondContact O-N 3.44Å; R1079-T1083 PolarHBondContact O-OG1 3.49Å; R1079-E1091 IonicContact CZ-OE1 2.63Å; R1079-E1091 IonicContact CZ-OE2 3.93Å; R1079-E1091 IonicContact NH1-OE2 3.42Å; R1079-E1091 IonicContact NH2-OE1 2.62Å; R1079-E1091 PolarHBondContact NH2-OE1 2.83Å; R1079-E1091 IonicContact NH2-OE2 3.92Å; R1079-E1091 PolarHBondContact NH2-OE2 2.89Å
1080	T	88	Confident	84	Confident	44 Å²	44	29.3 Å²	29.3	27%	0.27	17%	0.165	S	C	.	.	H	α-helix	trans	-60	-43.5	176.7	-55.9	0	0	0	0	112	I676 T1076 L1077 I1078 G1085	I676-T1080 HydrophobicContact CD1-CG2 3.91Å; T1076-T1080 PolarHBondContact O-N 3.06Å; T1076-T1080 PolarHBondContact O-OG1 3.37Å; L1077-T1080 PolarHBondContact O-N 3.47Å; I1078-T1080 VanDerWaalsContact C-N 3.34Å; I1078-T1080 PolarHBondContact O-N 3.41Å; T1080-G1085 PolarHBondContact O-N 2.98Å
1081	L	88.7	Confident	83.9	Confident	14 Å²	14	28 Å²	28	7%	0.073	16%	0.16	C	C	.	.	H	α-helix	trans	-70.6	-40.5	-179.4	-172.5	61.7	0	0	0	112.6	Q589 F596 M600 I676 L1077 I1078 R1079 V1118 L1190	Q589-L1081 PolarHBondContact NE2-O 3.05Å; F596-L1081 HydrophobicContact CZ-CD2 3.77Å; F596-L1081 HydrophobicContact CZ-CG 3.98Å; M600-L1081 HydrophobicContact CE-CD2 3.69Å; M600-L1081 HydrophobicContact SD-CD2 3.95Å; I676-L1081 HydrophobicContact CD1-CB 4.01Å; I676-L1081 HydrophobicContact CD1-CD1 4.16Å; L1077-L1081 WeakPolarHBondContact O-CB 3.46Å; L1077-L1081 PolarHBondContact O-N 2.64Å; I1078-L1081 PolarHBondContact O-N 3.26Å; R1079-L1081 VanDerWaalsContact C-N 3.34Å; R1079-L1081 PolarHBondContact O-N 3.43Å; L1081-V1118 HydrophobicContact CD1-CG2 3.85Å; L1081-L1190 HydrophobicContact CD1-CD2 4.07Å
1082	V	91.2	Very high	83.9	Confident	0 Å²	0	32 Å²	32	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-83.6	-44.1	-171.5	171.9	0	0	0	0	112.1	F586 Q589 I1078 R1079 G1084	F586-V1082 HydrophobicContact CD1-CG1 4.47Å; F586-V1082 HydrophobicContact CD1-CG2 3.74Å; F586-V1082 HydrophobicContact CE1-CG2 3.39Å; F586-V1082 HydrophobicContact CZ-CG2 3.96Å; Q589-V1082 PolarHBondContact NE2-O 3.27Å; I1078-V1082 HydrophobicContact CG2-CG2 3.96Å; I1078-V1082 WeakPolarHBondContact O-CB 3.4Å; I1078-V1082 WeakPolarHBondContact O-CG2 3.42Å; I1078-V1082 PolarHBondContact O-N 2.66Å; R1079-V1082 PolarHBondContact O-N 2.98Å; V1082-G1084 VanDerWaalsContact C-N 3.28Å; V1082-G1084 PolarHBondContact O-N 2.95Å
1083	T	89.2	Confident	84.2	Confident	12 Å²	12	29.6 Å²	29.6	7%	0.074	17%	0.168	C	C	.	.	H	α-helix	trans	-79.7	-9.1	-175.7	64.3	0	0	0	0	113.8	E581 R1079 G1085 A1086	E581-T1083 HydrophobicContact CG-CG2 4.1Å; R1079-T1083 VanDerWaalsContact O-CB 3.31Å; R1079-T1083 WeakPolarHBondContact O-CB 3.4Å; R1079-T1083 WeakPolarHBondContact O-CG2 3.29Å; R1079-T1083 PolarHBondContact O-N 3.44Å; R1079-T1083 PolarHBondContact O-OG1 3.49Å; T1083-G1085 VanDerWaalsContact C-N 3.33Å; T1083-G1085 PolarHBondContact OG1-N 3.2Å; T1083-A1086 HydrophobicContact CG2-CB 4.23Å; T1083-A1086 VanDerWaalsContact OG1-CB 3.31Å; T1083-A1086 WeakPolarHBondContact OG1-CB 3.47Å; T1083-A1086 PolarHBondContact OG1-N 3.23Å
1084	G	78.6	Confident	84.4	Confident	7 Å²	7	28.9 Å²	28.9	7%	0.072	16%	0.161	C	C	.	.	S	Bend	trans	78.3	16.8	-172.9	0	0	0	0	0	113.7	V1082 R1115	V1082-G1084 VanDerWaalsContact C-N 3.28Å; V1082-G1084 PolarHBondContact O-N 2.95Å; G1084-R1115 PolarHBondContact O-NE 3.37Å; G1084-R1115 PolarHBondContact O-NH2 3.2Å
1085	G	74	Confident	84.1	Confident	4 Å²	4	30.5 Å²	30.5	4%	0.041	18%	0.175	C	C	.	.			trans	100.2	48	179.1	0	0	0	0	0	114.3	M839 T1080 T1083 T1087	M839-G1085 WeakPolarHBondContact CE-O 3.22Å; T1080-G1085 PolarHBondContact O-N 2.98Å; T1083-G1085 VanDerWaalsContact C-N 3.33Å; T1083-G1085 PolarHBondContact OG1-N 3.2Å; G1085-T1087 VanDerWaalsContact C-N 3.33Å; G1085-T1087 PolarHBondContact O-N 3.49Å
1086	A	76.8	Confident	83.8	Confident	19 Å²	19	35.9 Å²	35.9	16%	0.157	20%	0.199	C	C	.	.			trans	-68.8	90.6	168.3	0	0	0	0	0	110.4	T1083	T1083-A1086 HydrophobicContact CG2-CB 4.23Å; T1083-A1086 VanDerWaalsContact OG1-CB 3.31Å; T1083-A1086 WeakPolarHBondContact OG1-CB 3.47Å; T1083-A1086 PolarHBondContact OG1-N 3.23Å
1087	T	81	Confident	83.2	Confident	43 Å²	43	36.2 Å²	36.2	26%	0.264	22%	0.215	S	C	.	.			trans	-67.6	151.9	176.7	46.2	0	0	0	0	111.5	M839 G1085 E1089 L1090 E1091	M839-T1087 HydrophobicContact CE-CG2 3.91Å; G1085-T1087 VanDerWaalsContact C-N 3.33Å; G1085-T1087 PolarHBondContact O-N 3.49Å; T1087-E1089 PolarHBondContact O-N 3.39Å; T1087-E1089 VanDerWaalsContact O-N 3.15Å; T1087-L1090 WeakPolarHBondContact O-CA 3.26Å; T1087-L1090 WeakPolarHBondContact O-CB 3.42Å; T1087-L1090 PolarHBondContact O-N 3.13Å; T1087-E1091 PolarHBondContact O-N 2.71Å
1088	P	79.1	Confident	82.4	Confident	71 Å²	71	38.3 Å²	38.3	46%	0.461	23%	0.233	S	C	.	.	H	α-helix	trans	-53.1	-34	172.6	-26.4	34.8	0	0	0	113.6	L1090 E1091 L1092	P1088-L1090 VanDerWaalsContact C-N 3.33Å; P1088-L1090 PolarHBondContact O-N 3.01Å; P1088-E1091 PolarHBondContact O-N 3.11Å; P1088-E1091 VanDerWaalsContact O-N 3.17Å; P1088-L1092 PolarHBondContact O-N 3.38Å
1089	E	81.1	Confident	82	Confident	119 Å²	119	39.3 Å²	39.3	56%	0.556	24%	0.243	S	C	*	.	H	α-helix	trans	-57.6	-44.3	173.5	-177.2	180	178.7	0	0	112.1	T837 T1087 L1092 I1093	T837-E1089 HydrophobicContact CG2-CG 4.39Å; T1087-E1089 PolarHBondContact O-N 3.39Å; T1087-E1089 VanDerWaalsContact O-N 3.15Å; E1089-L1092 PolarHBondContact O-N 2.89Å; E1089-I1093 HydrophobicContact CG-CD1 4.33Å; E1089-I1093 WeakPolarHBondContact O-CG1 3.47Å; E1089-I1093 PolarHBondContact O-N 2.91Å; E1089-I1093 VanDerWaalsContact O-N 3.11Å
1090	L	85.5	Confident	81.8	Confident	2 Å²	2	38 Å²	38	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-64.4	-42.4	175.9	-179	62.4	0	0	0	110.6	T837 F840 T1087 P1088 L1092 I1093 L1094 L1100	T837-L1090 HydrophobicContact CG2-CB 4.22Å; T837-L1090 HydrophobicContact CG2-CD1 4.32Å; F840-L1090 HydrophobicContact CD2-CD2 3.85Å; F840-L1090 HydrophobicContact CE2-CD2 3.36Å; F840-L1090 HydrophobicContact CZ-CD2 4.4Å; T1087-L1090 WeakPolarHBondContact O-CA 3.26Å; T1087-L1090 WeakPolarHBondContact O-CB 3.42Å; T1087-L1090 PolarHBondContact O-N 3.13Å; P1088-L1090 VanDerWaalsContact C-N 3.33Å; P1088-L1090 PolarHBondContact O-N 3.01Å; L1090-L1092 VanDerWaalsContact C-N 3.26Å; L1090-L1092 PolarHBondContact O-N 3.4Å; L1090-I1093 PolarHBondContact O-N 3.16Å; L1090-L1094 HydrophobicContact CD1-CD1 4.27Å; L1090-L1094 HydrophobicContact CD1-CD2 4.47Å; L1090-L1094 HydrophobicContact CD1-CG 4.26Å; L1090-L1094 HydrophobicContact CG-CD1 3.93Å; L1090-L1094 HydrophobicContact CG-CG 4.37Å; L1090-L1094 WeakPolarHBondContact O-CG 3.42Å; L1090-L1094 PolarHBondContact O-N 3.15Å; L1090-L1100 HydrophobicContact CD1-CD1 3.71Å
1091	E	83.1	Confident	81.8	Confident	18 Å²	18	41.1 Å²	41.1	8%	0.084	25%	0.245	C	C	.	.	H	α-helix	trans	-60	-38.6	178.5	-53.9	-153.8	114.2	0	0	112.2	Y556 K559 R1079 T1087 P1088 L1094 A1095	Y556-E1091 PolarHBondContact OH-OE1 3.25Å; K559-E1091 WeakPolarHBondContact CE-OE1 3.4Å; K559-E1091 IonicContact NZ-OE1 3.5Å; K559-E1091 PolarHBondContact NZ-OE1 3.18Å; K559-E1091 IonicContact NZ-OE2 3.84Å; R1079-E1091 IonicContact CZ-OE1 2.63Å; R1079-E1091 IonicContact CZ-OE2 3.93Å; R1079-E1091 IonicContact NH1-OE2 3.42Å; R1079-E1091 IonicContact NH2-OE1 2.62Å; R1079-E1091 PolarHBondContact NH2-OE1 2.83Å; R1079-E1091 IonicContact NH2-OE2 3.92Å; R1079-E1091 PolarHBondContact NH2-OE2 2.89Å; T1087-E1091 PolarHBondContact O-N 2.71Å; P1088-E1091 PolarHBondContact O-N 3.11Å; P1088-E1091 VanDerWaalsContact O-N 3.17Å; E1091-L1094 PolarHBondContact O-N 3.31Å; E1091-A1095 WeakPolarHBondContact O-CB 3.4Å; E1091-A1095 PolarHBondContact O-N 3.09Å
1092	L	81.7	Confident	81.6	Confident	107 Å²	107	41.5 Å²	41.5	56%	0.56	25%	0.253	S	S	*	.	H	α-helix	trans	-64.5	-45.2	175.5	-172.9	65.6	0	0	0	111.9	P1088 E1089 L1090 L1094 A1095 E1096	P1088-L1092 PolarHBondContact O-N 3.38Å; E1089-L1092 PolarHBondContact O-N 2.89Å; L1090-L1092 VanDerWaalsContact C-N 3.26Å; L1090-L1092 PolarHBondContact O-N 3.4Å; L1092-L1094 PolarHBondContact O-N 3.39Å; L1092-A1095 WeakPolarHBondContact O-CB 3.26Å; L1092-A1095 PolarHBondContact O-N 3.46Å; L1092-A1095 VanDerWaalsContact O-N 3.11Å; L1092-E1096 PolarHBondContact O-N 3.23Å; L1092-E1096 VanDerWaalsContact O-N 3.13Å
1093	I	84.7	Confident	81.4	Confident	21 Å²	21	44.1 Å²	44.1	11%	0.108	27%	0.267	C	S	.	.	H	α-helix	trans	-58.7	-37.3	176.6	-67.1	165.3	0	0	0	111	T837 E1089 L1090 E1096	T837-I1093 HydrophobicContact CG2-CD1 3.85Å; E1089-I1093 HydrophobicContact CG-CD1 4.33Å; E1089-I1093 WeakPolarHBondContact O-CG1 3.47Å; E1089-I1093 PolarHBondContact O-N 2.91Å; E1089-I1093 VanDerWaalsContact O-N 3.11Å; L1090-I1093 PolarHBondContact O-N 3.16Å; I1093-E1096 WeakPolarHBondContact O-CB 3.4Å; I1093-E1096 PolarHBondContact O-N 3.06Å
1094	L	84.2	Confident	81.2	Confident	22 Å²	22	48.2 Å²	48.2	12%	0.115	28%	0.284	C	S	.	.	H	α-helix	trans	-75.7	-32.6	179	-59.3	169.3	0	0	0	112.4	Y556 R883 L1090 E1091 L1092 E1096 G1097	Y556-L1094 HydrophobicContact CE1-CD1 4.15Å; R883-L1094 VanDerWaalsContact CZ-CD1 3.49Å; R883-L1094 VanDerWaalsContact CZ-CD2 3.49Å; R883-L1094 VanDerWaalsContact NH1-CD2 3.32Å; L1090-L1094 HydrophobicContact CD1-CD1 4.27Å; L1090-L1094 HydrophobicContact CD1-CD2 4.47Å; L1090-L1094 HydrophobicContact CD1-CG 4.26Å; L1090-L1094 HydrophobicContact CG-CD1 3.93Å; L1090-L1094 HydrophobicContact CG-CG 4.37Å; L1090-L1094 WeakPolarHBondContact O-CG 3.42Å; L1090-L1094 PolarHBondContact O-N 3.15Å; E1091-L1094 PolarHBondContact O-N 3.31Å; L1092-L1094 PolarHBondContact O-N 3.39Å; L1094-E1096 PolarHBondContact O-N 2.9Å; L1094-G1097 PolarHBondContact O-N 3.06Å
