A0A087Y4P9_POEFO Loading...

Potassium voltage-gated channel subfamily B member 2

AlphaFold DB , UniProt , Accession A0A087Y4P9, Species POEFO (Poecilia formosa, Amazon molly), Gene KCNB2, Length 1,001 aa.

						>A0A087Y4P9_POEFO|A0A087Y4P9|KCNB2
MAEKLGPAGPKPNNVRTAPPLPPEPIEIIRTKARSRRVRLNVGGLNHEVLWRTLDRLPRTRLGKLRDCNTHESLMEICDDYSLSENEYFFDRHPGAFTSILNFYRTGKLHMMEEMCALSFGQELDYWGIDEIYLESCCQARYHQKKEQMNEELRREAETMREREGEGEFDNTCCPEKRRKLWDLLEKPSSSVAAKILAIISILFIVLSTIALSLNTLPELQVADEYGQANDNPQLAHVEAVCIAWFTMEYLLRFLSSPNKWKFFKGPLNVIDLLAILPYYVTIFLTESNKSVLQFQNVRRVVQIFRIMRILRILKLARHSTGLQSLGFTLRRSYNELGLLILFLAMGIMIFSSLVFFAEKDEDATKFTSIPASFWWATITMTTVGYGDIYPQTLLGKIVGGLCCIAGVLVIALPIPIIVNNFSEFYKEQKRQEKAIKRREALERAKRNGSIVSMNLKDAFARSMEILDVVVEKGEDKTSLDNHLTPNRLGSSTRHATSESSLRSPDKRNPELGSQSSPHGITIATTGSQHRISRTPQHLSVQKLEEMYNQMTKSQSFTNLNTTSSMSTLSTTMTVPGSPKKSLSPDSMLKEEVLLEMREVRDSLKDNVASCPAECINQGFNQAGDDDGLYEIRHPTIPPLLNFSHLRCTGNDFYESHNPCDGSDLHTEEGKRFNSAVEITQSSLSENNPPKIKGLKSNFNKSSNDGPITPPSTTSPGDISSSVLGDESPTGETSPLIPSSEELIPVTLEGPCSFSPKKLLVDTPPGDEDQSTDNHEEKQLMEEAGAAVAPLSPKTAAQNCSQGNNPALFQSKYLTAAGHDEKSLICAFLARVMHGKQLDVLFEKDERVMPLMSAAVVWSSLENAVEDEGLFKEITGLLFVQAVAVCLEKGQRSSASSVLKWFEKRHTYPRNLGIKLSTIVTKTDTYHPVLMSFSFKRLLETINSFLDNYLKKNPCDFLIKTATGFVQSSQNVMDSESVESQDSTVSEKQSETTQKNKKYEK
					

Structure Viewer

Loading PAE data...

(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	33.3	Very low	35.5	Very low	254 Å²	254	143.1 Å²	143.1	100%	1.251	85%	0.851	S	S	*	*				0	152.7	0	-74.2	167.2	167.5	0	0	108.1
2	A	36.2	Very low	35.8	Very low	99 Å²	99	141.6 Å²	141.6	82%	0.818	85%	0.847	S	S	*	*			trans	-130.9	135	-174.5	0	0	0	0	0	110.8
3	E	34.6	Very low	35.7	Very low	162 Å²	162	142.5 Å²	142.5	76%	0.757	85%	0.845	S	S	*	*			trans	177.8	152.9	165.9	-103.6	-171.3	154.1	0	0	106.4
4	K	35.9	Very low	35.8	Very low	181 Å²	181	144.1 Å²	144.1	79%	0.787	85%	0.848	S	S	*	*			cis	-153.2	172	-9.3	-141.1	163	-168.1	158	0	108.1
5	L	36.9	Very low	36.2	Very low	180 Å²	180	142.2 Å²	142.2	94%	0.942	84%	0.838	S	S	*	*			trans	-113.7	133.4	-169.1	-118.5	162	0	0	0	114.1
6	G	30.8	Very low	36.4	Very low	66 Å²	66	147.6 Å²	147.6	68%	0.68	84%	0.84	S	S	*	*			trans	89.7	170.2	159.9	0	0	0	0	0	117.5
7	P	42.1	Very low	36.8	Very low	135 Å²	135	146.6 Å²	146.6	88%	0.877	84%	0.838	S	S	*	*			cis	-109	-178.2	-1.5	40.2	-30.8	0	0	0	113.8
8	A	37.2	Very low	37.4	Very low	104 Å²	104	142.6 Å²	142.6	86%	0.86	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-88.8	143.5	-175.6	0	0	0	0	0	114.3
9	G	33.5	Very low	38	Very low	65 Å²	65	141 Å²	141	67%	0.67	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-94.5	160.9	168.4	0	0	0	0	0	113.3
10	P	36.9	Very low	39.1	Very low	134 Å²	134	140.1 Å²	140.1	87%	0.87	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-72.2	144.7	-178	30.1	-35.1	0	0	0	112.5
11	K	33.3	Very low	40.3	Very low	194 Å²	194	141 Å²	141	84%	0.843	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-77.7	139.4	172.2	-63.7	178.1	-178.6	176.9	0	109.9
12	P	39.3	Very low	42.2	Very low	125 Å²	125	132.7 Å²	132.7	81%	0.812	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-68.3	142.4	175.9	28.5	-34.3	0	0	0	111.4	N14	P12-N14 PolarHBondContact O-N 3.18Å
13	N	34.2	Very low	44.2	Very low	154 Å²	154	129.6 Å²	129.6	82%	0.824	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-71.1	127.7	178.2	-82.5	-26.6	0	0	0	111.3	V15	N13-V15 PolarHBondContact O-N 3.34Å
14	N	36.6	Very low	46.3	Very low	165 Å²	165	128 Å²	128	88%	0.882	75%	0.749	S	S	*	*			trans	-84.1	81	-177.9	-150.4	10.9	0	0	0	110.1	P12 R16	P12-N14 PolarHBondContact O-N 3.18Å; N14-R16 PolarHBondContact O-N 3.42Å
15	V	41.9	Very low	48.6	Very low	115 Å²	115	121.8 Å²	121.8	70%	0.697	73%	0.727	S	S	*	*			trans	-67.2	117.8	176	178.8	0	0	0	0	108.9	N13 T17	N13-V15 PolarHBondContact O-N 3.34Å; V15-T17 PolarHBondContact O-N 2.9Å
16	R	40.4	Very low	50.7	Low	229 Å²	229	118.4 Å²	118.4	86%	0.864	71%	0.708	S	S	*	*			trans	-69.4	97.9	165.3	-89.5	-177.1	169.4	161.7	-2.4	108.6	N14 A18	N14-R16 PolarHBondContact O-N 3.42Å; R16-A18 PolarHBondContact O-N 3.34Å
17	T	42.4	Very low	53.1	Low	131 Å²	131	119.3 Å²	119.3	80%	0.804	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-57	134.3	164.7	-27.7	0	0	0	0	108.8	V15	V15-T17 PolarHBondContact O-N 2.9Å
18	A	46.9	Very low	55.1	Low	73 Å²	73	112.9 Å²	112.9	60%	0.603	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-59.9	158.3	163.4	0	0	0	0	0	109.5	R16	R16-A18 PolarHBondContact O-N 3.34Å
19	P	49.3	Very low	57.3	Low	113 Å²	113	111.8 Å²	111.8	73%	0.734	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-51.9	136.7	163.4	25.1	-34.4	0	0	0	108.7	L21	P19-L21 PolarHBondContact O-N 3.47Å
20	P	59.8	Low	59.7	Low	123 Å²	123	114 Å²	114	80%	0.799	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-58.6	135.1	-178.9	25	-33.5	0	0	0	109.3
21	L	65.1	Low	61.8	Low	159 Å²	159	108.4 Å²	108.4	83%	0.832	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-59.3	141.6	169.5	-69.6	170.2	0	0	0	108.4	P19	P19-L21 PolarHBondContact O-N 3.47Å
22	P	73.3	Confident	64.2	Low	80 Å²	80	100.2 Å²	100.2	52%	0.519	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-59.5	135.2	179.2	27.2	-35.5	0	0	0	109.5	E24 H71	P22-E24 PolarHBondContact O-N 3.19Å; P22-H71 HydrophobicContact CB-CB 4.21Å; P22-H71 WeakPolarHBondContact CB-CD2 3.32Å
23	P	77	Confident	66.2	Low	33 Å²	33	98.3 Å²	98.3	21%	0.214	54%	0.542	C	S	.	.	P	Polyproline II helix	trans	-66	137.4	-173.5	25.9	-33.6	0	0	0	111	I28 Y81 L83	P23-I28 HydrophobicContact CG-CD1 4.44Å; P23-I28 HydrophobicContact CG-CG1 4.42Å; P23-Y81 WeakPolarHBondContact CD-OH 3.33Å; P23-Y81 HydrophobicContact CG-CE2 4.3Å; P23-Y81 WeakPolarHBondContact CG-OH 3.49Å; P23-L83 HydrophobicContact CB-CD1 3.61Å; P23-L83 HydrophobicContact CG-CD1 3.65Å
24	E	79.8	Confident	68.6	Low	130 Å²	130	100 Å²	100	61%	0.607	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-55	139.1	178.4	-79.4	-68.2	162.9	0	0	111.2	P22 I26 E27 I28	P22-E24 PolarHBondContact O-N 3.19Å; E24-I26 PolarHBondContact O-N 3.16Å; E24-E27 WeakPolarHBondContact O-CA 3.44Å; E24-E27 WeakPolarHBondContact O-CB 3.25Å; E24-E27 PolarHBondContact O-N 2.64Å; E24-I28 PolarHBondContact O-N 3.2Å
25	P	83	Confident	70.8	Confident	50 Å²	50	94.2 Å²	94.2	33%	0.325	51%	0.51	S	S	.	.	H	α-helix	trans	-51.7	-33.7	177.6	-30.6	37.8	0	0	0	113.6	E27 I28 I29 N69 T70	P25-E27 VanDerWaalsContact C-N 3.27Å; P25-E27 PolarHBondContact O-N 3.04Å; P25-I28 PolarHBondContact O-N 3.13Å; P25-I29 WeakPolarHBondContact O-CB 3.2Å; P25-I29 WeakPolarHBondContact O-CD1 3.35Å; P25-I29 VanDerWaalsContact O-CG1 3.22Å; P25-I29 WeakPolarHBondContact O-CG1 3.36Å; P25-I29 PolarHBondContact O-N 3.35Å; P25-N69 VanDerWaalsContact CA-O 3.29Å; P25-N69 WeakPolarHBondContact CA-O 3.32Å; P25-N69 WeakPolarHBondContact CB-O 3.46Å; P25-T70 HydrophobicContact CB-CG2 4.46Å; P25-T70 HydrophobicContact CG-CG2 4.15Å
26	I	81.5	Confident	73	Confident	108 Å²	108	99.2 Å²	99.2	55%	0.554	52%	0.516	S	S	*	.	H	α-helix	trans	-61.3	-34.2	176.5	-59.8	174	0	0	0	111.7	E24 R30	E24-I26 PolarHBondContact O-N 3.16Å; I26-R30 WeakPolarHBondContact O-CB 3.21Å; I26-R30 PolarHBondContact O-N 3.43Å
27	E	81.9	Confident	75.4	Confident	85 Å²	85	93.4 Å²	93.4	40%	0.397	49%	0.494	S	S	.	.	H	α-helix	trans	-75.7	-41.2	177.6	-175.2	151.3	-122.7	0	0	112.1	E24 P25 I29 R30 T31 L83	E24-E27 WeakPolarHBondContact O-CA 3.44Å; E24-E27 WeakPolarHBondContact O-CB 3.25Å; E24-E27 PolarHBondContact O-N 2.64Å; P25-E27 VanDerWaalsContact C-N 3.27Å; P25-E27 PolarHBondContact O-N 3.04Å; E27-I29 PolarHBondContact O-N 3.16Å; E27-R30 PolarHBondContact O-N 2.8Å; E27-T31 WeakPolarHBondContact O-CB 3.36Å; E27-T31 PolarHBondContact O-N 2.88Å; E27-T31 PolarHBondContact O-OG1 3.27Å; E27-L83 HydrophobicContact CG-CD1 4.36Å
28	I	82.9	Confident	77.9	Confident	0 Å²	0	87.2 Å²	87.2	0%	0	46%	0.456	C	S	.	.	H	α-helix	trans	-57.4	-51	172.9	-61.3	169.5	0	0	0	110	P23 E24 P25 R30 T31 K32 L74 L83	P23-I28 HydrophobicContact CG-CD1 4.44Å; P23-I28 HydrophobicContact CG-CG1 4.42Å; E24-I28 PolarHBondContact O-N 3.2Å; P25-I28 PolarHBondContact O-N 3.13Å; I28-R30 PolarHBondContact O-N 2.95Å; I28-T31 PolarHBondContact O-N 2.65Å; I28-K32 HydrophobicContact CG2-CD 4.36Å; I28-K32 WeakPolarHBondContact O-CG 3.3Å; I28-K32 PolarHBondContact O-N 3.33Å; I28-L74 HydrophobicContact CD1-CD1 4.07Å; I28-L74 HydrophobicContact CG1-CD1 4.47Å; I28-L74 HydrophobicContact CG2-CD1 3.98Å; I28-L83 HydrophobicContact CG1-CD1 4.03Å; I28-L83 HydrophobicContact CG1-CD2 4.33Å
29	I	83.6	Confident	80.1	Confident	81 Å²	81	87.7 Å²	87.7	42%	0.415	44%	0.443	S	S	.	.	H	α-helix	trans	-58.6	-45.7	176.4	-66.7	162.4	0	0	0	110.9	P25 E27 T31 K32 A33 N69	P25-I29 WeakPolarHBondContact O-CB 3.2Å; P25-I29 WeakPolarHBondContact O-CD1 3.35Å; P25-I29 VanDerWaalsContact O-CG1 3.22Å; P25-I29 WeakPolarHBondContact O-CG1 3.36Å; P25-I29 PolarHBondContact O-N 3.35Å; E27-I29 PolarHBondContact O-N 3.16Å; I29-T31 PolarHBondContact O-N 3.45Å; I29-K32 PolarHBondContact O-N 2.96Å; I29-A33 WeakPolarHBondContact O-CB 3.47Å; I29-A33 PolarHBondContact O-N 3.39Å; I29-N69 HydrophobicContact CD1-CB 4.06Å; I29-N69 HydrophobicContact CG1-CB 3.76Å; I29-N69 WeakPolarHBondContact CG1-OD1 3.24Å
30	R	83.8	Confident	82.3	Confident	112 Å²	112	82.3 Å²	82.3	42%	0.423	41%	0.408	S	S	.	.	H	α-helix	trans	-62.8	-40.9	-179.9	-175.8	-170.5	-62.6	140.3	-2.8	112.1	I26 E27 I28 A33 R34	I26-R30 WeakPolarHBondContact O-CB 3.21Å; I26-R30 PolarHBondContact O-N 3.43Å; E27-R30 PolarHBondContact O-N 2.8Å; I28-R30 PolarHBondContact O-N 2.95Å; R30-A33 PolarHBondContact O-N 2.8Å; R30-R34 WeakPolarHBondContact O-CB 3.47Å; R30-R34 WeakPolarHBondContact O-CD 3.43Å; R30-R34 WeakPolarHBondContact O-CG 3.32Å; R30-R34 PolarHBondContact O-N 3.19Å
31	T	82.8	Confident	84	Confident	16 Å²	16	77.5 Å²	77.5	10%	0.098	38%	0.375	C	S	.	.	H	α-helix	trans	-67.6	-44.6	177.2	-69.7	0	0	0	0	111.3	E27 I28 I29 A33 R34 S35 L83 N86	E27-T31 WeakPolarHBondContact O-CB 3.36Å; E27-T31 PolarHBondContact O-N 2.88Å; E27-T31 PolarHBondContact O-OG1 3.27Å; I28-T31 PolarHBondContact O-N 2.65Å; I29-T31 PolarHBondContact O-N 3.45Å; T31-A33 VanDerWaalsContact C-N 3.33Å; T31-A33 PolarHBondContact O-N 3.3Å; T31-R34 PolarHBondContact O-N 3.1Å; T31-S35 PolarHBondContact O-N 3.26Å; T31-L83 HydrophobicContact CG2-CD2 4.32Å; T31-L83 WeakPolarHBondContact CG2-O 3.4Å; T31-N86 HydrophobicContact CG2-CB 4.24Å
32	K	82.8	Confident	85.5	Confident	22 Å²	22	70 Å²	70	10%	0.096	34%	0.336	C	S	.	.	H	α-helix	trans	-59	-40.9	173	-74.1	-178.8	164.2	-176.7	0	112.7	I28 I29 S35 W51 L65 R66 C68	I28-K32 HydrophobicContact CG2-CD 4.36Å; I28-K32 WeakPolarHBondContact O-CG 3.3Å; I28-K32 PolarHBondContact O-N 3.33Å; I29-K32 PolarHBondContact O-N 2.96Å; K32-S35 VanDerWaalsContact O-O 3.13Å; K32-W51 HydrophobicContact CB-CZ2 4.44Å; K32-W51 HydrophobicContact CD-CH2 4.39Å; K32-W51 HydrophobicContact CD-CZ2 4.45Å; K32-W51 HydrophobicContact CG-CH2 4.15Å; K32-W51 HydrophobicContact CG-CZ2 3.75Å; K32-L65 PolarHBondContact NZ-O 3.03Å; K32-R66 PolarHBondContact NZ-O 3.09Å; K32-C68 PolarHBondContact NZ-O 2.95Å
33	A	81.4	Confident	86.4	Confident	85 Å²	85	67.4 Å²	67.4	70%	0.702	32%	0.324	S	S	*	.	H	α-helix	trans	-71.9	-28	177.7	0	0	0	0	0	113.8	I29 R30 T31	I29-A33 WeakPolarHBondContact O-CB 3.47Å; I29-A33 PolarHBondContact O-N 3.39Å; R30-A33 PolarHBondContact O-N 2.8Å; T31-A33 VanDerWaalsContact C-N 3.33Å; T31-A33 PolarHBondContact O-N 3.3Å
34	R	83.9	Confident	87.1	Confident	190 Å²	190	66.8 Å²	66.8	72%	0.717	32%	0.324	S	S	*	.	H	α-helix	trans	-71.7	-37.8	179.9	-83.9	168	169.3	-179.4	-5	113.4	R30 T31	R30-R34 WeakPolarHBondContact O-CB 3.47Å; R30-R34 WeakPolarHBondContact O-CD 3.43Å; R30-R34 WeakPolarHBondContact O-CG 3.32Å; R30-R34 PolarHBondContact O-N 3.19Å; T31-R34 PolarHBondContact O-N 3.1Å
35	S	83.5	Confident	87.7	Confident	44 Å²	44	61.1 Å²	61.1	31%	0.308	30%	0.298	S	S	.	.			trans	-110.9	130.4	-177.8	-174.7	0	0	0	0	112.7	T31 K32 R37 W51	T31-S35 PolarHBondContact O-N 3.26Å; K32-S35 VanDerWaalsContact O-O 3.13Å; S35-R37 WeakPolarHBondContact CB-O 3.44Å; S35-R37 PolarHBondContact O-N 3.47Å; S35-R37 PolarHBondContact OG-N 3.24Å; S35-R37 VanDerWaalsContact OG-N 3.1Å; S35-R37 PolarHBondContact OG-O 3.02Å; S35-W51 PolarHBondContact O-NE1 2.82Å; S35-W51 VanDerWaalsContact O-NE1 3.14Å
36	R	87.9	Confident	88.2	Confident	219 Å²	219	61.1 Å²	61.1	83%	0.826	30%	0.295	S	S	*	.	S	Bend	trans	-72.1	-16.1	169.8	-65.3	-178.5	177.4	-178.2	-1	113.1	L50 W51	R36-L50 HydrophobicContact CB-CD2 4.5Å; R36-L50 WeakPolarHBondContact O-CA 3.35Å; R36-W51 PolarHBondContact O-N 3.47Å
37	R	91.7	Very high	88.8	Confident	107 Å²	107	57.1 Å²	57.1	40%	0.404	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	147.1	-175.3	-60.3	179.7	85.6	-154.6	-4.3	111.4	S35 E48 V49 L50 N86	S35-R37 WeakPolarHBondContact CB-O 3.44Å; S35-R37 PolarHBondContact O-N 3.47Å; S35-R37 PolarHBondContact OG-N 3.24Å; S35-R37 VanDerWaalsContact OG-N 3.1Å; S35-R37 PolarHBondContact OG-O 3.02Å; R37-E48 HydrophobicContact CB-CG 4.29Å; R37-E48 WeakPolarHBondContact CD-OE1 3.47Å; R37-E48 IonicContact CZ-OE1 2.67Å; R37-E48 IonicContact CZ-OE2 3.93Å; R37-E48 IonicContact NE-OE1 3.75Å; R37-E48 PolarHBondContact NE-OE1 2.84Å; R37-E48 IonicContact NE-OE2 2.88Å; R37-E48 IonicContact NH1-OE1 2.69Å; R37-E48 PolarHBondContact NH1-OE1 2.85Å; R37-E48 IonicContact NH1-OE2 2.95Å; R37-E48 PolarHBondContact NH1-OE2 3.22Å; R37-E48 IonicContact NH2-OE1 3.34Å; R37-E48 IonicContact NH2-OE2 3.36Å; R37-E48 PolarHBondContact NH2-OE2 3.45Å; R37-V49 CarbonylContact C-O 3.51Å; R37-V49 WeakPolarHBondContact CA-O 3.37Å; R37-V49 WeakPolarHBondContact CB-O 3.4Å; R37-L50 HydrophobicContact CG-CD2 3.69Å; R37-L50 HydrophobicContact CG-CG 4.33Å; R37-N86 PolarHBondContact O-ND2 2.86Å
38	V	93.2	Very high	89.4	Confident	1 Å²	1	57.2 Å²	57.2	1%	0.006	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	142.7	178.6	56.4	0	0	0	0	109.8	L40 V49 W51 L54 Y88	V38-L40 HydrophobicContact CG2-CD2 4.13Å; V38-V49 HydrophobicContact CG1-CG2 3.48Å; V38-V49 VanDerWaalsContact CG1-CG2 3.48Å; V38-V49 PolarHBondContact N-O 2.99Å; V38-V49 PolarHBondContact O-N 3.48Å; V38-W51 HydrophobicContact CB-CD2 4.12Å; V38-W51 HydrophobicContact CB-CE3 4.38Å; V38-W51 HydrophobicContact CB-CH2 3.9Å; V38-W51 HydrophobicContact CB-CZ2 3.61Å; V38-W51 HydrophobicContact CB-CZ3 4.27Å; V38-W51 HydrophobicContact CG1-CD2 3.93Å; V38-W51 HydrophobicContact CG1-CE3 3.92Å; V38-W51 HydrophobicContact CG1-CH2 4.2Å; V38-W51 HydrophobicContact CG1-CZ2 4.22Å; V38-W51 HydrophobicContact CG1-CZ3 4.05Å; V38-W51 HydrophobicContact CG2-CH2 3.64Å; V38-W51 HydrophobicContact CG2-CZ2 3.71Å; V38-W51 HydrophobicContact CG2-CZ3 4.22Å; V38-L54 HydrophobicContact CG1-CD1 4.36Å; V38-Y88 HydrophobicContact CG2-CD2 3.44Å; V38-Y88 VanDerWaalsContact CG2-CD2 3.44Å; V38-Y88 HydrophobicContact CG2-CE2 3.48Å; V38-Y88 VanDerWaalsContact CG2-CE2 3.48Å
39	R	94.7	Very high	89.9	Confident	84 Å²	84	57.5 Å²	57.5	32%	0.317	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	127.4	172.3	-60.2	179.3	-169.8	158.6	10.5	108.9	E48 E85 N86 E87 Y88	R39-E48 HydrophobicContact CG-CG 4.34Å; R39-E85 IonicContact CZ-OE2 2.87Å; R39-E85 IonicContact NH1-OE2 3.91Å; R39-E85 PolarHBondContact NH1-OE2 3.43Å; R39-E85 IonicContact NH2-OE2 2.71Å; R39-E85 PolarHBondContact NH2-OE2 3.41Å; R39-N86 PolarHBondContact N-O 2.81Å; R39-E87 HydrophobicContact CB-CB 4Å; R39-E87 HydrophobicContact CB-CG 3.88Å; R39-E87 VanDerWaalsContact CD-OE2 3.31Å; R39-E87 WeakPolarHBondContact CD-OE2 3.46Å; R39-E87 IonicContact NH1-OE2 3.93Å; R39-E87 WeakPolarHBondContact O-CA 3.41Å; R39-Y88 PolarHBondContact O-N 2.81Å
40	L	95.8	Very high	90.4	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	108.9	172.3	-55.1	177.6	0	0	0	106.7	V38 H47 V49 L54 L62 L65 F90 F97	V38-L40 HydrophobicContact CG2-CD2 4.13Å; L40-H47 PolarHBondContact N-O 3.35Å; L40-H47 PolarHBondContact O-N 2.76Å; L40-V49 HydrophobicContact CD1-CG1 4.42Å; L40-V49 HydrophobicContact CD1-CG2 3.81Å; L40-V49 HydrophobicContact CG-CG2 4.15Å; L40-L54 HydrophobicContact CD1-CD2 4.49Å; L40-L62 HydrophobicContact CD1-CD1 3.97Å; L40-L62 HydrophobicContact CD1-CD2 3.97Å; L40-L62 HydrophobicContact CD2-CD2 4.46Å; L40-L65 HydrophobicContact CD2-CD2 3.66Å; L40-F90 HydrophobicContact CD2-CE2 4.16Å; L40-F97 HydrophobicContact CB-CE1 4.45Å; L40-F97 HydrophobicContact CB-CZ 4.26Å; L40-F97 HydrophobicContact CD1-CZ 3.95Å
41	N	95.6	Very high	90.8	Very high	22 Å²	22	51.9 Å²	51.9	12%	0.118	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	110.6	179.5	-179.2	-21.3	0	0	0	107.8	G44 L45 N46 E87 Y88 F89 F90	N41-G44 VanDerWaalsContact OD1-C 3.3Å; N41-G44 WeakPolarHBondContact OD1-CA 3.43Å; N41-G44 PolarHBondContact OD1-N 3.48Å; N41-L45 WeakPolarHBondContact CA-O 3.45Å; N41-N46 VanDerWaalsContact CB-OD1 3.25Å; N41-N46 WeakPolarHBondContact CB-OD1 3.37Å; N41-N46 PolarHBondContact ND2-OD1 2.91Å; N41-N46 PolarHBondContact OD1-OD1 2.92Å; N41-E87 HydrophobicContact CB-CG 3.93Å; N41-E87 WeakPolarHBondContact CB-OE1 3.3Å; N41-E87 PolarHBondContact ND2-OE1 3.01Å; N41-Y88 PolarHBondContact N-O 3.44Å; N41-F89 HydrophobicContact CB-CD2 4.15Å; N41-F89 CarbonylContact O-C 3.56Å; N41-F89 VanDerWaalsContact O-CA 3.31Å; N41-F89 WeakPolarHBondContact O-CA 3.38Å; N41-F90 PolarHBondContact O-N 3.12Å
42	V	96.3	Very high	91.2	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	114.6	-175.6	-173.5	0	0	0	0	109.3	G44 L45 F90 R92 F97 W127	V42-G44 PolarHBondContact O-N 3.07Å; V42-G44 VanDerWaalsContact O-N 3.08Å; V42-L45 PolarHBondContact N-O 3.37Å; V42-L45 PolarHBondContact O-N 3.35Å; V42-F90 WeakPolarHBondContact CA-O 3.35Å; V42-F90 HydrophobicContact CG1-CB 4.44Å; V42-F90 HydrophobicContact CG2-CB 4.32Å; V42-F90 HydrophobicContact CG2-CD2 4.08Å; V42-R92 HydrophobicContact CG1-CB 3.96Å; V42-F97 HydrophobicContact CB-CB 4.29Å; V42-F97 HydrophobicContact CB-CD1 4.13Å; V42-F97 HydrophobicContact CB-CG 4.06Å; V42-F97 HydrophobicContact CG1-CB 3.89Å; V42-F97 HydrophobicContact CG1-CD2 4.27Å; V42-F97 HydrophobicContact CG1-CG 4Å; V42-F97 HydrophobicContact CG2-CB 4.48Å; V42-F97 HydrophobicContact CG2-CD1 3.66Å; V42-F97 HydrophobicContact CG2-CD2 3.86Å; V42-F97 HydrophobicContact CG2-CE1 3.7Å; V42-F97 HydrophobicContact CG2-CE2 3.89Å; V42-F97 HydrophobicContact CG2-CG 3.73Å; V42-F97 HydrophobicContact CG2-CZ 3.8Å; V42-W127 HydrophobicContact CG1-CZ2 4.11Å; V42-W127 HydrophobicContact CG2-CH2 4.25Å
43	G	91.9	Very high	91.6	Very high	26 Å²	26	59.4 Å²	59.4	27%	0.268	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.3	14.1	-174.4	0	0	0	0	0	114.5	F90 R92 L544	G43-F90 PolarHBondContact N-O 2.99Å; G43-R92 WeakPolarHBondContact CA-O 3.32Å; G43-R92 PolarHBondContact N-O 2.98Å; G43-L544 VanDerWaalsContact O-CD2 3.24Å; G43-L544 WeakPolarHBondContact O-CD2 3.46Å
44	G	90.4	Very high	92.1	Very high	21 Å²	21	55.3 Å²	55.3	22%	0.216	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	100.6	0.3	-173.2	0	0	0	0	0	115.4	N41 V42 L544	N41-G44 VanDerWaalsContact OD1-C 3.3Å; N41-G44 WeakPolarHBondContact OD1-CA 3.43Å; N41-G44 PolarHBondContact OD1-N 3.48Å; V42-G44 PolarHBondContact O-N 3.07Å; V42-G44 VanDerWaalsContact O-N 3.08Å; G44-L544 WeakPolarHBondContact O-CD2 3.46Å
45	L	93.7	Very high	92.4	Very high	11 Å²	11	49.6 Å²	49.6	6%	0.058	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	124.7	175.8	-172.2	64.6	0	0	0	110.8	N41 V42 H47 P94 V541 E545	N41-L45 WeakPolarHBondContact CA-O 3.45Å; V42-L45 PolarHBondContact N-O 3.37Å; V42-L45 PolarHBondContact O-N 3.35Å; L45-H47 PolarHBondContact O-CD2 3.45Å; L45-H47 VanDerWaalsContact O-CD2 3.3Å; L45-P94 HydrophobicContact CB-CB 3.89Å; L45-P94 HydrophobicContact CD2-CB 3.89Å; L45-V541 HydrophobicContact CD1-CG1 4.42Å; L45-E545 HydrophobicContact CD1-CB 3.91Å; L45-E545 HydrophobicContact CD1-CG 4.01Å
46	N	94	Very high	92.7	Very high	49 Å²	49	54.5 Å²	54.5	26%	0.262	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	112	-171.3	-76.2	18.1	0	0	0	113	N41 E87 V541	N41-N46 VanDerWaalsContact CB-OD1 3.25Å; N41-N46 WeakPolarHBondContact CB-OD1 3.37Å; N41-N46 PolarHBondContact ND2-OD1 2.91Å; N41-N46 PolarHBondContact OD1-OD1 2.92Å; N46-E87 PolarHBondContact ND2-OE1 3.37Å; N46-E87 PolarHBondContact ND2-OE2 3.18Å; N46-V541 HydrophobicContact CB-CG1 4.23Å; N46-V541 HydrophobicContact CB-CG2 4.37Å
47	H	93.9	Very high	92.8	Very high	25 Å²	25	45.9 Å²	45.9	12%	0.116	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	112.4	177.9	-56.6	-81.3	0	0	0	111.3	L40 L45 F97 L101	L40-H47 PolarHBondContact N-O 3.35Å; L40-H47 PolarHBondContact O-N 2.76Å; L45-H47 PolarHBondContact O-CD2 3.45Å; L45-H47 VanDerWaalsContact O-CD2 3.3Å; H47-F97 HydrophobicContact CB-CE1 4.07Å; H47-F97 AromaticContact CD2-CD1 3.4Å; H47-F97 VanDerWaalsContact CD2-CD1 3.4Å; H47-F97 WeakPolarHBondContact CD2-CD1 3.43Å; H47-F97 AromaticContact CD2-CE1 3.58Å; H47-F97 AromaticContact CG-CD1 3.95Å; H47-F97 AromaticContact CG-CE1 3.86Å; H47-F97 AromaticContact NE2-CD1 3.59Å; H47-L101 HydrophobicContact CB-CD2 3.82Å
48	E	94.1	Very high	92.8	Very high	86 Å²	86	44.4 Å²	44.4	40%	0.402	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	118.3	178.8	-160.6	-170.3	175.3	0	0	112.1	R37 R39	R37-E48 HydrophobicContact CB-CG 4.29Å; R37-E48 WeakPolarHBondContact CD-OE1 3.47Å; R37-E48 IonicContact CZ-OE1 2.67Å; R37-E48 IonicContact CZ-OE2 3.93Å; R37-E48 IonicContact NE-OE1 3.75Å; R37-E48 PolarHBondContact NE-OE1 2.84Å; R37-E48 IonicContact NE-OE2 2.88Å; R37-E48 IonicContact NH1-OE1 2.69Å; R37-E48 PolarHBondContact NH1-OE1 2.85Å; R37-E48 IonicContact NH1-OE2 2.95Å; R37-E48 PolarHBondContact NH1-OE2 3.22Å; R37-E48 IonicContact NH2-OE1 3.34Å; R37-E48 IonicContact NH2-OE2 3.36Å; R37-E48 PolarHBondContact NH2-OE2 3.45Å; R39-E48 HydrophobicContact CG-CG 4.34Å
49	V	94.1	Very high	92.6	Very high	7 Å²	7	55 Å²	55	4%	0.042	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	169.8	-173.7	-51.7	0	0	0	0	111.3	R37 V38 L40 L54 L101	R37-V49 CarbonylContact C-O 3.51Å; R37-V49 WeakPolarHBondContact CA-O 3.37Å; R37-V49 WeakPolarHBondContact CB-O 3.4Å; V38-V49 HydrophobicContact CG1-CG2 3.48Å; V38-V49 VanDerWaalsContact CG1-CG2 3.48Å; V38-V49 PolarHBondContact N-O 2.99Å; V38-V49 PolarHBondContact O-N 3.48Å; L40-V49 HydrophobicContact CD1-CG1 4.42Å; L40-V49 HydrophobicContact CD1-CG2 3.81Å; L40-V49 HydrophobicContact CG-CG2 4.15Å; V49-L54 HydrophobicContact CG2-CD2 4.27Å; V49-L101 HydrophobicContact CG1-CD1 3.54Å; V49-L101 HydrophobicContact CG1-CD2 3.89Å; V49-L101 HydrophobicContact CG1-CG 4.36Å
50	L	93.3	Very high	92.5	Very high	55 Å²	55	51.4 Å²	51.4	29%	0.288	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	143.7	174.1	-67.4	151	0	0	0	109.6	R36 R37 R52 T53	R36-L50 HydrophobicContact CB-CD2 4.5Å; R36-L50 WeakPolarHBondContact O-CA 3.35Å; R37-L50 HydrophobicContact CG-CD2 3.69Å; R37-L50 HydrophobicContact CG-CG 4.33Å; L50-R52 HydrophobicContact CB-CG 3.93Å; L50-R52 PolarHBondContact O-N 3.21Å; L50-R52 VanDerWaalsContact O-N 3.12Å; L50-T53 VanDerWaalsContact O-CB 3.24Å; L50-T53 WeakPolarHBondContact O-CB 3.47Å; L50-T53 PolarHBondContact O-N 3.27Å
51	W	91.2	Very high	92.4	Very high	19 Å²	19	54.5 Å²	54.5	7%	0.072	26%	0.256	C	S	.	.	H	α-helix	trans	-57.4	-30.4	176.2	-71.7	118.8	0	0	0	113.1	K32 S35 R36 V38 T53 L54 D55 R66 Y88	K32-W51 HydrophobicContact CB-CZ2 4.44Å; K32-W51 HydrophobicContact CD-CH2 4.39Å; K32-W51 HydrophobicContact CD-CZ2 4.45Å; K32-W51 HydrophobicContact CG-CH2 4.15Å; K32-W51 HydrophobicContact CG-CZ2 3.75Å; S35-W51 PolarHBondContact O-NE1 2.82Å; S35-W51 VanDerWaalsContact O-NE1 3.14Å; R36-W51 PolarHBondContact O-N 3.47Å; V38-W51 HydrophobicContact CB-CD2 4.12Å; V38-W51 HydrophobicContact CB-CE3 4.38Å; V38-W51 HydrophobicContact CB-CH2 3.9Å; V38-W51 HydrophobicContact CB-CZ2 3.61Å; V38-W51 HydrophobicContact CB-CZ3 4.27Å; V38-W51 HydrophobicContact CG1-CD2 3.93Å; V38-W51 HydrophobicContact CG1-CE3 3.92Å; V38-W51 HydrophobicContact CG1-CH2 4.2Å; V38-W51 HydrophobicContact CG1-CZ2 4.22Å; V38-W51 HydrophobicContact CG1-CZ3 4.05Å; V38-W51 HydrophobicContact CG2-CH2 3.64Å; V38-W51 HydrophobicContact CG2-CZ2 3.71Å; V38-W51 HydrophobicContact CG2-CZ3 4.22Å; W51-T53 PolarHBondContact O-N 3.34Å; W51-L54 HydrophobicContact CE3-CD1 4.09Å; W51-L54 HydrophobicContact CZ3-CD1 4.2Å; W51-L54 PolarHBondContact O-N 3.22Å; W51-D55 PolarHBondContact O-N 3.15Å; W51-R66 VanDerWaalsContact C-NH1 3.28Å; W51-R66 HydrophobicContact CE3-CB 4.31Å; W51-R66 HydrophobicContact CE3-CG 4.3Å; W51-R66 PolarHBondContact O-NH1 2.76Å; W51-Y88 AromaticContact CH2-CE2 3.85Å; W51-Y88 HydrophobicContact CH2-CE2 3.85Å; W51-Y88 HydrophobicContact CZ2-CE2 4.22Å
52	R	91.4	Very high	92.3	Very high	178 Å²	178	53.4 Å²	53.4	67%	0.672	25%	0.251	S	S	*	.	H	α-helix	trans	-70	-11.4	173.8	73.4	173.8	-175.5	176.9	0.2	115.2	L50 D55	L50-R52 HydrophobicContact CB-CG 3.93Å; L50-R52 PolarHBondContact O-N 3.21Å; L50-R52 VanDerWaalsContact O-N 3.12Å; R52-D55 WeakPolarHBondContact CA-OD1 3.4Å
53	T	92.3	Very high	92.1	Very high	18 Å²	18	53.5 Å²	53.5	11%	0.11	25%	0.252	C	S	.	.	H	α-helix	trans	-79.7	-32.2	173.4	-61.8	0	0	0	0	110.1	L50 W51 R105	L50-T53 VanDerWaalsContact O-CB 3.24Å; L50-T53 WeakPolarHBondContact O-CB 3.47Å; L50-T53 PolarHBondContact O-N 3.27Å; W51-T53 PolarHBondContact O-N 3.34Å; T53-R105 HydrophobicContact CG2-CG 4.43Å
54	L	91.8	Very high	92.1	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-78.1	-32.1	178.9	-50.3	-170.8	0	0	0	112	V38 L40 V49 W51 R56 L57 L62 L65 Y104	V38-L54 HydrophobicContact CG1-CD1 4.36Å; L40-L54 HydrophobicContact CD1-CD2 4.49Å; V49-L54 HydrophobicContact CG2-CD2 4.27Å; W51-L54 HydrophobicContact CE3-CD1 4.09Å; W51-L54 HydrophobicContact CZ3-CD1 4.2Å; W51-L54 PolarHBondContact O-N 3.22Å; L54-R56 PolarHBondContact O-N 3.05Å; L54-L57 PolarHBondContact O-N 3.47Å; L54-L62 HydrophobicContact CD1-CB 4.43Å; L54-L62 HydrophobicContact CD2-CB 4Å; L54-L62 HydrophobicContact CD2-CD1 4.16Å; L54-L65 HydrophobicContact CD1-CD2 4.5Å; L54-Y104 HydrophobicContact CD2-CD1 4.34Å
55	D	89.2	Confident	92.1	Very high	69 Å²	69	56.7 Å²	56.7	37%	0.369	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.9	-31.6	171.2	-83	150.2	0	0	0	114.5	W51 R52 L57 P58 R66	W51-D55 PolarHBondContact O-N 3.15Å; R52-D55 WeakPolarHBondContact CA-OD1 3.4Å; D55-L57 PolarHBondContact O-N 3.43Å; D55-P58 WeakPolarHBondContact O-CD 3.22Å; D55-R66 IonicContact OD1-CZ 3.18Å; D55-R66 IonicContact OD1-NH1 3.7Å; D55-R66 PolarHBondContact OD1-NH1 2.93Å; D55-R66 IonicContact OD1-NH2 2.68Å; D55-R66 PolarHBondContact OD1-NH2 3.35Å; D55-R66 WeakPolarHBondContact OD2-CD 3.34Å; D55-R66 IonicContact OD2-CZ 2.96Å; D55-R66 IonicContact OD2-NE 3.21Å; D55-R66 PolarHBondContact OD2-NE 3.01Å; D55-R66 VanDerWaalsContact OD2-NE 3.13Å; D55-R66 IonicContact OD2-NH1 3.39Å; D55-R66 PolarHBondContact OD2-NH1 2.66Å; D55-R66 IonicContact OD2-NH2 2.72Å; D55-R66 PolarHBondContact OD2-NH2 3.29Å
56	R	90.2	Very high	91.8	Very high	148 Å²	148	60 Å²	60	56%	0.558	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-24.3	-171.2	-69.6	173.6	160.6	-164.1	-10.5	113.2	L54 Y104 R105	L54-R56 PolarHBondContact O-N 3.05Å; R56-Y104 WeakPolarHBondContact CD-O 3.38Å; R56-Y104 PolarHBondContact NH1-O 2.98Å; R56-R105 VanDerWaalsContact NH1-C 3.31Å; R56-R105 PolarHBondContact NH1-O 3Å
57	L	91.2	Very high	91.4	Very high	38 Å²	38	62.7 Å²	62.7	20%	0.199	28%	0.278	C	S	.	.	S	Bend	trans	-138.1	68.7	-176	-63	172	0	0	0	109.2	L54 D55 R59 T60 G63 F103 Y104	L54-L57 PolarHBondContact O-N 3.47Å; D55-L57 PolarHBondContact O-N 3.43Å; L57-R59 PolarHBondContact O-N 2.99Å; L57-R59 VanDerWaalsContact O-N 3.09Å; L57-T60 HydrophobicContact CB-CG2 3.74Å; L57-T60 HydrophobicContact CD1-CG2 4.5Å; L57-T60 PolarHBondContact O-N 2.67Å; L57-T60 PolarHBondContact O-OG1 3.22Å; L57-G63 WeakPolarHBondContact O-CA 3.3Å; L57-F103 HydrophobicContact CD1-CD1 3.55Å; L57-F103 HydrophobicContact CD1-CE1 3.34Å; L57-F103 HydrophobicContact CD1-CG 4.36Å; L57-F103 HydrophobicContact CD1-CZ 4Å; L57-F103 HydrophobicContact CD2-CE1 4.28Å; L57-F103 HydrophobicContact CD2-CZ 4.28Å; L57-F103 HydrophobicContact CG-CE1 4.47Å; L57-Y104 HydrophobicContact CB-CD1 4.13Å; L57-Y104 HydrophobicContact CB-CE1 3.81Å; L57-Y104 HydrophobicContact CD1-CD1 3.8Å; L57-Y104 HydrophobicContact CD1-CD2 4.44Å; L57-Y104 HydrophobicContact CD1-CE1 3.87Å; L57-Y104 HydrophobicContact CD1-CE2 4.46Å; L57-Y104 HydrophobicContact CD1-CG 4.09Å; L57-Y104 HydrophobicContact CG-CD1 4.27Å; L57-Y104 HydrophobicContact CG-CE1 4.35Å
58	P	89.8	Confident	91.1	Very high	76 Å²	76	62.5 Å²	62.5	49%	0.494	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-16.8	-167.2	28.1	-35.1	0	0	0	113.9	D55	D55-P58 WeakPolarHBondContact O-CD 3.22Å
59	R	89.3	Confident	90.7	Very high	222 Å²	222	61.3 Å²	61.3	84%	0.838	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-18.1	-179.4	-66.2	-176.7	176.6	179.5	-1.3	114.1	L57 K64	L57-R59 PolarHBondContact O-N 2.99Å; L57-R59 VanDerWaalsContact O-N 3.09Å; R59-K64 WeakPolarHBondContact O-CE 3.49Å; R59-K64 PolarHBondContact O-NZ 2.69Å
60	T	93.6	Very high	90.4	Very high	10 Å²	10	63.7 Å²	63.7	6%	0.061	29%	0.29	C	S	.	.	S	Bend	trans	-77.7	172.3	-177.3	69.8	0	0	0	0	111.9	L57 L62 G63 K64 Y104 W127 G128 I129	L57-T60 HydrophobicContact CB-CG2 3.74Å; L57-T60 HydrophobicContact CD1-CG2 4.5Å; L57-T60 PolarHBondContact O-N 2.67Å; L57-T60 PolarHBondContact O-OG1 3.22Å; T60-L62 PolarHBondContact O-N 3.21Å; T60-G63 PolarHBondContact O-N 2.9Å; T60-G63 PolarHBondContact OG1-N 3.48Å; T60-G63 VanDerWaalsContact OG1-N 3.08Å; T60-K64 WeakPolarHBondContact O-CG 3.2Å; T60-K64 PolarHBondContact O-N 3.5Å; T60-Y104 WeakPolarHBondContact CB-OH 3.35Å; T60-Y104 PolarHBondContact OG1-OH 3.23Å; T60-W127 WeakPolarHBondContact CB-O 3.06Å; T60-G128 WeakPolarHBondContact CG2-O 3.46Å; T60-I129 HydrophobicContact CG2-CG1 3.76Å
61	R	93.7	Very high	90.1	Very high	64 Å²	64	64.1 Å²	64.1	24%	0.242	29%	0.291	C	S	.	.	H	α-helix	trans	-57.5	-45.5	175.3	-176.9	176.9	-71.6	-90.3	-5	112.1	L65 E76 I77 Y126 W127	R61-L65 PolarHBondContact O-N 3.25Å; R61-L65 VanDerWaalsContact O-N 3.13Å; R61-E76 PolarHBondContact NH1-O 3.05Å; R61-I77 HydrophobicContact CG-CG2 3.82Å; R61-I77 PolarHBondContact NH1-O 3.24Å; R61-Y126 VanDerWaalsContact CD-CE1 3.5Å; R61-Y126 VanDerWaalsContact CZ-CE2 3.45Å; R61-Y126 PolarHBondContact NE-O 3.47Å; R61-W127 HydrophobicContact CB-CE3 4.28Å; R61-W127 WeakPolarHBondContact CB-O 3.29Å; R61-W127 HydrophobicContact CG-CE3 4.4Å; R61-W127 PolarHBondContact N-O 3.39Å
62	L	93.7	Very high	89.9	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-75.1	-28.4	178.4	-61.7	-177.2	0	0	0	113.4	L40 L54 T60 L65 F90 F97 Y104 W127	L40-L62 HydrophobicContact CD1-CD1 3.97Å; L40-L62 HydrophobicContact CD1-CD2 3.97Å; L40-L62 HydrophobicContact CD2-CD2 4.46Å; L54-L62 HydrophobicContact CD1-CB 4.43Å; L54-L62 HydrophobicContact CD2-CB 4Å; L54-L62 HydrophobicContact CD2-CD1 4.16Å; T60-L62 PolarHBondContact O-N 3.21Å; L62-L65 HydrophobicContact CD2-CD2 4.31Å; L62-L65 WeakPolarHBondContact O-CB 3.37Å; L62-F90 HydrophobicContact CD2-CE2 4.37Å; L62-F90 HydrophobicContact CD2-CZ 3.96Å; L62-F97 HydrophobicContact CD1-CE2 3.84Å; L62-F97 HydrophobicContact CD1-CZ 3.88Å; L62-Y104 HydrophobicContact CB-CE1 4.05Å; L62-Y104 HydrophobicContact CD1-CD2 4.44Å; L62-Y104 HydrophobicContact CD1-CE2 3.87Å; L62-W127 HydrophobicContact CD2-CE3 4.14Å; L62-W127 HydrophobicContact CD2-CZ3 3.69Å; L62-W127 HydrophobicContact CG-CE3 4.02Å; L62-W127 HydrophobicContact CG-CZ3 4.08Å
63	G	91.6	Very high	89.8	Confident	2 Å²	2	63 Å²	63	2%	0.021	30%	0.296	C	S	.	.	H	α-helix	trans	-59.9	-55.9	171.3	0	0	0	0	0	110.6	L57 T60 L65 R66	L57-G63 WeakPolarHBondContact O-CA 3.3Å; T60-G63 PolarHBondContact O-N 2.9Å; T60-G63 PolarHBondContact OG1-N 3.48Å; T60-G63 VanDerWaalsContact OG1-N 3.08Å; G63-L65 VanDerWaalsContact C-N 3.28Å; G63-L65 PolarHBondContact O-N 2.83Å; G63-R66 WeakPolarHBondContact O-CB 3.28Å; G63-R66 PolarHBondContact O-N 2.82Å; G63-R66 VanDerWaalsContact O-N 3.11Å
64	K	91.6	Very high	89.6	Confident	113 Å²	113	62.1 Å²	62.1	49%	0.491	29%	0.291	S	S	.	.	H	α-helix	trans	-56.5	-36.5	177.4	-67.6	167.6	179.3	168.9	0	113.4	R59 T60 R66 D67 C68 I77	R59-K64 WeakPolarHBondContact O-CE 3.49Å; R59-K64 PolarHBondContact O-NZ 2.69Å; T60-K64 WeakPolarHBondContact O-CG 3.2Å; T60-K64 PolarHBondContact O-N 3.5Å; K64-R66 PolarHBondContact O-N 3.1Å; K64-D67 PolarHBondContact O-N 3.18Å; K64-C68 PolarHBondContact O-N 2.78Å; K64-C68 PolarHBondContact O-SG 2.82Å; K64-I77 HydrophobicContact CB-CD1 3.52Å
65	L	91.2	Very high	89.5	Confident	0 Å²	0	66 Å²	66	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-50.6	-33	176.7	-177.6	68.3	0	0	0	112.9	K32 L40 L54 R61 L62 G63 L74 I77 Y88 F90	K32-L65 PolarHBondContact NZ-O 3.03Å; L40-L65 HydrophobicContact CD2-CD2 3.66Å; L54-L65 HydrophobicContact CD1-CD2 4.5Å; R61-L65 PolarHBondContact O-N 3.25Å; R61-L65 VanDerWaalsContact O-N 3.13Å; L62-L65 HydrophobicContact CD2-CD2 4.31Å; L62-L65 WeakPolarHBondContact O-CB 3.37Å; G63-L65 VanDerWaalsContact C-N 3.28Å; G63-L65 PolarHBondContact O-N 2.83Å; L65-L74 HydrophobicContact CD1-CD2 3.91Å; L65-I77 HydrophobicContact CB-CG2 4.01Å; L65-I77 HydrophobicContact CD1-CG2 3.79Å; L65-I77 HydrophobicContact CG-CG2 4.47Å; L65-Y88 HydrophobicContact CD1-CD1 3.8Å; L65-Y88 HydrophobicContact CD1-CE1 4.24Å; L65-Y88 HydrophobicContact CD1-CG 4.25Å; L65-Y88 HydrophobicContact CD2-CG 4.34Å; L65-F90 HydrophobicContact CD2-CZ 4.12Å
66	R	85.9	Confident	89.4	Confident	82 Å²	82	70.2 Å²	70.2	31%	0.309	33%	0.328	S	S	.	.	H	α-helix	trans	-64.6	-46.8	176.9	-178.6	-178.5	171.9	141.1	-32.5	112.2	K32 W51 D55 G63 K64	K32-R66 PolarHBondContact NZ-O 3.09Å; W51-R66 VanDerWaalsContact C-NH1 3.28Å; W51-R66 HydrophobicContact CE3-CB 4.31Å; W51-R66 HydrophobicContact CE3-CG 4.3Å; W51-R66 PolarHBondContact O-NH1 2.76Å; D55-R66 IonicContact OD1-CZ 3.18Å; D55-R66 IonicContact OD1-NH1 3.7Å; D55-R66 PolarHBondContact OD1-NH1 2.93Å; D55-R66 IonicContact OD1-NH2 2.68Å; D55-R66 PolarHBondContact OD1-NH2 3.35Å; D55-R66 WeakPolarHBondContact OD2-CD 3.34Å; D55-R66 IonicContact OD2-CZ 2.96Å; D55-R66 IonicContact OD2-NE 3.21Å; D55-R66 PolarHBondContact OD2-NE 3.01Å; D55-R66 VanDerWaalsContact OD2-NE 3.13Å; D55-R66 IonicContact OD2-NH1 3.39Å; D55-R66 PolarHBondContact OD2-NH1 2.66Å; D55-R66 IonicContact OD2-NH2 2.72Å; D55-R66 PolarHBondContact OD2-NH2 3.29Å; G63-R66 WeakPolarHBondContact O-CB 3.28Å; G63-R66 PolarHBondContact O-N 2.82Å; G63-R66 VanDerWaalsContact O-N 3.11Å; K64-R66 PolarHBondContact O-N 3.1Å
67	D	85.6	Confident	89.4	Confident	105 Å²	105	63.8 Å²	63.8	56%	0.561	30%	0.304	S	S	*	.	H	α-helix	trans	-83	-17.1	-171.1	-60	-29.7	0	0	0	113	K64 N69	K64-D67 PolarHBondContact O-N 3.18Å; D67-N69 PolarHBondContact O-N 2.93Å; D67-N69 PolarHBondContact O-ND2 2.89Å
68	C	88.3	Confident	89.4	Confident	20 Å²	20	62 Å²	62	14%	0.135	30%	0.295	C	S	.	.			trans	-65.4	101.3	176.3	-71.7	0	0	0	0	112.8	K32 K64 S73 L74 I77	K32-C68 PolarHBondContact NZ-O 2.95Å; K64-C68 PolarHBondContact O-N 2.78Å; K64-C68 PolarHBondContact O-SG 2.82Å; C68-S73 WeakPolarHBondContact CA-OG 3.42Å; C68-S73 WeakPolarHBondContact CB-O 3.43Å; C68-S73 VanDerWaalsContact CB-OG 3.28Å; C68-S73 WeakPolarHBondContact CB-OG 3.45Å; C68-S73 PolarHBondContact SG-O 2.73Å; C68-L74 HydrophobicContact CB-CD2 3.82Å; C68-L74 HydrophobicContact CB-CG 4.37Å; C68-I77 HydrophobicContact CB-CD1 4.49Å; C68-I77 WeakPolarHBondContact SG-CD1 3.22Å
69	N	86.7	Confident	89.5	Confident	62 Å²	62	62.4 Å²	62.4	33%	0.332	29%	0.293	S	S	.	.			trans	-105.6	-0.2	-173.9	-70.8	-45.4	0	0	0	114.1	P25 I29 D67 S73	P25-N69 VanDerWaalsContact CA-O 3.29Å; P25-N69 WeakPolarHBondContact CA-O 3.32Å; P25-N69 WeakPolarHBondContact CB-O 3.46Å; I29-N69 HydrophobicContact CD1-CB 4.06Å; I29-N69 HydrophobicContact CG1-CB 3.76Å; I29-N69 WeakPolarHBondContact CG1-OD1 3.24Å; D67-N69 PolarHBondContact O-N 2.93Å; D67-N69 PolarHBondContact O-ND2 2.89Å; N69-S73 PolarHBondContact N-OG 3.29Å
70	T	87.3	Confident	89.6	Confident	56 Å²	56	56.5 Å²	56.5	34%	0.344	28%	0.278	S	S	.	.	S	Bend	trans	-115.3	154.6	174.8	71.6	0	0	0	0	110.9	P25 E72 S73 L74	P25-T70 HydrophobicContact CB-CG2 4.46Å; P25-T70 HydrophobicContact CG-CG2 4.15Å; T70-E72 VanDerWaalsContact C-N 3.31Å; T70-E72 PolarHBondContact O-N 3.15Å; T70-S73 PolarHBondContact N-OG 3.14Å; T70-S73 VanDerWaalsContact N-OG 3.08Å; T70-S73 PolarHBondContact O-N 2.81Å; T70-S73 PolarHBondContact O-OG 3.4Å; T70-S73 WeakPolarHBondContact OG1-CB 3.24Å; T70-S73 PolarHBondContact OG1-N 3.04Å; T70-S73 PolarHBondContact OG1-OG 3.46Å; T70-S73 VanDerWaalsContact OG1-OG 3.08Å; T70-L74 PolarHBondContact O-N 2.86Å; T70-L74 VanDerWaalsContact O-N 3.17Å
71	H	86.9	Confident	89.5	Confident	64 Å²	64	57.6 Å²	57.6	30%	0.296	28%	0.281	S	S	.	.	H	α-helix	trans	-54	-46.3	176.2	171.8	39.7	0	0	0	112.4	P22 S73 L74 M75 Y81	P22-H71 HydrophobicContact CB-CB 4.21Å; P22-H71 WeakPolarHBondContact CB-CD2 3.32Å; H71-S73 PolarHBondContact O-N 3.31Å; H71-L74 WeakPolarHBondContact O-CB 3.39Å; H71-L74 PolarHBondContact O-N 2.67Å; H71-L74 VanDerWaalsContact O-N 3.11Å; H71-M75 WeakPolarHBondContact CE1-CG 3.3Å; H71-M75 WeakPolarHBondContact O-CG 3.35Å; H71-M75 PolarHBondContact O-N 2.98Å; H71-Y81 AromaticContact CE1-CE1 3.93Å; H71-Y81 AromaticContact ND1-CE1 3.46Å; H71-Y81 WeakPolarHBondContact ND1-CE1 3.24Å; H71-Y81 AromaticContact ND1-CZ 3.63Å; H71-Y81 PolarHBondContact ND1-OH 3.19Å
72	E	86.1	Confident	89.3	Confident	152 Å²	152	56.6 Å²	56.6	71%	0.71	28%	0.284	S	S	*	.	H	α-helix	trans	-56.7	-49.4	178.2	-62.2	173.1	162.1	0	0	111.2	T70 L74 M75 E76	T70-E72 VanDerWaalsContact C-N 3.31Å; T70-E72 PolarHBondContact O-N 3.15Å; E72-L74 PolarHBondContact O-N 2.87Å; E72-L74 VanDerWaalsContact O-N 3.17Å; E72-M75 PolarHBondContact O-N 3.46Å; E72-M75 VanDerWaalsContact O-N 3.12Å; E72-E76 PolarHBondContact O-N 3.34Å; E72-E76 VanDerWaalsContact O-N 3.15Å
73	S	89.1	Confident	89	Confident	22 Å²	22	58.1 Å²	58.1	15%	0.154	29%	0.292	C	S	.	.	H	α-helix	trans	-65.1	-18.6	179.1	70.3	0	0	0	0	114.4	C68 N69 T70 H71	C68-S73 WeakPolarHBondContact CA-OG 3.42Å; C68-S73 WeakPolarHBondContact CB-O 3.43Å; C68-S73 VanDerWaalsContact CB-OG 3.28Å; C68-S73 WeakPolarHBondContact CB-OG 3.45Å; C68-S73 PolarHBondContact SG-O 2.73Å; N69-S73 PolarHBondContact N-OG 3.29Å; T70-S73 PolarHBondContact N-OG 3.14Å; T70-S73 VanDerWaalsContact N-OG 3.08Å; T70-S73 PolarHBondContact O-N 2.81Å; T70-S73 PolarHBondContact O-OG 3.4Å; T70-S73 WeakPolarHBondContact OG1-CB 3.24Å; T70-S73 PolarHBondContact OG1-N 3.04Å; T70-S73 PolarHBondContact OG1-OG 3.46Å; T70-S73 VanDerWaalsContact OG1-OG 3.08Å; H71-S73 PolarHBondContact O-N 3.31Å
74	L	89	Confident	88.6	Confident	0 Å²	0	63 Å²	63	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-82.5	-44.9	170.7	-68.8	175.2	0	0	0	111.3	I28 L65 C68 T70 H71 E72 E76 I77 C78 Y81 Y88	I28-L74 HydrophobicContact CD1-CD1 4.07Å; I28-L74 HydrophobicContact CG1-CD1 4.47Å; I28-L74 HydrophobicContact CG2-CD1 3.98Å; L65-L74 HydrophobicContact CD1-CD2 3.91Å; C68-L74 HydrophobicContact CB-CD2 3.82Å; C68-L74 HydrophobicContact CB-CG 4.37Å; T70-L74 PolarHBondContact O-N 2.86Å; T70-L74 VanDerWaalsContact O-N 3.17Å; H71-L74 WeakPolarHBondContact O-CB 3.39Å; H71-L74 PolarHBondContact O-N 2.67Å; H71-L74 VanDerWaalsContact O-N 3.11Å; E72-L74 PolarHBondContact O-N 2.87Å; E72-L74 VanDerWaalsContact O-N 3.17Å; L74-E76 PolarHBondContact O-N 3.44Å; L74-I77 WeakPolarHBondContact O-CA 3.4Å; L74-I77 PolarHBondContact O-N 2.79Å; L74-C78 PolarHBondContact O-N 2.84Å; L74-C78 PolarHBondContact O-SG 3.46Å; L74-Y81 HydrophobicContact CB-CD1 4.49Å; L74-Y81 HydrophobicContact CD1-CD2 3.79Å; L74-Y81 HydrophobicContact CD1-CE1 4.49Å; L74-Y81 HydrophobicContact CD1-CE2 3.62Å; L74-Y81 HydrophobicContact CD1-CG 4.29Å; L74-Y88 HydrophobicContact CD1-CE1 4.13Å; L74-Y88 HydrophobicContact CD2-CD1 4.32Å; L74-Y88 HydrophobicContact CD2-CE1 3.81Å
75	M	89	Confident	88.3	Confident	82 Å²	82	62.1 Å²	62.1	40%	0.404	32%	0.323	S	S	.	.	H	α-helix	trans	-67	-18.8	-179.9	-59.3	-51.7	-58.4	0	0	113.9	H71 E72 I77 D79 Y81	H71-M75 WeakPolarHBondContact CE1-CG 3.3Å; H71-M75 WeakPolarHBondContact O-CG 3.35Å; H71-M75 PolarHBondContact O-N 2.98Å; E72-M75 PolarHBondContact O-N 3.46Å; E72-M75 VanDerWaalsContact O-N 3.12Å; M75-I77 VanDerWaalsContact C-N 3.27Å; M75-D79 WeakPolarHBondContact CE-O 3.43Å; M75-Y81 HydrophobicContact SD-CD1 3.89Å; M75-Y81 HydrophobicContact SD-CE1 3.74Å
76	E	88.1	Confident	88.2	Confident	156 Å²	156	62.7 Å²	62.7	73%	0.729	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-19.7	167.9	-69.9	-175.2	160.9	0	0	113.2	R61 E72 L74	R61-E76 PolarHBondContact NH1-O 3.05Å; E72-E76 PolarHBondContact O-N 3.34Å; E72-E76 VanDerWaalsContact O-N 3.15Å; L74-E76 PolarHBondContact O-N 3.44Å
77	I	89.6	Confident	88.5	Confident	14 Å²	14	60.4 Å²	60.4	7%	0.072	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	-46.3	-169.8	-67.9	-167.3	0	0	0	112.9	R61 K64 L65 C68 L74 M75 F90	R61-I77 HydrophobicContact CG-CG2 3.82Å; R61-I77 PolarHBondContact NH1-O 3.24Å; K64-I77 HydrophobicContact CB-CD1 3.52Å; L65-I77 HydrophobicContact CB-CG2 4.01Å; L65-I77 HydrophobicContact CD1-CG2 3.79Å; L65-I77 HydrophobicContact CG-CG2 4.47Å; C68-I77 HydrophobicContact CB-CD1 4.49Å; C68-I77 WeakPolarHBondContact SG-CD1 3.22Å; L74-I77 WeakPolarHBondContact O-CA 3.4Å; L74-I77 PolarHBondContact O-N 2.79Å; M75-I77 VanDerWaalsContact C-N 3.27Å; I77-F90 HydrophobicContact CG2-CE1 4.37Å; I77-F90 WeakPolarHBondContact O-CE1 3.49Å
78	C	91.8	Very high	88.9	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.007	29%	0.293	C	S	.	.			trans	-120.9	149	-179.3	56.6	0	0	0	0	110.8	L74 F89 F90	L74-C78 PolarHBondContact O-N 2.84Å; L74-C78 PolarHBondContact O-SG 3.46Å; C78-F89 WeakPolarHBondContact CB-O 3.33Å; C78-F90 HydrophobicContact CB-CD1 4.16Å; C78-F90 HydrophobicContact CB-CE1 3.67Å; C78-F90 HydrophobicContact CB-CE2 4.33Å; C78-F90 HydrophobicContact CB-CZ 3.76Å
79	D	91.7	Very high	89.3	Confident	84 Å²	84	57.4 Å²	57.4	45%	0.449	30%	0.299	S	S	.	.	S	Bend	trans	-76.4	-27.5	-173.5	-57.2	-66.8	0	0	0	112.4	M75 F89 F90 D91	M75-D79 WeakPolarHBondContact CE-O 3.43Å; D79-F89 HydrophobicContact CB-CD1 4.12Å; D79-F89 HydrophobicContact CB-CE1 4.5Å; D79-F89 PolarHBondContact N-O 3.3Å; D79-F90 VanDerWaalsContact OD2-CA 3.3Å; D79-F90 WeakPolarHBondContact OD2-CA 3.38Å; D79-D91 PolarHBondContact OD2-N 2.99Å
80	D	91.2	Very high	89.7	Confident	98 Å²	98	54.4 Å²	54.4	52%	0.524	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	166.5	169.1	-159.6	-3.2	0	0	0	110.6	F89	D80-F89 HydrophobicContact CB-CB 4.16Å; D80-F89 HydrophobicContact CB-CD1 4.3Å; D80-F89 PolarHBondContact O-N 3.01Å
81	Y	91.5	Very high	90	Very high	33 Å²	33	57.6 Å²	57.6	13%	0.129	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	145.7	176.4	72.1	-68.8	0	0	0	113.8	P23 H71 L74 M75 L83 E87 Y88	P23-Y81 WeakPolarHBondContact CD-OH 3.33Å; P23-Y81 HydrophobicContact CG-CE2 4.3Å; P23-Y81 WeakPolarHBondContact CG-OH 3.49Å; H71-Y81 AromaticContact CE1-CE1 3.93Å; H71-Y81 AromaticContact ND1-CE1 3.46Å; H71-Y81 WeakPolarHBondContact ND1-CE1 3.24Å; H71-Y81 AromaticContact ND1-CZ 3.63Å; H71-Y81 PolarHBondContact ND1-OH 3.19Å; L74-Y81 HydrophobicContact CB-CD1 4.49Å; L74-Y81 HydrophobicContact CD1-CD2 3.79Å; L74-Y81 HydrophobicContact CD1-CE1 4.49Å; L74-Y81 HydrophobicContact CD1-CE2 3.62Å; L74-Y81 HydrophobicContact CD1-CG 4.29Å; M75-Y81 HydrophobicContact SD-CD1 3.89Å; M75-Y81 HydrophobicContact SD-CE1 3.74Å; Y81-L83 HydrophobicContact CD2-CD2 3.91Å; Y81-L83 HydrophobicContact CD2-CG 4.04Å; Y81-L83 HydrophobicContact CE2-CD1 4.19Å; Y81-L83 HydrophobicContact CE2-CD2 3.85Å; Y81-L83 HydrophobicContact CE2-CG 3.76Å; Y81-E87 CarbonylContact C-O 3.57Å; Y81-E87 WeakPolarHBondContact CA-O 3.32Å; Y81-Y88 HydrophobicContact CD2-CE1 4.3Å; Y81-Y88 HydrophobicContact CG-CD1 4.41Å; Y81-Y88 HydrophobicContact CG-CE1 4.48Å
82	S	89.9	Confident	90.3	Very high	42 Å²	42	57.7 Å²	57.7	29%	0.294	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	111.7	176.9	176.8	0	0	0	0	111.3	S84 N86 E87	S82-S84 VanDerWaalsContact C-N 3.33Å; S82-S84 PolarHBondContact O-N 2.86Å; S82-S84 PolarHBondContact OG-OG 3.39Å; S82-N86 WeakPolarHBondContact O-CA 3.49Å; S82-N86 PolarHBondContact O-N 3.46Å; S82-E87 PolarHBondContact N-O 3.38Å; S82-E87 PolarHBondContact O-N 2.76Å
83	L	86.3	Confident	90.4	Very high	32 Å²	32	54.6 Å²	54.6	17%	0.168	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-22.2	176.8	-66.5	-179	0	0	0	113.7	P23 E27 I28 T31 Y81	P23-L83 HydrophobicContact CB-CD1 3.61Å; P23-L83 HydrophobicContact CG-CD1 3.65Å; E27-L83 HydrophobicContact CG-CD1 4.36Å; I28-L83 HydrophobicContact CG1-CD1 4.03Å; I28-L83 HydrophobicContact CG1-CD2 4.33Å; T31-L83 HydrophobicContact CG2-CD2 4.32Å; T31-L83 WeakPolarHBondContact CG2-O 3.4Å; Y81-L83 HydrophobicContact CD2-CD2 3.91Å; Y81-L83 HydrophobicContact CD2-CG 4.04Å; Y81-L83 HydrophobicContact CE2-CD1 4.19Å; Y81-L83 HydrophobicContact CE2-CD2 3.85Å; Y81-L83 HydrophobicContact CE2-CG 3.76Å
84	S	84.3	Confident	90.5	Very high	105 Å²	105	54.5 Å²	54.5	73%	0.734	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-38.7	177.3	61.3	0	0	0	0	111.9	S82	S82-S84 VanDerWaalsContact C-N 3.33Å; S82-S84 PolarHBondContact O-N 2.86Å; S82-S84 PolarHBondContact OG-OG 3.39Å
85	E	84.1	Confident	90.4	Very high	94 Å²	94	54.5 Å²	54.5	44%	0.439	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-8.1	178.1	-65.9	-52.3	127.8	0	0	113.5	R39 E87	R39-E85 IonicContact CZ-OE2 2.87Å; R39-E85 IonicContact NH1-OE2 3.91Å; R39-E85 PolarHBondContact NH1-OE2 3.43Å; R39-E85 IonicContact NH2-OE2 2.71Å; R39-E85 PolarHBondContact NH2-OE2 3.41Å; E85-E87 VanDerWaalsContact C-N 3.29Å; E85-E87 HydrophobicContact CB-CB 4.01Å; E85-E87 PolarHBondContact O-N 3.16Å