1095	A	78.9	Confident	81.4	Confident	35 Å²	35	49.9 Å²	49.9	29%	0.289	29%	0.294	S	S	.	.	H	α-helix	trans	-64.5	-27.8	173	0	0	0	0	0	112.4	A560 E1091 L1092 G1097	A560-A1095 HydrophobicContact CB-CB 3.83Å; E1091-A1095 WeakPolarHBondContact O-CB 3.4Å; E1091-A1095 PolarHBondContact O-N 3.09Å; L1092-A1095 WeakPolarHBondContact O-CB 3.26Å; L1092-A1095 PolarHBondContact O-N 3.46Å; L1092-A1095 VanDerWaalsContact O-N 3.11Å; A1095-G1097 PolarHBondContact O-N 2.63Å
1096	E	79.5	Confident	82	Confident	114 Å²	114	52.8 Å²	52.8	53%	0.533	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-14	171.3	-64.4	178.5	-172	0	0	113.4	L1092 I1093 L1094 A1098 R1101	L1092-E1096 PolarHBondContact O-N 3.23Å; L1092-E1096 VanDerWaalsContact O-N 3.13Å; I1093-E1096 WeakPolarHBondContact O-CB 3.4Å; I1093-E1096 PolarHBondContact O-N 3.06Å; L1094-E1096 PolarHBondContact O-N 2.9Å; E1096-A1098 VanDerWaalsContact C-N 3.33Å; E1096-A1098 PolarHBondContact O-N 3.15Å; E1096-R1101 IonicContact OE2-CZ 3.16Å; E1096-R1101 IonicContact OE2-NH1 2.74Å; E1096-R1101 PolarHBondContact OE2-NH1 2.64Å; E1096-R1101 IonicContact OE2-NH2 2.73Å; E1096-R1101 PolarHBondContact OE2-NH2 3.3Å
1097	G	75	Confident	82.4	Confident	66 Å²	66	58.6 Å²	58.6	68%	0.68	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	2.9	174.1	0	0	0	0	0	115.6	L1094 A1095 G1099	L1094-G1097 PolarHBondContact O-N 3.06Å; A1095-G1097 PolarHBondContact O-N 2.63Å; G1097-G1099 VanDerWaalsContact C-N 3.29Å; G1097-G1099 PolarHBondContact O-N 3.19Å
1098	A	71.3	Confident	82.5	Confident	46 Å²	46	63.2 Å²	63.2	38%	0.38	35%	0.354	S	S	.	.	S	Bend	trans	-83.1	0.4	-179.4	0	0	0	0	0	114.7	E1096 R1101	E1096-A1098 VanDerWaalsContact C-N 3.33Å; E1096-A1098 PolarHBondContact O-N 3.15Å; A1098-R1101 VanDerWaalsContact CB-NE 3.32Å
1099	G	81	Confident	82.7	Confident	21 Å²	21	62.8 Å²	62.8	22%	0.216	34%	0.343	C	S	.	.			trans	71.5	-162.8	-174.1	0	0	0	0	0	113	G1097 R1101	G1097-G1099 VanDerWaalsContact C-N 3.29Å; G1097-G1099 PolarHBondContact O-N 3.19Å; G1099-R1101 PolarHBondContact O-N 3.15Å
1100	L	85.4	Confident	82.9	Confident	13 Å²	13	60 Å²	60	7%	0.068	33%	0.331	C	S	.	.	S	Bend	trans	-80.2	112.5	-179.8	-168.8	70.5	0	0	0	110	D835 F840 W842 N920 L921 L1090	D835-L1100 HydrophobicContact CB-CD1 3.68Å; D835-L1100 HydrophobicContact CB-CD2 4.06Å; D835-L1100 HydrophobicContact CB-CG 3.78Å; F840-L1100 HydrophobicContact CB-CD2 4.48Å; W842-L1100 PolarHBondContact NE1-O 3.04Å; N920-L1100 HydrophobicContact CB-CB 4.48Å; N920-L1100 PolarHBondContact OD1-O 3.35Å; L921-L1100 HydrophobicContact CD2-CD2 4.05Å; L1090-L1100 HydrophobicContact CD1-CD1 3.71Å
1101	R	86.9	Confident	82.9	Confident	109 Å²	109	65.5 Å²	65.5	41%	0.411	36%	0.355	S	S	.	.			trans	-86.5	134.2	179.1	-61.7	-178	-177.8	151.1	6.5	110.2	D835 S836 E1096 A1098 G1099	D835-R1101 CarbonylContact C-O 3.51Å; D835-R1101 VanDerWaalsContact CA-O 3.23Å; D835-R1101 WeakPolarHBondContact CA-O 3.5Å; S836-R1101 PolarHBondContact N-O 3.08Å; E1096-R1101 IonicContact OE2-CZ 3.16Å; E1096-R1101 IonicContact OE2-NH1 2.74Å; E1096-R1101 PolarHBondContact OE2-NH1 2.64Å; E1096-R1101 IonicContact OE2-NH2 2.73Å; E1096-R1101 PolarHBondContact OE2-NH2 3.3Å; A1098-R1101 VanDerWaalsContact CB-NE 3.32Å; G1099-R1101 PolarHBondContact O-N 3.15Å
1102	G	86	Confident	83	Confident	22 Å²	22	67.9 Å²	67.9	23%	0.227	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	147.6	170.4	0	0	0	0	0	111
1103	D	86.3	Confident	83.3	Confident	55 Å²	55	64.2 Å²	64.2	29%	0.294	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	166.5	174.4	-157.7	-4.8	0	0	0	111.9	Y834 R1109	Y834-D1103 PolarHBondContact O-N 2.89Å; D1103-R1109 IonicContact OD1-NH1 2.77Å; D1103-R1109 IonicContact OD2-CZ 3.74Å; D1103-R1109 IonicContact OD2-NH1 3.98Å; D1103-R1109 PolarHBondContact OD2-NH1 3.46Å; D1103-R1109 IonicContact OD2-NH2 3.67Å; D1103-R1109 PolarHBondContact OD2-NH2 3.34Å
1104	F	85.8	Confident	83.3	Confident	99 Å²	99	67 Å²	67	43%	0.434	36%	0.362	S	S	.	.			trans	-63.7	144.5	178.6	-64.4	-79.6	0	0	0	111.7	Q830 I832 T1106 R1109	Q830-F1104 HydrophobicContact CB-CD1 4.26Å; Q830-F1104 HydrophobicContact CB-CE1 4.41Å; I832-F1104 HydrophobicContact CG1-CD1 4.44Å; I832-F1104 HydrophobicContact CG1-CE1 4.34Å; F1104-T1106 PolarHBondContact O-N 3.36Å; F1104-R1109 PolarHBondContact O-NH1 3.2Å
1105	S	83.1	Confident	83.5	Confident	42 Å²	42	68 Å²	68	29%	0.294	37%	0.365	S	S	.	.			trans	-81.7	94.8	-177.5	-55.3	0	0	0	0	111	Y834	Y834-S1105 WeakPolarHBondContact CD2-OG 3.31Å
1106	T	85.7	Confident	84	Confident	64 Å²	64	67.5 Å²	67.5	39%	0.393	36%	0.359	S	S	.	.			trans	-76.4	156.7	169.2	62.8	0	0	0	0	110.5	F1104 E1108 R1109 L1110	F1104-T1106 PolarHBondContact O-N 3.36Å; T1106-E1108 PolarHBondContact O-N 2.8Å; T1106-R1109 PolarHBondContact O-N 3.37Å; T1106-R1109 WeakPolarHBondContact OG1-CG 3.49Å; T1106-R1109 PolarHBondContact OG1-N 3.31Å; T1106-L1110 WeakPolarHBondContact O-CG 3.42Å; T1106-L1110 PolarHBondContact O-N 3.42Å
1107	E	84.4	Confident	84.5	Confident	141 Å²	141	63.3 Å²	63.3	66%	0.659	34%	0.338	S	S	*	.	H	α-helix	trans	-57.9	-37.4	178.3	-166.4	-166	133.6	0	0	111.9	L1110 K1111	E1107-L1110 PolarHBondContact O-N 3Å; E1107-K1111 WeakPolarHBondContact O-CG 3.24Å; E1107-K1111 PolarHBondContact O-N 3.27Å; E1107-K1111 VanDerWaalsContact O-N 3.09Å; E1107-K1111 VanDerWaalsContact OE1-CE 3.27Å; E1107-K1111 WeakPolarHBondContact OE1-CE 3.09Å; E1107-K1111 IonicContact OE1-NZ 2.71Å; E1107-K1111 PolarHBondContact OE1-NZ 3.1Å
1108	E	83.9	Confident	85.3	Confident	141 Å²	141	60.4 Å²	60.4	66%	0.659	31%	0.307	S	S	*	.	H	α-helix	trans	-62.1	-47.1	175.8	-172.5	177.5	-178.3	0	0	112.2	T1106 L1110 K1111 N1112	T1106-E1108 PolarHBondContact O-N 2.8Å; E1108-L1110 VanDerWaalsContact C-N 3.29Å; E1108-L1110 PolarHBondContact O-N 2.97Å; E1108-K1111 WeakPolarHBondContact O-CB 3.17Å; E1108-K1111 PolarHBondContact O-N 3.47Å; E1108-K1111 VanDerWaalsContact O-N 3.15Å; E1108-N1112 PolarHBondContact O-N 3.2Å
1109	R	84.1	Confident	86.2	Confident	62 Å²	62	59 Å²	59	23%	0.234	30%	0.295	C	S	.	.	H	α-helix	trans	-65.7	-32.5	176.2	-73	175.1	177.8	162.7	-7.8	112.5	S836 D1103 F1104 T1106 K1111 N1112	S836-R1109 PolarHBondContact O-NE 3.04Å; S836-R1109 PolarHBondContact O-NH2 2.83Å; D1103-R1109 IonicContact OD1-NH1 2.77Å; D1103-R1109 IonicContact OD2-CZ 3.74Å; D1103-R1109 IonicContact OD2-NH1 3.98Å; D1103-R1109 PolarHBondContact OD2-NH1 3.46Å; D1103-R1109 IonicContact OD2-NH2 3.67Å; D1103-R1109 PolarHBondContact OD2-NH2 3.34Å; F1104-R1109 PolarHBondContact O-NH1 3.2Å; T1106-R1109 PolarHBondContact O-N 3.37Å; T1106-R1109 WeakPolarHBondContact OG1-CG 3.49Å; T1106-R1109 PolarHBondContact OG1-N 3.31Å; R1109-K1111 VanDerWaalsContact C-N 3.32Å; R1109-N1112 WeakPolarHBondContact O-CB 3.39Å; R1109-N1112 PolarHBondContact O-N 3.44Å
1110	L	85.3	Confident	86.6	Confident	59 Å²	59	59.8 Å²	59.8	31%	0.309	29%	0.294	S	S	.	.	H	α-helix	trans	-69	-30.3	175.3	-70.5	174.2	0	0	0	112.2	Y834 T1106 E1107 E1108 N1112 R1113	Y834-L1110 HydrophobicContact CD2-CD2 4.34Å; Y834-L1110 HydrophobicContact CE2-CD2 3.99Å; T1106-L1110 WeakPolarHBondContact O-CG 3.42Å; T1106-L1110 PolarHBondContact O-N 3.42Å; E1107-L1110 PolarHBondContact O-N 3Å; E1108-L1110 VanDerWaalsContact C-N 3.29Å; E1108-L1110 PolarHBondContact O-N 2.97Å; L1110-N1112 VanDerWaalsContact C-N 3.25Å; L1110-N1112 PolarHBondContact O-N 2.89Å; L1110-R1113 VanDerWaalsContact O-CB 3.24Å; L1110-R1113 WeakPolarHBondContact O-CB 3.32Å; L1110-R1113 WeakPolarHBondContact O-CD 3.36Å; L1110-R1113 VanDerWaalsContact O-CG 3.27Å; L1110-R1113 WeakPolarHBondContact O-CG 3.39Å; L1110-R1113 PolarHBondContact O-N 3.44Å
1111	K	85.6	Confident	86.8	Confident	119 Å²	119	60 Å²	60	52%	0.517	30%	0.295	S	S	.	.	H	α-helix	trans	-65.5	-28.8	172.8	-71.1	171.1	-173.6	167.5	0	112.5	E1107 E1108 R1109 R1113 D1114	E1107-K1111 WeakPolarHBondContact O-CG 3.24Å; E1107-K1111 PolarHBondContact O-N 3.27Å; E1107-K1111 VanDerWaalsContact O-N 3.09Å; E1107-K1111 VanDerWaalsContact OE1-CE 3.27Å; E1107-K1111 WeakPolarHBondContact OE1-CE 3.09Å; E1107-K1111 IonicContact OE1-NZ 2.71Å; E1107-K1111 PolarHBondContact OE1-NZ 3.1Å; E1108-K1111 WeakPolarHBondContact O-CB 3.17Å; E1108-K1111 PolarHBondContact O-N 3.47Å; E1108-K1111 VanDerWaalsContact O-N 3.15Å; R1109-K1111 VanDerWaalsContact C-N 3.32Å; K1111-R1113 PolarHBondContact O-N 3.08Å; K1111-D1114 WeakPolarHBondContact O-CB 3.44Å; K1111-D1114 PolarHBondContact O-N 2.7Å; K1111-D1114 VanDerWaalsContact O-N 3.1Å
1112	N	85.5	Confident	86.9	Confident	68 Å²	68	55.9 Å²	55.9	36%	0.364	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-22.9	175.2	-70	-14.7	0	0	0	112	T837 M839 E1108 R1109 L1110 D1114 R1115	T837-N1112 PolarHBondContact O-ND2 3.14Å; M839-N1112 HydrophobicContact SD-CB 3.75Å; E1108-N1112 PolarHBondContact O-N 3.2Å; R1109-N1112 WeakPolarHBondContact O-CB 3.39Å; R1109-N1112 PolarHBondContact O-N 3.44Å; L1110-N1112 VanDerWaalsContact C-N 3.25Å; L1110-N1112 PolarHBondContact O-N 2.89Å; N1112-D1114 PolarHBondContact O-N 3.04Å; N1112-R1115 VanDerWaalsContact O-CG 3.32Å; N1112-R1115 WeakPolarHBondContact O-CG 3.49Å; N1112-R1115 PolarHBondContact O-NH1 3.35Å