86	N	89.3	Confident	90.5	Very high	12 Å²	12	50.6 Å²	50.6	6%	0.064	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.1	51.1	-168.2	-169	46.5	0	0	0	111.8	T31 R37 R39 S82 Y88	T31-N86 HydrophobicContact CG2-CB 4.24Å; R37-N86 PolarHBondContact O-ND2 2.86Å; R39-N86 PolarHBondContact N-O 2.81Å; S82-N86 WeakPolarHBondContact O-CA 3.49Å; S82-N86 PolarHBondContact O-N 3.46Å; N86-Y88 PolarHBondContact OD1-OH 3.28Å
87	E	93.1	Very high	90.8	Very high	34 Å²	34	43.1 Å²	43.1	16%	0.159	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	135.9	-173.5	-171.3	163.9	141.1	0	0	110.7	R39 N41 N46 Y81 S82 E85	R39-E87 HydrophobicContact CB-CB 4Å; R39-E87 HydrophobicContact CB-CG 3.88Å; R39-E87 VanDerWaalsContact CD-OE2 3.31Å; R39-E87 WeakPolarHBondContact CD-OE2 3.46Å; R39-E87 IonicContact NH1-OE2 3.93Å; R39-E87 WeakPolarHBondContact O-CA 3.41Å; N41-E87 HydrophobicContact CB-CG 3.93Å; N41-E87 WeakPolarHBondContact CB-OE1 3.3Å; N41-E87 PolarHBondContact ND2-OE1 3.01Å; N46-E87 PolarHBondContact ND2-OE1 3.37Å; N46-E87 PolarHBondContact ND2-OE2 3.18Å; Y81-E87 CarbonylContact C-O 3.57Å; Y81-E87 WeakPolarHBondContact CA-O 3.32Å; S82-E87 PolarHBondContact N-O 3.38Å; S82-E87 PolarHBondContact O-N 2.76Å; E85-E87 VanDerWaalsContact C-N 3.29Å; E85-E87 HydrophobicContact CB-CB 4.01Å; E85-E87 PolarHBondContact O-N 3.16Å
88	Y	94.4	Very high	91	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	127.9	-178.8	-58.3	-99.4	0	0	0	108.6	V38 R39 N41 W51 L65 L74 Y81 N86	V38-Y88 HydrophobicContact CG2-CD2 3.44Å; V38-Y88 VanDerWaalsContact CG2-CD2 3.44Å; V38-Y88 HydrophobicContact CG2-CE2 3.48Å; V38-Y88 VanDerWaalsContact CG2-CE2 3.48Å; R39-Y88 PolarHBondContact O-N 2.81Å; N41-Y88 PolarHBondContact N-O 3.44Å; W51-Y88 AromaticContact CH2-CE2 3.85Å; W51-Y88 HydrophobicContact CH2-CE2 3.85Å; W51-Y88 HydrophobicContact CZ2-CE2 4.22Å; L65-Y88 HydrophobicContact CD1-CD1 3.8Å; L65-Y88 HydrophobicContact CD1-CE1 4.24Å; L65-Y88 HydrophobicContact CD1-CG 4.25Å; L65-Y88 HydrophobicContact CD2-CG 4.34Å; L74-Y88 HydrophobicContact CD1-CE1 4.13Å; L74-Y88 HydrophobicContact CD2-CD1 4.32Å; L74-Y88 HydrophobicContact CD2-CE1 3.81Å; Y81-Y88 HydrophobicContact CD2-CE1 4.3Å; Y81-Y88 HydrophobicContact CG-CD1 4.41Å; Y81-Y88 HydrophobicContact CG-CE1 4.48Å; N86-Y88 PolarHBondContact OD1-OH 3.28Å
89	F	95.2	Very high	91	Very high	62 Å²	62	45.3 Å²	45.3	27%	0.272	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	141.1	-170.6	178.8	-107.3	0	0	0	112.6	N41 C78 D79 D80 D91	N41-F89 HydrophobicContact CB-CD2 4.15Å; N41-F89 CarbonylContact O-C 3.56Å; N41-F89 VanDerWaalsContact O-CA 3.31Å; N41-F89 WeakPolarHBondContact O-CA 3.38Å; C78-F89 WeakPolarHBondContact CB-O 3.33Å; D79-F89 HydrophobicContact CB-CD1 4.12Å; D79-F89 HydrophobicContact CB-CE1 4.5Å; D79-F89 PolarHBondContact N-O 3.3Å; D80-F89 HydrophobicContact CB-CB 4.16Å; D80-F89 HydrophobicContact CB-CD1 4.3Å; D80-F89 PolarHBondContact O-N 3.01Å; F89-D91 HydrophobicContact CE1-CB 3.95Å; F89-D91 HydrophobicContact CZ-CB 4.14Å
90	F	95.8	Very high	91.2	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	120.3	177.6	-54.8	-95.2	0	0	0	109.6	L40 N41 V42 G43 L62 L65 I77 C78 D79 R92 Y126 W127	L40-F90 HydrophobicContact CD2-CE2 4.16Å; N41-F90 PolarHBondContact O-N 3.12Å; V42-F90 WeakPolarHBondContact CA-O 3.35Å; V42-F90 HydrophobicContact CG1-CB 4.44Å; V42-F90 HydrophobicContact CG2-CB 4.32Å; V42-F90 HydrophobicContact CG2-CD2 4.08Å; G43-F90 PolarHBondContact N-O 2.99Å; L62-F90 HydrophobicContact CD2-CE2 4.37Å; L62-F90 HydrophobicContact CD2-CZ 3.96Å; L65-F90 HydrophobicContact CD2-CZ 4.12Å; I77-F90 HydrophobicContact CG2-CE1 4.37Å; I77-F90 WeakPolarHBondContact O-CE1 3.49Å; C78-F90 HydrophobicContact CB-CD1 4.16Å; C78-F90 HydrophobicContact CB-CE1 3.67Å; C78-F90 HydrophobicContact CB-CE2 4.33Å; C78-F90 HydrophobicContact CB-CZ 3.76Å; D79-F90 VanDerWaalsContact OD2-CA 3.3Å; D79-F90 WeakPolarHBondContact OD2-CA 3.38Å; F90-R92 HydrophobicContact CB-CG 4.27Å; F90-R92 PolarHBondContact O-N 3.44Å; F90-Y126 HydrophobicContact CD1-CE1 4.49Å; F90-W127 HydrophobicContact CB-CH2 3.82Å; F90-W127 AromaticContact CD1-CH2 3.68Å; F90-W127 HydrophobicContact CD1-CH2 3.68Å; F90-W127 AromaticContact CD1-CZ3 3.78Å; F90-W127 HydrophobicContact CD1-CZ3 3.78Å; F90-W127 HydrophobicContact CD2-CH2 4.13Å; F90-W127 HydrophobicContact CE1-CH2 4.25Å; F90-W127 AromaticContact CE1-CZ3 3.91Å; F90-W127 HydrophobicContact CE1-CZ3 3.91Å; F90-W127 AromaticContact CG-CH2 3.61Å; F90-W127 HydrophobicContact CG-CH2 3.61Å; F90-W127 HydrophobicContact CG-CZ3 4.12Å; F90-W127 HydrophobicContact CZ-CZ3 4.38Å
91	D	93.9	Very high	91.4	Very high	122 Å²	122	36.7 Å²	36.7	65%	0.652	19%	0.194	S	C	*	.			trans	-81.7	64.3	-178.3	-165.4	22.4	0	0	0	111.5	D79 F89	D79-D91 PolarHBondContact OD2-N 2.99Å; F89-D91 HydrophobicContact CE1-CB 3.95Å; F89-D91 HydrophobicContact CZ-CB 4.14Å
92	R	93.1	Very high	91.5	Very high	66 Å²	66	38.1 Å²	38.1	25%	0.249	20%	0.204	C	C	.	.	S	Bend	trans	-133.5	170.1	-170.1	-56.6	-61.5	-61.3	-146.4	-1.4	112.4	V42 G43 F90 P94 Q122 E123 Y126 W127	V42-R92 HydrophobicContact CG1-CB 3.96Å; G43-R92 WeakPolarHBondContact CA-O 3.32Å; G43-R92 PolarHBondContact N-O 2.98Å; F90-R92 HydrophobicContact CB-CG 4.27Å; F90-R92 PolarHBondContact O-N 3.44Å; R92-P94 VanDerWaalsContact O-CD 3.29Å; R92-P94 WeakPolarHBondContact O-CD 3.39Å; R92-Q122 PolarHBondContact NH2-O 3.41Å; R92-E123 IonicContact CZ-OE1 3.21Å; R92-E123 IonicContact NE-OE1 2.68Å; R92-E123 PolarHBondContact NE-OE1 3.28Å; R92-E123 IonicContact NH2-OE1 3.93Å; R92-E123 PolarHBondContact NH2-OE1 3.43Å; R92-Y126 HydrophobicContact CG-CD1 4.03Å; R92-Y126 HydrophobicContact CG-CE1 3.53Å; R92-Y126 VanDerWaalsContact CZ-CG 3.41Å; R92-Y126 VanDerWaalsContact NH1-CG 3.34Å; R92-W127 HydrophobicContact CB-CZ2 4.13Å; R92-W127 HydrophobicContact CG-CZ2 4.18Å
93	H	88.2	Confident	91.7	Very high	87 Å²	87	36.6 Å²	36.6	40%	0.403	19%	0.192	S	C	.	.			trans	-74.5	111.3	-172.5	-174.5	-111.2	0	0	0	112.8	G95 A96 F97	H93-G95 VanDerWaalsContact C-N 3.27Å; H93-G95 PolarHBondContact O-N 2.85Å; H93-A96 HydrophobicContact CB-CB 4.38Å; H93-A96 PolarHBondContact ND1-N 3.25Å; H93-A96 PolarHBondContact O-N 3.14Å; H93-A96 VanDerWaalsContact O-N 3.13Å; H93-F97 PolarHBondContact O-N 3.11Å
94	P	90.7	Very high	92.1	Very high	20 Å²	20	35.1 Å²	35.1	13%	0.13	19%	0.185	C	C	.	.	H	α-helix	trans	-62	-31.9	-172.2	21.9	-32.7	0	0	0	113.6	L45 R92 F97 T98 Y548	L45-P94 HydrophobicContact CB-CB 3.89Å; L45-P94 HydrophobicContact CD2-CB 3.89Å; R92-P94 VanDerWaalsContact O-CD 3.29Å; R92-P94 WeakPolarHBondContact O-CD 3.39Å; P94-F97 PolarHBondContact O-N 3.38Å; P94-T98 PolarHBondContact O-N 3.31Å; P94-T98 PolarHBondContact O-OG1 3.13Å; P94-Y548 HydrophobicContact CG-CD2 4.23Å
95	G	88.1	Confident	92.5	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-65.3	-42	177.5	0	0	0	0	0	113	H93 F97 T98 Y548	H93-G95 VanDerWaalsContact C-N 3.27Å; H93-G95 PolarHBondContact O-N 2.85Å; G95-F97 VanDerWaalsContact C-N 3.3Å; G95-F97 PolarHBondContact O-N 3.27Å; G95-T98 WeakPolarHBondContact O-CB 3.38Å; G95-T98 PolarHBondContact O-N 3.5Å; G95-Y548 WeakPolarHBondContact CA-OH 3.46Å
96	A	90.9	Very high	92.9	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-65.2	-40.3	177.3	0	0	0	0	0	110.6	H93 T98 S99 I100 M115 E123	H93-A96 HydrophobicContact CB-CB 4.38Å; H93-A96 PolarHBondContact ND1-N 3.25Å; H93-A96 PolarHBondContact O-N 3.14Å; H93-A96 VanDerWaalsContact O-N 3.13Å; A96-T98 PolarHBondContact O-N 3.21Å; A96-T98 VanDerWaalsContact O-N 3.14Å; A96-S99 PolarHBondContact O-N 3.48Å; A96-S99 VanDerWaalsContact O-N 3.1Å; A96-I100 WeakPolarHBondContact O-CG1 3.27Å; A96-I100 PolarHBondContact O-N 3.2Å; A96-M115 HydrophobicContact CB-CE 4.07Å; A96-M115 HydrophobicContact CB-SD 3.83Å; A96-E123 HydrophobicContact CB-CB 4.04Å; A96-E123 HydrophobicContact CB-CG 3.6Å
97	F	94.8	Very high	93	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-58.8	-26.6	178	-167.5	-105.2	0	0	0	114	L40 V42 H47 L62 H93 P94 G95 I100 L101 W127	L40-F97 HydrophobicContact CB-CE1 4.45Å; L40-F97 HydrophobicContact CB-CZ 4.26Å; L40-F97 HydrophobicContact CD1-CZ 3.95Å; V42-F97 HydrophobicContact CB-CB 4.29Å; V42-F97 HydrophobicContact CB-CD1 4.13Å; V42-F97 HydrophobicContact CB-CG 4.06Å; V42-F97 HydrophobicContact CG1-CB 3.89Å; V42-F97 HydrophobicContact CG1-CD2 4.27Å; V42-F97 HydrophobicContact CG1-CG 4Å; V42-F97 HydrophobicContact CG2-CB 4.48Å; V42-F97 HydrophobicContact CG2-CD1 3.66Å; V42-F97 HydrophobicContact CG2-CD2 3.86Å; V42-F97 HydrophobicContact CG2-CE1 3.7Å; V42-F97 HydrophobicContact CG2-CE2 3.89Å; V42-F97 HydrophobicContact CG2-CG 3.73Å; V42-F97 HydrophobicContact CG2-CZ 3.8Å; H47-F97 HydrophobicContact CB-CE1 4.07Å; H47-F97 AromaticContact CD2-CD1 3.4Å; H47-F97 VanDerWaalsContact CD2-CD1 3.4Å; H47-F97 WeakPolarHBondContact CD2-CD1 3.43Å; H47-F97 AromaticContact CD2-CE1 3.58Å; H47-F97 AromaticContact CG-CD1 3.95Å; H47-F97 AromaticContact CG-CE1 3.86Å; H47-F97 AromaticContact NE2-CD1 3.59Å; L62-F97 HydrophobicContact CD1-CE2 3.84Å; L62-F97 HydrophobicContact CD1-CZ 3.88Å; H93-F97 PolarHBondContact O-N 3.11Å; P94-F97 PolarHBondContact O-N 3.38Å; G95-F97 VanDerWaalsContact C-N 3.3Å; G95-F97 PolarHBondContact O-N 3.27Å; F97-I100 HydrophobicContact CD2-CB 4.35Å; F97-I100 HydrophobicContact CD2-CG2 4.28Å; F97-I100 HydrophobicContact CE2-CG2 4.41Å; F97-I100 PolarHBondContact O-N 3.39Å; F97-L101 HydrophobicContact CD1-CB 4.33Å; F97-L101 HydrophobicContact CE1-CB 4.08Å; F97-L101 HydrophobicContact CE1-CD2 4.06Å; F97-L101 HydrophobicContact CZ-CB 4.47Å; F97-L101 VanDerWaalsContact O-CB 3.24Å; F97-L101 WeakPolarHBondContact O-CB 3.33Å; F97-L101 PolarHBondContact O-N 2.9Å; F97-W127 HydrophobicContact CD2-CD2 4.26Å; F97-W127 AromaticContact CD2-CE2 3.64Å; F97-W127 AromaticContact CD2-CH2 3.74Å; F97-W127 HydrophobicContact CD2-CH2 3.74Å; F97-W127 AromaticContact CD2-CZ2 3.37Å; F97-W127 HydrophobicContact CD2-CZ2 3.37Å; F97-W127 HydrophobicContact CD2-CZ3 4.32Å; F97-W127 HydrophobicContact CE2-CD2 4.31Å; F97-W127 HydrophobicContact CE2-CE3 4.18Å; F97-W127 AromaticContact CE2-CH2 3.58Å; F97-W127 HydrophobicContact CE2-CH2 3.58Å; F97-W127 AromaticContact CE2-CZ2 3.73Å; F97-W127 HydrophobicContact CE2-CZ2 3.73Å; F97-W127 AromaticContact CE2-CZ3 3.83Å; F97-W127 HydrophobicContact CE2-CZ3 3.83Å; F97-W127 HydrophobicContact CG-CZ2 4.41Å
98	T	92.1	Very high	93	Very high	47 Å²	47	40.5 Å²	40.5	29%	0.288	21%	0.211	S	C	.	.	H	α-helix	trans	-64.3	-42.7	175.7	-64	0	0	0	0	111.9	P94 G95 A96 N102	P94-T98 PolarHBondContact O-N 3.31Å; P94-T98 PolarHBondContact O-OG1 3.13Å; G95-T98 WeakPolarHBondContact O-CB 3.38Å; G95-T98 PolarHBondContact O-N 3.5Å; A96-T98 PolarHBondContact O-N 3.21Å; A96-T98 VanDerWaalsContact O-N 3.14Å; T98-N102 WeakPolarHBondContact O-CB 3.44Å; T98-N102 PolarHBondContact O-N 3.15Å; T98-N102 PolarHBondContact O-ND2 3.05Å
99	S	93.5	Very high	93	Very high	13 Å²	13	40.5 Å²	40.5	9%	0.091	21%	0.211	C	C	.	.	H	α-helix	trans	-64.7	-45.5	171.5	-83.2	0	0	0	0	112.1	A96 L101 N102 F103 H110	A96-S99 PolarHBondContact O-N 3.48Å; A96-S99 VanDerWaalsContact O-N 3.1Å; S99-L101 PolarHBondContact O-N 3.27Å; S99-N102 PolarHBondContact O-N 3.07Å; S99-F103 PolarHBondContact O-N 2.83Å; S99-F103 VanDerWaalsContact O-N 3.1Å; S99-H110 VanDerWaalsContact CB-O 3.24Å; S99-H110 WeakPolarHBondContact CB-O 3.31Å; S99-H110 PolarHBondContact OG-O 3.03Å
100	I	95.3	Very high	92.9	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-57.5	-50.4	178.8	-61.4	-69.6	0	0	0	110.6	A96 F97 N102 F103 Y104 L124 W127 I129	A96-I100 WeakPolarHBondContact O-CG1 3.27Å; A96-I100 PolarHBondContact O-N 3.2Å; F97-I100 HydrophobicContact CD2-CB 4.35Å; F97-I100 HydrophobicContact CD2-CG2 4.28Å; F97-I100 HydrophobicContact CE2-CG2 4.41Å; F97-I100 PolarHBondContact O-N 3.39Å; I100-N102 VanDerWaalsContact C-N 3.34Å; I100-N102 PolarHBondContact O-N 3.5Å; I100-F103 WeakPolarHBondContact O-CB 3.5Å; I100-F103 PolarHBondContact O-N 3.05Å; I100-Y104 HydrophobicContact CG2-CE2 3.92Å; I100-Y104 WeakPolarHBondContact O-CD2 3.32Å; I100-L124 HydrophobicContact CD1-CD2 3.61Å; I100-L124 HydrophobicContact CD1-CG 4.41Å; I100-W127 HydrophobicContact CD1-CB 4.39Å; I100-W127 HydrophobicContact CD1-CG 4.32Å; I100-W127 HydrophobicContact CG1-CG 4.3Å; I100-W127 HydrophobicContact CG2-CB 4.1Å; I100-W127 HydrophobicContact CG2-CD2 4.27Å; I100-W127 HydrophobicContact CG2-CG 3.83Å; I100-I129 HydrophobicContact CD1-CD1 3.98Å; I100-I129 HydrophobicContact CG2-CD1 3.8Å
101	L	94.3	Very high	92.6	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-66.8	-34.8	-180	176.4	55.3	0	0	0	112.4	H47 V49 F97 S99 F103 Y104 R105	H47-L101 HydrophobicContact CB-CD2 3.82Å; V49-L101 HydrophobicContact CG1-CD1 3.54Å; V49-L101 HydrophobicContact CG1-CD2 3.89Å; V49-L101 HydrophobicContact CG1-CG 4.36Å; F97-L101 HydrophobicContact CD1-CB 4.33Å; F97-L101 HydrophobicContact CE1-CB 4.08Å; F97-L101 HydrophobicContact CE1-CD2 4.06Å; F97-L101 HydrophobicContact CZ-CB 4.47Å; F97-L101 VanDerWaalsContact O-CB 3.24Å; F97-L101 WeakPolarHBondContact O-CB 3.33Å; F97-L101 PolarHBondContact O-N 2.9Å; S99-L101 PolarHBondContact O-N 3.27Å; L101-F103 VanDerWaalsContact C-N 3.3Å; L101-F103 PolarHBondContact O-N 3.42Å; L101-Y104 PolarHBondContact O-N 2.88Å; L101-R105 WeakPolarHBondContact O-CG 3.32Å; L101-R105 PolarHBondContact O-N 3.21Å
102	N	93.3	Very high	92.3	Very high	63 Å²	63	38.7 Å²	38.7	34%	0.337	20%	0.2	S	C	.	.	H	α-helix	trans	-64.6	-34.3	174.6	-75.3	-17.6	0	0	0	112	T98 S99 I100 Y104 R105 T106	T98-N102 WeakPolarHBondContact O-CB 3.44Å; T98-N102 PolarHBondContact O-N 3.15Å; T98-N102 PolarHBondContact O-ND2 3.05Å; S99-N102 PolarHBondContact O-N 3.07Å; I100-N102 VanDerWaalsContact C-N 3.34Å; I100-N102 PolarHBondContact O-N 3.5Å; N102-Y104 PolarHBondContact O-N 3.36Å; N102-R105 CarbonylContact O-C 3.54Å; N102-R105 WeakPolarHBondContact O-CA 3.27Å; N102-R105 WeakPolarHBondContact O-CB 3.37Å; N102-R105 PolarHBondContact O-N 3.02Å; N102-R105 WeakPolarHBondContact OD1-CD 3.25Å; N102-R105 PolarHBondContact OD1-NH1 3.28Å; N102-T106 PolarHBondContact O-N 2.76Å; N102-T106 PolarHBondContact O-OG1 2.76Å
103	F	95.4	Very high	91.8	Very high	10 Å²	10	41.6 Å²	41.6	4%	0.044	22%	0.217	C	C	.	.	H	α-helix	trans	-58.6	-43.2	172.3	176.8	-129.9	0	0	0	112.8	L57 S99 I100 L101 R105 G107 L109 I129 Y133	L57-F103 HydrophobicContact CD1-CD1 3.55Å; L57-F103 HydrophobicContact CD1-CE1 3.34Å; L57-F103 HydrophobicContact CD1-CG 4.36Å; L57-F103 HydrophobicContact CD1-CZ 4Å; L57-F103 HydrophobicContact CD2-CE1 4.28Å; L57-F103 HydrophobicContact CD2-CZ 4.28Å; L57-F103 HydrophobicContact CG-CE1 4.47Å; S99-F103 PolarHBondContact O-N 2.83Å; S99-F103 VanDerWaalsContact O-N 3.1Å; I100-F103 WeakPolarHBondContact O-CB 3.5Å; I100-F103 PolarHBondContact O-N 3.05Å; L101-F103 VanDerWaalsContact C-N 3.3Å; L101-F103 PolarHBondContact O-N 3.42Å; F103-R105 PolarHBondContact O-N 3.23Å; F103-G107 WeakPolarHBondContact CE2-O 3.35Å; F103-G107 VanDerWaalsContact O-CA 3.3Å; F103-G107 WeakPolarHBondContact O-CA 3.42Å; F103-G107 PolarHBondContact O-N 2.89Å; F103-L109 HydrophobicContact CB-CB 4.22Å; F103-L109 HydrophobicContact CB-CD1 3.9Å; F103-L109 HydrophobicContact CD2-CB 3.8Å; F103-L109 HydrophobicContact CE2-CB 4.3Å; F103-L109 HydrophobicContact CG-CB 4Å; F103-L109 HydrophobicContact CG-CD1 4.24Å; F103-I129 HydrophobicContact CD1-CD1 3.97Å; F103-I129 HydrophobicContact CD1-CG1 4.33Å; F103-I129 HydrophobicContact CD1-CG2 4.04Å; F103-I129 HydrophobicContact CE1-CD1 4.39Å; F103-I129 HydrophobicContact CE1-CG1 4.25Å; F103-I129 HydrophobicContact CE1-CG2 3.69Å; F103-Y133 HydrophobicContact CE1-CD2 4.42Å; F103-Y133 HydrophobicContact CE1-CG 4.32Å; F103-Y133 HydrophobicContact CE2-CD1 4.49Å; F103-Y133 HydrophobicContact CE2-CG 4.36Å; F103-Y133 AromaticContact CZ-CD1 3.9Å; F103-Y133 HydrophobicContact CZ-CD1 3.9Å; F103-Y133 HydrophobicContact CZ-CD2 4.1Å; F103-Y133 AromaticContact CZ-CG 3.61Å; F103-Y133 HydrophobicContact CZ-CG 3.61Å
104	Y	94.1	Very high	91.5	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.008	22%	0.217	C	C	.	.	H	α-helix	trans	-64.9	-25.9	172.6	-62.8	-102.9	0	0	0	112.9	L54 R56 L57 T60 L62 I100 L101 N102 I129	L54-Y104 HydrophobicContact CD2-CD1 4.34Å; R56-Y104 WeakPolarHBondContact CD-O 3.38Å; R56-Y104 PolarHBondContact NH1-O 2.98Å; L57-Y104 HydrophobicContact CB-CD1 4.13Å; L57-Y104 HydrophobicContact CB-CE1 3.81Å; L57-Y104 HydrophobicContact CD1-CD1 3.8Å; L57-Y104 HydrophobicContact CD1-CD2 4.44Å; L57-Y104 HydrophobicContact CD1-CE1 3.87Å; L57-Y104 HydrophobicContact CD1-CE2 4.46Å; L57-Y104 HydrophobicContact CD1-CG 4.09Å; L57-Y104 HydrophobicContact CG-CD1 4.27Å; L57-Y104 HydrophobicContact CG-CE1 4.35Å; T60-Y104 WeakPolarHBondContact CB-OH 3.35Å; T60-Y104 PolarHBondContact OG1-OH 3.23Å; L62-Y104 HydrophobicContact CB-CE1 4.05Å; L62-Y104 HydrophobicContact CD1-CD2 4.44Å; L62-Y104 HydrophobicContact CD1-CE2 3.87Å; I100-Y104 HydrophobicContact CG2-CE2 3.92Å; I100-Y104 WeakPolarHBondContact O-CD2 3.32Å; L101-Y104 PolarHBondContact O-N 2.88Å; N102-Y104 PolarHBondContact O-N 3.36Å; Y104-I129 HydrophobicContact CE2-CD1 4.1Å
105	R	93.6	Very high	91.3	Very high	120 Å²	120	41.7 Å²	41.7	45%	0.453	22%	0.216	S	C	.	.	H	α-helix	trans	-82.8	-41	-179.3	-69.2	165.5	169	168.7	-5.4	112.8	T53 R56 L101 N102 F103	T53-R105 HydrophobicContact CG2-CG 4.43Å; R56-R105 VanDerWaalsContact NH1-C 3.31Å; R56-R105 PolarHBondContact NH1-O 3Å; L101-R105 WeakPolarHBondContact O-CG 3.32Å; L101-R105 PolarHBondContact O-N 3.21Å; N102-R105 CarbonylContact O-C 3.54Å; N102-R105 WeakPolarHBondContact O-CA 3.27Å; N102-R105 WeakPolarHBondContact O-CB 3.37Å; N102-R105 PolarHBondContact O-N 3.02Å; N102-R105 WeakPolarHBondContact OD1-CD 3.25Å; N102-R105 PolarHBondContact OD1-NH1 3.28Å; F103-R105 PolarHBondContact O-N 3.23Å
106	T	92.6	Very high	91.3	Very high	90 Å²	90	44.4 Å²	44.4	55%	0.552	23%	0.234	S	C	*	.	H	α-helix	trans	-107.1	-23.1	-172.1	61.3	0	0	0	0	114.2	N102 K108	N102-T106 PolarHBondContact O-N 2.76Å; N102-T106 PolarHBondContact O-OG1 2.76Å; T106-K108 PolarHBondContact OG1-N 3.03Å; T106-K108 PolarHBondContact OG1-O 3.35Å
107	G	91	Very high	91.2	Very high	51 Å²	51	44.5 Å²	44.5	53%	0.526	24%	0.235	S	C	.	.	S	Bend	trans	77.3	3.5	-164.9	0	0	0	0	0	114.2	F103	F103-G107 WeakPolarHBondContact CE2-O 3.35Å; F103-G107 VanDerWaalsContact O-CA 3.3Å; F103-G107 WeakPolarHBondContact O-CA 3.42Å; F103-G107 PolarHBondContact O-N 2.89Å
108	K	91.9	Very high	91	Very high	97 Å²	97	46.1 Å²	46.1	42%	0.422	24%	0.243	S	C	.	.			trans	-117.7	123.1	-178	-61.5	-165.8	157.6	-74.4	0	111	T106 E135	T106-K108 PolarHBondContact OG1-N 3.03Å; T106-K108 PolarHBondContact OG1-O 3.35Å; K108-E135 HydrophobicContact CB-CG 3.97Å; K108-E135 HydrophobicContact CG-CG 4.42Å; K108-E135 VanDerWaalsContact CG-OE1 3.28Å; K108-E135 WeakPolarHBondContact CG-OE1 3.4Å; K108-E135 IonicContact NZ-OE1 2.78Å; K108-E135 PolarHBondContact NZ-OE1 3.48Å; K108-E135 IonicContact NZ-OE2 2.93Å; K108-E135 PolarHBondContact NZ-OE2 3.02Å
109	L	94.9	Very high	90.8	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-97.8	131.2	177.4	-178.2	70.1	0	0	0	110.1	F103 F120 L124 I129 Y133 L134 E135	F103-L109 HydrophobicContact CB-CB 4.22Å; F103-L109 HydrophobicContact CB-CD1 3.9Å; F103-L109 HydrophobicContact CD2-CB 3.8Å; F103-L109 HydrophobicContact CE2-CB 4.3Å; F103-L109 HydrophobicContact CG-CB 4Å; F103-L109 HydrophobicContact CG-CD1 4.24Å; L109-F120 HydrophobicContact CD1-CZ 4.19Å; L109-L124 HydrophobicContact CD1-CD2 4.15Å; L109-L124 HydrophobicContact CD2-CD1 4.47Å; L109-L124 HydrophobicContact CD2-CD2 3.66Å; L109-I129 HydrophobicContact CD2-CG2 4.15Å; L109-Y133 WeakPolarHBondContact CB-O 3.48Å; L109-L134 HydrophobicContact CD2-CB 4.26Å; L109-L134 HydrophobicContact CD2-CD1 4.16Å; L109-L134 HydrophobicContact CG-CD1 3.97Å; L109-E135 WeakPolarHBondContact O-CB 3.28Å; L109-E135 WeakPolarHBondContact O-CG 3.49Å; L109-E135 PolarHBondContact O-N 3.21Å
110	H	93.2	Very high	90.8	Very high	72 Å²	72	45.4 Å²	45.4	33%	0.333	24%	0.24	S	C	.	.			trans	-134.9	140.9	176.3	-63.3	-76.6	0	0	0	110.6	S99 E135 C137 C138	S99-H110 VanDerWaalsContact CB-O 3.24Å; S99-H110 WeakPolarHBondContact CB-O 3.31Å; S99-H110 PolarHBondContact OG-O 3.03Å; H110-E135 VanDerWaalsContact CE1-CB 3.48Å; H110-E135 WeakPolarHBondContact CE1-CB 3.2Å; H110-C137 VanDerWaalsContact CE1-SG 3.6Å; H110-C138 PolarHBondContact ND1-SG 3.05Å
111	M	90.8	Very high	90.6	Very high	16 Å²	16	45.6 Å²	45.6	8%	0.079	24%	0.242	C	C	.	.			trans	-85.5	139.8	173.1	-179.5	-176.3	58.4	0	0	110.2	M115 A117 F120 L134 C138 R141 Y142	M111-M115 HydrophobicContact CG-CB 4.48Å; M111-A117 HydrophobicContact SD-CB 4.46Å; M111-F120 HydrophobicContact CB-CD1 3.9Å; M111-F120 HydrophobicContact CB-CE1 3.69Å; M111-F120 HydrophobicContact CB-CZ 4.3Å; M111-F120 HydrophobicContact CG-CD1 3.74Å; M111-F120 HydrophobicContact CG-CE1 4.06Å; M111-F120 HydrophobicContact CG-CG 4.12Å; M111-F120 HydrophobicContact SD-CD1 4.26Å; M111-L134 HydrophobicContact CB-CD1 4.5Å; M111-C138 HydrophobicContact CB-CB 4.48Å; M111-R141 HydrophobicContact CE-CG 3.96Å; M111-Y142 HydrophobicContact SD-CD2 3.7Å
112	M	87.6	Confident	90.5	Very high	58 Å²	58	51.5 Å²	51.5	29%	0.286	27%	0.269	S	S	.	.			trans	-71.6	145.5	173.8	-67.2	177.5	67	0	0	112.5	E114 M115	M112-E114 PolarHBondContact O-N 3Å; M112-M115 HydrophobicContact CB-CB 4.3Å; M112-M115 HydrophobicContact CB-CE 4.24Å; M112-M115 HydrophobicContact CG-CE 4.43Å; M112-M115 PolarHBondContact O-N 3.29Å; M112-M115 HydrophobicContact SD-CE 3.81Å
113	E	80.8	Confident	90.5	Very high	127 Å²	127	48.9 Å²	48.9	59%	0.593	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.6	-56.7	-177	-174	63.8	-131.6	0	0	113.4	M115 R141	E113-M115 VanDerWaalsContact C-N 3.34Å; E113-M115 PolarHBondContact O-N 3.12Å; E113-R141 VanDerWaalsContact CD-NH1 3.26Å; E113-R141 PolarHBondContact O-NH2 2.69Å; E113-R141 IonicContact OE1-CZ 2.92Å; E113-R141 IonicContact OE1-NH1 2.86Å; E113-R141 PolarHBondContact OE1-NH1 2.87Å; E113-R141 IonicContact OE1-NH2 2.88Å; E113-R141 PolarHBondContact OE1-NH2 3.28Å; E113-R141 IonicContact OE2-CZ 3.98Å; E113-R141 IonicContact OE2-NH1 3.91Å; E113-R141 PolarHBondContact OE2-NH1 2.97Å; E113-R141 IonicContact OE2-NH2 2.64Å
114	E	83.1	Confident	90.4	Very high	87 Å²	87	48.4 Å²	48.4	41%	0.407	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-10.8	-173.2	-69	160.5	-149.1	0	0	114.2	M112	M112-E114 PolarHBondContact O-N 3Å
115	M	86.1	Confident	90.4	Very high	21 Å²	21	53.9 Å²	53.9	10%	0.103	28%	0.283	C	S	.	.			trans	-76.1	135.9	-167.4	-156.9	159.4	-71.8	0	0	112.7	A96 M111 M112 E113 A117 F120	A96-M115 HydrophobicContact CB-CE 4.07Å; A96-M115 HydrophobicContact CB-SD 3.83Å; M111-M115 HydrophobicContact CG-CB 4.48Å; M112-M115 HydrophobicContact CB-CB 4.3Å; M112-M115 HydrophobicContact CB-CE 4.24Å; M112-M115 HydrophobicContact CG-CE 4.43Å; M112-M115 PolarHBondContact O-N 3.29Å; M112-M115 HydrophobicContact SD-CE 3.81Å; E113-M115 VanDerWaalsContact C-N 3.34Å; E113-M115 PolarHBondContact O-N 3.12Å; M115-A117 PolarHBondContact O-N 2.98Å; M115-F120 HydrophobicContact CG-CB 4.18Å; M115-F120 HydrophobicContact SD-CB 4.06Å; M115-F120 HydrophobicContact SD-CD2 3.6Å; M115-F120 VanDerWaalsContact SD-CD2 3.6Å; M115-F120 HydrophobicContact SD-CE2 4.46Å; M115-F120 HydrophobicContact SD-CG 4.18Å
116	C	87.9	Confident	90.4	Very high	58 Å²	58	49.9 Å²	49.9	39%	0.392	27%	0.268	S	S	.	.			trans	-61.5	120.4	168.1	169.1	0	0	0	0	109.7	L118 S119 F120 M149	C116-L118 VanDerWaalsContact C-N 3.31Å; C116-L118 PolarHBondContact O-N 2.98Å; C116-S119 WeakPolarHBondContact O-CB 3.45Å; C116-S119 PolarHBondContact O-N 3.02Å; C116-F120 PolarHBondContact O-N 2.93Å; C116-M149 WeakPolarHBondContact SG-CE 3.5Å
117	A	90	Very high	90.5	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.008	24%	0.241	C	C	.	.	H	α-helix	trans	-58.9	-39.8	-176.5	0	0	0	0	0	112.7	M111 M115 S119 F120 G121 Y142 K145 K146	M111-A117 HydrophobicContact SD-CB 4.46Å; M115-A117 PolarHBondContact O-N 2.98Å; A117-S119 PolarHBondContact O-N 3.4Å; A117-F120 PolarHBondContact O-N 3.03Å; A117-G121 PolarHBondContact O-N 3.23Å; A117-Y142 HydrophobicContact CB-CD2 4.01Å; A117-Y142 HydrophobicContact CB-CE2 4.08Å; A117-Y142 VanDerWaalsContact O-CE2 3.3Å; A117-Y142 WeakPolarHBondContact O-CE2 3.34Å; A117-K145 HydrophobicContact CB-CB 3.78Å; A117-K146 HydrophobicContact CB-CB 4.24Å
118	L	88.7	Confident	90.5	Very high	35 Å²	35	45.2 Å²	45.2	18%	0.183	24%	0.238	C	C	.	.	H	α-helix	trans	-65.7	-36.9	175.2	-64.6	176.6	0	0	0	112.6	C116 G121 Q122 K146 M149 N150 L153	C116-L118 VanDerWaalsContact C-N 3.31Å; C116-L118 PolarHBondContact O-N 2.98Å; L118-G121 PolarHBondContact O-N 2.68Å; L118-Q122 WeakPolarHBondContact O-CG 3.26Å; L118-Q122 PolarHBondContact O-N 2.8Å; L118-K146 HydrophobicContact CD2-CG 3.98Å; L118-M149 HydrophobicContact CB-CE 4.3Å; L118-M149 HydrophobicContact CD1-CB 4.2Å; L118-M149 HydrophobicContact CD1-CE 4.11Å; L118-M149 HydrophobicContact CD1-CG 3.75Å; L118-M149 HydrophobicContact CD1-SD 4.37Å; L118-M149 HydrophobicContact CG-CE 3.93Å; L118-M149 HydrophobicContact CG-CG 4.47Å; L118-N150 VanDerWaalsContact CD2-OD1 3.26Å; L118-N150 WeakPolarHBondContact CD2-OD1 3.35Å; L118-L153 HydrophobicContact CD1-CD2 4.41Å
119	S	89.7	Confident	90.7	Very high	44 Å²	44	41 Å²	41	31%	0.308	22%	0.22	S	C	.	.	H	α-helix	trans	-68.6	-36.1	174.8	-172.5	0	0	0	0	111.9	C116 A117 E123	C116-S119 WeakPolarHBondContact O-CB 3.45Å; C116-S119 PolarHBondContact O-N 3.02Å; A117-S119 PolarHBondContact O-N 3.4Å; S119-E123 WeakPolarHBondContact O-CG 3.45Å; S119-E123 PolarHBondContact O-N 2.96Å
120	F	93	Very high	90.5	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-68.8	-38.8	175.5	-170.6	-121.6	0	0	0	111.4	L109 M111 M115 C116 A117 E123 L124 L134 Y142	L109-F120 HydrophobicContact CD1-CZ 4.19Å; M111-F120 HydrophobicContact CB-CD1 3.9Å; M111-F120 HydrophobicContact CB-CE1 3.69Å; M111-F120 HydrophobicContact CB-CZ 4.3Å; M111-F120 HydrophobicContact CG-CD1 3.74Å; M111-F120 HydrophobicContact CG-CE1 4.06Å; M111-F120 HydrophobicContact CG-CG 4.12Å; M111-F120 HydrophobicContact SD-CD1 4.26Å; M115-F120 HydrophobicContact CG-CB 4.18Å; M115-F120 HydrophobicContact SD-CB 4.06Å; M115-F120 HydrophobicContact SD-CD2 3.6Å; M115-F120 VanDerWaalsContact SD-CD2 3.6Å; M115-F120 HydrophobicContact SD-CE2 4.46Å; M115-F120 HydrophobicContact SD-CG 4.18Å; C116-F120 PolarHBondContact O-N 2.93Å; A117-F120 PolarHBondContact O-N 3.03Å; F120-E123 PolarHBondContact O-N 3.01Å; F120-L124 HydrophobicContact CD1-CD1 3.91Å; F120-L124 HydrophobicContact CD1-CG 4.46Å; F120-L124 HydrophobicContact CE1-CD1 3.81Å; F120-L124 HydrophobicContact CE1-CD2 4.5Å; F120-L124 HydrophobicContact CE1-CG 4.3Å; F120-L124 HydrophobicContact CZ-CD1 4.4Å; F120-L124 HydrophobicContact CZ-CD2 4.32Å; F120-L124 HydrophobicContact CZ-CG 4.44Å; F120-L124 WeakPolarHBondContact O-CG 3.37Å; F120-L124 PolarHBondContact O-N 3.42Å; F120-L134 HydrophobicContact CE1-CD1 4.26Å; F120-Y142 HydrophobicContact CB-CE2 4.39Å; F120-Y142 HydrophobicContact CD1-CD2 4.11Å; F120-Y142 AromaticContact CD1-CE2 3.91Å; F120-Y142 HydrophobicContact CD1-CE2 3.91Å
121	G	91.4	Very high	90.4	Very high	4 Å²	4	43.3 Å²	43.3	4%	0.041	23%	0.234	C	C	.	.	H	α-helix	trans	-58	-49.7	170.6	0	0	0	0	0	112.8	A117 L118 E123 L124 D125 Y142	A117-G121 PolarHBondContact O-N 3.23Å; L118-G121 PolarHBondContact O-N 2.68Å; G121-E123 PolarHBondContact O-N 3.44Å; G121-E123 VanDerWaalsContact O-N 3.14Å; G121-L124 WeakPolarHBondContact O-CB 3.12Å; G121-L124 PolarHBondContact O-N 3Å; G121-D125 PolarHBondContact O-N 2.87Å; G121-Y142 WeakPolarHBondContact CA-OH 3.18Å
122	Q	91.3	Very high	90.3	Very high	125 Å²	125	48 Å²	48	58%	0.584	26%	0.258	S	S	*	.	H	α-helix	trans	-61.7	-22.6	177.2	-71.4	171.9	6.3	0	0	114.3	R92 L118 Y126	R92-Q122 PolarHBondContact NH2-O 3.41Å; L118-Q122 WeakPolarHBondContact O-CG 3.26Å; L118-Q122 PolarHBondContact O-N 2.8Å; Q122-Y126 WeakPolarHBondContact O-CB 3.49Å; Q122-Y126 PolarHBondContact O-N 3.34Å
123	E	93.9	Very high	90.5	Very high	9 Å²	9	51.1 Å²	51.1	4%	0.042	27%	0.267	C	S	.	.	H	α-helix	trans	-80.4	-47.3	169.8	-74.3	-73.4	127.1	0	0	111.1	R92 A96 S119 F120 G121 D125 Y126 W127	R92-E123 IonicContact CZ-OE1 3.21Å; R92-E123 IonicContact NE-OE1 2.68Å; R92-E123 PolarHBondContact NE-OE1 3.28Å; R92-E123 IonicContact NH2-OE1 3.93Å; R92-E123 PolarHBondContact NH2-OE1 3.43Å; A96-E123 HydrophobicContact CB-CB 4.04Å; A96-E123 HydrophobicContact CB-CG 3.6Å; S119-E123 WeakPolarHBondContact O-CG 3.45Å; S119-E123 PolarHBondContact O-N 2.96Å; F120-E123 PolarHBondContact O-N 3.01Å; G121-E123 PolarHBondContact O-N 3.44Å; G121-E123 VanDerWaalsContact O-N 3.14Å; E123-D125 VanDerWaalsContact C-N 3.33Å; E123-D125 PolarHBondContact O-N 3.45Å; E123-Y126 PolarHBondContact O-N 2.92Å; E123-Y126 VanDerWaalsContact O-N 3.13Å; E123-W127 PolarHBondContact O-N 2.74Å; E123-W127 PolarHBondContact OE2-NE1 3.07Å
124	L	93.4	Very high	91.1	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-53.9	-48.1	174.8	-70.6	171.4	0	0	0	111.7	I100 L109 F120 G121 Y126 W127 G128 I129 E131	I100-L124 HydrophobicContact CD1-CD2 3.61Å; I100-L124 HydrophobicContact CD1-CG 4.41Å; L109-L124 HydrophobicContact CD1-CD2 4.15Å; L109-L124 HydrophobicContact CD2-CD1 4.47Å; L109-L124 HydrophobicContact CD2-CD2 3.66Å; F120-L124 HydrophobicContact CD1-CD1 3.91Å; F120-L124 HydrophobicContact CD1-CG 4.46Å; F120-L124 HydrophobicContact CE1-CD1 3.81Å; F120-L124 HydrophobicContact CE1-CD2 4.5Å; F120-L124 HydrophobicContact CE1-CG 4.3Å; F120-L124 HydrophobicContact CZ-CD1 4.4Å; F120-L124 HydrophobicContact CZ-CD2 4.32Å; F120-L124 HydrophobicContact CZ-CG 4.44Å; F120-L124 WeakPolarHBondContact O-CG 3.37Å; F120-L124 PolarHBondContact O-N 3.42Å; G121-L124 WeakPolarHBondContact O-CB 3.12Å; G121-L124 PolarHBondContact O-N 3Å; L124-Y126 PolarHBondContact O-N 2.78Å; L124-W127 PolarHBondContact O-N 2.85Å; L124-G128 PolarHBondContact O-N 3.09Å; L124-I129 CarbonylContact C-O 3.52Å; L124-I129 HydrophobicContact CD2-CB 4.05Å; L124-I129 HydrophobicContact CD2-CG2 3.82Å; L124-I129 PolarHBondContact O-N 3.34Å; L124-E131 HydrophobicContact CD1-CG 4.26Å
125	D	93.5	Very high	91.7	Very high	117 Å²	117	43.6 Å²	43.6	63%	0.626	23%	0.232	S	C	*	.	H	α-helix	trans	-54.5	-50.1	173.5	-72.4	-35.5	0	0	0	111.9	G121 E123 G128	G121-D125 PolarHBondContact O-N 2.87Å; E123-D125 VanDerWaalsContact C-N 3.33Å; E123-D125 PolarHBondContact O-N 3.45Å; D125-G128 PolarHBondContact O-N 2.92Å; D125-G128 VanDerWaalsContact O-N 3.15Å
126	Y	93.8	Very high	91.9	Very high	35 Å²	35	47.2 Å²	47.2	14%	0.137	26%	0.259	C	S	.	.	H	α-helix	trans	-65.9	-42.1	-178.1	172.7	-93.9	0	0	0	112.4	R61 F90 R92 Q122 E123 L124 G128	R61-Y126 VanDerWaalsContact CD-CE1 3.5Å; R61-Y126 VanDerWaalsContact CZ-CE2 3.45Å; R61-Y126 PolarHBondContact NE-O 3.47Å; F90-Y126 HydrophobicContact CD1-CE1 4.49Å; R92-Y126 HydrophobicContact CG-CD1 4.03Å; R92-Y126 HydrophobicContact CG-CE1 3.53Å; R92-Y126 VanDerWaalsContact CZ-CG 3.41Å; R92-Y126 VanDerWaalsContact NH1-CG 3.34Å; Q122-Y126 WeakPolarHBondContact O-CB 3.49Å; Q122-Y126 PolarHBondContact O-N 3.34Å; E123-Y126 PolarHBondContact O-N 2.92Å; E123-Y126 VanDerWaalsContact O-N 3.13Å; L124-Y126 PolarHBondContact O-N 2.78Å; Y126-G128 PolarHBondContact O-N 2.95Å
127	W	94.6	Very high	92	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-74.4	-10.4	176.2	-63.7	113.4	0	0	0	112.4	V42 T60 R61 L62 F90 R92 F97 I100 E123 L124 I129	V42-W127 HydrophobicContact CG1-CZ2 4.11Å; V42-W127 HydrophobicContact CG2-CH2 4.25Å; T60-W127 WeakPolarHBondContact CB-O 3.06Å; R61-W127 HydrophobicContact CB-CE3 4.28Å; R61-W127 WeakPolarHBondContact CB-O 3.29Å; R61-W127 HydrophobicContact CG-CE3 4.4Å; R61-W127 PolarHBondContact N-O 3.39Å; L62-W127 HydrophobicContact CD2-CE3 4.14Å; L62-W127 HydrophobicContact CD2-CZ3 3.69Å; L62-W127 HydrophobicContact CG-CE3 4.02Å; L62-W127 HydrophobicContact CG-CZ3 4.08Å; F90-W127 HydrophobicContact CB-CH2 3.82Å; F90-W127 AromaticContact CD1-CH2 3.68Å; F90-W127 HydrophobicContact CD1-CH2 3.68Å; F90-W127 AromaticContact CD1-CZ3 3.78Å; F90-W127 HydrophobicContact CD1-CZ3 3.78Å; F90-W127 HydrophobicContact CD2-CH2 4.13Å; F90-W127 HydrophobicContact CE1-CH2 4.25Å; F90-W127 AromaticContact CE1-CZ3 3.91Å; F90-W127 HydrophobicContact CE1-CZ3 3.91Å; F90-W127 AromaticContact CG-CH2 3.61Å; F90-W127 HydrophobicContact CG-CH2 3.61Å; F90-W127 HydrophobicContact CG-CZ3 4.12Å; F90-W127 HydrophobicContact CZ-CZ3 4.38Å; R92-W127 HydrophobicContact CB-CZ2 4.13Å; R92-W127 HydrophobicContact CG-CZ2 4.18Å; F97-W127 HydrophobicContact CD2-CD2 4.26Å; F97-W127 AromaticContact CD2-CE2 3.64Å; F97-W127 AromaticContact CD2-CH2 3.74Å; F97-W127 HydrophobicContact CD2-CH2 3.74Å; F97-W127 AromaticContact CD2-CZ2 3.37Å; F97-W127 HydrophobicContact CD2-CZ2 3.37Å; F97-W127 HydrophobicContact CD2-CZ3 4.32Å; F97-W127 HydrophobicContact CE2-CD2 4.31Å; F97-W127 HydrophobicContact CE2-CE3 4.18Å; F97-W127 AromaticContact CE2-CH2 3.58Å; F97-W127 HydrophobicContact CE2-CH2 3.58Å; F97-W127 AromaticContact CE2-CZ2 3.73Å; F97-W127 HydrophobicContact CE2-CZ2 3.73Å; F97-W127 AromaticContact CE2-CZ3 3.83Å; F97-W127 HydrophobicContact CE2-CZ3 3.83Å; F97-W127 HydrophobicContact CG-CZ2 4.41Å; I100-W127 HydrophobicContact CD1-CB 4.39Å; I100-W127 HydrophobicContact CD1-CG 4.32Å; I100-W127 HydrophobicContact CG1-CG 4.3Å; I100-W127 HydrophobicContact CG2-CB 4.1Å; I100-W127 HydrophobicContact CG2-CD2 4.27Å; I100-W127 HydrophobicContact CG2-CG 3.83Å; E123-W127 PolarHBondContact O-N 2.74Å; E123-W127 PolarHBondContact OE2-NE1 3.07Å; L124-W127 PolarHBondContact O-N 2.85Å; W127-I129 HydrophobicContact CB-CD1 4.09Å
128	G	92.1	Very high	92.1	Very high	44 Å²	44	49.5 Å²	49.5	45%	0.454	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.5	38	178.4	0	0	0	0	0	112.9	T60 L124 D125 Y126	T60-G128 WeakPolarHBondContact CG2-O 3.46Å; L124-G128 PolarHBondContact O-N 3.09Å; D125-G128 PolarHBondContact O-N 2.92Å; D125-G128 VanDerWaalsContact O-N 3.15Å; Y126-G128 PolarHBondContact O-N 2.95Å
129	I	94.8	Very high	92.3	Very high	7 Å²	7	51.4 Å²	51.4	4%	0.036	28%	0.283	C	S	.	.			trans	-112.1	126.9	178.1	-66.5	160.3	0	0	0	108	T60 I100 F103 Y104 L109 L124 W127 Y133	T60-I129 HydrophobicContact CG2-CG1 3.76Å; I100-I129 HydrophobicContact CD1-CD1 3.98Å; I100-I129 HydrophobicContact CG2-CD1 3.8Å; F103-I129 HydrophobicContact CD1-CD1 3.97Å; F103-I129 HydrophobicContact CD1-CG1 4.33Å; F103-I129 HydrophobicContact CD1-CG2 4.04Å; F103-I129 HydrophobicContact CE1-CD1 4.39Å; F103-I129 HydrophobicContact CE1-CG1 4.25Å; F103-I129 HydrophobicContact CE1-CG2 3.69Å; Y104-I129 HydrophobicContact CE2-CD1 4.1Å; L109-I129 HydrophobicContact CD2-CG2 4.15Å; L124-I129 CarbonylContact C-O 3.52Å; L124-I129 HydrophobicContact CD2-CB 4.05Å; L124-I129 HydrophobicContact CD2-CG2 3.82Å; L124-I129 PolarHBondContact O-N 3.34Å; W127-I129 HydrophobicContact CB-CD1 4.09Å; I129-Y133 HydrophobicContact CG2-CD2 4.14Å
130	D	91.2	Very high	92.2	Very high	89 Å²	89	52.8 Å²	52.8	48%	0.476	30%	0.297	S	S	.	.			trans	-75.2	144	-179.7	-164.3	-39.4	0	0	0	111.5	I132 Y133	D130-I132 HydrophobicContact CB-CD1 4.29Å; D130-I132 HydrophobicContact CB-CG1 3.91Å; D130-I132 PolarHBondContact O-N 3.41Å; D130-I132 WeakPolarHBondContact OD1-CG2 3.21Å; D130-I132 PolarHBondContact OD1-N 3.16Å; D130-I132 VanDerWaalsContact OD1-N 3.13Å; D130-Y133 HydrophobicContact CB-CD2 3.89Å; D130-Y133 HydrophobicContact CB-CE2 3.86Å; D130-Y133 WeakPolarHBondContact O-CD2 3.45Å; D130-Y133 PolarHBondContact O-N 3.43Å
131	E	90.9	Very high	92.1	Very high	33 Å²	33	56.4 Å²	56.4	15%	0.154	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-63.1	-24	179.4	-59.6	-172.5	160.5	0	0	112.3	L124 Y133 L134 Y142 K146	L124-E131 HydrophobicContact CD1-CG 4.26Å; E131-Y133 PolarHBondContact O-N 2.78Å; E131-Y133 VanDerWaalsContact O-N 3.1Å; E131-L134 VanDerWaalsContact O-CB 3.24Å; E131-L134 WeakPolarHBondContact O-CB 3.34Å; E131-L134 PolarHBondContact O-N 3.39Å; E131-L134 VanDerWaalsContact O-N 3.08Å; E131-Y142 HydrophobicContact CG-CE1 4.23Å; E131-Y142 PolarHBondContact OE1-OH 2.95Å; E131-K146 IonicContact OE1-NZ 2.69Å; E131-K146 PolarHBondContact OE1-NZ 3.01Å; E131-K146 IonicContact OE2-NZ 3.1Å; E131-K146 PolarHBondContact OE2-NZ 3.2Å
132	I	89.3	Confident	92	Very high	115 Å²	115	56.3 Å²	56.3	59%	0.59	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-60.7	-17	175.4	68.8	-175.1	0	0	0	114.1	D130 L134	D130-I132 HydrophobicContact CB-CD1 4.29Å; D130-I132 HydrophobicContact CB-CG1 3.91Å; D130-I132 PolarHBondContact O-N 3.41Å; D130-I132 WeakPolarHBondContact OD1-CG2 3.21Å; D130-I132 PolarHBondContact OD1-N 3.16Å; D130-I132 VanDerWaalsContact OD1-N 3.13Å; I132-L134 VanDerWaalsContact C-N 3.29Å
133	Y	91.5	Very high	92	Very high	122 Å²	122	53.3 Å²	53.3	48%	0.478	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-81.1	-6.5	177.2	-67	-63.3	0	0	0	113.7	F103 L109 I129 D130 E131 E135	F103-Y133 HydrophobicContact CE1-CD2 4.42Å; F103-Y133 HydrophobicContact CE1-CG 4.32Å; F103-Y133 HydrophobicContact CE2-CD1 4.49Å; F103-Y133 HydrophobicContact CE2-CG 4.36Å; F103-Y133 AromaticContact CZ-CD1 3.9Å; F103-Y133 HydrophobicContact CZ-CD1 3.9Å; F103-Y133 HydrophobicContact CZ-CD2 4.1Å; F103-Y133 AromaticContact CZ-CG 3.61Å; F103-Y133 HydrophobicContact CZ-CG 3.61Å; L109-Y133 WeakPolarHBondContact CB-O 3.48Å; I129-Y133 HydrophobicContact CG2-CD2 4.14Å; D130-Y133 HydrophobicContact CB-CD2 3.89Å; D130-Y133 HydrophobicContact CB-CE2 3.86Å; D130-Y133 WeakPolarHBondContact O-CD2 3.45Å; D130-Y133 PolarHBondContact O-N 3.43Å; E131-Y133 PolarHBondContact O-N 2.78Å; E131-Y133 VanDerWaalsContact O-N 3.1Å; Y133-E135 PolarHBondContact O-N 3.15Å
134	L	93.8	Very high	91.8	Very high	4 Å²	4	59.4 Å²	59.4	2%	0.021	32%	0.324	C	S	.	.	B	Isolated β-bridge	trans	-71.3	123.8	-178.6	-170.5	62.7	0	0	0	111.2	L109 M111 F120 E131 I132 C138 Y142	L109-L134 HydrophobicContact CD2-CB 4.26Å; L109-L134 HydrophobicContact CD2-CD1 4.16Å; L109-L134 HydrophobicContact CG-CD1 3.97Å; M111-L134 HydrophobicContact CB-CD1 4.5Å; F120-L134 HydrophobicContact CE1-CD1 4.26Å; E131-L134 VanDerWaalsContact O-CB 3.24Å; E131-L134 WeakPolarHBondContact O-CB 3.34Å; E131-L134 PolarHBondContact O-N 3.39Å; E131-L134 VanDerWaalsContact O-N 3.08Å; I132-L134 VanDerWaalsContact C-N 3.29Å; L134-C138 HydrophobicContact CD1-CB 3.69Å; L134-C138 HydrophobicContact CD2-CB 4.27Å; L134-C138 HydrophobicContact CG-CB 3.86Å; L134-Y142 HydrophobicContact CD2-CD1 3.83Å; L134-Y142 HydrophobicContact CD2-CD2 4.24Å; L134-Y142 HydrophobicContact CD2-CG 3.55Å
135	E	94.2	Very high	91.5	Very high	53 Å²	53	62.9 Å²	62.9	25%	0.248	34%	0.339	C	S	.	.			trans	-62.2	147.3	-177.8	-70.5	-93.7	151.1	0	0	112.2	K108 L109 H110 Y133 C137 C138 Q139	K108-E135 HydrophobicContact CB-CG 3.97Å; K108-E135 HydrophobicContact CG-CG 4.42Å; K108-E135 VanDerWaalsContact CG-OE1 3.28Å; K108-E135 WeakPolarHBondContact CG-OE1 3.4Å; K108-E135 IonicContact NZ-OE1 2.78Å; K108-E135 PolarHBondContact NZ-OE1 3.48Å; K108-E135 IonicContact NZ-OE2 2.93Å; K108-E135 PolarHBondContact NZ-OE2 3.02Å; L109-E135 WeakPolarHBondContact O-CB 3.28Å; L109-E135 WeakPolarHBondContact O-CG 3.49Å; L109-E135 PolarHBondContact O-N 3.21Å; H110-E135 VanDerWaalsContact CE1-CB 3.48Å; H110-E135 WeakPolarHBondContact CE1-CB 3.2Å; Y133-E135 PolarHBondContact O-N 3.15Å; E135-C137 PolarHBondContact O-N 2.92Å; E135-C137 VanDerWaalsContact O-N 3.07Å; E135-C138 WeakPolarHBondContact O-CA 3.49Å; E135-C138 PolarHBondContact O-N 3.38Å; E135-Q139 PolarHBondContact O-N 3.14Å
136	S	91.3	Very high	91.2	Very high	96 Å²	96	59.9 Å²	59.9	67%	0.671	32%	0.32	S	S	*	.	H	α-helix	trans	-55.7	-32.7	-170.2	56.8	0	0	0	0	114.7	C138 Q139	S136-C138 VanDerWaalsContact C-N 3.26Å; S136-C138 PolarHBondContact O-N 3.37Å; S136-Q139 PolarHBondContact O-N 3.2Å
137	C	90.4	Very high	90.8	Very high	92 Å²	92	64.5 Å²	64.5	62%	0.622	34%	0.343	S	S	*	.	H	α-helix	trans	-66.7	-23.5	175.2	61.7	0	0	0	0	114	H110 E135	H110-C137 VanDerWaalsContact CE1-SG 3.6Å; E135-C137 PolarHBondContact O-N 2.92Å; E135-C137 VanDerWaalsContact O-N 3.07Å
138	C	91.3	Very high	90.2	Very high	15 Å²	15	70 Å²	70	10%	0.101	37%	0.368	C	S	.	.	H	α-helix	trans	-100.3	-29.8	173.8	-64.6	0	0	0	0	112.4	H110 M111 L134 E135 S136 R141 Y142	H110-C138 PolarHBondContact ND1-SG 3.05Å; M111-C138 HydrophobicContact CB-CB 4.48Å; L134-C138 HydrophobicContact CD1-CB 3.69Å; L134-C138 HydrophobicContact CD2-CB 4.27Å; L134-C138 HydrophobicContact CG-CB 3.86Å; E135-C138 WeakPolarHBondContact O-CA 3.49Å; E135-C138 PolarHBondContact O-N 3.38Å; S136-C138 VanDerWaalsContact C-N 3.26Å; S136-C138 PolarHBondContact O-N 3.37Å; C138-R141 PolarHBondContact O-N 3.17Å; C138-Y142 WeakPolarHBondContact O-CB 3.36Å; C138-Y142 PolarHBondContact O-N 3.27Å
139	Q	92.1	Very high	89.6	Confident	75 Å²	75	70.9 Å²	70.9	35%	0.35	36%	0.362	S	S	.	.	H	α-helix	trans	-57.6	-55.1	-170.3	-168.8	174.9	26.5	0	0	113	E135 S136 R141 Y142 H143	E135-Q139 PolarHBondContact O-N 3.14Å; S136-Q139 PolarHBondContact O-N 3.2Å; Q139-R141 VanDerWaalsContact C-N 3.35Å; Q139-R141 PolarHBondContact O-N 3.48Å; Q139-Y142 WeakPolarHBondContact O-CB 3.4Å; Q139-Y142 PolarHBondContact O-N 2.89Å; Q139-Y142 VanDerWaalsContact O-N 3.14Å; Q139-H143 PolarHBondContact O-CD2 3.16Å; Q139-H143 PolarHBondContact O-N 3.08Å
140	A	89.4	Confident	88.9	Confident	74 Å²	74	73.6 Å²	73.6	61%	0.612	38%	0.376	S	S	*	.	H	α-helix	trans	-59.6	-44.2	-179.9	0	0	0	0	0	112.3	Y142 Q144	A140-Y142 VanDerWaalsContact C-N 3.33Å; A140-Y142 PolarHBondContact O-N 2.66Å; A140-Q144 VanDerWaalsContact O-CB 3.24Å; A140-Q144 WeakPolarHBondContact O-CB 3.21Å; A140-Q144 PolarHBondContact O-N 3.08Å
141	R	89.2	Confident	88.2	Confident	76 Å²	76	72.9 Å²	72.9	29%	0.287	37%	0.37	S	S	.	.	H	α-helix	trans	-61.7	-38.2	176	175.6	-177.4	170	133.3	8.3	112.3	M111 E113 C138 Q139 K145	M111-R141 HydrophobicContact CE-CG 3.96Å; E113-R141 VanDerWaalsContact CD-NH1 3.26Å; E113-R141 PolarHBondContact O-NH2 2.69Å; E113-R141 IonicContact OE1-CZ 2.92Å; E113-R141 IonicContact OE1-NH1 2.86Å; E113-R141 PolarHBondContact OE1-NH1 2.87Å; E113-R141 IonicContact OE1-NH2 2.88Å; E113-R141 PolarHBondContact OE1-NH2 3.28Å; E113-R141 IonicContact OE2-CZ 3.98Å; E113-R141 IonicContact OE2-NH1 3.91Å; E113-R141 PolarHBondContact OE2-NH1 2.97Å; E113-R141 IonicContact OE2-NH2 2.64Å; C138-R141 PolarHBondContact O-N 3.17Å; Q139-R141 VanDerWaalsContact C-N 3.35Å; Q139-R141 PolarHBondContact O-N 3.48Å; R141-K145 WeakPolarHBondContact O-CB 3.19Å; R141-K145 WeakPolarHBondContact O-CG 3.29Å; R141-K145 PolarHBondContact O-N 2.91Å; R141-K145 VanDerWaalsContact O-N 3.13Å
142	Y	91.2	Very high	87.4	Confident	1 Å²	1	74 Å²	74	0%	0.004	38%	0.375	C	S	.	.	H	α-helix	trans	-68.3	-54.1	178.4	174.8	-99.7	0	0	0	111.5	M111 A117 F120 G121 E131 L134 C138 Q139 A140 Q144 K145 K146	M111-Y142 HydrophobicContact SD-CD2 3.7Å; A117-Y142 HydrophobicContact CB-CD2 4.01Å; A117-Y142 HydrophobicContact CB-CE2 4.08Å; A117-Y142 VanDerWaalsContact O-CE2 3.3Å; A117-Y142 WeakPolarHBondContact O-CE2 3.34Å; F120-Y142 HydrophobicContact CB-CE2 4.39Å; F120-Y142 HydrophobicContact CD1-CD2 4.11Å; F120-Y142 AromaticContact CD1-CE2 3.91Å; F120-Y142 HydrophobicContact CD1-CE2 3.91Å; G121-Y142 WeakPolarHBondContact CA-OH 3.18Å; E131-Y142 HydrophobicContact CG-CE1 4.23Å; E131-Y142 PolarHBondContact OE1-OH 2.95Å; L134-Y142 HydrophobicContact CD2-CD1 3.83Å; L134-Y142 HydrophobicContact CD2-CD2 4.24Å; L134-Y142 HydrophobicContact CD2-CG 3.55Å; C138-Y142 WeakPolarHBondContact O-CB 3.36Å; C138-Y142 PolarHBondContact O-N 3.27Å; Q139-Y142 WeakPolarHBondContact O-CB 3.4Å; Q139-Y142 PolarHBondContact O-N 2.89Å; Q139-Y142 VanDerWaalsContact O-N 3.14Å; A140-Y142 VanDerWaalsContact C-N 3.33Å; A140-Y142 PolarHBondContact O-N 2.66Å; Y142-Q144 PolarHBondContact O-N 3.19Å; Y142-K145 PolarHBondContact O-N 2.9Å; Y142-K146 HydrophobicContact CE1-CD 3.73Å; Y142-K146 WeakPolarHBondContact O-CB 3.45Å; Y142-K146 PolarHBondContact O-N 3.1Å
143	H	90.3	Very high	86.5	Confident	62 Å²	62	71.6 Å²	71.6	29%	0.287	36%	0.363	S	S	.	.	H	α-helix	trans	-60.9	-45.2	179.2	-70.7	-72.7	0	0	0	111.2	Q139 K145 K146 E147	Q139-H143 PolarHBondContact O-CD2 3.16Å; Q139-H143 PolarHBondContact O-N 3.08Å; H143-K145 PolarHBondContact O-N 3.31Å; H143-K146 PolarHBondContact O-N 3.23Å; H143-K146 VanDerWaalsContact O-N 3.16Å; H143-E147 WeakPolarHBondContact O-CB 3.44Å; H143-E147 WeakPolarHBondContact O-CG 3.34Å; H143-E147 PolarHBondContact O-N 3.2Å
144	Q	88.9	Confident	85.7	Confident	137 Å²	137	71.9 Å²	71.9	64%	0.64	36%	0.364	S	S	*	.	H	α-helix	trans	-58.2	-46.4	176.7	-171.5	-176.3	25.1	0	0	112.7	A140 Y142 Q148	A140-Q144 VanDerWaalsContact O-CB 3.24Å; A140-Q144 WeakPolarHBondContact O-CB 3.21Å; A140-Q144 PolarHBondContact O-N 3.08Å; Y142-Q144 PolarHBondContact O-N 3.19Å; Q144-Q148 VanDerWaalsContact O-CB 3.3Å; Q144-Q148 WeakPolarHBondContact O-CB 3.46Å; Q144-Q148 PolarHBondContact O-N 2.82Å
145	K	87.7	Confident	84.5	Confident	74 Å²	74	78.4 Å²	78.4	32%	0.322	39%	0.388	S	S	.	.	H	α-helix	trans	-68.4	-34.8	176.6	-75.3	-169.3	-178.2	-167	0	112.6	A117 R141 Y142 H143 M149	A117-K145 HydrophobicContact CB-CB 3.78Å; R141-K145 WeakPolarHBondContact O-CB 3.19Å; R141-K145 WeakPolarHBondContact O-CG 3.29Å; R141-K145 PolarHBondContact O-N 2.91Å; R141-K145 VanDerWaalsContact O-N 3.13Å; Y142-K145 PolarHBondContact O-N 2.9Å; H143-K145 PolarHBondContact O-N 3.31Å; K145-M149 VanDerWaalsContact O-CB 3.23Å; K145-M149 WeakPolarHBondContact O-CB 3.31Å; K145-M149 PolarHBondContact O-N 3.26Å; K145-M149 VanDerWaalsContact O-N 3.14Å