1113	R	86.3	Confident	86.7	Confident	30 Å²	30	55.3 Å²	55.3	11%	0.113	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-16.3	180	-57.2	170.6	60.8	-150.9	3.3	114	Y834 S892 L1110 K1111 R1115 Y1193	Y834-R1113 PolarHBondContact OH-NE 3.43Å; Y834-R1113 PolarHBondContact OH-NH2 2.91Å; Y834-R1113 VanDerWaalsContact OH-NH2 3.12Å; S892-R1113 PolarHBondContact O-NE 3.33Å; L1110-R1113 VanDerWaalsContact O-CB 3.24Å; L1110-R1113 WeakPolarHBondContact O-CB 3.32Å; L1110-R1113 WeakPolarHBondContact O-CD 3.36Å; L1110-R1113 VanDerWaalsContact O-CG 3.27Å; L1110-R1113 WeakPolarHBondContact O-CG 3.39Å; L1110-R1113 PolarHBondContact O-N 3.44Å; K1111-R1113 PolarHBondContact O-N 3.08Å; R1113-R1115 PolarHBondContact O-N 3.44Å; R1113-Y1193 VanDerWaalsContact CZ-OH 3.24Å; R1113-Y1193 PolarHBondContact NH2-OH 2.83Å
1114	D	85.2	Confident	86.2	Confident	79 Å²	79	56.7 Å²	56.7	42%	0.422	28%	0.284	S	S	.	.			trans	-73.1	26.2	-174.6	-66.2	-9.7	0	0	0	113.8	K1111 N1112 Y1193 H1195	K1111-D1114 WeakPolarHBondContact O-CB 3.44Å; K1111-D1114 PolarHBondContact O-N 2.7Å; K1111-D1114 VanDerWaalsContact O-N 3.1Å; N1112-D1114 PolarHBondContact O-N 3.04Å; D1114-Y1193 WeakPolarHBondContact OD1-CD1 3.12Å; D1114-H1195 IonicContact OD1-CE1 3.21Å; D1114-H1195 PolarHBondContact OD1-CE1 3.04Å; D1114-H1195 IonicContact OD1-NE2 3.06Å; D1114-H1195 PolarHBondContact OD1-NE2 3.43Å; D1114-H1195 IonicContact OD2-CE1 3.98Å; D1114-H1195 IonicContact OD2-NE2 3.77Å; D1114-H1195 PolarHBondContact OD2-NE2 2.78Å
1115	R	88.3	Confident	85.5	Confident	44 Å²	44	53.5 Å²	53.5	17%	0.166	27%	0.271	C	S	.	.			trans	-82	144.6	177.1	-56.1	-176	-54.4	-85.7	10.9	109.7	M839 G1084 N1112 R1113	M839-R1115 VanDerWaalsContact CE-NH1 3.33Å; M839-R1115 PolarHBondContact O-NH2 2.84Å; M839-R1115 PolarHBondContact SD-NH1 2.59Å; G1084-R1115 PolarHBondContact O-NE 3.37Å; G1084-R1115 PolarHBondContact O-NH2 3.2Å; N1112-R1115 VanDerWaalsContact O-CG 3.32Å; N1112-R1115 WeakPolarHBondContact O-CG 3.49Å; N1112-R1115 PolarHBondContact O-NH1 3.35Å; R1113-R1115 PolarHBondContact O-N 3.44Å
1116	C	89.1	Confident	84.5	Confident	24 Å²	24	55.7 Å²	55.7	16%	0.162	29%	0.287	C	S	.	.			trans	-62.5	147.9	170.7	-68.3	0	0	0	0	111.2	I676 N677 N893 L1190 Q1191	I676-C1116 PolarHBondContact O-SG 3.4Å; I676-C1116 VanDerWaalsContact O-SG 3.37Å; N677-C1116 PolarHBondContact O-SG 3.37Å; N893-C1116 PolarHBondContact ND2-O 2.9Å; C1116-L1190 HydrophobicContact CB-CB 4.26Å; C1116-Q1191 CarbonylContact C-O 3.58Å; C1116-Q1191 VanDerWaalsContact CA-O 3.29Å; C1116-Q1191 WeakPolarHBondContact CA-O 3.24Å
1117	R	89.9	Confident	83.7	Confident	26 Å²	26	54.4 Å²	54.4	10%	0.098	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	148.3	172.5	66.6	-170.7	-173.9	-177.9	6.2	110.1	N893 F894 E898 L1190 Q1191	N893-R1117 PolarHBondContact O-NH1 3.07Å; F894-R1117 HydrophobicContact CE1-CB 4.41Å; F894-R1117 HydrophobicContact CE1-CG 4.5Å; F894-R1117 HydrophobicContact CZ-CB 4.03Å; E898-R1117 VanDerWaalsContact CD-NH1 3.3Å; E898-R1117 IonicContact OE1-CZ 2.72Å; E898-R1117 IonicContact OE1-NH1 3.57Å; E898-R1117 PolarHBondContact OE1-NH1 3Å; E898-R1117 IonicContact OE1-NH2 3.55Å; E898-R1117 PolarHBondContact OE1-NH2 2.89Å; E898-R1117 IonicContact OE2-CZ 2.71Å; E898-R1117 IonicContact OE2-NH1 3.6Å; E898-R1117 PolarHBondContact OE2-NH1 3.47Å; E898-R1117 IonicContact OE2-NH2 3.14Å; R1117-L1190 WeakPolarHBondContact O-CA 3.29Å; R1117-Q1191 HydrophobicContact CG-CB 4.01Å; R1117-Q1191 PolarHBondContact N-O 3.15Å; R1117-Q1191 VanDerWaalsContact NH2-OE1 3.14Å; R1117-Q1191 PolarHBondContact O-N 3.45Å
1118	V	91.7	Very high	83.2	Confident	5 Å²	5	47.8 Å²	47.8	3%	0.03	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	128.7	171.7	-177.4	0	0	0	0	108.2	A593 F596 L1081 L1190	A593-V1118 HydrophobicContact CB-CG1 3.76Å; F596-V1118 HydrophobicContact CD2-CG1 3.49Å; F596-V1118 VanDerWaalsContact CD2-CG1 3.49Å; F596-V1118 HydrophobicContact CE1-CG2 4.42Å; F596-V1118 HydrophobicContact CE2-CB 4.38Å; F596-V1118 HydrophobicContact CE2-CG1 3.58Å; F596-V1118 HydrophobicContact CE2-CG2 3.84Å; F596-V1118 HydrophobicContact CG-CG1 4.09Å; F596-V1118 HydrophobicContact CZ-CG1 4.23Å; F596-V1118 HydrophobicContact CZ-CG2 3.77Å; L1081-V1118 HydrophobicContact CD1-CG2 3.85Å; V1118-L1190 HydrophobicContact CG2-CD2 4.02Å
1119	A	90.8	Very high	82.3	Confident	16 Å²	16	46.7 Å²	46.7	13%	0.132	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	160.3	175.8	0	0	0	0	0	111.2	V1189	A1119-V1189 HydrophobicContact CB-CG2 4.05Å; A1119-V1189 PolarHBondContact N-O 3.49Å; A1119-V1189 PolarHBondContact O-N 3.24Å
1120	Q	90.1	Very high	81.5	Confident	38 Å²	38	48.1 Å²	48.1	18%	0.178	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	132.6	165.9	-79.9	178.6	10.9	0	0	109.5	A593 P594 Y1186 V1187 Y1188	A593-Q1120 HydrophobicContact CB-CG 3.74Å; P594-Q1120 VanDerWaalsContact N-NE2 3.15Å; P594-Q1120 PolarHBondContact O-NE2 3.06Å; Q1120-Y1186 HydrophobicContact CB-CD1 4.38Å; Q1120-V1187 WeakPolarHBondContact CA-O 3.31Å; Q1120-Y1188 HydrophobicContact CG-CD1 3.83Å; Q1120-Y1188 HydrophobicContact CG-CE1 3.98Å; Q1120-Y1188 HydrophobicContact CG-CG 4.47Å; Q1120-Y1188 VanDerWaalsContact NE2-CZ 3.31Å; Q1120-Y1188 PolarHBondContact NE2-OH 2.89Å
1121	I	89.3	Confident	80.6	Confident	18 Å²	18	47.7 Å²	47.7	9%	0.092	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	125.2	177.8	-57.5	177.6	0	0	0	108.4	D1125 F1128 M1150 V1187 V1189	I1121-D1125 HydrophobicContact CG2-CB 4.11Å; I1121-F1128 HydrophobicContact CB-CE2 3.84Å; I1121-F1128 HydrophobicContact CD1-CE2 4.39Å; I1121-F1128 HydrophobicContact CG2-CD2 3.81Å; I1121-F1128 HydrophobicContact CG2-CE2 3.49Å; I1121-F1128 VanDerWaalsContact CG2-CE2 3.49Å; I1121-M1150 HydrophobicContact CD1-CE 4.11Å; I1121-M1150 HydrophobicContact CD1-SD 3.56Å; I1121-M1150 VanDerWaalsContact CD1-SD 3.56Å; I1121-V1187 PolarHBondContact N-O 3.47Å; I1121-V1187 PolarHBondContact O-N 3.18Å; I1121-V1189 HydrophobicContact CD1-CG2 3.64Å; I1121-V1189 HydrophobicContact CG1-CG2 3.9Å
1122	P	87.8	Confident	79.4	Confident	21 Å²	21	45.6 Å²	45.6	14%	0.136	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	143.2	172.5	29.4	-33.2	0	0	0	110.5	V1124 D1125 Y1186	P1122-V1124 HydrophobicContact CB-CG2 3.78Å; P1122-V1124 HydrophobicContact CG-CG2 4.26Å; P1122-V1124 PolarHBondContact O-N 3.38Å; P1122-V1124 VanDerWaalsContact O-N 3.12Å; P1122-D1125 WeakPolarHBondContact CD-OD2 3.27Å; P1122-D1125 HydrophobicContact CG-CB 4.25Å; P1122-D1125 WeakPolarHBondContact CG-OD2 3.36Å; P1122-D1125 WeakPolarHBondContact O-CB 3.44Å; P1122-D1125 PolarHBondContact O-N 3.25Å; P1122-D1125 VanDerWaalsContact O-N 3.09Å; P1122-Y1186 HydrophobicContact CB-CD1 3.89Å; P1122-Y1186 HydrophobicContact CB-CE1 3.61Å; P1122-Y1186 HydrophobicContact CB-CE2 4.39Å; P1122-Y1186 HydrophobicContact CB-CG 4.41Å; P1122-Y1186 HydrophobicContact CG-CD1 4.48Å; P1122-Y1186 HydrophobicContact CG-CE1 4.06Å
1123	L	82.3	Confident	78.5	Confident	10 Å²	10	48.8 Å²	48.8	5%	0.052	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-16.4	178.3	-73.1	174.7	0	0	0	114.4	D1125 F1128 L1181 L1182 D1185 V1187	L1123-D1125 VanDerWaalsContact C-N 3.27Å; L1123-F1128 HydrophobicContact CD2-CB 4.01Å; L1123-F1128 HydrophobicContact CD2-CD2 4.04Å; L1123-F1128 HydrophobicContact CD2-CG 4.04Å; L1123-L1181 HydrophobicContact CD1-CB 3.76Å; L1123-L1181 HydrophobicContact CD1-CD1 3.99Å; L1123-L1181 HydrophobicContact CD1-CG 4.34Å; L1123-L1181 HydrophobicContact CD2-CD1 4.13Å; L1123-L1182 VanDerWaalsContact CD1-O 3.3Å; L1123-L1182 WeakPolarHBondContact CD1-O 3.26Å; L1123-D1185 HydrophobicContact CD1-CB 3.78Å; L1123-D1185 PolarHBondContact N-O 3.48Å; L1123-V1187 HydrophobicContact CD2-CG2 3.6Å; L1123-V1187 HydrophobicContact CG-CG2 3.98Å
1124	V	76	Confident	77.8	Confident	84 Å²	84	50 Å²	50	51%	0.509	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-16.6	174.7	-76.3	0	0	0	0	113.4	P1122	P1122-V1124 HydrophobicContact CB-CG2 3.78Å; P1122-V1124 HydrophobicContact CG-CG2 4.26Å; P1122-V1124 PolarHBondContact O-N 3.38Å; P1122-V1124 VanDerWaalsContact O-N 3.12Å
1125	D	72.3	Confident	77.7	Confident	32 Å²	32	46.6 Å²	46.6	17%	0.171	28%	0.283	C	S	.	.	S	Bend	trans	-68.8	156.3	179.1	-85.1	-8.4	0	0	0	112.7	I1121 P1122 L1123 C1127 F1128 Q1129	I1121-D1125 HydrophobicContact CG2-CB 4.11Å; P1122-D1125 WeakPolarHBondContact CD-OD2 3.27Å; P1122-D1125 HydrophobicContact CG-CB 4.25Å; P1122-D1125 WeakPolarHBondContact CG-OD2 3.36Å; P1122-D1125 WeakPolarHBondContact O-CB 3.44Å; P1122-D1125 PolarHBondContact O-N 3.25Å; P1122-D1125 VanDerWaalsContact O-N 3.09Å; L1123-D1125 VanDerWaalsContact C-N 3.27Å; D1125-C1127 PolarHBondContact O-N 3.13Å; D1125-C1127 VanDerWaalsContact O-N 3.08Å; D1125-F1128 PolarHBondContact O-N 3.3Å; D1125-Q1129 PolarHBondContact O-N 3.24Å; D1125-Q1129 VanDerWaalsContact O-N 3.16Å
1126	S	61.1	Low	77.8	Confident	89 Å²	89	46 Å²	46	62%	0.622	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-30.9	-173	55.1	0	0	0	0	114	F1128	S1126-F1128 PolarHBondContact O-N 3.48Å
1127	C	70	Confident	77.9	Confident	36 Å²	36	44.9 Å²	44.9	24%	0.243	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-27.4	177.9	-58.1	0	0	0	0	113.5	D1125 Y1148 M1150	D1125-C1127 PolarHBondContact O-N 3.13Å; D1125-C1127 VanDerWaalsContact O-N 3.08Å; C1127-Y1148 HydrophobicContact CB-CE1 4.46Å; C1127-Y1148 HydrophobicContact CB-CE2 4.37Å; C1127-M1150 HydrophobicContact CB-CE 4.39Å