146	K	87.5	Confident	83.1	Confident	53 Å²	53	80.3 Å²	80.3	23%	0.23	40%	0.397	C	S	.	.	H	α-helix	trans	-68.7	-46.6	177.7	176.4	170.5	174.6	179.6	0	111	A117 L118 E131 Y142 H143 N150	A117-K146 HydrophobicContact CB-CB 4.24Å; L118-K146 HydrophobicContact CD2-CG 3.98Å; E131-K146 IonicContact OE1-NZ 2.69Å; E131-K146 PolarHBondContact OE1-NZ 3.01Å; E131-K146 IonicContact OE2-NZ 3.1Å; E131-K146 PolarHBondContact OE2-NZ 3.2Å; Y142-K146 HydrophobicContact CE1-CD 3.73Å; Y142-K146 WeakPolarHBondContact O-CB 3.45Å; Y142-K146 PolarHBondContact O-N 3.1Å; H143-K146 PolarHBondContact O-N 3.23Å; H143-K146 VanDerWaalsContact O-N 3.16Å; K146-N150 VanDerWaalsContact O-CB 3.23Å; K146-N150 WeakPolarHBondContact O-CB 3.45Å; K146-N150 PolarHBondContact O-N 3.15Å
147	E	85.1	Confident	81.9	Confident	133 Å²	133	77.7 Å²	77.7	62%	0.621	38%	0.381	S	S	*	.	H	α-helix	trans	-66.3	-49.6	177	-73.5	174.9	179.9	0	0	111.9	H143 M149 N150 E151	H143-E147 WeakPolarHBondContact O-CB 3.44Å; H143-E147 WeakPolarHBondContact O-CG 3.34Å; H143-E147 PolarHBondContact O-N 3.2Å; E147-M149 VanDerWaalsContact C-N 3.3Å; E147-M149 PolarHBondContact O-N 3.48Å; E147-N150 PolarHBondContact O-N 3.25Å; E147-E151 VanDerWaalsContact O-CB 3.31Å; E147-E151 WeakPolarHBondContact O-CB 3.22Å; E147-E151 PolarHBondContact O-N 2.89Å
148	Q	81.6	Confident	80.6	Confident	114 Å²	114	77.3 Å²	77.3	53%	0.533	37%	0.37	S	S	.	.	H	α-helix	trans	-55.1	-48.6	176.5	-176.8	-165.5	-29.9	0	0	110.8	Q144 E151 E152	Q144-Q148 VanDerWaalsContact O-CB 3.3Å; Q144-Q148 WeakPolarHBondContact O-CB 3.46Å; Q144-Q148 PolarHBondContact O-N 2.82Å; Q148-E151 PolarHBondContact O-N 2.77Å; Q148-E152 PolarHBondContact NE2-OE1 3.25Å; Q148-E152 WeakPolarHBondContact O-CG 3.27Å; Q148-E152 PolarHBondContact O-N 3.18Å
149	M	80.1	Confident	79.2	Confident	63 Å²	63	80.1 Å²	80.1	31%	0.31	39%	0.387	S	S	.	.	H	α-helix	trans	-73.2	-33.4	-176.4	-167.9	154.3	43.7	0	0	112.2	C116 L118 K145 E147 L153	C116-M149 WeakPolarHBondContact SG-CE 3.5Å; L118-M149 HydrophobicContact CB-CE 4.3Å; L118-M149 HydrophobicContact CD1-CB 4.2Å; L118-M149 HydrophobicContact CD1-CE 4.11Å; L118-M149 HydrophobicContact CD1-CG 3.75Å; L118-M149 HydrophobicContact CD1-SD 4.37Å; L118-M149 HydrophobicContact CG-CE 3.93Å; L118-M149 HydrophobicContact CG-CG 4.47Å; K145-M149 VanDerWaalsContact O-CB 3.23Å; K145-M149 WeakPolarHBondContact O-CB 3.31Å; K145-M149 PolarHBondContact O-N 3.26Å; K145-M149 VanDerWaalsContact O-N 3.14Å; E147-M149 VanDerWaalsContact C-N 3.3Å; E147-M149 PolarHBondContact O-N 3.48Å; M149-L153 VanDerWaalsContact O-CB 3.23Å; M149-L153 WeakPolarHBondContact O-CB 3.49Å; M149-L153 PolarHBondContact O-N 3.45Å
150	N	79.9	Confident	77.5	Confident	64 Å²	64	78 Å²	78	34%	0.342	38%	0.377	S	S	.	.	H	α-helix	trans	-65.7	-36.7	169.7	-85.7	-17.3	0	0	0	112.4	L118 K146 E147 L153 R154	L118-N150 VanDerWaalsContact CD2-OD1 3.26Å; L118-N150 WeakPolarHBondContact CD2-OD1 3.35Å; K146-N150 VanDerWaalsContact O-CB 3.23Å; K146-N150 WeakPolarHBondContact O-CB 3.45Å; K146-N150 PolarHBondContact O-N 3.15Å; E147-N150 PolarHBondContact O-N 3.25Å; N150-L153 CarbonylContact O-C 3.58Å; N150-L153 PolarHBondContact O-N 2.94Å; N150-R154 WeakPolarHBondContact O-CB 3.42Å; N150-R154 PolarHBondContact O-N 2.76Å
151	E	76.7	Confident	76.1	Confident	75 Å²	75	82.6 Å²	82.6	35%	0.35	38%	0.379	S	S	.	.	H	α-helix	trans	-71.4	-38.4	176.7	176.1	62.7	-178.9	0	0	111.5	E147 Q148 R154 R155	E147-E151 VanDerWaalsContact O-CB 3.31Å; E147-E151 WeakPolarHBondContact O-CB 3.22Å; E147-E151 PolarHBondContact O-N 2.89Å; Q148-E151 PolarHBondContact O-N 2.77Å; E151-R154 PolarHBondContact O-N 3.33Å; E151-R155 WeakPolarHBondContact O-CB 3.44Å; E151-R155 WeakPolarHBondContact O-CG 3.47Å; E151-R155 PolarHBondContact O-N 2.88Å; E151-R155 IonicContact OE1-CZ 2.71Å; E151-R155 IonicContact OE1-NE 2.72Å; E151-R155 PolarHBondContact OE1-NE 2.71Å; E151-R155 IonicContact OE1-NH2 3.13Å; E151-R155 PolarHBondContact OE1-NH2 3.33Å
152	E	73.6	Confident	74.5	Confident	56 Å²	56	84.8 Å²	84.8	26%	0.262	39%	0.392	S	S	.	.	H	α-helix	trans	-61.6	-45.6	168.5	-73	-172.7	-125.3	0	0	111.2	Q148 R154 R155 E156 R431	Q148-E152 PolarHBondContact NE2-OE1 3.25Å; Q148-E152 WeakPolarHBondContact O-CG 3.27Å; Q148-E152 PolarHBondContact O-N 3.18Å; E152-R154 VanDerWaalsContact C-N 3.33Å; E152-R154 PolarHBondContact O-N 3.44Å; E152-R155 PolarHBondContact O-N 3.18Å; E152-E156 PolarHBondContact O-N 3.21Å; E152-R431 IonicContact OE2-CZ 3.69Å; E152-R431 IonicContact OE2-NH1 3.76Å; E152-R431 PolarHBondContact OE2-NH1 2.9Å; E152-R431 IonicContact OE2-NH2 3.83Å; E152-R431 PolarHBondContact OE2-NH2 2.85Å
153	L	71.8	Confident	72.8	Confident	65 Å²	65	88.8 Å²	88.8	34%	0.34	41%	0.407	S	S	.	.	H	α-helix	trans	-65.4	-35.3	177.9	-150.2	69.5	0	0	0	112.2	L118 M149 N150 A157 F460	L118-L153 HydrophobicContact CD1-CD2 4.41Å; M149-L153 VanDerWaalsContact O-CB 3.23Å; M149-L153 WeakPolarHBondContact O-CB 3.49Å; M149-L153 PolarHBondContact O-N 3.45Å; N150-L153 CarbonylContact O-C 3.58Å; N150-L153 PolarHBondContact O-N 2.94Å; L153-A157 VanDerWaalsContact O-CB 3.29Å; L153-A157 WeakPolarHBondContact O-CB 3.16Å; L153-A157 PolarHBondContact O-N 3.38Å; L153-F460 HydrophobicContact CD1-CE1 4.37Å; L153-F460 HydrophobicContact CD2-CE1 3.77Å; L153-F460 HydrophobicContact CD2-CZ 4.39Å; L153-F460 HydrophobicContact CG-CE1 4.11Å
154	R	73.8	Confident	70.9	Confident	128 Å²	128	91.5 Å²	91.5	48%	0.483	42%	0.42	S	S	.	.	H	α-helix	trans	-69.4	-43.8	175.2	-177.7	176	178	121.4	13.6	110.9	N150 E151 E152 A157 E158	N150-R154 WeakPolarHBondContact O-CB 3.42Å; N150-R154 PolarHBondContact O-N 2.76Å; E151-R154 PolarHBondContact O-N 3.33Å; E152-R154 VanDerWaalsContact C-N 3.33Å; E152-R154 PolarHBondContact O-N 3.44Å; R154-A157 CarbonylContact O-C 3.45Å; R154-A157 PolarHBondContact O-N 2.77Å; R154-A157 VanDerWaalsContact O-N 3.15Å; R154-E158 HydrophobicContact CG-CG 4.3Å; R154-E158 IonicContact CZ-OE1 3.76Å; R154-E158 VanDerWaalsContact CZ-OE1 3.26Å; R154-E158 IonicContact NE-OE1 2.72Å; R154-E158 PolarHBondContact NE-OE1 2.73Å; R154-E158 IonicContact NH2-OE1 3.79Å; R154-E158 PolarHBondContact NH2-OE1 2.92Å; R154-E158 WeakPolarHBondContact O-CB 3.11Å; R154-E158 WeakPolarHBondContact O-CG 3.35Å; R154-E158 PolarHBondContact O-N 2.71Å
155	R	68.6	Low	68.9	Low	140 Å²	140	87.2 Å²	87.2	53%	0.528	41%	0.412	S	S	.	.	H	α-helix	trans	-64.2	-38.5	173.7	-71.3	169.4	-173.2	-178.5	7.2	112	E151 E152 T159	E151-R155 WeakPolarHBondContact O-CB 3.44Å; E151-R155 WeakPolarHBondContact O-CG 3.47Å; E151-R155 PolarHBondContact O-N 2.88Å; E151-R155 IonicContact OE1-CZ 2.71Å; E151-R155 IonicContact OE1-NE 2.72Å; E151-R155 PolarHBondContact OE1-NE 2.71Å; E151-R155 IonicContact OE1-NH2 3.13Å; E151-R155 PolarHBondContact OE1-NH2 3.33Å; E152-R155 PolarHBondContact O-N 3.18Å; R155-T159 WeakPolarHBondContact O-CB 3.49Å; R155-T159 WeakPolarHBondContact O-CG2 3.48Å; R155-T159 PolarHBondContact O-N 3.43Å; R155-T159 PolarHBondContact O-OG1 3.26Å
156	E	65.7	Low	67	Low	94 Å²	94	86.6 Å²	86.6	44%	0.439	41%	0.41	S	S	.	.	H	α-helix	trans	-63.8	-42.7	169.7	-73.8	-159.9	163.8	0	0	111.4	E152 T159 M160	E152-E156 PolarHBondContact O-N 3.21Å; E156-T159 PolarHBondContact O-OG1 2.89Å; E156-M160 WeakPolarHBondContact O-CB 3.42Å; E156-M160 WeakPolarHBondContact O-CG 3.13Å; E156-M160 PolarHBondContact O-N 3.18Å
157	A	64.9	Low	65.1	Low	40 Å²	40	85.8 Å²	85.8	33%	0.331	42%	0.418	S	S	.	.	H	α-helix	trans	-67.4	-35.4	177.3	0	0	0	0	0	113.4	L153 R154 R161	L153-A157 VanDerWaalsContact O-CB 3.29Å; L153-A157 WeakPolarHBondContact O-CB 3.16Å; L153-A157 PolarHBondContact O-N 3.38Å; R154-A157 CarbonylContact O-C 3.45Å; R154-A157 PolarHBondContact O-N 2.77Å; R154-A157 VanDerWaalsContact O-N 3.15Å; A157-R161 WeakPolarHBondContact O-CB 3.26Å; A157-R161 WeakPolarHBondContact O-CG 3.44Å; A157-R161 PolarHBondContact O-N 3.46Å
158	E	63.4	Low	63.5	Low	85 Å²	85	86.1 Å²	86.1	40%	0.397	42%	0.419	S	S	.	.	H	α-helix	trans	-75.4	-45.6	178.3	-76.2	178.1	175.9	0	0	111.4	R154 M160 R161 E162	R154-E158 HydrophobicContact CG-CG 4.3Å; R154-E158 IonicContact CZ-OE1 3.76Å; R154-E158 VanDerWaalsContact CZ-OE1 3.26Å; R154-E158 IonicContact NE-OE1 2.72Å; R154-E158 PolarHBondContact NE-OE1 2.73Å; R154-E158 IonicContact NH2-OE1 3.79Å; R154-E158 PolarHBondContact NH2-OE1 2.92Å; R154-E158 WeakPolarHBondContact O-CB 3.11Å; R154-E158 WeakPolarHBondContact O-CG 3.35Å; R154-E158 PolarHBondContact O-N 2.71Å; E158-M160 PolarHBondContact O-N 2.88Å; E158-R161 CarbonylContact O-C 3.23Å; E158-R161 PolarHBondContact O-N 3.41Å; E158-R161 VanDerWaalsContact O-N 3.1Å; E158-E162 PolarHBondContact O-N 2.9Å
159	T	61.2	Low	62.2	Low	73 Å²	73	81.4 Å²	81.4	45%	0.448	40%	0.397	S	S	.	.	H	α-helix	trans	-64.1	-31.3	171.6	54	0	0	0	0	112	R155 E156 R163	R155-T159 WeakPolarHBondContact O-CB 3.49Å; R155-T159 WeakPolarHBondContact O-CG2 3.48Å; R155-T159 PolarHBondContact O-N 3.43Å; R155-T159 PolarHBondContact O-OG1 3.26Å; E156-T159 PolarHBondContact O-OG1 2.89Å; T159-R163 VanDerWaalsContact O-CB 3.31Å; T159-R163 WeakPolarHBondContact O-CB 3.21Å; T159-R163 PolarHBondContact O-N 3.38Å
160	M	57.3	Low	60.8	Low	30 Å²	30	85.4 Å²	85.4	15%	0.148	42%	0.419	C	S	.	.	H	α-helix	trans	-70.7	-40.4	168.9	-77.3	-58	-31.4	0	0	112.8	E156 E158 R163 E164	E156-M160 WeakPolarHBondContact O-CB 3.42Å; E156-M160 WeakPolarHBondContact O-CG 3.13Å; E156-M160 PolarHBondContact O-N 3.18Å; E158-M160 PolarHBondContact O-N 2.88Å; M160-R163 CarbonylContact O-C 3.52Å; M160-R163 PolarHBondContact O-N 3.36Å; M160-E164 HydrophobicContact CE-CG 3.71Å; M160-E164 WeakPolarHBondContact CE-OE1 3.25Å; M160-E164 WeakPolarHBondContact O-CB 3.34Å; M160-E164 WeakPolarHBondContact O-CG 3.41Å; M160-E164 PolarHBondContact O-N 3.28Å
161	R	59.4	Low	59.5	Low	172 Å²	172	90 Å²	90	65%	0.649	44%	0.444	S	S	*	.	H	α-helix	trans	-65.1	-39.4	174.8	-89.7	-177.8	162.9	-169.5	-2.1	112.3	A157 E158 R163 G165	A157-R161 WeakPolarHBondContact O-CB 3.26Å; A157-R161 WeakPolarHBondContact O-CG 3.44Å; A157-R161 PolarHBondContact O-N 3.46Å; E158-R161 CarbonylContact O-C 3.23Å; E158-R161 PolarHBondContact O-N 3.41Å; E158-R161 VanDerWaalsContact O-N 3.1Å; R161-R163 VanDerWaalsContact C-N 3.26Å; R161-R163 PolarHBondContact O-N 3.2Å; R161-G165 VanDerWaalsContact O-CA 3.31Å; R161-G165 WeakPolarHBondContact O-CA 3.23Å; R161-G165 PolarHBondContact O-N 2.89Å
162	E	56.8	Low	58.6	Low	122 Å²	122	90.1 Å²	90.1	57%	0.57	45%	0.45	S	S	*	.	H	α-helix	trans	-62.6	-35.2	172.7	-78.8	-142.5	99.2	0	0	112	E158 E166 K262	E158-E162 PolarHBondContact O-N 2.9Å; E162-E166 PolarHBondContact O-N 3.1Å; E162-K262 IonicContact OE1-NZ 2.76Å; E162-K262 PolarHBondContact OE1-NZ 3.41Å
163	R	54.4	Low	57.7	Low	85 Å²	85	92.6 Å²	92.6	32%	0.321	47%	0.472	S	S	.	.	H	α-helix	trans	-84.1	-31.3	-178.7	-174.7	175.6	174.1	-178	-2.2	114	T159 M160 R161 E440	T159-R163 VanDerWaalsContact O-CB 3.31Å; T159-R163 WeakPolarHBondContact O-CB 3.21Å; T159-R163 PolarHBondContact O-N 3.38Å; M160-R163 CarbonylContact O-C 3.52Å; M160-R163 PolarHBondContact O-N 3.36Å; R161-R163 VanDerWaalsContact C-N 3.26Å; R161-R163 PolarHBondContact O-N 3.2Å; R163-E440 IonicContact CZ-OE1 2.73Å; R163-E440 IonicContact NH1-OE1 2.66Å; R163-E440 IonicContact NH2-OE1 3.59Å; R163-E440 PolarHBondContact NH2-OE1 2.93Å
164	E	50.7	Low	57.6	Low	119 Å²	119	92.2 Å²	92.2	56%	0.556	48%	0.475	S	S	*	.	H	α-helix	trans	-85.1	-27.5	174.1	-70	-180	-173.2	0	0	110.7	M160 E166 G167 R439	M160-E164 HydrophobicContact CE-CG 3.71Å; M160-E164 WeakPolarHBondContact CE-OE1 3.25Å; M160-E164 WeakPolarHBondContact O-CB 3.34Å; M160-E164 WeakPolarHBondContact O-CG 3.41Å; M160-E164 PolarHBondContact O-N 3.28Å; E164-E166 PolarHBondContact O-N 3.26Å; E164-G167 WeakPolarHBondContact O-CA 3.34Å; E164-G167 PolarHBondContact O-N 2.66Å; E164-R439 IonicContact OE1-CZ 2.95Å; E164-R439 IonicContact OE1-NH1 3.13Å; E164-R439 PolarHBondContact OE1-NH1 2.99Å; E164-R439 IonicContact OE1-NH2 2.99Å; E164-R439 PolarHBondContact OE1-NH2 2.73Å
165	G	46.4	Very low	57.5	Low	46 Å²	46	88.9 Å²	88.9	47%	0.474	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-71.5	-5.6	167.4	0	0	0	0	0	114.9	R161 G167	R161-G165 VanDerWaalsContact O-CA 3.31Å; R161-G165 WeakPolarHBondContact O-CA 3.23Å; R161-G165 PolarHBondContact O-N 2.89Å; G165-G167 PolarHBondContact O-N 3.15Å
166	E	48.9	Very low	57.9	Low	61 Å²	61	88.4 Å²	88.4	29%	0.285	47%	0.473	S	S	.	.	G	3₁₀ helix	trans	-65	-3.7	156.7	-58.7	-160.1	130	0	0	112	E162 E164 E168 F169 W182 K187	E162-E166 PolarHBondContact O-N 3.1Å; E164-E166 PolarHBondContact O-N 3.26Å; E166-E168 VanDerWaalsContact C-N 3.32Å; E166-E168 PolarHBondContact O-N 2.93Å; E166-F169 WeakPolarHBondContact O-CD2 3.36Å; E166-F169 WeakPolarHBondContact O-CE2 3.4Å; E166-W182 PolarHBondContact OE1-NE1 2.96Å; E166-W182 PolarHBondContact OE2-NE1 3.2Å; E166-K187 IonicContact OE2-NZ 2.78Å
167	G	47.8	Very low	58.6	Low	37 Å²	37	91.1 Å²	91.1	38%	0.381	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-70.6	-8.1	-175.2	0	0	0	0	0	117.1	E164 G165 F169	E164-G167 WeakPolarHBondContact O-CA 3.34Å; E164-G167 PolarHBondContact O-N 2.66Å; G165-G167 PolarHBondContact O-N 3.15Å; G167-F169 PolarHBondContact O-N 2.89Å
168	E	50	Low	59.5	Low	140 Å²	140	90.7 Å²	90.7	65%	0.654	47%	0.473	S	S	*	.			trans	-70.4	63	175.1	-66.3	-173.2	134.6	0	0	112.6	E166	E166-E168 VanDerWaalsContact C-N 3.32Å; E166-E168 PolarHBondContact O-N 2.93Å
169	F	54.3	Low	60.4	Low	14 Å²	14	93.4 Å²	93.4	6%	0.061	48%	0.48	C	S	.	.			trans	-96.1	-5.1	174.7	-87.7	-91.9	0	0	0	113.2	E166 G167 N171 P175 R178 R179 P258	E166-F169 WeakPolarHBondContact O-CD2 3.36Å; E166-F169 WeakPolarHBondContact O-CE2 3.4Å; G167-F169 PolarHBondContact O-N 2.89Å; F169-N171 VanDerWaalsContact C-N 3.31Å; F169-N171 PolarHBondContact O-N 3.1Å; F169-P175 HydrophobicContact CB-CB 3.92Å; F169-P175 HydrophobicContact CD1-CB 4.37Å; F169-R178 HydrophobicContact CD1-CB 4.44Å; F169-R178 HydrophobicContact CD1-CG 4.43Å; F169-R178 HydrophobicContact CE1-CB 4.04Å; F169-R178 HydrophobicContact CE1-CG 3.79Å; F169-R179 HydrophobicContact CE1-CB 4.28Å; F169-R179 HydrophobicContact CZ-CB 4.27Å; F169-P258 HydrophobicContact CE2-CB 4.27Å; F169-P258 HydrophobicContact CZ-CB 4.4Å
170	D	50.4	Low	61.4	Low	147 Å²	147	96.2 Å²	96.2	79%	0.786	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-22.3	-164.4	-67.4	-22.4	0	0	0	115
171	N	53.5	Low	62.9	Low	162 Å²	162	97.4 Å²	97.4	87%	0.866	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	34.3	-176.8	-73.4	-39.3	0	0	0	114.1	F169	F169-N171 VanDerWaalsContact C-N 3.31Å; F169-N171 PolarHBondContact O-N 3.1Å
172	T	56.8	Low	64.2	Low	76 Å²	76	90 Å²	90	47%	0.466	46%	0.464	S	S	.	.	S	Bend	trans	-152.9	146.1	173.3	-44.5	0	0	0	0	113.4	R178	T172-R178 PolarHBondContact OG1-NH1 3.41Å
173	C	56.6	Low	65.5	Low	108 Å²	108	86.4 Å²	86.4	73%	0.73	45%	0.449	S	S	*	.	S	Bend	trans	-53.5	141.1	175.9	-175.1	0	0	0	0	113.4
174	C	68.3	Low	67.2	Low	58 Å²	58	84.5 Å²	84.5	39%	0.392	45%	0.445	S	S	.	.			trans	54.8	54.1	177.5	-69	0	0	0	0	115.7	E176 K177 R178	C174-E176 VanDerWaalsContact C-N 3.32Å; C174-E176 PolarHBondContact O-N 2.71Å; C174-K177 HydrophobicContact CB-CB 4.14Å; C174-K177 HydrophobicContact CB-CD 4.09Å; C174-K177 HydrophobicContact CB-CG 4.25Å; C174-K177 PolarHBondContact O-N 3.04Å; C174-K177 VanDerWaalsContact O-N 3.09Å; C174-R178 PolarHBondContact O-N 3.08Å
175	P	72.6	Confident	68.9	Low	57 Å²	57	79.8 Å²	79.8	37%	0.37	42%	0.424	S	S	.	.	H	α-helix	trans	-57.6	-41.1	-176.3	24.3	-34.2	0	0	0	112.8	F169 K177 R178 R179	F169-P175 HydrophobicContact CB-CB 3.92Å; F169-P175 HydrophobicContact CD1-CB 4.37Å; P175-K177 PolarHBondContact O-N 3.26Å; P175-R178 PolarHBondContact O-N 3.06Å; P175-R179 WeakPolarHBondContact O-CB 3.45Å; P175-R179 PolarHBondContact O-N 3.48Å
176	E	75.8	Confident	70.7	Confident	130 Å²	130	80.2 Å²	80.2	61%	0.607	41%	0.413	S	S	*	.	H	α-helix	trans	-59.1	-45.3	175.1	-79.8	-160.7	-157	0	0	113.9	C174 R179 K180	C174-E176 VanDerWaalsContact C-N 3.32Å; C174-E176 PolarHBondContact O-N 2.71Å; E176-R179 PolarHBondContact O-N 2.93Å; E176-K180 WeakPolarHBondContact O-CB 3.28Å; E176-K180 WeakPolarHBondContact O-CD 3.42Å; E176-K180 VanDerWaalsContact O-CG 3.25Å; E176-K180 WeakPolarHBondContact O-CG 3.36Å; E176-K180 PolarHBondContact O-N 2.73Å; E176-K180 IonicContact OE2-NZ 2.66Å; E176-K180 PolarHBondContact OE2-NZ 3.18Å
177	K	81.9	Confident	72.3	Confident	151 Å²	151	79.4 Å²	79.4	66%	0.657	41%	0.409	S	S	*	.	H	α-helix	trans	-68.3	-41.1	-177.5	-61.4	-177.4	-177.4	172.9	0	109.9	C174 P175 K180 L181	C174-K177 HydrophobicContact CB-CB 4.14Å; C174-K177 HydrophobicContact CB-CD 4.09Å; C174-K177 HydrophobicContact CB-CG 4.25Å; C174-K177 PolarHBondContact O-N 3.04Å; C174-K177 VanDerWaalsContact O-N 3.09Å; P175-K177 PolarHBondContact O-N 3.26Å; K177-K180 PolarHBondContact O-N 2.77Å; K177-L181 WeakPolarHBondContact O-CB 3.45Å; K177-L181 PolarHBondContact O-N 3.47Å
178	R	83.4	Confident	73.9	Confident	31 Å²	31	80.1 Å²	80.1	12%	0.117	41%	0.407	C	S	.	.	H	α-helix	trans	-62	-43.5	175.4	-167.6	-174.5	161.8	-178.5	-0.5	111.7	F169 T172 C174 P175 L181 W182 S256 S257 P258	F169-R178 HydrophobicContact CD1-CB 4.44Å; F169-R178 HydrophobicContact CD1-CG 4.43Å; F169-R178 HydrophobicContact CE1-CB 4.04Å; F169-R178 HydrophobicContact CE1-CG 3.79Å; T172-R178 PolarHBondContact OG1-NH1 3.41Å; C174-R178 PolarHBondContact O-N 3.08Å; P175-R178 PolarHBondContact O-N 3.06Å; R178-L181 PolarHBondContact O-N 3.49Å; R178-W182 WeakPolarHBondContact O-CB 3.27Å; R178-W182 PolarHBondContact O-N 3.26Å; R178-S256 WeakPolarHBondContact CG-O 3.27Å; R178-S256 PolarHBondContact NE-O 3.39Å; R178-S257 PolarHBondContact NH2-O 3.22Å; R178-P258 PolarHBondContact NH2-O 3.09Å
179	R	81.6	Confident	75	Confident	142 Å²	142	77.5 Å²	77.5	54%	0.536	40%	0.404	S	S	.	.	H	α-helix	trans	-65.4	-44.8	174.8	-172.8	175.2	-175.6	158	7.1	112.5	F169 P175 E176 L181 W182 D183	F169-R179 HydrophobicContact CE1-CB 4.28Å; F169-R179 HydrophobicContact CZ-CB 4.27Å; P175-R179 WeakPolarHBondContact O-CB 3.45Å; P175-R179 PolarHBondContact O-N 3.48Å; E176-R179 PolarHBondContact O-N 2.93Å; R179-L181 VanDerWaalsContact C-N 3.28Å; R179-L181 PolarHBondContact O-N 3.44Å; R179-W182 WeakPolarHBondContact O-CB 3.43Å; R179-W182 PolarHBondContact O-N 2.83Å; R179-D183 PolarHBondContact O-N 2.91Å
180	K	83.6	Confident	76.2	Confident	132 Å²	132	79.7 Å²	79.7	57%	0.574	42%	0.421	S	S	*	.	H	α-helix	trans	-59.4	-37.7	174.2	-74.5	161.4	179.2	163.2	0	111.8	E176 K177 L184	E176-K180 WeakPolarHBondContact O-CB 3.28Å; E176-K180 WeakPolarHBondContact O-CD 3.42Å; E176-K180 VanDerWaalsContact O-CG 3.25Å; E176-K180 WeakPolarHBondContact O-CG 3.36Å; E176-K180 PolarHBondContact O-N 2.73Å; E176-K180 IonicContact OE2-NZ 2.66Å; E176-K180 PolarHBondContact OE2-NZ 3.18Å; K177-K180 PolarHBondContact O-N 2.77Å; K180-L184 VanDerWaalsContact O-CB 3.28Å; K180-L184 WeakPolarHBondContact O-CB 3.31Å; K180-L184 PolarHBondContact O-N 3.36Å; K180-L184 VanDerWaalsContact O-N 3.1Å
181	L	87.3	Confident	78	Confident	55 Å²	55	74.8 Å²	74.8	29%	0.288	40%	0.398	S	S	.	.	H	α-helix	trans	-71.4	-39.3	174.5	-175.9	60.6	0	0	0	112.8	K177 R178 R179 L184 L185	K177-L181 WeakPolarHBondContact O-CB 3.45Å; K177-L181 PolarHBondContact O-N 3.47Å; R178-L181 PolarHBondContact O-N 3.49Å; R179-L181 VanDerWaalsContact C-N 3.28Å; R179-L181 PolarHBondContact O-N 3.44Å; L181-L184 HydrophobicContact CD1-CD2 4.28Å; L181-L184 WeakPolarHBondContact O-CB 3.37Å; L181-L184 PolarHBondContact O-N 3.2Å; L181-L185 HydrophobicContact CD1-CD1 3.73Å; L181-L185 HydrophobicContact CD1-CG 4.09Å; L181-L185 HydrophobicContact CG-CD1 3.85Å; L181-L185 WeakPolarHBondContact O-CG 3.3Å; L181-L185 PolarHBondContact O-N 3.42Å
182	W	87.8	Confident	79.7	Confident	16 Å²	16	72.1 Å²	72.1	6%	0.061	39%	0.387	C	S	.	.	H	α-helix	trans	-61.1	-49.6	173.7	-176.2	-119.5	0	0	0	111.5	E166 R178 R179 L184 L185 E186 F263	E166-W182 PolarHBondContact OE1-NE1 2.96Å; E166-W182 PolarHBondContact OE2-NE1 3.2Å; R178-W182 WeakPolarHBondContact O-CB 3.27Å; R178-W182 PolarHBondContact O-N 3.26Å; R179-W182 WeakPolarHBondContact O-CB 3.43Å; R179-W182 PolarHBondContact O-N 2.83Å; W182-L184 PolarHBondContact O-N 3.49Å; W182-L185 PolarHBondContact O-N 3.3Å; W182-E186 HydrophobicContact CD2-CB 4.32Å; W182-E186 HydrophobicContact CE3-CB 4.45Å; W182-E186 HydrophobicContact CH2-CG 4.19Å; W182-E186 HydrophobicContact CZ2-CG 4.08Å; W182-E186 VanDerWaalsContact O-CB 3.26Å; W182-E186 WeakPolarHBondContact O-CB 3.39Å; W182-E186 PolarHBondContact O-N 3.5Å; W182-F263 HydrophobicContact CH2-CD2 4.21Å; W182-F263 HydrophobicContact CH2-CE2 4.48Å; W182-F263 HydrophobicContact CZ3-CD2 4.32Å; W182-F263 HydrophobicContact CZ3-CE2 4.31Å
183	D	84.4	Confident	81.3	Confident	47 Å²	47	70.9 Å²	70.9	25%	0.251	39%	0.385	S	S	.	.	H	α-helix	trans	-65.9	-23	176.5	-71.6	-34.4	0	0	0	112.9	R179 K187 S190	R179-D183 PolarHBondContact O-N 2.91Å; D183-K187 WeakPolarHBondContact OD1-CD 3.47Å; D183-K187 WeakPolarHBondContact OD1-CE 3.32Å; D183-K187 IonicContact OD1-NZ 3.7Å; D183-K187 PolarHBondContact OD1-NZ 3.36Å; D183-S190 WeakPolarHBondContact O-CB 3.41Å; D183-S190 PolarHBondContact O-OG 2.87Å
184	L	88.8	Confident	82.9	Confident	46 Å²	46	65.8 Å²	65.8	24%	0.241	35%	0.351	C	S	.	.	H	α-helix	trans	-76.7	-38.3	174.2	-177.3	69.7	0	0	0	112.8	K180 L181 W182 A193 A194 L197	K180-L184 VanDerWaalsContact O-CB 3.28Å; K180-L184 WeakPolarHBondContact O-CB 3.31Å; K180-L184 PolarHBondContact O-N 3.36Å; K180-L184 VanDerWaalsContact O-N 3.1Å; L181-L184 HydrophobicContact CD1-CD2 4.28Å; L181-L184 WeakPolarHBondContact O-CB 3.37Å; L181-L184 PolarHBondContact O-N 3.2Å; W182-L184 PolarHBondContact O-N 3.49Å; L184-A193 HydrophobicContact CD1-CB 3.75Å; L184-A194 HydrophobicContact CD1-CB 4.07Å; L184-A194 WeakPolarHBondContact O-CB 3.3Å; L184-L197 HydrophobicContact CD1-CD1 3.93Å; L184-L197 HydrophobicContact CD2-CD1 3.81Å; L184-L197 HydrophobicContact CG-CD1 3.7Å
185	L	87.3	Confident	84	Confident	20 Å²	20	68.7 Å²	68.7	11%	0.105	36%	0.357	C	S	.	.	H	α-helix	trans	-95	-26.6	-172.7	-66.5	171.2	0	0	0	114.7	L181 W182 L252 R253	L181-L185 HydrophobicContact CD1-CD1 3.73Å; L181-L185 HydrophobicContact CD1-CG 4.09Å; L181-L185 HydrophobicContact CG-CD1 3.85Å; L181-L185 WeakPolarHBondContact O-CG 3.3Å; L181-L185 PolarHBondContact O-N 3.42Å; W182-L185 PolarHBondContact O-N 3.3Å; L185-L252 HydrophobicContact CD1-CB 3.68Å; L185-R253 HydrophobicContact CB-CG 3.97Å; L185-R253 HydrophobicContact CD1-CG 4.22Å; L185-R253 PolarHBondContact O-NE 3.18Å; L185-R253 VanDerWaalsContact O-NE 3.15Å; L185-R253 PolarHBondContact O-NH2 3.42Å
186	E	84.6	Confident	84.9	Confident	54 Å²	54	70.3 Å²	70.3	25%	0.252	36%	0.361	S	S	.	.	H	α-helix	trans	-106.7	-21.4	-173.7	-158.1	63.3	-167.3	0	0	112.9	W182 P188 R253 R318	W182-E186 HydrophobicContact CD2-CB 4.32Å; W182-E186 HydrophobicContact CE3-CB 4.45Å; W182-E186 HydrophobicContact CH2-CG 4.19Å; W182-E186 HydrophobicContact CZ2-CG 4.08Å; W182-E186 VanDerWaalsContact O-CB 3.26Å; W182-E186 WeakPolarHBondContact O-CB 3.39Å; W182-E186 PolarHBondContact O-N 3.5Å; E186-P188 WeakPolarHBondContact O-CD 3.35Å; E186-R253 IonicContact OE2-NE 2.88Å; E186-R318 IonicContact OE1-CZ 2.78Å; E186-R318 IonicContact OE1-NH1 3.78Å; E186-R318 PolarHBondContact OE1-NH1 2.98Å; E186-R318 IonicContact OE2-CZ 2.74Å; E186-R318 IonicContact OE2-NH1 3.23Å; E186-R318 PolarHBondContact OE2-NH1 2.89Å
187	K	81.3	Confident	85.7	Confident	45 Å²	45	66.5 Å²	66.5	20%	0.196	35%	0.345	C	S	.	.			trans	-122.5	83.2	-177.2	-55.7	-174.1	-176.2	74.6	0	111	E166 D183 S189 S190	E166-K187 IonicContact OE2-NZ 2.78Å; D183-K187 WeakPolarHBondContact OD1-CD 3.47Å; D183-K187 WeakPolarHBondContact OD1-CE 3.32Å; D183-K187 IonicContact OD1-NZ 3.7Å; D183-K187 PolarHBondContact OD1-NZ 3.36Å; K187-S189 PolarHBondContact O-N 2.95Å; K187-S190 VanDerWaalsContact O-CB 3.25Å; K187-S190 WeakPolarHBondContact O-CB 3.4Å; K187-S190 PolarHBondContact O-N 3.44Å; K187-S190 PolarHBondContact O-OG 3.49Å
188	P	81.1	Confident	86.2	Confident	51 Å²	51	59.9 Å²	59.9	33%	0.331	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-23.6	-177.4	-29	36.2	0	0	0	115.4	E186 K195 A198	E186-P188 WeakPolarHBondContact O-CD 3.35Å; P188-K195 WeakPolarHBondContact O-CG 3.31Å; P188-K195 PolarHBondContact O-N 3.01Å; P188-A198 HydrophobicContact CB-CB 3.89Å; P188-A198 HydrophobicContact CG-CB 4.11Å
189	S	73.3	Confident	86.7	Confident	85 Å²	85	63.8 Å²	63.8	59%	0.594	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-9.2	177.8	51.9	0	0	0	0	114.8	K187 S191	K187-S189 PolarHBondContact O-N 2.95Å; S189-S191 PolarHBondContact O-N 2.86Å
190	S	80.6	Confident	87.3	Confident	60 Å²	60	59.6 Å²	59.6	42%	0.42	33%	0.328	S	S	.	.	S	Bend	trans	-66.6	-34.3	-171.8	68.6	0	0	0	0	114	D183 K187 A194	D183-S190 WeakPolarHBondContact O-CB 3.41Å; D183-S190 PolarHBondContact O-OG 2.87Å; K187-S190 VanDerWaalsContact O-CB 3.25Å; K187-S190 WeakPolarHBondContact O-CB 3.4Å; K187-S190 PolarHBondContact O-N 3.44Å; K187-S190 PolarHBondContact O-OG 3.49Å; S190-A194 WeakPolarHBondContact OG-CB 3.22Å
191	S	87.9	Confident	87.8	Confident	44 Å²	44	53.5 Å²	53.5	31%	0.308	30%	0.302	S	S	.	.			trans	-157.2	164.6	-173.9	62.8	0	0	0	0	111.3	S189 A193 A194 K195	S189-S191 PolarHBondContact O-N 2.86Å; S191-A193 VanDerWaalsContact C-N 3.28Å; S191-A193 PolarHBondContact O-N 3.27Å; S191-A194 PolarHBondContact O-N 2.9Å; S191-A194 WeakPolarHBondContact OG-CB 3.41Å; S191-A194 PolarHBondContact OG-N 2.93Å; S191-K195 PolarHBondContact O-N 3.3Å
192	V	89.2	Confident	88.1	Confident	106 Å²	106	53.9 Å²	53.9	64%	0.642	30%	0.304	S	S	*	.	H	α-helix	trans	-63.5	-36.9	173.5	-177.8	0	0	0	0	110.9	A194 K195 I196	V192-A194 PolarHBondContact O-N 3.43Å; V192-K195 WeakPolarHBondContact O-CB 3.08Å; V192-K195 PolarHBondContact O-N 3Å; V192-I196 HydrophobicContact CG1-CD1 4.03Å; V192-I196 WeakPolarHBondContact O-CG1 3.36Å; V192-I196 PolarHBondContact O-N 3.17Å
193	A	90.8	Very high	88.5	Confident	51 Å²	51	58.6 Å²	58.6	42%	0.421	33%	0.33	S	S	.	.	H	α-helix	trans	-62.6	-40.3	174.7	0	0	0	0	0	112.6	L184 S191 K195 I196 L197	L184-A193 HydrophobicContact CD1-CB 3.75Å; S191-A193 VanDerWaalsContact C-N 3.28Å; S191-A193 PolarHBondContact O-N 3.27Å; A193-K195 VanDerWaalsContact C-N 3.32Å; A193-K195 PolarHBondContact O-N 3.25Å; A193-I196 PolarHBondContact O-N 3.43Å; A193-L197 WeakPolarHBondContact O-CG 3.22Å; A193-L197 PolarHBondContact O-N 3.04Å
194	A	89.9	Confident	89	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.008	33%	0.326	C	S	.	.	H	α-helix	trans	-63	-37.9	175.3	0	0	0	0	0	112.1	L184 S190 S191 V192 A198	L184-A194 HydrophobicContact CD1-CB 4.07Å; L184-A194 WeakPolarHBondContact O-CB 3.3Å; S190-A194 WeakPolarHBondContact OG-CB 3.22Å; S191-A194 PolarHBondContact O-N 2.9Å; S191-A194 WeakPolarHBondContact OG-CB 3.41Å; S191-A194 PolarHBondContact OG-N 2.93Å; V192-A194 PolarHBondContact O-N 3.43Å; A194-A198 VanDerWaalsContact O-CB 3.29Å; A194-A198 WeakPolarHBondContact O-CB 3.4Å; A194-A198 PolarHBondContact O-N 3.39Å
195	K	90.4	Very high	89.3	Confident	118 Å²	118	56 Å²	56	51%	0.513	31%	0.314	S	S	.	.	H	α-helix	trans	-63.9	-46.8	173.1	-64.4	-179.6	-177.5	-179	0	111.9	P188 S191 V192 A193 A198 I199	P188-K195 WeakPolarHBondContact O-CG 3.31Å; P188-K195 PolarHBondContact O-N 3.01Å; S191-K195 PolarHBondContact O-N 3.3Å; V192-K195 WeakPolarHBondContact O-CB 3.08Å; V192-K195 PolarHBondContact O-N 3Å; A193-K195 VanDerWaalsContact C-N 3.32Å; A193-K195 PolarHBondContact O-N 3.25Å; K195-A198 PolarHBondContact O-N 3.41Å; K195-I199 VanDerWaalsContact O-CG1 3.3Å; K195-I199 WeakPolarHBondContact O-CG1 3.29Å; K195-I199 PolarHBondContact O-N 3.32Å
196	I	93.1	Very high	89.7	Confident	91 Å²	91	58.1 Å²	58.1	47%	0.467	33%	0.328	S	S	.	.	H	α-helix	trans	-61.4	-47.8	179.3	-68.2	166.3	0	0	0	110.4	V192 A193 A198 I199 I200	V192-I196 HydrophobicContact CG1-CD1 4.03Å; V192-I196 WeakPolarHBondContact O-CG1 3.36Å; V192-I196 PolarHBondContact O-N 3.17Å; A193-I196 PolarHBondContact O-N 3.43Å; I196-A198 VanDerWaalsContact C-N 3.34Å; I196-A198 PolarHBondContact O-N 3.39Å; I196-I199 PolarHBondContact O-N 3.47Å; I196-I200 HydrophobicContact CG2-CD1 3.85Å; I196-I200 WeakPolarHBondContact O-CG1 3.11Å; I196-I200 PolarHBondContact O-N 2.88Å
197	L	92.2	Very high	90.2	Very high	50 Å²	50	59.2 Å²	59.2	26%	0.262	34%	0.335	S	S	.	.	H	α-helix	trans	-61.5	-40.3	176.4	-73.5	171.3	0	0	0	112.4	L184 A193 I199 I200 S201 W245	L184-L197 HydrophobicContact CD1-CD1 3.93Å; L184-L197 HydrophobicContact CD2-CD1 3.81Å; L184-L197 HydrophobicContact CG-CD1 3.7Å; A193-L197 WeakPolarHBondContact O-CG 3.22Å; A193-L197 PolarHBondContact O-N 3.04Å; L197-I199 PolarHBondContact O-N 3.19Å; L197-I200 PolarHBondContact O-N 3.47Å; L197-S201 PolarHBondContact O-N 3.07Å; L197-S201 PolarHBondContact O-OG 2.93Å; L197-W245 HydrophobicContact CD2-CH2 4.45Å
198	A	91.9	Very high	90.8	Very high	12 Å²	12	57 Å²	57	10%	0.099	33%	0.326	C	S	.	.	H	α-helix	trans	-64.9	-36.9	175.6	0	0	0	0	0	112.8	P188 A194 K195 I196 S201 I202	P188-A198 HydrophobicContact CB-CB 3.89Å; P188-A198 HydrophobicContact CG-CB 4.11Å; A194-A198 VanDerWaalsContact O-CB 3.29Å; A194-A198 WeakPolarHBondContact O-CB 3.4Å; A194-A198 PolarHBondContact O-N 3.39Å; K195-A198 PolarHBondContact O-N 3.41Å; I196-A198 VanDerWaalsContact C-N 3.34Å; I196-A198 PolarHBondContact O-N 3.39Å; A198-S201 WeakPolarHBondContact O-CB 3.3Å; A198-S201 PolarHBondContact O-N 2.88Å; A198-I202 WeakPolarHBondContact O-CD1 3.46Å; A198-I202 VanDerWaalsContact O-CG1 3.27Å; A198-I202 WeakPolarHBondContact O-CG1 3.45Å; A198-I202 PolarHBondContact O-N 3.49Å; A198-I202 VanDerWaalsContact O-N 3.08Å
199	I	92.8	Very high	91.3	Very high	113 Å²	113	56.1 Å²	56.1	58%	0.579	32%	0.319	S	S	*	.	H	α-helix	trans	-65.6	-43	173.5	-68.7	162.4	0	0	0	110.6	K195 I196 L197 S201 I202 L203	K195-I199 VanDerWaalsContact O-CG1 3.3Å; K195-I199 WeakPolarHBondContact O-CG1 3.29Å; K195-I199 PolarHBondContact O-N 3.32Å; I196-I199 PolarHBondContact O-N 3.47Å; L197-I199 PolarHBondContact O-N 3.19Å; I199-S201 VanDerWaalsContact C-N 3.34Å; I199-S201 PolarHBondContact O-N 2.91Å; I199-I202 PolarHBondContact O-N 3.19Å; I199-L203 PolarHBondContact O-N 2.86Å
200	I	94.6	Very high	92.3	Very high	55 Å²	55	56.1 Å²	56.1	28%	0.282	31%	0.312	S	S	.	.	H	α-helix	trans	-62.7	-41.6	175.1	-66	165.5	0	0	0	110.9	I196 L197 I202 L203 F204 W245	I196-I200 HydrophobicContact CG2-CD1 3.85Å; I196-I200 WeakPolarHBondContact O-CG1 3.11Å; I196-I200 PolarHBondContact O-N 2.88Å; L197-I200 PolarHBondContact O-N 3.47Å; I200-I202 VanDerWaalsContact C-N 3.33Å; I200-I202 PolarHBondContact O-N 2.98Å; I200-L203 PolarHBondContact O-N 2.85Å; I200-F204 HydrophobicContact CG2-CD2 3.71Å; I200-F204 HydrophobicContact CG2-CE2 3.7Å; I200-F204 WeakPolarHBondContact O-CD2 3.41Å; I200-F204 PolarHBondContact O-N 3.2Å; I200-W245 HydrophobicContact CB-CZ2 4.4Å; I200-W245 HydrophobicContact CG2-CH2 3.78Å; I200-W245 HydrophobicContact CG2-CZ2 3.5Å; I200-W245 VanDerWaalsContact CG2-CZ2 3.5Å; I200-W245 HydrophobicContact CG2-CZ3 4.48Å
201	S	94	Very high	92.8	Very high	4 Å²	4	53.5 Å²	53.5	3%	0.028	29%	0.294	C	S	.	.	H	α-helix	trans	-56.1	-47.5	174.9	-48.3	0	0	0	0	111	L197 A198 I199 F204 I205 E249	L197-S201 PolarHBondContact O-N 3.07Å; L197-S201 PolarHBondContact O-OG 2.93Å; A198-S201 WeakPolarHBondContact O-CB 3.3Å; A198-S201 PolarHBondContact O-N 2.88Å; I199-S201 VanDerWaalsContact C-N 3.34Å; I199-S201 PolarHBondContact O-N 2.91Å; S201-F204 PolarHBondContact O-N 2.7Å; S201-I205 WeakPolarHBondContact O-CD1 3.28Å; S201-I205 VanDerWaalsContact O-CG1 3.27Å; S201-I205 WeakPolarHBondContact O-CG1 3.34Å; S201-I205 PolarHBondContact O-N 2.67Å; S201-I205 VanDerWaalsContact O-N 3.08Å; S201-E249 VanDerWaalsContact CB-OE1 3.31Å; S201-E249 WeakPolarHBondContact CB-OE1 3.28Å; S201-E249 PolarHBondContact OG-OE1 3Å; S201-E249 VanDerWaalsContact OG-OE1 3.06Å
202	I	94.2	Very high	92.9	Very high	63 Å²	63	52.8 Å²	52.8	32%	0.323	29%	0.286	S	S	.	.	H	α-helix	trans	-64.3	-42.7	178	-65.2	160.7	0	0	0	111	A198 I199 I200 F204 I205 V206 L316 H319	A198-I202 WeakPolarHBondContact O-CD1 3.46Å; A198-I202 VanDerWaalsContact O-CG1 3.27Å; A198-I202 WeakPolarHBondContact O-CG1 3.45Å; A198-I202 PolarHBondContact O-N 3.49Å; A198-I202 VanDerWaalsContact O-N 3.08Å; I199-I202 PolarHBondContact O-N 3.19Å; I200-I202 VanDerWaalsContact C-N 3.33Å; I200-I202 PolarHBondContact O-N 2.98Å; I202-F204 PolarHBondContact O-N 2.79Å; I202-I205 PolarHBondContact O-N 3.23Å; I202-V206 HydrophobicContact CG2-CG2 4.42Å; I202-V206 WeakPolarHBondContact O-CG2 3.37Å; I202-V206 PolarHBondContact O-N 2.59Å; I202-L316 HydrophobicContact CG2-CD2 4.38Å; I202-H319 HydrophobicContact CD1-CB 3.9Å; I202-H319 HydrophobicContact CG1-CB 3.96Å
203	L	95.4	Very high	92.9	Very high	114 Å²	114	51.3 Å²	51.3	60%	0.597	28%	0.28	S	S	*	.	H	α-helix	trans	-60.8	-44	178	-177.7	63.1	0	0	0	111.9	I199 I200 I205 V206 L207	I199-L203 PolarHBondContact O-N 2.86Å; I200-L203 PolarHBondContact O-N 2.85Å; L203-I205 VanDerWaalsContact C-N 3.35Å; L203-I205 PolarHBondContact O-N 2.93Å; L203-V206 PolarHBondContact O-N 3.49Å; L203-L207 VanDerWaalsContact O-CB 3.32Å; L203-L207 WeakPolarHBondContact O-CB 3.39Å; L203-L207 PolarHBondContact O-N 3.11Å
204	F	96	Very high	92.9	Very high	39 Å²	39	52.1 Å²	52.1	17%	0.171	28%	0.277	C	S	.	.	H	α-helix	trans	-64.5	-36.4	174.3	-86.5	-72.7	0	0	0	112.7	I200 S201 I202 S208 V241 W245 F246	I200-F204 HydrophobicContact CG2-CD2 3.71Å; I200-F204 HydrophobicContact CG2-CE2 3.7Å; I200-F204 WeakPolarHBondContact O-CD2 3.41Å; I200-F204 PolarHBondContact O-N 3.2Å; S201-F204 PolarHBondContact O-N 2.7Å; I202-F204 PolarHBondContact O-N 2.79Å; F204-S208 WeakPolarHBondContact O-CB 3.3Å; F204-S208 PolarHBondContact O-N 3.23Å; F204-S208 PolarHBondContact O-OG 2.77Å; F204-V241 HydrophobicContact CE1-CG1 4.23Å; F204-W245 HydrophobicContact CB-CG 4.37Å; F204-W245 HydrophobicContact CD1-CB 4.1Å; F204-W245 HydrophobicContact CD1-CG 4.19Å; F204-W245 HydrophobicContact CD2-CB 4.28Å; F204-W245 AromaticContact CD2-CD1 3.49Å; F204-W245 VanDerWaalsContact CD2-CD1 3.49Å; F204-W245 AromaticContact CD2-CD2 3.59Å; F204-W245 HydrophobicContact CD2-CD2 3.59Å; F204-W245 AromaticContact CD2-CE2 3.71Å; F204-W245 HydrophobicContact CD2-CE3 4.29Å; F204-W245 AromaticContact CD2-CG 3.51Å; F204-W245 HydrophobicContact CD2-CG 3.51Å; F204-W245 AromaticContact CD2-NE1 3.63Å; F204-W245 HydrophobicContact CE1-CB 4.16Å; F204-W245 HydrophobicContact CE1-CG 4.36Å; F204-W245 HydrophobicContact CE2-CB 4.33Å; F204-W245 AromaticContact CE2-CD2 3.46Å; F204-W245 HydrophobicContact CE2-CD2 3.46Å; F204-W245 VanDerWaalsContact CE2-CD2 3.46Å; F204-W245 AromaticContact CE2-CE2 3.9Å; F204-W245 AromaticContact CE2-CE3 3.68Å; F204-W245 HydrophobicContact CE2-CE3 3.68Å; F204-W245 AromaticContact CE2-CG 3.71Å; F204-W245 HydrophobicContact CE2-CG 3.71Å; F204-W245 HydrophobicContact CE2-CZ3 4.28Å; F204-W245 HydrophobicContact CG-CB 4.17Å; F204-W245 AromaticContact CG-CD1 3.65Å; F204-W245 HydrophobicContact CG-CD2 4.34Å; F204-W245 AromaticContact CG-CG 3.77Å; F204-W245 HydrophobicContact CG-CG 3.77Å; F204-W245 HydrophobicContact CZ-CB 4.27Å; F204-W245 HydrophobicContact CZ-CD2 4.12Å; F204-W245 HydrophobicContact CZ-CE3 4.14Å; F204-W245 HydrophobicContact CZ-CG 4.14Å; F204-F246 HydrophobicContact CB-CE1 3.83Å; F204-F246 HydrophobicContact CB-CZ 4.36Å
205	I	95.2	Very high	92.8	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-62	-52.1	173.4	-62.9	159.1	0	0	0	110.1	S201 I202 L203 L207 S208 T209 F246 K315 L316	S201-I205 WeakPolarHBondContact O-CD1 3.28Å; S201-I205 VanDerWaalsContact O-CG1 3.27Å; S201-I205 WeakPolarHBondContact O-CG1 3.34Å; S201-I205 PolarHBondContact O-N 2.67Å; S201-I205 VanDerWaalsContact O-N 3.08Å; I202-I205 PolarHBondContact O-N 3.23Å; L203-I205 VanDerWaalsContact C-N 3.35Å; L203-I205 PolarHBondContact O-N 2.93Å; I205-L207 PolarHBondContact O-N 3.28Å; I205-S208 PolarHBondContact O-N 3.45Å; I205-S208 PolarHBondContact O-OG 2.94Å; I205-T209 PolarHBondContact O-N 3.37Å; I205-T209 PolarHBondContact O-OG1 3.01Å; I205-F246 HydrophobicContact CG1-CE1 3.86Å; I205-F246 HydrophobicContact CG1-CZ 3.95Å; I205-K315 HydrophobicContact CD1-CB 3.92Å; I205-K315 HydrophobicContact CD1-CD 3.91Å; I205-K315 HydrophobicContact CD1-CG 3.67Å; I205-K315 HydrophobicContact CG1-CB 4.32Å; I205-K315 HydrophobicContact CG1-CD 4.05Å; I205-K315 HydrophobicContact CG1-CG 4.26Å; I205-L316 HydrophobicContact CB-CD2 4.12Å; I205-L316 HydrophobicContact CD1-CD2 3.99Å; I205-L316 HydrophobicContact CG2-CD2 3.75Å; I205-L316 HydrophobicContact CG2-CG 3.85Å
206	V	94.7	Very high	92.6	Very high	63 Å²	63	51.1 Å²	51.1	38%	0.382	28%	0.281	S	S	.	.	H	α-helix	trans	-58.2	-49.6	178.8	172.8	0	0	0	0	111.4	I202 L203 S208 T209 I210	I202-V206 HydrophobicContact CG2-CG2 4.42Å; I202-V206 WeakPolarHBondContact O-CG2 3.37Å; I202-V206 PolarHBondContact O-N 2.59Å; L203-V206 PolarHBondContact O-N 3.49Å; V206-S208 VanDerWaalsContact C-N 3.33Å; V206-S208 PolarHBondContact O-N 3.41Å; V206-T209 WeakPolarHBondContact CA-OG1 3.27Å; V206-T209 PolarHBondContact O-N 3.44Å; V206-T209 VanDerWaalsContact O-N 3.16Å; V206-T209 PolarHBondContact O-OG1 3.08Å; V206-I210 HydrophobicContact CG1-CD1 3.78Å; V206-I210 HydrophobicContact CG1-CG1 4.47Å; V206-I210 WeakPolarHBondContact O-CG1 3.36Å; V206-I210 PolarHBondContact O-N 3.43Å
207	L	95	Very high	92.3	Very high	77 Å²	77	50.2 Å²	50.2	40%	0.403	28%	0.277	S	S	.	.	H	α-helix	trans	-56.7	-46	176.5	178.4	61.4	0	0	0	111.7	L203 I205 T209 I210 A211 V238	L203-L207 VanDerWaalsContact O-CB 3.32Å; L203-L207 WeakPolarHBondContact O-CB 3.39Å; L203-L207 PolarHBondContact O-N 3.11Å; I205-L207 PolarHBondContact O-N 3.28Å; L207-T209 VanDerWaalsContact C-N 3.31Å; L207-T209 PolarHBondContact O-N 3Å; L207-I210 PolarHBondContact O-N 3.05Å; L207-A211 WeakPolarHBondContact O-CB 3.5Å; L207-A211 PolarHBondContact O-N 2.88Å; L207-V238 HydrophobicContact CD1-CG1 4.18Å; L207-V238 HydrophobicContact CD2-CG1 4.29Å; L207-V238 HydrophobicContact CG-CG1 4.07Å
208	S	94.3	Very high	91.9	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-67.4	-29.4	179.6	76.5	0	0	0	0	113.4	F204 I205 V206 L212 R312	F204-S208 WeakPolarHBondContact O-CB 3.3Å; F204-S208 PolarHBondContact O-N 3.23Å; F204-S208 PolarHBondContact O-OG 2.77Å; I205-S208 PolarHBondContact O-N 3.45Å; I205-S208 PolarHBondContact O-OG 2.94Å; V206-S208 VanDerWaalsContact C-N 3.33Å; V206-S208 PolarHBondContact O-N 3.41Å; S208-L212 WeakPolarHBondContact O-CB 3.28Å; S208-L212 PolarHBondContact O-N 2.83Å; S208-L212 VanDerWaalsContact O-N 3.14Å; S208-R312 PolarHBondContact O-NH1 3.44Å; S208-R312 WeakPolarHBondContact OG-CD 3.39Å
209	T	92.4	Very high	91.5	Very high	31 Å²	31	58.7 Å²	58.7	19%	0.19	32%	0.321	C	S	.	.	H	α-helix	trans	-76.5	-35.9	172.3	49.6	0	0	0	0	112.6	I205 V206 L207 L212 S213 R312 I313	I205-T209 PolarHBondContact O-N 3.37Å; I205-T209 PolarHBondContact O-OG1 3.01Å; V206-T209 WeakPolarHBondContact CA-OG1 3.27Å; V206-T209 PolarHBondContact O-N 3.44Å; V206-T209 VanDerWaalsContact O-N 3.16Å; V206-T209 PolarHBondContact O-OG1 3.08Å; L207-T209 VanDerWaalsContact C-N 3.31Å; L207-T209 PolarHBondContact O-N 3Å; T209-L212 WeakPolarHBondContact O-CB 3.48Å; T209-L212 PolarHBondContact O-N 3.24Å; T209-S213 PolarHBondContact O-N 3.33Å; T209-S213 PolarHBondContact O-OG 3.28Å; T209-R312 HydrophobicContact CG2-CG 3.9Å; T209-I313 HydrophobicContact CG2-CB 4.19Å; T209-I313 HydrophobicContact CG2-CG1 4.24Å
210	I	93.3	Very high	91	Very high	86 Å²	86	56.3 Å²	56.3	44%	0.441	31%	0.309	S	S	.	.	H	α-helix	trans	-66.3	-45.2	173.7	-67.6	167.9	0	0	0	110	V206 L207 L212 S213 L214	V206-I210 HydrophobicContact CG1-CD1 3.78Å; V206-I210 HydrophobicContact CG1-CG1 4.47Å; V206-I210 WeakPolarHBondContact O-CG1 3.36Å; V206-I210 PolarHBondContact O-N 3.43Å; L207-I210 PolarHBondContact O-N 3.05Å; I210-L212 VanDerWaalsContact C-N 3.29Å; I210-L212 PolarHBondContact O-N 3.49Å; I210-S213 PolarHBondContact O-N 3.1Å; I210-S213 VanDerWaalsContact O-N 3.17Å; I210-L214 HydrophobicContact CG2-CD1 3.88Å; I210-L214 HydrophobicContact CG2-CG 4.26Å; I210-L214 WeakPolarHBondContact O-CG 3.34Å; I210-L214 PolarHBondContact O-N 2.97Å
211	A	91.8	Very high	90.6	Very high	5 Å²	5	56.1 Å²	56.1	4%	0.041	31%	0.306	C	S	.	.	H	α-helix	trans	-60.2	-37.2	175.5	0	0	0	0	0	112.4	L207 N215 V238	L207-A211 WeakPolarHBondContact O-CB 3.5Å; L207-A211 PolarHBondContact O-N 2.88Å; A211-N215 WeakPolarHBondContact O-CB 3.36Å; A211-N215 PolarHBondContact O-N 2.69Å; A211-V238 HydrophobicContact CB-CG1 4.02Å
212	L	89.2	Confident	90	Very high	29 Å²	29	59.1 Å²	59.1	15%	0.152	33%	0.325	C	S	.	.	H	α-helix	trans	-61.3	-50.2	171.9	179.8	57	0	0	0	111.6	S208 T209 I210 L214 N215 T216 R309 I310	S208-L212 WeakPolarHBondContact O-CB 3.28Å; S208-L212 PolarHBondContact O-N 2.83Å; S208-L212 VanDerWaalsContact O-N 3.14Å; T209-L212 WeakPolarHBondContact O-CB 3.48Å; T209-L212 PolarHBondContact O-N 3.24Å; I210-L212 VanDerWaalsContact C-N 3.29Å; I210-L212 PolarHBondContact O-N 3.49Å; L212-L214 PolarHBondContact O-N 2.88Å; L212-N215 PolarHBondContact O-N 2.97Å; L212-T216 PolarHBondContact O-N 3.28Å; L212-R309 HydrophobicContact CD1-CB 4.49Å; L212-I310 HydrophobicContact CD2-CB 4.34Å
213	S	90.3	Very high	89	Confident	74 Å²	74	59.7 Å²	59.7	52%	0.517	34%	0.338	S	S	.	.	H	α-helix	trans	-61	-44	178.9	-59.9	0	0	0	0	112.1	T209 I210 N215 T216	T209-S213 PolarHBondContact O-N 3.33Å; T209-S213 PolarHBondContact O-OG 3.28Å; I210-S213 PolarHBondContact O-N 3.1Å; I210-S213 VanDerWaalsContact O-N 3.17Å; S213-N215 VanDerWaalsContact C-N 3.34Å; S213-N215 PolarHBondContact O-N 3.4Å; S213-T216 PolarHBondContact O-N 3.41Å; S213-T216 PolarHBondContact O-OG1 2.72Å
214	L	91	Very high	87.8	Confident	69 Å²	69	57.5 Å²	57.5	36%	0.361	33%	0.327	S	S	.	.	H	α-helix	trans	-65	-36.1	177.9	-66.1	174.5	0	0	0	112.1	I210 L212 T216 L217 L220 L235	I210-L214 HydrophobicContact CG2-CD1 3.88Å; I210-L214 HydrophobicContact CG2-CG 4.26Å; I210-L214 WeakPolarHBondContact O-CG 3.34Å; I210-L214 PolarHBondContact O-N 2.97Å; L212-L214 PolarHBondContact O-N 2.88Å; L214-T216 PolarHBondContact O-N 3.05Å; L214-L217 HydrophobicContact CD2-CD1 3.89Å; L214-L217 WeakPolarHBondContact O-CB 3.31Å; L214-L217 PolarHBondContact O-N 3.29Å; L214-L217 VanDerWaalsContact O-N 3.12Å; L214-L220 HydrophobicContact CB-CD1 3.96Å; L214-L220 HydrophobicContact CD2-CD1 4.05Å; L214-L235 HydrophobicContact CB-CD2 3.6Å
215	N	86.6	Confident	86.5	Confident	4 Å²	4	64.7 Å²	64.7	2%	0.021	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-9.3	172	-94.9	-25.7	0	0	0	113.9	A211 L212 S213 Q221 N232 L235	A211-N215 WeakPolarHBondContact O-CB 3.36Å; A211-N215 PolarHBondContact O-N 2.69Å; L212-N215 PolarHBondContact O-N 2.97Å; S213-N215 VanDerWaalsContact C-N 3.34Å; S213-N215 PolarHBondContact O-N 3.4Å; N215-Q221 PolarHBondContact O-NE2 3.08Å; N215-N232 PolarHBondContact OD1-N 2.91Å; N215-L235 HydrophobicContact CB-CD2 4.34Å; N215-L235 WeakPolarHBondContact OD1-CB 3.42Å; N215-L235 WeakPolarHBondContact OD1-CD2 3.44Å
216	T	86.3	Confident	85.1	Confident	94 Å²	94	74 Å²	74	58%	0.577	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-11	171.2	65.9	0	0	0	0	114.3	L212 S213 L214	L212-T216 PolarHBondContact O-N 3.28Å; S213-T216 PolarHBondContact O-N 3.41Å; S213-T216 PolarHBondContact O-OG1 2.72Å; L214-T216 PolarHBondContact O-N 3.05Å
217	L	87.7	Confident	83.7	Confident	72 Å²	72	73.9 Å²	73.9	38%	0.377	41%	0.409	S	S	.	.			trans	-77.5	123.2	178.7	-63.8	179	0	0	0	110.7	L214 E219 L220 Q221	L214-L217 HydrophobicContact CD2-CD1 3.89Å; L214-L217 WeakPolarHBondContact O-CB 3.31Å; L214-L217 PolarHBondContact O-N 3.29Å; L214-L217 VanDerWaalsContact O-N 3.12Å; L217-E219 PolarHBondContact O-N 3.49Å; L217-L220 HydrophobicContact CB-CB 4.43Å; L217-L220 HydrophobicContact CB-CD1 4.35Å; L217-L220 HydrophobicContact CB-CG 4.32Å; L217-L220 HydrophobicContact CD1-CD1 4.02Å; L217-L220 PolarHBondContact O-N 3.46Å; L217-L220 VanDerWaalsContact O-N 3.11Å; L217-Q221 WeakPolarHBondContact O-CG 3.45Å; L217-Q221 PolarHBondContact O-N 2.91Å
218	P	83	Confident	82.4	Confident	89 Å²	89	73.9 Å²	73.9	58%	0.578	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-24.9	-178.3	27.3	-34.5	0	0	0	112.8	L220 Q221	P218-L220 PolarHBondContact O-N 3.42Å; P218-Q221 PolarHBondContact O-N 3.28Å
219	E	84.3	Confident	81.2	Confident	151 Å²	151	76.4 Å²	76.4	71%	0.706	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-19.2	176.5	-53.7	77.1	-168.9	0	0	113	L217	L217-E219 PolarHBondContact O-N 3.49Å
220	L	82.6	Confident	80.3	Confident	63 Å²	63	78.2 Å²	78.2	33%	0.33	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-17.3	177.7	-63	-178.4	0	0	0	112.9	L214 L217 P218 N232	L214-L220 HydrophobicContact CB-CD1 3.96Å; L214-L220 HydrophobicContact CD2-CD1 4.05Å; L217-L220 HydrophobicContact CB-CB 4.43Å; L217-L220 HydrophobicContact CB-CD1 4.35Å; L217-L220 HydrophobicContact CB-CG 4.32Å; L217-L220 HydrophobicContact CD1-CD1 4.02Å; L217-L220 PolarHBondContact O-N 3.46Å; L217-L220 VanDerWaalsContact O-N 3.11Å; P218-L220 PolarHBondContact O-N 3.42Å; L220-N232 WeakPolarHBondContact O-CB 3.38Å; L220-N232 PolarHBondContact O-ND2 3.29Å