1128	F	73.7	Confident	77.9	Confident	3 Å²	3	44 Å²	44	1%	0.013	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.7	3.4	-177	-58.8	-52.9	0	0	0	113.4	I1121 L1123 D1125 S1126 A1130 F1131 V1140 A1144 M1150	I1121-F1128 HydrophobicContact CB-CE2 3.84Å; I1121-F1128 HydrophobicContact CD1-CE2 4.39Å; I1121-F1128 HydrophobicContact CG2-CD2 3.81Å; I1121-F1128 HydrophobicContact CG2-CE2 3.49Å; I1121-F1128 VanDerWaalsContact CG2-CE2 3.49Å; L1123-F1128 HydrophobicContact CD2-CB 4.01Å; L1123-F1128 HydrophobicContact CD2-CD2 4.04Å; L1123-F1128 HydrophobicContact CD2-CG 4.04Å; D1125-F1128 PolarHBondContact O-N 3.3Å; S1126-F1128 PolarHBondContact O-N 3.48Å; F1128-A1130 PolarHBondContact O-N 2.76Å; F1128-F1131 WeakPolarHBondContact O-CB 3.37Å; F1128-F1131 PolarHBondContact O-N 2.86Å; F1128-V1140 HydrophobicContact CD1-CG1 3.66Å; F1128-V1140 HydrophobicContact CE1-CG1 3.58Å; F1128-V1140 HydrophobicContact CG-CG1 4.44Å; F1128-V1140 HydrophobicContact CZ-CG1 4.29Å; F1128-A1144 HydrophobicContact CE1-CB 3.99Å; F1128-A1144 HydrophobicContact CZ-CB 4.45Å; F1128-M1150 HydrophobicContact CZ-CE 4.39Å
1129	Q	65.1	Low	77.8	Confident	118 Å²	118	48.8 Å²	48.8	55%	0.551	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-56.4	-27.3	-174.3	-171.1	168.6	22.4	0	0	113.5	D1125 F1131 Q1132	D1125-Q1129 PolarHBondContact O-N 3.24Å; D1125-Q1129 VanDerWaalsContact O-N 3.16Å; Q1129-F1131 PolarHBondContact O-N 3.06Å; Q1129-F1131 VanDerWaalsContact O-N 3.17Å; Q1129-Q1132 WeakPolarHBondContact O-CG 3.17Å
1130	A	65.7	Low	77.7	Confident	91 Å²	91	48 Å²	48	75%	0.752	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-63.2	-16.5	174.6	0	0	0	0	0	114.3	F1128	F1128-A1130 PolarHBondContact O-N 2.76Å
1131	F	67.4	Low	77.7	Confident	51 Å²	51	46.2 Å²	46.2	22%	0.224	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-115.5	10.1	-167.3	-63.9	-71.8	0	0	0	114.4	F1128 Q1129 T1133 A1135 V1140 Q1143	F1128-F1131 WeakPolarHBondContact O-CB 3.37Å; F1128-F1131 PolarHBondContact O-N 2.86Å; Q1129-F1131 PolarHBondContact O-N 3.06Å; Q1129-F1131 VanDerWaalsContact O-N 3.17Å; F1131-T1133 PolarHBondContact O-N 3.42Å; F1131-A1135 HydrophobicContact CB-CB 3.53Å; F1131-A1135 HydrophobicContact CD1-CB 3.81Å; F1131-A1135 HydrophobicContact CG-CB 4.09Å; F1131-A1135 VanDerWaalsContact O-CB 3.25Å; F1131-A1135 WeakPolarHBondContact O-CB 3.45Å; F1131-V1140 HydrophobicContact CB-CG2 4.08Å; F1131-V1140 HydrophobicContact CD2-CG2 4.38Å; F1131-V1140 HydrophobicContact CG-CG2 4.08Å; F1131-Q1143 HydrophobicContact CE2-CB 4.1Å; F1131-Q1143 HydrophobicContact CE2-CG 3.82Å; F1131-Q1143 HydrophobicContact CZ-CB 3.98Å; F1131-Q1143 HydrophobicContact CZ-CG 3.87Å
1132	Q	61	Low	77.7	Confident	74 Å²	74	46.3 Å²	46.3	35%	0.346	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-17.5	-167.6	-72.7	-177.3	-10.8	0	0	115.9	Q1129	Q1129-Q1132 WeakPolarHBondContact O-CG 3.17Å
1133	T	65.1	Low	77.7	Confident	135 Å²	135	48.2 Å²	48.2	83%	0.828	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.3	109.7	178.2	36.2	0	0	0	0	112.9	F1131	F1131-T1133 PolarHBondContact O-N 3.42Å
1134	G	71.8	Confident	78	Confident	57 Å²	57	47.8 Å²	47.8	59%	0.588	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.8	5	169.7	0	0	0	0	0	116
1135	A	84.2	Confident	78.7	Confident	6 Å²	6	44 Å²	44	5%	0.05	27%	0.267	C	S	.	.			trans	-65.5	145.3	175	0	0	0	0	0	111.7	F1131 V1140 L1181	F1131-A1135 HydrophobicContact CB-CB 3.53Å; F1131-A1135 HydrophobicContact CD1-CB 3.81Å; F1131-A1135 HydrophobicContact CG-CB 4.09Å; F1131-A1135 VanDerWaalsContact O-CB 3.25Å; F1131-A1135 WeakPolarHBondContact O-CB 3.45Å; A1135-V1140 HydrophobicContact CB-CG2 4.33Å; A1135-L1181 PolarHBondContact O-N 3.03Å; A1135-L1181 VanDerWaalsContact O-N 3.11Å
1136	T	90.2	Very high	79.4	Confident	33 Å²	33	48.6 Å²	48.6	20%	0.202	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-93.7	148.9	175.2	59.5	0	0	0	0	110.2	G1138 Q1139 V1140 P1177 L1179	T1136-G1138 PolarHBondContact O-N 3.41Å; T1136-G1138 VanDerWaalsContact O-N 3.15Å; T1136-Q1139 WeakPolarHBondContact O-CB 3.47Å; T1136-Q1139 PolarHBondContact O-N 3.02Å; T1136-Q1139 VanDerWaalsContact OG1-CD 3.29Å; T1136-Q1139 VanDerWaalsContact OG1-CG 3.27Å; T1136-Q1139 WeakPolarHBondContact OG1-CG 3.44Å; T1136-Q1139 PolarHBondContact OG1-OE1 2.67Å; T1136-V1140 PolarHBondContact O-N 3.02Å; T1136-P1177 VanDerWaalsContact CB-O 3.27Å; T1136-P1177 WeakPolarHBondContact CB-O 3.34Å; T1136-P1177 PolarHBondContact OG1-O 3.44Å; T1136-L1179 CarbonylContact C-O 3.53Å; T1136-L1179 VanDerWaalsContact CA-O 3.3Å; T1136-L1179 WeakPolarHBondContact CA-O 3.42Å
1137	Y	91.2	Very high	80.6	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-52.3	-39.3	179.6	-178.5	-101.7	0	0	0	113.2	Y652 Q1139 V1140 L1141 C1152 I1153 G1154 L1155 P1175 L1179 L1181 V1187	Y652-Y1137 WeakPolarHBondContact OH-CD1 3.35Å; Y652-Y1137 WeakPolarHBondContact OH-CE1 3.41Å; Y1137-Q1139 VanDerWaalsContact C-N 3.32Å; Y1137-Q1139 PolarHBondContact O-N 3.29Å; Y1137-V1140 PolarHBondContact O-N 3.28Å; Y1137-L1141 HydrophobicContact CE1-CD1 3.97Å; Y1137-L1141 PolarHBondContact O-N 3.41Å; Y1137-C1152 HydrophobicContact CE2-CB 4.18Å; Y1137-C1152 VanDerWaalsContact OH-C 3.27Å; Y1137-C1152 WeakPolarHBondContact OH-CB 3.38Å; Y1137-C1152 PolarHBondContact OH-O 3.24Å; Y1137-I1153 VanDerWaalsContact OH-C 3.28Å; Y1137-I1153 PolarHBondContact OH-N 3.3Å; Y1137-G1154 PolarHBondContact OH-N 3.23Å; Y1137-G1154 VanDerWaalsContact OH-N 3.14Å; Y1137-L1155 HydrophobicContact CD2-CD1 4.1Å; Y1137-L1155 HydrophobicContact CD2-CD2 3.79Å; Y1137-L1155 HydrophobicContact CD2-CG 3.96Å; Y1137-L1155 HydrophobicContact CE2-CD2 3.82Å; Y1137-L1155 HydrophobicContact CE2-CG 3.96Å; Y1137-P1175 HydrophobicContact CD1-CB 4.04Å; Y1137-P1175 HydrophobicContact CD1-CG 4.08Å; Y1137-P1175 HydrophobicContact CD2-CG 4.1Å; Y1137-P1175 HydrophobicContact CE1-CB 4.37Å; Y1137-P1175 HydrophobicContact CE1-CG 4Å; Y1137-P1175 HydrophobicContact CE2-CG 3.99Å; Y1137-P1175 HydrophobicContact CG-CB 4.16Å; Y1137-P1175 HydrophobicContact CG-CG 4.12Å; Y1137-L1179 PolarHBondContact N-O 3.4Å; Y1137-L1181 HydrophobicContact CD2-CD2 4.08Å; Y1137-V1187 HydrophobicContact CE2-CG1 4.36Å
1138	G	89.4	Confident	81.3	Confident	8 Å²	8	50.1 Å²	50.1	8%	0.082	28%	0.278	C	S	.	.	H	α-helix	trans	-66.9	-28.4	178.7	0	0	0	0	0	114.9	T1136 S1142 P1177	T1136-G1138 PolarHBondContact O-N 3.41Å; T1136-G1138 VanDerWaalsContact O-N 3.15Å; G1138-S1142 WeakPolarHBondContact O-CB 3.42Å; G1138-S1142 PolarHBondContact O-N 2.97Å; G1138-S1142 VanDerWaalsContact O-N 3.1Å; G1138-P1177 PolarHBondContact N-O 3.29Å
1139	Q	89	Confident	82	Confident	104 Å²	104	51.1 Å²	51.1	49%	0.486	29%	0.289	S	S	.	.	H	α-helix	trans	-70.1	-44.3	173.5	-72.8	169.7	-22	0	0	110.7	T1136 Y1137 S1142 Q1143	T1136-Q1139 WeakPolarHBondContact O-CB 3.47Å; T1136-Q1139 PolarHBondContact O-N 3.02Å; T1136-Q1139 VanDerWaalsContact OG1-CD 3.29Å; T1136-Q1139 VanDerWaalsContact OG1-CG 3.27Å; T1136-Q1139 WeakPolarHBondContact OG1-CG 3.44Å; T1136-Q1139 PolarHBondContact OG1-OE1 2.67Å; Y1137-Q1139 VanDerWaalsContact C-N 3.32Å; Y1137-Q1139 PolarHBondContact O-N 3.29Å; Q1139-S1142 PolarHBondContact O-N 3.34Å; Q1139-Q1143 WeakPolarHBondContact O-CB 3.47Å; Q1139-Q1143 PolarHBondContact O-N 3.31Å; Q1139-Q1143 VanDerWaalsContact O-N 3.07Å
1140	V	88.8	Confident	83.2	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.006	26%	0.264	C	S	.	.	H	α-helix	trans	-63.8	-44.6	177.8	175.2	0	0	0	0	110.8	F1128 F1131 A1135 T1136 Y1137 Q1143 A1144 L1181	F1128-V1140 HydrophobicContact CD1-CG1 3.66Å; F1128-V1140 HydrophobicContact CE1-CG1 3.58Å; F1128-V1140 HydrophobicContact CG-CG1 4.44Å; F1128-V1140 HydrophobicContact CZ-CG1 4.29Å; F1131-V1140 HydrophobicContact CB-CG2 4.08Å; F1131-V1140 HydrophobicContact CD2-CG2 4.38Å; F1131-V1140 HydrophobicContact CG-CG2 4.08Å; A1135-V1140 HydrophobicContact CB-CG2 4.33Å; T1136-V1140 PolarHBondContact O-N 3.02Å; Y1137-V1140 PolarHBondContact O-N 3.28Å; V1140-Q1143 PolarHBondContact O-N 3.49Å; V1140-A1144 WeakPolarHBondContact O-CB 3.35Å; V1140-A1144 PolarHBondContact O-N 3.1Å; V1140-L1181 HydrophobicContact CB-CD1 4.08Å; V1140-L1181 HydrophobicContact CG2-CD1 3.44Å; V1140-L1181 VanDerWaalsContact CG2-CD1 3.44Å
1141	L	90.9	Very high	84.6	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60	-49.8	177.1	-175.3	155.5	0	0	0	111.8	Y652 L658 Y1137 Q1143 A1144 L1145 C1152	Y652-L1141 HydrophobicContact CD1-CD1 3.94Å; Y652-L1141 HydrophobicContact CD1-CD2 3.89Å; Y652-L1141 HydrophobicContact CD1-CG 4.41Å; Y652-L1141 HydrophobicContact CD2-CD1 4.04Å; Y652-L1141 HydrophobicContact CE1-CD1 3.91Å; Y652-L1141 HydrophobicContact CE2-CD1 4.01Å; Y652-L1141 HydrophobicContact CG-CD1 4.01Å; Y652-L1141 HydrophobicContact CG-CD2 4.11Å; L658-L1141 HydrophobicContact CD1-CD1 4.17Å; Y1137-L1141 HydrophobicContact CE1-CD1 3.97Å; Y1137-L1141 PolarHBondContact O-N 3.41Å; L1141-Q1143 VanDerWaalsContact C-N 3.29Å; L1141-Q1143 PolarHBondContact O-N 2.92Å; L1141-A1144 PolarHBondContact O-N 3.38Å; L1141-L1145 VanDerWaalsContact O-CB 3.26Å; L1141-L1145 WeakPolarHBondContact O-CB 3.44Å; L1141-L1145 PolarHBondContact O-N 3.5Å; L1141-C1152 HydrophobicContact CB-CB 4.22Å; L1141-C1152 HydrophobicContact CD1-CB 4.16Å; L1141-C1152 HydrophobicContact CG-CB 4.13Å
1142	S	89.7	Confident	85.8	Confident	19 Å²	19	39 Å²	39	13%	0.133	22%	0.218	C	C	.	.	H	α-helix	trans	-60.6	-40.3	-179	-165.8	0	0	0	0	111.8	D649 G1138 Q1139 K1146	D649-S1142 VanDerWaalsContact CG-OG 3.28Å; D649-S1142 VanDerWaalsContact OD1-CB 3.26Å; D649-S1142 WeakPolarHBondContact OD1-CB 3.4Å; D649-S1142 PolarHBondContact OD1-OG 2.77Å; D649-S1142 PolarHBondContact OD2-OG 3.45Å; G1138-S1142 WeakPolarHBondContact O-CB 3.42Å; G1138-S1142 PolarHBondContact O-N 2.97Å; G1138-S1142 VanDerWaalsContact O-N 3.1Å; Q1139-S1142 PolarHBondContact O-N 3.34Å; S1142-K1146 WeakPolarHBondContact O-CB 3.35Å; S1142-K1146 WeakPolarHBondContact O-CD 3.44Å; S1142-K1146 VanDerWaalsContact O-CG 3.25Å; S1142-K1146 WeakPolarHBondContact O-CG 3.48Å; S1142-K1146 PolarHBondContact O-N 3.43Å; S1142-K1146 VanDerWaalsContact O-N 3.17Å; S1142-K1146 PolarHBondContact OG-NZ 3.37Å
1143	Q	87	Confident	87.4	Confident	61 Å²	61	35.7 Å²	35.7	29%	0.285	20%	0.202	S	C	.	.	H	α-helix	trans	-70.6	-48.5	178.3	-170.1	75.7	-6	0	0	112.1	F1131 Q1139 V1140 L1141 L1145 K1146 E1147	F1131-Q1143 HydrophobicContact CE2-CB 4.1Å; F1131-Q1143 HydrophobicContact CE2-CG 3.82Å; F1131-Q1143 HydrophobicContact CZ-CB 3.98Å; F1131-Q1143 HydrophobicContact CZ-CG 3.87Å; Q1139-Q1143 WeakPolarHBondContact O-CB 3.47Å; Q1139-Q1143 PolarHBondContact O-N 3.31Å; Q1139-Q1143 VanDerWaalsContact O-N 3.07Å; V1140-Q1143 PolarHBondContact O-N 3.49Å; L1141-Q1143 VanDerWaalsContact C-N 3.29Å; L1141-Q1143 PolarHBondContact O-N 2.92Å; Q1143-L1145 PolarHBondContact O-N 2.68Å; Q1143-K1146 PolarHBondContact O-N 2.95Å; Q1143-K1146 VanDerWaalsContact O-N 3.17Å; Q1143-E1147 HydrophobicContact CG-CG 4.36Å; Q1143-E1147 WeakPolarHBondContact CG-OE2 3.32Å; Q1143-E1147 PolarHBondContact NE2-OE1 3.27Å; Q1143-E1147 PolarHBondContact NE2-OE2 3.05Å; Q1143-E1147 PolarHBondContact O-N 3.2Å
1144	A	89.1	Confident	88.8	Confident	1 Å²	1	29.2 Å²	29.2	1%	0.008	16%	0.163	C	C	.	.	H	α-helix	trans	-56.6	-41.8	179.8	0	0	0	0	0	111.6	F1128 V1140 L1141 Y1148 G1149 M1150	F1128-A1144 HydrophobicContact CE1-CB 3.99Å; F1128-A1144 HydrophobicContact CZ-CB 4.45Å; V1140-A1144 WeakPolarHBondContact O-CB 3.35Å; V1140-A1144 PolarHBondContact O-N 3.1Å; L1141-A1144 PolarHBondContact O-N 3.38Å; A1144-Y1148 CarbonylContact O-C 3.36Å; A1144-Y1148 WeakPolarHBondContact O-CA 3.47Å; A1144-Y1148 WeakPolarHBondContact O-CB 3.11Å; A1144-Y1148 PolarHBondContact O-N 3.4Å; A1144-G1149 PolarHBondContact O-N 2.86Å; A1144-G1149 VanDerWaalsContact O-N 3.16Å; A1144-M1150 CarbonylContact C-O 3.27Å; A1144-M1150 HydrophobicContact CB-CB 4.26Å; A1144-M1150 PolarHBondContact O-N 3.32Å; A1144-M1150 VanDerWaalsContact O-N 3.09Å
1145	L	90	Very high	89.9	Confident	4 Å²	4	26.5 Å²	26.5	2%	0.021	14%	0.135	C	C	.	.	H	α-helix	trans	-70.8	-38.4	180	-173.4	61.4	0	0	0	112.3	P645 A648 D649 L1141 Q1143 G1149 M1150 L1151	P645-L1145 HydrophobicContact CB-CD1 4.07Å; P645-L1145 HydrophobicContact CB-CD2 4.49Å; P645-L1145 HydrophobicContact CB-CG 3.97Å; P645-L1145 WeakPolarHBondContact O-CD2 3.43Å; A648-L1145 HydrophobicContact CB-CD2 3.79Å; D649-L1145 HydrophobicContact CB-CD2 4.24Å; L1141-L1145 VanDerWaalsContact O-CB 3.26Å; L1141-L1145 WeakPolarHBondContact O-CB 3.44Å; L1141-L1145 PolarHBondContact O-N 3.5Å; Q1143-L1145 PolarHBondContact O-N 2.68Å; L1145-G1149 WeakPolarHBondContact O-CA 3.04Å; L1145-G1149 PolarHBondContact O-N 2.94Å; L1145-M1150 WeakPolarHBondContact CA-O 3.5Å; L1145-M1150 PolarHBondContact N-O 3.36Å; L1145-L1151 HydrophobicContact CD1-CD1 4.35Å; L1145-L1151 HydrophobicContact CD2-CD1 4.5Å
1146	K	87.4	Confident	90.4	Very high	129 Å²	129	27.4 Å²	27.4	56%	0.561	14%	0.137	S	C	*	.	H	α-helix	trans	-75.4	-44.2	-179.9	-77.5	171.1	-179.1	147.4	0	113.6	D649 S1142 Q1143	D649-K1146 IonicContact OD1-NZ 3.88Å; D649-K1146 WeakPolarHBondContact OD2-CE 3.43Å; D649-K1146 IonicContact OD2-NZ 2.72Å; D649-K1146 PolarHBondContact OD2-NZ 3.25Å; S1142-K1146 WeakPolarHBondContact O-CB 3.35Å; S1142-K1146 WeakPolarHBondContact O-CD 3.44Å; S1142-K1146 VanDerWaalsContact O-CG 3.25Å; S1142-K1146 WeakPolarHBondContact O-CG 3.48Å; S1142-K1146 PolarHBondContact O-N 3.43Å; S1142-K1146 VanDerWaalsContact O-N 3.17Å; S1142-K1146 PolarHBondContact OG-NZ 3.37Å; Q1143-K1146 PolarHBondContact O-N 2.95Å; Q1143-K1146 VanDerWaalsContact O-N 3.17Å
1147	E	85.6	Confident	90.5	Very high	104 Å²	104	26.2 Å²	26.2	49%	0.486	13%	0.128	S	C	.	.	H	α-helix	trans	-88.3	-38.5	-173.6	-69.7	-169.7	150.7	0	0	113	Q1143	Q1143-E1147 HydrophobicContact CG-CG 4.36Å; Q1143-E1147 WeakPolarHBondContact CG-OE2 3.32Å; Q1143-E1147 PolarHBondContact NE2-OE1 3.27Å; Q1143-E1147 PolarHBondContact NE2-OE2 3.05Å; Q1143-E1147 PolarHBondContact O-N 3.2Å
1148	Y	85.6	Confident	90.3	Very high	54 Å²	54	28.4 Å²	28.4	21%	0.212	14%	0.14	C	C	.	.	H	α-helix	trans	-115.5	-7.4	-170.8	-56.6	-88.8	0	0	0	113.3	F1000 C1127 A1144 M1150 P1192	F1000-Y1148 AromaticContact CD1-CD1 3.92Å; F1000-Y1148 HydrophobicContact CD1-CD1 3.92Å; F1000-Y1148 HydrophobicContact CD1-CE1 4.18Å; F1000-Y1148 AromaticContact CE1-CD1 3.15Å; F1000-Y1148 HydrophobicContact CE1-CD1 3.15Å; F1000-Y1148 AromaticContact CE1-CE1 3.53Å; F1000-Y1148 HydrophobicContact CE1-CE1 3.53Å; F1000-Y1148 HydrophobicContact CE1-CG 4.15Å; F1000-Y1148 AromaticContact CZ-CD1 3.72Å; F1000-Y1148 HydrophobicContact CZ-CD1 3.72Å; F1000-Y1148 AromaticContact CZ-CE1 3.74Å; F1000-Y1148 HydrophobicContact CZ-CE1 3.74Å; C1127-Y1148 HydrophobicContact CB-CE1 4.46Å; C1127-Y1148 HydrophobicContact CB-CE2 4.37Å; A1144-Y1148 CarbonylContact O-C 3.36Å; A1144-Y1148 WeakPolarHBondContact O-CA 3.47Å; A1144-Y1148 WeakPolarHBondContact O-CB 3.11Å; A1144-Y1148 PolarHBondContact O-N 3.4Å; Y1148-M1150 HydrophobicContact CD1-CE 4.03Å; Y1148-M1150 HydrophobicContact CD2-CE 3.87Å; Y1148-M1150 HydrophobicContact CG-CE 3.5Å; Y1148-M1150 PolarHBondContact O-N 3.23Å; Y1148-P1192 WeakPolarHBondContact O-CG 3.39Å
1149	G	88.2	Confident	90	Very high	24 Å²	24	28.5 Å²	28.5	25%	0.247	14%	0.138	C	C	.	.			trans	64.7	17.8	-171.7	0	0	0	0	0	113.4	N677 A1144 L1145	N677-G1149 PolarHBondContact ND2-O 3.3Å; A1144-G1149 PolarHBondContact O-N 2.86Å; A1144-G1149 VanDerWaalsContact O-N 3.16Å; L1145-G1149 WeakPolarHBondContact O-CA 3.04Å; L1145-G1149 PolarHBondContact O-N 2.94Å
1150	M	91	Very high	89	Confident	5 Å²	5	27.9 Å²	27.9	3%	0.025	14%	0.139	C	C	.	.			trans	-89.3	124.4	-177.9	-67.2	-168.8	-72.3	0	0	110.5	I1121 C1127 F1128 A1144 L1145 Y1148 V1189 L1190 Q1191	I1121-M1150 HydrophobicContact CD1-CE 4.11Å; I1121-M1150 HydrophobicContact CD1-SD 3.56Å; I1121-M1150 VanDerWaalsContact CD1-SD 3.56Å; C1127-M1150 HydrophobicContact CB-CE 4.39Å; F1128-M1150 HydrophobicContact CZ-CE 4.39Å; A1144-M1150 CarbonylContact C-O 3.27Å; A1144-M1150 HydrophobicContact CB-CB 4.26Å; A1144-M1150 PolarHBondContact O-N 3.32Å; A1144-M1150 VanDerWaalsContact O-N 3.09Å; L1145-M1150 WeakPolarHBondContact CA-O 3.5Å; L1145-M1150 PolarHBondContact N-O 3.36Å; Y1148-M1150 HydrophobicContact CD1-CE 4.03Å; Y1148-M1150 HydrophobicContact CD2-CE 3.87Å; Y1148-M1150 HydrophobicContact CG-CE 3.5Å; Y1148-M1150 PolarHBondContact O-N 3.23Å; M1150-V1189 HydrophobicContact SD-CG2 4.42Å; M1150-L1190 WeakPolarHBondContact CA-O 3.43Å; M1150-Q1191 HydrophobicContact CG-CG 4.29Å; M1150-Q1191 HydrophobicContact SD-CG 4.16Å
1151	L	93.4	Very high	87.6	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	115.2	175.3	-174.9	70.8	0	0	0	110.5	L658 L659 N677 L1145 V1189 L1190	L658-L1151 HydrophobicContact CD1-CD1 4.04Å; L658-L1151 HydrophobicContact CD1-CG 4.41Å; L659-L1151 VanDerWaalsContact O-CD2 3.25Å; L659-L1151 WeakPolarHBondContact O-CD2 3.29Å; N677-L1151 HydrophobicContact CB-CB 4.37Å; L1145-L1151 HydrophobicContact CD1-CD1 4.35Å; L1145-L1151 HydrophobicContact CD2-CD1 4.5Å; L1151-V1189 CarbonylContact O-C 3.6Å; L1151-V1189 VanDerWaalsContact O-CA 3.26Å; L1151-V1189 WeakPolarHBondContact O-CA 3.33Å; L1151-L1190 HydrophobicContact CB-CB 4.3Å; L1151-L1190 HydrophobicContact CD2-CD1 4.15Å; L1151-L1190 PolarHBondContact N-O 3.27Å; L1151-L1190 PolarHBondContact O-N 3.44Å
1152	C	94	Very high	86.1	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	126.5	173	-54.8	0	0	0	0	110.6	Y1137 L1141 V1187 Y1188	Y1137-C1152 HydrophobicContact CE2-CB 4.18Å; Y1137-C1152 VanDerWaalsContact OH-C 3.27Å; Y1137-C1152 WeakPolarHBondContact OH-CB 3.38Å; Y1137-C1152 PolarHBondContact OH-O 3.24Å; L1141-C1152 HydrophobicContact CB-CB 4.22Å; L1141-C1152 HydrophobicContact CD1-CB 4.16Å; L1141-C1152 HydrophobicContact CG-CB 4.13Å; C1152-V1187 HydrophobicContact CB-CG1 3.9Å; C1152-Y1188 CarbonylContact C-O 3.48Å; C1152-Y1188 WeakPolarHBondContact CA-O 3.34Å
1153	I	93.7	Very high	84.7	Confident	3 Å²	3	38.2 Å²	38.2	2%	0.015	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	-30.4	-179.7	-53.7	163.8	0	0	0	112.2	M599 L658 L660 I693 Y1137 N1174 Y1188 L1190	M599-I1153 HydrophobicContact CE-CB 4.45Å; M599-I1153 HydrophobicContact CE-CG2 4.13Å; M599-I1153 HydrophobicContact SD-CB 4.45Å; M599-I1153 HydrophobicContact SD-CG2 3.83Å; L658-I1153 HydrophobicContact CD2-CG2 4.19Å; L660-I1153 HydrophobicContact CD1-CD1 4.27Å; L660-I1153 HydrophobicContact CD1-CG1 4.48Å; I693-I1153 HydrophobicContact CD1-CG2 4.01Å; Y1137-I1153 VanDerWaalsContact OH-C 3.28Å; Y1137-I1153 PolarHBondContact OH-N 3.3Å; I1153-N1174 PolarHBondContact O-N 3.39Å; I1153-Y1188 PolarHBondContact N-O 3.15Å; I1153-L1190 HydrophobicContact CD1-CD1 3.85Å; I1153-L1190 HydrophobicContact CD1-CD2 3.66Å; I1153-L1190 HydrophobicContact CD1-CG 3.43Å; I1153-L1190 VanDerWaalsContact CD1-CG 3.43Å; I1153-L1190 HydrophobicContact CG1-CD1 4.42Å; I1153-L1190 HydrophobicContact CG1-CG 4.15Å
1154	G	94.6	Very high	83.3	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.6	-172.1	-176.1	0	0	0	0	0	113.9	Y1137 I1172 Y1188	Y1137-G1154 PolarHBondContact OH-N 3.23Å; Y1137-G1154 VanDerWaalsContact OH-N 3.14Å; G1154-I1172 CarbonylContact C-O 3.52Å; G1154-I1172 WeakPolarHBondContact CA-O 3.24Å; G1154-Y1188 PolarHBondContact O-N 2.92Å