221	Q	84.5	Confident	79.6	Confident	50 Å²	50	75.6 Å²	75.6	23%	0.234	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-71.3	138.8	176.3	-73.4	169.2	4.5	0	0	110.7	N215 L217 P218 A229	N215-Q221 PolarHBondContact O-NE2 3.08Å; L217-Q221 WeakPolarHBondContact O-CG 3.45Å; L217-Q221 PolarHBondContact O-N 2.91Å; P218-Q221 PolarHBondContact O-N 3.28Å; Q221-A229 HydrophobicContact CB-CB 4.21Å
222	V	81.4	Confident	79.4	Confident	68 Å²	68	76.6 Å²	76.6	41%	0.412	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	136.6	177.2	-179	0	0	0	0	108.7	N230	V222-N230 PolarHBondContact N-O 3.12Å; V222-N230 PolarHBondContact O-N 2.95Å
223	A	74.9	Confident	79.2	Confident	74 Å²	74	78.8 Å²	78.8	61%	0.612	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.6	123.4	171.9	0	0	0	0	0	110.3	Q228	A223-Q228 WeakPolarHBondContact CA-O 3.42Å
224	D	70.3	Confident	79.1	Confident	68 Å²	68	82.4 Å²	82.4	36%	0.364	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-64.6	167.1	168.4	-71.6	-32.4	0	0	0	111.4	Y226 G227 Q228 N230	D224-Y226 PolarHBondContact O-N 3.01Å; D224-G227 PolarHBondContact O-N 2.95Å; D224-Q228 PolarHBondContact N-O 3.2Å; D224-N230 WeakPolarHBondContact OD1-CB 3.16Å; D224-N230 PolarHBondContact OD1-ND2 2.9Å; D224-N230 PolarHBondContact OD2-ND2 3.27Å
225	E	67.8	Low	79.1	Confident	190 Å²	190	80.3 Å²	80.3	89%	0.888	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-22.4	174.9	-166.9	172.5	-171.4	0	0	114.2
226	Y	65.6	Low	79.1	Confident	198 Å²	198	81.9 Å²	81.9	78%	0.776	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	16.4	174.9	-59.9	-73.9	0	0	0	114.5	D224 Q228	D224-Y226 PolarHBondContact O-N 3.01Å; Y226-Q228 VanDerWaalsContact C-N 3.26Å; Y226-Q228 PolarHBondContact O-N 3.45Å
227	G	64.9	Low	79.3	Confident	59 Å²	59	84 Å²	84	61%	0.608	46%	0.458	S	S	*	.	S	Bend	trans	64.7	25.6	-179.1	0	0	0	0	0	114.1	D224	D224-G227 PolarHBondContact O-N 2.95Å
228	Q	69.1	Low	79.6	Confident	78 Å²	78	83.2 Å²	83.2	36%	0.364	46%	0.456	S	S	.	.			trans	-102.8	137.4	-178.9	-63.3	-61.1	-70.8	0	0	110.7	A223 D224 Y226 N230 R299	A223-Q228 WeakPolarHBondContact CA-O 3.42Å; D224-Q228 PolarHBondContact N-O 3.2Å; Y226-Q228 VanDerWaalsContact C-N 3.26Å; Y226-Q228 PolarHBondContact O-N 3.45Å; Q228-N230 PolarHBondContact O-N 2.93Å; Q228-R299 VanDerWaalsContact OE1-CZ 3.28Å
229	A	67.9	Low	80	Confident	53 Å²	53	79.2 Å²	79.2	44%	0.438	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	122.6	179.6	0	0	0	0	0	112.5	Q221	Q221-A229 HydrophobicContact CB-CB 4.21Å
230	N	75.1	Confident	80.4	Confident	69 Å²	69	73.5 Å²	73.5	37%	0.369	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	163.6	-175.9	-159.8	-2.9	0	0	0	112.1	V222 D224 Q228	V222-N230 PolarHBondContact N-O 3.12Å; V222-N230 PolarHBondContact O-N 2.95Å; D224-N230 WeakPolarHBondContact OD1-CB 3.16Å; D224-N230 PolarHBondContact OD1-ND2 2.9Å; D224-N230 PolarHBondContact OD2-ND2 3.27Å; Q228-N230 PolarHBondContact O-N 2.93Å
231	D	78.4	Confident	81	Confident	30 Å²	30	74.8 Å²	74.8	16%	0.16	42%	0.419	C	S	.	.			trans	-61.5	135.3	173	-84.5	-35.4	0	0	0	109.5	R306 R309	D231-R306 VanDerWaalsContact CG-NH2 3.32Å; D231-R306 IonicContact OD1-CZ 3.33Å; D231-R306 IonicContact OD1-NE 3.22Å; D231-R306 PolarHBondContact OD1-NE 3.12Å; D231-R306 IonicContact OD1-NH2 3.92Å; D231-R306 PolarHBondContact OD1-NH2 3.38Å; D231-R306 IonicContact OD2-NE 3.52Å; D231-R306 IonicContact OD2-NH2 3.02Å; D231-R309 IonicContact OD2-CZ 3.79Å; D231-R309 IonicContact OD2-NH1 2.99Å; D231-R309 PolarHBondContact OD2-NH1 2.88Å; D231-R309 IonicContact OD2-NH2 3.6Å
232	N	86.1	Confident	81.6	Confident	26 Å²	26	72.4 Å²	72.4	14%	0.139	41%	0.407	C	S	.	.			trans	-66.3	132	-179	-177.7	-62.4	0	0	0	110.2	N215 L220 Q234 L235 A236	N215-N232 PolarHBondContact OD1-N 2.91Å; L220-N232 WeakPolarHBondContact O-CB 3.38Å; L220-N232 PolarHBondContact O-ND2 3.29Å; N232-Q234 VanDerWaalsContact C-N 3.27Å; N232-Q234 PolarHBondContact O-N 3.14Å; N232-Q234 PolarHBondContact OD1-N 3.5Å; N232-L235 HydrophobicContact CB-CB 4.2Å; N232-L235 HydrophobicContact CB-CD1 4.16Å; N232-L235 HydrophobicContact CB-CD2 4.41Å; N232-L235 HydrophobicContact CB-CG 4.48Å; N232-L235 PolarHBondContact O-N 3.39Å; N232-L235 VanDerWaalsContact O-N 3.1Å; N232-A236 WeakPolarHBondContact O-CB 3.41Å; N232-A236 PolarHBondContact O-N 2.87Å
233	P	86.1	Confident	82.2	Confident	75 Å²	75	69.4 Å²	69.4	49%	0.487	39%	0.389	S	S	.	.	H	α-helix	trans	-60.3	-32.7	-174.3	22.6	-33.5	0	0	0	113.5	H237	P233-H237 PolarHBondContact O-N 2.86Å; P233-H237 PolarHBondContact O-ND1 3.3Å
234	Q	88.5	Confident	83.2	Confident	150 Å²	150	68.5 Å²	68.5	70%	0.701	38%	0.381	S	S	*	.	H	α-helix	trans	-72.5	-41.5	176.6	-63.8	-170.2	-1.7	0	0	111.8	N232 A236 H237 V238	N232-Q234 VanDerWaalsContact C-N 3.27Å; N232-Q234 PolarHBondContact O-N 3.14Å; N232-Q234 PolarHBondContact OD1-N 3.5Å; Q234-A236 VanDerWaalsContact C-N 3.32Å; Q234-A236 PolarHBondContact O-N 3.42Å; Q234-H237 WeakPolarHBondContact O-CB 3.43Å; Q234-H237 PolarHBondContact O-N 3.23Å; Q234-V238 PolarHBondContact O-N 2.87Å; Q234-V238 VanDerWaalsContact O-N 3.13Å
235	L	89.3	Confident	84.5	Confident	26 Å²	26	67.8 Å²	67.8	14%	0.136	37%	0.374	C	S	.	.	H	α-helix	trans	-71	-30.5	177.4	-77.1	59.1	0	0	0	111.4	L214 N215 N232 H237 V238 E239	L214-L235 HydrophobicContact CB-CD2 3.6Å; N215-L235 HydrophobicContact CB-CD2 4.34Å; N215-L235 WeakPolarHBondContact OD1-CB 3.42Å; N215-L235 WeakPolarHBondContact OD1-CD2 3.44Å; N232-L235 HydrophobicContact CB-CB 4.2Å; N232-L235 HydrophobicContact CB-CD1 4.16Å; N232-L235 HydrophobicContact CB-CD2 4.41Å; N232-L235 HydrophobicContact CB-CG 4.48Å; N232-L235 PolarHBondContact O-N 3.39Å; N232-L235 VanDerWaalsContact O-N 3.1Å; L235-H237 VanDerWaalsContact C-N 3.34Å; L235-V238 PolarHBondContact O-N 3.42Å; L235-E239 WeakPolarHBondContact O-CB 3.35Å; L235-E239 PolarHBondContact O-N 2.94Å
236	A	87.6	Confident	85.9	Confident	37 Å²	37	58.8 Å²	58.8	31%	0.306	33%	0.332	S	S	.	.	H	α-helix	trans	-63.8	-36.2	171.2	0	0	0	0	0	112.3	N232 Q234 E239 A240	N232-A236 WeakPolarHBondContact O-CB 3.41Å; N232-A236 PolarHBondContact O-N 2.87Å; Q234-A236 VanDerWaalsContact C-N 3.32Å; Q234-A236 PolarHBondContact O-N 3.42Å; A236-E239 PolarHBondContact O-N 2.98Å; A236-A240 WeakPolarHBondContact O-CB 3.32Å; A236-A240 PolarHBondContact O-N 3.18Å
237	H	91.3	Very high	87.3	Confident	138 Å²	138	50.7 Å²	50.7	64%	0.639	30%	0.303	S	S	*	.	H	α-helix	trans	-65.8	-43.9	170.4	-77.6	79.1	0	0	0	111.7	P233 Q234 L235 E239 A240 V241	P233-H237 PolarHBondContact O-N 2.86Å; P233-H237 PolarHBondContact O-ND1 3.3Å; Q234-H237 WeakPolarHBondContact O-CB 3.43Å; Q234-H237 PolarHBondContact O-N 3.23Å; L235-H237 VanDerWaalsContact C-N 3.34Å; H237-E239 VanDerWaalsContact C-N 3.32Å; H237-E239 PolarHBondContact O-N 3.46Å; H237-A240 PolarHBondContact O-N 2.85Å; H237-V241 WeakPolarHBondContact O-CG2 3.38Å; H237-V241 PolarHBondContact O-N 3.4Å
238	V	92.9	Very high	88.8	Confident	55 Å²	55	51.8 Å²	51.8	33%	0.333	29%	0.293	S	S	.	.	H	α-helix	trans	-60.1	-42.3	175.3	175.7	0	0	0	0	111.1	L207 A211 Q234 L235 V241 C242	L207-V238 HydrophobicContact CD1-CG1 4.18Å; L207-V238 HydrophobicContact CD2-CG1 4.29Å; L207-V238 HydrophobicContact CG-CG1 4.07Å; A211-V238 HydrophobicContact CB-CG1 4.02Å; Q234-V238 PolarHBondContact O-N 2.87Å; Q234-V238 VanDerWaalsContact O-N 3.13Å; L235-V238 PolarHBondContact O-N 3.42Å; V238-V241 PolarHBondContact O-N 2.79Å; V238-C242 PolarHBondContact O-N 3.4Å; V238-C242 PolarHBondContact O-SG 2.98Å
239	E	91.9	Very high	90.1	Very high	6 Å²	6	48.3 Å²	48.3	3%	0.028	28%	0.277	C	S	.	.	H	α-helix	trans	-64.4	-45.2	175.3	178.7	153.2	-103.7	0	0	112.1	L235 A236 H237 V241 C242 I243 Y279 R309 R312	L235-E239 WeakPolarHBondContact O-CB 3.35Å; L235-E239 PolarHBondContact O-N 2.94Å; A236-E239 PolarHBondContact O-N 2.98Å; H237-E239 VanDerWaalsContact C-N 3.32Å; H237-E239 PolarHBondContact O-N 3.46Å; E239-V241 VanDerWaalsContact C-N 3.31Å; E239-V241 PolarHBondContact O-N 2.99Å; E239-C242 PolarHBondContact O-N 2.96Å; E239-C242 VanDerWaalsContact O-N 3.16Å; E239-I243 HydrophobicContact CG-CG1 4.2Å; E239-I243 WeakPolarHBondContact O-CG1 3.29Å; E239-I243 PolarHBondContact O-N 3.37Å; E239-Y279 HydrophobicContact CG-CD2 4.47Å; E239-R309 IonicContact OE2-CZ 3.35Å; E239-R309 IonicContact OE2-NE 2.67Å; E239-R309 IonicContact OE2-NH1 2.69Å; E239-R309 PolarHBondContact OE2-NH1 2.73Å; E239-R312 IonicContact OE1-CZ 2.78Å; E239-R312 IonicContact OE1-NH1 2.65Å; E239-R312 PolarHBondContact OE1-NH1 3.46Å; E239-R312 IonicContact OE1-NH2 2.67Å; E239-R312 PolarHBondContact OE1-NH2 2.92Å
240	A	92.6	Very high	91.3	Very high	31 Å²	31	46.8 Å²	46.8	26%	0.256	26%	0.26	S	S	.	.	H	α-helix	trans	-58.2	-42.2	176.3	0	0	0	0	0	112.1	A236 H237 I243 A244	A236-A240 WeakPolarHBondContact O-CB 3.32Å; A236-A240 PolarHBondContact O-N 3.18Å; H237-A240 PolarHBondContact O-N 2.85Å; A240-I243 PolarHBondContact O-N 3.06Å; A240-A244 WeakPolarHBondContact O-CB 3.42Å; A240-A244 PolarHBondContact O-N 3.17Å
241	V	95.8	Very high	92.2	Very high	89 Å²	89	48.1 Å²	48.1	54%	0.539	27%	0.266	S	S	.	.	H	α-helix	trans	-65.4	-41.4	175.2	173.3	0	0	0	0	111.7	F204 H237 V238 E239 A244 W245	F204-V241 HydrophobicContact CE1-CG1 4.23Å; H237-V241 WeakPolarHBondContact O-CG2 3.38Å; H237-V241 PolarHBondContact O-N 3.4Å; V238-V241 PolarHBondContact O-N 2.79Å; E239-V241 VanDerWaalsContact C-N 3.31Å; E239-V241 PolarHBondContact O-N 2.99Å; V241-A244 PolarHBondContact O-N 3.41Å; V241-W245 PolarHBondContact O-N 2.8Å
242	C	95.5	Very high	92.9	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-64.8	-41.4	175.9	-65.9	0	0	0	0	112.4	V238 E239 W245 F246	V238-C242 PolarHBondContact O-N 3.4Å; V238-C242 PolarHBondContact O-SG 2.98Å; E239-C242 PolarHBondContact O-N 2.96Å; E239-C242 VanDerWaalsContact O-N 3.16Å; C242-W245 PolarHBondContact O-N 3.38Å; C242-F246 HydrophobicContact CB-CE2 4.5Å; C242-F246 WeakPolarHBondContact O-CD2 3.3Å; C242-F246 VanDerWaalsContact O-CG 3.28Å; C242-F246 WeakPolarHBondContact O-CG 3.34Å; C242-F246 PolarHBondContact O-N 3.21Å
243	I	95.6	Very high	93.2	Very high	6 Å²	6	48.4 Å²	48.4	3%	0.031	27%	0.267	C	S	.	.	H	α-helix	trans	-68.9	-37.5	176.4	-64	-69	0	0	0	111	E239 A240 W245 F246 T247 Y279 Y280	E239-I243 HydrophobicContact CG-CG1 4.2Å; E239-I243 WeakPolarHBondContact O-CG1 3.29Å; E239-I243 PolarHBondContact O-N 3.37Å; A240-I243 PolarHBondContact O-N 3.06Å; I243-W245 VanDerWaalsContact C-N 3.33Å; I243-W245 PolarHBondContact O-N 3.42Å; I243-F246 HydrophobicContact CD1-CD2 4.37Å; I243-F246 PolarHBondContact O-N 2.85Å; I243-T247 HydrophobicContact CG2-CG2 4.13Å; I243-T247 WeakPolarHBondContact O-CB 3.42Å; I243-T247 VanDerWaalsContact O-CG2 3.32Å; I243-T247 WeakPolarHBondContact O-CG2 3.49Å; I243-T247 PolarHBondContact O-N 2.94Å; I243-T247 PolarHBondContact O-OG1 3.31Å; I243-Y279 HydrophobicContact CB-CD1 4.39Å; I243-Y279 HydrophobicContact CB-CG 4.34Å; I243-Y279 HydrophobicContact CG1-CD2 4.13Å; I243-Y279 HydrophobicContact CG1-CG 4.02Å; I243-Y279 HydrophobicContact CG2-CD1 3.69Å; I243-Y279 HydrophobicContact CG2-CE1 4.27Å; I243-Y279 HydrophobicContact CG2-CG 3.93Å; I243-Y280 HydrophobicContact CG2-CE2 3.88Å
244	A	96.3	Very high	93.4	Very high	54 Å²	54	47.3 Å²	47.3	45%	0.446	26%	0.255	S	S	.	.	H	α-helix	trans	-60.2	-42.3	172.1	0	0	0	0	0	111.6	A240 V241 T247 M248	A240-A244 WeakPolarHBondContact O-CB 3.42Å; A240-A244 PolarHBondContact O-N 3.17Å; V241-A244 PolarHBondContact O-N 3.41Å; A244-T247 WeakPolarHBondContact CA-OG1 3.39Å; A244-T247 PolarHBondContact O-OG1 3.12Å; A244-T247 VanDerWaalsContact O-OG1 3.05Å; A244-M248 VanDerWaalsContact O-CB 3.3Å; A244-M248 WeakPolarHBondContact O-CB 3.28Å; A244-M248 PolarHBondContact O-N 2.8Å
245	W	96.8	Very high	93.5	Very high	54 Å²	54	44.7 Å²	44.7	21%	0.205	25%	0.245	C	C	.	.	H	α-helix	trans	-63.6	-47	173.6	-177.6	-91.5	0	0	0	112.4	L197 I200 F204 V241 C242 I243 T247 M248 E249	L197-W245 HydrophobicContact CD2-CH2 4.45Å; I200-W245 HydrophobicContact CB-CZ2 4.4Å; I200-W245 HydrophobicContact CG2-CH2 3.78Å; I200-W245 HydrophobicContact CG2-CZ2 3.5Å; I200-W245 VanDerWaalsContact CG2-CZ2 3.5Å; I200-W245 HydrophobicContact CG2-CZ3 4.48Å; F204-W245 HydrophobicContact CB-CG 4.37Å; F204-W245 HydrophobicContact CD1-CB 4.1Å; F204-W245 HydrophobicContact CD1-CG 4.19Å; F204-W245 HydrophobicContact CD2-CB 4.28Å; F204-W245 AromaticContact CD2-CD1 3.49Å; F204-W245 VanDerWaalsContact CD2-CD1 3.49Å; F204-W245 AromaticContact CD2-CD2 3.59Å; F204-W245 HydrophobicContact CD2-CD2 3.59Å; F204-W245 AromaticContact CD2-CE2 3.71Å; F204-W245 HydrophobicContact CD2-CE3 4.29Å; F204-W245 AromaticContact CD2-CG 3.51Å; F204-W245 HydrophobicContact CD2-CG 3.51Å; F204-W245 AromaticContact CD2-NE1 3.63Å; F204-W245 HydrophobicContact CE1-CB 4.16Å; F204-W245 HydrophobicContact CE1-CG 4.36Å; F204-W245 HydrophobicContact CE2-CB 4.33Å; F204-W245 AromaticContact CE2-CD2 3.46Å; F204-W245 HydrophobicContact CE2-CD2 3.46Å; F204-W245 VanDerWaalsContact CE2-CD2 3.46Å; F204-W245 AromaticContact CE2-CE2 3.9Å; F204-W245 AromaticContact CE2-CE3 3.68Å; F204-W245 HydrophobicContact CE2-CE3 3.68Å; F204-W245 AromaticContact CE2-CG 3.71Å; F204-W245 HydrophobicContact CE2-CG 3.71Å; F204-W245 HydrophobicContact CE2-CZ3 4.28Å; F204-W245 HydrophobicContact CG-CB 4.17Å; F204-W245 AromaticContact CG-CD1 3.65Å; F204-W245 HydrophobicContact CG-CD2 4.34Å; F204-W245 AromaticContact CG-CG 3.77Å; F204-W245 HydrophobicContact CG-CG 3.77Å; F204-W245 HydrophobicContact CZ-CB 4.27Å; F204-W245 HydrophobicContact CZ-CD2 4.12Å; F204-W245 HydrophobicContact CZ-CE3 4.14Å; F204-W245 HydrophobicContact CZ-CG 4.14Å; V241-W245 PolarHBondContact O-N 2.8Å; C242-W245 PolarHBondContact O-N 3.38Å; I243-W245 VanDerWaalsContact C-N 3.33Å; I243-W245 PolarHBondContact O-N 3.42Å; W245-T247 PolarHBondContact O-N 3.48Å; W245-M248 HydrophobicContact CD2-CE 4.05Å; W245-M248 HydrophobicContact CE3-CE 3.54Å; W245-M248 HydrophobicContact CH2-CE 3.92Å; W245-M248 HydrophobicContact CZ2-CE 4.37Å; W245-M248 HydrophobicContact CZ3-CE 3.48Å; W245-M248 VanDerWaalsContact CZ3-CE 3.48Å; W245-M248 PolarHBondContact O-N 3.43Å; W245-E249 PolarHBondContact NE1-OE1 2.84Å; W245-E249 WeakPolarHBondContact O-CB 3.41Å; W245-E249 PolarHBondContact O-N 3.4Å
246	F	96.3	Very high	93.4	Very high	1 Å²	1	43.5 Å²	43.5	0%	0.004	24%	0.239	C	C	.	.	H	α-helix	trans	-66.4	-34.9	179.4	-62.3	-24.2	0	0	0	113.7	F204 I205 C242 I243 E249 Y250 I276 K315	F204-F246 HydrophobicContact CB-CE1 3.83Å; F204-F246 HydrophobicContact CB-CZ 4.36Å; I205-F246 HydrophobicContact CG1-CE1 3.86Å; I205-F246 HydrophobicContact CG1-CZ 3.95Å; C242-F246 HydrophobicContact CB-CE2 4.5Å; C242-F246 WeakPolarHBondContact O-CD2 3.3Å; C242-F246 VanDerWaalsContact O-CG 3.28Å; C242-F246 WeakPolarHBondContact O-CG 3.34Å; C242-F246 PolarHBondContact O-N 3.21Å; I243-F246 HydrophobicContact CD1-CD2 4.37Å; I243-F246 PolarHBondContact O-N 2.85Å; F246-E249 WeakPolarHBondContact O-CB 3.27Å; F246-Y250 WeakPolarHBondContact O-CB 3.24Å; F246-Y250 PolarHBondContact O-N 3.04Å; F246-I276 HydrophobicContact CB-CG2 3.5Å; F246-I276 VanDerWaalsContact CB-CG2 3.5Å; F246-K315 HydrophobicContact CD1-CD 4.28Å; F246-K315 HydrophobicContact CE1-CD 4.42Å
247	T	96.6	Very high	93.3	Very high	28 Å²	28	41.8 Å²	41.8	17%	0.172	23%	0.225	C	C	.	.	H	α-helix	trans	-74.1	-38.9	176.8	51	0	0	0	0	112.2	I243 A244 W245 Y250 L251 I276 Y280	I243-T247 HydrophobicContact CG2-CG2 4.13Å; I243-T247 WeakPolarHBondContact O-CB 3.42Å; I243-T247 VanDerWaalsContact O-CG2 3.32Å; I243-T247 WeakPolarHBondContact O-CG2 3.49Å; I243-T247 PolarHBondContact O-N 2.94Å; I243-T247 PolarHBondContact O-OG1 3.31Å; A244-T247 WeakPolarHBondContact CA-OG1 3.39Å; A244-T247 PolarHBondContact O-OG1 3.12Å; A244-T247 VanDerWaalsContact O-OG1 3.05Å; W245-T247 PolarHBondContact O-N 3.48Å; T247-Y250 PolarHBondContact O-N 3.44Å; T247-L251 VanDerWaalsContact O-CB 3.24Å; T247-L251 WeakPolarHBondContact O-CB 3.35Å; T247-L251 PolarHBondContact O-N 2.72Å; T247-I276 HydrophobicContact CG2-CB 3.92Å; T247-I276 HydrophobicContact CG2-CD1 3.71Å; T247-I276 HydrophobicContact CG2-CG1 4.39Å; T247-I276 HydrophobicContact CG2-CG2 3.88Å; T247-Y280 HydrophobicContact CG2-CE2 3.46Å; T247-Y280 VanDerWaalsContact CG2-CE2 3.46Å; T247-Y280 VanDerWaalsContact CG2-OH 3.24Å; T247-Y280 WeakPolarHBondContact CG2-OH 3.37Å
248	M	95.8	Very high	92.8	Very high	82 Å²	82	36.2 Å²	36.2	40%	0.404	20%	0.201	S	C	.	.	H	α-helix	trans	-58.2	-48.7	168.5	-176.3	-170	67.9	0	0	110.8	A244 W245 Y250 L251 L252	A244-M248 VanDerWaalsContact O-CB 3.3Å; A244-M248 WeakPolarHBondContact O-CB 3.28Å; A244-M248 PolarHBondContact O-N 2.8Å; W245-M248 HydrophobicContact CD2-CE 4.05Å; W245-M248 HydrophobicContact CE3-CE 3.54Å; W245-M248 HydrophobicContact CH2-CE 3.92Å; W245-M248 HydrophobicContact CZ2-CE 4.37Å; W245-M248 HydrophobicContact CZ3-CE 3.48Å; W245-M248 VanDerWaalsContact CZ3-CE 3.48Å; W245-M248 PolarHBondContact O-N 3.43Å; M248-Y250 PolarHBondContact O-N 2.65Å; M248-L251 PolarHBondContact O-N 2.8Å; M248-L252 HydrophobicContact CG-CD1 3.83Å; M248-L252 HydrophobicContact CG-CG 4.32Å; M248-L252 WeakPolarHBondContact O-CB 3.5Å; M248-L252 WeakPolarHBondContact O-CG 3.38Å; M248-L252 PolarHBondContact O-N 2.78Å; M248-L252 HydrophobicContact SD-CD1 4.42Å
249	E	95	Very high	92.3	Very high	5 Å²	5	37.3 Å²	37.3	2%	0.023	21%	0.205	C	C	.	.	H	α-helix	trans	-55.6	-48.8	174.4	-93.4	-169	-150	0	0	112.6	S201 W245 F246 L252 R253 K315	S201-E249 VanDerWaalsContact CB-OE1 3.31Å; S201-E249 WeakPolarHBondContact CB-OE1 3.28Å; S201-E249 PolarHBondContact OG-OE1 3Å; S201-E249 VanDerWaalsContact OG-OE1 3.06Å; W245-E249 PolarHBondContact NE1-OE1 2.84Å; W245-E249 WeakPolarHBondContact O-CB 3.41Å; W245-E249 PolarHBondContact O-N 3.4Å; F246-E249 WeakPolarHBondContact O-CB 3.27Å; E249-L252 PolarHBondContact O-N 2.93Å; E249-R253 WeakPolarHBondContact O-CG 3.36Å; E249-R253 PolarHBondContact O-N 3.37Å; E249-R253 IonicContact OE2-CZ 2.71Å; E249-R253 IonicContact OE2-NH1 2.92Å; E249-R253 PolarHBondContact OE2-NH1 2.88Å; E249-R253 IonicContact OE2-NH2 2.73Å; E249-K315 VanDerWaalsContact OE2-CE 3.23Å; E249-K315 WeakPolarHBondContact OE2-CE 3.26Å; E249-K315 IonicContact OE2-NZ 3.18Å; E249-K315 PolarHBondContact OE2-NZ 3.16Å
250	Y	94.9	Very high	92.1	Very high	21 Å²	21	40.1 Å²	40.1	8%	0.082	22%	0.217	C	C	.	.	H	α-helix	trans	-64.2	-43.9	-178.4	-174.1	-106.5	0	0	0	111.5	F246 T247 M248 R253 F254 F263 F264 N269 D272 L273 I276	F246-Y250 WeakPolarHBondContact O-CB 3.24Å; F246-Y250 PolarHBondContact O-N 3.04Å; T247-Y250 PolarHBondContact O-N 3.44Å; M248-Y250 PolarHBondContact O-N 2.65Å; Y250-R253 PolarHBondContact O-N 2.86Å; Y250-F254 VanDerWaalsContact O-CB 3.3Å; Y250-F254 WeakPolarHBondContact O-CB 3.31Å; Y250-F254 PolarHBondContact O-N 2.97Å; Y250-F263 HydrophobicContact CD2-CE1 4.41Å; Y250-F263 HydrophobicContact CD2-CZ 4.4Å; Y250-F263 AromaticContact CE2-CE1 3.78Å; Y250-F263 HydrophobicContact CE2-CE1 3.78Å; Y250-F263 HydrophobicContact CE2-CZ 4.12Å; Y250-F263 AromaticContact CZ-CE1 3.95Å; Y250-F264 HydrophobicContact CE1-CE1 4.43Å; Y250-F264 WeakPolarHBondContact OH-CD1 3.32Å; Y250-F264 VanDerWaalsContact OH-CE1 3.22Å; Y250-F264 WeakPolarHBondContact OH-CE1 3.32Å; Y250-N269 WeakPolarHBondContact CE2-O 3.4Å; Y250-D272 HydrophobicContact CD2-CB 3.68Å; Y250-D272 HydrophobicContact CE2-CB 4.1Å; Y250-L273 HydrophobicContact CE1-CD1 4.16Å; Y250-L273 HydrophobicContact CE2-CB 4.17Å; Y250-I276 HydrophobicContact CD1-CD1 4.11Å; Y250-I276 HydrophobicContact CG-CD1 4.29Å
251	L	94	Very high	91.8	Very high	96 Å²	96	48.3 Å²	48.3	50%	0.503	24%	0.242	S	C	.	.	H	α-helix	trans	-64.7	-43.1	176.9	-178.6	60.4	0	0	0	111.6	T247 M248 F254 L255	T247-L251 VanDerWaalsContact O-CB 3.24Å; T247-L251 WeakPolarHBondContact O-CB 3.35Å; T247-L251 PolarHBondContact O-N 2.72Å; M248-L251 PolarHBondContact O-N 2.8Å; L251-F254 PolarHBondContact O-N 3.1Å; L251-L255 HydrophobicContact CD1-CD1 4.02Å; L251-L255 HydrophobicContact CD1-CG 4.01Å; L251-L255 HydrophobicContact CG-CD1 3.89Å; L251-L255 HydrophobicContact CG-CG 4.32Å; L251-L255 WeakPolarHBondContact O-CB 3.2Å; L251-L255 WeakPolarHBondContact O-CG 3.35Å; L251-L255 PolarHBondContact O-N 3.18Å
252	L	92.4	Very high	91.3	Very high	57 Å²	57	50.4 Å²	50.4	30%	0.298	24%	0.243	S	C	.	.	H	α-helix	trans	-64.4	-40.3	176.8	-72	171.9	0	0	0	112	L185 M248 E249 S256	L185-L252 HydrophobicContact CD1-CB 3.68Å; M248-L252 HydrophobicContact CG-CD1 3.83Å; M248-L252 HydrophobicContact CG-CG 4.32Å; M248-L252 WeakPolarHBondContact O-CB 3.5Å; M248-L252 WeakPolarHBondContact O-CG 3.38Å; M248-L252 PolarHBondContact O-N 2.78Å; M248-L252 HydrophobicContact SD-CD1 4.42Å; E249-L252 PolarHBondContact O-N 2.93Å; L252-S256 WeakPolarHBondContact O-CB 3.35Å; L252-S256 PolarHBondContact O-N 2.97Å; L252-S256 PolarHBondContact O-OG 3.3Å
253	R	91.5	Very high	90.9	Very high	6 Å²	6	50.8 Å²	50.8	2%	0.023	25%	0.245	C	C	.	.	H	α-helix	trans	-65.7	-44.3	172	-73.4	-171.8	-177.4	97.8	9	111.9	L185 E186 E249 Y250 S256 S257 F263	L185-R253 HydrophobicContact CB-CG 3.97Å; L185-R253 HydrophobicContact CD1-CG 4.22Å; L185-R253 PolarHBondContact O-NE 3.18Å; L185-R253 VanDerWaalsContact O-NE 3.15Å; L185-R253 PolarHBondContact O-NH2 3.42Å; E186-R253 IonicContact OE2-NE 2.88Å; E249-R253 WeakPolarHBondContact O-CG 3.36Å; E249-R253 PolarHBondContact O-N 3.37Å; E249-R253 IonicContact OE2-CZ 2.71Å; E249-R253 IonicContact OE2-NH1 2.92Å; E249-R253 PolarHBondContact OE2-NH1 2.88Å; E249-R253 IonicContact OE2-NH2 2.73Å; Y250-R253 PolarHBondContact O-N 2.86Å; R253-S256 PolarHBondContact O-N 2.89Å; R253-S256 PolarHBondContact O-OG 3.26Å; R253-S257 VanDerWaalsContact O-CB 3.32Å; R253-S257 WeakPolarHBondContact O-CB 3.32Å; R253-S257 PolarHBondContact O-N 2.76Å; R253-F263 HydrophobicContact CB-CE2 3.82Å; R253-F263 HydrophobicContact CB-CZ 3.77Å
254	F	91.8	Very high	90.6	Very high	51 Å²	51	54.6 Å²	54.6	22%	0.224	26%	0.262	C	S	.	.	H	α-helix	trans	-59.5	-49.1	176	175.8	-106.3	0	0	0	111.6	Y250 L251 S257 K260 F263 F264	Y250-F254 VanDerWaalsContact O-CB 3.3Å; Y250-F254 WeakPolarHBondContact O-CB 3.31Å; Y250-F254 PolarHBondContact O-N 2.97Å; L251-F254 PolarHBondContact O-N 3.1Å; F254-S257 PolarHBondContact O-OG 3.24Å; F254-K260 HydrophobicContact CD2-CD 4.38Å; F254-K260 HydrophobicContact CE2-CB 3.89Å; F254-K260 HydrophobicContact CE2-CD 3.91Å; F254-K260 HydrophobicContact CE2-CG 4.2Å; F254-K260 HydrophobicContact CZ-CB 4.25Å; F254-K260 HydrophobicContact CZ-CD 4.06Å; F254-K260 HydrophobicContact CZ-CG 4.22Å; F254-K260 PolarHBondContact O-NZ 3.3Å; F254-F263 HydrophobicContact CB-CD1 4.37Å; F254-F263 HydrophobicContact CB-CE1 3.89Å; F254-F263 HydrophobicContact CB-CZ 4.37Å; F254-F263 AromaticContact CD2-CD1 3.79Å; F254-F263 HydrophobicContact CD2-CD1 3.79Å; F254-F263 HydrophobicContact CD2-CE1 4.1Å; F254-F264 HydrophobicContact CD2-CE2 4.01Å; F254-F264 HydrophobicContact CD2-CZ 4.1Å; F254-F264 HydrophobicContact CE2-CD2 4.03Å; F254-F264 AromaticContact CE2-CE2 3.32Å; F254-F264 HydrophobicContact CE2-CE2 3.32Å; F254-F264 AromaticContact CE2-CZ 3.77Å; F254-F264 HydrophobicContact CE2-CZ 3.77Å; F254-F264 AromaticContact CZ-CE2 4Å; F254-F264 HydrophobicContact CZ-CE2 4Å; F254-F264 HydrophobicContact CZ-CZ 4.38Å
255	L	89.5	Confident	90.2	Very high	96 Å²	96	60.2 Å²	60.2	50%	0.503	28%	0.276	S	S	.	.	H	α-helix	trans	-63.4	-43.8	179.4	-71.6	172.1	0	0	0	112.1	L251 K260	L251-L255 HydrophobicContact CD1-CD1 4.02Å; L251-L255 HydrophobicContact CD1-CG 4.01Å; L251-L255 HydrophobicContact CG-CD1 3.89Å; L251-L255 HydrophobicContact CG-CG 4.32Å; L251-L255 WeakPolarHBondContact O-CB 3.2Å; L251-L255 WeakPolarHBondContact O-CG 3.35Å; L251-L255 PolarHBondContact O-N 3.18Å; L255-K260 PolarHBondContact O-NZ 2.92Å
256	S	87.6	Confident	89.9	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-71.7	-36.9	179.6	54.1	0	0	0	0	113.8	R178 L252 R253	R178-S256 WeakPolarHBondContact CG-O 3.27Å; R178-S256 PolarHBondContact NE-O 3.39Å; L252-S256 WeakPolarHBondContact O-CB 3.35Å; L252-S256 PolarHBondContact O-N 2.97Å; L252-S256 PolarHBondContact O-OG 3.3Å; R253-S256 PolarHBondContact O-N 2.89Å; R253-S256 PolarHBondContact O-OG 3.26Å
257	S	86.1	Confident	89.5	Confident	1 Å²	1	63 Å²	63	1%	0.007	30%	0.304	C	S	.	.			trans	-48.4	140.4	-178	69.7	0	0	0	0	113.3	R178 R253 F254 K260	R178-S257 PolarHBondContact NH2-O 3.22Å; R253-S257 VanDerWaalsContact O-CB 3.32Å; R253-S257 WeakPolarHBondContact O-CB 3.32Å; R253-S257 PolarHBondContact O-N 2.76Å; F254-S257 PolarHBondContact O-OG 3.24Å; S257-K260 PolarHBondContact O-NZ 3.45Å
258	P	79.7	Confident	89.2	Confident	21 Å²	21	64 Å²	64	14%	0.136	31%	0.308	C	S	.	.	S	Bend	trans	-64.8	-64.9	178.8	23	-30.3	0	0	0	110.9	F169 R178	F169-P258 HydrophobicContact CE2-CB 4.27Å; F169-P258 HydrophobicContact CZ-CB 4.4Å; R178-P258 PolarHBondContact NH2-O 3.09Å
259	N	82.9	Confident	89.1	Confident	79 Å²	79	60.7 Å²	60.7	42%	0.422	29%	0.292	S	S	.	.			trans	-103.1	106.5	-173.3	-87.9	-47.7	0	0	0	112.5	W261 K262 F263	N259-W261 PolarHBondContact O-N 2.86Å; N259-K262 HydrophobicContact CB-CB 3.96Å; N259-K262 PolarHBondContact O-N 2.76Å; N259-K262 VanDerWaalsContact O-N 3.15Å; N259-F263 PolarHBondContact O-N 3.07Å
260	K	87.2	Confident	89	Confident	64 Å²	64	63.2 Å²	63.2	28%	0.278	31%	0.308	S	S	.	.	H	α-helix	trans	-61	-39.6	-171.4	-52.9	-49.5	-178.6	-168.8	0	113.9	F254 L255 S257 F263 F264	F254-K260 HydrophobicContact CD2-CD 4.38Å; F254-K260 HydrophobicContact CE2-CB 3.89Å; F254-K260 HydrophobicContact CE2-CD 3.91Å; F254-K260 HydrophobicContact CE2-CG 4.2Å; F254-K260 HydrophobicContact CZ-CB 4.25Å; F254-K260 HydrophobicContact CZ-CD 4.06Å; F254-K260 HydrophobicContact CZ-CG 4.22Å; F254-K260 PolarHBondContact O-NZ 3.3Å; L255-K260 PolarHBondContact O-NZ 2.92Å; S257-K260 PolarHBondContact O-NZ 3.45Å; K260-F263 WeakPolarHBondContact O-CB 3.34Å; K260-F263 PolarHBondContact O-N 3.06Å; K260-F264 WeakPolarHBondContact O-CD2 3.43Å; K260-F264 PolarHBondContact O-N 3.09Å
261	W	86.5	Confident	89	Confident	204 Å²	204	64.2 Å²	64.2	77%	0.773	31%	0.314	S	S	*	.	H	α-helix	trans	-72.1	-35.4	175.8	-77.1	106.7	0	0	0	113.1	N259 F263 K265	N259-W261 PolarHBondContact O-N 2.86Å; W261-F263 VanDerWaalsContact C-N 3.31Å; W261-K265 PolarHBondContact O-N 3.39Å
262	K	84.8	Confident	89	Confident	133 Å²	133	59.8 Å²	59.8	58%	0.578	29%	0.291	S	S	*	.	H	α-helix	trans	-66.3	-36.4	171.8	-167.3	174.7	-176.3	177.3	0	110.3	E162 N259 G266	E162-K262 IonicContact OE1-NZ 2.76Å; E162-K262 PolarHBondContact OE1-NZ 3.41Å; N259-K262 HydrophobicContact CB-CB 3.96Å; N259-K262 PolarHBondContact O-N 2.76Å; N259-K262 VanDerWaalsContact O-N 3.15Å; K262-G266 PolarHBondContact O-N 3.36Å
263	F	88.4	Confident	89	Confident	8 Å²	8	60 Å²	60	4%	0.035	29%	0.292	C	S	.	.	H	α-helix	trans	-60.9	-55	173.9	-177.3	-92.8	0	0	0	112.1	W182 Y250 R253 F254 N259 K260 W261 K265 G266 N269	W182-F263 HydrophobicContact CH2-CD2 4.21Å; W182-F263 HydrophobicContact CH2-CE2 4.48Å; W182-F263 HydrophobicContact CZ3-CD2 4.32Å; W182-F263 HydrophobicContact CZ3-CE2 4.31Å; Y250-F263 HydrophobicContact CD2-CE1 4.41Å; Y250-F263 HydrophobicContact CD2-CZ 4.4Å; Y250-F263 AromaticContact CE2-CE1 3.78Å; Y250-F263 HydrophobicContact CE2-CE1 3.78Å; Y250-F263 HydrophobicContact CE2-CZ 4.12Å; Y250-F263 AromaticContact CZ-CE1 3.95Å; R253-F263 HydrophobicContact CB-CE2 3.82Å; R253-F263 HydrophobicContact CB-CZ 3.77Å; F254-F263 HydrophobicContact CB-CD1 4.37Å; F254-F263 HydrophobicContact CB-CE1 3.89Å; F254-F263 HydrophobicContact CB-CZ 4.37Å; F254-F263 AromaticContact CD2-CD1 3.79Å; F254-F263 HydrophobicContact CD2-CD1 3.79Å; F254-F263 HydrophobicContact CD2-CE1 4.1Å; N259-F263 PolarHBondContact O-N 3.07Å; K260-F263 WeakPolarHBondContact O-CB 3.34Å; K260-F263 PolarHBondContact O-N 3.06Å; W261-F263 VanDerWaalsContact C-N 3.31Å; F263-K265 VanDerWaalsContact C-N 3.28Å; F263-K265 PolarHBondContact O-N 3.22Å; F263-G266 PolarHBondContact O-N 3.43Å; F263-N269 HydrophobicContact CD1-CB 4.38Å; F263-N269 VanDerWaalsContact CD2-ND2 3.33Å; F263-N269 WeakPolarHBondContact CD2-ND2 3.35Å; F263-N269 HydrophobicContact CE1-CB 4.08Å; F263-N269 HydrophobicContact CE2-CB 4.24Å; F263-N269 VanDerWaalsContact CE2-CG 3.46Å; F263-N269 WeakPolarHBondContact CE2-OD1 3.37Å; F263-N269 HydrophobicContact CZ-CB 4.01Å; F263-N269 VanDerWaalsContact O-CB 3.31Å; F263-N269 WeakPolarHBondContact O-CB 3.24Å; F263-N269 PolarHBondContact O-ND2 3.28Å
264	F	88.9	Confident	89.1	Confident	86 Å²	86	62.5 Å²	62.5	38%	0.377	31%	0.305	S	S	.	.	H	α-helix	trans	-60.1	-33.8	179.5	-83	-63.2	0	0	0	113.8	Y250 F254 K260 G266 V270	Y250-F264 HydrophobicContact CE1-CE1 4.43Å; Y250-F264 WeakPolarHBondContact OH-CD1 3.32Å; Y250-F264 VanDerWaalsContact OH-CE1 3.22Å; Y250-F264 WeakPolarHBondContact OH-CE1 3.32Å; F254-F264 HydrophobicContact CD2-CE2 4.01Å; F254-F264 HydrophobicContact CD2-CZ 4.1Å; F254-F264 HydrophobicContact CE2-CD2 4.03Å; F254-F264 AromaticContact CE2-CE2 3.32Å; F254-F264 HydrophobicContact CE2-CE2 3.32Å; F254-F264 AromaticContact CE2-CZ 3.77Å; F254-F264 HydrophobicContact CE2-CZ 3.77Å; F254-F264 AromaticContact CZ-CE2 4Å; F254-F264 HydrophobicContact CZ-CE2 4Å; F254-F264 HydrophobicContact CZ-CZ 4.38Å; K260-F264 WeakPolarHBondContact O-CD2 3.43Å; K260-F264 PolarHBondContact O-N 3.09Å; F264-G266 VanDerWaalsContact C-N 3.3Å; F264-G266 PolarHBondContact O-N 2.99Å; F264-V270 WeakPolarHBondContact O-CG2 3.29Å
265	K	88.8	Confident	89.2	Confident	171 Å²	171	60.2 Å²	60.2	74%	0.743	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-6.3	176.3	-68.9	-176	177.5	-176.8	0	114.1	W261 F263	W261-K265 PolarHBondContact O-N 3.39Å; F263-K265 VanDerWaalsContact C-N 3.28Å; F263-K265 PolarHBondContact O-N 3.22Å
266	G	88.8	Confident	89.5	Confident	16 Å²	16	56.2 Å²	56.2	17%	0.165	28%	0.275	C	S	.	.			trans	-75.5	127.3	-179.7	0	0	0	0	0	112.2	K262 F263 F264 L268 N269 V270	K262-G266 PolarHBondContact O-N 3.36Å; F263-G266 PolarHBondContact O-N 3.43Å; F264-G266 VanDerWaalsContact C-N 3.3Å; F264-G266 PolarHBondContact O-N 2.99Å; G266-L268 VanDerWaalsContact C-N 3.35Å; G266-L268 PolarHBondContact O-N 3.3Å; G266-N269 WeakPolarHBondContact O-CA 3.35Å; G266-N269 WeakPolarHBondContact O-CB 3.29Å; G266-N269 PolarHBondContact O-N 2.91Å; G266-V270 PolarHBondContact O-N 3.21Å
267	P	89.4	Confident	89.8	Confident	97 Å²	97	59.3 Å²	59.3	63%	0.63	29%	0.291	S	S	*	.	H	α-helix	trans	-62.4	-35.9	-169.7	22.5	-33.6	0	0	0	113.9	N269 V270 I271	P267-N269 VanDerWaalsContact C-N 3.3Å; P267-N269 PolarHBondContact O-N 2.95Å; P267-V270 PolarHBondContact O-N 3.24Å; P267-I271 WeakPolarHBondContact O-CG1 3.03Å; P267-I271 PolarHBondContact O-N 3.28Å
268	L	89.9	Confident	90.1	Very high	50 Å²	50	59.3 Å²	59.3	26%	0.262	29%	0.291	S	S	.	.	H	α-helix	trans	-65.9	-32.8	174.6	-61.1	179.3	0	0	0	112.3	G266 I271 D272 A317	G266-L268 VanDerWaalsContact C-N 3.35Å; G266-L268 PolarHBondContact O-N 3.3Å; L268-I271 PolarHBondContact O-N 3.16Å; L268-D272 PolarHBondContact O-N 3.26Å; L268-A317 HydrophobicContact CD2-CB 4.28Å
269	N	92.9	Very high	90.7	Very high	13 Å²	13	61.3 Å²	61.3	7%	0.07	30%	0.297	C	S	.	.	H	α-helix	trans	-78.5	-30.1	178.5	-51.5	-35	0	0	0	111.4	Y250 F263 G266 P267 D272 L273 R318	Y250-N269 WeakPolarHBondContact CE2-O 3.4Å; F263-N269 HydrophobicContact CD1-CB 4.38Å; F263-N269 VanDerWaalsContact CD2-ND2 3.33Å; F263-N269 WeakPolarHBondContact CD2-ND2 3.35Å; F263-N269 HydrophobicContact CE1-CB 4.08Å; F263-N269 HydrophobicContact CE2-CB 4.24Å; F263-N269 VanDerWaalsContact CE2-CG 3.46Å; F263-N269 WeakPolarHBondContact CE2-OD1 3.37Å; F263-N269 HydrophobicContact CZ-CB 4.01Å; F263-N269 VanDerWaalsContact O-CB 3.31Å; F263-N269 WeakPolarHBondContact O-CB 3.24Å; F263-N269 PolarHBondContact O-ND2 3.28Å; G266-N269 WeakPolarHBondContact O-CA 3.35Å; G266-N269 WeakPolarHBondContact O-CB 3.29Å; G266-N269 PolarHBondContact O-N 2.91Å; P267-N269 VanDerWaalsContact C-N 3.3Å; P267-N269 PolarHBondContact O-N 2.95Å; N269-D272 PolarHBondContact O-N 3.47Å; N269-L273 WeakPolarHBondContact O-CB 3.25Å; N269-L273 PolarHBondContact O-N 3.2Å; N269-R318 PolarHBondContact OD1-NH2 3.25Å
270	V	93.6	Very high	91.2	Very high	58 Å²	58	63 Å²	63	35%	0.352	30%	0.297	S	S	.	.	H	α-helix	trans	-64.1	-42.6	168.1	175.7	0	0	0	0	110.2	F264 G266 P267 L273 L274	F264-V270 WeakPolarHBondContact O-CG2 3.29Å; G266-V270 PolarHBondContact O-N 3.21Å; P267-V270 PolarHBondContact O-N 3.24Å; V270-L273 PolarHBondContact O-N 3.23Å; V270-L274 HydrophobicContact CG1-CD1 3.85Å; V270-L274 HydrophobicContact CG1-CG 4.25Å; V270-L274 VanDerWaalsContact O-CG 3.27Å; V270-L274 WeakPolarHBondContact O-CG 3.49Å; V270-L274 PolarHBondContact O-N 3.26Å
271	I	93.8	Very high	91.4	Very high	42 Å²	42	61.5 Å²	61.5	22%	0.215	29%	0.294	C	S	.	.	H	α-helix	trans	-61.8	-45.4	174.4	-68.8	165.8	0	0	0	111.5	P267 L268 L273 L274 A275 L314	P267-I271 WeakPolarHBondContact O-CG1 3.03Å; P267-I271 PolarHBondContact O-N 3.28Å; L268-I271 PolarHBondContact O-N 3.16Å; I271-L273 VanDerWaalsContact C-N 3.28Å; I271-L273 PolarHBondContact O-N 3.13Å; I271-L274 PolarHBondContact O-N 3.07Å; I271-A275 WeakPolarHBondContact O-CB 3.37Å; I271-A275 PolarHBondContact O-N 3.41Å; I271-L314 HydrophobicContact CG2-CB 3.76Å
272	D	93.9	Very high	91.4	Very high	2 Å²	2	52.7 Å²	52.7	1%	0.011	26%	0.263	C	S	.	.	H	α-helix	trans	-58.4	-38.2	174.7	-83	-56.4	0	0	0	112.5	Y250 L268 N269 K315 R318	Y250-D272 HydrophobicContact CD2-CB 3.68Å; Y250-D272 HydrophobicContact CE2-CB 4.1Å; L268-D272 PolarHBondContact O-N 3.26Å; N269-D272 PolarHBondContact O-N 3.47Å; D272-K315 VanDerWaalsContact OD1-CD 3.26Å; D272-K315 WeakPolarHBondContact OD1-CD 3.17Å; D272-K315 WeakPolarHBondContact OD1-CE 3.49Å; D272-K315 WeakPolarHBondContact OD1-CG 3.31Å; D272-K315 IonicContact OD1-NZ 3.69Å; D272-K315 PolarHBondContact OD1-NZ 3.37Å; D272-R318 IonicContact OD2-CZ 2.82Å; D272-R318 VanDerWaalsContact OD2-CZ 3.23Å; D272-R318 IonicContact OD2-NE 2.69Å; D272-R318 PolarHBondContact OD2-NE 3.06Å; D272-R318 IonicContact OD2-NH2 3.85Å; D272-R318 PolarHBondContact OD2-NH2 3.4Å
273	L	94.1	Very high	91.6	Very high	62 Å²	62	50.1 Å²	50.1	33%	0.325	26%	0.255	S	S	.	.	H	α-helix	trans	-69.3	-44.9	176	-179.3	60.8	0	0	0	112.2	Y250 N269 V270 I271 A275 I276 L277	Y250-L273 HydrophobicContact CE1-CD1 4.16Å; Y250-L273 HydrophobicContact CE2-CB 4.17Å; N269-L273 WeakPolarHBondContact O-CB 3.25Å; N269-L273 PolarHBondContact O-N 3.2Å; V270-L273 PolarHBondContact O-N 3.23Å; I271-L273 VanDerWaalsContact C-N 3.28Å; I271-L273 PolarHBondContact O-N 3.13Å; L273-A275 PolarHBondContact O-N 3.41Å; L273-I276 HydrophobicContact CD1-CD1 4.26Å; L273-I276 HydrophobicContact CD1-CG1 4.33Å; L273-I276 WeakPolarHBondContact O-CG1 3.12Å; L273-I276 PolarHBondContact O-N 2.91Å; L273-I276 VanDerWaalsContact O-N 3.14Å; L273-L277 WeakPolarHBondContact O-CB 3.4Å; L273-L277 PolarHBondContact O-N 2.77Å
274	L	93.2	Very high	91.6	Very high	58 Å²	58	56.8 Å²	56.8	30%	0.304	28%	0.284	S	S	.	.	H	α-helix	trans	-65.6	-23.1	177.9	-67.3	170.9	0	0	0	112.7	V270 I271 L277 P278 M308 L311	V270-L274 HydrophobicContact CG1-CD1 3.85Å; V270-L274 HydrophobicContact CG1-CG 4.25Å; V270-L274 VanDerWaalsContact O-CG 3.27Å; V270-L274 WeakPolarHBondContact O-CG 3.49Å; V270-L274 PolarHBondContact O-N 3.26Å; I271-L274 PolarHBondContact O-N 3.07Å; L274-L277 HydrophobicContact CD2-CD2 4.42Å; L274-P278 VanDerWaalsContact O-CD 3.28Å; L274-P278 WeakPolarHBondContact O-CD 3.47Å; L274-M308 HydrophobicContact CB-CE 4.32Å; L274-M308 HydrophobicContact CD2-CE 3.49Å; L274-M308 VanDerWaalsContact CD2-CE 3.49Å; L274-M308 HydrophobicContact CG-CE 4.47Å; L274-L311 HydrophobicContact CB-CD1 4.28Å
275	A	93.9	Very high	91.4	Very high	4 Å²	4	54.2 Å²	54.2	3%	0.033	27%	0.274	C	S	.	.	H	α-helix	trans	-72.8	-25.8	173.8	0	0	0	0	0	113.7	I271 L273 R312	I271-A275 WeakPolarHBondContact O-CB 3.37Å; I271-A275 PolarHBondContact O-N 3.41Å; L273-A275 PolarHBondContact O-N 3.41Å; A275-R312 HydrophobicContact CB-CB 4.21Å
276	I	94.9	Very high	91	Very high	12 Å²	12	49.4 Å²	49.4	6%	0.062	26%	0.259	C	S	.	.	H	α-helix	trans	-103.9	-30.7	-178.5	61.4	170.9	0	0	0	113.3	F246 T247 Y250 L273 Y279 Y280	F246-I276 HydrophobicContact CB-CG2 3.5Å; F246-I276 VanDerWaalsContact CB-CG2 3.5Å; T247-I276 HydrophobicContact CG2-CB 3.92Å; T247-I276 HydrophobicContact CG2-CD1 3.71Å; T247-I276 HydrophobicContact CG2-CG1 4.39Å; T247-I276 HydrophobicContact CG2-CG2 3.88Å; Y250-I276 HydrophobicContact CD1-CD1 4.11Å; Y250-I276 HydrophobicContact CG-CD1 4.29Å; L273-I276 HydrophobicContact CD1-CD1 4.26Å; L273-I276 HydrophobicContact CD1-CG1 4.33Å; L273-I276 WeakPolarHBondContact O-CG1 3.12Å; L273-I276 PolarHBondContact O-N 2.91Å; L273-I276 VanDerWaalsContact O-N 3.14Å; I276-Y279 PolarHBondContact O-N 2.89Å; I276-Y280 WeakPolarHBondContact O-CD2 3.44Å
277	L	93.6	Very high	90.7	Very high	64 Å²	64	54 Å²	54	34%	0.335	28%	0.276	S	S	.	.	H	α-helix	trans	-49.6	-43.7	-176.6	-176	69.3	0	0	0	114.6	L273 L274 Y279 Y280 V281 M308	L273-L277 WeakPolarHBondContact O-CB 3.4Å; L273-L277 PolarHBondContact O-N 2.77Å; L274-L277 HydrophobicContact CD2-CD2 4.42Å; L277-Y279 VanDerWaalsContact C-N 3.27Å; L277-Y279 PolarHBondContact O-N 2.73Å; L277-Y280 PolarHBondContact O-N 2.69Å; L277-V281 HydrophobicContact CD1-CG2 3.67Å; L277-V281 HydrophobicContact CG-CG2 3.88Å; L277-V281 WeakPolarHBondContact O-CG2 3.44Å; L277-V281 PolarHBondContact O-N 2.88Å; L277-M308 HydrophobicContact CD2-CE 4.25Å
278	P	92.3	Very high	90.2	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.006	27%	0.268	C	S	.	.	H	α-helix	trans	-65	-28.4	-172.9	-21.4	33.4	0	0	0	114	L274 T282 F305 M308 R309	L274-P278 VanDerWaalsContact O-CD 3.28Å; L274-P278 WeakPolarHBondContact O-CD 3.47Å; P278-T282 VanDerWaalsContact O-CB 3.32Å; P278-T282 WeakPolarHBondContact O-CB 3.43Å; P278-T282 PolarHBondContact O-N 2.9Å; P278-T282 PolarHBondContact O-OG1 3.19Å; P278-F305 HydrophobicContact CB-CB 4.22Å; P278-F305 HydrophobicContact CB-CD1 4.17Å; P278-F305 WeakPolarHBondContact CB-O 3.24Å; P278-M308 HydrophobicContact CB-CB 4.43Å; P278-M308 HydrophobicContact CG-CB 4.02Å; P278-M308 HydrophobicContact CG-CE 4.39Å; P278-M308 HydrophobicContact CG-CG 3.79Å; P278-M308 HydrophobicContact CG-SD 3.95Å; P278-R309 HydrophobicContact CB-CG 3.97Å
279	Y	91.9	Very high	89.3	Confident	64 Å²	64	51.8 Å²	51.8	25%	0.251	26%	0.264	S	S	.	.	H	α-helix	trans	-68.2	-52.7	177.6	-177.5	-97.4	0	0	0	111	E239 I243 I276 L277 V281 T282 I283	E239-Y279 HydrophobicContact CG-CD2 4.47Å; I243-Y279 HydrophobicContact CB-CD1 4.39Å; I243-Y279 HydrophobicContact CB-CG 4.34Å; I243-Y279 HydrophobicContact CG1-CD2 4.13Å; I243-Y279 HydrophobicContact CG1-CG 4.02Å; I243-Y279 HydrophobicContact CG2-CD1 3.69Å; I243-Y279 HydrophobicContact CG2-CE1 4.27Å; I243-Y279 HydrophobicContact CG2-CG 3.93Å; I276-Y279 PolarHBondContact O-N 2.89Å; L277-Y279 VanDerWaalsContact C-N 3.27Å; L277-Y279 PolarHBondContact O-N 2.73Å; Y279-V281 PolarHBondContact O-N 3.42Å; Y279-T282 WeakPolarHBondContact O-CB 3.34Å; Y279-T282 PolarHBondContact O-N 3.4Å; Y279-I283 HydrophobicContact CD1-CD1 3.86Å; Y279-I283 HydrophobicContact CE1-CD1 3.41Å; Y279-I283 VanDerWaalsContact CE1-CD1 3.41Å; Y279-I283 HydrophobicContact CE2-CD1 4.47Å; Y279-I283 PolarHBondContact O-N 3.23Å; Y279-I283 VanDerWaalsContact O-N 3.07Å
280	Y	93.5	Very high	88.1	Confident	113 Å²	113	58.8 Å²	58.8	44%	0.443	29%	0.294	S	S	.	.	H	α-helix	trans	-64.9	-39.4	178.8	-67.3	-80.8	0	0	0	112.9	I243 T247 I276 L277 T282 I283 F284	I243-Y280 HydrophobicContact CG2-CE2 3.88Å; T247-Y280 HydrophobicContact CG2-CE2 3.46Å; T247-Y280 VanDerWaalsContact CG2-CE2 3.46Å; T247-Y280 VanDerWaalsContact CG2-OH 3.24Å; T247-Y280 WeakPolarHBondContact CG2-OH 3.37Å; I276-Y280 WeakPolarHBondContact O-CD2 3.44Å; L277-Y280 PolarHBondContact O-N 2.69Å; Y280-T282 VanDerWaalsContact C-N 3.35Å; Y280-I283 PolarHBondContact O-N 3.35Å; Y280-F284 WeakPolarHBondContact O-CB 3.44Å; Y280-F284 PolarHBondContact O-N 3.35Å
281	V	91.5	Very high	86.5	Confident	33 Å²	33	59.1 Å²	59.1	20%	0.2	30%	0.299	C	S	.	.	H	α-helix	trans	-67.6	-36.3	176.2	177.6	0	0	0	0	111.2	L277 Y279 F284 L285 F305	L277-V281 HydrophobicContact CD1-CG2 3.67Å; L277-V281 HydrophobicContact CG-CG2 3.88Å; L277-V281 WeakPolarHBondContact O-CG2 3.44Å; L277-V281 PolarHBondContact O-N 2.88Å; Y279-V281 PolarHBondContact O-N 3.42Å; V281-F284 PolarHBondContact O-N 3.5Å; V281-L285 HydrophobicContact CG1-CD1 3.76Å; V281-L285 HydrophobicContact CG1-CG 4.13Å; V281-L285 WeakPolarHBondContact O-CB 3.14Å; V281-L285 VanDerWaalsContact O-CG 3.24Å; V281-L285 WeakPolarHBondContact O-CG 3.47Å; V281-L285 PolarHBondContact O-N 3.02Å; V281-F305 HydrophobicContact CB-CD1 4.36Å; V281-F305 HydrophobicContact CB-CE1 4.28Å; V281-F305 HydrophobicContact CB-CZ 4.38Å; V281-F305 HydrophobicContact CG1-CD1 4.25Å; V281-F305 HydrophobicContact CG1-CD2 3.78Å; V281-F305 HydrophobicContact CG1-CE1 3.98Å; V281-F305 HydrophobicContact CG1-CE2 3.47Å; V281-F305 VanDerWaalsContact CG1-CE2 3.47Å; V281-F305 HydrophobicContact CG1-CG 4.18Å; V281-F305 HydrophobicContact CG1-CZ 3.59Å
282	T	87.7	Confident	84.9	Confident	20 Å²	20	63.5 Å²	63.5	12%	0.123	33%	0.327	C	S	.	.	H	α-helix	trans	-59.9	-50.1	172.6	-59.8	0	0	0	0	111	P278 Y279 Y280 F284 L285 T286 V302	P278-T282 VanDerWaalsContact O-CB 3.32Å; P278-T282 WeakPolarHBondContact O-CB 3.43Å; P278-T282 PolarHBondContact O-N 2.9Å; P278-T282 PolarHBondContact O-OG1 3.19Å; Y279-T282 WeakPolarHBondContact O-CB 3.34Å; Y279-T282 PolarHBondContact O-N 3.4Å; Y280-T282 VanDerWaalsContact C-N 3.35Å; T282-F284 PolarHBondContact O-N 3.47Å; T282-L285 PolarHBondContact O-N 3.48Å; T282-T286 PolarHBondContact O-N 2.94Å; T282-T286 PolarHBondContact O-OG1 3.02Å; T282-T286 VanDerWaalsContact O-OG1 3.09Å; T282-V302 HydrophobicContact CG2-CG1 3.94Å
283	I	88.1	Confident	83.1	Confident	79 Å²	79	71.2 Å²	71.2	41%	0.405	37%	0.368	S	S	.	.	H	α-helix	trans	-60.3	-47.9	179	-67.5	170.8	0	0	0	111	Y279 Y280 L285 T286 E287	Y279-I283 HydrophobicContact CD1-CD1 3.86Å; Y279-I283 HydrophobicContact CE1-CD1 3.41Å; Y279-I283 VanDerWaalsContact CE1-CD1 3.41Å; Y279-I283 HydrophobicContact CE2-CD1 4.47Å; Y279-I283 PolarHBondContact O-N 3.23Å; Y279-I283 VanDerWaalsContact O-N 3.07Å; Y280-I283 PolarHBondContact O-N 3.35Å; I283-L285 PolarHBondContact O-N 3.22Å; I283-T286 PolarHBondContact O-N 3.05Å; I283-E287 WeakPolarHBondContact O-CB 3.3Å; I283-E287 PolarHBondContact O-N 3.3Å
284	F	88.4	Confident	81.6	Confident	148 Å²	148	72.9 Å²	72.9	65%	0.649	37%	0.374	S	S	*	.	H	α-helix	trans	-60.2	-43.4	179.8	177.3	-98.3	0	0	0	112.6	Y280 V281 T282 S288	Y280-F284 WeakPolarHBondContact O-CB 3.44Å; Y280-F284 PolarHBondContact O-N 3.35Å; V281-F284 PolarHBondContact O-N 3.5Å; T282-F284 PolarHBondContact O-N 3.47Å; F284-S288 WeakPolarHBondContact O-CB 3.39Å; F284-S288 PolarHBondContact O-N 2.74Å; F284-S288 VanDerWaalsContact O-N 3.16Å; F284-S288 PolarHBondContact O-OG 3.33Å
285	L	85.8	Confident	80.4	Confident	31 Å²	31	75.6 Å²	75.6	16%	0.162	38%	0.383	C	S	.	.	H	α-helix	trans	-67.1	-40.3	178.5	-73.4	174	0	0	0	112.3	V281 T282 I283 S288 N289 V298 V301 V302 F305	V281-L285 HydrophobicContact CG1-CD1 3.76Å; V281-L285 HydrophobicContact CG1-CG 4.13Å; V281-L285 WeakPolarHBondContact O-CB 3.14Å; V281-L285 VanDerWaalsContact O-CG 3.24Å; V281-L285 WeakPolarHBondContact O-CG 3.47Å; V281-L285 PolarHBondContact O-N 3.02Å; T282-L285 PolarHBondContact O-N 3.48Å; I283-L285 PolarHBondContact O-N 3.22Å; L285-S288 PolarHBondContact O-OG 2.68Å; L285-N289 WeakPolarHBondContact O-CB 3.26Å; L285-N289 PolarHBondContact O-N 2.97Å; L285-N289 PolarHBondContact O-ND2 3.21Å; L285-V298 HydrophobicContact CB-CG1 4.16Å; L285-V301 HydrophobicContact CD1-CB 4.49Å; L285-V301 HydrophobicContact CD1-CG1 3.67Å; L285-V302 HydrophobicContact CB-CG2 4.22Å; L285-V302 HydrophobicContact CD1-CG2 4.25Å; L285-F305 HydrophobicContact CD1-CD2 4.13Å; L285-F305 HydrophobicContact CD1-CE2 4.18Å
286	T	79.5	Confident	79.3	Confident	71 Å²	71	82 Å²	82	44%	0.436	41%	0.412	S	S	.	.	H	α-helix	trans	-67.9	-45.6	177.9	-61.1	0	0	0	0	111.9	T282 I283 S288	T282-T286 PolarHBondContact O-N 2.94Å; T282-T286 PolarHBondContact O-OG1 3.02Å; T282-T286 VanDerWaalsContact O-OG1 3.09Å; I283-T286 PolarHBondContact O-N 3.05Å; T286-S288 PolarHBondContact O-N 3.15Å
287	E	83.2	Confident	78.5	Confident	112 Å²	112	85.7 Å²	85.7	52%	0.523	43%	0.433	S	S	.	.	H	α-helix	trans	-68.3	-32.2	-178.9	-82.7	-60	134.1	0	0	113.9	I283 K290	I283-E287 WeakPolarHBondContact O-CB 3.3Å; I283-E287 PolarHBondContact O-N 3.3Å; E287-K290 WeakPolarHBondContact O-CE 3.36Å; E287-K290 PolarHBondContact O-NZ 3.07Å; E287-K290 WeakPolarHBondContact OE2-CE 3.23Å; E287-K290 IonicContact OE2-NZ 2.64Å; E287-K290 PolarHBondContact OE2-NZ 3.15Å
288	S	79.3	Confident	77.9	Confident	65 Å²	65	83.5 Å²	83.5	46%	0.455	42%	0.422	S	S	.	.	H	α-helix	trans	-80.9	-27.6	-178.3	53.1	0	0	0	0	114	F284 L285 T286 K290	F284-S288 WeakPolarHBondContact O-CB 3.39Å; F284-S288 PolarHBondContact O-N 2.74Å; F284-S288 VanDerWaalsContact O-N 3.16Å; F284-S288 PolarHBondContact O-OG 3.33Å; L285-S288 PolarHBondContact O-OG 2.68Å; T286-S288 PolarHBondContact O-N 3.15Å; S288-K290 PolarHBondContact O-N 2.88Å
289	N	70.3	Confident	77.2	Confident	36 Å²	36	87.5 Å²	87.5	19%	0.193	44%	0.436	C	S	.	.			trans	-103.8	53.9	-169.9	-70.1	-81.8	0	0	0	113.9	L285 S291 V298	L285-N289 WeakPolarHBondContact O-CB 3.26Å; L285-N289 PolarHBondContact O-N 2.97Å; L285-N289 PolarHBondContact O-ND2 3.21Å; N289-S291 PolarHBondContact O-N 2.91Å; N289-V298 HydrophobicContact CB-CG1 4.34Å; N289-V298 HydrophobicContact CB-CG2 3.84Å; N289-V298 VanDerWaalsContact CG-CG2 3.49Å