1155	L	94.5	Very high	81.9	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	150.2	177.9	-60.7	172.2	0	0	0	111.1	Y1137 I1172 P1175 L1179 L1181 Y1186 V1187 Y1188	Y1137-L1155 HydrophobicContact CD2-CD1 4.1Å; Y1137-L1155 HydrophobicContact CD2-CD2 3.79Å; Y1137-L1155 HydrophobicContact CD2-CG 3.96Å; Y1137-L1155 HydrophobicContact CE2-CD2 3.82Å; Y1137-L1155 HydrophobicContact CE2-CG 3.96Å; L1155-I1172 HydrophobicContact CB-CB 4.31Å; L1155-I1172 PolarHBondContact N-O 3.4Å; L1155-I1172 PolarHBondContact O-N 3.47Å; L1155-P1175 HydrophobicContact CD1-CB 4.39Å; L1155-P1175 HydrophobicContact CD1-CG 3.83Å; L1155-P1175 HydrophobicContact CG-CG 3.85Å; L1155-L1179 HydrophobicContact CD1-CD2 3.76Å; L1155-L1181 HydrophobicContact CD1-CD2 3.5Å; L1155-L1181 HydrophobicContact CD2-CD2 3.78Å; L1155-L1181 HydrophobicContact CG-CD2 4.28Å; L1155-Y1186 CarbonylContact C-O 3.5Å; L1155-Y1186 WeakPolarHBondContact CA-O 3.22Å; L1155-V1187 HydrophobicContact CD2-CB 4.38Å; L1155-V1187 HydrophobicContact CD2-CG1 4.37Å; L1155-V1187 HydrophobicContact CD2-CG2 3.84Å; L1155-Y1188 WeakPolarHBondContact O-CE2 3.33Å
1156	Y	94.2	Very high	80.7	Confident	25 Å²	25	49.2 Å²	49.2	10%	0.098	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	87.5	170.1	-166.7	-131.3	0	0	0	108.9	P594 C1052 R1169 Y1170 V1171 Y1186 Y1188	P594-Y1156 HydrophobicContact CB-CE1 4.06Å; C1052-Y1156 PolarHBondContact O-OH 2.89Å; Y1156-R1169 HydrophobicContact CD1-CB 3.66Å; Y1156-R1169 VanDerWaalsContact CD1-CD 3.49Å; Y1156-R1169 HydrophobicContact CD1-CG 4.2Å; Y1156-R1169 HydrophobicContact CD2-CB 3.9Å; Y1156-R1169 HydrophobicContact CE1-CB 3.34Å; Y1156-R1169 VanDerWaalsContact CE1-CD 3.49Å; Y1156-R1169 HydrophobicContact CE1-CG 4.05Å; Y1156-R1169 VanDerWaalsContact CE2-C 3.48Å; Y1156-R1169 HydrophobicContact CE2-CB 3.61Å; Y1156-R1169 WeakPolarHBondContact CE2-O 3.14Å; Y1156-R1169 HydrophobicContact CG-CB 3.91Å; Y1156-R1169 PolarHBondContact O-NH1 3.05Å; Y1156-R1169 PolarHBondContact OH-O 2.86Å; Y1156-Y1170 WeakPolarHBondContact CA-O 3.26Å; Y1156-Y1170 WeakPolarHBondContact CD2-O 3.24Å; Y1156-V1171 HydrophobicContact CD2-CG2 4.09Å; Y1156-V1171 HydrophobicContact CE2-CG2 4.22Å; Y1156-Y1186 PolarHBondContact N-O 3.45Å; Y1156-Y1186 PolarHBondContact O-N 2.83Å; Y1156-Y1188 HydrophobicContact CD2-CE2 4.45Å; Y1156-Y1188 VanDerWaalsContact CD2-OH 3.23Å; Y1156-Y1188 WeakPolarHBondContact CD2-OH 2.95Å; Y1156-Y1188 HydrophobicContact CG-CE2 4.4Å
1157	R	92.3	Very high	80.2	Confident	7 Å²	7	47.1 Å²	47.1	3%	0.026	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	143.5	-167.9	175.1	161.2	-71.2	173.9	-2.8	110.9	D621 R1169 Y1170 I1172 K1180 L1182 D1185	D621-R1157 IonicContact OD2-NH1 2.73Å; R1157-R1169 CarbonylContact O-C 3.54Å; R1157-R1169 WeakPolarHBondContact O-CA 3.47Å; R1157-R1169 WeakPolarHBondContact O-CB 3.32Å; R1157-Y1170 HydrophobicContact CB-CD1 4.47Å; R1157-Y1170 HydrophobicContact CB-CE1 3.91Å; R1157-Y1170 VanDerWaalsContact CD-OH 3.29Å; R1157-Y1170 WeakPolarHBondContact CD-OH 3.44Å; R1157-Y1170 HydrophobicContact CG-CE1 3.78Å; R1157-Y1170 PolarHBondContact N-O 3.33Å; R1157-Y1170 WeakPolarHBondContact O-CD1 3.48Å; R1157-Y1170 PolarHBondContact O-N 3.41Å; R1157-I1172 HydrophobicContact CB-CD1 4.02Å; R1157-K1180 PolarHBondContact NH2-O 3.25Å; R1157-L1182 HydrophobicContact CG-CD1 4.39Å; R1157-D1185 WeakPolarHBondContact CB-OD1 3.27Å; R1157-D1185 WeakPolarHBondContact CG-OD1 3.48Å; R1157-D1185 IonicContact CZ-OD2 3.1Å; R1157-D1185 IonicContact NE-OD1 3.25Å; R1157-D1185 PolarHBondContact NE-OD1 3.37Å; R1157-D1185 VanDerWaalsContact NE-OD1 3.1Å; R1157-D1185 IonicContact NE-OD2 3.61Å; R1157-D1185 PolarHBondContact NE-OD2 2.84Å; R1157-D1185 IonicContact NH2-OD2 3.45Å; R1157-D1185 PolarHBondContact NH2-OD2 3.4Å
1158	L	88.3	Confident	80.2	Confident	47 Å²	47	43.4 Å²	43.4	25%	0.246	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	138.1	174.9	-165.6	73.1	0	0	0	110.4	D1160 K1168 R1169	L1158-D1160 PolarHBondContact O-N 3.23Å; L1158-K1168 WeakPolarHBondContact CD1-O 3.43Å; L1158-R1169 HydrophobicContact CD1-CG 4Å
1159	H	82.8	Confident	80.5	Confident	9 Å²	9	42.7 Å²	42.7	4%	0.042	24%	0.235	C	C	.	.			trans	-75.3	111.5	-179.6	-168.7	-88	0	0	0	110.8	W618 M1161 A1162 K1168 Y1170	W618-H1159 AromaticContact CD1-CE1 3.83Å; W618-H1159 AromaticContact CD1-NE2 3.4Å; W618-H1159 AromaticContact CD2-CD2 3.71Å; W618-H1159 AromaticContact CD2-NE2 3.21Å; W618-H1159 AromaticContact CE2-NE2 3.21Å; W618-H1159 AromaticContact CE3-NE2 3.86Å; W618-H1159 AromaticContact CG-CD2 3.77Å; W618-H1159 AromaticContact CG-NE2 3.38Å; W618-H1159 AromaticContact CZ2-NE2 3.84Å; W618-H1159 AromaticContact NE1-CE1 3.76Å; W618-H1159 AromaticContact NE1-NE2 3.29Å; W618-H1159 PolarHBondContact NE1-NE2 3.21Å; H1159-M1161 PolarHBondContact O-N 2.98Å; H1159-A1162 HydrophobicContact CB-CB 3.98Å; H1159-A1162 PolarHBondContact ND1-N 2.95Å; H1159-A1162 VanDerWaalsContact ND1-N 3.16Å; H1159-A1162 PolarHBondContact O-N 3.36Å; H1159-A1162 VanDerWaalsContact O-N 3.12Å; H1159-K1168 HydrophobicContact CB-CB 4.33Å; H1159-K1168 WeakPolarHBondContact CB-O 3.38Å; H1159-K1168 PolarHBondContact N-O 2.75Å; H1159-Y1170 HydrophobicContact CB-CD1 4.39Å
1160	D	67.3	Low	80.7	Confident	92 Å²	92	41.6 Å²	41.6	49%	0.492	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-27	-171.8	-67.9	-29.4	0	0	0	114.3	L1158	L1158-D1160 PolarHBondContact O-N 3.23Å
1161	M	60.7	Low	80.9	Confident	145 Å²	145	41.4 Å²	41.4	71%	0.714	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-7.1	-179.9	-68.4	-160.6	148.9	0	0	113.9	H1159	H1159-M1161 PolarHBondContact O-N 2.98Å
1162	A	58.6	Low	81	Confident	16 Å²	16	41.6 Å²	41.6	13%	0.132	22%	0.224	C	C	.	.	S	Bend	trans	-71.9	136	176.3	0	0	0	0	0	108.6	H1159 S1164 L1166 K1168	H1159-A1162 HydrophobicContact CB-CB 3.98Å; H1159-A1162 PolarHBondContact ND1-N 2.95Å; H1159-A1162 VanDerWaalsContact ND1-N 3.16Å; H1159-A1162 PolarHBondContact O-N 3.36Å; H1159-A1162 VanDerWaalsContact O-N 3.12Å; A1162-S1164 PolarHBondContact O-N 3.49Å; A1162-L1166 HydrophobicContact CB-CB 4.5Å; A1162-K1168 HydrophobicContact CB-CB 4.44Å
1163	P	59.8	Low	81	Confident	75 Å²	75	41.8 Å²	41.8	49%	0.487	23%	0.225	S	C	.	.			trans	-48.7	136.8	169.2	-22.5	28.6	0	0	0	109.2	E1165 L1166	P1163-E1165 PolarHBondContact O-N 3.46Å; P1163-L1166 HydrophobicContact CB-CD1 3.75Å; P1163-L1166 HydrophobicContact CG-CD1 3.67Å; P1163-L1166 PolarHBondContact O-N 3.12Å
1164	S	58.2	Low	81	Confident	118 Å²	118	42 Å²	42	83%	0.825	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-18.4	-173.5	-49.5	0	0	0	0	113.7	A1162	A1162-S1164 PolarHBondContact O-N 3.49Å
1165	E	58.8	Low	80.9	Confident	139 Å²	139	42.1 Å²	42.1	65%	0.65	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75	-24.5	176.8	-59.1	-174.2	172.9	0	0	114.3	Q1016 P1163	Q1016-E1165 PolarHBondContact NE2-O 3.47Å; P1163-E1165 PolarHBondContact O-N 3.46Å
1166	L	65.8	Low	80.7	Confident	40 Å²	40	43.8 Å²	43.8	21%	0.209	24%	0.237	C	C	.	.	S	Bend	trans	-86.2	-18	-171.5	-86.9	100.8	0	0	0	115.2	A1162 P1163 K1168	A1162-L1166 HydrophobicContact CB-CB 4.5Å; P1163-L1166 HydrophobicContact CB-CD1 3.75Å; P1163-L1166 HydrophobicContact CG-CD1 3.67Å; P1163-L1166 PolarHBondContact O-N 3.12Å; L1166-K1168 HydrophobicContact CB-CG 4.37Å; L1166-K1168 HydrophobicContact CD2-CD 4.4Å; L1166-K1168 PolarHBondContact O-N 2.84Å
1167	N	76.2	Confident	80.4	Confident	86 Å²	86	45.2 Å²	45.2	46%	0.46	25%	0.249	S	C	.	.			trans	47.9	25.3	176.9	-78.4	-25.7	0	0	0	116.1
1168	K	85.5	Confident	80.2	Confident	26 Å²	26	50.4 Å²	50.4	11%	0.113	28%	0.278	C	S	.	.			trans	-68.9	142.6	177.6	-69.9	-175.8	-175.2	177.5	0	110.8	D1033 D1035 L1158 H1159 A1162 L1166	D1033-K1168 IonicContact OD1-NZ 3.33Å; D1033-K1168 PolarHBondContact OD1-NZ 2.94Å; D1033-K1168 WeakPolarHBondContact OD2-CE 3.48Å; D1033-K1168 IonicContact OD2-NZ 3.99Å; D1033-K1168 PolarHBondContact OD2-NZ 2.76Å; D1035-K1168 IonicContact OD1-NZ 2.85Å; D1035-K1168 PolarHBondContact OD1-NZ 3.22Å; D1035-K1168 IonicContact OD2-NZ 2.85Å; D1035-K1168 PolarHBondContact OD2-NZ 3.34Å; L1158-K1168 WeakPolarHBondContact CD1-O 3.43Å; H1159-K1168 HydrophobicContact CB-CB 4.33Å; H1159-K1168 WeakPolarHBondContact CB-O 3.38Å; H1159-K1168 PolarHBondContact N-O 2.75Å; A1162-K1168 HydrophobicContact CB-CB 4.44Å; L1166-K1168 HydrophobicContact CB-CG 4.37Å; L1166-K1168 HydrophobicContact CD2-CD 4.4Å; L1166-K1168 PolarHBondContact O-N 2.84Å
1169	R	91.6	Very high	80.3	Confident	39 Å²	39	49.4 Å²	49.4	15%	0.147	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	144.2	-177.3	-71.3	169.8	176	-77.8	-4.1	109.6	C1052 Y1156 R1157 L1158 T1184 Y1186	C1052-R1169 WeakPolarHBondContact CA-O 3.42Å; C1052-R1169 VanDerWaalsContact CB-O 3.28Å; C1052-R1169 WeakPolarHBondContact CB-O 3.44Å; C1052-R1169 PolarHBondContact SG-O 3.46Å; Y1156-R1169 HydrophobicContact CD1-CB 3.66Å; Y1156-R1169 VanDerWaalsContact CD1-CD 3.49Å; Y1156-R1169 HydrophobicContact CD1-CG 4.2Å; Y1156-R1169 HydrophobicContact CD2-CB 3.9Å; Y1156-R1169 HydrophobicContact CE1-CB 3.34Å; Y1156-R1169 VanDerWaalsContact CE1-CD 3.49Å; Y1156-R1169 HydrophobicContact CE1-CG 4.05Å; Y1156-R1169 VanDerWaalsContact CE2-C 3.48Å; Y1156-R1169 HydrophobicContact CE2-CB 3.61Å; Y1156-R1169 WeakPolarHBondContact CE2-O 3.14Å; Y1156-R1169 HydrophobicContact CG-CB 3.91Å; Y1156-R1169 PolarHBondContact O-NH1 3.05Å; Y1156-R1169 PolarHBondContact OH-O 2.86Å; R1157-R1169 CarbonylContact O-C 3.54Å; R1157-R1169 WeakPolarHBondContact O-CA 3.47Å; R1157-R1169 WeakPolarHBondContact O-CB 3.32Å; L1158-R1169 HydrophobicContact CD1-CG 4Å; R1169-T1184 VanDerWaalsContact CZ-O 3.25Å; R1169-T1184 PolarHBondContact NH1-O 3.47Å; R1169-T1184 PolarHBondContact NH2-O 2.8Å; R1169-Y1186 VanDerWaalsContact CZ-CD2 3.48Å; R1169-Y1186 VanDerWaalsContact CZ-CE2 3.47Å