290	K	67.8	Low	76.7	Confident	160 Å²	160	92.1 Å²	92.1	70%	0.696	45%	0.453	S	S	*	.			trans	-71.2	21.2	178.7	-71.1	167.2	177.3	152.1	0	114.8	E287 S288	E287-K290 WeakPolarHBondContact O-CE 3.36Å; E287-K290 PolarHBondContact O-NZ 3.07Å; E287-K290 WeakPolarHBondContact OE2-CE 3.23Å; E287-K290 IonicContact OE2-NZ 2.64Å; E287-K290 PolarHBondContact OE2-NZ 3.15Å; S288-K290 PolarHBondContact O-N 2.88Å
291	S	60.9	Low	76.4	Confident	64 Å²	64	89.6 Å²	89.6	45%	0.448	45%	0.45	S	S	.	.	S	Bend	trans	-120.3	128.2	179.8	68.5	0	0	0	0	112	N289 L293 Q294 F295	N289-S291 PolarHBondContact O-N 2.91Å; S291-L293 VanDerWaalsContact C-N 3.32Å; S291-L293 PolarHBondContact O-N 3.41Å; S291-Q294 PolarHBondContact O-N 3.47Å; S291-F295 PolarHBondContact O-N 3.11Å
292	V	59.7	Low	76	Confident	134 Å²	134	89.4 Å²	89.4	81%	0.812	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-37.4	-165.3	-176.5	0	0	0	0	113.5	F295	V292-F295 VanDerWaalsContact O-CB 3.25Å; V292-F295 WeakPolarHBondContact O-CB 3.14Å; V292-F295 PolarHBondContact O-N 3.32Å
293	L	55.9	Low	75.8	Confident	164 Å²	164	93.2 Å²	93.2	86%	0.859	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-26.5	-177.2	-72.4	172	0	0	0	114.2	S291 F295	S291-L293 VanDerWaalsContact C-N 3.32Å; S291-L293 PolarHBondContact O-N 3.41Å; L293-F295 VanDerWaalsContact C-N 3.28Å
294	Q	61.8	Low	75.8	Confident	97 Å²	97	94.5 Å²	94.5	45%	0.453	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-25.6	172.1	-70.8	-66.6	-3.3	0	0	111.9	S291 Q296 N297 V298	S291-Q294 PolarHBondContact O-N 3.47Å; Q294-Q296 VanDerWaalsContact C-N 3.29Å; Q294-Q296 PolarHBondContact O-N 3.01Å; Q294-Q296 VanDerWaalsContact O-N 3.16Å; Q294-N297 PolarHBondContact O-N 2.9Å; Q294-N297 VanDerWaalsContact O-N 3.13Å; Q294-V298 HydrophobicContact CB-CG2 4.43Å; Q294-V298 WeakPolarHBondContact O-CG2 3.49Å; Q294-V298 PolarHBondContact O-N 2.75Å
295	F	68	Low	75.8	Confident	116 Å²	116	89.4 Å²	89.4	51%	0.509	45%	0.449	S	S	.	.	H	α-helix	trans	-57.8	-34.8	-169.2	-155.3	-98.9	0	0	0	113.9	S291 V292 L293 R299	S291-F295 PolarHBondContact O-N 3.11Å; V292-F295 VanDerWaalsContact O-CB 3.25Å; V292-F295 WeakPolarHBondContact O-CB 3.14Å; V292-F295 PolarHBondContact O-N 3.32Å; L293-F295 VanDerWaalsContact C-N 3.28Å; F295-R299 WeakPolarHBondContact O-CB 3.21Å; F295-R299 PolarHBondContact O-N 2.93Å
296	Q	71.6	Confident	75.8	Confident	137 Å²	137	91.4 Å²	91.4	64%	0.64	46%	0.455	S	S	*	.	H	α-helix	trans	-65.9	-43.7	177.6	-75.7	-72.4	2.5	0	0	113.2	Q294 R300	Q294-Q296 VanDerWaalsContact C-N 3.29Å; Q294-Q296 PolarHBondContact O-N 3.01Å; Q294-Q296 VanDerWaalsContact O-N 3.16Å; Q296-R300 PolarHBondContact O-N 2.85Å
297	N	77.5	Confident	76.2	Confident	91 Å²	91	94 Å²	94	49%	0.487	47%	0.465	S	S	.	.	H	α-helix	trans	-69.9	-42.5	177.4	-71.9	-32.5	0	0	0	110.6	Q294 R299 R300 V301	Q294-N297 PolarHBondContact O-N 2.9Å; Q294-N297 VanDerWaalsContact O-N 3.13Å; N297-R299 VanDerWaalsContact C-N 3.35Å; N297-R299 PolarHBondContact O-N 3.19Å; N297-R300 PolarHBondContact O-N 2.9Å; N297-V301 PolarHBondContact O-N 2.68Å
298	V	81.3	Confident	76.5	Confident	17 Å²	17	90.7 Å²	90.7	10%	0.103	45%	0.449	C	S	.	.	H	α-helix	trans	-61.6	-41.3	176	175.6	0	0	0	0	111.2	L285 N289 Q294 R300 V301 V302	L285-V298 HydrophobicContact CB-CG1 4.16Å; N289-V298 HydrophobicContact CB-CG1 4.34Å; N289-V298 HydrophobicContact CB-CG2 3.84Å; N289-V298 VanDerWaalsContact CG-CG2 3.49Å; Q294-V298 HydrophobicContact CB-CG2 4.43Å; Q294-V298 WeakPolarHBondContact O-CG2 3.49Å; Q294-V298 PolarHBondContact O-N 2.75Å; V298-R300 VanDerWaalsContact C-N 3.31Å; V298-R300 PolarHBondContact O-N 2.82Å; V298-V301 PolarHBondContact O-N 3.48Å; V298-V301 VanDerWaalsContact O-N 3.1Å; V298-V302 HydrophobicContact CG1-CG2 4.17Å; V298-V302 WeakPolarHBondContact O-CG2 3.41Å; V298-V302 PolarHBondContact O-N 3.29Å
299	R	77.7	Confident	77	Confident	85 Å²	85	88.6 Å²	88.6	32%	0.321	43%	0.432	S	S	.	.	H	α-helix	trans	-57.8	-41.6	176.4	-169.7	177.8	-164	-154.1	2.7	112	Q228 F295 N297 V302 Q303	Q228-R299 VanDerWaalsContact OE1-CZ 3.28Å; F295-R299 WeakPolarHBondContact O-CB 3.21Å; F295-R299 PolarHBondContact O-N 2.93Å; N297-R299 VanDerWaalsContact C-N 3.35Å; N297-R299 PolarHBondContact O-N 3.19Å; R299-V302 PolarHBondContact O-N 2.91Å; R299-Q303 VanDerWaalsContact O-CG 3.3Å; R299-Q303 WeakPolarHBondContact O-CG 3.44Å; R299-Q303 PolarHBondContact O-N 3.37Å
300	R	82.3	Confident	78	Confident	161 Å²	161	91.7 Å²	91.7	61%	0.608	45%	0.447	S	S	*	.	H	α-helix	trans	-65	-39.5	175.7	-165.7	-175.1	-61.2	152.3	4.3	112.1	Q296 N297 V298 Q303 I304	Q296-R300 PolarHBondContact O-N 2.85Å; N297-R300 PolarHBondContact O-N 2.9Å; V298-R300 VanDerWaalsContact C-N 3.31Å; V298-R300 PolarHBondContact O-N 2.82Å; R300-Q303 PolarHBondContact O-N 3.41Å; R300-I304 WeakPolarHBondContact O-CG1 3.42Å; R300-I304 PolarHBondContact O-N 2.9Å
301	V	85.8	Confident	79.1	Confident	61 Å²	61	86.7 Å²	86.7	37%	0.37	43%	0.428	S	S	.	.	H	α-helix	trans	-68.2	-42.4	175.6	177.2	0	0	0	0	111.2	L285 N297 V298 Q303 I304 F305	L285-V301 HydrophobicContact CD1-CB 4.49Å; L285-V301 HydrophobicContact CD1-CG1 3.67Å; N297-V301 PolarHBondContact O-N 2.68Å; V298-V301 PolarHBondContact O-N 3.48Å; V298-V301 VanDerWaalsContact O-N 3.1Å; V301-Q303 VanDerWaalsContact C-N 3.32Å; V301-Q303 PolarHBondContact O-N 3.35Å; V301-I304 WeakPolarHBondContact O-CB 3.43Å; V301-I304 PolarHBondContact O-N 2.81Å; V301-I304 VanDerWaalsContact O-N 3.15Å; V301-F305 HydrophobicContact CG1-CD2 3.87Å; V301-F305 HydrophobicContact CG1-CE2 3.65Å; V301-F305 VanDerWaalsContact O-CD2 3.3Å; V301-F305 WeakPolarHBondContact O-CD2 3.17Å; V301-F305 PolarHBondContact O-N 3.28Å
302	V	83.2	Confident	80.6	Confident	28 Å²	28	83.8 Å²	83.8	17%	0.17	41%	0.407	C	S	.	.	H	α-helix	trans	-62.2	-37.3	174.8	168.2	0	0	0	0	111.6	T282 L285 V298 R299 F305 R306	T282-V302 HydrophobicContact CG2-CG1 3.94Å; L285-V302 HydrophobicContact CB-CG2 4.22Å; L285-V302 HydrophobicContact CD1-CG2 4.25Å; V298-V302 HydrophobicContact CG1-CG2 4.17Å; V298-V302 WeakPolarHBondContact O-CG2 3.41Å; V298-V302 PolarHBondContact O-N 3.29Å; R299-V302 PolarHBondContact O-N 2.91Å; V302-F305 PolarHBondContact O-N 3.41Å; V302-R306 WeakPolarHBondContact O-CB 3.46Å; V302-R306 PolarHBondContact O-N 2.64Å
303	Q	84	Confident	82.2	Confident	100 Å²	100	81.2 Å²	81.2	47%	0.467	39%	0.388	S	S	.	.	H	α-helix	trans	-60.2	-43.3	171.9	-76.5	168.1	-26.4	0	0	112.1	R299 R300 V301 F305 R306 I307	R299-Q303 VanDerWaalsContact O-CG 3.3Å; R299-Q303 WeakPolarHBondContact O-CG 3.44Å; R299-Q303 PolarHBondContact O-N 3.37Å; R300-Q303 PolarHBondContact O-N 3.41Å; V301-Q303 VanDerWaalsContact C-N 3.32Å; V301-Q303 PolarHBondContact O-N 3.35Å; Q303-F305 VanDerWaalsContact C-N 3.35Å; Q303-F305 PolarHBondContact O-N 2.92Å; Q303-R306 PolarHBondContact O-N 3.24Å; Q303-I307 WeakPolarHBondContact O-CG1 3.34Å; Q303-I307 PolarHBondContact O-N 2.88Å
304	I	88.3	Confident	83.9	Confident	106 Å²	106	77 Å²	77	54%	0.544	37%	0.366	S	S	.	.	H	α-helix	trans	-61.1	-43.6	175.2	-64.8	164.8	0	0	0	110.6	R300 V301 I307 M308	R300-I304 WeakPolarHBondContact O-CG1 3.42Å; R300-I304 PolarHBondContact O-N 2.9Å; V301-I304 WeakPolarHBondContact O-CB 3.43Å; V301-I304 PolarHBondContact O-N 2.81Å; V301-I304 VanDerWaalsContact O-N 3.15Å; I304-I307 PolarHBondContact O-N 3.4Å; I304-M308 WeakPolarHBondContact O-CB 3.17Å; I304-M308 PolarHBondContact O-N 3.43Å
305	F	89	Confident	85.4	Confident	42 Å²	42	72.6 Å²	72.6	18%	0.184	35%	0.345	C	S	.	.	H	α-helix	trans	-67.2	-34.8	175	-75.9	-68.8	0	0	0	113.2	P278 V281 L285 V301 V302 Q303 I307 M308 R309	P278-F305 HydrophobicContact CB-CB 4.22Å; P278-F305 HydrophobicContact CB-CD1 4.17Å; P278-F305 WeakPolarHBondContact CB-O 3.24Å; V281-F305 HydrophobicContact CB-CD1 4.36Å; V281-F305 HydrophobicContact CB-CE1 4.28Å; V281-F305 HydrophobicContact CB-CZ 4.38Å; V281-F305 HydrophobicContact CG1-CD1 4.25Å; V281-F305 HydrophobicContact CG1-CD2 3.78Å; V281-F305 HydrophobicContact CG1-CE1 3.98Å; V281-F305 HydrophobicContact CG1-CE2 3.47Å; V281-F305 VanDerWaalsContact CG1-CE2 3.47Å; V281-F305 HydrophobicContact CG1-CG 4.18Å; V281-F305 HydrophobicContact CG1-CZ 3.59Å; L285-F305 HydrophobicContact CD1-CD2 4.13Å; L285-F305 HydrophobicContact CD1-CE2 4.18Å; V301-F305 HydrophobicContact CG1-CD2 3.87Å; V301-F305 HydrophobicContact CG1-CE2 3.65Å; V301-F305 VanDerWaalsContact O-CD2 3.3Å; V301-F305 WeakPolarHBondContact O-CD2 3.17Å; V301-F305 PolarHBondContact O-N 3.28Å; V302-F305 PolarHBondContact O-N 3.41Å; Q303-F305 VanDerWaalsContact C-N 3.35Å; Q303-F305 PolarHBondContact O-N 2.92Å; F305-I307 VanDerWaalsContact C-N 3.33Å; F305-I307 PolarHBondContact O-N 3.4Å; F305-M308 HydrophobicContact CD1-SD 3.68Å; F305-M308 HydrophobicContact CE1-SD 3.74Å; F305-M308 WeakPolarHBondContact O-CB 3.4Å; F305-M308 PolarHBondContact O-N 3.41Å; F305-R309 WeakPolarHBondContact O-CG 3.29Å; F305-R309 PolarHBondContact O-N 3.49Å; F305-R309 VanDerWaalsContact O-N 3.15Å
306	R	85.3	Confident	86.5	Confident	73 Å²	73	69.5 Å²	69.5	28%	0.275	33%	0.334	S	S	.	.	H	α-helix	trans	-61.4	-40.6	173.7	-161.1	173.5	-176	-157.1	-0.8	111.1	D231 V302 Q303 R309	D231-R306 VanDerWaalsContact CG-NH2 3.32Å; D231-R306 IonicContact OD1-CZ 3.33Å; D231-R306 IonicContact OD1-NE 3.22Å; D231-R306 PolarHBondContact OD1-NE 3.12Å; D231-R306 IonicContact OD1-NH2 3.92Å; D231-R306 PolarHBondContact OD1-NH2 3.38Å; D231-R306 IonicContact OD2-NE 3.52Å; D231-R306 IonicContact OD2-NH2 3.02Å; V302-R306 WeakPolarHBondContact O-CB 3.46Å; V302-R306 PolarHBondContact O-N 2.64Å; Q303-R306 PolarHBondContact O-N 3.24Å; R306-R309 WeakPolarHBondContact O-CB 3.42Å; R306-R309 WeakPolarHBondContact O-CG 3.29Å; R306-R309 PolarHBondContact O-N 3.37Å
307	I	87.6	Confident	87.3	Confident	126 Å²	126	63.4 Å²	63.4	65%	0.646	31%	0.307	S	S	*	.	H	α-helix	trans	-67.5	-43.7	171.9	-63.3	165.4	0	0	0	111	Q303 I304 F305 R309 I310	Q303-I307 WeakPolarHBondContact O-CG1 3.34Å; Q303-I307 PolarHBondContact O-N 2.88Å; I304-I307 PolarHBondContact O-N 3.4Å; F305-I307 VanDerWaalsContact C-N 3.33Å; F305-I307 PolarHBondContact O-N 3.4Å; I307-R309 PolarHBondContact O-N 3.04Å; I307-I310 WeakPolarHBondContact O-CB 3.43Å; I307-I310 VanDerWaalsContact O-CG2 3.25Å; I307-I310 WeakPolarHBondContact O-CG2 3.44Å; I307-I310 PolarHBondContact O-N 3.45Å
308	M	89.3	Confident	87.8	Confident	41 Å²	41	60.2 Å²	60.2	20%	0.202	29%	0.288	C	S	.	.	H	α-helix	trans	-56.7	-23.4	178.4	-170.3	-177.8	171.9	0	0	113	L274 L277 P278 I304 F305 I310 L311	L274-M308 HydrophobicContact CB-CE 4.32Å; L274-M308 HydrophobicContact CD2-CE 3.49Å; L274-M308 VanDerWaalsContact CD2-CE 3.49Å; L274-M308 HydrophobicContact CG-CE 4.47Å; L277-M308 HydrophobicContact CD2-CE 4.25Å; P278-M308 HydrophobicContact CB-CB 4.43Å; P278-M308 HydrophobicContact CG-CB 4.02Å; P278-M308 HydrophobicContact CG-CE 4.39Å; P278-M308 HydrophobicContact CG-CG 3.79Å; P278-M308 HydrophobicContact CG-SD 3.95Å; I304-M308 WeakPolarHBondContact O-CB 3.17Å; I304-M308 PolarHBondContact O-N 3.43Å; F305-M308 HydrophobicContact CD1-SD 3.68Å; F305-M308 HydrophobicContact CE1-SD 3.74Å; F305-M308 WeakPolarHBondContact O-CB 3.4Å; F305-M308 PolarHBondContact O-N 3.41Å; M308-I310 PolarHBondContact O-N 3.11Å; M308-L311 HydrophobicContact CE-CD1 3.82Å; M308-L311 HydrophobicContact CG-CD1 3.62Å; M308-L311 HydrophobicContact CG-CG 4.25Å; M308-L311 WeakPolarHBondContact O-CB 3.45Å; M308-L311 WeakPolarHBondContact O-CG 3.41Å; M308-L311 PolarHBondContact O-N 2.9Å
309	R	90.4	Very high	88.1	Confident	21 Å²	21	61.5 Å²	61.5	8%	0.079	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-56.1	-17.3	171.1	-54.4	-178.2	-169.8	162.9	11.3	113.3	L212 D231 E239 P278 F305 R306 I307 L311 R312	L212-R309 HydrophobicContact CD1-CB 4.49Å; D231-R309 IonicContact OD2-CZ 3.79Å; D231-R309 IonicContact OD2-NH1 2.99Å; D231-R309 PolarHBondContact OD2-NH1 2.88Å; D231-R309 IonicContact OD2-NH2 3.6Å; E239-R309 IonicContact OE2-CZ 3.35Å; E239-R309 IonicContact OE2-NE 2.67Å; E239-R309 IonicContact OE2-NH1 2.69Å; E239-R309 PolarHBondContact OE2-NH1 2.73Å; P278-R309 HydrophobicContact CB-CG 3.97Å; F305-R309 WeakPolarHBondContact O-CG 3.29Å; F305-R309 PolarHBondContact O-N 3.49Å; F305-R309 VanDerWaalsContact O-N 3.15Å; R306-R309 WeakPolarHBondContact O-CB 3.42Å; R306-R309 WeakPolarHBondContact O-CG 3.29Å; R306-R309 PolarHBondContact O-N 3.37Å; I307-R309 PolarHBondContact O-N 3.04Å; R309-L311 VanDerWaalsContact C-N 3.25Å; R309-L311 PolarHBondContact O-N 2.9Å; R309-R312 VanDerWaalsContact CB-NH2 3.32Å; R309-R312 WeakPolarHBondContact O-CB 3.33Å; R309-R312 VanDerWaalsContact O-CG 3.29Å; R309-R312 WeakPolarHBondContact O-CG 3.4Å; R309-R312 PolarHBondContact O-N 2.86Å; R309-R312 PolarHBondContact O-NE 3.27Å
310	I	91.3	Very high	88.6	Confident	102 Å²	102	59.8 Å²	59.8	52%	0.523	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-64.5	-27.7	172.9	-158.3	171.6	0	0	0	112.8	L212 I307 M308 R312 I313	L212-I310 HydrophobicContact CD2-CB 4.34Å; I307-I310 WeakPolarHBondContact O-CB 3.43Å; I307-I310 VanDerWaalsContact O-CG2 3.25Å; I307-I310 WeakPolarHBondContact O-CG2 3.44Å; I307-I310 PolarHBondContact O-N 3.45Å; M308-I310 PolarHBondContact O-N 3.11Å; I310-R312 PolarHBondContact O-N 3.43Å; I310-I313 VanDerWaalsContact O-CG2 3.27Å; I310-I313 WeakPolarHBondContact O-CG2 3.32Å; I310-I313 PolarHBondContact O-N 3.39Å
311	L	90.4	Very high	88.6	Confident	54 Å²	54	55.3 Å²	55.3	28%	0.283	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-59.1	-17.8	178.5	-62.2	-179.1	0	0	0	112.9	L274 M308 R309 I313 L314	L274-L311 HydrophobicContact CB-CD1 4.28Å; M308-L311 HydrophobicContact CE-CD1 3.82Å; M308-L311 HydrophobicContact CG-CD1 3.62Å; M308-L311 HydrophobicContact CG-CG 4.25Å; M308-L311 WeakPolarHBondContact O-CB 3.45Å; M308-L311 WeakPolarHBondContact O-CG 3.41Å; M308-L311 PolarHBondContact O-N 2.9Å; R309-L311 VanDerWaalsContact C-N 3.25Å; R309-L311 PolarHBondContact O-N 2.9Å; L311-I313 PolarHBondContact O-N 3.3Å; L311-I313 VanDerWaalsContact O-N 3.12Å; L311-L314 HydrophobicContact CD2-CD1 3.83Å; L311-L314 WeakPolarHBondContact O-CB 3.31Å; L311-L314 PolarHBondContact O-N 2.88Å
312	R	93.1	Very high	88.6	Confident	3 Å²	3	53.7 Å²	53.7	1%	0.011	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-53.9	-29.2	171.8	84	-179	90.8	-164.7	16.2	113	S208 T209 E239 A275 R309 I310 L314 K315	S208-R312 PolarHBondContact O-NH1 3.44Å; S208-R312 WeakPolarHBondContact OG-CD 3.39Å; T209-R312 HydrophobicContact CG2-CG 3.9Å; E239-R312 IonicContact OE1-CZ 2.78Å; E239-R312 IonicContact OE1-NH1 2.65Å; E239-R312 PolarHBondContact OE1-NH1 3.46Å; E239-R312 IonicContact OE1-NH2 2.67Å; E239-R312 PolarHBondContact OE1-NH2 2.92Å; A275-R312 HydrophobicContact CB-CB 4.21Å; R309-R312 VanDerWaalsContact CB-NH2 3.32Å; R309-R312 WeakPolarHBondContact O-CB 3.33Å; R309-R312 VanDerWaalsContact O-CG 3.29Å; R309-R312 WeakPolarHBondContact O-CG 3.4Å; R309-R312 PolarHBondContact O-N 2.86Å; R309-R312 PolarHBondContact O-NE 3.27Å; I310-R312 PolarHBondContact O-N 3.43Å; R312-L314 VanDerWaalsContact C-N 3.27Å; R312-L314 PolarHBondContact O-N 3.27Å; R312-K315 WeakPolarHBondContact O-CB 3.36Å; R312-K315 PolarHBondContact O-N 3.28Å
313	I	93.4	Very high	88.8	Confident	81 Å²	81	55.4 Å²	55.4	42%	0.415	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-65.4	-30.1	177.4	-156.2	172.7	0	0	0	112.4	T209 I310 L311 K315 L316	T209-I313 HydrophobicContact CG2-CB 4.19Å; T209-I313 HydrophobicContact CG2-CG1 4.24Å; I310-I313 VanDerWaalsContact O-CG2 3.27Å; I310-I313 WeakPolarHBondContact O-CG2 3.32Å; I310-I313 PolarHBondContact O-N 3.39Å; L311-I313 PolarHBondContact O-N 3.3Å; L311-I313 VanDerWaalsContact O-N 3.12Å; I313-K315 PolarHBondContact O-N 2.82Å; I313-L316 HydrophobicContact CG1-CD1 4.08Å; I313-L316 WeakPolarHBondContact O-CB 3.46Å; I313-L316 WeakPolarHBondContact O-CG 3.44Å; I313-L316 PolarHBondContact O-N 2.86Å; I313-L316 VanDerWaalsContact O-N 3.1Å
314	L	91.2	Very high	88.9	Confident	76 Å²	76	52.9 Å²	52.9	40%	0.398	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-66.7	-18.2	178.8	-59	179.1	0	0	0	112.1	I271 L311 R312 L316 A317	I271-L314 HydrophobicContact CG2-CB 3.76Å; L311-L314 HydrophobicContact CD2-CD1 3.83Å; L311-L314 WeakPolarHBondContact O-CB 3.31Å; L311-L314 PolarHBondContact O-N 2.88Å; R312-L314 VanDerWaalsContact C-N 3.27Å; R312-L314 PolarHBondContact O-N 3.27Å; L314-L316 PolarHBondContact O-N 2.78Å; L314-A317 WeakPolarHBondContact O-CB 3.47Å; L314-A317 PolarHBondContact O-N 3.45Å
315	K	92.7	Very high	88.7	Confident	3 Å²	3	47.8 Å²	47.8	1%	0.013	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-59.6	-23.9	172.6	-170.8	172.5	166.3	132.6	0	112.6	I205 F246 E249 D272 R312 I313 A317 R318	I205-K315 HydrophobicContact CD1-CB 3.92Å; I205-K315 HydrophobicContact CD1-CD 3.91Å; I205-K315 HydrophobicContact CD1-CG 3.67Å; I205-K315 HydrophobicContact CG1-CB 4.32Å; I205-K315 HydrophobicContact CG1-CD 4.05Å; I205-K315 HydrophobicContact CG1-CG 4.26Å; F246-K315 HydrophobicContact CD1-CD 4.28Å; F246-K315 HydrophobicContact CE1-CD 4.42Å; E249-K315 VanDerWaalsContact OE2-CE 3.23Å; E249-K315 WeakPolarHBondContact OE2-CE 3.26Å; E249-K315 IonicContact OE2-NZ 3.18Å; E249-K315 PolarHBondContact OE2-NZ 3.16Å; D272-K315 VanDerWaalsContact OD1-CD 3.26Å; D272-K315 WeakPolarHBondContact OD1-CD 3.17Å; D272-K315 WeakPolarHBondContact OD1-CE 3.49Å; D272-K315 WeakPolarHBondContact OD1-CG 3.31Å; D272-K315 IonicContact OD1-NZ 3.69Å; D272-K315 PolarHBondContact OD1-NZ 3.37Å; R312-K315 WeakPolarHBondContact O-CB 3.36Å; R312-K315 PolarHBondContact O-N 3.28Å; I313-K315 PolarHBondContact O-N 2.82Å; K315-A317 PolarHBondContact O-N 3.1Å; K315-A317 VanDerWaalsContact O-N 3.1Å; K315-R318 WeakPolarHBondContact O-CB 3.44Å; K315-R318 PolarHBondContact O-N 2.68Å
316	L	91.1	Very high	88.6	Confident	52 Å²	52	49.3 Å²	49.3	27%	0.272	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-57.6	-21.7	169.5	-64.2	176.8	0	0	0	112.9	I202 I205 I313 L314 R318 H319 S320	I202-L316 HydrophobicContact CG2-CD2 4.38Å; I205-L316 HydrophobicContact CB-CD2 4.12Å; I205-L316 HydrophobicContact CD1-CD2 3.99Å; I205-L316 HydrophobicContact CG2-CD2 3.75Å; I205-L316 HydrophobicContact CG2-CG 3.85Å; I313-L316 HydrophobicContact CG1-CD1 4.08Å; I313-L316 WeakPolarHBondContact O-CB 3.46Å; I313-L316 WeakPolarHBondContact O-CG 3.44Å; I313-L316 PolarHBondContact O-N 2.86Å; I313-L316 VanDerWaalsContact O-N 3.1Å; L314-L316 PolarHBondContact O-N 2.78Å; L316-R318 PolarHBondContact O-N 3.45Å; L316-H319 CarbonylContact O-C 3.57Å; L316-H319 PolarHBondContact O-N 2.86Å; L316-S320 WeakPolarHBondContact O-CB 3.29Å; L316-S320 PolarHBondContact O-N 3.44Å
317	A	89.4	Confident	88.7	Confident	9 Å²	9	47.8 Å²	47.8	7%	0.074	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-58.7	-32.7	173.6	0	0	0	0	0	112.6	L268 L314 K315 H319 S320 L323 Q324	L268-A317 HydrophobicContact CD2-CB 4.28Å; L314-A317 WeakPolarHBondContact O-CB 3.47Å; L314-A317 PolarHBondContact O-N 3.45Å; K315-A317 PolarHBondContact O-N 3.1Å; K315-A317 VanDerWaalsContact O-N 3.1Å; A317-H319 PolarHBondContact O-N 3.01Å; A317-S320 PolarHBondContact O-N 2.93Å; A317-L323 HydrophobicContact CB-CB 4.42Å; A317-L323 HydrophobicContact CB-CD2 3.79Å; A317-L323 HydrophobicContact CB-CG 3.86Å; A317-Q324 WeakPolarHBondContact O-CG 3.38Å; A317-Q324 PolarHBondContact O-NE2 2.78Å
318	R	88.1	Confident	88.6	Confident	23 Å²	23	46.5 Å²	46.5	9%	0.087	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-62	-28	174.3	-178.2	173.1	-70.8	-73.2	6.2	112.5	E186 N269 D272 K315 L316 Q324	E186-R318 IonicContact OE1-CZ 2.78Å; E186-R318 IonicContact OE1-NH1 3.78Å; E186-R318 PolarHBondContact OE1-NH1 2.98Å; E186-R318 IonicContact OE2-CZ 2.74Å; E186-R318 IonicContact OE2-NH1 3.23Å; E186-R318 PolarHBondContact OE2-NH1 2.89Å; N269-R318 PolarHBondContact OD1-NH2 3.25Å; D272-R318 IonicContact OD2-CZ 2.82Å; D272-R318 VanDerWaalsContact OD2-CZ 3.23Å; D272-R318 IonicContact OD2-NE 2.69Å; D272-R318 PolarHBondContact OD2-NE 3.06Å; D272-R318 IonicContact OD2-NH2 3.85Å; D272-R318 PolarHBondContact OD2-NH2 3.4Å; K315-R318 WeakPolarHBondContact O-CB 3.44Å; K315-R318 PolarHBondContact O-N 2.68Å; L316-R318 PolarHBondContact O-N 3.45Å; R318-Q324 PolarHBondContact O-NE2 2.83Å
319	H	87.1	Confident	88.5	Confident	44 Å²	44	44.7 Å²	44.7	20%	0.204	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.3	-13	-175.9	-58.7	-83.5	0	0	0	113.9	I202 L316 A317	I202-H319 HydrophobicContact CD1-CB 3.9Å; I202-H319 HydrophobicContact CG1-CB 3.96Å; L316-H319 CarbonylContact O-C 3.57Å; L316-H319 PolarHBondContact O-N 2.86Å; A317-H319 PolarHBondContact O-N 3.01Å
320	S	87.6	Confident	88.4	Confident	49 Å²	49	47 Å²	47	34%	0.343	26%	0.262	S	S	.	.			trans	-110.2	103.1	-178.8	178.8	0	0	0	0	111.9	L316 A317 G322 L323 Q324	L316-S320 WeakPolarHBondContact O-CB 3.29Å; L316-S320 PolarHBondContact O-N 3.44Å; A317-S320 PolarHBondContact O-N 2.93Å; S320-G322 PolarHBondContact O-N 3.09Å; S320-L323 PolarHBondContact O-N 2.87Å; S320-L323 PolarHBondContact OG-N 2.84Å; S320-Q324 PolarHBondContact O-N 2.85Å; S320-Q324 VanDerWaalsContact O-N 3.07Å
321	T	82.7	Confident	88.2	Confident	67 Å²	67	51.7 Å²	51.7	41%	0.411	27%	0.273	S	S	.	.	H	α-helix	trans	-52.5	-37.6	171.6	-46.4	0	0	0	0	111.9	Q324 S325 Q429	T321-Q324 PolarHBondContact O-N 3.06Å; T321-S325 VanDerWaalsContact O-CB 3.31Å; T321-S325 WeakPolarHBondContact O-CB 3.21Å; T321-S325 PolarHBondContact O-N 2.92Å; T321-Q429 HydrophobicContact CG2-CG 4.32Å; T321-Q429 VanDerWaalsContact CG2-OE1 3.28Å; T321-Q429 PolarHBondContact O-OE1 2.86Å
322	G	85.6	Confident	87.9	Confident	28 Å²	28	55.3 Å²	55.3	29%	0.289	28%	0.283	S	S	.	.	H	α-helix	trans	-65.4	-37.9	177.5	0	0	0	0	0	113.6	S320 S325 L326	S320-G322 PolarHBondContact O-N 3.09Å; G322-S325 WeakPolarHBondContact O-CB 3.46Å; G322-S325 PolarHBondContact O-N 3.19Å; G322-L326 WeakPolarHBondContact O-CB 3.23Å; G322-L326 PolarHBondContact O-N 3.34Å
323	L	87	Confident	87.8	Confident	64 Å²	64	55.2 Å²	55.2	34%	0.335	28%	0.283	S	S	.	.	H	α-helix	trans	-76	-31.1	177.9	-173.2	52.8	0	0	0	112	A317 S320 L326 G327	A317-L323 HydrophobicContact CB-CB 4.42Å; A317-L323 HydrophobicContact CB-CD2 3.79Å; A317-L323 HydrophobicContact CB-CG 3.86Å; S320-L323 PolarHBondContact O-N 2.87Å; S320-L323 PolarHBondContact OG-N 2.84Å; L323-L326 HydrophobicContact CD1-CD2 4.09Å; L323-G327 PolarHBondContact O-N 3.03Å; L323-G327 VanDerWaalsContact O-N 3.09Å
324	Q	85.9	Confident	87.8	Confident	46 Å²	46	58.7 Å²	58.7	22%	0.215	29%	0.292	C	S	.	.	H	α-helix	trans	-64.2	-49.6	167.4	-62.9	173.9	15.5	0	0	110.9	A317 R318 S320 T321 L326 G327 F328	A317-Q324 WeakPolarHBondContact O-CG 3.38Å; A317-Q324 PolarHBondContact O-NE2 2.78Å; R318-Q324 PolarHBondContact O-NE2 2.83Å; S320-Q324 PolarHBondContact O-N 2.85Å; S320-Q324 VanDerWaalsContact O-N 3.07Å; T321-Q324 PolarHBondContact O-N 3.06Å; Q324-L326 PolarHBondContact O-N 2.84Å; Q324-G327 PolarHBondContact O-N 3.15Å; Q324-G327 VanDerWaalsContact O-N 3.09Å; Q324-F328 HydrophobicContact CB-CE2 4.44Å; Q324-F328 WeakPolarHBondContact O-CD2 3.42Å; Q324-F328 PolarHBondContact O-N 2.83Å
325	S	84	Confident	87.8	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-53.2	-42.8	175.2	-176.1	0	0	0	0	111.6	T321 G322 T329 F422	T321-S325 VanDerWaalsContact O-CB 3.31Å; T321-S325 WeakPolarHBondContact O-CB 3.21Å; T321-S325 PolarHBondContact O-N 2.92Å; G322-S325 WeakPolarHBondContact O-CB 3.46Å; G322-S325 PolarHBondContact O-N 3.19Å; S325-T329 VanDerWaalsContact O-CB 3.29Å; S325-T329 WeakPolarHBondContact O-CB 3.33Å; S325-T329 PolarHBondContact O-N 3.44Å; S325-T329 PolarHBondContact O-OG1 3.19Å; S325-F422 WeakPolarHBondContact OG-CE2 3.49Å
326	L	88.4	Confident	87.8	Confident	74 Å²	74	62.2 Å²	62.2	39%	0.387	31%	0.309	S	S	.	.	H	α-helix	trans	-62.1	-49	175.6	-176.2	63.5	0	0	0	111.5	G322 L323 Q324 F328 T329 L330 F422	G322-L326 WeakPolarHBondContact O-CB 3.23Å; G322-L326 PolarHBondContact O-N 3.34Å; L323-L326 HydrophobicContact CD1-CD2 4.09Å; Q324-L326 PolarHBondContact O-N 2.84Å; L326-F328 PolarHBondContact O-N 2.68Å; L326-T329 PolarHBondContact O-N 2.81Å; L326-L330 HydrophobicContact CD1-CD1 4.32Å; L326-L330 HydrophobicContact CD1-CG 4.32Å; L326-L330 HydrophobicContact CG-CD1 4.01Å; L326-L330 HydrophobicContact CG-CG 4.44Å; L326-L330 VanDerWaalsContact O-CG 3.29Å; L326-L330 WeakPolarHBondContact O-CG 3.31Å; L326-L330 PolarHBondContact O-N 2.82Å; L326-F422 HydrophobicContact CB-CE2 4.19Å
327	G	87.3	Confident	87.8	Confident	41 Å²	41	62.3 Å²	62.3	42%	0.423	31%	0.31	S	S	.	.	H	α-helix	trans	-59.1	-43.2	178.1	0	0	0	0	0	113.7	L323 Q324 R331	L323-G327 PolarHBondContact O-N 3.03Å; L323-G327 VanDerWaalsContact O-N 3.09Å; Q324-G327 PolarHBondContact O-N 3.15Å; Q324-G327 VanDerWaalsContact O-N 3.09Å; G327-R331 PolarHBondContact O-N 3.15Å; G327-R331 VanDerWaalsContact O-N 3.12Å
328	F	83.9	Confident	88	Confident	99 Å²	99	63.7 Å²	63.7	43%	0.434	32%	0.324	S	S	.	.	H	α-helix	trans	-68.2	-38	174.4	-71.9	-66.6	0	0	0	112.5	Q324 L326 R331 R332 F425	Q324-F328 HydrophobicContact CB-CE2 4.44Å; Q324-F328 WeakPolarHBondContact O-CD2 3.42Å; Q324-F328 PolarHBondContact O-N 2.83Å; L326-F328 PolarHBondContact O-N 2.68Å; F328-R331 PolarHBondContact O-N 2.84Å; F328-R332 PolarHBondContact O-N 3.34Å; F328-F425 HydrophobicContact CB-CD1 4.19Å; F328-F425 HydrophobicContact CB-CD2 4.4Å; F328-F425 HydrophobicContact CB-CE1 3.6Å; F328-F425 HydrophobicContact CB-CE2 3.84Å; F328-F425 HydrophobicContact CB-CZ 3.41Å; F328-F425 VanDerWaalsContact CB-CZ 3.41Å; F328-F425 HydrophobicContact CD1-CZ 4.41Å; F328-F425 AromaticContact CD2-CE1 3.82Å; F328-F425 HydrophobicContact CD2-CE1 3.82Å; F328-F425 AromaticContact CD2-CZ 3.7Å; F328-F425 HydrophobicContact CD2-CZ 3.7Å; F328-F425 HydrophobicContact CG-CE1 4Å; F328-F425 HydrophobicContact CG-CE2 4.32Å; F328-F425 AromaticContact CG-CZ 3.6Å; F328-F425 HydrophobicContact CG-CZ 3.6Å
329	T	87.8	Confident	88.2	Confident	2 Å²	2	66.1 Å²	66.1	1%	0.012	34%	0.339	C	S	.	.	H	α-helix	trans	-64.6	-43.4	176.6	-57.8	0	0	0	0	111.7	S325 L326 R331 R332 S333 N421 F422	S325-T329 VanDerWaalsContact O-CB 3.29Å; S325-T329 WeakPolarHBondContact O-CB 3.33Å; S325-T329 PolarHBondContact O-N 3.44Å; S325-T329 PolarHBondContact O-OG1 3.19Å; L326-T329 PolarHBondContact O-N 2.81Å; T329-R331 VanDerWaalsContact C-N 3.32Å; T329-R331 PolarHBondContact O-N 2.96Å; T329-R332 PolarHBondContact O-N 3.19Å; T329-S333 VanDerWaalsContact O-CB 3.27Å; T329-S333 WeakPolarHBondContact O-CB 3.41Å; T329-S333 PolarHBondContact O-N 3.17Å; T329-S333 PolarHBondContact O-OG 3.21Å; T329-N421 HydrophobicContact CG2-CB 3.97Å; T329-F422 HydrophobicContact CG2-CB 3.9Å
330	L	89.1	Confident	88.5	Confident	70 Å²	70	65 Å²	65	37%	0.366	33%	0.334	S	S	.	.	H	α-helix	trans	-61.5	-41.1	175.4	-69.7	167.8	0	0	0	110.9	L326 S333 Y334 L337	L326-L330 HydrophobicContact CD1-CD1 4.32Å; L326-L330 HydrophobicContact CD1-CG 4.32Å; L326-L330 HydrophobicContact CG-CD1 4.01Å; L326-L330 HydrophobicContact CG-CG 4.44Å; L326-L330 VanDerWaalsContact O-CG 3.29Å; L326-L330 WeakPolarHBondContact O-CG 3.31Å; L326-L330 PolarHBondContact O-N 2.82Å; L330-S333 CarbonylContact O-C 3.53Å; L330-S333 PolarHBondContact O-N 3.48Å; L330-Y334 PolarHBondContact O-N 3.28Å; L330-Y334 VanDerWaalsContact O-N 3.17Å; L330-L337 HydrophobicContact CD2-CD2 3.91Å
331	R	86.1	Confident	88.8	Confident	201 Å²	201	67.5 Å²	67.5	76%	0.758	34%	0.343	S	S	*	.	H	α-helix	trans	-64.9	-36.3	174.3	-173.9	177.3	177.7	-165.6	-2.6	113	G327 F328 T329 Y334	G327-R331 PolarHBondContact O-N 3.15Å; G327-R331 VanDerWaalsContact O-N 3.12Å; F328-R331 PolarHBondContact O-N 2.84Å; T329-R331 VanDerWaalsContact C-N 3.32Å; T329-R331 PolarHBondContact O-N 2.96Å; R331-Y334 WeakPolarHBondContact O-CD1 3.33Å
332	R	84.9	Confident	89.4	Confident	129 Å²	129	69.1 Å²	69.1	49%	0.487	35%	0.348	S	S	.	.	H	α-helix	trans	-76.7	-31.7	176.4	-178.8	168.5	166.8	-171.6	-13.8	112.8	F328 T329 E424	F328-R332 PolarHBondContact O-N 3.34Å; T329-R332 PolarHBondContact O-N 3.19Å; R332-E424 IonicContact CZ-OE1 3.3Å; R332-E424 IonicContact CZ-OE2 2.87Å; R332-E424 IonicContact NH1-OE1 3.26Å; R332-E424 PolarHBondContact NH1-OE1 3.31Å; R332-E424 IonicContact NH1-OE2 3.79Å; R332-E424 IonicContact NH2-OE1 3.15Å; R332-E424 PolarHBondContact NH2-OE1 2.76Å; R332-E424 IonicContact NH2-OE2 2.63Å; R332-E424 PolarHBondContact NH2-OE2 2.66Å
333	S	90.5	Very high	89.9	Confident	2 Å²	2	71.6 Å²	71.6	1%	0.014	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	21.8	-175.8	-41	0	0	0	0	112.9	T329 L330 N335 E336 L337 N421	T329-S333 VanDerWaalsContact O-CB 3.27Å; T329-S333 WeakPolarHBondContact O-CB 3.41Å; T329-S333 PolarHBondContact O-N 3.17Å; T329-S333 PolarHBondContact O-OG 3.21Å; L330-S333 CarbonylContact O-C 3.53Å; L330-S333 PolarHBondContact O-N 3.48Å; S333-N335 VanDerWaalsContact C-N 3.27Å; S333-N335 PolarHBondContact O-N 3.38Å; S333-E336 PolarHBondContact O-N 2.84Å; S333-L337 PolarHBondContact O-N 3.42Å; S333-N421 PolarHBondContact OG-ND2 3.45Å
334	Y	92.6	Very high	90.3	Very high	154 Å²	154	70.1 Å²	70.1	60%	0.604	34%	0.343	S	S	*	.	H	α-helix	trans	-63.9	-31.2	-172.4	80.3	-80.7	0	0	0	113	L330 R331 G338	L330-Y334 PolarHBondContact O-N 3.28Å; L330-Y334 VanDerWaalsContact O-N 3.17Å; R331-Y334 WeakPolarHBondContact O-CD1 3.33Å; Y334-G338 PolarHBondContact O-N 3.35Å
335	N	91.3	Very high	90.8	Very high	95 Å²	95	70.2 Å²	70.2	51%	0.508	35%	0.353	S	S	.	.	H	α-helix	trans	-63.3	-51.1	172.3	-72	-22.2	0	0	0	111.4	S333 L337 G338 L339	S333-N335 VanDerWaalsContact C-N 3.27Å; S333-N335 PolarHBondContact O-N 3.38Å; N335-L337 VanDerWaalsContact C-N 3.33Å; N335-L337 PolarHBondContact O-N 3.28Å; N335-G338 PolarHBondContact O-N 3.03Å; N335-L339 WeakPolarHBondContact O-CB 3.23Å; N335-L339 PolarHBondContact O-N 3.45Å
336	E	92.9	Very high	91.5	Very high	57 Å²	57	74.8 Å²	74.8	27%	0.266	38%	0.375	S	S	.	.	H	α-helix	trans	-61.7	-40.9	179.5	-45.6	-49.3	132.7	0	0	112	S333 L339 L340 I417 I418	S333-E336 PolarHBondContact O-N 2.84Å; E336-L339 PolarHBondContact O-N 3.36Å; E336-L340 PolarHBondContact O-N 2.9Å; E336-I417 HydrophobicContact CG-CG2 3.95Å; E336-I418 HydrophobicContact CB-CG1 4.24Å
337	L	91.9	Very high	91.9	Very high	55 Å²	55	71.6 Å²	71.6	29%	0.288	36%	0.36	S	S	.	.	H	α-helix	trans	-68.9	-40.3	176.7	-175.9	65.1	0	0	0	111.8	L330 S333 N335 L339 L340 I341 I418	L330-L337 HydrophobicContact CD2-CD2 3.91Å; S333-L337 PolarHBondContact O-N 3.42Å; N335-L337 VanDerWaalsContact C-N 3.33Å; N335-L337 PolarHBondContact O-N 3.28Å; L337-L339 VanDerWaalsContact C-N 3.34Å; L337-L340 PolarHBondContact O-N 3.34Å; L337-I341 HydrophobicContact CD1-CD1 4.44Å; L337-I341 HydrophobicContact CG-CD1 4.11Å; L337-I341 VanDerWaalsContact O-CG1 3.28Å; L337-I341 WeakPolarHBondContact O-CG1 3.5Å; L337-I341 PolarHBondContact O-N 2.98Å; L337-I418 HydrophobicContact CD1-CD1 4.46Å
338	G	93.1	Very high	92.4	Very high	37 Å²	37	71 Å²	71	38%	0.381	35%	0.347	S	S	.	.	H	α-helix	trans	-63.3	-40.3	174.1	0	0	0	0	0	112.1	Y334 N335 I341 L342	Y334-G338 PolarHBondContact O-N 3.35Å; N335-G338 PolarHBondContact O-N 3.03Å; G338-I341 PolarHBondContact O-N 2.86Å; G338-L342 VanDerWaalsContact O-CB 3.3Å; G338-L342 WeakPolarHBondContact O-CB 3.34Å; G338-L342 PolarHBondContact O-N 3.16Å
339	L	92.6	Very high	93	Very high	75 Å²	75	71.4 Å²	71.4	39%	0.393	35%	0.351	S	S	.	.	H	α-helix	trans	-64.7	-43.6	175.5	-173.6	63.4	0	0	0	111.9	N335 E336 L337 L342 F343	N335-L339 WeakPolarHBondContact O-CB 3.23Å; N335-L339 PolarHBondContact O-N 3.45Å; E336-L339 PolarHBondContact O-N 3.36Å; L337-L339 VanDerWaalsContact C-N 3.34Å; L339-L342 PolarHBondContact O-N 3.41Å; L339-F343 HydrophobicContact CD1-CD2 4.13Å; L339-F343 HydrophobicContact CD1-CE1 4.25Å; L339-F343 HydrophobicContact CD1-CE2 3.54Å; L339-F343 HydrophobicContact CD1-CZ 3.61Å; L339-F343 HydrophobicContact CD2-CE2 4Å; L339-F343 HydrophobicContact CG-CD2 3.95Å; L339-F343 HydrophobicContact CG-CE2 3.53Å; L339-F343 HydrophobicContact CG-CZ 4.14Å; L339-F343 WeakPolarHBondContact O-CD2 3.32Å; L339-F343 PolarHBondContact O-N 2.86Å
340	L	93.3	Very high	93.5	Very high	19 Å²	19	75.2 Å²	75.2	10%	0.099	37%	0.371	C	S	.	.	H	α-helix	trans	-58.5	-47.7	173	176.6	58.5	0	0	0	111.8	E336 L337 L342 F343 L344 V410 I411 P414	E336-L340 PolarHBondContact O-N 2.9Å; L337-L340 PolarHBondContact O-N 3.34Å; L340-L342 VanDerWaalsContact C-N 3.34Å; L340-L342 PolarHBondContact O-N 2.86Å; L340-F343 PolarHBondContact O-N 3.35Å; L340-L344 HydrophobicContact CD1-CD1 3.93Å; L340-L344 HydrophobicContact CD1-CG 4.22Å; L340-L344 HydrophobicContact CG-CD1 4.07Å; L340-L344 WeakPolarHBondContact O-CB 3.12Å; L340-L344 WeakPolarHBondContact O-CG 3.39Å; L340-L344 PolarHBondContact O-N 3.34Å; L340-V410 HydrophobicContact CD1-CG1 4.34Å; L340-V410 WeakPolarHBondContact CD1-O 3.07Å; L340-I411 HydrophobicContact CD1-CG1 4.5Å; L340-P414 HydrophobicContact CB-CB 4.07Å; L340-P414 HydrophobicContact CB-CG 3.92Å; L340-P414 HydrophobicContact CD1-CG 4Å; L340-P414 HydrophobicContact CG-CG 4.41Å
341	I	94.6	Very high	93.9	Very high	103 Å²	103	73.2 Å²	73.2	53%	0.528	36%	0.359	S	S	.	.	H	α-helix	trans	-63.7	-40.2	178.6	-69.2	166	0	0	0	110.9	L337 G338 L344 A345	L337-I341 HydrophobicContact CD1-CD1 4.44Å; L337-I341 HydrophobicContact CG-CD1 4.11Å; L337-I341 VanDerWaalsContact O-CG1 3.28Å; L337-I341 WeakPolarHBondContact O-CG1 3.5Å; L337-I341 PolarHBondContact O-N 2.98Å; G338-I341 PolarHBondContact O-N 2.86Å; I341-L344 PolarHBondContact O-N 3.12Å; I341-A345 VanDerWaalsContact O-CB 3.3Å; I341-A345 WeakPolarHBondContact O-CB 3.5Å; I341-A345 PolarHBondContact O-N 3.06Å
342	L	95.1	Very high	94.5	Very high	101 Å²	101	63.7 Å²	63.7	53%	0.529	32%	0.323	S	S	.	.	H	α-helix	trans	-65.1	-45.8	178.2	-177.2	149.1	0	0	0	111.9	G338 L339 L340 A345 M346	G338-L342 VanDerWaalsContact O-CB 3.3Å; G338-L342 WeakPolarHBondContact O-CB 3.34Å; G338-L342 PolarHBondContact O-N 3.16Å; L339-L342 PolarHBondContact O-N 3.41Å; L340-L342 VanDerWaalsContact C-N 3.34Å; L340-L342 PolarHBondContact O-N 2.86Å; L342-A345 PolarHBondContact O-N 3.3Å; L342-M346 WeakPolarHBondContact O-CB 2.99Å; L342-M346 PolarHBondContact O-N 2.87Å
343	F	95.6	Very high	95.1	Very high	79 Å²	79	59.3 Å²	59.3	35%	0.346	31%	0.312	S	S	.	.	H	α-helix	trans	-67.3	-37.3	176.6	-70.6	-37.7	0	0	0	112.6	L339 L340 M346 G347 V410	L339-F343 HydrophobicContact CD1-CD2 4.13Å; L339-F343 HydrophobicContact CD1-CE1 4.25Å; L339-F343 HydrophobicContact CD1-CE2 3.54Å; L339-F343 HydrophobicContact CD1-CZ 3.61Å; L339-F343 HydrophobicContact CD2-CE2 4Å; L339-F343 HydrophobicContact CG-CD2 3.95Å; L339-F343 HydrophobicContact CG-CE2 3.53Å; L339-F343 HydrophobicContact CG-CZ 4.14Å; L339-F343 WeakPolarHBondContact O-CD2 3.32Å; L339-F343 PolarHBondContact O-N 2.86Å; L340-F343 PolarHBondContact O-N 3.35Å; F343-M346 HydrophobicContact CD1-CE 4.33Å; F343-G347 PolarHBondContact O-N 2.97Å; F343-V410 HydrophobicContact CB-CG1 3.67Å; F343-V410 HydrophobicContact CB-CG2 4.38Å
344	L	95.8	Very high	95.4	Very high	33 Å²	33	63.3 Å²	63.3	17%	0.173	33%	0.333	C	S	.	.	H	α-helix	trans	-63.6	-47.7	172.6	-76.9	170.5	0	0	0	111.5	L340 I341 M346 G347 I348 M381 V410 I411	L340-L344 HydrophobicContact CD1-CD1 3.93Å; L340-L344 HydrophobicContact CD1-CG 4.22Å; L340-L344 HydrophobicContact CG-CD1 4.07Å; L340-L344 WeakPolarHBondContact O-CB 3.12Å; L340-L344 WeakPolarHBondContact O-CG 3.39Å; L340-L344 PolarHBondContact O-N 3.34Å; I341-L344 PolarHBondContact O-N 3.12Å; L344-M346 PolarHBondContact O-N 3.16Å; L344-G347 PolarHBondContact O-N 2.71Å; L344-I348 WeakPolarHBondContact O-CB 3.33Å; L344-I348 WeakPolarHBondContact O-CD1 3.4Å; L344-I348 WeakPolarHBondContact O-CG1 3.3Å; L344-I348 PolarHBondContact O-N 2.64Å; L344-M381 HydrophobicContact CD2-CE 4.14Å; L344-V410 HydrophobicContact CD2-CG1 4.02Å; L344-V410 HydrophobicContact CG-CG1 4.02Å; L344-I411 HydrophobicContact CD2-CD1 4.23Å; L344-I411 HydrophobicContact CD2-CG1 4.02Å
345	A	97.1	Very high	95.6	Very high	49 Å²	49	56 Å²	56	41%	0.405	31%	0.305	S	S	.	.	H	α-helix	trans	-61.4	-42.7	178.6	0	0	0	0	0	112.3	I341 L342 M349	I341-A345 VanDerWaalsContact O-CB 3.3Å; I341-A345 WeakPolarHBondContact O-CB 3.5Å; I341-A345 PolarHBondContact O-N 3.06Å; L342-A345 PolarHBondContact O-N 3.3Å; A345-M349 WeakPolarHBondContact O-CG 3.4Å; A345-M349 PolarHBondContact O-N 3.22Å
346	M	97.1	Very high	95.9	Very high	95 Å²	95	53.4 Å²	53.4	47%	0.468	29%	0.289	S	S	.	.	H	α-helix	trans	-63.1	-46.7	174.7	-173.5	-175.1	74.4	0	0	111.6	L342 F343 L344 M349 I350	L342-M346 WeakPolarHBondContact O-CB 2.99Å; L342-M346 PolarHBondContact O-N 2.87Å; F343-M346 HydrophobicContact CD1-CE 4.33Å; L344-M346 PolarHBondContact O-N 3.16Å; M346-M349 PolarHBondContact O-N 3.29Å; M346-I350 HydrophobicContact CG-CD1 3.84Å; M346-I350 VanDerWaalsContact O-CG1 3.31Å; M346-I350 WeakPolarHBondContact O-CG1 3.43Å; M346-I350 PolarHBondContact O-N 2.93Å
347	G	96.8	Very high	96	Very high	7 Å²	7	56.5 Å²	56.5	7%	0.072	30%	0.302	C	S	.	.	H	α-helix	trans	-61.4	-45	178.1	0	0	0	0	0	112.6	F343 L344 I350 F351	F343-G347 PolarHBondContact O-N 2.97Å; L344-G347 PolarHBondContact O-N 2.71Å; G347-I350 PolarHBondContact O-N 2.78Å; G347-F351 WeakPolarHBondContact O-CD2 3.38Å; G347-F351 PolarHBondContact O-N 3.34Å
348	I	97.8	Very high	96.1	Very high	28 Å²	28	54.6 Å²	54.6	14%	0.144	29%	0.294	C	S	.	.	H	α-helix	trans	-57	-52.6	175	-70.7	160.6	0	0	0	109.8	L344 I350 F351 S352 F374 A377 T378 M381	L344-I348 WeakPolarHBondContact O-CB 3.33Å; L344-I348 WeakPolarHBondContact O-CD1 3.4Å; L344-I348 WeakPolarHBondContact O-CG1 3.3Å; L344-I348 PolarHBondContact O-N 2.64Å; I348-I350 VanDerWaalsContact C-N 3.31Å; I348-I350 PolarHBondContact O-N 2.87Å; I348-F351 PolarHBondContact O-N 2.82Å; I348-S352 WeakPolarHBondContact O-CB 3.42Å; I348-S352 PolarHBondContact O-N 3.39Å; I348-S352 PolarHBondContact O-OG 2.87Å; I348-F374 HydrophobicContact CG2-CB 3.91Å; I348-F374 HydrophobicContact CG2-CD1 3.78Å; I348-F374 HydrophobicContact CG2-CG 3.96Å; I348-A377 HydrophobicContact CG2-CB 4.36Å; I348-T378 HydrophobicContact CD1-CG2 4.35Å; I348-T378 WeakPolarHBondContact CD1-OG1 3.41Å; I348-M381 HydrophobicContact CG1-SD 4.1Å
349	M	97.9	Very high	96.2	Very high	108 Å²	108	52.8 Å²	52.8	53%	0.532	28%	0.275	S	S	.	.	H	α-helix	trans	-59	-40.1	179.2	-71.3	-163	-58.9	0	0	113.1	A345 M346 S353 F374	A345-M349 WeakPolarHBondContact O-CG 3.4Å; A345-M349 PolarHBondContact O-N 3.22Å; M346-M349 PolarHBondContact O-N 3.29Å; M349-S353 WeakPolarHBondContact O-CB 3.32Å; M349-S353 PolarHBondContact O-N 3.16Å; M349-S353 PolarHBondContact O-OG 3.34Å; M349-F374 HydrophobicContact CG-CE1 4.13Å; M349-F374 HydrophobicContact CG-CZ 4.13Å
350	I	98.1	Very high	96.1	Very high	83 Å²	83	53.8 Å²	53.8	43%	0.426	28%	0.277	S	S	.	.	H	α-helix	trans	-68.6	-57.1	179.1	-68.6	168.5	0	0	0	110.9	M346 G347 I348 S352 S353 L354	M346-I350 HydrophobicContact CG-CD1 3.84Å; M346-I350 VanDerWaalsContact O-CG1 3.31Å; M346-I350 WeakPolarHBondContact O-CG1 3.43Å; M346-I350 PolarHBondContact O-N 2.93Å; G347-I350 PolarHBondContact O-N 2.78Å; I348-I350 VanDerWaalsContact C-N 3.31Å; I348-I350 PolarHBondContact O-N 2.87Å; I350-S352 PolarHBondContact O-N 2.96Å; I350-S353 PolarHBondContact O-N 3.05Å; I350-S353 VanDerWaalsContact O-N 3.17Å; I350-L354 HydrophobicContact CG2-CD1 3.82Å; I350-L354 HydrophobicContact CG2-CG 4.42Å; I350-L354 WeakPolarHBondContact O-CG 3.14Å; I350-L354 PolarHBondContact O-N 3.13Å
351	F	97.9	Very high	95.8	Very high	28 Å²	28	58.7 Å²	58.7	12%	0.123	30%	0.303	C	S	.	.	H	α-helix	trans	-68.5	-33.6	-174.6	-70.9	-64.3	0	0	0	112.9	G347 I348 S353 L354 V355 A377 M381 V399 L402 C403 A406	G347-F351 WeakPolarHBondContact O-CD2 3.38Å; G347-F351 PolarHBondContact O-N 3.34Å; I348-F351 PolarHBondContact O-N 2.82Å; F351-S353 VanDerWaalsContact C-N 3.34Å; F351-L354 HydrophobicContact CD1-CD1 4.33Å; F351-L354 PolarHBondContact O-N 3.24Å; F351-V355 WeakPolarHBondContact O-CB 3.12Å; F351-V355 WeakPolarHBondContact O-CG1 3.43Å; F351-V355 PolarHBondContact O-N 2.56Å; F351-A377 HydrophobicContact CB-CB 4.33Å; F351-M381 HydrophobicContact CD2-SD 4.06Å; F351-V399 HydrophobicContact CD1-CG1 4.23Å; F351-L402 HydrophobicContact CE1-CB 4.09Å; F351-C403 HydrophobicContact CB-CB 4.15Å; F351-C403 HydrophobicContact CD1-CB 3.73Å; F351-C403 HydrophobicContact CD2-CB 4.18Å; F351-C403 HydrophobicContact CE1-CB 4.16Å; F351-C403 HydrophobicContact CG-CB 3.76Å; F351-A406 HydrophobicContact CE2-CB 3.55Å; F351-A406 HydrophobicContact CZ-CB 3.56Å
352	S	97.7	Very high	95.5	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-65.9	-34.2	172.3	-64.4	0	0	0	0	113.2	I348 I350 F356 S373 F374 A377	I348-S352 WeakPolarHBondContact O-CB 3.42Å; I348-S352 PolarHBondContact O-N 3.39Å; I348-S352 PolarHBondContact O-OG 2.87Å; I350-S352 PolarHBondContact O-N 2.96Å; S352-F356 WeakPolarHBondContact O-CB 3.46Å; S352-F356 PolarHBondContact O-N 3.28Å; S352-S373 WeakPolarHBondContact O-CB 3.36Å; S352-S373 PolarHBondContact OG-O 2.72Å; S352-F374 VanDerWaalsContact OG-CA 3.29Å; S352-F374 WeakPolarHBondContact OG-CA 3.24Å; S352-F374 PolarHBondContact OG-N 3.25Å; S352-A377 WeakPolarHBondContact OG-CB 3.5Å
353	S	97.7	Very high	94.4	Very high	37 Å²	37	62.5 Å²	62.5	26%	0.259	32%	0.321	S	S	.	.	H	α-helix	trans	-71.4	-45.8	173.9	-58.6	0	0	0	0	110.9	M349 I350 F351 F356 F357	M349-S353 WeakPolarHBondContact O-CB 3.32Å; M349-S353 PolarHBondContact O-N 3.16Å; M349-S353 PolarHBondContact O-OG 3.34Å; I350-S353 PolarHBondContact O-N 3.05Å; I350-S353 VanDerWaalsContact O-N 3.17Å; F351-S353 VanDerWaalsContact C-N 3.34Å; S353-F356 PolarHBondContact O-N 3.01Å; S353-F357 WeakPolarHBondContact O-CD2 3.22Å; S353-F357 PolarHBondContact O-N 3.25Å
354	L	97.3	Very high	93.4	Very high	87 Å²	87	62 Å²	62	46%	0.455	33%	0.332	S	S	.	.	H	α-helix	trans	-62.8	-44.8	179.3	-70.3	173.3	0	0	0	112.5	I350 F351 F357 A358 V399	I350-L354 HydrophobicContact CG2-CD1 3.82Å; I350-L354 HydrophobicContact CG2-CG 4.42Å; I350-L354 WeakPolarHBondContact O-CG 3.14Å; I350-L354 PolarHBondContact O-N 3.13Å; F351-L354 HydrophobicContact CD1-CD1 4.33Å; F351-L354 PolarHBondContact O-N 3.24Å; L354-F357 PolarHBondContact O-N 3.44Å; L354-A358 WeakPolarHBondContact O-CB 3.27Å; L354-A358 PolarHBondContact O-N 3.14Å; L354-V399 HydrophobicContact CB-CG1 3.72Å; L354-V399 HydrophobicContact CB-CG2 4.22Å
355	V	96.8	Very high	92.9	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-68.9	-37.4	178.8	79.5	0	0	0	0	111.2	F351 A358 E359 F367 W376 P391 V399	F351-V355 WeakPolarHBondContact O-CB 3.12Å; F351-V355 WeakPolarHBondContact O-CG1 3.43Å; F351-V355 PolarHBondContact O-N 2.56Å; V355-A358 PolarHBondContact O-N 3.38Å; V355-E359 HydrophobicContact CG2-CG 4.04Å; V355-E359 WeakPolarHBondContact O-CB 3.11Å; V355-E359 VanDerWaalsContact O-CG 3.3Å; V355-E359 WeakPolarHBondContact O-CG 3.3Å; V355-E359 PolarHBondContact O-N 3.2Å; V355-F367 HydrophobicContact CB-CE1 4.46Å; V355-F367 HydrophobicContact CG1-CD1 3.82Å; V355-F367 HydrophobicContact CG1-CE1 3.66Å; V355-F367 HydrophobicContact CG1-CZ 4.37Å; V355-F367 HydrophobicContact CG2-CD1 4.46Å; V355-F367 HydrophobicContact CG2-CE1 3.9Å; V355-F367 HydrophobicContact CG2-CE2 4.18Å; V355-F367 HydrophobicContact CG2-CZ 3.74Å; V355-W376 HydrophobicContact CB-CE3 4.16Å; V355-W376 HydrophobicContact CB-CH2 4.02Å; V355-W376 HydrophobicContact CB-CZ3 3.64Å; V355-W376 HydrophobicContact CG1-CD2 4.45Å; V355-W376 HydrophobicContact CG1-CE3 3.62Å; V355-W376 HydrophobicContact CG1-CH2 4.39Å; V355-W376 HydrophobicContact CG1-CZ3 3.59Å; V355-W376 HydrophobicContact CG2-CE3 4.33Å; V355-W376 HydrophobicContact CG2-CH2 3.87Å; V355-W376 HydrophobicContact CG2-CZ2 4.28Å; V355-W376 HydrophobicContact CG2-CZ3 3.92Å; V355-P391 HydrophobicContact CG2-CB 4.17Å; V355-V399 HydrophobicContact CB-CG1 4.19Å
356	F	96.4	Very high	92.5	Very high	41 Å²	41	65.3 Å²	65.3	18%	0.18	34%	0.338	C	S	.	.	H	α-helix	trans	-59.8	-50.2	174.8	175.7	-102.4	0	0	0	110.8	S352 S353 A358 E359 K360 F367 I370	S352-F356 WeakPolarHBondContact O-CB 3.46Å; S352-F356 PolarHBondContact O-N 3.28Å; S353-F356 PolarHBondContact O-N 3.01Å; F356-A358 PolarHBondContact O-N 2.98Å; F356-E359 PolarHBondContact O-N 2.96Å; F356-K360 HydrophobicContact CZ-CB 4.43Å; F356-K360 WeakPolarHBondContact O-CB 3.36Å; F356-K360 PolarHBondContact O-N 3.45Å; F356-F367 VanDerWaalsContact CD2-O 3.22Å; F356-F367 WeakPolarHBondContact CD2-O 3.23Å; F356-F367 WeakPolarHBondContact CE2-O 3.37Å; F356-I370 HydrophobicContact CB-CG1 3.99Å; F356-I370 HydrophobicContact CD1-CD1 4.08Å; F356-I370 HydrophobicContact CD1-CG1 3.53Å; F356-I370 HydrophobicContact CE1-CG1 4.14Å; F356-I370 HydrophobicContact CG-CG1 3.74Å
357	F	95.7	Very high	92.3	Very high	122 Å²	122	61 Å²	61	54%	0.535	32%	0.317	S	S	.	.	H	α-helix	trans	-68.6	-18.9	177.6	-74	-62.4	0	0	0	114.4	S353 L354 K360 I370	S353-F357 WeakPolarHBondContact O-CD2 3.22Å; S353-F357 PolarHBondContact O-N 3.25Å; L354-F357 PolarHBondContact O-N 3.44Å; F357-K360 HydrophobicContact CD1-CD 4.03Å; F357-I370 HydrophobicContact CE2-CD1 4.3Å
358	A	94.9	Very high	92.1	Very high	14 Å²	14	66.1 Å²	66.1	12%	0.116	35%	0.347	C	S	.	.	H	α-helix	trans	-84.8	-24.6	174.3	0	0	0	0	0	114.1	L354 V355 F356 T393 L395	L354-A358 WeakPolarHBondContact O-CB 3.27Å; L354-A358 PolarHBondContact O-N 3.14Å; V355-A358 PolarHBondContact O-N 3.38Å; F356-A358 PolarHBondContact O-N 2.98Å; A358-T393 PolarHBondContact O-OG1 2.86Å; A358-L395 HydrophobicContact CB-CB 4.15Å; A358-L395 HydrophobicContact CB-CD2 3.84Å; A358-L395 HydrophobicContact CB-CG 3.76Å