1170	Y	93.6	Very high	80.6	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	156.9	-179.3	70.1	-83.5	0	0	0	111.7	W618 D621 Y1156 R1157 H1159 I1172	W618-Y1170 HydrophobicContact CB-CD1 4.16Å; W618-Y1170 HydrophobicContact CB-CE1 3.67Å; W618-Y1170 HydrophobicContact CB-CE2 4.28Å; W618-Y1170 HydrophobicContact CE3-CG 4.46Å; W618-Y1170 VanDerWaalsContact O-CE2 3.31Å; W618-Y1170 WeakPolarHBondContact O-CE2 3.49Å; D621-Y1170 HydrophobicContact CB-CE2 4.03Å; Y1156-Y1170 WeakPolarHBondContact CA-O 3.26Å; Y1156-Y1170 WeakPolarHBondContact CD2-O 3.24Å; R1157-Y1170 HydrophobicContact CB-CD1 4.47Å; R1157-Y1170 HydrophobicContact CB-CE1 3.91Å; R1157-Y1170 VanDerWaalsContact CD-OH 3.29Å; R1157-Y1170 WeakPolarHBondContact CD-OH 3.44Å; R1157-Y1170 HydrophobicContact CG-CE1 3.78Å; R1157-Y1170 PolarHBondContact N-O 3.33Å; R1157-Y1170 WeakPolarHBondContact O-CD1 3.48Å; R1157-Y1170 PolarHBondContact O-N 3.41Å; H1159-Y1170 HydrophobicContact CB-CD1 4.39Å; Y1170-I1172 HydrophobicContact CD2-CG1 4.02Å; Y1170-I1172 HydrophobicContact CE2-CD1 3.7Å; Y1170-I1172 HydrophobicContact CE2-CG1 3.53Å
1171	V	95.3	Very high	81.6	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.006	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	135	-174.4	179.4	0	0	0	0	111.3	G595 T598 M599 Y622 A1051 Y1156 T1173 Y1188	G595-V1171 WeakPolarHBondContact O-CG2 3.27Å; T598-V1171 HydrophobicContact CG2-CG2 4.35Å; M599-V1171 HydrophobicContact CB-CG1 3.75Å; M599-V1171 HydrophobicContact CG-CG1 4.47Å; Y622-V1171 WeakPolarHBondContact CD2-O 3.23Å; A1051-V1171 PolarHBondContact O-N 2.94Å; Y1156-V1171 HydrophobicContact CD2-CG2 4.09Å; Y1156-V1171 HydrophobicContact CE2-CG2 4.22Å; V1171-T1173 HydrophobicContact CG1-CG2 3.84Å; V1171-Y1188 HydrophobicContact CG1-CE2 4.39Å
1172	I	95.2	Very high	82.8	Confident	6 Å²	6	48.9 Å²	48.9	3%	0.031	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	111.2	168.1	-53.1	171.4	0	0	0	108	D621 G1154 L1155 R1157 Y1170 P1175	D621-I1172 HydrophobicContact CB-CD1 3.91Å; D621-I1172 HydrophobicContact CB-CG1 4.25Å; G1154-I1172 CarbonylContact C-O 3.52Å; G1154-I1172 WeakPolarHBondContact CA-O 3.24Å; L1155-I1172 HydrophobicContact CB-CB 4.31Å; L1155-I1172 PolarHBondContact N-O 3.4Å; L1155-I1172 PolarHBondContact O-N 3.47Å; R1157-I1172 HydrophobicContact CB-CD1 4.02Å; Y1170-I1172 HydrophobicContact CD2-CG1 4.02Å; Y1170-I1172 HydrophobicContact CE2-CD1 3.7Å; Y1170-I1172 HydrophobicContact CE2-CG1 3.53Å; I1172-P1175 HydrophobicContact CG2-CB 4.17Å; I1172-P1175 HydrophobicContact CG2-CG 3.93Å
1173	T	94.8	Very high	83.9	Confident	4 Å²	4	51.5 Å²	51.5	3%	0.025	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	140.7	-180	74.4	0	0	0	0	110	M599 G625 V1171	M599-T1173 HydrophobicContact CB-CG2 4.01Å; M599-T1173 HydrophobicContact CG-CG2 3.5Å; M599-T1173 HydrophobicContact SD-CG2 4.11Å; G625-T1173 WeakPolarHBondContact CA-OG1 3.27Å; G625-T1173 PolarHBondContact O-OG1 2.88Å; V1171-T1173 HydrophobicContact CG1-CG2 3.84Å
1174	N	93.8	Very high	85.2	Confident	8 Å²	8	51 Å²	51	4%	0.043	28%	0.277	C	S	.	.	S	Bend	trans	38.1	60.4	179.9	-171	31.7	0	0	0	114.8	M628 Y652 L658 I693 I1153	M628-N1174 HydrophobicContact CE-CB 4.27Å; M628-N1174 WeakPolarHBondContact CE-O 3.42Å; M628-N1174 HydrophobicContact CG-CB 4.13Å; M628-N1174 HydrophobicContact SD-CB 4.11Å; Y652-N1174 WeakPolarHBondContact CE2-OD1 3.36Å; L658-N1174 HydrophobicContact CD2-CB 4.24Å; I693-N1174 HydrophobicContact CG2-CB 3.84Å; I693-N1174 PolarHBondContact O-ND2 2.6Å; I1153-N1174 PolarHBondContact O-N 3.39Å
1175	P	92.5	Very high	86.6	Confident	2 Å²	2	45.4 Å²	45.4	1%	0.013	24%	0.238	C	C	.	.			trans	-57.5	153.2	178.8	-10.9	17.7	0	0	0	111.9	Y652 Y1137 L1155 I1172 L1179	Y652-P1175 PolarHBondContact OH-O 2.83Å; Y1137-P1175 HydrophobicContact CD1-CB 4.04Å; Y1137-P1175 HydrophobicContact CD1-CG 4.08Å; Y1137-P1175 HydrophobicContact CD2-CG 4.1Å; Y1137-P1175 HydrophobicContact CE1-CB 4.37Å; Y1137-P1175 HydrophobicContact CE1-CG 4Å; Y1137-P1175 HydrophobicContact CE2-CG 3.99Å; Y1137-P1175 HydrophobicContact CG-CB 4.16Å; Y1137-P1175 HydrophobicContact CG-CG 4.12Å; L1155-P1175 HydrophobicContact CD1-CB 4.39Å; L1155-P1175 HydrophobicContact CD1-CG 3.83Å; L1155-P1175 HydrophobicContact CG-CG 3.85Å; I1172-P1175 HydrophobicContact CG2-CB 4.17Å; I1172-P1175 HydrophobicContact CG2-CG 3.93Å; P1175-L1179 HydrophobicContact CB-CB 4.34Å; P1175-L1179 HydrophobicContact CB-CD2 3.55Å; P1175-L1179 HydrophobicContact CG-CD2 4.35Å
1176	P	89	Confident	88.2	Confident	34 Å²	34	42.7 Å²	42.7	22%	0.221	22%	0.222	C	C	.	.			trans	-68.3	152.2	177.6	31.7	-36.1	0	0	0	110.8	D1178 L1179	P1176-D1178 WeakPolarHBondContact CB-OD1 3.12Å; P1176-D1178 PolarHBondContact O-N 2.87Å; P1176-D1178 VanDerWaalsContact O-N 3.08Å; P1176-L1179 HydrophobicContact CG-CB 4.14Å; P1176-L1179 WeakPolarHBondContact O-CB 3.44Å; P1176-L1179 PolarHBondContact O-N 2.91Å
1177	P	87.3	Confident	89.4	Confident	55 Å²	55	40.8 Å²	40.8	36%	0.357	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-23.7	-170.7	23.4	-34.4	0	0	0	113.8	Y652 T1136 G1138	Y652-P1177 HydrophobicContact CE1-CB 3.9Å; T1136-P1177 VanDerWaalsContact CB-O 3.27Å; T1136-P1177 WeakPolarHBondContact CB-O 3.34Å; T1136-P1177 PolarHBondContact OG1-O 3.44Å; G1138-P1177 PolarHBondContact N-O 3.29Å
1178	D	89.3	Confident	90.3	Very high	117 Å²	117	36.8 Å²	36.8	63%	0.626	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-3.6	-179.7	63.1	-43	0	0	0	114.2	P1176 K1180	P1176-D1178 WeakPolarHBondContact CB-OD1 3.12Å; P1176-D1178 PolarHBondContact O-N 2.87Å; P1176-D1178 VanDerWaalsContact O-N 3.08Å; D1178-K1180 PolarHBondContact O-N 2.89Å
1179	L	89.9	Confident	90.7	Very high	25 Å²	25	35.5 Å²	35.5	13%	0.131	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-60.6	124.7	177.6	-175.1	68.6	0	0	0	110.4	T1136 Y1137 L1155 P1175 P1176	T1136-L1179 CarbonylContact C-O 3.53Å; T1136-L1179 VanDerWaalsContact CA-O 3.3Å; T1136-L1179 WeakPolarHBondContact CA-O 3.42Å; Y1137-L1179 PolarHBondContact N-O 3.4Å; L1155-L1179 HydrophobicContact CD1-CD2 3.76Å; P1175-L1179 HydrophobicContact CB-CB 4.34Å; P1175-L1179 HydrophobicContact CB-CD2 3.55Å; P1175-L1179 HydrophobicContact CG-CD2 4.35Å; P1176-L1179 HydrophobicContact CG-CB 4.14Å; P1176-L1179 WeakPolarHBondContact O-CB 3.44Å; P1176-L1179 PolarHBondContact O-N 2.91Å
1180	K	89.7	Confident	90.7	Very high	152 Å²	152	33.7 Å²	33.7	66%	0.661	18%	0.178	S	C	*	.	B	Isolated β-bridge	trans	-74.2	133.5	174.9	-66.2	-177.2	-179.7	178.6	0	110.5	R1157 D1178	R1157-K1180 PolarHBondContact NH2-O 3.25Å; D1178-K1180 PolarHBondContact O-N 2.89Å
1181	L	88.3	Confident	90.6	Very high	17 Å²	17	36 Å²	36	9%	0.089	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-86.8	146.1	177.7	-60.6	178.9	0	0	0	111.5	L1123 A1135 Y1137 V1140 L1155	L1123-L1181 HydrophobicContact CD1-CB 3.76Å; L1123-L1181 HydrophobicContact CD1-CD1 3.99Å; L1123-L1181 HydrophobicContact CD1-CG 4.34Å; L1123-L1181 HydrophobicContact CD2-CD1 4.13Å; A1135-L1181 PolarHBondContact O-N 3.03Å; A1135-L1181 VanDerWaalsContact O-N 3.11Å; Y1137-L1181 HydrophobicContact CD2-CD2 4.08Å; V1140-L1181 HydrophobicContact CB-CD1 4.08Å; V1140-L1181 HydrophobicContact CG2-CD1 3.44Å; V1140-L1181 VanDerWaalsContact CG2-CD1 3.44Å; L1155-L1181 HydrophobicContact CD1-CD2 3.5Å; L1155-L1181 HydrophobicContact CD2-CD2 3.78Å; L1155-L1181 HydrophobicContact CG-CD2 4.28Å
1182	L	86.3	Confident	90.3	Very high	67 Å²	67	38.2 Å²	38.2	35%	0.351	20%	0.203	S	C	.	.	P	Polyproline II helix	trans	-99.8	143.5	172	-57.5	176.8	0	0	0	109.1	L1123 R1157 T1184 D1185	L1123-L1182 VanDerWaalsContact CD1-O 3.3Å; L1123-L1182 WeakPolarHBondContact CD1-O 3.26Å; R1157-L1182 HydrophobicContact CG-CD1 4.39Å; L1182-T1184 PolarHBondContact O-N 3.02Å; L1182-D1185 PolarHBondContact N-OD2 3.33Å; L1182-D1185 WeakPolarHBondContact O-CB 3.09Å; L1182-D1185 PolarHBondContact O-N 3.48Å
1183	P	81.8	Confident	89.8	Confident	71 Å²	71	38.9 Å²	38.9	46%	0.461	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-23	179.8	-24.3	33.4	0	0	0	114.2
1184	T	85.5	Confident	89	Confident	65 Å²	65	42 Å²	42	40%	0.399	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-8.3	178.3	50.8	0	0	0	0	113.6	R1169 L1182	R1169-T1184 VanDerWaalsContact CZ-O 3.25Å; R1169-T1184 PolarHBondContact NH1-O 3.47Å; R1169-T1184 PolarHBondContact NH2-O 2.8Å; L1182-T1184 PolarHBondContact O-N 3.02Å
1185	D	88.6	Confident	87.9	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.247	C	C	.	.			trans	-70.6	142.4	-177.3	-66.6	-23.9	0	0	0	111.2	L1123 R1157 L1182	L1123-D1185 HydrophobicContact CD1-CB 3.78Å; L1123-D1185 PolarHBondContact N-O 3.48Å; R1157-D1185 WeakPolarHBondContact CB-OD1 3.27Å; R1157-D1185 WeakPolarHBondContact CG-OD1 3.48Å; R1157-D1185 IonicContact CZ-OD2 3.1Å; R1157-D1185 IonicContact NE-OD1 3.25Å; R1157-D1185 PolarHBondContact NE-OD1 3.37Å; R1157-D1185 VanDerWaalsContact NE-OD1 3.1Å; R1157-D1185 IonicContact NE-OD2 3.61Å; R1157-D1185 PolarHBondContact NE-OD2 2.84Å; R1157-D1185 IonicContact NH2-OD2 3.45Å; R1157-D1185 PolarHBondContact NH2-OD2 3.4Å; L1182-D1185 PolarHBondContact N-OD2 3.33Å; L1182-D1185 WeakPolarHBondContact O-CB 3.09Å; L1182-D1185 PolarHBondContact O-N 3.48Å