359	E	94.3	Very high	91.9	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-113.4	-12.7	-173	-61.6	-81.6	131	0	0	113.4	V355 F356 D361 E362 T365 F367 P391 Q392 T393	V355-E359 HydrophobicContact CG2-CG 4.04Å; V355-E359 WeakPolarHBondContact O-CB 3.11Å; V355-E359 VanDerWaalsContact O-CG 3.3Å; V355-E359 WeakPolarHBondContact O-CG 3.3Å; V355-E359 PolarHBondContact O-N 3.2Å; F356-E359 PolarHBondContact O-N 2.96Å; E359-D361 PolarHBondContact O-N 3.45Å; E359-D361 VanDerWaalsContact O-N 3.08Å; E359-E362 PolarHBondContact O-N 3.39Å; E359-E362 VanDerWaalsContact O-N 3.15Å; E359-T365 HydrophobicContact CB-CG2 4.15Å; E359-T365 PolarHBondContact O-OG1 3.3Å; E359-T365 VanDerWaalsContact OE2-CG2 3.28Å; E359-T365 WeakPolarHBondContact OE2-CG2 3.31Å; E359-F367 HydrophobicContact CB-CB 4.32Å; E359-F367 HydrophobicContact CB-CD2 3.6Å; E359-F367 HydrophobicContact CB-CE2 4.29Å; E359-F367 HydrophobicContact CB-CG 4.23Å; E359-F367 HydrophobicContact CG-CD2 3.63Å; E359-F367 HydrophobicContact CG-CE2 3.79Å; E359-F367 HydrophobicContact CG-CG 4.47Å; E359-P391 HydrophobicContact CG-CB 4.25Å; E359-P391 WeakPolarHBondContact OE1-CB 3.45Å; E359-P391 WeakPolarHBondContact OE2-CA 3.5Å; E359-Q392 PolarHBondContact OE1-N 3.05Å; E359-Q392 PolarHBondContact OE2-N 2.93Å; E359-T393 VanDerWaalsContact OE1-CB 3.27Å; E359-T393 WeakPolarHBondContact OE1-CB 3.4Å; E359-T393 WeakPolarHBondContact OE1-CG2 3.33Å; E359-T393 PolarHBondContact OE1-N 3.03Å; E359-T393 PolarHBondContact OE1-OG1 3.14Å
360	K	90.5	Very high	91.8	Very high	96 Å²	96	64 Å²	64	42%	0.417	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-17.7	-174.6	62.7	158.5	-176.1	61.3	0	116.3	F356 F357	F356-K360 HydrophobicContact CZ-CB 4.43Å; F356-K360 WeakPolarHBondContact O-CB 3.36Å; F356-K360 PolarHBondContact O-N 3.45Å; F357-K360 HydrophobicContact CD1-CD 4.03Å
361	D	86.9	Confident	91.7	Very high	121 Å²	121	64.2 Å²	64.2	65%	0.647	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	6.7	-177.4	-57.4	-50.9	0	0	0	112.3	E359	E359-D361 PolarHBondContact O-N 3.45Å; E359-D361 VanDerWaalsContact O-N 3.08Å
362	E	87.6	Confident	91.6	Very high	106 Å²	106	64.5 Å²	64.5	50%	0.495	36%	0.355	S	S	.	.			trans	-114.6	109.1	177.4	-68.9	-79	-173.8	0	0	110.2	E359 A364 T365 T393	E359-E362 PolarHBondContact O-N 3.39Å; E359-E362 VanDerWaalsContact O-N 3.15Å; E362-A364 PolarHBondContact O-N 3.27Å; E362-T365 HydrophobicContact CB-CG2 3.59Å; E362-T365 WeakPolarHBondContact O-CG2 3.47Å; E362-T365 PolarHBondContact O-N 3.48Å; E362-T365 PolarHBondContact O-OG1 3.14Å; E362-T365 VanDerWaalsContact O-OG1 3.1Å; E362-T393 HydrophobicContact CG-CG2 3.58Å
363	D	72.2	Confident	91.5	Very high	178 Å²	178	64.5 Å²	64.5	95%	0.952	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-17.2	-176.1	-66.5	-47.5	0	0	0	114.3
364	A	75.9	Confident	91.5	Very high	70 Å²	70	66.2 Å²	66.2	58%	0.579	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	3.4	-177.8	0	0	0	0	0	114.5	E362 Q392	E362-A364 PolarHBondContact O-N 3.27Å; A364-Q392 PolarHBondContact O-NE2 2.83Å
365	T	84.6	Confident	91.5	Very high	27 Å²	27	67.9 Å²	67.9	17%	0.166	36%	0.358	C	S	.	.			trans	-97.4	157.6	-171.6	72.2	0	0	0	0	113.7	E359 E362	E359-T365 HydrophobicContact CB-CG2 4.15Å; E359-T365 PolarHBondContact O-OG1 3.3Å; E359-T365 VanDerWaalsContact OE2-CG2 3.28Å; E359-T365 WeakPolarHBondContact OE2-CG2 3.31Å; E362-T365 HydrophobicContact CB-CG2 3.59Å; E362-T365 WeakPolarHBondContact O-CG2 3.47Å; E362-T365 PolarHBondContact O-N 3.48Å; E362-T365 PolarHBondContact O-OG1 3.14Å; E362-T365 VanDerWaalsContact O-OG1 3.1Å
366	K	89.1	Confident	91.5	Very high	123 Å²	123	68.2 Å²	68.2	54%	0.535	36%	0.36	S	S	.	.	S	Bend	trans	-94.7	5.1	179.4	-63.4	-178	-175.3	178.6	0	113.6	T368 D388 I389	K366-T368 VanDerWaalsContact C-N 3.28Å; K366-T368 PolarHBondContact O-N 3.13Å; K366-D388 VanDerWaalsContact CD-O 3.27Å; K366-D388 WeakPolarHBondContact CD-O 3.39Å; K366-D388 WeakPolarHBondContact CE-O 3.32Å; K366-D388 PolarHBondContact NZ-O 2.91Å; K366-I389 HydrophobicContact CB-CD1 4.36Å; K366-I389 HydrophobicContact CB-CG1 4.07Å; K366-I389 HydrophobicContact CB-CG2 4.26Å; K366-I389 HydrophobicContact CD-CG1 4.11Å
367	F	92.1	Very high	91.6	Very high	6 Å²	6	66.2 Å²	66.2	3%	0.026	35%	0.351	C	S	.	.			trans	-85.7	63.3	-175.4	-63.3	-76.3	0	0	0	111.5	V355 F356 E359 S369 S373 W376 I389 Y390 P391	V355-F367 HydrophobicContact CB-CE1 4.46Å; V355-F367 HydrophobicContact CG1-CD1 3.82Å; V355-F367 HydrophobicContact CG1-CE1 3.66Å; V355-F367 HydrophobicContact CG1-CZ 4.37Å; V355-F367 HydrophobicContact CG2-CD1 4.46Å; V355-F367 HydrophobicContact CG2-CE1 3.9Å; V355-F367 HydrophobicContact CG2-CE2 4.18Å; V355-F367 HydrophobicContact CG2-CZ 3.74Å; F356-F367 VanDerWaalsContact CD2-O 3.22Å; F356-F367 WeakPolarHBondContact CD2-O 3.23Å; F356-F367 WeakPolarHBondContact CE2-O 3.37Å; E359-F367 HydrophobicContact CB-CB 4.32Å; E359-F367 HydrophobicContact CB-CD2 3.6Å; E359-F367 HydrophobicContact CB-CE2 4.29Å; E359-F367 HydrophobicContact CB-CG 4.23Å; E359-F367 HydrophobicContact CG-CD2 3.63Å; E359-F367 HydrophobicContact CG-CE2 3.79Å; E359-F367 HydrophobicContact CG-CG 4.47Å; F367-S369 VanDerWaalsContact C-N 3.28Å; F367-S369 PolarHBondContact O-N 3.03Å; F367-S373 WeakPolarHBondContact CD1-OG 3.3Å; F367-W376 HydrophobicContact CE1-CB 3.95Å; F367-W376 AromaticContact CE1-CD2 3.88Å; F367-W376 HydrophobicContact CE1-CD2 3.88Å; F367-W376 HydrophobicContact CE1-CE3 4.25Å; F367-W376 AromaticContact CE1-CG 3.73Å; F367-W376 HydrophobicContact CE1-CG 3.73Å; F367-W376 HydrophobicContact CZ-CD2 4.18Å; F367-W376 HydrophobicContact CZ-CG 4.1Å; F367-I389 HydrophobicContact CD1-CG2 4.04Å; F367-I389 HydrophobicContact CE1-CG2 3.46Å; F367-I389 VanDerWaalsContact CE1-CG2 3.46Å; F367-I389 HydrophobicContact CE2-CG2 4.04Å; F367-I389 HydrophobicContact CZ-CG2 3.46Å; F367-I389 VanDerWaalsContact CZ-CG2 3.46Å; F367-Y390 WeakPolarHBondContact CE2-O 3.49Å; F367-P391 HydrophobicContact CE2-CB 4.42Å
368	T	92.3	Very high	91.6	Very high	113 Å²	113	62.9 Å²	62.9	69%	0.693	34%	0.34	S	S	*	.			trans	-67.2	-22.9	-172.2	59.7	0	0	0	0	114.8	K366	K366-T368 VanDerWaalsContact C-N 3.28Å; K366-T368 PolarHBondContact O-N 3.13Å
369	S	94.4	Very high	91.7	Very high	45 Å²	45	62.5 Å²	62.5	32%	0.315	34%	0.337	S	S	.	.	S	Bend	trans	-166.1	157.7	179.2	62.4	0	0	0	0	111.1	F367 A372 S373	F367-S369 VanDerWaalsContact C-N 3.28Å; F367-S369 PolarHBondContact O-N 3.03Å; S369-A372 WeakPolarHBondContact O-CB 3.4Å; S369-A372 PolarHBondContact O-N 3.04Å; S369-A372 WeakPolarHBondContact OG-CB 3.39Å; S369-A372 PolarHBondContact OG-N 3.31Å; S369-S373 PolarHBondContact O-N 3.23Å; S369-S373 PolarHBondContact O-OG 3.08Å; S369-S373 VanDerWaalsContact O-OG 3.08Å
370	I	95.9	Very high	91.9	Very high	48 Å²	48	63.3 Å²	63.3	25%	0.246	34%	0.342	C	S	.	.	H	α-helix	trans	-55.2	-42.4	177.5	-58.1	173.9	0	0	0	112.5	F356 F357 A372 S373 F374	F356-I370 HydrophobicContact CB-CG1 3.99Å; F356-I370 HydrophobicContact CD1-CD1 4.08Å; F356-I370 HydrophobicContact CD1-CG1 3.53Å; F356-I370 HydrophobicContact CE1-CG1 4.14Å; F356-I370 HydrophobicContact CG-CG1 3.74Å; F357-I370 HydrophobicContact CE2-CD1 4.3Å; I370-A372 PolarHBondContact O-N 3.29Å; I370-S373 CarbonylContact O-C 3.52Å; I370-S373 WeakPolarHBondContact O-CA 3.43Å; I370-S373 WeakPolarHBondContact O-CB 3.34Å; I370-S373 PolarHBondContact O-N 3.28Å; I370-F374 HydrophobicContact CG2-CE1 3.87Å; I370-F374 VanDerWaalsContact O-CD1 3.31Å; I370-F374 WeakPolarHBondContact O-CD1 3.36Å; I370-F374 PolarHBondContact O-N 3.45Å; I370-F374 VanDerWaalsContact O-N 3.16Å
371	P	96.4	Very high	92.1	Very high	86 Å²	86	58.8 Å²	58.8	56%	0.558	32%	0.322	S	S	*	.	H	α-helix	trans	-67.1	-32.2	174.7	-23.1	36.1	0	0	0	114.3	S373 F374	P371-S373 VanDerWaalsContact C-N 3.33Å; P371-F374 HydrophobicContact CB-CD2 4.3Å; P371-F374 HydrophobicContact CB-CE2 4.31Å; P371-F374 VanDerWaalsContact O-CB 3.29Å; P371-F374 WeakPolarHBondContact O-CB 3.26Å; P371-F374 PolarHBondContact O-N 3.21Å
372	A	94.2	Very high	92.6	Very high	34 Å²	34	55.3 Å²	55.3	28%	0.281	31%	0.305	S	S	.	.	H	α-helix	trans	-66.4	-38.9	170.9	0	0	0	0	0	111	S369 I370 F374 W375	S369-A372 WeakPolarHBondContact O-CB 3.4Å; S369-A372 PolarHBondContact O-N 3.04Å; S369-A372 WeakPolarHBondContact OG-CB 3.39Å; S369-A372 PolarHBondContact OG-N 3.31Å; I370-A372 PolarHBondContact O-N 3.29Å; A372-F374 PolarHBondContact O-N 3.08Å; A372-W375 PolarHBondContact O-N 3.1Å
373	S	96.4	Very high	93	Very high	0 Å²	0	55 Å²	55	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-64	-15.3	173	-53.9	0	0	0	0	113.8	S352 F367 S369 I370 P371 W375 W376 A377	S352-S373 WeakPolarHBondContact O-CB 3.36Å; S352-S373 PolarHBondContact OG-O 2.72Å; F367-S373 WeakPolarHBondContact CD1-OG 3.3Å; S369-S373 PolarHBondContact O-N 3.23Å; S369-S373 PolarHBondContact O-OG 3.08Å; S369-S373 VanDerWaalsContact O-OG 3.08Å; I370-S373 CarbonylContact O-C 3.52Å; I370-S373 WeakPolarHBondContact O-CA 3.43Å; I370-S373 WeakPolarHBondContact O-CB 3.34Å; I370-S373 PolarHBondContact O-N 3.28Å; P371-S373 VanDerWaalsContact C-N 3.33Å; S373-W375 VanDerWaalsContact C-N 3.3Å; S373-W375 PolarHBondContact O-N 3.37Å; S373-W376 PolarHBondContact O-N 3.38Å; S373-A377 PolarHBondContact O-N 3.35Å; S373-A377 VanDerWaalsContact O-N 3.08Å
374	F	97.4	Very high	94.1	Very high	73 Å²	73	50 Å²	50	32%	0.32	29%	0.286	S	S	.	.	H	α-helix	trans	-63	-35.6	173.4	-67.4	-14.7	0	0	0	111.9	I348 M349 S352 I370 P371 A372 T378	I348-F374 HydrophobicContact CG2-CB 3.91Å; I348-F374 HydrophobicContact CG2-CD1 3.78Å; I348-F374 HydrophobicContact CG2-CG 3.96Å; M349-F374 HydrophobicContact CG-CE1 4.13Å; M349-F374 HydrophobicContact CG-CZ 4.13Å; S352-F374 VanDerWaalsContact OG-CA 3.29Å; S352-F374 WeakPolarHBondContact OG-CA 3.24Å; S352-F374 PolarHBondContact OG-N 3.25Å; I370-F374 HydrophobicContact CG2-CE1 3.87Å; I370-F374 VanDerWaalsContact O-CD1 3.31Å; I370-F374 WeakPolarHBondContact O-CD1 3.36Å; I370-F374 PolarHBondContact O-N 3.45Å; I370-F374 VanDerWaalsContact O-N 3.16Å; P371-F374 HydrophobicContact CB-CD2 4.3Å; P371-F374 HydrophobicContact CB-CE2 4.31Å; P371-F374 VanDerWaalsContact O-CB 3.29Å; P371-F374 WeakPolarHBondContact O-CB 3.26Å; P371-F374 PolarHBondContact O-N 3.21Å; A372-F374 PolarHBondContact O-N 3.08Å; F374-T378 VanDerWaalsContact O-CB 3.3Å; F374-T378 WeakPolarHBondContact O-CB 3.46Å; F374-T378 PolarHBondContact O-N 3.17Å; F374-T378 PolarHBondContact O-OG1 3.41Å
375	W	97.3	Very high	95.1	Very high	122 Å²	122	49 Å²	49	46%	0.462	28%	0.283	S	S	.	.	H	α-helix	trans	-59.5	-53.3	176.2	172	-115	0	0	0	110.7	A372 S373 A377 T378 I379 Y386 D388	A372-W375 PolarHBondContact O-N 3.1Å; S373-W375 VanDerWaalsContact C-N 3.3Å; S373-W375 PolarHBondContact O-N 3.37Å; W375-A377 PolarHBondContact O-N 3.45Å; W375-T378 WeakPolarHBondContact O-CB 3.19Å; W375-T378 PolarHBondContact O-N 3.12Å; W375-I379 HydrophobicContact CD2-CG2 4.17Å; W375-I379 HydrophobicContact CE3-CG2 4.16Å; W375-I379 HydrophobicContact CH2-CG2 4.03Å; W375-I379 HydrophobicContact CZ2-CG2 4.01Å; W375-I379 HydrophobicContact CZ3-CG2 4.09Å; W375-I379 PolarHBondContact O-N 2.92Å; W375-Y386 HydrophobicContact CH2-CD2 4.16Å; W375-Y386 AromaticContact CH2-CE2 3.7Å; W375-Y386 HydrophobicContact CH2-CE2 3.7Å; W375-Y386 AromaticContact CZ2-CD2 3.65Å; W375-Y386 HydrophobicContact CZ2-CD2 3.65Å; W375-Y386 AromaticContact CZ2-CE2 3.68Å; W375-Y386 HydrophobicContact CZ2-CE2 3.68Å; W375-D388 PolarHBondContact NE1-OD2 3.16Å
376	W	97.1	Very high	95.6	Very high	7 Å²	7	55 Å²	55	3%	0.027	30%	0.304	C	S	.	.	H	α-helix	trans	-55.6	-53.3	176.8	174.7	78.9	0	0	0	112.3	V355 F367 S373 T378 I379 T380 I389 P391 C403	V355-W376 HydrophobicContact CB-CE3 4.16Å; V355-W376 HydrophobicContact CB-CH2 4.02Å; V355-W376 HydrophobicContact CB-CZ3 3.64Å; V355-W376 HydrophobicContact CG1-CD2 4.45Å; V355-W376 HydrophobicContact CG1-CE3 3.62Å; V355-W376 HydrophobicContact CG1-CH2 4.39Å; V355-W376 HydrophobicContact CG1-CZ3 3.59Å; V355-W376 HydrophobicContact CG2-CE3 4.33Å; V355-W376 HydrophobicContact CG2-CH2 3.87Å; V355-W376 HydrophobicContact CG2-CZ2 4.28Å; V355-W376 HydrophobicContact CG2-CZ3 3.92Å; F367-W376 HydrophobicContact CE1-CB 3.95Å; F367-W376 AromaticContact CE1-CD2 3.88Å; F367-W376 HydrophobicContact CE1-CD2 3.88Å; F367-W376 HydrophobicContact CE1-CE3 4.25Å; F367-W376 AromaticContact CE1-CG 3.73Å; F367-W376 HydrophobicContact CE1-CG 3.73Å; F367-W376 HydrophobicContact CZ-CD2 4.18Å; F367-W376 HydrophobicContact CZ-CG 4.1Å; S373-W376 PolarHBondContact O-N 3.38Å; W376-T378 VanDerWaalsContact C-N 3.26Å; W376-T378 PolarHBondContact O-N 3.15Å; W376-I379 VanDerWaalsContact O-CG1 3.28Å; W376-I379 WeakPolarHBondContact O-CG1 3.49Å; W376-I379 PolarHBondContact O-N 3.15Å; W376-T380 HydrophobicContact CZ2-CG2 4.35Å; W376-T380 PolarHBondContact NE1-OG1 2.86Å; W376-T380 WeakPolarHBondContact O-CB 3.24Å; W376-T380 PolarHBondContact O-N 2.92Å; W376-T380 PolarHBondContact O-OG1 2.85Å; W376-T380 VanDerWaalsContact O-OG1 3.11Å; W376-I389 HydrophobicContact CB-CB 4.34Å; W376-I389 HydrophobicContact CB-CG2 3.99Å; W376-I389 VanDerWaalsContact CD1-O 3.23Å; W376-I389 HydrophobicContact CG-CG2 4.14Å; W376-P391 HydrophobicContact CZ2-CG 4.2Å; W376-C403 HydrophobicContact CH2-CB 4.19Å
377	A	97.6	Very high	95.8	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-64	-33.6	-178.2	0	0	0	0	0	112	I348 F351 S352 S373 W375 M381	I348-A377 HydrophobicContact CG2-CB 4.36Å; F351-A377 HydrophobicContact CB-CB 4.33Å; S352-A377 WeakPolarHBondContact OG-CB 3.5Å; S373-A377 PolarHBondContact O-N 3.35Å; S373-A377 VanDerWaalsContact O-N 3.08Å; W375-A377 PolarHBondContact O-N 3.45Å; A377-M381 VanDerWaalsContact O-CB 3.24Å; A377-M381 WeakPolarHBondContact O-CB 3.36Å; A377-M381 VanDerWaalsContact O-CG 3.28Å; A377-M381 WeakPolarHBondContact O-CG 3.33Å; A377-M381 PolarHBondContact O-N 3.38Å
378	T	97.3	Very high	95.9	Very high	51 Å²	51	54 Å²	54	31%	0.313	31%	0.314	S	S	.	.	H	α-helix	trans	-63	-51.6	174.4	-56	0	0	0	0	111.1	I348 F374 W375 W376 T380 T382	I348-T378 HydrophobicContact CD1-CG2 4.35Å; I348-T378 WeakPolarHBondContact CD1-OG1 3.41Å; F374-T378 VanDerWaalsContact O-CB 3.3Å; F374-T378 WeakPolarHBondContact O-CB 3.46Å; F374-T378 PolarHBondContact O-N 3.17Å; F374-T378 PolarHBondContact O-OG1 3.41Å; W375-T378 WeakPolarHBondContact O-CB 3.19Å; W375-T378 PolarHBondContact O-N 3.12Å; W376-T378 VanDerWaalsContact C-N 3.26Å; W376-T378 PolarHBondContact O-N 3.15Å; T378-T380 VanDerWaalsContact C-N 3.32Å; T378-T380 PolarHBondContact O-N 2.8Å; T378-T382 WeakPolarHBondContact O-CB 3.3Å; T378-T382 WeakPolarHBondContact O-CG2 3.21Å; T378-T382 PolarHBondContact O-N 3.44Å; T378-T382 PolarHBondContact O-OG1 2.87Å
379	I	96.9	Very high	96	Very high	7 Å²	7	49.8 Å²	49.8	4%	0.036	29%	0.288	C	S	.	.	H	α-helix	trans	-71	-26.7	-178.3	67.4	175.2	0	0	0	112.8	W375 W376 T383 V384 G385 Y386 D388	W375-I379 HydrophobicContact CD2-CG2 4.17Å; W375-I379 HydrophobicContact CE3-CG2 4.16Å; W375-I379 HydrophobicContact CH2-CG2 4.03Å; W375-I379 HydrophobicContact CZ2-CG2 4.01Å; W375-I379 HydrophobicContact CZ3-CG2 4.09Å; W375-I379 PolarHBondContact O-N 2.92Å; W376-I379 VanDerWaalsContact O-CG1 3.28Å; W376-I379 WeakPolarHBondContact O-CG1 3.49Å; W376-I379 PolarHBondContact O-N 3.15Å; I379-T383 PolarHBondContact O-N 2.92Å; I379-V384 HydrophobicContact CB-CB 4.35Å; I379-V384 PolarHBondContact O-N 3.23Å; I379-G385 PolarHBondContact O-N 2.71Å; I379-Y386 HydrophobicContact CB-CD2 4.35Å; I379-Y386 HydrophobicContact CD1-CD2 3.95Å; I379-Y386 HydrophobicContact CG2-CD2 3.88Å; I379-Y386 HydrophobicContact CG2-CE2 3.94Å; I379-D388 WeakPolarHBondContact CD1-OD1 3.21Å
380	T	96.9	Very high	96	Very high	17 Å²	17	54 Å²	54	10%	0.104	30%	0.298	C	S	.	.	H	α-helix	trans	-77.2	-48	174.4	-63.9	0	0	0	0	111.7	W376 T378 T382 T383 C403 C404	W376-T380 HydrophobicContact CZ2-CG2 4.35Å; W376-T380 PolarHBondContact NE1-OG1 2.86Å; W376-T380 WeakPolarHBondContact O-CB 3.24Å; W376-T380 PolarHBondContact O-N 2.92Å; W376-T380 PolarHBondContact O-OG1 2.85Å; W376-T380 VanDerWaalsContact O-OG1 3.11Å; T378-T380 VanDerWaalsContact C-N 3.32Å; T378-T380 PolarHBondContact O-N 2.8Å; T380-T382 VanDerWaalsContact C-N 3.31Å; T380-T382 PolarHBondContact O-N 3.45Å; T380-T383 PolarHBondContact O-N 2.8Å; T380-C403 HydrophobicContact CG2-CB 4.08Å; T380-C404 VanDerWaalsContact CG2-SG 3.5Å
381	M	96.3	Very high	96	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-64.9	-34.3	177.6	-73.4	-171.8	73.5	0	0	112.6	L344 I348 F351 A377 T383 C403 G407 V410 I411	L344-M381 HydrophobicContact CD2-CE 4.14Å; I348-M381 HydrophobicContact CG1-SD 4.1Å; F351-M381 HydrophobicContact CD2-SD 4.06Å; A377-M381 VanDerWaalsContact O-CB 3.24Å; A377-M381 WeakPolarHBondContact O-CB 3.36Å; A377-M381 VanDerWaalsContact O-CG 3.28Å; A377-M381 WeakPolarHBondContact O-CG 3.33Å; A377-M381 PolarHBondContact O-N 3.38Å; M381-T383 PolarHBondContact O-N 2.87Å; M381-C403 VanDerWaalsContact CG-SG 3.6Å; M381-G407 CarbonylContact O-C 3.59Å; M381-G407 WeakPolarHBondContact O-CA 3.23Å; M381-V410 HydrophobicContact CE-CG2 4.48Å; M381-I411 VanDerWaalsContact O-CD1 3.32Å; M381-I411 WeakPolarHBondContact O-CD1 3.38Å
382	T	96.1	Very high	95.8	Very high	48 Å²	48	52.1 Å²	52.1	29%	0.294	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	3.5	174.2	58	0	0	0	0	113.9	T378 T380 V384 I411	T378-T382 WeakPolarHBondContact O-CB 3.3Å; T378-T382 WeakPolarHBondContact O-CG2 3.21Å; T378-T382 PolarHBondContact O-N 3.44Å; T378-T382 PolarHBondContact O-OG1 2.87Å; T380-T382 VanDerWaalsContact C-N 3.31Å; T380-T382 PolarHBondContact O-N 3.45Å; T382-V384 PolarHBondContact O-N 3.13Å; T382-I411 HydrophobicContact CG2-CD1 4.22Å
383	T	96.1	Very high	95.8	Very high	98 Å²	98	51.5 Å²	51.5	60%	0.601	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	17.7	179.9	65.7	0	0	0	0	115.8	I379 T380 M381 V408	I379-T383 PolarHBondContact O-N 2.92Å; T380-T383 PolarHBondContact O-N 2.8Å; M381-T383 PolarHBondContact O-N 2.87Å; T383-V408 HydrophobicContact CG2-CG2 3.63Å
384	V	97	Very high	95.7	Very high	74 Å²	74	58 Å²	58	45%	0.448	31%	0.309	S	S	.	.			trans	-75.2	-43.8	177.8	176.4	0	0	0	0	111.7	I379 T382 Y386	I379-V384 HydrophobicContact CB-CB 4.35Å; I379-V384 PolarHBondContact O-N 3.23Å; T382-V384 PolarHBondContact O-N 3.13Å; V384-Y386 HydrophobicContact CG1-CD1 4.14Å; V384-Y386 HydrophobicContact CG1-CD2 4.12Å; V384-Y386 HydrophobicContact CG1-CE1 3.74Å; V384-Y386 HydrophobicContact CG1-CE2 3.71Å; V384-Y386 HydrophobicContact CG1-CG 4.31Å; V384-Y386 PolarHBondContact O-N 3.24Å
385	G	95.3	Very high	95.6	Very high	49 Å²	49	59.5 Å²	59.5	51%	0.505	32%	0.319	S	S	.	.			trans	52.4	52	165.8	0	0	0	0	0	117.2	I379 G387	I379-G385 PolarHBondContact O-N 2.71Å; G385-G387 PolarHBondContact O-N 3.2Å
386	Y	95.6	Very high	95.5	Very high	154 Å²	154	53.7 Å²	53.7	60%	0.604	30%	0.297	S	S	*	.			trans	-54.7	-21.9	-178.7	-65.8	-61.1	0	0	0	115.9	W375 I379 V384 D388	W375-Y386 HydrophobicContact CH2-CD2 4.16Å; W375-Y386 AromaticContact CH2-CE2 3.7Å; W375-Y386 HydrophobicContact CH2-CE2 3.7Å; W375-Y386 AromaticContact CZ2-CD2 3.65Å; W375-Y386 HydrophobicContact CZ2-CD2 3.65Å; W375-Y386 AromaticContact CZ2-CE2 3.68Å; W375-Y386 HydrophobicContact CZ2-CE2 3.68Å; I379-Y386 HydrophobicContact CB-CD2 4.35Å; I379-Y386 HydrophobicContact CD1-CD2 3.95Å; I379-Y386 HydrophobicContact CG2-CD2 3.88Å; I379-Y386 HydrophobicContact CG2-CE2 3.94Å; V384-Y386 HydrophobicContact CG1-CD1 4.14Å; V384-Y386 HydrophobicContact CG1-CD2 4.12Å; V384-Y386 HydrophobicContact CG1-CE1 3.74Å; V384-Y386 HydrophobicContact CG1-CE2 3.71Å; V384-Y386 HydrophobicContact CG1-CG 4.31Å; V384-Y386 PolarHBondContact O-N 3.24Å; Y386-D388 PolarHBondContact O-N 2.78Å
387	G	93.9	Very high	95.5	Very high	45 Å²	45	59 Å²	59	46%	0.464	32%	0.321	S	S	.	.	S	Bend	trans	75	7.5	179.7	0	0	0	0	0	114.7	G385 Y390	G385-G387 PolarHBondContact O-N 3.2Å; G387-Y390 WeakPolarHBondContact O-CD1 3.36Å
388	D	94.4	Very high	95.5	Very high	61 Å²	61	63.4 Å²	63.4	33%	0.326	34%	0.343	S	S	.	.	S	Bend	trans	-68.9	-35.9	174.5	65.7	-43.6	0	0	0	112.1	K366 W375 I379 Y386	K366-D388 VanDerWaalsContact CD-O 3.27Å; K366-D388 WeakPolarHBondContact CD-O 3.39Å; K366-D388 WeakPolarHBondContact CE-O 3.32Å; K366-D388 PolarHBondContact NZ-O 2.91Å; W375-D388 PolarHBondContact NE1-OD2 3.16Å; I379-D388 WeakPolarHBondContact CD1-OD1 3.21Å; Y386-D388 PolarHBondContact O-N 2.78Å
389	I	93.9	Very high	95.5	Very high	25 Å²	25	61.6 Å²	61.6	13%	0.128	33%	0.332	C	S	.	.	S	Bend	trans	-123.8	136.3	169.5	-58.7	-175.5	0	0	0	108.6	K366 F367 W376	K366-I389 HydrophobicContact CB-CD1 4.36Å; K366-I389 HydrophobicContact CB-CG1 4.07Å; K366-I389 HydrophobicContact CB-CG2 4.26Å; K366-I389 HydrophobicContact CD-CG1 4.11Å; F367-I389 HydrophobicContact CD1-CG2 4.04Å; F367-I389 HydrophobicContact CE1-CG2 3.46Å; F367-I389 VanDerWaalsContact CE1-CG2 3.46Å; F367-I389 HydrophobicContact CE2-CG2 4.04Å; F367-I389 HydrophobicContact CZ-CG2 3.46Å; F367-I389 VanDerWaalsContact CZ-CG2 3.46Å; W376-I389 HydrophobicContact CB-CB 4.34Å; W376-I389 HydrophobicContact CB-CG2 3.99Å; W376-I389 VanDerWaalsContact CD1-O 3.23Å; W376-I389 HydrophobicContact CG-CG2 4.14Å
390	Y	94.4	Very high	95.5	Very high	134 Å²	134	61.7 Å²	61.7	53%	0.525	33%	0.334	S	S	.	.			trans	-155.9	151	174.7	57.6	-92.1	0	0	0	111.1	F367 G387 Q392	F367-Y390 WeakPolarHBondContact CE2-O 3.49Å; G387-Y390 WeakPolarHBondContact O-CD1 3.36Å; Y390-Q392 HydrophobicContact CD2-CG 4.25Å; Y390-Q392 HydrophobicContact CE2-CG 3.91Å
391	P	95.1	Very high	95.5	Very high	15 Å²	15	62.5 Å²	62.5	10%	0.097	35%	0.346	C	S	.	.			trans	-71.8	136	175.2	28.4	-33.9	0	0	0	112.6	V355 E359 F367 W376 G396 K397	V355-P391 HydrophobicContact CG2-CB 4.17Å; E359-P391 HydrophobicContact CG-CB 4.25Å; E359-P391 WeakPolarHBondContact OE1-CB 3.45Å; E359-P391 WeakPolarHBondContact OE2-CA 3.5Å; F367-P391 HydrophobicContact CE2-CB 4.42Å; W376-P391 HydrophobicContact CZ2-CG 4.2Å; P391-G396 WeakPolarHBondContact CB-O 3.36Å; P391-G396 WeakPolarHBondContact CG-O 3.46Å; P391-K397 HydrophobicContact CG-CG 4.3Å; P391-K397 VanDerWaalsContact O-CE 3.29Å; P391-K397 WeakPolarHBondContact O-CE 3.44Å
392	Q	92.6	Very high	95.5	Very high	79 Å²	79	67.2 Å²	67.2	37%	0.369	37%	0.371	S	S	.	.			trans	-99.6	-32.5	178.9	-63.6	-175.6	50.6	0	0	112	E359 A364 Y390 K397	E359-Q392 PolarHBondContact OE1-N 3.05Å; E359-Q392 PolarHBondContact OE2-N 2.93Å; A364-Q392 PolarHBondContact O-NE2 2.83Å; Y390-Q392 HydrophobicContact CD2-CG 4.25Å; Y390-Q392 HydrophobicContact CE2-CG 3.91Å; Q392-K397 VanDerWaalsContact O-CE 3.32Å; Q392-K397 WeakPolarHBondContact O-CE 3.38Å; Q392-K397 PolarHBondContact O-NZ 3.2Å
393	T	94.8	Very high	95.6	Very high	22 Å²	22	64.9 Å²	64.9	14%	0.135	36%	0.357	C	S	.	.	S	Bend	trans	-71.5	160.7	178.9	70.8	0	0	0	0	112.2	A358 E359 E362 L395 G396 K397	A358-T393 PolarHBondContact O-OG1 2.86Å; E359-T393 VanDerWaalsContact OE1-CB 3.27Å; E359-T393 WeakPolarHBondContact OE1-CB 3.4Å; E359-T393 WeakPolarHBondContact OE1-CG2 3.33Å; E359-T393 PolarHBondContact OE1-N 3.03Å; E359-T393 PolarHBondContact OE1-OG1 3.14Å; E362-T393 HydrophobicContact CG-CG2 3.58Å; T393-L395 VanDerWaalsContact C-N 3.32Å; T393-L395 PolarHBondContact OG1-N 3.36Å; T393-G396 PolarHBondContact OG1-N 3.39Å; T393-K397 WeakPolarHBondContact O-CB 3.24Å; T393-K397 VanDerWaalsContact O-CD 3.31Å; T393-K397 WeakPolarHBondContact O-CD 3.5Å; T393-K397 WeakPolarHBondContact O-CG 3.34Å; T393-K397 PolarHBondContact O-N 2.98Å
394	L	94.5	Very high	95.6	Very high	137 Å²	137	63 Å²	63	72%	0.717	35%	0.347	S	S	*	.	H	α-helix	trans	-62.9	-39.7	171.1	-179.2	60.3	0	0	0	111.7	K397 I398	L394-K397 PolarHBondContact O-N 3.46Å; L394-I398 HydrophobicContact CD1-CD1 4.44Å; L394-I398 HydrophobicContact CG-CD1 4.23Å; L394-I398 WeakPolarHBondContact O-CG1 3.48Å; L394-I398 PolarHBondContact O-N 2.95Å
395	L	95	Very high	95.6	Very high	104 Å²	104	64.6 Å²	64.6	55%	0.545	35%	0.352	S	S	.	.	H	α-helix	trans	-68.3	-47	-179	-176.9	61.6	0	0	0	111.5	A358 T393 K397 I398 V399	A358-L395 HydrophobicContact CB-CB 4.15Å; A358-L395 HydrophobicContact CB-CD2 3.84Å; A358-L395 HydrophobicContact CB-CG 3.76Å; T393-L395 VanDerWaalsContact C-N 3.32Å; T393-L395 PolarHBondContact OG1-N 3.36Å; L395-K397 VanDerWaalsContact C-N 3.29Å; L395-K397 PolarHBondContact O-N 2.74Å; L395-I398 WeakPolarHBondContact O-CB 3.49Å; L395-I398 PolarHBondContact O-N 3.17Å; L395-I398 VanDerWaalsContact O-N 3.14Å; L395-V399 WeakPolarHBondContact O-CG2 3.43Å; L395-V399 PolarHBondContact O-N 2.97Å
396	G	95.6	Very high	95.7	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-60.7	-36.6	174.7	0	0	0	0	0	112.4	P391 T393 V399 G400	P391-G396 WeakPolarHBondContact CB-O 3.36Å; P391-G396 WeakPolarHBondContact CG-O 3.46Å; T393-G396 PolarHBondContact OG1-N 3.39Å; G396-V399 PolarHBondContact O-N 3.42Å; G396-G400 PolarHBondContact O-N 3.46Å
397	K	96.3	Very high	95.7	Very high	118 Å²	118	56.1 Å²	56.1	51%	0.513	31%	0.309	S	S	.	.	H	α-helix	trans	-65.5	-38.4	173.1	-75.8	164.4	-179.1	157	0	112.7	P391 Q392 T393 L394 L395 G400 G401	P391-K397 HydrophobicContact CG-CG 4.3Å; P391-K397 VanDerWaalsContact O-CE 3.29Å; P391-K397 WeakPolarHBondContact O-CE 3.44Å; Q392-K397 VanDerWaalsContact O-CE 3.32Å; Q392-K397 WeakPolarHBondContact O-CE 3.38Å; Q392-K397 PolarHBondContact O-NZ 3.2Å; T393-K397 WeakPolarHBondContact O-CB 3.24Å; T393-K397 VanDerWaalsContact O-CD 3.31Å; T393-K397 WeakPolarHBondContact O-CD 3.5Å; T393-K397 WeakPolarHBondContact O-CG 3.34Å; T393-K397 PolarHBondContact O-N 2.98Å; L394-K397 PolarHBondContact O-N 3.46Å; L395-K397 VanDerWaalsContact C-N 3.29Å; L395-K397 PolarHBondContact O-N 2.74Å; K397-G400 PolarHBondContact O-N 3.39Å; K397-G401 PolarHBondContact O-N 3.49Å
398	I	97.7	Very high	95.8	Very high	93 Å²	93	57.7 Å²	57.7	48%	0.477	31%	0.309	S	S	.	.	H	α-helix	trans	-65	-46.1	172.7	-67.8	163	0	0	0	110.5	L394 L395 G400 G401 L402	L394-I398 HydrophobicContact CD1-CD1 4.44Å; L394-I398 HydrophobicContact CG-CD1 4.23Å; L394-I398 WeakPolarHBondContact O-CG1 3.48Å; L394-I398 PolarHBondContact O-N 2.95Å; L395-I398 WeakPolarHBondContact O-CB 3.49Å; L395-I398 PolarHBondContact O-N 3.17Å; L395-I398 VanDerWaalsContact O-N 3.14Å; I398-G400 VanDerWaalsContact C-N 3.29Å; I398-G400 PolarHBondContact O-N 3.37Å; I398-G401 PolarHBondContact O-N 3.48Å; I398-L402 HydrophobicContact CG2-CD1 4.31Å; I398-L402 WeakPolarHBondContact O-CG 3.39Å; I398-L402 PolarHBondContact O-N 2.76Å
399	V	97.5	Very high	95.9	Very high	13 Å²	13	59.8 Å²	59.8	8%	0.079	32%	0.32	C	S	.	.	H	α-helix	trans	-59.4	-40.3	174.4	173.3	0	0	0	0	111.3	F351 L354 V355 L395 G396 L402 C403	F351-V399 HydrophobicContact CD1-CG1 4.23Å; L354-V399 HydrophobicContact CB-CG1 3.72Å; L354-V399 HydrophobicContact CB-CG2 4.22Å; V355-V399 HydrophobicContact CB-CG1 4.19Å; L395-V399 WeakPolarHBondContact O-CG2 3.43Å; L395-V399 PolarHBondContact O-N 2.97Å; G396-V399 PolarHBondContact O-N 3.42Å; V399-L402 PolarHBondContact O-N 3.25Å; V399-C403 VanDerWaalsContact O-CB 3.24Å; V399-C403 WeakPolarHBondContact O-CB 3.26Å; V399-C403 PolarHBondContact O-N 2.93Å
400	G	96.5	Very high	95.9	Very high	8 Å²	8	60.1 Å²	60.1	8%	0.082	32%	0.323	C	S	.	.	H	α-helix	trans	-61.8	-45.2	173.9	0	0	0	0	0	113.2	G396 K397 I398 L402 C403 C404	G396-G400 PolarHBondContact O-N 3.46Å; K397-G400 PolarHBondContact O-N 3.39Å; I398-G400 VanDerWaalsContact C-N 3.29Å; I398-G400 PolarHBondContact O-N 3.37Å; G400-L402 PolarHBondContact O-N 3.26Å; G400-C403 WeakPolarHBondContact O-CB 3.38Å; G400-C403 PolarHBondContact O-N 2.87Å; G400-C404 PolarHBondContact O-N 3.18Å; G400-C404 PolarHBondContact O-SG 3.09Å
401	G	96.5	Very high	95.9	Very high	34 Å²	34	55.6 Å²	55.6	35%	0.351	31%	0.308	S	S	.	.	H	α-helix	trans	-59.8	-44.1	174.5	0	0	0	0	0	112.8	K397 I398 C404 I405	K397-G401 PolarHBondContact O-N 3.49Å; I398-G401 PolarHBondContact O-N 3.48Å; G401-C404 PolarHBondContact O-N 2.77Å; G401-I405 WeakPolarHBondContact O-CG1 3.38Å; G401-I405 PolarHBondContact O-N 2.94Å
402	L	97.3	Very high	95.9	Very high	100 Å²	100	57.4 Å²	57.4	52%	0.524	32%	0.324	S	S	.	.	H	α-helix	trans	-64.9	-39.9	174.7	-66.6	172.2	0	0	0	112.1	F351 I398 V399 G400 I405 A406	F351-L402 HydrophobicContact CE1-CB 4.09Å; I398-L402 HydrophobicContact CG2-CD1 4.31Å; I398-L402 WeakPolarHBondContact O-CG 3.39Å; I398-L402 PolarHBondContact O-N 2.76Å; V399-L402 PolarHBondContact O-N 3.25Å; G400-L402 PolarHBondContact O-N 3.26Å; L402-I405 PolarHBondContact O-N 3.46Å; L402-A406 VanDerWaalsContact O-CB 3.26Å; L402-A406 WeakPolarHBondContact O-CB 3.49Å; L402-A406 PolarHBondContact O-N 2.89Å
403	C	97.8	Very high	95.7	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-61.3	-45.5	176.4	-175.1	0	0	0	0	111.9	F351 W376 T380 M381 V399 G400 A406 G407	F351-C403 HydrophobicContact CB-CB 4.15Å; F351-C403 HydrophobicContact CD1-CB 3.73Å; F351-C403 HydrophobicContact CD2-CB 4.18Å; F351-C403 HydrophobicContact CE1-CB 4.16Å; F351-C403 HydrophobicContact CG-CB 3.76Å; W376-C403 HydrophobicContact CH2-CB 4.19Å; T380-C403 HydrophobicContact CG2-CB 4.08Å; M381-C403 VanDerWaalsContact CG-SG 3.6Å; V399-C403 VanDerWaalsContact O-CB 3.24Å; V399-C403 WeakPolarHBondContact O-CB 3.26Å; V399-C403 PolarHBondContact O-N 2.93Å; G400-C403 WeakPolarHBondContact O-CB 3.38Å; G400-C403 PolarHBondContact O-N 2.87Å; C403-A406 PolarHBondContact O-N 3.07Å; C403-G407 PolarHBondContact O-N 3.04Å
404	C	96.6	Very high	95.5	Very high	58 Å²	58	59.1 Å²	59.1	39%	0.392	33%	0.334	S	S	.	.	H	α-helix	trans	-58	-50.2	174.4	-69.3	0	0	0	0	112.1	T380 G400 G401 G407 V408	T380-C404 VanDerWaalsContact CG2-SG 3.5Å; G400-C404 PolarHBondContact O-N 3.18Å; G400-C404 PolarHBondContact O-SG 3.09Å; G401-C404 PolarHBondContact O-N 2.77Å; C404-G407 PolarHBondContact O-N 3.41Å; C404-V408 WeakPolarHBondContact O-CG2 3.3Å; C404-V408 PolarHBondContact O-N 3.18Å; C404-V408 VanDerWaalsContact O-N 3.11Å
405	I	96.9	Very high	95.4	Very high	107 Å²	107	56.2 Å²	56.2	55%	0.549	32%	0.319	S	S	.	.	H	α-helix	trans	-64.1	-46.1	-178.2	-65.6	166.4	0	0	0	110.5	G401 L402 V408 L409	G401-I405 WeakPolarHBondContact O-CG1 3.38Å; G401-I405 PolarHBondContact O-N 2.94Å; L402-I405 PolarHBondContact O-N 3.46Å; I405-V408 PolarHBondContact O-N 2.82Å; I405-L409 HydrophobicContact CG2-CD1 4Å; I405-L409 WeakPolarHBondContact O-CG 3.5Å; I405-L409 PolarHBondContact O-N 3.03Å; I405-L409 VanDerWaalsContact O-N 3.11Å
406	A	96.8	Very high	95.3	Very high	26 Å²	26	55 Å²	55	22%	0.215	32%	0.317	C	S	.	.	H	α-helix	trans	-64.4	-40.2	178.6	0	0	0	0	0	112.5	F351 L402 C403 L409 V410	F351-A406 HydrophobicContact CE2-CB 3.55Å; F351-A406 HydrophobicContact CZ-CB 3.56Å; L402-A406 VanDerWaalsContact O-CB 3.26Å; L402-A406 WeakPolarHBondContact O-CB 3.49Å; L402-A406 PolarHBondContact O-N 2.89Å; C403-A406 PolarHBondContact O-N 3.07Å; A406-L409 PolarHBondContact O-N 3.02Å; A406-V410 WeakPolarHBondContact O-CB 3.5Å; A406-V410 VanDerWaalsContact O-CG2 3.3Å; A406-V410 WeakPolarHBondContact O-CG2 3.31Å; A406-V410 PolarHBondContact O-N 2.97Å
407	G	96.3	Very high	95	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-59.9	-49.4	176.1	0	0	0	0	0	112.8	M381 C403 C404 L409 V410 I411	M381-G407 CarbonylContact O-C 3.59Å; M381-G407 WeakPolarHBondContact O-CA 3.23Å; C403-G407 PolarHBondContact O-N 3.04Å; C404-G407 PolarHBondContact O-N 3.41Å; G407-L409 VanDerWaalsContact C-N 3.34Å; G407-L409 PolarHBondContact O-N 3.3Å; G407-V410 PolarHBondContact O-N 3.04Å; G407-I411 WeakPolarHBondContact O-CB 3.48Å; G407-I411 WeakPolarHBondContact O-CG1 3.42Å; G407-I411 PolarHBondContact O-N 3.06Å
408	V	96.2	Very high	94.8	Very high	78 Å²	78	54.2 Å²	54.2	47%	0.473	32%	0.317	S	S	.	.	H	α-helix	trans	-57.2	-46.4	175.3	171.7	0	0	0	0	111.2	T383 C404 I405 I411 A412	T383-V408 HydrophobicContact CG2-CG2 3.63Å; C404-V408 WeakPolarHBondContact O-CG2 3.3Å; C404-V408 PolarHBondContact O-N 3.18Å; C404-V408 VanDerWaalsContact O-N 3.11Å; I405-V408 PolarHBondContact O-N 2.82Å; V408-I411 PolarHBondContact O-N 3.11Å; V408-A412 WeakPolarHBondContact O-CB 3.28Å; V408-A412 PolarHBondContact O-N 3.08Å
409	L	95.4	Very high	94.5	Very high	105 Å²	105	53.8 Å²	53.8	55%	0.55	32%	0.319	S	S	.	.	H	α-helix	trans	-65.3	-44.7	179.7	-69.3	170.8	0	0	0	112.7	I405 A406 G407 I411 A412 L413	I405-L409 HydrophobicContact CG2-CD1 4Å; I405-L409 WeakPolarHBondContact O-CG 3.5Å; I405-L409 PolarHBondContact O-N 3.03Å; I405-L409 VanDerWaalsContact O-N 3.11Å; A406-L409 PolarHBondContact O-N 3.02Å; G407-L409 VanDerWaalsContact C-N 3.34Å; G407-L409 PolarHBondContact O-N 3.3Å; L409-I411 VanDerWaalsContact C-N 3.32Å; L409-I411 PolarHBondContact O-N 3.11Å; L409-A412 PolarHBondContact O-N 3.26Å; L409-L413 WeakPolarHBondContact O-CG 3.43Å; L409-L413 PolarHBondContact O-N 3.13Å
410	V	94.6	Very high	94.1	Very high	31 Å²	31	57.9 Å²	57.9	19%	0.188	34%	0.34	C	S	.	.	H	α-helix	trans	-62.4	-38.7	178.6	165	0	0	0	0	111.7	L340 F343 L344 M381 A406 G407 P414	L340-V410 HydrophobicContact CD1-CG1 4.34Å; L340-V410 WeakPolarHBondContact CD1-O 3.07Å; F343-V410 HydrophobicContact CB-CG1 3.67Å; F343-V410 HydrophobicContact CB-CG2 4.38Å; L344-V410 HydrophobicContact CD2-CG1 4.02Å; L344-V410 HydrophobicContact CG-CG1 4.02Å; M381-V410 HydrophobicContact CE-CG2 4.48Å; A406-V410 WeakPolarHBondContact O-CB 3.5Å; A406-V410 VanDerWaalsContact O-CG2 3.3Å; A406-V410 WeakPolarHBondContact O-CG2 3.31Å; A406-V410 PolarHBondContact O-N 2.97Å; G407-V410 PolarHBondContact O-N 3.04Å; V410-P414 WeakPolarHBondContact O-CD 3.48Å
411	I	94.1	Very high	93.8	Very high	40 Å²	40	58.8 Å²	58.8	21%	0.205	34%	0.343	C	S	.	.	H	α-helix	trans	-77.5	-36.3	179.7	-68.2	175.6	0	0	0	111.6	L340 L344 M381 T382 G407 V408 L409 L413 I415	L340-I411 HydrophobicContact CD1-CG1 4.5Å; L344-I411 HydrophobicContact CD2-CD1 4.23Å; L344-I411 HydrophobicContact CD2-CG1 4.02Å; M381-I411 VanDerWaalsContact O-CD1 3.32Å; M381-I411 WeakPolarHBondContact O-CD1 3.38Å; T382-I411 HydrophobicContact CG2-CD1 4.22Å; G407-I411 WeakPolarHBondContact O-CB 3.48Å; G407-I411 WeakPolarHBondContact O-CG1 3.42Å; G407-I411 PolarHBondContact O-N 3.06Å; V408-I411 PolarHBondContact O-N 3.11Å; L409-I411 VanDerWaalsContact C-N 3.32Å; L409-I411 PolarHBondContact O-N 3.11Å; I411-L413 PolarHBondContact O-N 3.29Å; I411-I415 HydrophobicContact CG2-CD1 3.54Å; I411-I415 WeakPolarHBondContact O-CG1 3.48Å
412	A	94.1	Very high	93.4	Very high	53 Å²	53	60.2 Å²	60.2	44%	0.438	34%	0.34	S	S	.	.	H	α-helix	trans	-70.6	-23.2	-176	0	0	0	0	0	114.6	V408 L409 P416	V408-A412 WeakPolarHBondContact O-CB 3.28Å; V408-A412 PolarHBondContact O-N 3.08Å; L409-A412 PolarHBondContact O-N 3.26Å; A412-P416 WeakPolarHBondContact O-CD 3.28Å; A412-P416 VanDerWaalsContact O-CG 3.32Å; A412-P416 WeakPolarHBondContact O-CG 3.49Å
413	L	89.8	Confident	93	Very high	129 Å²	129	57.3 Å²	57.3	68%	0.675	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-48.3	-176.6	-67.6	167.5	0	0	0	113.9	L409 I411	L409-L413 WeakPolarHBondContact O-CG 3.43Å; L409-L413 PolarHBondContact O-N 3.13Å; I411-L413 PolarHBondContact O-N 3.29Å
414	P	90.1	Very high	92.3	Very high	7 Å²	7	61.2 Å²	61.2	5%	0.045	35%	0.346	C	S	.	.	H	α-helix	trans	-84.9	-25.8	-175	-16.6	35.7	0	0	0	113.7	L340 V410 I417 I418	L340-P414 HydrophobicContact CB-CB 4.07Å; L340-P414 HydrophobicContact CB-CG 3.92Å; L340-P414 HydrophobicContact CD1-CG 4Å; L340-P414 HydrophobicContact CG-CG 4.41Å; V410-P414 WeakPolarHBondContact O-CD 3.48Å; P414-I417 WeakPolarHBondContact O-CB 3.46Å; P414-I417 PolarHBondContact O-N 3.45Å; P414-I417 VanDerWaalsContact O-N 3.15Å; P414-I418 WeakPolarHBondContact O-CG1 3.42Å; P414-I418 PolarHBondContact O-N 3.17Å
415	I	91.6	Very high	91.7	Very high	77 Å²	77	60.8 Å²	60.8	40%	0.395	34%	0.338	S	S	.	.	H	α-helix	trans	-58.7	-46.8	-178	-73.8	-178.4	0	0	0	112.7	I411 I417 I418 V419	I411-I415 HydrophobicContact CG2-CD1 3.54Å; I411-I415 WeakPolarHBondContact O-CG1 3.48Å; I415-I417 PolarHBondContact O-N 3.47Å; I415-I418 PolarHBondContact O-N 3.11Å; I415-V419 HydrophobicContact CG2-CG2 4.06Å; I415-V419 WeakPolarHBondContact O-CB 3.36Å; I415-V419 VanDerWaalsContact O-CG2 3.3Å; I415-V419 WeakPolarHBondContact O-CG2 3.33Å; I415-V419 PolarHBondContact O-N 3.22Å
416	P	93.2	Very high	91.1	Very high	77 Å²	77	60 Å²	60	50%	0.5	33%	0.329	S	S	.	.	H	α-helix	trans	-57.4	-35.1	175.6	-27.6	36.3	0	0	0	113.8	A412 N420	A412-P416 WeakPolarHBondContact O-CD 3.28Å; A412-P416 VanDerWaalsContact O-CG 3.32Å; A412-P416 WeakPolarHBondContact O-CG 3.49Å; P416-N420 WeakPolarHBondContact O-CB 3.35Å; P416-N420 PolarHBondContact O-N 2.7Å
417	I	90.4	Very high	90.6	Very high	74 Å²	74	65.2 Å²	65.2	38%	0.379	35%	0.346	S	S	.	.	H	α-helix	trans	-67.9	-48	177.5	-52	176.3	0	0	0	109.9	E336 P414 I415 V419 N420 N421	E336-I417 HydrophobicContact CG-CG2 3.95Å; P414-I417 WeakPolarHBondContact O-CB 3.46Å; P414-I417 PolarHBondContact O-N 3.45Å; P414-I417 VanDerWaalsContact O-N 3.15Å; I415-I417 PolarHBondContact O-N 3.47Å; I417-V419 VanDerWaalsContact C-N 3.33Å; I417-V419 PolarHBondContact O-N 3.08Å; I417-N420 PolarHBondContact O-N 3.24Å; I417-N421 WeakPolarHBondContact O-CB 3.2Å; I417-N421 VanDerWaalsContact O-CG 3.29Å; I417-N421 PolarHBondContact O-N 3.08Å
418	I	91	Very high	89.7	Confident	28 Å²	28	67.7 Å²	67.7	14%	0.144	36%	0.358	C	S	.	.	H	α-helix	trans	-62.2	-40.4	176.9	-63.1	166.4	0	0	0	111	E336 L337 P414 I415 N421 F422	E336-I418 HydrophobicContact CB-CG1 4.24Å; L337-I418 HydrophobicContact CD1-CD1 4.46Å; P414-I418 WeakPolarHBondContact O-CG1 3.42Å; P414-I418 PolarHBondContact O-N 3.17Å; I415-I418 PolarHBondContact O-N 3.11Å; I418-N421 PolarHBondContact O-N 2.73Å; I418-F422 WeakPolarHBondContact O-CB 3.4Å; I418-F422 PolarHBondContact O-N 3.36Å
419	V	91.8	Very high	89	Confident	85 Å²	85	65.4 Å²	65.4	52%	0.515	34%	0.342	S	S	.	.	H	α-helix	trans	-68.4	-37.7	176.9	169.9	0	0	0	0	111.8	I415 I417 F422 S423	I415-V419 HydrophobicContact CG2-CG2 4.06Å; I415-V419 WeakPolarHBondContact O-CB 3.36Å; I415-V419 VanDerWaalsContact O-CG2 3.3Å; I415-V419 WeakPolarHBondContact O-CG2 3.33Å; I415-V419 PolarHBondContact O-N 3.22Å; I417-V419 VanDerWaalsContact C-N 3.33Å; I417-V419 PolarHBondContact O-N 3.08Å; V419-F422 PolarHBondContact O-N 2.8Å; V419-S423 WeakPolarHBondContact O-CB 3.38Å; V419-S423 PolarHBondContact O-N 3.18Å
420	N	90.4	Very high	88.3	Confident	98 Å²	98	65 Å²	65	52%	0.524	34%	0.336	S	S	.	.	H	α-helix	trans	-66.7	-45.4	174.2	-173.6	59.2	0	0	0	111.4	P416 I417 F422 S423 E424	P416-N420 WeakPolarHBondContact O-CB 3.35Å; P416-N420 PolarHBondContact O-N 2.7Å; I417-N420 PolarHBondContact O-N 3.24Å; N420-F422 VanDerWaalsContact C-N 3.29Å; N420-F422 PolarHBondContact O-N 3.33Å; N420-S423 WeakPolarHBondContact O-CB 3.24Å; N420-S423 PolarHBondContact O-N 2.73Å; N420-S423 VanDerWaalsContact O-N 3.09Å; N420-E424 PolarHBondContact O-N 3.1Å
421	N	88.2	Confident	87.6	Confident	27 Å²	27	68.8 Å²	68.8	14%	0.144	35%	0.347	C	S	.	.	H	α-helix	trans	-59.3	-39.4	174.1	-69.8	-12.9	0	0	0	111.8	T329 S333 I417 I418 F425	T329-N421 HydrophobicContact CG2-CB 3.97Å; S333-N421 PolarHBondContact OG-ND2 3.45Å; I417-N421 WeakPolarHBondContact O-CB 3.2Å; I417-N421 VanDerWaalsContact O-CG 3.29Å; I417-N421 PolarHBondContact O-N 3.08Å; I418-N421 PolarHBondContact O-N 2.73Å; N421-F425 WeakPolarHBondContact O-CB 3.46Å; N421-F425 PolarHBondContact O-N 3.02Å
422	F	88.8	Confident	86.8	Confident	64 Å²	64	70.3 Å²	70.3	28%	0.281	35%	0.353	S	S	.	.	H	α-helix	trans	-64	-44.2	172.9	-176.4	-99.7	0	0	0	111.8	S325 L326 T329 I418 V419 N420 F425 Y426	S325-F422 WeakPolarHBondContact OG-CE2 3.49Å; L326-F422 HydrophobicContact CB-CE2 4.19Å; T329-F422 HydrophobicContact CG2-CB 3.9Å; I418-F422 WeakPolarHBondContact O-CB 3.4Å; I418-F422 PolarHBondContact O-N 3.36Å; V419-F422 PolarHBondContact O-N 2.8Å; N420-F422 VanDerWaalsContact C-N 3.29Å; N420-F422 PolarHBondContact O-N 3.33Å; F422-F425 PolarHBondContact O-N 2.78Å; F422-Y426 WeakPolarHBondContact O-CB 3.34Å; F422-Y426 PolarHBondContact O-N 2.92Å
423	S	88.6	Confident	85.9	Confident	39 Å²	39	71.9 Å²	71.9	27%	0.273	35%	0.351	S	S	.	.	H	α-helix	trans	-61.8	-44.4	178.8	-168.2	0	0	0	0	111.5	V419 N420 K427	V419-S423 WeakPolarHBondContact O-CB 3.38Å; V419-S423 PolarHBondContact O-N 3.18Å; N420-S423 WeakPolarHBondContact O-CB 3.24Å; N420-S423 PolarHBondContact O-N 2.73Å; N420-S423 VanDerWaalsContact O-N 3.09Å; S423-K427 VanDerWaalsContact O-CB 3.3Å; S423-K427 WeakPolarHBondContact O-CB 3.33Å; S423-K427 VanDerWaalsContact O-CD 3.24Å; S423-K427 WeakPolarHBondContact O-CD 3.47Å; S423-K427 WeakPolarHBondContact O-CG 3.29Å; S423-K427 PolarHBondContact O-N 2.9Å; S423-K427 WeakPolarHBondContact OG-CE 3.3Å; S423-K427 PolarHBondContact OG-NZ 3.45Å
424	E	84.3	Confident	85.5	Confident	83 Å²	83	71.4 Å²	71.4	39%	0.388	34%	0.344	S	S	.	.	H	α-helix	trans	-60.5	-56.4	173.7	-168.1	-157.3	121.3	0	0	111.1	R332 N420 Y426 K427 E428	R332-E424 IonicContact CZ-OE1 3.3Å; R332-E424 IonicContact CZ-OE2 2.87Å; R332-E424 IonicContact NH1-OE1 3.26Å; R332-E424 PolarHBondContact NH1-OE1 3.31Å; R332-E424 IonicContact NH1-OE2 3.79Å; R332-E424 IonicContact NH2-OE1 3.15Å; R332-E424 PolarHBondContact NH2-OE1 2.76Å; R332-E424 IonicContact NH2-OE2 2.63Å; R332-E424 PolarHBondContact NH2-OE2 2.66Å; N420-E424 PolarHBondContact O-N 3.1Å; E424-Y426 PolarHBondContact O-N 3.14Å; E424-K427 PolarHBondContact O-N 3.18Å; E424-E428 WeakPolarHBondContact O-CB 3.43Å; E424-E428 PolarHBondContact O-N 3.33Å
425	F	82.7	Confident	84.8	Confident	49 Å²	49	72.6 Å²	72.6	22%	0.215	36%	0.355	C	S	.	.	H	α-helix	trans	-64	-39.7	-176.4	-168.7	-85.8	0	0	0	112.4	F328 N421 F422 E428 Q429	F328-F425 HydrophobicContact CB-CD1 4.19Å; F328-F425 HydrophobicContact CB-CD2 4.4Å; F328-F425 HydrophobicContact CB-CE1 3.6Å; F328-F425 HydrophobicContact CB-CE2 3.84Å; F328-F425 HydrophobicContact CB-CZ 3.41Å; F328-F425 VanDerWaalsContact CB-CZ 3.41Å; F328-F425 HydrophobicContact CD1-CZ 4.41Å; F328-F425 AromaticContact CD2-CE1 3.82Å; F328-F425 HydrophobicContact CD2-CE1 3.82Å; F328-F425 AromaticContact CD2-CZ 3.7Å; F328-F425 HydrophobicContact CD2-CZ 3.7Å; F328-F425 HydrophobicContact CG-CE1 4Å; F328-F425 HydrophobicContact CG-CE2 4.32Å; F328-F425 AromaticContact CG-CZ 3.6Å; F328-F425 HydrophobicContact CG-CZ 3.6Å; N421-F425 WeakPolarHBondContact O-CB 3.46Å; N421-F425 PolarHBondContact O-N 3.02Å; F422-F425 PolarHBondContact O-N 2.78Å; F425-E428 PolarHBondContact O-N 3.06Å; F425-Q429 HydrophobicContact CD1-CB 4.48Å; F425-Q429 HydrophobicContact CE1-CB 4.23Å; F425-Q429 HydrophobicContact CE1-CG 4.47Å; F425-Q429 WeakPolarHBondContact O-CB 3.29Å; F425-Q429 PolarHBondContact O-N 2.98Å
426	Y	85.8	Confident	83.9	Confident	90 Å²	90	72 Å²	72	35%	0.353	35%	0.352	S	S	.	.	H	α-helix	trans	-67.6	-38.8	177.1	178	-121.1	0	0	0	112.2	F422 E424 E428 K430	F422-Y426 WeakPolarHBondContact O-CB 3.34Å; F422-Y426 PolarHBondContact O-N 2.92Å; E424-Y426 PolarHBondContact O-N 3.14Å; Y426-E428 VanDerWaalsContact C-N 3.35Å; Y426-K430 WeakPolarHBondContact O-CB 3.34Å; Y426-K430 PolarHBondContact O-N 3.2Å; Y426-K430 VanDerWaalsContact O-N 3.15Å; Y426-K430 PolarHBondContact OH-NZ 2.87Å
427	K	84.7	Confident	83.2	Confident	135 Å²	135	73.1 Å²	73.1	59%	0.587	35%	0.348	S	S	*	.	H	α-helix	trans	-62.3	-44.2	171.3	-75.3	164	-173.3	162.2	0	110.7	S423 E424 K430 R431	S423-K427 VanDerWaalsContact O-CB 3.3Å; S423-K427 WeakPolarHBondContact O-CB 3.33Å; S423-K427 VanDerWaalsContact O-CD 3.24Å; S423-K427 WeakPolarHBondContact O-CD 3.47Å; S423-K427 WeakPolarHBondContact O-CG 3.29Å; S423-K427 PolarHBondContact O-N 2.9Å; S423-K427 WeakPolarHBondContact OG-CE 3.3Å; S423-K427 PolarHBondContact OG-NZ 3.45Å; E424-K427 PolarHBondContact O-N 3.18Å; K427-K430 CarbonylContact O-C 3.58Å; K427-K430 PolarHBondContact O-N 3.27Å; K427-R431 PolarHBondContact O-N 3.37Å
428	E	79.3	Confident	82.5	Confident	52 Å²	52	78.8 Å²	78.8	24%	0.243	37%	0.365	C	S	.	.	H	α-helix	trans	-69.5	-47.6	-177.2	178.6	54.8	-166.6	0	0	112.6	E424 F425 Y426 K430 R431 Q432	E424-E428 WeakPolarHBondContact O-CB 3.43Å; E424-E428 PolarHBondContact O-N 3.33Å; F425-E428 PolarHBondContact O-N 3.06Å; Y426-E428 VanDerWaalsContact C-N 3.35Å; E428-K430 PolarHBondContact O-N 3.18Å; E428-R431 VanDerWaalsContact CD-NH2 3.31Å; E428-R431 CarbonylContact O-C 3.55Å; E428-R431 WeakPolarHBondContact O-CA 3.32Å; E428-R431 WeakPolarHBondContact O-CB 3.34Å; E428-R431 PolarHBondContact O-N 3.13Å; E428-R431 IonicContact OE1-CZ 3.06Å; E428-R431 IonicContact OE1-NE 2.86Å; E428-R431 IonicContact OE1-NH2 2.76Å; E428-R431 PolarHBondContact OE1-NH2 3.36Å; E428-R431 IonicContact OE2-CZ 3.3Å; E428-R431 IonicContact OE2-NE 2.67Å; E428-R431 PolarHBondContact OE2-NE 3.28Å; E428-R431 IonicContact OE2-NH2 3.74Å; E428-R431 PolarHBondContact OE2-NH2 2.86Å; E428-Q432 WeakPolarHBondContact O-CG 3.47Å; E428-Q432 PolarHBondContact O-N 3.43Å; E428-Q432 WeakPolarHBondContact OE1-CG 3.46Å; E428-Q432 PolarHBondContact OE1-NE2 2.74Å
429	Q	80.4	Confident	81.7	Confident	31 Å²	31	82.8 Å²	82.8	15%	0.145	38%	0.378	C	S	.	.	H	α-helix	trans	-57.5	-35.7	174.2	-163.8	-176.2	29.9	0	0	111.1	T321 F425 E433	T321-Q429 HydrophobicContact CG2-CG 4.32Å; T321-Q429 VanDerWaalsContact CG2-OE1 3.28Å; T321-Q429 PolarHBondContact O-OE1 2.86Å; F425-Q429 HydrophobicContact CD1-CB 4.48Å; F425-Q429 HydrophobicContact CE1-CB 4.23Å; F425-Q429 HydrophobicContact CE1-CG 4.47Å; F425-Q429 WeakPolarHBondContact O-CB 3.29Å; F425-Q429 PolarHBondContact O-N 2.98Å; Q429-E433 WeakPolarHBondContact O-CB 3.32Å; Q429-E433 PolarHBondContact O-N 3.45Å
430	K	81.4	Confident	80.8	Confident	95 Å²	95	81.5 Å²	81.5	41%	0.413	37%	0.367	S	S	.	.	H	α-helix	trans	-77.2	-22.2	175	-164.5	170.2	-169.5	167.4	0	113.6	Y426 K427 E428 K434	Y426-K430 WeakPolarHBondContact O-CB 3.34Å; Y426-K430 PolarHBondContact O-N 3.2Å; Y426-K430 VanDerWaalsContact O-N 3.15Å; Y426-K430 PolarHBondContact OH-NZ 2.87Å; K427-K430 CarbonylContact O-C 3.58Å; K427-K430 PolarHBondContact O-N 3.27Å; E428-K430 PolarHBondContact O-N 3.18Å; K430-K434 WeakPolarHBondContact O-CD 3.33Å; K430-K434 VanDerWaalsContact O-CG 3.27Å; K430-K434 WeakPolarHBondContact O-CG 3.4Å
431	R	79.8	Confident	80.2	Confident	111 Å²	111	79.1 Å²	79.1	42%	0.419	36%	0.361	S	S	.	.	H	α-helix	trans	-71.9	-50.2	167.4	-172.5	175.8	71.5	142.8	2.7	109.5	E152 K427 E428 E433 K434 A435	E152-R431 IonicContact OE2-CZ 3.69Å; E152-R431 IonicContact OE2-NH1 3.76Å; E152-R431 PolarHBondContact OE2-NH1 2.9Å; E152-R431 IonicContact OE2-NH2 3.83Å; E152-R431 PolarHBondContact OE2-NH2 2.85Å; K427-R431 PolarHBondContact O-N 3.37Å; E428-R431 VanDerWaalsContact CD-NH2 3.31Å; E428-R431 CarbonylContact O-C 3.55Å; E428-R431 WeakPolarHBondContact O-CA 3.32Å; E428-R431 WeakPolarHBondContact O-CB 3.34Å; E428-R431 PolarHBondContact O-N 3.13Å; E428-R431 IonicContact OE1-CZ 3.06Å; E428-R431 IonicContact OE1-NE 2.86Å; E428-R431 IonicContact OE1-NH2 2.76Å; E428-R431 PolarHBondContact OE1-NH2 3.36Å; E428-R431 IonicContact OE2-CZ 3.3Å; E428-R431 IonicContact OE2-NE 2.67Å; E428-R431 PolarHBondContact OE2-NE 3.28Å; E428-R431 IonicContact OE2-NH2 3.74Å; E428-R431 PolarHBondContact OE2-NH2 2.86Å; R431-E433 PolarHBondContact O-N 3.44Å; R431-K434 WeakPolarHBondContact O-CB 3.43Å; R431-K434 PolarHBondContact O-N 3.48Å; R431-A435 WeakPolarHBondContact O-CB 3.41Å; R431-A435 PolarHBondContact O-N 3.31Å
432	Q	76.2	Confident	79.7	Confident	72 Å²	72	82.4 Å²	82.4	34%	0.336	38%	0.378	S	S	.	.	H	α-helix	trans	-60.8	-43.8	178	-67.3	175.7	7.1	0	0	112.3	E428 K434 A435 I436	E428-Q432 WeakPolarHBondContact O-CG 3.47Å; E428-Q432 PolarHBondContact O-N 3.43Å; E428-Q432 WeakPolarHBondContact OE1-CG 3.46Å; E428-Q432 PolarHBondContact OE1-NE2 2.74Å; Q432-K434 VanDerWaalsContact C-N 3.28Å; Q432-K434 PolarHBondContact O-N 3.49Å; Q432-A435 PolarHBondContact O-N 3.26Å; Q432-A435 VanDerWaalsContact O-N 3.15Å; Q432-I436 WeakPolarHBondContact O-CB 3.47Å; Q432-I436 WeakPolarHBondContact O-CG1 3.34Å; Q432-I436 PolarHBondContact O-N 3Å
433	E	76.8	Confident	79	Confident	86 Å²	86	82 Å²	82	40%	0.402	38%	0.377	S	S	.	.	H	α-helix	trans	-61	-36.8	176.6	-158	-143.6	-177	0	0	112.1	Q429 R431 K437	Q429-E433 WeakPolarHBondContact O-CB 3.32Å; Q429-E433 PolarHBondContact O-N 3.45Å; R431-E433 PolarHBondContact O-N 3.44Å; E433-K437 WeakPolarHBondContact O-CD 3.28Å; E433-K437 VanDerWaalsContact O-CG 3.22Å; E433-K437 WeakPolarHBondContact O-CG 3.45Å; E433-K437 PolarHBondContact O-N 3.27Å; E433-K437 VanDerWaalsContact OE1-CE 3.26Å; E433-K437 WeakPolarHBondContact OE1-CE 3.41Å; E433-K437 IonicContact OE1-NZ 3.54Å; E433-K437 PolarHBondContact OE1-NZ 2.94Å; E433-K437 IonicContact OE2-NZ 2.73Å; E433-K437 PolarHBondContact OE2-NZ 3.35Å
434	K	80.3	Confident	78.4	Confident	119 Å²	119	85.6 Å²	85.6	52%	0.517	38%	0.384	S	S	.	.	H	α-helix	trans	-71.4	-42	173	-71	171.5	-178.9	-179.6	0	112.1	K430 R431 Q432 K437 R438	K430-K434 WeakPolarHBondContact O-CD 3.33Å; K430-K434 VanDerWaalsContact O-CG 3.27Å; K430-K434 WeakPolarHBondContact O-CG 3.4Å; R431-K434 WeakPolarHBondContact O-CB 3.43Å; R431-K434 PolarHBondContact O-N 3.48Å; Q432-K434 VanDerWaalsContact C-N 3.28Å; Q432-K434 PolarHBondContact O-N 3.49Å; K434-K437 PolarHBondContact O-N 3.26Å; K434-R438 WeakPolarHBondContact O-CG 3.46Å; K434-R438 PolarHBondContact O-N 3.35Å
435	A	74.6	Confident	78.1	Confident	33 Å²	33	83 Å²	83	27%	0.273	38%	0.376	S	S	.	.	H	α-helix	trans	-62.9	-44.6	178.7	0	0	0	0	0	111.3	R431 Q432 R438 R439	R431-A435 WeakPolarHBondContact O-CB 3.41Å; R431-A435 PolarHBondContact O-N 3.31Å; Q432-A435 PolarHBondContact O-N 3.26Å; Q432-A435 VanDerWaalsContact O-N 3.15Å; A435-R438 CarbonylContact O-C 3.58Å; A435-R438 WeakPolarHBondContact O-CB 3.44Å; A435-R438 PolarHBondContact O-N 3.33Å; A435-R439 PolarHBondContact O-N 2.9Å
436	I	73.3	Confident	77.8	Confident	65 Å²	65	84.8 Å²	84.8	33%	0.333	38%	0.384	S	S	.	.	H	α-helix	trans	-58.1	-49.9	172.8	-72.6	166.1	0	0	0	110.9	Q432 R438 R439 E440	Q432-I436 WeakPolarHBondContact O-CB 3.47Å; Q432-I436 WeakPolarHBondContact O-CG1 3.34Å; Q432-I436 PolarHBondContact O-N 3Å; I436-R438 VanDerWaalsContact C-N 3.26Å; I436-R438 PolarHBondContact O-N 3.19Å; I436-R439 PolarHBondContact O-N 3.26Å; I436-E440 HydrophobicContact CG2-CG 4.37Å; I436-E440 WeakPolarHBondContact CG2-OE1 3.5Å; I436-E440 WeakPolarHBondContact O-CB 3.23Å; I436-E440 WeakPolarHBondContact O-CG 3.19Å; I436-E440 PolarHBondContact O-N 3.39Å
437	K	78.1	Confident	77.2	Confident	99 Å²	99	88.9 Å²	88.9	43%	0.43	40%	0.399	S	S	.	.	H	α-helix	trans	-58.7	-37.7	177.3	-73.2	166.4	-173.5	171	0	112.1	E433 K434 A441	E433-K437 WeakPolarHBondContact O-CD 3.28Å; E433-K437 VanDerWaalsContact O-CG 3.22Å; E433-K437 WeakPolarHBondContact O-CG 3.45Å; E433-K437 PolarHBondContact O-N 3.27Å; E433-K437 VanDerWaalsContact OE1-CE 3.26Å; E433-K437 WeakPolarHBondContact OE1-CE 3.41Å; E433-K437 IonicContact OE1-NZ 3.54Å; E433-K437 PolarHBondContact OE1-NZ 2.94Å; E433-K437 IonicContact OE2-NZ 2.73Å; E433-K437 PolarHBondContact OE2-NZ 3.35Å; K434-K437 PolarHBondContact O-N 3.26Å; K437-A441 WeakPolarHBondContact O-CB 3.3Å; K437-A441 PolarHBondContact O-N 2.82Å
438	R	76.8	Confident	76.9	Confident	194 Å²	194	88.8 Å²	88.8	73%	0.732	41%	0.405	S	S	*	.	H	α-helix	trans	-66.9	-49.9	173.2	-73	171.9	173	-177.3	-4.1	112.2	K434 A435 I436 E440 A441 L442	K434-R438 WeakPolarHBondContact O-CG 3.46Å; K434-R438 PolarHBondContact O-N 3.35Å; A435-R438 CarbonylContact O-C 3.58Å; A435-R438 WeakPolarHBondContact O-CB 3.44Å; A435-R438 PolarHBondContact O-N 3.33Å; I436-R438 VanDerWaalsContact C-N 3.26Å; I436-R438 PolarHBondContact O-N 3.19Å; R438-E440 VanDerWaalsContact C-N 3.32Å; R438-E440 PolarHBondContact O-N 3.3Å; R438-A441 WeakPolarHBondContact O-CB 3.4Å; R438-A441 PolarHBondContact O-N 2.86Å; R438-A441 VanDerWaalsContact O-N 3.12Å; R438-L442 WeakPolarHBondContact O-CB 3.22Å; R438-L442 PolarHBondContact O-N 3.49Å
439	R	72.9	Confident	76.4	Confident	111 Å²	111	89.3 Å²	89.3	42%	0.419	42%	0.424	S	S	.	.	H	α-helix	trans	-60.9	-40	178.4	-168.3	-176.5	-170.5	-102.7	16.1	111.5	E164 A435 I436 L442 E443	E164-R439 IonicContact OE1-CZ 2.95Å; E164-R439 IonicContact OE1-NH1 3.13Å; E164-R439 PolarHBondContact OE1-NH1 2.99Å; E164-R439 IonicContact OE1-NH2 2.99Å; E164-R439 PolarHBondContact OE1-NH2 2.73Å; A435-R439 PolarHBondContact O-N 2.9Å; I436-R439 PolarHBondContact O-N 3.26Å; R439-L442 WeakPolarHBondContact O-CB 3.48Å; R439-L442 PolarHBondContact O-N 3.07Å; R439-E443 WeakPolarHBondContact O-CB 3.42Å; R439-E443 PolarHBondContact O-N 3.22Å
440	E	74.6	Confident	75.6	Confident	59 Å²	59	92.3 Å²	92.3	28%	0.276	45%	0.449	S	S	.	.	H	α-helix	trans	-68.4	-35.7	174.5	-70.7	179.8	-169.3	0	0	112.9	R163 I436 R438 R444	R163-E440 IonicContact CZ-OE1 2.73Å; R163-E440 IonicContact NH1-OE1 2.66Å; R163-E440 IonicContact NH2-OE1 3.59Å; R163-E440 PolarHBondContact NH2-OE1 2.93Å; I436-E440 HydrophobicContact CG2-CG 4.37Å; I436-E440 WeakPolarHBondContact CG2-OE1 3.5Å; I436-E440 WeakPolarHBondContact O-CB 3.23Å; I436-E440 WeakPolarHBondContact O-CG 3.19Å; I436-E440 PolarHBondContact O-N 3.39Å; R438-E440 VanDerWaalsContact C-N 3.32Å; R438-E440 PolarHBondContact O-N 3.3Å; E440-R444 VanDerWaalsContact C-NH1 3.27Å; E440-R444 VanDerWaalsContact O-CG 3.23Å; E440-R444 WeakPolarHBondContact O-CG 3.45Å; E440-R444 PolarHBondContact O-N 3.31Å; E440-R444 PolarHBondContact O-NH1 2.93Å; E440-R444 IonicContact OE2-CZ 3.02Å; E440-R444 IonicContact OE2-NH2 2.69Å; E440-R444 PolarHBondContact OE2-NH2 3.19Å
441	A	77.7	Confident	74.4	Confident	48 Å²	48	91.4 Å²	91.4	40%	0.397	45%	0.448	S	S	.	.	H	α-helix	trans	-66.7	-40.4	172.5	0	0	0	0	0	111.4	K437 R438 R444 A445	K437-A441 WeakPolarHBondContact O-CB 3.3Å; K437-A441 PolarHBondContact O-N 2.82Å; R438-A441 WeakPolarHBondContact O-CB 3.4Å; R438-A441 PolarHBondContact O-N 2.86Å; R438-A441 VanDerWaalsContact O-N 3.12Å; A441-R444 PolarHBondContact O-N 2.92Å; A441-A445 PolarHBondContact O-N 2.86Å
442	L	76.8	Confident	72.9	Confident	95 Å²	95	92.5 Å²	92.5	50%	0.497	47%	0.467	S	S	.	.	H	α-helix	trans	-62.6	-46.3	174.8	-168.8	72.9	0	0	0	111.7	R438 R439 R444 A445 K446 I451	R438-L442 WeakPolarHBondContact O-CB 3.22Å; R438-L442 PolarHBondContact O-N 3.49Å; R439-L442 WeakPolarHBondContact O-CB 3.48Å; R439-L442 PolarHBondContact O-N 3.07Å; L442-R444 VanDerWaalsContact C-N 3.31Å; L442-R444 PolarHBondContact O-N 3.38Å; L442-A445 PolarHBondContact O-N 3.36Å; L442-A445 VanDerWaalsContact O-N 3.16Å; L442-K446 VanDerWaalsContact O-CB 3.31Å; L442-K446 WeakPolarHBondContact O-CB 3.4Å; L442-K446 PolarHBondContact O-N 2.56Å; L442-I451 HydrophobicContact CD1-CD1 3.52Å
443	E	73.3	Confident	71.4	Confident	56 Å²	56	92.8 Å²	92.8	26%	0.262	48%	0.477	S	S	.	.	H	α-helix	trans	-70.2	-22.6	176	-78.9	-62.7	156.7	0	0	113.5	R439 K446 R447	R439-E443 WeakPolarHBondContact O-CB 3.42Å; R439-E443 PolarHBondContact O-N 3.22Å; E443-K446 IonicContact OE1-NZ 3.26Å; E443-K446 PolarHBondContact OE1-NZ 2.66Å; E443-K446 IonicContact OE2-NZ 2.77Å; E443-K446 PolarHBondContact OE2-NZ 2.99Å; E443-R447 WeakPolarHBondContact O-CB 3.17Å; E443-R447 WeakPolarHBondContact O-CG 3.39Å; E443-R447 PolarHBondContact O-N 3.13Å; E443-R447 PolarHBondContact O-NE 3.13Å; E443-R447 PolarHBondContact O-NH2 2.84Å
444	R	77.1	Confident	70.2	Confident	115 Å²	115	96.3 Å²	96.3	43%	0.434	50%	0.495	S	S	.	.	H	α-helix	trans	-70.8	-47.8	165.1	-71.7	171.6	-154.6	107.8	4.4	110.4	E440 A441 L442 K446 R447 N448	E440-R444 VanDerWaalsContact C-NH1 3.27Å; E440-R444 VanDerWaalsContact O-CG 3.23Å; E440-R444 WeakPolarHBondContact O-CG 3.45Å; E440-R444 PolarHBondContact O-N 3.31Å; E440-R444 PolarHBondContact O-NH1 2.93Å; E440-R444 IonicContact OE2-CZ 3.02Å; E440-R444 IonicContact OE2-NH2 2.69Å; E440-R444 PolarHBondContact OE2-NH2 3.19Å; A441-R444 PolarHBondContact O-N 2.92Å; L442-R444 VanDerWaalsContact C-N 3.31Å; L442-R444 PolarHBondContact O-N 3.38Å; R444-K446 PolarHBondContact O-N 2.65Å; R444-R447 PolarHBondContact O-N 2.95Å; R444-N448 WeakPolarHBondContact O-CB 3.37Å; R444-N448 PolarHBondContact O-N 3.41Å; R444-N448 PolarHBondContact O-OD1 2.84Å
445	A	77.3	Confident	68.4	Low	27 Å²	27	95.2 Å²	95.2	22%	0.223	50%	0.495	C	S	.	.	H	α-helix	trans	-62	-41.4	179.9	0	0	0	0	0	113	A441 L442 N448 G449 S450 I451	A441-A445 PolarHBondContact O-N 2.86Å; L442-A445 PolarHBondContact O-N 3.36Å; L442-A445 VanDerWaalsContact O-N 3.16Å; A445-N448 CarbonylContact O-C 3.49Å; A445-N448 PolarHBondContact O-N 3.27Å; A445-G449 PolarHBondContact O-N 3.28Å; A445-S450 WeakPolarHBondContact O-CB 3.37Å; A445-S450 PolarHBondContact O-N 3.31Å; A445-I451 HydrophobicContact CB-CD1 3.81Å; A445-I451 HydrophobicContact CB-CG1 4.23Å
446	K	76.1	Confident	67.3	Low	87 Å²	87	99 Å²	99	38%	0.378	51%	0.51	S	S	.	.	H	α-helix	trans	-62.3	-47.7	174.2	175.5	175.8	155.2	-163.5	0	112.3	L442 E443 R444 N448 G449	L442-K446 VanDerWaalsContact O-CB 3.31Å; L442-K446 WeakPolarHBondContact O-CB 3.4Å; L442-K446 PolarHBondContact O-N 2.56Å; E443-K446 IonicContact OE1-NZ 3.26Å; E443-K446 PolarHBondContact OE1-NZ 2.66Å; E443-K446 IonicContact OE2-NZ 2.77Å; E443-K446 PolarHBondContact OE2-NZ 2.99Å; R444-K446 PolarHBondContact O-N 2.65Å; K446-N448 VanDerWaalsContact C-N 3.27Å; K446-N448 PolarHBondContact O-N 3.23Å; K446-G449 PolarHBondContact O-N 2.69Å
447	R	74.2	Confident	65.9	Low	177 Å²	177	103.9 Å²	103.9	67%	0.668	53%	0.528	S	S	*	.	H	α-helix	trans	-65.7	-27.7	173.9	-79.3	178.5	-69.4	129.7	-4.6	113.6	E443 R444 G449	E443-R447 WeakPolarHBondContact O-CB 3.17Å; E443-R447 WeakPolarHBondContact O-CG 3.39Å; E443-R447 PolarHBondContact O-N 3.13Å; E443-R447 PolarHBondContact O-NE 3.13Å; E443-R447 PolarHBondContact O-NH2 2.84Å; R444-R447 PolarHBondContact O-N 2.95Å; R447-G449 PolarHBondContact O-N 3.14Å
448	N	78.1	Confident	64.4	Low	132 Å²	132	103.1 Å²	103.1	71%	0.706	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	5.9	172.4	-65.7	1.1	0	0	0	113.1	R444 A445 K446 S450	R444-N448 WeakPolarHBondContact O-CB 3.37Å; R444-N448 PolarHBondContact O-N 3.41Å; R444-N448 PolarHBondContact O-OD1 2.84Å; A445-N448 CarbonylContact O-C 3.49Å; A445-N448 PolarHBondContact O-N 3.27Å; K446-N448 VanDerWaalsContact C-N 3.27Å; K446-N448 PolarHBondContact O-N 3.23Å; N448-S450 PolarHBondContact O-N 3Å; N448-S450 VanDerWaalsContact O-N 3.16Å
449	G	68.9	Low	62.9	Low	63 Å²	63	96.9 Å²	96.9	65%	0.649	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.8	4.8	-179.5	0	0	0	0	0	115.1	A445 K446 R447 I451	A445-G449 PolarHBondContact O-N 3.28Å; K446-G449 PolarHBondContact O-N 2.69Å; R447-G449 PolarHBondContact O-N 3.14Å; G449-I451 VanDerWaalsContact C-N 3.25Å; G449-I451 PolarHBondContact O-N 2.97Å
450	S	64.4	Low	61.6	Low	95 Å²	95	96.4 Å²	96.4	66%	0.664	52%	0.52	S	S	*	.	S	Bend	trans	-78	-8.2	-174.4	-173.2	0	0	0	0	113.8	A445 N448	A445-S450 WeakPolarHBondContact O-CB 3.37Å; A445-S450 PolarHBondContact O-N 3.31Å; N448-S450 PolarHBondContact O-N 3Å; N448-S450 VanDerWaalsContact O-N 3.16Å
451	I	55.8	Low	60.3	Low	75 Å²	75	95.5 Å²	95.5	39%	0.385	52%	0.523	S	S	.	.	S	Bend	trans	-138.7	120.6	178.6	-60.6	178.1	0	0	0	107.2	L442 A445 G449 S453	L442-I451 HydrophobicContact CD1-CD1 3.52Å; A445-I451 HydrophobicContact CB-CD1 3.81Å; A445-I451 HydrophobicContact CB-CG1 4.23Å; G449-I451 VanDerWaalsContact C-N 3.25Å; G449-I451 PolarHBondContact O-N 2.97Å; I451-S453 PolarHBondContact O-N 2.95Å
452	V	48.3	Very low	58.7	Low	135 Å²	135	101.1 Å²	101.1	82%	0.818	53%	0.534	S	S	*	.			trans	-65	118.5	170.2	177.2	0	0	0	0	108	M454	V452-M454 PolarHBondContact O-N 2.69Å
453	S	45	Very low	57.2	Low	78 Å²	78	100 Å²	100	55%	0.545	53%	0.534	S	S	.	.			trans	-75.2	93.2	177.9	56.5	0	0	0	0	110.6	I451	I451-S453 PolarHBondContact O-N 2.95Å
454	M	50.1	Low	55.8	Low	160 Å²	160	101.1 Å²	101.1	79%	0.788	54%	0.54	S	S	*	.			trans	-56.6	139.2	158.7	-65.5	-175	75.1	0	0	108.8	V452 L456	V452-M454 PolarHBondContact O-N 2.69Å; M454-L456 VanDerWaalsContact C-N 3.29Å; M454-L456 PolarHBondContact O-N 2.74Å
455	N	44.1	Very low	54.3	Low	95 Å²	95	101.6 Å²	101.6	51%	0.508	55%	0.547	S	S	.	.			trans	-81	71.3	-166.7	-165.1	17.3	0	0	0	112.9	K457 D458	N455-K457 PolarHBondContact O-N 2.78Å; N455-D458 PolarHBondContact ND2-OD1 3.21Å; N455-D458 PolarHBondContact ND2-OD2 3.1Å; N455-D458 PolarHBondContact O-N 3.3Å; N455-D458 VanDerWaalsContact O-N 3.16Å
456	L	51	Low	53.1	Low	112 Å²	112	105.8 Å²	105.8	59%	0.586	57%	0.565	S	S	*	*	H	α-helix	trans	-55.6	-23.5	176.9	-98	74.1	0	0	0	113.5	M454 D458 A459 F460	M454-L456 VanDerWaalsContact C-N 3.29Å; M454-L456 PolarHBondContact O-N 2.74Å; L456-D458 VanDerWaalsContact C-N 3.29Å; L456-D458 PolarHBondContact O-N 3.46Å; L456-A459 PolarHBondContact O-N 2.96Å; L456-F460 HydrophobicContact CD2-CE2 4.16Å; L456-F460 HydrophobicContact CG-CE2 4.48Å; L456-F460 WeakPolarHBondContact O-CD2 3.32Å; L456-F460 PolarHBondContact O-N 3.07Å; L456-F460 VanDerWaalsContact O-N 3.1Å
457	K	44.1	Very low	51.7	Low	168 Å²	168	106 Å²	106	73%	0.73	57%	0.569	S	S	*	*	H	α-helix	trans	-59	-40.2	177.5	-82.6	-165.3	167.2	-165.7	0	112.1	N455 A459 F460 A461	N455-K457 PolarHBondContact O-N 2.78Å; K457-A459 VanDerWaalsContact C-N 3.32Å; K457-A459 PolarHBondContact O-N 3.45Å; K457-F460 PolarHBondContact O-N 3.43Å; K457-A461 VanDerWaalsContact O-CB 3.23Å; K457-A461 WeakPolarHBondContact O-CB 3.29Å; K457-A461 PolarHBondContact O-N 3.27Å
458	D	45.9	Very low	49.9	Very low	83 Å²	83	102.3 Å²	102.3	44%	0.444	56%	0.563	S	S	.	*	H	α-helix	trans	-72	-28.8	-177.2	-59.8	-3.8	0	0	0	112.1	N455 L456 R462	N455-D458 PolarHBondContact ND2-OD1 3.21Å; N455-D458 PolarHBondContact ND2-OD2 3.1Å; N455-D458 PolarHBondContact O-N 3.3Å; N455-D458 VanDerWaalsContact O-N 3.16Å; L456-D458 VanDerWaalsContact C-N 3.29Å; L456-D458 PolarHBondContact O-N 3.46Å; D458-R462 WeakPolarHBondContact O-CD 3.49Å; D458-R462 WeakPolarHBondContact O-CG 3.41Å
459	A	44.8	Very low	48.4	Very low	63 Å²	63	100.6 Å²	100.6	52%	0.521	56%	0.557	S	S	.	*	H	α-helix	trans	-72.9	-44.7	175.2	0	0	0	0	0	111.7	L456 K457	L456-A459 PolarHBondContact O-N 2.96Å; K457-A459 VanDerWaalsContact C-N 3.32Å; K457-A459 PolarHBondContact O-N 3.45Å
460	F	46.6	Very low	47.3	Very low	101 Å²	101	102.3 Å²	102.3	44%	0.443	56%	0.555	S	S	.	*	H	α-helix	trans	-78.6	-28.5	-178.4	-84.2	-102.1	0	0	0	114	L153 L456 K457 S463 M464	L153-F460 HydrophobicContact CD1-CE1 4.37Å; L153-F460 HydrophobicContact CD2-CE1 3.77Å; L153-F460 HydrophobicContact CD2-CZ 4.39Å; L153-F460 HydrophobicContact CG-CE1 4.11Å; L456-F460 HydrophobicContact CD2-CE2 4.16Å; L456-F460 HydrophobicContact CG-CE2 4.48Å; L456-F460 WeakPolarHBondContact O-CD2 3.32Å; L456-F460 PolarHBondContact O-N 3.07Å; L456-F460 VanDerWaalsContact O-N 3.1Å; K457-F460 PolarHBondContact O-N 3.43Å; F460-S463 PolarHBondContact O-OG 2.96Å; F460-M464 PolarHBondContact O-N 3.32Å
461	A	46	Very low	46.3	Very low	40 Å²	40	103 Å²	103	33%	0.331	56%	0.555	S	S	.	*	H	α-helix	trans	-61.9	-52.8	173.8	0	0	0	0	0	110.6	K457 S463 M464 E465	K457-A461 VanDerWaalsContact O-CB 3.23Å; K457-A461 WeakPolarHBondContact O-CB 3.29Å; K457-A461 PolarHBondContact O-N 3.27Å; A461-S463 VanDerWaalsContact C-N 3.33Å; A461-S463 PolarHBondContact O-N 3.25Å; A461-M464 PolarHBondContact O-N 3.48Å; A461-E465 WeakPolarHBondContact O-CG 3.24Å; A461-E465 PolarHBondContact O-N 2.82Å
462	R	44	Very low	45.4	Very low	166 Å²	166	108 Å²	108	63%	0.626	58%	0.577	S	S	*	*	H	α-helix	trans	-57.8	-41.4	-179	-68.9	173.7	-174.6	171.7	4.6	112.9	D458 M464 I466	D458-R462 WeakPolarHBondContact O-CD 3.49Å; D458-R462 WeakPolarHBondContact O-CG 3.41Å; R462-M464 VanDerWaalsContact C-N 3.27Å; R462-M464 PolarHBondContact O-N 3.03Å; R462-I466 WeakPolarHBondContact O-CB 3.36Å; R462-I466 WeakPolarHBondContact O-CD1 3.43Å; R462-I466 WeakPolarHBondContact O-CG1 3.11Å; R462-I466 PolarHBondContact O-N 3.29Å; R462-I466 VanDerWaalsContact O-N 3.12Å
463	S	46.2	Very low	44.8	Very low	71 Å²	71	110.2 Å²	110.2	50%	0.497	58%	0.575	S	S	.	*	H	α-helix	trans	-69.6	-22.7	179	59.7	0	0	0	0	113.8	F460 A461	F460-S463 PolarHBondContact O-OG 2.96Å; A461-S463 VanDerWaalsContact C-N 3.33Å; A461-S463 PolarHBondContact O-N 3.25Å
464	M	44.3	Very low	44.2	Very low	81 Å²	81	109.6 Å²	109.6	40%	0.399	58%	0.581	S	S	.	*	H	α-helix	trans	-91.2	-38.9	178.1	-168.5	145.4	52.2	0	0	111.6	F460 A461 R462 I466 L467 D468	F460-M464 PolarHBondContact O-N 3.32Å; A461-M464 PolarHBondContact O-N 3.48Å; R462-M464 VanDerWaalsContact C-N 3.27Å; R462-M464 PolarHBondContact O-N 3.03Å; M464-I466 VanDerWaalsContact C-N 3.3Å; M464-I466 PolarHBondContact O-N 3.35Å; M464-L467 PolarHBondContact O-N 3.34Å; M464-L467 VanDerWaalsContact O-N 3.07Å; M464-D468 PolarHBondContact O-N 3.48Å; M464-D468 VanDerWaalsContact O-N 3.13Å
465	E	44.8	Very low	43.4	Very low	125 Å²	125	110.9 Å²	110.9	58%	0.584	59%	0.585	S	S	*	*	H	α-helix	trans	-58.9	-39.9	171.8	-71.5	171.2	161.8	0	0	112	A461 L467 V469	A461-E465 WeakPolarHBondContact O-CG 3.24Å; A461-E465 PolarHBondContact O-N 2.82Å; E465-L467 VanDerWaalsContact C-N 3.29Å; E465-L467 PolarHBondContact O-N 2.79Å; E465-V469 WeakPolarHBondContact O-CB 3.4Å; E465-V469 VanDerWaalsContact O-CG2 3.24Å; E465-V469 WeakPolarHBondContact O-CG2 3.14Å; E465-V469 PolarHBondContact O-N 2.82Å
466	I	52.5	Low	42.7	Very low	115 Å²	115	113.4 Å²	113.4	59%	0.59	60%	0.599	S	S	*	*	H	α-helix	trans	-64.8	-32.2	175.2	-70.4	167.2	0	0	0	111.8	R462 M464 V470	R462-I466 WeakPolarHBondContact O-CB 3.36Å; R462-I466 WeakPolarHBondContact O-CD1 3.43Å; R462-I466 WeakPolarHBondContact O-CG1 3.11Å; R462-I466 PolarHBondContact O-N 3.29Å; R462-I466 VanDerWaalsContact O-N 3.12Å; M464-I466 VanDerWaalsContact C-N 3.3Å; M464-I466 PolarHBondContact O-N 3.35Å; I466-V470 VanDerWaalsContact O-CG2 3.29Å; I466-V470 WeakPolarHBondContact O-CG2 3.5Å; I466-V470 PolarHBondContact O-N 3.32Å
467	L	45.7	Very low	41.8	Very low	90 Å²	90	117 Å²	117	47%	0.471	61%	0.609	S	S	.	*	H	α-helix	trans	-79	-42.1	-176.6	-169.4	62.7	0	0	0	112.4	M464 E465 V469 V470 V471	M464-L467 PolarHBondContact O-N 3.34Å; M464-L467 VanDerWaalsContact O-N 3.07Å; E465-L467 VanDerWaalsContact C-N 3.29Å; E465-L467 PolarHBondContact O-N 2.79Å; L467-V469 VanDerWaalsContact C-N 3.32Å; L467-V469 PolarHBondContact O-N 2.86Å; L467-V470 PolarHBondContact O-N 3.26Å; L467-V470 VanDerWaalsContact O-N 3.16Å; L467-V471 PolarHBondContact O-N 3.35Å
468	D	37.8	Very low	40.9	Very low	101 Å²	101	115.2 Å²	115.2	54%	0.54	61%	0.613	S	S	.	*	H	α-helix	trans	-61.7	-41.3	174.2	-78.8	-20	0	0	0	110.9	M464 V470 V471 E472	M464-D468 PolarHBondContact O-N 3.48Å; M464-D468 VanDerWaalsContact O-N 3.13Å; D468-V470 PolarHBondContact O-N 3.45Å; D468-V471 PolarHBondContact O-N 3.03Å; D468-E472 PolarHBondContact O-N 2.98Å; D468-E472 VanDerWaalsContact O-N 3.12Å
469	V	46.7	Very low	40	Very low	95 Å²	95	117.3 Å²	117.3	58%	0.576	63%	0.634	S	S	*	*	H	α-helix	trans	-65.2	-22.6	176.4	170.5	0	0	0	0	113.3	E465 L467	E465-V469 WeakPolarHBondContact O-CB 3.4Å; E465-V469 VanDerWaalsContact O-CG2 3.24Å; E465-V469 WeakPolarHBondContact O-CG2 3.14Å; E465-V469 PolarHBondContact O-N 2.82Å; L467-V469 VanDerWaalsContact C-N 3.32Å; L467-V469 PolarHBondContact O-N 2.86Å
470	V	45.8	Very low	39.3	Very low	99 Å²	99	121.4 Å²	121.4	60%	0.6	65%	0.647	S	S	*	*	H	α-helix	trans	-82	-28.1	173.1	166.3	0	0	0	0	111.9	I466 L467 D468	I466-V470 VanDerWaalsContact O-CG2 3.29Å; I466-V470 WeakPolarHBondContact O-CG2 3.5Å; I466-V470 PolarHBondContact O-N 3.32Å; L467-V470 PolarHBondContact O-N 3.26Å; L467-V470 VanDerWaalsContact O-N 3.16Å; D468-V470 PolarHBondContact O-N 3.45Å
471	V	42.2	Very low	38.4	Very low	111 Å²	111	122.2 Å²	122.2	67%	0.673	66%	0.656	S	S	*	*	H	α-helix	trans	-76.1	-41.7	176.8	175.4	0	0	0	0	111.8	L467 D468 K473	L467-V471 PolarHBondContact O-N 3.35Å; D468-V471 PolarHBondContact O-N 3.03Å; V471-K473 PolarHBondContact O-N 3.08Å
472	E	36.8	Very low	37.6	Very low	180 Å²	180	126.3 Å²	126.3	84%	0.841	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	-13.1	178.3	-72.3	-163.5	142.1	0	0	114.2	D468	D468-E472 PolarHBondContact O-N 2.98Å; D468-E472 VanDerWaalsContact O-N 3.12Å
473	K	37.2	Very low	36.9	Very low	181 Å²	181	126.4 Å²	126.4	79%	0.787	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.2	24.3	-174.7	-146.1	167.3	-171.8	171.2	0	114.3	V471	V471-K473 PolarHBondContact O-N 3.08Å
474	G	31.1	Very low	36	Very low	65 Å²	65	130.8 Å²	130.8	67%	0.67	70%	0.696	S	S	*	*	S	Bend	trans	-84.3	-21	-177.9	0	0	0	0	0	116.1
475	E	33	Very low	35.2	Very low	187 Å²	187	132.8 Å²	132.8	87%	0.874	71%	0.713	S	S	*	*	S	Bend	trans	-130.6	95	-172.1	-63.4	-170.5	149.7	0	0	112.1
476	D	30.1	Very low	34.5	Very low	148 Å²	148	133 Å²	133	79%	0.791	73%	0.725	S	S	*	*				-179.9	164.1	122.9	-115.4	-28	0	0	0	112.2
477	K	31.6	Very low	33.3	Very low	186 Å²	186	135.1 Å²	135.1	81%	0.809	74%	0.738	S	S	*	*			trans	-141	144	-176.2	-123.6	-179.9	-175.7	174	0	115.3
478	T	26.6	Very low	32.5	Very low	132 Å²	132	141.7 Å²	141.7	81%	0.81	76%	0.756	S	S	*	*			trans	61.7	111.7	157.6	47	0	0	0	0	120.2
479	S	27.1	Very low	31.9	Very low	127 Å²	127	145.5 Å²	145.5	89%	0.888	78%	0.776	S	S	*	*				-141.5	176.6	124.5	61	0	0	0	0	109.5
480	L	29.6	Very low	30.8	Very low	149 Å²	149	144.6 Å²	144.6	78%	0.78	79%	0.786	S	S	*	*			trans	-102.3	174.2	-160.1	-152.6	69.3	0	0	0	113.9
481	D	26.9	Very low	29.7	Very low	118 Å²	118	145.3 Å²	145.3	63%	0.631	80%	0.795	S	S	*	*			trans	85	107.8	152.3	-71.2	-33.1	0	0	0	121.7
482	N	30.3	Very low	29	Very low	125 Å²	125	144.5 Å²	144.5	67%	0.668	79%	0.794	S	S	*	*				78.5	113.5	120.9	-65	-34.6	0	0	0	122.6
483	H	28.3	Very low	28.5	Very low	168 Å²	168	142.7 Å²	142.7	78%	0.778	80%	0.796	S	S	*	*			trans	85.5	130.5	132.3	-88.8	-82.1	0	0	0	121.9
484	L	27.5	Very low	28.1	Very low	163 Å²	163	144.2 Å²	144.2	85%	0.853	80%	0.797	S	S	*	*			trans	84.7	143	155.4	-63.6	167.9	0	0	0	120.1
485	T	28.2	Very low	27.9	Very low	124 Å²	124	150 Å²	150	76%	0.761	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-79.4	143.3	-177.9	46.3	0	0	0	0	112.4
486	P	30.6	Very low	27.6	Very low	129 Å²	129	145.4 Å²	145.4	84%	0.838	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-70.5	138	176	30.3	-34.8	0	0	0	111.7
487	N	26.5	Very low	27.3	Very low	159 Å²	159	144.8 Å²	144.8	85%	0.85	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-100.3	166.6	171	-159.9	1.6	0	0	0	110.9
488	R	28.3	Very low	27.1	Very low	228 Å²	228	140.4 Å²	140.4	86%	0.86	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-72.8	156.7	-173.6	-70.9	179.5	163.2	-166.7	-3.8	114.4
489	L	25.7	Very low	27.1	Very low	182 Å²	182	143.1 Å²	143.1	95%	0.953	80%	0.798	S	S	*	*			trans	78.8	132	145.7	-158.7	71.3	0	0	0	117.8
490	G	22.6	Very low	27	Very low	76 Å²	76	141.7 Å²	141.7	78%	0.784	79%	0.787	S	S	*	*			trans	173.3	85.3	174.6	0	0	0	0	0	114.4
491	S	23.1	Very low	26.9	Very low	113 Å²	113	139.5 Å²	139.5	79%	0.79	79%	0.785	S	S	*	*			trans	-70.3	135.4	179.5	148	0	0	0	0	113.8
492	S	28.8	Very low	26.9	Very low	95 Å²	95	141 Å²	141	66%	0.664	79%	0.792	S	S	*	*			trans	44.7	125.5	139.1	-169.3	0	0	0	0	120.7
493	T	25.4	Very low	26.6	Very low	142 Å²	142	146.3 Å²	146.3	87%	0.871	80%	0.803	S	S	*	*			trans	-134.7	142.2	154.3	-58.4	0	0	0	0	110
494	R	29.4	Very low	26.5	Very low	213 Å²	213	143 Å²	143	80%	0.804	80%	0.798	S	S	*	*			trans	-113.1	172.2	175.8	-66.1	-179.9	177.6	173.5	-1.3	111
495	H	26.1	Very low	27.2	Very low	187 Å²	187	140.6 Å²	140.6	87%	0.866	79%	0.793	S	S	*	*			trans	123.8	111.3	164.8	-72.5	-70.1	0	0	0	110.6
496	A	26.5	Very low	27.2	Very low	89 Å²	89	140.3 Å²	140.3	74%	0.736	79%	0.787	S	S	*	*			cis	92.1	99.7	11.8	0	0	0	0	0	117.5
497	T	23.5	Very low	27.2	Very low	136 Å²	136	142.3 Å²	142.3	83%	0.834	78%	0.782	S	S	*	*			trans	-167.7	148.4	161.6	44.2	0	0	0	0	108.7
498	S	27.5	Very low	27	Very low	94 Å²	94	144.2 Å²	144.2	66%	0.657	78%	0.777	S	S	*	*			cis	-167.8	133.7	-17.9	-83.9	0	0	0	0	111.2
499	E	27.2	Very low	27	Very low	189 Å²	189	140.2 Å²	140.2	88%	0.883	77%	0.773	S	S	*	*			trans	58.2	166.2	143.2	-50.8	-170.9	123.9	0	0	120.9
500	S	24.5	Very low	27.7	Very low	96 Å²	96	135.6 Å²	135.6	67%	0.671	75%	0.754	S	S	*	*			cis	-149	134.5	7.4	60.6	0	0	0	0	115.7
501	S	28.1	Very low	27.9	Very low	104 Å²	104	140.6 Å²	140.6	73%	0.727	76%	0.757	S	S	*	*			trans	57	161.6	138.8	81.4	0	0	0	0	121.7
502	L	27.8	Very low	28	Very low	150 Å²	150	143.4 Å²	143.4	79%	0.785	76%	0.762	S	S	*	*			cis	-132	179.7	-1.2	-72.3	169.6	0	0	0	108
503	R	23.8	Very low	27.7	Very low	235 Å²	235	142.5 Å²	142.5	89%	0.887	77%	0.767	S	S	*	*			cis	-158.3	162.9	16.7	-149.4	174.9	-166.3	169.2	4.5	109.9
504	S	26.2	Very low	27.6	Very low	98 Å²	98	140.8 Å²	140.8	69%	0.685	76%	0.761	S	S	*	*			trans	-121.6	170.2	170.8	-170.4	0	0	0	0	110.3
505	P	42.3	Very low	27.3	Very low	114 Å²	114	139 Å²	139	74%	0.74	76%	0.762	S	S	*	*				-151.3	153.7	97.5	40.3	-23.3	0	0	0	117.6
506	D	27.8	Very low	27.1	Very low	118 Å²	118	135.6 Å²	135.6	63%	0.631	76%	0.759	S	S	*	*			trans	36.5	146.2	134.1	-71.3	-1.7	0	0	0	123.4
507	K	29.4	Very low	27	Very low	170 Å²	170	136.8 Å²	136.8	74%	0.739	76%	0.762	S	S	*	*			cis	-160.1	-151.9	-7.9	-114.7	172.2	-177.4	79.2	0	106.2
508	R	23.9	Very low	28.1	Very low	200 Å²	200	135.2 Å²	135.2	76%	0.755	75%	0.754	S	S	*	*			cis	-160.5	161.5	7.7	-157.7	-147.4	153.5	126.6	-1.4	109.6
509	N	26.7	Very low	28.1	Very low	144 Å²	144	139.6 Å²	139.6	77%	0.77	76%	0.764	S	S	*	*			trans	-123.9	166.8	158.1	-87.4	-17	0	0	0	109.8
510	P	40.3	Very low	28	Very low	84 Å²	84	133.9 Å²	133.9	55%	0.545	76%	0.756	S	S	.	*				-148.5	158.7	97.3	41.5	-25.9	0	0	0	115.7
511	E	27	Very low	28	Very low	181 Å²	181	137.2 Å²	137.2	85%	0.846	76%	0.764	S	S	*	*			trans	43.6	161	131.3	-63.7	167.6	170.4	0	0	122.1
512	L	25.1	Very low	27.9	Very low	173 Å²	173	137.5 Å²	137.5	91%	0.906	76%	0.762	S	S	*	*			cis	-176.8	138.2	-25.2	175.2	71.3	0	0	0	105.3
513	G	22.6	Very low	27.8	Very low	75 Å²	75	137.7 Å²	137.7	77%	0.773	76%	0.762	S	S	*	*			trans	173	159.6	176.9	0	0	0	0	0	115.7
514	S	24.1	Very low	27.9	Very low	106 Å²	106	131.1 Å²	131.1	74%	0.741	76%	0.758	S	S	*	*			trans	-153.6	167.2	-175	63.6	0	0	0	0	114
515	Q	22.6	Very low	27.8	Very low	177 Å²	177	132.2 Å²	132.2	83%	0.827	76%	0.761	S	S	*	*			trans	90.9	155.5	164.1	-54	-171.1	32.3	0	0	120.9
516	S	22.1	Very low	27.1	Very low	114 Å²	114	133.3 Å²	133.3	80%	0.797	77%	0.765	S	S	*	*			trans	68.9	106.4	157.5	42.2	0	0	0	0	121.7
517	S	25.2	Very low	27	Very low	115 Å²	115	131.6 Å²	131.6	80%	0.804	78%	0.776	S	S	*	*			trans	-72.6	-175.4	141.4	-141.4	0	0	0	0	109.7
518	P	45.8	Very low	26.7	Very low	102 Å²	102	129.1 Å²	129.1	66%	0.662	78%	0.78	S	S	*	*			cis	-139.4	-178.9	2.8	43.9	-26.2	0	0	0	116.2
519	H	27.1	Very low	26.9	Very low	186 Å²	186	129 Å²	129	86%	0.861	79%	0.788	S	S	*	*			trans	175	134	138.2	-94.2	72.6	0	0	0	104.7
520	G	25.3	Very low	26.9	Very low	70 Å²	70	129.7 Å²	129.7	72%	0.722	79%	0.786	S	S	*	*			cis	121.5	138.7	17.4	0	0	0	0	0	108.1
521	I	25.3	Very low	26.1	Very low	165 Å²	165	137.5 Å²	137.5	85%	0.846	81%	0.805	S	S	*	*			cis	-163.5	152.6	8.4	-97.8	167.2	0	0	0	104.9
522	T	25.2	Very low	26	Very low	111 Å²	111	135.6 Å²	135.6	68%	0.681	80%	0.799	S	S	*	*			cis	-171.8	146.3	-16.6	-72	0	0	0	0	103.3
523	I	26.2	Very low	26	Very low	154 Å²	154	133 Å²	133	79%	0.79	80%	0.796	S	S	*	*				-139.1	-116.5	69.8	-40	-176.8	0	0	0	112.2
524	A	25.4	Very low	26.1	Very low	96 Å²	96	140.7 Å²	140.7	79%	0.793	80%	0.801	S	S	*	*			cis	-148	176.6	6.6	0	0	0	0	0	113
525	T	24.2	Very low	26.2	Very low	122 Å²	122	141.5 Å²	141.5	75%	0.748	80%	0.802	S	S	*	*			trans	-143.8	143.6	-163.4	-3.1	0	0	0	0	109.6
526	T	27.2	Very low	26.6	Very low	136 Å²	136	139.3 Å²	139.3	83%	0.834	80%	0.803	S	S	*	*			cis	-151.7	171.3	33.9	49.7	0	0	0	0	112.7
527	G	25.6	Very low	27	Very low	82 Å²	82	142.5 Å²	142.5	85%	0.845	81%	0.805	S	S	*	*			trans	120.9	105.4	154.8	0	0	0	0	0	116.3
528	S	24.9	Very low	27.2	Very low	119 Å²	119	145.8 Å²	145.8	83%	0.832	81%	0.807	S	S	*	*			trans	-100.6	148.6	168.8	61.8	0	0	0	0	111.4
529	Q	27.8	Very low	26.7	Very low	198 Å²	198	146.2 Å²	146.2	93%	0.925	80%	0.803	S	S	*	*			trans	-134.5	138.6	158.7	-77.7	-159.5	-6.9	0	0	112.1
530	H	26	Very low	27.4	Very low	158 Å²	158	140.2 Å²	140.2	73%	0.731	78%	0.783	S	S	*	*			trans	-81.5	139.7	-178	-121.7	-84.3	0	0	0	110.9	I532	H530-I532 PolarHBondContact O-N 3.06Å
531	R	24.6	Very low	28.2	Very low	248 Å²	248	139.3 Å²	139.3	94%	0.936	76%	0.763	S	S	*	*			trans	-69.9	118.6	165.8	-146.7	-179.9	-163.1	-173.5	5.5	108.3
532	I	24.5	Very low	28.7	Very low	140 Å²	140	138.9 Å²	138.9	72%	0.718	76%	0.757	S	S	*	*			trans	-104.9	114.2	178.6	-63.1	174.7	0	0	0	109	H530	H530-I532 PolarHBondContact O-N 3.06Å
533	S	24.1	Very low	29.4	Very low	120 Å²	120	139.6 Å²	139.6	84%	0.839	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-70.2	127.2	161.4	-60.9	0	0	0	0	108.8
534	R	24.9	Very low	30.2	Very low	236 Å²	236	134 Å²	134	89%	0.891	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-94.2	127.3	169.9	-77.6	-177.4	168.7	177.8	-4	109.5
535	T	25.8	Very low	31.2	Very low	123 Å²	123	134.1 Å²	134.1	76%	0.755	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-68.9	149.3	164.2	49.9	0	0	0	0	110.1
536	P	31.2	Very low	32.2	Very low	130 Å²	130	134 Å²	134	84%	0.844	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-58	153.5	167.3	-21.7	33.8	0	0	0	111.6
537	Q	30.5	Very low	33	Very low	181 Å²	181	132.3 Å²	132.3	85%	0.846	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-100.8	137.8	173.2	-72.1	-176.5	-32.7	0	0	110.2	L539	Q537-L539 PolarHBondContact O-N 2.93Å; Q537-L539 VanDerWaalsContact O-N 3.11Å
538	H	30.4	Very low	33.7	Very low	184 Å²	184	130.7 Å²	130.7	85%	0.852	65%	0.65	S	S	*	*			trans	-62.5	105	-178.6	174.1	-72.3	0	0	0	111.8
539	L	34.7	Very low	34.7	Very low	111 Å²	111	128.8 Å²	128.8	58%	0.581	63%	0.631	S	S	*	*			trans	-77.2	141.1	169.3	-122.7	72.2	0	0	0	109.9	Q537 L544	Q537-L539 PolarHBondContact O-N 2.93Å; Q537-L539 VanDerWaalsContact O-N 3.11Å; L539-L544 HydrophobicContact CD2-CD1 4.18Å
540	S	41.1	Very low	35.1	Very low	61 Å²	61	125.5 Å²	125.5	43%	0.427	62%	0.615	S	S	.	*			trans	-77.6	128.4	176.8	48	0	0	0	0	111.4	Q542 K543 L544	S540-Q542 PolarHBondContact O-N 3.44Å; S540-Q542 VanDerWaalsContact O-N 3.11Å; S540-K543 WeakPolarHBondContact O-CB 3.31Å; S540-K543 PolarHBondContact O-N 3.29Å; S540-L544 PolarHBondContact O-N 3.29Å
541	V	42.4	Very low	35.5	Very low	51 Å²	51	123.8 Å²	123.8	31%	0.309	61%	0.609	S	S	.	*	H	α-helix	trans	-46.4	-44.3	179.8	-178.6	0	0	0	0	112.2	L45 N46 K543 L544 E545	L45-V541 HydrophobicContact CD1-CG1 4.42Å; N46-V541 HydrophobicContact CB-CG1 4.23Å; N46-V541 HydrophobicContact CB-CG2 4.37Å; V541-K543 PolarHBondContact O-N 2.98Å; V541-L544 WeakPolarHBondContact O-CA 3.25Å; V541-L544 WeakPolarHBondContact O-CB 3Å; V541-L544 PolarHBondContact O-N 3.09Å; V541-E545 PolarHBondContact O-N 3.13Å
542	Q	36.7	Very low	35.9	Very low	156 Å²	156	113.6 Å²	113.6	73%	0.729	58%	0.575	S	S	*	*	H	α-helix	trans	-54.3	-37.1	179.2	-165	172.1	26	0	0	113.4	S540 E546	S540-Q542 PolarHBondContact O-N 3.44Å; S540-Q542 VanDerWaalsContact O-N 3.11Å; Q542-E546 WeakPolarHBondContact O-CG 3.46Å; Q542-E546 PolarHBondContact O-N 3.1Å
543	K	38.8	Very low	36.4	Very low	125 Å²	125	115.1 Å²	115.1	54%	0.543	58%	0.576	S	S	.	*	H	α-helix	trans	-79.1	-22.5	179.2	-167.2	166.5	-171.8	168.9	0	112.8	S540 V541 M547	S540-K543 WeakPolarHBondContact O-CB 3.31Å; S540-K543 PolarHBondContact O-N 3.29Å; V541-K543 PolarHBondContact O-N 2.98Å; K543-M547 WeakPolarHBondContact O-CB 3.33Å; K543-M547 PolarHBondContact O-N 2.7Å
544	L	44.4	Very low	36.8	Very low	38 Å²	38	114.1 Å²	114.1	20%	0.199	57%	0.569	C	S	.	*	H	α-helix	trans	-80.9	-36.5	172.4	-149.7	84.6	0	0	0	111.3	G43 G44 L539 S540 V541 M547 Y548	G43-L544 VanDerWaalsContact O-CD2 3.24Å; G43-L544 WeakPolarHBondContact O-CD2 3.46Å; G44-L544 WeakPolarHBondContact O-CD2 3.46Å; L539-L544 HydrophobicContact CD2-CD1 4.18Å; S540-L544 PolarHBondContact O-N 3.29Å; V541-L544 WeakPolarHBondContact O-CA 3.25Å; V541-L544 WeakPolarHBondContact O-CB 3Å; V541-L544 PolarHBondContact O-N 3.09Å; L544-M547 HydrophobicContact CD1-CE 4.31Å; L544-M547 PolarHBondContact O-N 3.33Å; L544-Y548 WeakPolarHBondContact O-CB 3.24Å; L544-Y548 PolarHBondContact O-N 3Å
545	E	44.6	Very low	37.2	Very low	97 Å²	97	108.6 Å²	108.6	45%	0.453	55%	0.553	S	S	.	*	H	α-helix	trans	-66.9	-38.6	173.6	-166.6	162.4	-159.6	0	0	111.4	L45 V541 N549	L45-E545 HydrophobicContact CD1-CB 3.91Å; L45-E545 HydrophobicContact CD1-CG 4.01Å; V541-E545 PolarHBondContact O-N 3.13Å; E545-N549 VanDerWaalsContact O-CB 3.31Å; E545-N549 WeakPolarHBondContact O-CB 3.45Å; E545-N549 PolarHBondContact O-N 3.01Å; E545-N549 PolarHBondContact O-ND2 3.19Å
546	E	46.4	Very low	37.3	Very low	121 Å²	121	105.4 Å²	105.4	57%	0.565	54%	0.536	S	S	*	.	H	α-helix	trans	-58.9	-44.5	166.5	-77.4	-176.3	134	0	0	112.4	Q542 N549 Q550	Q542-E546 WeakPolarHBondContact O-CG 3.46Å; Q542-E546 PolarHBondContact O-N 3.1Å; E546-N549 PolarHBondContact O-N 3.19Å; E546-Q550 WeakPolarHBondContact O-CG 3.41Å; E546-Q550 PolarHBondContact O-N 3.07Å
547	M	42.9	Very low	37.1	Very low	100 Å²	100	106.8 Å²	106.8	49%	0.493	53%	0.529	S	S	.	.	H	α-helix	trans	-67.8	-39.9	-178.2	-161.2	-175	-45.4	0	0	112.2	K543 L544 Q550 M551	K543-M547 WeakPolarHBondContact O-CB 3.33Å; K543-M547 PolarHBondContact O-N 2.7Å; L544-M547 HydrophobicContact CD1-CE 4.31Å; L544-M547 PolarHBondContact O-N 3.33Å; M547-Q550 PolarHBondContact O-N 3.15Å; M547-M551 PolarHBondContact O-N 3.49Å
548	Y	40.5	Very low	36.8	Very low	48 Å²	48	104.5 Å²	104.5	19%	0.188	53%	0.528	C	S	.	.	H	α-helix	trans	-63.5	-45.4	173.3	178.6	-103.7	0	0	0	111.4	P94 G95 L544 Q550 M551 T552	P94-Y548 HydrophobicContact CG-CD2 4.23Å; G95-Y548 WeakPolarHBondContact CA-OH 3.46Å; L544-Y548 WeakPolarHBondContact O-CB 3.24Å; L544-Y548 PolarHBondContact O-N 3Å; Y548-Q550 VanDerWaalsContact C-N 3.28Å; Y548-Q550 PolarHBondContact O-N 3.38Å; Y548-M551 PolarHBondContact O-N 2.77Å; Y548-M551 VanDerWaalsContact O-N 3.07Å; Y548-T552 HydrophobicContact CE1-CG2 4.27Å; Y548-T552 HydrophobicContact CE2-CG2 4.22Å; Y548-T552 PolarHBondContact O-N 3.03Å; Y548-T552 VanDerWaalsContact O-N 3.13Å; Y548-T552 PolarHBondContact O-OG1 3.28Å
549	N	46.4	Very low	36.6	Very low	78 Å²	78	103 Å²	103	42%	0.417	53%	0.525	S	S	.	.	H	α-helix	trans	-68.8	-21.1	176.1	-76.1	-56.5	0	0	0	114	E545 E546 K553	E545-N549 VanDerWaalsContact O-CB 3.31Å; E545-N549 WeakPolarHBondContact O-CB 3.45Å; E545-N549 PolarHBondContact O-N 3.01Å; E545-N549 PolarHBondContact O-ND2 3.19Å; E546-N549 PolarHBondContact O-N 3.19Å; N549-K553 WeakPolarHBondContact O-CD 3.49Å; N549-K553 VanDerWaalsContact O-CG 3.32Å; N549-K553 WeakPolarHBondContact O-CG 3.26Å
550	Q	37	Very low	36.5	Very low	130 Å²	130	104.1 Å²	104.1	61%	0.607	53%	0.531	S	S	*	.	H	α-helix	trans	-77.1	-36.9	166.8	-77.2	-179.4	0.8	0	0	111.7	E546 M547 Y548 K553 S554	E546-Q550 WeakPolarHBondContact O-CG 3.41Å; E546-Q550 PolarHBondContact O-N 3.07Å; M547-Q550 PolarHBondContact O-N 3.15Å; Y548-Q550 VanDerWaalsContact C-N 3.28Å; Y548-Q550 PolarHBondContact O-N 3.38Å; Q550-K553 PolarHBondContact O-N 3.35Å; Q550-S554 WeakPolarHBondContact O-CB 3.16Å; Q550-S554 PolarHBondContact O-N 3.44Å; Q550-S554 VanDerWaalsContact O-N 3.15Å; Q550-S554 PolarHBondContact O-OG 3.1Å
551	M	32.6	Very low	35.7	Very low	122 Å²	122	108.4 Å²	108.4	60%	0.601	55%	0.55	S	S	*	.	H	α-helix	trans	-72.3	-40	-174.7	-158.9	165.7	-157.4	0	0	113	M547 Y548 S554 Q555	M547-M551 PolarHBondContact O-N 3.49Å; Y548-M551 PolarHBondContact O-N 2.77Å; Y548-M551 VanDerWaalsContact O-N 3.07Å; M551-S554 WeakPolarHBondContact O-CB 3.31Å; M551-S554 PolarHBondContact O-N 3.46Å; M551-S554 VanDerWaalsContact O-N 3.1Å; M551-Q555 PolarHBondContact O-N 2.99Å
552	T	34.8	Very low	34.8	Very low	34 Å²	34	111.6 Å²	111.6	21%	0.209	57%	0.57	C	S	.	*	H	α-helix	trans	-62.8	-45.8	171.6	47.3	0	0	0	0	111.6	Y548 S554 Q555 S556	Y548-T552 HydrophobicContact CE1-CG2 4.27Å; Y548-T552 HydrophobicContact CE2-CG2 4.22Å; Y548-T552 PolarHBondContact O-N 3.03Å; Y548-T552 VanDerWaalsContact O-N 3.13Å; Y548-T552 PolarHBondContact O-OG1 3.28Å; T552-S554 PolarHBondContact O-N 3.43Å; T552-Q555 PolarHBondContact O-N 3.23Å; T552-Q555 VanDerWaalsContact O-N 3.09Å; T552-S556 PolarHBondContact O-N 3.2Å
553	K	34.7	Very low	34.2	Very low	172 Å²	172	110.2 Å²	110.2	75%	0.748	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.7	-8.4	171.7	-72.7	-176	177.6	-174.3	0	114.9	N549 Q550	N549-K553 WeakPolarHBondContact O-CD 3.49Å; N549-K553 VanDerWaalsContact O-CG 3.32Å; N549-K553 WeakPolarHBondContact O-CG 3.26Å; Q550-K553 PolarHBondContact O-N 3.35Å
554	S	32.5	Very low	33.5	Very low	98 Å²	98	109.3 Å²	109.3	69%	0.685	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.2	-2.9	178.5	-56.9	0	0	0	0	113.7	Q550 M551 T552	Q550-S554 WeakPolarHBondContact O-CB 3.16Å; Q550-S554 PolarHBondContact O-N 3.44Å; Q550-S554 VanDerWaalsContact O-N 3.15Å; Q550-S554 PolarHBondContact O-OG 3.1Å; M551-S554 WeakPolarHBondContact O-CB 3.31Å; M551-S554 PolarHBondContact O-N 3.46Å; M551-S554 VanDerWaalsContact O-N 3.1Å; T552-S554 PolarHBondContact O-N 3.43Å
555	Q	32.9	Very low	32.5	Very low	120 Å²	120	112.9 Å²	112.9	56%	0.561	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.3	-15.2	179.7	-65.3	-166	-5.2	0	0	113.7	M551 T552 F557	M551-Q555 PolarHBondContact O-N 2.99Å; T552-Q555 PolarHBondContact O-N 3.23Å; T552-Q555 VanDerWaalsContact O-N 3.09Å; Q555-F557 VanDerWaalsContact C-N 3.25Å; Q555-F557 PolarHBondContact O-N 3.18Å
556	S	27	Very low	31.5	Very low	57 Å²	57	117.2 Å²	117.2	40%	0.399	63%	0.632	S	S	.	*	S	Bend	trans	-66.9	78.4	162	62.1	0	0	0	0	111.7	T552	T552-S556 PolarHBondContact O-N 3.2Å
557	F	28.3	Very low	30.5	Very low	159 Å²	159	116.1 Å²	116.1	70%	0.697	64%	0.638	S	S	*	*			trans	158.3	85.4	145.7	-84.5	-55.9	0	0	0	111.9	Q555 E979	Q555-F557 VanDerWaalsContact C-N 3.25Å; Q555-F557 PolarHBondContact O-N 3.18Å; F557-E979 WeakPolarHBondContact CZ-OE1 2.87Å
558	T	24.9	Very low	29.6	Very low	133 Å²	133	117.1 Å²	117.1	82%	0.816	65%	0.65	S	S	*	*			trans	-155.8	65.1	155.4	-16.5	0	0	0	0	113.5
559	N	25.8	Very low	28.7	Very low	151 Å²	151	123.2 Å²	123.2	81%	0.807	69%	0.685	S	S	*	*			trans	-173.1	140.2	158.3	-91.1	-47.4	0	0	0	108.5
560	L	31.5	Very low	27.6	Very low	135 Å²	135	124.5 Å²	124.5	71%	0.707	70%	0.7	S	S	*	*			cis	-169.2	123.8	-28.5	-139.8	-179.9	0	0	0	104.5
561	N	24.5	Very low	26.9	Very low	151 Å²	151	124 Å²	124	81%	0.807	71%	0.706	S	S	*	*			trans	-154.1	122.9	165.2	-107.1	-27.5	0	0	0	111
562	T	24	Very low	26.5	Very low	119 Å²	119	124.5 Å²	124.5	73%	0.73	72%	0.716	S	S	*	*			trans	-146.4	70	175.5	-50.1	0	0	0	0	108.9	S564	T562-S564 PolarHBondContact O-N 2.72Å
563	T	24.3	Very low	26.1	Very low	126 Å²	126	130.8 Å²	130.8	77%	0.773	75%	0.745	S	S	*	*			trans	-75.5	97.5	164.2	45.1	0	0	0	0	108.7	S565	T563-S565 PolarHBondContact O-N 3.28Å; T563-S565 VanDerWaalsContact O-N 3.16Å
564	S	24.3	Very low	25.5	Very low	106 Å²	106	128.6 Å²	128.6	74%	0.741	75%	0.746	S	S	*	*			trans	-76.8	95.5	179.3	55.3	0	0	0	0	111.7	T562 M566	T562-S564 PolarHBondContact O-N 2.72Å; S564-M566 PolarHBondContact O-N 2.71Å
565	S	23	Very low	25.2	Very low	114 Å²	114	130.2 Å²	130.2	80%	0.797	75%	0.752	S	S	*	*			trans	-80.8	92.6	167.3	39.4	0	0	0	0	110.9	T563	T563-S565 PolarHBondContact O-N 3.28Å; T563-S565 VanDerWaalsContact O-N 3.16Å
566	M	23.7	Very low	25.3	Very low	187 Å²	187	130.6 Å²	130.6	92%	0.921	76%	0.764	S	S	*	*			trans	-81.2	111.1	159.5	-83.8	-166.5	70.2	0	0	109.6	S564	S564-M566 PolarHBondContact O-N 2.71Å
567	S	24.5	Very low	25.2	Very low	99 Å²	99	131.8 Å²	131.8	69%	0.692	79%	0.786	S	S	*	*			trans	-123.6	101.3	166.9	58.8	0	0	0	0	110.5
568	T	24.4	Very low	24.9	Very low	121 Å²	121	129.6 Å²	129.6	74%	0.742	79%	0.79	S	S	*	*			trans	30.4	106.8	145.2	53.6	0	0	0	0	117.9	S570	T568-S570 PolarHBondContact O-N 2.81Å
569	L	21.4	Very low	25.4	Very low	176 Å²	176	127.9 Å²	127.9	92%	0.921	78%	0.781	S	S	*	*			trans	-67.6	121.9	156.6	-142.8	81.4	0	0	0	108.5
570	S	24.3	Very low	25.3	Very low	105 Å²	105	129.7 Å²	129.7	73%	0.734	78%	0.782	S	S	*	*			trans	-127.6	115.6	167.1	-78	0	0	0	0	109.2	T568 T572	T568-S570 PolarHBondContact O-N 2.81Å; S570-T572 PolarHBondContact O-N 3.05Å
571	T	22.4	Very low	24.9	Very low	120 Å²	120	132.9 Å²	132.9	74%	0.736	79%	0.79	S	S	*	*			trans	-71.9	124	-177.6	-56	0	0	0	0	110.6
572	T	24	Very low	24.7	Very low	132 Å²	132	131.4 Å²	131.4	81%	0.81	79%	0.792	S	S	*	*			trans	-146.1	136.9	155.7	-54.9	0	0	0	0	109	S570	S570-T572 PolarHBondContact O-N 3.05Å
573	M	25.5	Very low	24.7	Very low	165 Å²	165	134 Å²	134	81%	0.813	80%	0.8	S	S	*	*			trans	-75.4	145.8	-175.8	-58	-102.4	69.9	0	0	111.1
574	T	21.4	Very low	24.5	Very low	127 Å²	127	132.7 Å²	132.7	78%	0.779	80%	0.796	S	S	*	*			trans	-106.8	177.4	159.5	50.1	0	0	0	0	109.6
575	V	27.7	Very low	25	Very low	132 Å²	132	132.6 Å²	132.6	80%	0.8	79%	0.793	S	S	*	*			trans	100.3	126.7	174.4	178.7	0	0	0	0	114.6
576	P	33.7	Very low	25	Very low	127 Å²	127	133.8 Å²	133.8	83%	0.825	79%	0.79	S	S	*	*			cis	-137.6	170.7	-26.1	36.4	-18	0	0	0	114.6
577	G	24.7	Very low	25	Very low	83 Å²	83	128.9 Å²	128.9	86%	0.856	77%	0.774	S	S	*	*			trans	-176.3	113	168.5	0	0	0	0	0	114.8
578	S	22.5	Very low	24.9	Very low	113 Å²	113	131.6 Å²	131.6	79%	0.79	78%	0.778	S	S	*	*			trans	-140.1	-180	173.5	75.3	0	0	0	0	108.5
579	P	35.8	Very low	25	Very low	96 Å²	96	131.5 Å²	131.5	62%	0.623	77%	0.773	S	S	*	*			cis	-140.6	-163.6	0.3	32.2	-7.5	0	0	0	114.6
580	K	24.5	Very low	25.1	Very low	189 Å²	189	130 Å²	130	82%	0.822	76%	0.759	S	S	*	*			trans	83.8	127.9	165.2	-54.6	166.8	-174.3	174.3	0	114.9
581	K	21.5	Very low	25.1	Very low	203 Å²	203	131.9 Å²	131.9	88%	0.883	76%	0.756	S	S	*	*			cis	80.8	104.2	46.1	-80.6	-165.7	171.2	-172.2	0	114.9
582	S	21.5	Very low	25.2	Very low	119 Å²	119	133.3 Å²	133.3	83%	0.832	75%	0.754	S	S	*	*				-176.2	134.6	120.8	53.8	0	0	0	0	114.1
583	L	22.8	Very low	25.2	Very low	173 Å²	173	132.1 Å²	132.1	91%	0.906	75%	0.746	S	S	*	*			trans	16	134.3	153.9	-91.5	61.5	0	0	0	123.1
584	S	21.3	Very low	25	Very low	99 Å²	99	131.2 Å²	131.2	69%	0.692	74%	0.744	S	S	*	*			trans	-84.6	-164.2	147.1	64.9	0	0	0	0	110.2
585	P	35.4	Very low	25.1	Very low	104 Å²	104	131.7 Å²	131.7	68%	0.675	74%	0.741	S	S	*	*			cis	-79.7	-149.5	15.6	39.2	-42.2	0	0	0	112.2
586	D	22.9	Very low	24.9	Very low	139 Å²	139	132.7 Å²	132.7	74%	0.743	74%	0.737	S	S	*	*			cis	-161	177.4	10.4	-121.5	-38.6	0	0	0	108
587	S	22.7	Very low	24.3	Very low	84 Å²	84	133.5 Å²	133.5	59%	0.587	73%	0.732	S	S	*	*				-154.3	-174.8	-73.2	56.8	0	0	0	0	109.6
588	M	23.6	Very low	24.1	Very low	156 Å²	156	138.3 Å²	138.3	77%	0.768	72%	0.724	S	S	*	*			trans	82.6	136.7	166	-53.6	-135.1	145.2	0	0	119.3
589	L	25	Very low	24	Very low	120 Å²	120	139.9 Å²	139.9	63%	0.628	72%	0.719	S	S	*	*			cis	-162.2	149.6	-16.6	-102.5	-173.6	0	0	0	111.9
590	K	23.9	Very low	23.5	Very low	145 Å²	145	140.5 Å²	140.5	63%	0.63	72%	0.72	S	S	*	*			trans	65.1	132.4	142.3	-70.6	-170.8	169.8	-83.7	0	120.6
591	E	24.2	Very low	23.4	Very low	144 Å²	144	141.3 Å²	141.3	67%	0.673	72%	0.718	S	S	*	*				78.3	148.1	61.3	-74.8	179.7	146.5	0	0	112.8
592	E	25.5	Very low	23.5	Very low	150 Å²	150	138.8 Å²	138.8	70%	0.701	72%	0.715	S	S	*	*			cis	-162.1	-178.2	19.6	-139.2	-179.7	133.9	0	0	114
593	V	23.7	Very low	23.6	Very low	107 Å²	107	137.3 Å²	137.3	65%	0.648	70%	0.704	S	S	*	*			trans	76	101.6	146.1	161.7	0	0	0	0	123.2
594	L	21.7	Very low	23.8	Very low	145 Å²	145	136 Å²	136	76%	0.759	70%	0.697	S	S	*	*				52.5	126.7	105.6	-89.2	161.8	0	0	0	125.5
595	L	22.9	Very low	23.9	Very low	138 Å²	138	139.3 Å²	139.3	72%	0.723	70%	0.699	S	S	*	*			trans	57.8	121.6	142	-87.3	176.5	0	0	0	125.3
596	E	22.8	Very low	23.3	Very low	153 Å²	153	139.3 Å²	139.3	72%	0.715	69%	0.694	S	S	*	*			trans	67.7	150.8	130.2	-106.8	-168.3	140.8	0	0	126.1