1186	Y	91.2	Very high	86.2	Confident	82 Å²	82	49.1 Å²	49.1	32%	0.322	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	140.3	164.9	-74.7	-109.8	0	0	0	108.5	Q1120 P1122 L1155 Y1156 R1169	Q1120-Y1186 HydrophobicContact CB-CD1 4.38Å; P1122-Y1186 HydrophobicContact CB-CD1 3.89Å; P1122-Y1186 HydrophobicContact CB-CE1 3.61Å; P1122-Y1186 HydrophobicContact CB-CE2 4.39Å; P1122-Y1186 HydrophobicContact CB-CG 4.41Å; P1122-Y1186 HydrophobicContact CG-CD1 4.48Å; P1122-Y1186 HydrophobicContact CG-CE1 4.06Å; L1155-Y1186 CarbonylContact C-O 3.5Å; L1155-Y1186 WeakPolarHBondContact CA-O 3.22Å; Y1156-Y1186 PolarHBondContact N-O 3.45Å; Y1156-Y1186 PolarHBondContact O-N 2.83Å; R1169-Y1186 VanDerWaalsContact CZ-CD2 3.48Å; R1169-Y1186 VanDerWaalsContact CZ-CE2 3.47Å
1187	V	92.4	Very high	83.8	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	127.4	-179.9	-171.4	0	0	0	0	109.1	Q1120 I1121 L1123 Y1137 C1152 L1155 V1189	Q1120-V1187 WeakPolarHBondContact CA-O 3.31Å; I1121-V1187 PolarHBondContact N-O 3.47Å; I1121-V1187 PolarHBondContact O-N 3.18Å; L1123-V1187 HydrophobicContact CD2-CG2 3.6Å; L1123-V1187 HydrophobicContact CG-CG2 3.98Å; Y1137-V1187 HydrophobicContact CE2-CG1 4.36Å; C1152-V1187 HydrophobicContact CB-CG1 3.9Å; L1155-V1187 HydrophobicContact CD2-CB 4.38Å; L1155-V1187 HydrophobicContact CD2-CG1 4.37Å; L1155-V1187 HydrophobicContact CD2-CG2 3.84Å; V1187-V1189 HydrophobicContact CB-CG1 4.43Å; V1187-V1189 HydrophobicContact CG1-CG1 3.95Å
1188	Y	95	Very high	81	Confident	1 Å²	1	60.8 Å²	60.8	0%	0.004	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	125.2	168.8	-67.6	-85.7	0	0	0	109.1	A593 P594 F596 M599 Q1120 C1152 I1153 G1154 L1155 Y1156 V1171	A593-Y1188 HydrophobicContact CB-CD1 4.16Å; A593-Y1188 HydrophobicContact CB-CE1 4.15Å; P594-Y1188 PolarHBondContact O-OH 3.22Å; F596-Y1188 HydrophobicContact CB-CE1 4.24Å; F596-Y1188 HydrophobicContact CD2-CD1 4.49Å; M599-Y1188 HydrophobicContact CE-CD1 4.01Å; M599-Y1188 HydrophobicContact CE-CD2 4.43Å; M599-Y1188 HydrophobicContact CE-CE1 4.5Å; M599-Y1188 HydrophobicContact CE-CG 3.97Å; M599-Y1188 HydrophobicContact SD-CD2 4.38Å; M599-Y1188 HydrophobicContact SD-CG 4.46Å; Q1120-Y1188 HydrophobicContact CG-CD1 3.83Å; Q1120-Y1188 HydrophobicContact CG-CE1 3.98Å; Q1120-Y1188 HydrophobicContact CG-CG 4.47Å; Q1120-Y1188 VanDerWaalsContact NE2-CZ 3.31Å; Q1120-Y1188 PolarHBondContact NE2-OH 2.89Å; C1152-Y1188 CarbonylContact C-O 3.48Å; C1152-Y1188 WeakPolarHBondContact CA-O 3.34Å; I1153-Y1188 PolarHBondContact N-O 3.15Å; G1154-Y1188 PolarHBondContact O-N 2.92Å; L1155-Y1188 WeakPolarHBondContact O-CE2 3.33Å; Y1156-Y1188 HydrophobicContact CD2-CE2 4.45Å; Y1156-Y1188 VanDerWaalsContact CD2-OH 3.23Å; Y1156-Y1188 WeakPolarHBondContact CD2-OH 2.95Å; Y1156-Y1188 HydrophobicContact CG-CE2 4.4Å; V1171-Y1188 HydrophobicContact CG1-CE2 4.39Å
1189	V	93.2	Very high	78.1	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	148	-180	-60.5	0	0	0	0	112.2	A1119 I1121 M1150 L1151 V1187	A1119-V1189 HydrophobicContact CB-CG2 4.05Å; A1119-V1189 PolarHBondContact N-O 3.49Å; A1119-V1189 PolarHBondContact O-N 3.24Å; I1121-V1189 HydrophobicContact CD1-CG2 3.64Å; I1121-V1189 HydrophobicContact CG1-CG2 3.9Å; M1150-V1189 HydrophobicContact SD-CG2 4.42Å; L1151-V1189 CarbonylContact O-C 3.6Å; L1151-V1189 VanDerWaalsContact O-CA 3.26Å; L1151-V1189 WeakPolarHBondContact O-CA 3.33Å; V1187-V1189 HydrophobicContact CB-CG1 4.43Å; V1187-V1189 HydrophobicContact CG1-CG1 3.95Å
1190	L	92.9	Very high	75.2	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	103	159.6	-60.6	176.7	0	0	0	107.9	L660 I676 N677 L1081 C1116 R1117 V1118 M1150 L1151 I1153	L660-L1190 HydrophobicContact CD1-CD1 4.48Å; L660-L1190 HydrophobicContact CG-CD1 4.25Å; I676-L1190 HydrophobicContact CG2-CD1 3.65Å; N677-L1190 HydrophobicContact CB-CB 4.14Å; N677-L1190 HydrophobicContact CB-CD1 4.02Å; N677-L1190 PolarHBondContact ND2-O 2.84Å; L1081-L1190 HydrophobicContact CD1-CD2 4.07Å; C1116-L1190 HydrophobicContact CB-CB 4.26Å; R1117-L1190 WeakPolarHBondContact O-CA 3.29Å; V1118-L1190 HydrophobicContact CG2-CD2 4.02Å; M1150-L1190 WeakPolarHBondContact CA-O 3.43Å; L1151-L1190 HydrophobicContact CB-CB 4.3Å; L1151-L1190 HydrophobicContact CD2-CD1 4.15Å; L1151-L1190 PolarHBondContact N-O 3.27Å; L1151-L1190 PolarHBondContact O-N 3.44Å; I1153-L1190 HydrophobicContact CD1-CD1 3.85Å; I1153-L1190 HydrophobicContact CD1-CD2 3.66Å; I1153-L1190 HydrophobicContact CD1-CG 3.43Å; I1153-L1190 VanDerWaalsContact CD1-CG 3.43Å; I1153-L1190 HydrophobicContact CG1-CD1 4.42Å; I1153-L1190 HydrophobicContact CG1-CG 4.15Å
1191	Q	90.2	Very high	72.3	Confident	50 Å²	50	66.4 Å²	66.4	23%	0.234	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	128.2	-180	-167.7	-178.5	19.2	0	0	109.3	C1116 R1117 M1150	C1116-Q1191 CarbonylContact C-O 3.58Å; C1116-Q1191 VanDerWaalsContact CA-O 3.29Å; C1116-Q1191 WeakPolarHBondContact CA-O 3.24Å; R1117-Q1191 HydrophobicContact CG-CB 4.01Å; R1117-Q1191 PolarHBondContact N-O 3.15Å; R1117-Q1191 VanDerWaalsContact NH2-OE1 3.14Å; R1117-Q1191 PolarHBondContact O-N 3.45Å; M1150-Q1191 HydrophobicContact CG-CG 4.29Å; M1150-Q1191 HydrophobicContact SD-CG 4.16Å
1192	P	89	Confident	69.7	Low	46 Å²	46	75.1 Å²	75.1	30%	0.299	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-65.8	154.8	170.6	28.2	-32.8	0	0	0	110.4	Y1148 D1194	Y1148-P1192 WeakPolarHBondContact O-CG 3.39Å; P1192-D1194 PolarHBondContact O-N 2.88Å
1193	Y	85.8	Confident	67.3	Low	21 Å²	21	80.2 Å²	80.2	8%	0.082	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-68.4	126.7	175.9	176.7	-103.7	0	0	0	110.5	N893 H895 R1113 D1114 H1195	N893-Y1193 WeakPolarHBondContact O-CD2 3.39Å; H895-Y1193 AromaticContact CE1-CE2 3.82Å; H895-Y1193 AromaticContact CE1-CZ 3.61Å; H895-Y1193 PolarHBondContact CE1-OH 2.84Å; H895-Y1193 PolarHBondContact ND1-OH 2.88Å; H895-Y1193 AromaticContact NE2-CE2 3.77Å; H895-Y1193 AromaticContact NE2-CZ 3.93Å; R1113-Y1193 VanDerWaalsContact CZ-OH 3.24Å; R1113-Y1193 PolarHBondContact NH2-OH 2.83Å; D1114-Y1193 WeakPolarHBondContact OD1-CD1 3.12Å; Y1193-H1195 AromaticContact CD1-CE1 3.96Å; Y1193-H1195 AromaticContact CD1-NE2 3.99Å; Y1193-H1195 AromaticContact CE1-CE1 3.8Å; Y1193-H1195 AromaticContact CE1-ND1 3.74Å
1194	D	78.1	Confident	64.9	Low	70 Å²	70	81.5 Å²	81.5	37%	0.374	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-89.3	120.6	175.4	-174	3.1	0	0	0	109.8	H895 P1192 G1196	H895-D1194 PolarHBondContact CE1-O 3.32Å; H895-D1194 VanDerWaalsContact CE1-O 3.31Å; H895-D1194 PolarHBondContact NE2-O 3.47Å; P1192-D1194 PolarHBondContact O-N 2.88Å; D1194-G1196 PolarHBondContact O-N 2.9Å; D1194-G1196 PolarHBondContact OD1-N 3.32Å
1195	H	69.5	Low	62.4	Low	120 Å²	120	88.1 Å²	88.1	56%	0.556	46%	0.458	S	S	*	.			trans	-69.9	-10.6	175.2	-77.6	-77	0	0	0	113.2	D1114 Y1193	D1114-H1195 IonicContact OD1-CE1 3.21Å; D1114-H1195 PolarHBondContact OD1-CE1 3.04Å; D1114-H1195 IonicContact OD1-NE2 3.06Å; D1114-H1195 PolarHBondContact OD1-NE2 3.43Å; D1114-H1195 IonicContact OD2-CE1 3.98Å; D1114-H1195 IonicContact OD2-NE2 3.77Å; D1114-H1195 PolarHBondContact OD2-NE2 2.78Å; Y1193-H1195 AromaticContact CD1-CE1 3.96Å; Y1193-H1195 AromaticContact CD1-NE2 3.99Å; Y1193-H1195 AromaticContact CE1-CE1 3.8Å; Y1193-H1195 AromaticContact CE1-ND1 3.74Å
1196	G	56.9	Low	59.5	Low	38 Å²	38	99.9 Å²	99.9	39%	0.392	51%	0.513	S	S	.	.			trans	70.7	142.3	-172.6	0	0	0	0	0	111.2	D1194 K1198	D1194-G1196 PolarHBondContact O-N 2.9Å; D1194-G1196 PolarHBondContact OD1-N 3.32Å; G1196-K1198 PolarHBondContact O-N 3.34Å
1197	L	38.7	Very low	57.9	Low	132 Å²	132	100.8 Å²	100.8	69%	0.691	52%	0.522	S	S	*	.			trans	-61.3	130.2	166.5	-74.4	159.7	0	0	0	108.5	Y1199	L1197-Y1199 PolarHBondContact O-N 3Å
1198	K	29.2	Very low	56.1	Low	203 Å²	203	106.1 Å²	106.1	88%	0.883	55%	0.55	S	S	*	.			trans	-50.1	106.7	169.5	-84.1	179.4	176.2	175.3	0	108.3	G1196 P1200	G1196-K1198 PolarHBondContact O-N 3.34Å; K1198-P1200 WeakPolarHBondContact O-CD 3.26Å; K1198-P1200 VanDerWaalsContact O-N 3.14Å
1199	Y	27.6	Very low	53.9	Low	203 Å²	203	111.9 Å²	111.9	80%	0.796	58%	0.58	S	S	*	*			trans	-53.3	122.6	170.1	-77.3	-86.4	0	0	0	107.9	L1197 A1201	L1197-Y1199 PolarHBondContact O-N 3Å; Y1199-A1201 PolarHBondContact O-N 3.42Å
1200	P	28.6	Very low	51.6	Low	106 Å²	106	118.5 Å²	118.5	69%	0.688	61%	0.614	S	S	*	*			trans	-64.2	112.6	168.8	24.7	-28.9	0	0	0	107	K1198 K1202	K1198-P1200 WeakPolarHBondContact O-CD 3.26Å; K1198-P1200 VanDerWaalsContact O-N 3.14Å; P1200-K1202 PolarHBondContact O-N 3.3Å
1201	A	29.9	Very low	49.1	Very low	103 Å²	103	125.9 Å²	125.9	85%	0.851	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	44.9	-174	0	0	0	0	0	114.4	Y1199	Y1199-A1201 PolarHBondContact O-N 3.42Å
1202	K	33.9	Very low	46.3	Very low	199 Å²	199	131 Å²	131	87%	0.865	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.6	13.2	-173.1	-82.9	-165.3	174	-175.5	0	116.6	P1200	P1200-K1202 PolarHBondContact O-N 3.3Å
1203	Q	35	Very low	43.3	Very low	175 Å²	175	137.1 Å²	137.1	82%	0.818	71%	0.708	S	S	*	*	S	Bend	trans	-133.7	6.3	-178.4	-75.4	-177.3	-18.3	0	0	116.6
1204	A	32.7	Very low	40	Very low	98 Å²	98	146 Å²	146	81%	0.81	76%	0.756	S	S	*	*			trans	-106.1	18.4	-179.1	0	0	0	0	0	114.8
1205	E	32.3	Very low	36.8	Very low	203 Å²	203	152.3 Å²	152.3	95%	0.949	79%	0.788	S	S	*	*			trans	-102.5	23.4	170.6	-78.8	-174.5	155	0	0	112.9
1206	Q	27.7	Very low	33.9	Very low	248 Å²	248	155.3 Å²	155.3	100%	1.159	81%	0.809	S	S	*	*			trans	-129.2	0	165.2	-74.4	-178.3	-3.4	0	0	108.5

Retrieved 1,206 of 1,206 residues in 2681.4 ms (Link to these results)

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