597	M	21.2	Very low	23.4	Very low	144 Å²	144	139 Å²	139	71%	0.709	69%	0.692	S	S	*	*			trans	68.5	97.5	156.5	-67.1	-143.4	-180	0	0	122.6
598	R	20	Very low	23.4	Very low	184 Å²	184	141 Å²	141	69%	0.694	70%	0.701	S	S	*	*				81.6	118.9	103.6	-171.6	-179.2	176	128.7	23.1	120.4
599	E	21.6	Very low	23.4	Very low	145 Å²	145	137.8 Å²	137.8	68%	0.678	70%	0.699	S	S	*	*			trans	67.9	153.1	153.7	-71.5	171.8	168	0	0	116.8
600	V	24.8	Very low	23.3	Very low	109 Å²	109	137.6 Å²	137.6	66%	0.661	71%	0.707	S	S	*	*			cis	-152.7	144.3	-0	96.2	0	0	0	0	113.4
601	R	22.9	Very low	23.6	Very low	206 Å²	206	136.1 Å²	136.1	78%	0.777	71%	0.714	S	S	*	*			trans	52.1	119.1	144.7	-167.1	178.6	-62.2	154.8	5.9	122.6
602	D	23.5	Very low	23.9	Very low	151 Å²	151	134.4 Å²	134.4	81%	0.807	72%	0.715	S	S	*	*				-154	155.2	125.5	-110.5	-33.6	0	0	0	107.5
603	S	24.3	Very low	23.8	Very low	88 Å²	88	132 Å²	132	62%	0.615	72%	0.721	S	S	*	*			cis	-154.3	110.8	-23.1	-133.3	0	0	0	0	105.6
604	L	25.7	Very low	23.8	Very low	145 Å²	145	135.6 Å²	135.6	76%	0.759	73%	0.731	S	S	*	*				92.8	134.7	90	-167	74.9	0	0	0	113.8
605	K	23.3	Very low	23.9	Very low	169 Å²	169	135 Å²	135	74%	0.735	74%	0.737	S	S	*	*			trans	89.3	132.3	172.6	-56	-160.6	155.3	-109.2	0	118.6
606	D	24.2	Very low	24.2	Very low	104 Å²	104	136 Å²	136	56%	0.556	74%	0.741	S	S	*	*			cis	-151.6	119	-18.1	-110.6	-35.3	0	0	0	111.6
607	N	24.6	Very low	24.3	Very low	131 Å²	131	135.4 Å²	135.4	70%	0.701	74%	0.743	S	S	*	*			trans	40.2	116	142.4	-69.5	-66.2	0	0	0	124.2
608	V	23	Very low	24.5	Very low	128 Å²	128	137.5 Å²	137.5	78%	0.776	75%	0.751	S	S	*	*				84.5	124.3	117.2	173.8	0	0	0	0	121.9
609	A	22.6	Very low	24.8	Very low	88 Å²	88	132.5 Å²	132.5	73%	0.727	76%	0.757	S	S	*	*			trans	82.4	132	146.2	0	0	0	0	0	123.6
610	S	22.9	Very low	24.9	Very low	116 Å²	116	135.1 Å²	135.1	81%	0.811	77%	0.766	S	S	*	*			trans	78.3	167.1	145	-145.2	0	0	0	0	119.9
611	C	30.6	Very low	25	Very low	114 Å²	114	135.9 Å²	135.9	77%	0.77	77%	0.767	S	S	*	*			trans	-81.8	148	-176.2	-49.1	0	0	0	0	112.7
612	P	29.4	Very low	25.2	Very low	107 Å²	107	134.4 Å²	134.4	70%	0.695	77%	0.768	S	S	*	*			trans	-112.3	148.2	136.8	1.9	19	0	0	0	109.6	E614	P612-E614 HydrophobicContact CB-CG 4.4Å
613	A	24.7	Very low	25.3	Very low	99 Å²	99	132 Å²	132	82%	0.818	77%	0.77	S	S	*	*			cis	58.4	75.8	1.8	0	0	0	0	0	115.8
614	E	23.3	Very low	25.3	Very low	184 Å²	184	131 Å²	131	86%	0.86	77%	0.773	S	S	*	*			trans	-106.7	142.7	153.7	-77.7	-167.4	126.2	0	0	110.2	P612	P612-E614 HydrophobicContact CB-CG 4.4Å
615	C	23.5	Very low	25.3	Very low	132 Å²	132	131.9 Å²	131.9	89%	0.892	78%	0.778	S	S	*	*			trans	-138.8	116.1	177.1	-90.1	0	0	0	0	110.5
616	I	28.9	Very low	25.5	Very low	158 Å²	158	131.2 Å²	131.2	81%	0.81	78%	0.783	S	S	*	*			trans	-138.1	127.5	161.2	-62.5	-176.7	0	0	0	103.5
617	N	25.1	Very low	25.7	Very low	142 Å²	142	133.6 Å²	133.6	76%	0.759	80%	0.796	S	S	*	*			cis	-140.6	-178.5	42.2	-142.7	-17.8	0	0	0	115.2
618	Q	26.7	Very low	26	Very low	188 Å²	188	130.6 Å²	130.6	88%	0.879	80%	0.795	S	S	*	*			trans	-80.7	156.8	-165.9	-59.3	163.7	-14.8	0	0	115.6
619	G	25	Very low	26	Very low	78 Å²	78	131.5 Å²	131.5	80%	0.804	80%	0.795	S	S	*	*			trans	-177.6	137	165	0	0	0	0	0	112.5
620	F	24.7	Very low	26.2	Very low	200 Å²	200	138.1 Å²	138.1	88%	0.877	80%	0.803	S	S	*	*			trans	-121.8	164	-176.5	-114.5	-96.9	0	0	0	111.4
621	N	26.7	Very low	26.3	Very low	125 Å²	125	140.8 Å²	140.8	67%	0.668	80%	0.803	S	S	*	*			trans	77	107.4	158.9	-66.1	-21	0	0	0	121
622	Q	25.8	Very low	26.2	Very low	175 Å²	175	143.2 Å²	143.2	82%	0.818	81%	0.806	S	S	*	*				66.7	109.7	104.2	-162.7	172.8	33.4	0	0	120.9
623	A	26.1	Very low	25.9	Very low	101 Å²	101	148.5 Å²	148.5	84%	0.835	81%	0.812	S	S	*	*			trans	71.3	135.5	146.6	0	0	0	0	0	121
624	G	25.1	Very low	25.8	Very low	66 Å²	66	151.5 Å²	151.5	68%	0.68	81%	0.809	S	S	*	*			trans	98.3	121.6	160.7	0	0	0	0	0	115.3
625	D	25.9	Very low	26.6	Very low	164 Å²	164	148.6 Å²	148.6	88%	0.877	81%	0.806	S	S	*	*			trans	24.8	131.2	135.6	-36.7	-30.4	0	0	0	117.4
626	D	26.8	Very low	26.5	Very low	156 Å²	156	148.1 Å²	148.1	83%	0.834	80%	0.8	S	S	*	*			cis	-163.6	167.1	45.5	-157	-0.1	0	0	0	113.1
627	D	28.2	Very low	26.7	Very low	154 Å²	154	148 Å²	148	82%	0.824	80%	0.799	S	S	*	*			trans	35.6	148.1	160.2	-138.4	-4.8	0	0	0	124.3
628	G	30.3	Very low	27.1	Very low	67 Å²	67	146.8 Å²	146.8	69%	0.691	80%	0.799	S	S	*	*			trans	93.5	58.9	149.7	0	0	0	0	0	121
629	L	24	Very low	27.4	Very low	147 Å²	147	143.5 Å²	143.5	77%	0.77	79%	0.794	S	S	*	*			trans	-92.9	128.2	170.8	-167.4	77.7	0	0	0	113.5	E631	L629-E631 HydrophobicContact CD2-CG 4.43Å
630	Y	26.4	Very low	27.4	Very low	228 Å²	228	146.3 Å²	146.3	89%	0.894	79%	0.79	S	S	*	*			trans	-130.4	103.9	160.4	-90.8	-76.3	0	0	0	110.7
631	E	26.1	Very low	27.2	Very low	172 Å²	172	145.2 Å²	145.2	80%	0.804	79%	0.792	S	S	*	*			trans	-81.2	150.6	168.2	-81.5	-165.8	115.9	0	0	112.1	L629	L629-E631 HydrophobicContact CD2-CG 4.43Å
632	I	27	Very low	26.9	Very low	165 Å²	165	145.3 Å²	145.3	85%	0.846	79%	0.792	S	S	*	*			trans	-134.5	93.8	167.1	-55.6	178.2	0	0	0	109.5
633	R	23.2	Very low	26.7	Very low	217 Å²	217	145.2 Å²	145.2	82%	0.819	79%	0.79	S	S	*	*			trans	-169.8	162.1	150.8	-119.3	175.8	-175.7	-173.3	1.8	116.5
634	H	22.6	Very low	26.4	Very low	162 Å²	162	145.1 Å²	145.1	75%	0.75	78%	0.783	S	S	*	*			trans	87.8	109.3	165.6	-58.9	-62.6	0	0	0	118.3
635	P	41.3	Very low	26.3	Very low	124 Å²	124	150.4 Å²	150.4	81%	0.805	79%	0.789	S	S	*	*			trans	-110.1	91.3	178.4	37.6	-27.8	0	0	0	113.9
636	T	21.3	Very low	26.1	Very low	122 Å²	122	149.9 Å²	149.9	75%	0.748	79%	0.786	S	S	*	*			trans	-147.9	100.4	170.6	-38	0	0	0	0	113.8
637	I	32	Very low	25.8	Very low	155 Å²	155	152.9 Å²	152.9	80%	0.795	79%	0.785	S	S	*	*			trans	30.1	123.9	131.8	-52.6	166.7	0	0	0	116.8
638	P	33.6	Very low	25.6	Very low	117 Å²	117	150.4 Å²	150.4	76%	0.76	78%	0.779	S	S	*	*				-140.2	-136.5	56.7	30.1	-3.5	0	0	0	115.1
639	P	32.6	Very low	25.2	Very low	118 Å²	118	153.5 Å²	153.5	77%	0.766	79%	0.785	S	S	*	*				-121.6	-170.7	-93.7	41.3	-26	0	0	0	116.8
640	L	24.7	Very low	25.1	Very low	138 Å²	138	149.3 Å²	149.3	72%	0.723	78%	0.777	S	S	*	*			trans	-36.4	148.2	178.4	-89.9	77.5	0	0	0	118.9
641	L	21.4	Very low	25	Very low	176 Å²	176	145 Å²	145	92%	0.921	77%	0.769	S	S	*	*				-164.8	-169.7	115.4	-108.4	169.5	0	0	0	113.6
642	N	20.1	Very low	24.9	Very low	127 Å²	127	142.5 Å²	142.5	68%	0.679	76%	0.762	S	S	*	*			trans	-134.1	173.3	-150.5	-167.4	3.3	0	0	0	114.2
643	F	21.4	Very low	24.7	Very low	174 Å²	174	143 Å²	143	76%	0.763	76%	0.758	S	S	*	*			trans	89.7	122.8	163.1	-79.2	-83.8	0	0	0	123.2
644	S	20.3	Very low	24.8	Very low	98 Å²	98	140.6 Å²	140.6	69%	0.685	75%	0.75	S	S	*	*				66.8	134.5	130	69.3	0	0	0	0	125.8
645	H	22.7	Very low	24.8	Very low	177 Å²	177	140.5 Å²	140.5	82%	0.819	75%	0.75	S	S	*	*			trans	15.4	136.5	136.5	-75.2	-83.5	0	0	0	122.4
646	L	22	Very low	23.9	Very low	154 Å²	154	138.9 Å²	138.9	81%	0.806	74%	0.741	S	S	*	*				-175.3	132.3	118.5	-87.9	148.5	0	0	0	107.1
647	R	21.5	Very low	24	Very low	219 Å²	219	141.6 Å²	141.6	83%	0.826	75%	0.745	S	S	*	*				57.7	136.4	75.2	-80.5	-168.3	178.2	-179.3	0.7	113.7
648	C	22.1	Very low	23.7	Very low	102 Å²	102	141 Å²	141	69%	0.689	74%	0.744	S	S	*	*			cis	-142.6	-177.5	3.6	-95.7	0	0	0	0	108.2
649	T	22.9	Very low	23.6	Very low	132 Å²	132	141.4 Å²	141.4	81%	0.81	75%	0.746	S	S	*	*			cis	-146.4	145	25.2	44.1	0	0	0	0	111.1
650	G	22.9	Very low	23.2	Very low	59 Å²	59	141.6 Å²	141.6	61%	0.608	75%	0.749	S	S	*	*			cis	-136.3	-99.7	-9.7	0	0	0	0	0	109.9
651	N	23.3	Very low	23.2	Very low	137 Å²	137	143.2 Å²	143.2	73%	0.733	76%	0.758	S	S	*	*			cis	-168.8	154.1	-19.1	-81.5	123	0	0	0	107.3
652	D	23.9	Very low	23.3	Very low	120 Å²	120	137.6 Å²	137.6	64%	0.642	74%	0.743	S	S	*	*			cis	-167.5	153.5	-35.7	-119.7	-54.5	0	0	0	111.3
653	F	23.7	Very low	23.6	Very low	174 Å²	174	137.6 Å²	137.6	76%	0.763	75%	0.753	S	S	*	*			trans	60.3	140.8	171.5	-76	-122.6	0	0	0	118.3
654	Y	24.5	Very low	23.7	Very low	168 Å²	168	136.7 Å²	136.7	66%	0.659	76%	0.756	S	S	*	*			cis	-158.6	169.5	-10.1	-138.3	-123.1	0	0	0	109.3
655	E	22.7	Very low	23.9	Very low	160 Å²	160	138.8 Å²	138.8	75%	0.748	76%	0.759	S	S	*	*			trans	13.3	153.7	150.9	-76.6	-178.6	167.9	0	0	123.2
656	S	22.1	Very low	24	Very low	89 Å²	89	138.4 Å²	138.4	62%	0.622	76%	0.757	S	S	*	*			cis	-173.8	157	3.8	162.6	0	0	0	0	112.3
657	H	22.7	Very low	24.2	Very low	180 Å²	180	137.4 Å²	137.4	83%	0.833	76%	0.757	S	S	*	*			trans	60.3	133.1	154.8	-95.9	-99.3	0	0	0	124.7
658	N	26.9	Very low	24.3	Very low	142 Å²	142	135.8 Å²	135.8	76%	0.759	76%	0.759	S	S	*	*			trans	-77	158	150.2	-94.9	-13.1	0	0	0	110.5
659	P	32.1	Very low	24.4	Very low	126 Å²	126	139.9 Å²	139.9	82%	0.818	77%	0.768	S	S	*	*				-142.9	173.8	105.8	40.1	-26.9	0	0	0	116.3
660	C	23	Very low	24.4	Very low	121 Å²	121	136.6 Å²	136.6	82%	0.818	76%	0.761	S	S	*	*			trans	-74.9	169.7	-167.7	-48.9	0	0	0	0	118.2
661	D	24.5	Very low	24.5	Very low	172 Å²	172	143.4 Å²	143.4	92%	0.92	77%	0.774	S	S	*	*			trans	83.4	154.5	145.5	-128.2	-24.9	0	0	0	119.3
662	G	24.9	Very low	24.6	Very low	58 Å²	58	147.9 Å²	147.9	60%	0.598	78%	0.78	S	S	*	*			trans	-131.8	-175.6	-158.9	0	0	0	0	0	116.7
663	S	24.5	Very low	24.8	Very low	128 Å²	128	149.2 Å²	149.2	90%	0.895	78%	0.78	S	S	*	*			trans	-163.7	156.6	172.6	-72.7	0	0	0	0	109.6
664	D	25.2	Very low	24.8	Very low	154 Å²	154	148.7 Å²	148.7	82%	0.824	79%	0.786	S	S	*	*			trans	-85.9	158.1	-169.3	-75.3	-68	0	0	0	116.4
665	L	24.6	Very low	24.8	Very low	142 Å²	142	145.5 Å²	145.5	74%	0.743	79%	0.788	S	S	*	*			trans	81.7	145.7	142	-114.1	62.6	0	0	0	122.4
666	H	24.4	Very low	24.9	Very low	170 Å²	170	141.2 Å²	141.2	79%	0.787	78%	0.78	S	S	*	*			trans	74.2	113.6	162.6	-75.2	-68.6	0	0	0	122.3
667	T	25.5	Very low	25	Very low	132 Å²	132	143.5 Å²	143.5	81%	0.81	79%	0.79	S	S	*	*			trans	-33.2	125.4	157.8	-40.5	0	0	0	0	116.6
668	E	23.5	Very low	25	Very low	185 Å²	185	143.2 Å²	143.2	86%	0.864	79%	0.789	S	S	*	*				-161.2	-170.7	113	-120.6	-176.3	-156.5	0	0	112.6
669	E	24.1	Very low	24.9	Very low	188 Å²	188	144 Å²	144	88%	0.879	79%	0.792	S	S	*	*			trans	-87.8	162.7	-152.7	-52.3	-173	126.9	0	0	117.6
670	G	24	Very low	24.5	Very low	63 Å²	63	144.5 Å²	144.5	65%	0.649	79%	0.793	S	S	*	*				123.5	97.7	120.5	0	0	0	0	0	119.8
671	K	24.8	Very low	24.5	Very low	203 Å²	203	148.1 Å²	148.1	88%	0.883	80%	0.797	S	S	*	*			trans	-176.5	132.9	140.7	-96.7	142.7	-166.2	167.5	0	108.2
672	R	25.6	Very low	24.4	Very low	230 Å²	230	144.5 Å²	144.5	87%	0.868	79%	0.786	S	S	*	*				59.5	136.4	58.2	-81.5	-162.5	170.2	-168.2	-1.1	114.2
673	F	27.9	Very low	24.2	Very low	148 Å²	148	146.7 Å²	146.7	65%	0.649	79%	0.792	S	S	*	*			cis	-171.3	149.4	-23.1	-148.6	-97	0	0	0	107.6
674	N	23.4	Very low	24.2	Very low	163 Å²	163	148.8 Å²	148.8	87%	0.872	79%	0.792	S	S	*	*	S	Bend	trans	176.5	123.4	148.7	-94.5	-17.8	0	0	0	107.9
675	S	24.1	Very low	24.1	Very low	101 Å²	101	147 Å²	147	71%	0.706	79%	0.791	S	S	*	*			cis	-139.8	176.8	-2.7	-165.3	0	0	0	0	110.7
676	A	24.7	Very low	24	Very low	71 Å²	71	148 Å²	148	59%	0.587	79%	0.793	S	S	*	*			trans	-66.7	170	178.8	0	0	0	0	0	111.6
677	V	24.4	Very low	24.1	Very low	136 Å²	136	146.8 Å²	146.8	82%	0.824	79%	0.792	S	S	*	*				-152.8	148.4	57.3	161.1	0	0	0	0	112.1
678	E	23.7	Very low	24.1	Very low	174 Å²	174	147.8 Å²	147.8	81%	0.813	79%	0.792	S	S	*	*			trans	-77.6	167	174.8	-57.3	160.4	106.4	0	0	112.5
679	I	24.3	Very low	25.4	Very low	159 Å²	159	144.5 Å²	144.5	82%	0.815	79%	0.787	S	S	*	*				180	136.7	121.2	-93.8	156.7	0	0	0	110.6
680	T	23.6	Very low	25.9	Very low	137 Å²	137	140.6 Å²	140.6	84%	0.84	78%	0.778	S	S	*	*			trans	-89.6	136.3	168.1	29.5	0	0	0	0	111.2
681	Q	23.8	Very low	25.9	Very low	196 Å²	196	146.5 Å²	146.5	92%	0.916	79%	0.786	S	S	*	*			trans	-155.7	159.6	149.3	-127.1	176.4	9.2	0	0	113.4
682	S	21.2	Very low	26	Very low	97 Å²	97	145.1 Å²	145.1	68%	0.678	79%	0.786	S	S	*	*			trans	-135.7	138.1	-169.2	55.1	0	0	0	0	112.4
683	S	22	Very low	25.9	Very low	104 Å²	104	143.3 Å²	143.3	73%	0.727	79%	0.785	S	S	*	*			trans	66	148.2	150.8	67.6	0	0	0	0	120.9
684	L	23.5	Very low	25.8	Very low	171 Å²	171	139.7 Å²	139.7	90%	0.895	79%	0.789	S	S	*	*			trans	68.8	110.7	161.6	-64.4	165.8	0	0	0	119
685	S	22.9	Very low	25.9	Very low	116 Å²	116	139.4 Å²	139.4	81%	0.811	79%	0.786	S	S	*	*				-162.6	168.6	106.3	-159.5	0	0	0	0	111.4
686	E	23.2	Very low	26	Very low	165 Å²	165	143.9 Å²	143.9	77%	0.771	79%	0.793	S	S	*	*			trans	-96.7	-178.2	-176.8	-56.1	164.1	109.6	0	0	113
687	N	25.2	Very low	26.1	Very low	144 Å²	144	145.7 Å²	145.7	77%	0.77	80%	0.802	S	S	*	*			trans	109.6	155.8	149.1	-66.3	-63.9	0	0	0	120.7
688	N	25.3	Very low	26.2	Very low	153 Å²	153	146 Å²	146	82%	0.818	80%	0.799	S	S	*	*			trans	-88.8	166	-164.6	-96.5	-57.1	0	0	0	114.4
689	P	51.3	Low	26.4	Very low	115 Å²	115	146.2 Å²	146.2	75%	0.747	80%	0.797	S	S	*	*			trans	-89.2	161	-167	35.6	-38.2	0	0	0	115.5
690	P	34.6	Very low	26.5	Very low	107 Å²	107	145.9 Å²	145.9	70%	0.695	80%	0.797	S	S	*	*			trans	-141.3	125.6	156.7	35.1	-17.5	0	0	0	117.9
691	K	23.4	Very low	26.7	Very low	187 Å²	187	147.5 Å²	147.5	81%	0.813	79%	0.792	S	S	*	*				58.2	122.5	129	-59.4	167	-177.1	165.5	0	122.4
692	I	27.6	Very low	26.9	Very low	173 Å²	173	143 Å²	143	89%	0.887	78%	0.783	S	S	*	*				-170.1	136.3	117.7	-102.2	162.2	0	0	0	109.1
693	K	23.9	Very low	27.4	Very low	193 Å²	193	142.1 Å²	142.1	84%	0.839	78%	0.776	S	S	*	*			cis	120.9	32.4	-18.7	-149.3	-119.7	167.8	-171	0	120.4
694	G	26.3	Very low	27.8	Very low	72 Å²	72	143.2 Å²	143.2	74%	0.742	77%	0.774	S	S	*	*			trans	-175.1	156.8	163	0	0	0	0	0	112.8
695	L	25.2	Very low	28.1	Very low	156 Å²	156	142.1 Å²	142.1	82%	0.817	77%	0.769	S	S	*	*			cis	-157.9	142.2	2.7	-170.6	74.2	0	0	0	111
696	K	26.9	Very low	28.4	Very low	195 Å²	195	139.8 Å²	139.8	85%	0.848	76%	0.763	S	S	*	*			trans	29.8	137	159.1	-66.5	177.6	177.7	-178.2	0	119.7
697	S	25.8	Very low	30	Very low	110 Å²	110	137.6 Å²	137.6	77%	0.769	76%	0.764	S	S	*	*			cis	-124.1	-159.7	39.4	53.4	0	0	0	0	112.8
698	N	26.6	Very low	30.2	Very low	143 Å²	143	138.5 Å²	138.5	77%	0.765	77%	0.767	S	S	*	*			cis	-149	-175.2	1.6	-154.9	7.1	0	0	0	112.9
699	F	27.6	Very low	30.3	Very low	177 Å²	177	137.1 Å²	137.1	78%	0.776	76%	0.764	S	S	*	*			trans	-108.6	164.6	171.9	-92.3	-121.7	0	0	0	110.6
700	N	27	Very low	30.5	Very low	152 Å²	152	137.2 Å²	137.2	81%	0.813	77%	0.765	S	S	*	*			cis	-144.7	175.2	32.3	-150.8	-6.6	0	0	0	115
701	K	28.2	Very low	30.9	Very low	171 Å²	171	138 Å²	138	74%	0.743	77%	0.77	S	S	*	*			trans	-105.2	158.6	-168.6	-175.8	170.5	176	-172.9	0	111.2	S703	K701-S703 WeakPolarHBondContact CE-OG 3.06Å
702	S	27.8	Very low	31.2	Very low	102 Å²	102	134 Å²	134	71%	0.713	77%	0.765	S	S	*	*				-160.1	144.7	56.5	46.3	0	0	0	0	112.1
703	S	31.1	Very low	31.2	Very low	78 Å²	78	131.6 Å²	131.6	55%	0.545	76%	0.759	S	S	.	*				65.9	133.3	58.3	85.9	0	0	0	0	113	K701	K701-S703 WeakPolarHBondContact CE-OG 3.06Å
704	N	30.6	Very low	31.4	Very low	127 Å²	127	129.1 Å²	129.1	68%	0.679	76%	0.76	S	S	*	*			cis	-143.5	175.3	44.8	-86.1	32	0	0	0	112.2
705	D	30.3	Very low	31.8	Very low	149 Å²	149	130.9 Å²	130.9	80%	0.797	76%	0.761	S	S	*	*			cis	-145.4	177.2	2.1	-122.5	-37.4	0	0	0	113.1
706	G	29.3	Very low	33.2	Very low	66 Å²	66	129.6 Å²	129.6	68%	0.68	76%	0.762	S	S	*	*			trans	-101.9	-166.3	-160.2	0	0	0	0	0	121
707	P	55.3	Low	33.2	Very low	120 Å²	120	123.8 Å²	123.8	78%	0.779	76%	0.757	S	S	*	*			trans	-126.1	-170	-156.2	43.1	-29	0	0	0	115.2
708	I	30.2	Very low	33.3	Very low	163 Å²	163	126 Å²	126	84%	0.836	76%	0.76	S	S	*	*			trans	176.4	157	131.6	-90.1	155	0	0	0	113
709	T	28.4	Very low	33.3	Very low	124 Å²	124	127 Å²	127	76%	0.761	76%	0.764	S	S	*	*			trans	-95	-178.4	-176	46.2	0	0	0	0	113.9
710	P	54.2	Low	33.3	Very low	117 Å²	117	123.4 Å²	123.4	76%	0.76	76%	0.761	S	S	*	*			cis	-108.8	-100.4	-5.6	23	1.9	0	0	0	113.1
711	P	44.3	Very low	33.3	Very low	124 Å²	124	120.7 Å²	120.7	81%	0.805	75%	0.754	S	S	*	*			cis	-107.2	-151.7	-2.3	43.9	-33.3	0	0	0	113.8
712	S	28.7	Very low	33.3	Very low	101 Å²	101	117.7 Å²	117.7	71%	0.706	76%	0.755	S	S	*	*			trans	-161.1	165.8	175.7	62	0	0	0	0	115.9
713	T	28.6	Very low	33.2	Very low	124 Å²	124	119.4 Å²	119.4	76%	0.761	76%	0.76	S	S	*	*			trans	92.8	158.4	161.1	73.7	0	0	0	0	122.5
714	T	28	Very low	33.1	Very low	140 Å²	140	123.5 Å²	123.5	86%	0.859	78%	0.775	S	S	*	*			trans	79.6	126.4	163	54	0	0	0	0	122.9
715	S	34.2	Very low	32.9	Very low	110 Å²	110	121.2 Å²	121.2	77%	0.769	78%	0.782	S	S	*	*			trans	-119.6	-174.3	147.2	64	0	0	0	0	106.9
716	P	53.6	Low	32.8	Very low	128 Å²	128	121.7 Å²	121.7	83%	0.831	78%	0.784	S	S	*	*			cis	-128.3	-167.1	-5.2	42.8	-26.3	0	0	0	113.1
717	G	27.1	Very low	32.7	Very low	73 Å²	73	127.7 Å²	127.7	75%	0.753	80%	0.795	S	S	*	*			trans	174.5	132.2	165.8	0	0	0	0	0	115
718	D	28.1	Very low	31.5	Very low	156 Å²	156	126.9 Å²	126.9	83%	0.834	79%	0.792	S	S	*	*			trans	-91.8	169	178.6	-56.4	-82.9	0	0	0	113.5
719	I	27.2	Very low	32.3	Very low	166 Å²	166	124.3 Å²	124.3	85%	0.851	79%	0.785	S	S	*	*				175.7	113.7	124.6	-88.4	156.3	0	0	0	113.2
720	S	26.7	Very low	32.4	Very low	100 Å²	100	125 Å²	125	70%	0.699	79%	0.789	S	S	*	*			trans	36.6	135.3	133.5	-153.5	0	0	0	0	125.6
721	S	28.4	Very low	31.3	Very low	95 Å²	95	123.1 Å²	123.1	66%	0.664	79%	0.792	S	S	*	*			trans	78.1	111.7	131.2	53.6	0	0	0	0	124.9
722	S	26.2	Very low	30.6	Very low	109 Å²	109	125.8 Å²	125.8	76%	0.762	79%	0.793	S	S	*	*				65.6	135.3	126.1	69.2	0	0	0	0	122.9
723	V	27.2	Very low	30.5	Very low	137 Å²	137	127 Å²	127	83%	0.83	80%	0.796	S	S	*	*				-168.4	150	110.6	142.2	0	0	0	0	112.3
724	L	27.8	Very low	30.6	Very low	165 Å²	165	126.6 Å²	126.6	86%	0.864	80%	0.799	S	S	*	*			trans	-31.4	157.2	179.1	-58	161.4	0	0	0	120.8
725	G	26.3	Very low	31.6	Very low	79 Å²	79	125 Å²	125	81%	0.814	79%	0.791	S	S	*	*			trans	178.8	117.7	161.1	0	0	0	0	0	112.1
726	D	28.8	Very low	31.3	Very low	158 Å²	158	127.6 Å²	127.6	85%	0.845	80%	0.795	S	S	*	*			trans	-107.3	177.8	-171.3	-102.5	-54.8	0	0	0	114
727	E	26.4	Very low	30.1	Very low	193 Å²	193	129.4 Å²	129.4	90%	0.902	80%	0.796	S	S	*	*			trans	91	145.4	159.2	-55.9	-151.5	116.7	0	0	122.1
728	S	31.3	Very low	31.3	Very low	103 Å²	103	131.9 Å²	131.9	72%	0.72	80%	0.799	S	S	*	*			trans	-140.8	157.7	158.5	76	0	0	0	0	106.3
729	P	46.9	Very low	31.6	Very low	108 Å²	108	129.3 Å²	129.3	70%	0.701	79%	0.793	S	S	*	*				-158.8	170.7	83.8	42.1	-22	0	0	0	118.2
730	T	31.3	Very low	31.9	Very low	138 Å²	138	125.9 Å²	125.9	85%	0.847	78%	0.784	S	S	*	*			trans	21.4	137.6	147.2	61.1	0	0	0	0	124.4
731	G	29.2	Very low	32.2	Very low	78 Å²	78	128.9 Å²	128.9	80%	0.804	79%	0.787	S	S	*	*			trans	111	154	144.9	0	0	0	0	0	116.8
732	E	31.6	Very low	32.4	Very low	180 Å²	180	132.3 Å²	132.3	84%	0.841	79%	0.793	S	S	*	*			cis	-166.3	170.9	-11.8	-160.2	177.3	-135.7	0	0	111.3
733	T	25.9	Very low	32.4	Very low	126 Å²	126	133.6 Å²	133.6	77%	0.773	79%	0.791	S	S	*	*			trans	92.1	148.4	159.1	69.5	0	0	0	0	122.5
734	S	30.1	Very low	32.3	Very low	117 Å²	117	134.9 Å²	134.9	82%	0.818	79%	0.791	S	S	*	*			trans	-122.4	-133.6	-178	-43.8	0	0	0	0	109.3
735	P	49.4	Very low	33.4	Very low	107 Å²	107	132.1 Å²	132.1	70%	0.695	78%	0.783	S	S	*	*			cis	-138.6	179.8	-12.4	33.4	-10	0	0	0	116.4
736	L	27.6	Very low	33.6	Very low	163 Å²	163	134.3 Å²	134.3	85%	0.853	78%	0.78	S	S	*	*				166	149.1	118.2	-87.3	170.7	0	0	0	115.4
737	I	29.6	Very low	33.9	Very low	166 Å²	166	132.2 Å²	132.2	85%	0.851	77%	0.773	S	S	*	*			trans	-159	138.4	-175	42.9	161.6	0	0	0	115.9
738	P	51.4	Low	34.3	Very low	126 Å²	126	130.6 Å²	130.6	82%	0.818	77%	0.77	S	S	*	*			trans	-144.9	-177.2	150.1	40	-24.8	0	0	0	113.7
739	S	33.4	Very low	34.3	Very low	101 Å²	101	133.6 Å²	133.6	71%	0.706	77%	0.772	S	S	*	*			cis	-168.7	174.3	-44.6	68.8	0	0	0	0	110.7
740	S	35.2	Very low	33.2	Very low	95 Å²	95	131.1 Å²	131.1	66%	0.664	77%	0.767	S	S	*	*			trans	76.6	145.4	156.7	-50.9	0	0	0	0	119.6
741	E	32.3	Very low	33.6	Very low	163 Å²	163	129.8 Å²	129.8	76%	0.762	76%	0.761	S	S	*	*			cis	-155.1	146.3	9.4	-147.4	140.5	-112.3	0	0	114.8
742	E	32.8	Very low	33.4	Very low	167 Å²	167	131.8 Å²	131.8	78%	0.78	76%	0.761	S	S	*	*			trans	42.3	159.1	150.4	-68.9	-169.1	156.1	0	0	124.7
743	L	25.3	Very low	33.2	Very low	136 Å²	136	128.1 Å²	128.1	71%	0.712	76%	0.755	S	S	*	*			cis	-138.3	152.3	1	-161.2	86.3	0	0	0	111.1	P745	L743-P745 VanDerWaalsContact O-CD 3.31Å; L743-P745 WeakPolarHBondContact O-CD 3.46Å
744	I	26.2	Very low	33	Very low	164 Å²	164	131.9 Å²	131.9	84%	0.841	76%	0.761	S	S	*	*			trans	-109.8	109.7	-168.9	-54.5	173.1	0	0	0	114.3
745	P	51.1	Low	32.5	Very low	107 Å²	107	131.2 Å²	131.2	70%	0.695	76%	0.756	S	S	*	*			trans	-96.8	175	155.6	34.7	-28	0	0	0	111.4	L743	L743-P745 VanDerWaalsContact O-CD 3.31Å; L743-P745 WeakPolarHBondContact O-CD 3.46Å
746	V	30.3	Very low	31.9	Very low	125 Å²	125	131 Å²	131	76%	0.758	76%	0.755	S	S	*	*			cis	164.6	129.8	-32.4	141	0	0	0	0	104.4
747	T	34.2	Very low	31.8	Very low	114 Å²	114	132.5 Å²	132.5	70%	0.699	76%	0.755	S	S	*	*			cis	-166.7	151.3	-9.6	35.4	0	0	0	0	105.2
748	L	35.8	Very low	31.6	Very low	158 Å²	158	133.9 Å²	133.9	83%	0.827	75%	0.754	S	S	*	*			cis	-155.9	-170.9	-2.8	-97.4	160	0	0	0	104.9
749	E	29.9	Very low	30.3	Very low	166 Å²	166	134.7 Å²	134.7	78%	0.776	75%	0.751	S	S	*	*			cis	-149.5	-148.8	8.9	-139.8	-102.8	72.6	0	0	108.2
750	G	24.9	Very low	29.8	Very low	56 Å²	56	137.3 Å²	137.3	58%	0.577	76%	0.756	S	S	*	*			trans	-154.9	-136.8	179.8	0	0	0	0	0	113.5
751	P	39.6	Very low	29.3	Very low	111 Å²	111	138.4 Å²	138.4	72%	0.721	76%	0.759	S	S	*	*			cis	-138	152.9	-4.9	40.1	-23	0	0	0	117.6
752	C	25.1	Very low	29	Very low	119 Å²	119	137.1 Å²	137.1	80%	0.804	76%	0.757	S	S	*	*			trans	42.5	118.1	138.2	-60.4	0	0	0	0	123.1
753	S	26.1	Very low	28.6	Very low	104 Å²	104	135 Å²	135	73%	0.727	76%	0.755	S	S	*	*				149	155.7	89.3	62.9	0	0	0	0	118.3
754	F	22.1	Very low	29.6	Very low	205 Å²	205	133.9 Å²	133.9	90%	0.899	76%	0.757	S	S	*	*			trans	67	173.2	158.2	-74.8	-67.1	0	0	0	122.2
755	S	19.8	Very low	30.3	Very low	102 Å²	102	131.7 Å²	131.7	71%	0.713	75%	0.753	S	S	*	*			trans	-126.8	-167.5	-167.4	69.2	0	0	0	0	110
756	P	38.1	Very low	29	Very low	102 Å²	102	129.1 Å²	129.1	66%	0.662	75%	0.746	S	S	*	*			cis	-138.8	-173.4	-7.6	40.3	-20.6	0	0	0	115.7
757	K	25.6	Very low	28.8	Very low	196 Å²	196	130.3 Å²	130.3	85%	0.852	75%	0.748	S	S	*	*			trans	51.5	120	144.4	-82.4	177.4	177.6	172.6	0	122.7
758	K	23.8	Very low	28.4	Very low	194 Å²	194	133.6 Å²	133.6	84%	0.843	76%	0.755	S	S	*	*				83.5	162.7	128.7	-143.1	-174.2	-177.8	-171.2	0	119
759	L	24.6	Very low	27.9	Very low	143 Å²	143	131.5 Å²	131.5	75%	0.749	75%	0.745	S	S	*	*			trans	71.2	130.9	-172	-84.5	70.4	0	0	0	113.3
760	L	22.6	Very low	27.7	Very low	157 Å²	157	131 Å²	131	82%	0.822	74%	0.743	S	S	*	*			cis	74.7	143.2	19.2	-154.1	76.9	0	0	0	114.7
761	V	26.2	Very low	27.7	Very low	117 Å²	117	133.8 Å²	133.8	71%	0.709	75%	0.753	S	S	*	*			trans	81.1	130.4	-172.6	-177.7	0	0	0	0	113.3
762	D	24.6	Very low	27.1	Very low	137 Å²	137	134.1 Å²	134.1	73%	0.733	75%	0.753	S	S	*	*			cis	-158.7	167.2	-26.6	-105	-31.4	0	0	0	111.2
763	T	24.3	Very low	27.1	Very low	121 Å²	121	134.7 Å²	134.7	74%	0.742	75%	0.748	S	S	*	*			trans	-62.4	176.3	161.9	42.6	0	0	0	0	114.3
764	P	47.3	Very low	27.2	Very low	114 Å²	114	135.8 Å²	135.8	74%	0.74	75%	0.746	S	S	*	*			cis	-127.7	-136.7	-33.9	38.1	-17.5	0	0	0	107.5
765	P	40.9	Very low	27.5	Very low	117 Å²	117	133 Å²	133	76%	0.76	74%	0.735	S	S	*	*			cis	-106.8	-168.7	-28.6	32	-9.1	0	0	0	111.2
766	G	24	Very low	27.8	Very low	53 Å²	53	135.7 Å²	135.7	55%	0.546	74%	0.737	S	S	.	*				58.2	134.4	64.1	0	0	0	0	0	112
767	D	24.8	Very low	27.4	Very low	150 Å²	150	137.4 Å²	137.4	80%	0.802	74%	0.736	S	S	*	*			cis	-162.1	173.3	-4.9	-93.5	-62.1	0	0	0	106.5
768	E	26.3	Very low	27.4	Very low	183 Å²	183	135.5 Å²	135.5	86%	0.855	73%	0.728	S	S	*	*			trans	66.3	157.7	168.8	-63.1	165.5	-178.1	0	0	114.9
769	D	25.5	Very low	27.6	Very low	115 Å²	115	133 Å²	133	62%	0.615	72%	0.719	S	S	*	*			cis	-154.4	158.9	0	-141.6	-23.3	0	0	0	114
770	Q	25.6	Very low	27.6	Very low	156 Å²	156	133.2 Å²	133.2	73%	0.729	72%	0.72	S	S	*	*			trans	51.4	158.3	144.9	-89.1	161.2	69.5	0	0	126.3
771	S	24.3	Very low	27.7	Very low	113 Å²	113	133.6 Å²	133.6	79%	0.79	72%	0.72	S	S	*	*			trans	82.5	139.5	157.8	85.9	0	0	0	0	117.5
772	T	27.1	Very low	27.6	Very low	118 Å²	118	136.5 Å²	136.5	72%	0.724	73%	0.726	S	S	*	*			cis	-141.8	157.8	3.8	52.7	0	0	0	0	113
773	D	26.7	Very low	27.5	Very low	131 Å²	131	138.4 Å²	138.4	70%	0.701	73%	0.73	S	S	*	*			trans	22.1	146.5	134.4	-64.6	35.9	0	0	0	121
774	N	26.7	Very low	27.6	Very low	127 Å²	127	137.8 Å²	137.8	68%	0.679	74%	0.737	S	S	*	*			cis	-160.9	173.7	-9.2	-89.9	-38.2	0	0	0	105.7
775	H	28.2	Very low	26.4	Very low	146 Å²	146	136 Å²	136	68%	0.676	74%	0.74	S	S	*	*			cis	-167.6	158.9	37.8	-138.2	-97.7	0	0	0	108.8
776	E	27.9	Very low	25.7	Very low	159 Å²	159	135.3 Å²	135.3	74%	0.743	74%	0.744	S	S	*	*			trans	59.3	142.6	160.6	-78.2	155.4	-133.7	0	0	121.7
777	E	28.2	Very low	25.7	Very low	138 Å²	138	138 Å²	138	65%	0.645	76%	0.761	S	S	*	*			cis	-157.7	153.8	-27.8	-130.8	-162.3	157.1	0	0	111.2
778	K	26.5	Very low	25.8	Very low	156 Å²	156	137.3 Å²	137.3	68%	0.678	76%	0.762	S	S	*	*			trans	11.6	148.4	152.1	-66.4	172.1	-170	148.6	0	120.9
779	Q	26.8	Very low	26	Very low	143 Å²	143	132.7 Å²	132.7	67%	0.668	76%	0.755	S	S	*	*			cis	-171.9	177.5	-8.1	-113.2	174.3	-56	0	0	105.3
780	L	26	Very low	26.1	Very low	147 Å²	147	132.7 Å²	132.7	77%	0.77	76%	0.761	S	S	*	*			cis	-137.5	-171.7	13.7	-75.7	173.2	0	0	0	107.9
781	M	24.6	Very low	26	Very low	164 Å²	164	133.1 Å²	133.1	81%	0.808	77%	0.768	S	S	*	*			cis	-179.3	162	-49	-165.2	160	-173.8	0	0	106.7
782	E	23	Very low	26.3	Very low	178 Å²	178	132.9 Å²	132.9	83%	0.832	77%	0.766	S	S	*	*			trans	-102.8	-179.4	-167.2	-150.9	175.6	157.7	0	0	114.5
783	E	23.9	Very low	26.4	Very low	178 Å²	178	133.1 Å²	133.1	83%	0.832	77%	0.769	S	S	*	*			trans	61.9	110.2	163.1	-68.5	-155.7	109.4	0	0	121
784	A	25.1	Very low	26.5	Very low	107 Å²	107	136.4 Å²	136.4	88%	0.884	78%	0.777	S	S	*	*			trans	-156.3	71.4	149.3	0	0	0	0	0	114.2
785	G	23.2	Very low	26.5	Very low	78 Å²	78	136.9 Å²	136.9	80%	0.804	79%	0.785	S	S	*	*			trans	77.2	158.5	143.6	0	0	0	0	0	122.2
786	A	24.8	Very low	26.4	Very low	101 Å²	101	135.1 Å²	135.1	84%	0.835	80%	0.796	S	S	*	*			trans	60.9	82.2	162.4	0	0	0	0	0	119	V788	A786-V788 PolarHBondContact O-N 3.16Å
787	A	25.4	Very low	26.4	Very low	110 Å²	110	132.6 Å²	132.6	91%	0.909	80%	0.802	S	S	*	*			trans	-72.7	106	162.8	0	0	0	0	0	112.1
788	V	25.8	Very low	26.5	Very low	135 Å²	135	134.8 Å²	134.8	82%	0.818	81%	0.813	S	S	*	*			trans	-132.6	134	163.6	179.4	0	0	0	0	108.5	A786	A786-V788 PolarHBondContact O-N 3.16Å
789	A	30.6	Very low	26.6	Very low	86 Å²	86	134.7 Å²	134.7	71%	0.711	82%	0.82	S	S	*	*			trans	-81.9	139.1	-169.5	0	0	0	0	0	114.3
790	P	27.6	Very low	26.4	Very low	116 Å²	116	134.6 Å²	134.6	75%	0.753	83%	0.833	S	S	*	*			trans	-90.9	125.5	152	33.6	-27.4	0	0	0	109.1
791	L	24.7	Very low	26.5	Very low	165 Å²	165	132.8 Å²	132.8	86%	0.864	83%	0.832	S	S	*	*				55	126.2	65.1	-77.8	164.3	0	0	0	114.5
792	S	29.2	Very low	26.7	Very low	107 Å²	107	134.7 Å²	134.7	75%	0.748	84%	0.84	S	S	*	*			trans	-86.5	147.7	-177.7	55.5	0	0	0	0	112.7
793	P	29.4	Very low	26.8	Very low	123 Å²	123	129.5 Å²	129.5	80%	0.799	83%	0.833	S	S	*	*			trans	-104.4	104.5	163.8	33.4	-26.4	0	0	0	111.9
794	K	29.1	Very low	26.9	Very low	200 Å²	200	129.2 Å²	129.2	87%	0.87	84%	0.838	S	S	*	*			trans	-87.9	93.2	155.5	-81.9	-175.4	177.4	176.7	0	109.4
795	T	27	Very low	26.8	Very low	138 Å²	138	130.4 Å²	130.4	85%	0.847	83%	0.829	S	S	*	*			trans	-175.5	102.1	154.2	26.4	0	0	0	0	111.6
796	A	26.4	Very low	27.1	Very low	108 Å²	108	133.4 Å²	133.4	89%	0.893	84%	0.835	S	S	*	*			trans	-172.4	44.7	161.2	0	0	0	0	0	112.5
797	A	27.2	Very low	27.2	Very low	107 Å²	107	132.1 Å²	132.1	88%	0.884	82%	0.824	S	S	*	*			trans	-149.3	44.2	-173.7	0	0	0	0	0	114.3
798	Q	31.5	Very low	27.4	Very low	184 Å²	184	134.4 Å²	134.4	86%	0.86	82%	0.82	S	S	*	*	S	Bend	trans	-143.3	136.8	169.2	-156.4	166.2	11.8	0	0	108.7
799	N	26.8	Very low	27.7	Very low	154 Å²	154	138 Å²	138	82%	0.824	83%	0.825	S	S	*	*			trans	81.3	82.2	-167	-54.4	-19.8	0	0	0	116
800	C	24	Very low	27.7	Very low	140 Å²	140	141.2 Å²	141.2	95%	0.946	83%	0.825	S	S	*	*			trans	-161.9	88.2	142.2	-125.3	0	0	0	0	109.7
801	S	27.2	Very low	27.8	Very low	109 Å²	109	140.6 Å²	140.6	76%	0.762	82%	0.824	S	S	*	*			trans	-148.9	137.7	-179.8	57.8	0	0	0	0	110.8
802	Q	28.8	Very low	28.3	Very low	205 Å²	205	138.8 Å²	138.8	96%	0.958	81%	0.809	S	S	*	*			trans	69.6	104.4	-170.8	-60.9	-172.2	-20.6	0	0	114.7
803	G	24.4	Very low	28.6	Very low	68 Å²	68	142.4 Å²	142.4	70%	0.701	81%	0.807	S	S	*	*			trans	-173.7	45.9	179.2	0	0	0	0	0	111.9	N805	G803-N805 VanDerWaalsContact C-N 3.29Å; G803-N805 PolarHBondContact O-N 3.46Å
804	N	26.1	Very low	29	Very low	172 Å²	172	142.5 Å²	142.5	92%	0.92	80%	0.801	S	S	*	*			trans	-69.7	84.3	178.4	-98.6	23.1	0	0	0	110.9
805	N	23.4	Very low	29.1	Very low	133 Å²	133	138.7 Å²	138.7	71%	0.711	79%	0.794	S	S	*	*			trans	-112.6	122.8	164.6	-87.9	-26.5	0	0	0	108.8	G803 A807	G803-N805 VanDerWaalsContact C-N 3.29Å; G803-N805 PolarHBondContact O-N 3.46Å; N805-A807 HydrophobicContact CB-CB 4.01Å; N805-A807 PolarHBondContact O-N 3.05Å
806	P	30.3	Very low	29.5	Very low	141 Å²	141	136.8 Å²	136.8	92%	0.916	79%	0.792	S	S	*	*	S	Bend	trans	-75.6	60.9	168.7	33.4	-34.7	0	0	0	110.1
807	A	27.3	Very low	29.7	Very low	74 Å²	74	136.4 Å²	136.4	61%	0.612	79%	0.789	S	S	*	*			trans	-135.4	35.6	-168.7	0	0	0	0	0	112.8	N805	N805-A807 HydrophobicContact CB-CB 4.01Å; N805-A807 PolarHBondContact O-N 3.05Å
808	L	29.3	Very low	30.4	Very low	158 Å²	158	135.1 Å²	135.1	83%	0.827	79%	0.786	S	S	*	*	S	Bend	trans	-134.9	23.9	-179.9	-125.9	166.5	0	0	0	114.3
809	F	32.2	Very low	31.2	Very low	211 Å²	211	131.7 Å²	131.7	93%	0.925	77%	0.77	S	S	*	*	S	Bend	trans	-135.6	13.3	166.5	-90.5	-69.8	0	0	0	114.8	S811	F809-S811 PolarHBondContact O-N 2.85Å
810	Q	30.4	Very low	33.4	Very low	152 Å²	152	128.6 Å²	128.6	71%	0.71	75%	0.754	S	S	*	*			trans	-93.8	62.9	165.7	-79.2	-159.7	-3.1	0	0	111.9	K812	Q810-K812 VanDerWaalsContact C-N 3.31Å; Q810-K812 PolarHBondContact O-N 2.92Å
811	S	29.8	Very low	35.9	Very low	103 Å²	103	125.2 Å²	125.2	72%	0.72	72%	0.724	S	S	*	*			trans	-72.8	90.5	162.8	-166.3	0	0	0	0	109.2	F809	F809-S811 PolarHBondContact O-N 2.85Å
812	K	35.6	Very low	38.5	Very low	127 Å²	127	122.9 Å²	122.9	55%	0.552	70%	0.7	S	S	*	*			trans	-71	147.8	163.9	-71.6	169.8	-178.5	165.5	0	107.7	Q810	Q810-K812 VanDerWaalsContact C-N 3.31Å; Q810-K812 PolarHBondContact O-N 2.92Å
813	Y	34.4	Very low	41.1	Very low	184 Å²	184	116.3 Å²	116.3	72%	0.722	68%	0.676	S	S	*	*			trans	77.8	96.7	-173.3	-52.2	-82.8	0	0	0	114.5
814	L	37.3	Very low	44	Very low	125 Å²	125	114 Å²	114	65%	0.654	65%	0.648	S	S	*	*			trans	-134.9	87.1	162	-111	161.2	0	0	0	106.9
815	T	32.7	Very low	46.9	Very low	120 Å²	120	105.9 Å²	105.9	74%	0.736	61%	0.605	S	S	*	*			trans	-144.6	111.9	179.8	47.1	0	0	0	0	109.8
816	A	33.6	Very low	49.8	Very low	97 Å²	97	101.8 Å²	101.8	80%	0.802	59%	0.586	S	S	*	*	S	Bend	trans	69.2	152	176.1	0	0	0	0	0	117.9
817	A	31.1	Very low	52.4	Low	100 Å²	100	96.2 Å²	96.2	83%	0.826	55%	0.552	S	S	*	*	S	Bend	trans	66.5	119.6	176.4	0	0	0	0	0	118
818	G	41.6	Very low	55.5	Low	80 Å²	80	92.7 Å²	92.7	83%	0.825	52%	0.523	S	S	*	.			trans	71.6	66.7	158.2	0	0	0	0	0	116.8	D820	G818-D820 PolarHBondContact O-N 3Å
819	H	49.6	Very low	58.4	Low	113 Å²	113	85.6 Å²	85.6	52%	0.523	49%	0.485	S	S	.	.			trans	-77.6	114.7	171.9	-76.7	-63.9	0	0	0	112.2	E821 L824	H819-E821 PolarHBondContact O-N 2.87Å; H819-L824 HydrophobicContact CB-CD1 3.8Å; H819-L824 HydrophobicContact CB-CG 4.31Å
820	D	71.6	Confident	60.9	Low	89 Å²	89	77.6 Å²	77.6	48%	0.476	46%	0.458	S	S	.	.			trans	-68	114.2	151.4	177.2	7.6	0	0	0	108.4	G818 K822 S823 L824	G818-D820 PolarHBondContact O-N 3Å; D820-K822 PolarHBondContact O-N 3.2Å; D820-K822 WeakPolarHBondContact OD1-CB 3.42Å; D820-K822 WeakPolarHBondContact OD1-CG 3.34Å; D820-K822 PolarHBondContact OD1-N 3.37Å; D820-S823 VanDerWaalsContact O-CB 3.28Å; D820-S823 WeakPolarHBondContact O-CB 3.43Å; D820-S823 PolarHBondContact O-N 3.22Å; D820-L824 PolarHBondContact O-N 2.93Å
821	E	77.9	Confident	63.7	Low	69 Å²	69	72 Å²	72	32%	0.322	43%	0.431	S	S	.	.	H	α-helix	trans	-48.1	-38.6	175.8	-176.4	-177.3	-131.1	0	0	112.1	H819 S823 L824 I825 L861 A864 Y949	H819-E821 PolarHBondContact O-N 2.87Å; E821-S823 VanDerWaalsContact C-N 3.31Å; E821-S823 PolarHBondContact O-N 2.91Å; E821-L824 WeakPolarHBondContact O-CB 3.47Å; E821-L824 PolarHBondContact O-N 3.07Å; E821-I825 HydrophobicContact CG-CD1 4.22Å; E821-I825 WeakPolarHBondContact O-CG1 3.49Å; E821-I825 PolarHBondContact O-N 2.85Å; E821-L861 HydrophobicContact CG-CD2 4.46Å; E821-A864 HydrophobicContact CG-CB 3.97Å; E821-A864 WeakPolarHBondContact OE1-CB 3.46Å; E821-Y949 VanDerWaalsContact CD-CE2 3.45Å; E821-Y949 HydrophobicContact CG-CE2 4.13Å; E821-Y949 VanDerWaalsContact OE2-CE2 3.23Å; E821-Y949 WeakPolarHBondContact OE2-CE2 3.5Å; E821-Y949 VanDerWaalsContact OE2-CZ 3.3Å; E821-Y949 PolarHBondContact OE2-OH 3.18Å
822	K	82	Confident	66.6	Low	59 Å²	59	67.2 Å²	67.2	26%	0.257	40%	0.397	S	S	.	.	H	α-helix	trans	-68	-34.1	-178.1	-55.6	169.2	-168.9	-163.9	0	111.3	D820 C826 D956 I959	D820-K822 PolarHBondContact O-N 3.2Å; D820-K822 WeakPolarHBondContact OD1-CB 3.42Å; D820-K822 WeakPolarHBondContact OD1-CG 3.34Å; D820-K822 PolarHBondContact OD1-N 3.37Å; K822-C826 WeakPolarHBondContact O-CB 3.28Å; K822-C826 PolarHBondContact O-N 3.19Å; K822-C826 PolarHBondContact O-SG 3.14Å; K822-D956 WeakPolarHBondContact CD-OD1 3.39Å; K822-D956 WeakPolarHBondContact CE-OD1 3.39Å; K822-D956 WeakPolarHBondContact CE-OD2 3.26Å; K822-D956 IonicContact NZ-OD1 3.3Å; K822-D956 PolarHBondContact NZ-OD1 3.39Å; K822-D956 IonicContact NZ-OD2 2.86Å; K822-D956 PolarHBondContact NZ-OD2 2.88Å; K822-I959 HydrophobicContact CB-CD1 4.27Å
823	S	81.6	Confident	68.9	Low	67 Å²	67	62.9 Å²	62.9	47%	0.469	38%	0.379	S	S	.	.	H	α-helix	trans	-68.5	-40.9	173.8	-170.2	0	0	0	0	111.3	D820 E821 C826 A827	D820-S823 VanDerWaalsContact O-CB 3.28Å; D820-S823 WeakPolarHBondContact O-CB 3.43Å; D820-S823 PolarHBondContact O-N 3.22Å; E821-S823 VanDerWaalsContact C-N 3.31Å; E821-S823 PolarHBondContact O-N 2.91Å; S823-C826 PolarHBondContact O-N 3.2Å; S823-A827 WeakPolarHBondContact O-CB 3.39Å; S823-A827 PolarHBondContact O-N 3.45Å
824	L	86.3	Confident	71.2	Confident	21 Å²	21	57.6 Å²	57.6	11%	0.11	36%	0.361	C	S	.	.	H	α-helix	trans	-63.4	-44	172.9	-74	175.3	0	0	0	112.1	H819 D820 E821 A827 F828 V857 L861	H819-L824 HydrophobicContact CB-CD1 3.8Å; H819-L824 HydrophobicContact CB-CG 4.31Å; D820-L824 PolarHBondContact O-N 2.93Å; E821-L824 WeakPolarHBondContact O-CB 3.47Å; E821-L824 PolarHBondContact O-N 3.07Å; L824-A827 PolarHBondContact O-N 3Å; L824-F828 WeakPolarHBondContact O-CB 3.12Å; L824-F828 PolarHBondContact O-N 3.27Å; L824-V857 HydrophobicContact CD2-CG1 4.06Å; L824-V857 WeakPolarHBondContact O-CG1 3.45Å; L824-L861 HydrophobicContact CB-CD1 4.47Å; L824-L861 HydrophobicContact CB-CD2 3.62Å; L824-L861 HydrophobicContact CB-CG 4.05Å; L824-L861 HydrophobicContact CD1-CD2 4.23Å
825	I	87.9	Confident	73.3	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-60.8	-47.9	176.2	-64.5	168.3	0	0	0	110.4	E821 A827 F828 L829 L861 F945 L946 Y949 I959	E821-I825 HydrophobicContact CG-CD1 4.22Å; E821-I825 WeakPolarHBondContact O-CG1 3.49Å; E821-I825 PolarHBondContact O-N 2.85Å; I825-A827 VanDerWaalsContact C-N 3.33Å; I825-A827 PolarHBondContact O-N 2.99Å; I825-F828 PolarHBondContact O-N 3.43Å; I825-L829 HydrophobicContact CG2-CD1 4.14Å; I825-L829 HydrophobicContact CG2-CG 4.41Å; I825-L829 WeakPolarHBondContact O-CG 3.09Å; I825-L829 PolarHBondContact O-N 3.42Å; I825-L861 HydrophobicContact CG1-CD1 4.15Å; I825-L861 HydrophobicContact CG1-CD2 3.86Å; I825-F945 HydrophobicContact CD1-CE1 4.47Å; I825-F945 HydrophobicContact CD1-CZ 4.08Å; I825-F945 HydrophobicContact CG1-CE1 4.3Å; I825-F945 HydrophobicContact CG1-CZ 4.19Å; I825-F945 HydrophobicContact CG2-CE1 4.43Å; I825-L946 HydrophobicContact CG2-CD2 3.68Å; I825-Y949 HydrophobicContact CD1-CD1 4.09Å; I825-Y949 HydrophobicContact CD1-CD2 3.87Å; I825-Y949 HydrophobicContact CD1-CE1 3.89Å; I825-Y949 HydrophobicContact CD1-CE2 3.68Å; I825-Y949 HydrophobicContact CD1-CG 4.07Å; I825-I959 HydrophobicContact CB-CD1 4.07Å; I825-I959 HydrophobicContact CG2-CD1 3.88Å
826	C	84.1	Confident	75.6	Confident	47 Å²	47	49.3 Å²	49.3	32%	0.318	31%	0.31	S	S	.	.	H	α-helix	trans	-60.8	-41.7	176.2	-66	0	0	0	0	112.3	K822 S823 F828 L829 A830	K822-C826 WeakPolarHBondContact O-CB 3.28Å; K822-C826 PolarHBondContact O-N 3.19Å; K822-C826 PolarHBondContact O-SG 3.14Å; S823-C826 PolarHBondContact O-N 3.2Å; C826-F828 VanDerWaalsContact C-N 3.34Å; C826-F828 PolarHBondContact O-N 3.41Å; C826-L829 PolarHBondContact O-N 3.4Å; C826-A830 WeakPolarHBondContact O-CB 3.44Å; C826-A830 PolarHBondContact O-N 2.98Å
827	A	84.8	Confident	77.9	Confident	24 Å²	24	48.8 Å²	48.8	20%	0.198	29%	0.291	C	S	.	.	H	α-helix	trans	-68.5	-29.9	179.1	0	0	0	0	0	113.4	S823 L824 I825 R831 V857	S823-A827 WeakPolarHBondContact O-CB 3.39Å; S823-A827 PolarHBondContact O-N 3.45Å; L824-A827 PolarHBondContact O-N 3Å; I825-A827 VanDerWaalsContact C-N 3.33Å; I825-A827 PolarHBondContact O-N 2.99Å; A827-R831 VanDerWaalsContact O-CD 3.24Å; A827-R831 WeakPolarHBondContact O-CD 3.31Å; A827-R831 VanDerWaalsContact O-CG 3.31Å; A827-R831 WeakPolarHBondContact O-CG 3.47Å; A827-R831 PolarHBondContact O-NH1 2.97Å; A827-V857 HydrophobicContact CB-CG1 4.38Å
828	F	91.9	Very high	80	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-70.8	-54	171.9	170.1	-114.3	0	0	0	110.9	L824 I825 C826 A830 R831 V832 A854 V857 W858 L861 I874 L878 I942	L824-F828 WeakPolarHBondContact O-CB 3.12Å; L824-F828 PolarHBondContact O-N 3.27Å; I825-F828 PolarHBondContact O-N 3.43Å; C826-F828 VanDerWaalsContact C-N 3.34Å; C826-F828 PolarHBondContact O-N 3.41Å; F828-A830 VanDerWaalsContact C-N 3.31Å; F828-A830 PolarHBondContact O-N 3.17Å; F828-R831 WeakPolarHBondContact O-CB 3.45Å; F828-R831 PolarHBondContact O-N 3.17Å; F828-V832 HydrophobicContact CD2-CG2 3.96Å; F828-V832 HydrophobicContact CE1-CG2 4.11Å; F828-V832 HydrophobicContact CE2-CG2 3.49Å; F828-V832 VanDerWaalsContact CE2-CG2 3.49Å; F828-V832 HydrophobicContact CG-CG2 4.44Å; F828-V832 HydrophobicContact CZ-CG2 3.59Å; F828-V832 PolarHBondContact O-N 3Å; F828-A854 HydrophobicContact CD2-CB 4.14Å; F828-A854 WeakPolarHBondContact CD2-O 3.38Å; F828-A854 HydrophobicContact CE2-CB 4.12Å; F828-V857 HydrophobicContact CB-CB 4.33Å; F828-V857 HydrophobicContact CB-CG1 3.84Å; F828-W858 AromaticContact CD1-CE3 3.79Å; F828-W858 HydrophobicContact CD1-CE3 3.79Å; F828-W858 HydrophobicContact CD1-CZ3 4.04Å; F828-W858 HydrophobicContact CD2-CB 4.06Å; F828-W858 HydrophobicContact CD2-CE3 4.08Å; F828-W858 HydrophobicContact CE1-CD2 4.39Å; F828-W858 AromaticContact CE1-CE3 3.41Å; F828-W858 HydrophobicContact CE1-CE3 3.41Å; F828-W858 VanDerWaalsContact CE1-CE3 3.41Å; F828-W858 AromaticContact CE1-CZ3 3.61Å; F828-W858 HydrophobicContact CE1-CZ3 3.61Å; F828-W858 HydrophobicContact CE2-CB 3.77Å; F828-W858 HydrophobicContact CE2-CD2 4.12Å; F828-W858 AromaticContact CE2-CE3 3.74Å; F828-W858 HydrophobicContact CE2-CE3 3.74Å; F828-W858 HydrophobicContact CE2-CG 4.16Å; F828-W858 HydrophobicContact CG-CE3 4.1Å; F828-W858 HydrophobicContact CZ-CB 4.47Å; F828-W858 AromaticContact CZ-CD2 3.93Å; F828-W858 HydrophobicContact CZ-CD2 3.93Å; F828-W858 AromaticContact CZ-CE3 3.38Å; F828-W858 HydrophobicContact CZ-CE3 3.38Å; F828-W858 HydrophobicContact CZ-CG 4.39Å; F828-W858 AromaticContact CZ-CZ3 3.98Å; F828-W858 HydrophobicContact CZ-CZ3 3.98Å; F828-L861 HydrophobicContact CB-CD1 4.13Å; F828-L861 HydrophobicContact CG-CD1 4.42Å; F828-I874 HydrophobicContact CZ-CG2 4.14Å; F828-L878 HydrophobicContact CE2-CD1 3.84Å; F828-L878 HydrophobicContact CE2-CD2 4.24Å; F828-L878 HydrophobicContact CZ-CD1 4.17Å; F828-I942 HydrophobicContact CE1-CD1 3.79Å; F828-I942 HydrophobicContact CE1-CG1 4.05Å; F828-I942 HydrophobicContact CE1-CG2 4.3Å; F828-I942 HydrophobicContact CZ-CD1 3.65Å; F828-I942 HydrophobicContact CZ-CG1 4.18Å
829	L	89.5	Confident	81.5	Confident	9 Å²	9	47.9 Å²	47.9	5%	0.047	25%	0.253	C	S	.	.	H	α-helix	trans	-58.7	-41.6	-178.8	-65.9	178.9	0	0	0	112.1	I825 C826 R831 V832 M833 I942 L946 A962 V966	I825-L829 HydrophobicContact CG2-CD1 4.14Å; I825-L829 HydrophobicContact CG2-CG 4.41Å; I825-L829 WeakPolarHBondContact O-CG 3.09Å; I825-L829 PolarHBondContact O-N 3.42Å; C826-L829 PolarHBondContact O-N 3.4Å; L829-R831 VanDerWaalsContact C-N 3.25Å; L829-R831 PolarHBondContact O-N 3.43Å; L829-V832 PolarHBondContact O-N 2.92Å; L829-M833 WeakPolarHBondContact O-CB 3.34Å; L829-M833 VanDerWaalsContact O-CG 3.28Å; L829-M833 WeakPolarHBondContact O-CG 3.24Å; L829-M833 PolarHBondContact O-N 3.38Å; L829-I942 HydrophobicContact CD2-CG2 3.53Å; L829-L946 HydrophobicContact CD1-CD1 3.77Å; L829-L946 HydrophobicContact CD1-CD2 3.93Å; L829-L946 HydrophobicContact CD1-CG 4.49Å; L829-L946 HydrophobicContact CD2-CD1 3.99Å; L829-L946 HydrophobicContact CD2-CD2 4.42Å; L829-A962 HydrophobicContact CD1-CB 3.69Å; L829-V966 HydrophobicContact CD1-CG2 4.22Å; L829-V966 HydrophobicContact CD2-CG2 3.98Å
830	A	85.4	Confident	82.6	Confident	43 Å²	43	44.3 Å²	44.3	36%	0.355	24%	0.239	S	C	.	.	H	α-helix	trans	-57.7	-36.6	175.7	0	0	0	0	0	113	C826 F828 H834	C826-A830 WeakPolarHBondContact O-CB 3.44Å; C826-A830 PolarHBondContact O-N 2.98Å; F828-A830 VanDerWaalsContact C-N 3.31Å; F828-A830 PolarHBondContact O-N 3.17Å; A830-H834 PolarHBondContact O-N 3.02Å; A830-H834 PolarHBondContact O-ND1 3.02Å
831	R	89.4	Confident	82.7	Confident	36 Å²	36	43.9 Å²	43.9	14%	0.136	24%	0.236	C	C	.	.	H	α-helix	trans	-77.9	-39.5	178.9	-69.8	164.8	163.1	77.6	-0.5	112.6	A827 F828 L829 M833 G835 F842 E843 P850 S853 A854	A827-R831 VanDerWaalsContact O-CD 3.24Å; A827-R831 WeakPolarHBondContact O-CD 3.31Å; A827-R831 VanDerWaalsContact O-CG 3.31Å; A827-R831 WeakPolarHBondContact O-CG 3.47Å; A827-R831 PolarHBondContact O-NH1 2.97Å; F828-R831 WeakPolarHBondContact O-CB 3.45Å; F828-R831 PolarHBondContact O-N 3.17Å; L829-R831 VanDerWaalsContact C-N 3.25Å; L829-R831 PolarHBondContact O-N 3.43Å; R831-M833 VanDerWaalsContact C-N 3.32Å; R831-G835 PolarHBondContact O-N 3.12Å; R831-F842 HydrophobicContact CG-CB 4.38Å; R831-F842 HydrophobicContact CG-CD1 3.65Å; R831-F842 HydrophobicContact CG-CD2 4.1Å; R831-F842 HydrophobicContact CG-CE1 3.86Å; R831-F842 HydrophobicContact CG-CE2 4.29Å; R831-F842 HydrophobicContact CG-CG 3.77Å; R831-F842 HydrophobicContact CG-CZ 4.18Å; R831-E843 IonicContact CZ-OE1 2.72Å; R831-E843 IonicContact NE-OE1 3.21Å; R831-E843 IonicContact NH2-OE1 2.64Å; R831-E843 PolarHBondContact NH2-OE1 3.28Å; R831-P850 WeakPolarHBondContact O-CB 3.45Å; R831-S853 WeakPolarHBondContact CD-OG 3.48Å; R831-S853 PolarHBondContact NE-OG 3.4Å; R831-A854 HydrophobicContact CB-CB 3.77Å
832	V	89.5	Confident	82.5	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.006	23%	0.233	C	C	.	.	H	α-helix	trans	-63.1	-41.6	173.4	175.8	0	0	0	0	110.6	F828 L829 H834 G835 A854 L878 F935 L938 L939 I942	F828-V832 HydrophobicContact CD2-CG2 3.96Å; F828-V832 HydrophobicContact CE1-CG2 4.11Å; F828-V832 HydrophobicContact CE2-CG2 3.49Å; F828-V832 VanDerWaalsContact CE2-CG2 3.49Å; F828-V832 HydrophobicContact CG-CG2 4.44Å; F828-V832 HydrophobicContact CZ-CG2 3.59Å; F828-V832 PolarHBondContact O-N 3Å; L829-V832 PolarHBondContact O-N 2.92Å; V832-H834 VanDerWaalsContact C-N 3.31Å; V832-H834 PolarHBondContact O-N 2.69Å; V832-G835 WeakPolarHBondContact O-CA 3.49Å; V832-G835 PolarHBondContact O-N 3.25Å; V832-A854 HydrophobicContact CG2-CB 3.86Å; V832-L878 HydrophobicContact CG2-CD2 4.05Å; V832-F935 WeakPolarHBondContact O-CZ 3.45Å; V832-L938 HydrophobicContact CG1-CD2 4.37Å; V832-L939 HydrophobicContact CG1-CD2 4.13Å; V832-I942 HydrophobicContact CB-CD1 4.46Å; V832-I942 HydrophobicContact CG1-CD1 3.82Å; V832-I942 HydrophobicContact CG2-CD1 4.04Å
833	M	84.3	Confident	82.2	Confident	36 Å²	36	44.5 Å²	44.5	18%	0.177	24%	0.239	C	C	.	.	H	α-helix	trans	-63.8	-33.6	-178.2	-78.8	-51.9	-38	0	0	113.9	L829 R831 G835 L939 F965 S969	L829-M833 WeakPolarHBondContact O-CB 3.34Å; L829-M833 VanDerWaalsContact O-CG 3.28Å; L829-M833 WeakPolarHBondContact O-CG 3.24Å; L829-M833 PolarHBondContact O-N 3.38Å; R831-M833 VanDerWaalsContact C-N 3.32Å; M833-G835 PolarHBondContact O-N 3.35Å; M833-L939 HydrophobicContact SD-CD2 4.08Å; M833-F965 HydrophobicContact CB-CE1 4.26Å; M833-F965 HydrophobicContact CE-CE1 4.1Å; M833-F965 HydrophobicContact CG-CD1 3.96Å; M833-F965 HydrophobicContact CG-CE1 3.85Å; M833-F965 HydrophobicContact SD-CD1 4.35Å; M833-F965 HydrophobicContact SD-CE1 4.36Å; M833-S969 WeakPolarHBondContact CE-OG 3.26Å
834	H	82.9	Confident	81.1	Confident	73 Å²	73	48.6 Å²	48.6	34%	0.338	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86	12.8	172.1	-62.1	80.9	0	0	0	112.3	A830 V832 K836 Q837 V840 F842 P850	A830-H834 PolarHBondContact O-N 3.02Å; A830-H834 PolarHBondContact O-ND1 3.02Å; V832-H834 VanDerWaalsContact C-N 3.31Å; V832-H834 PolarHBondContact O-N 2.69Å; H834-K836 VanDerWaalsContact C-N 3.29Å; H834-K836 PolarHBondContact O-N 3.33Å; H834-Q837 PolarHBondContact CD2-OE1 2.86Å; H834-Q837 WeakPolarHBondContact O-CB 3.48Å; H834-Q837 PolarHBondContact O-N 2.86Å; H834-V840 HydrophobicContact CB-CB 4.35Å; H834-V840 HydrophobicContact CB-CG1 4.23Å; H834-V840 HydrophobicContact CB-CG2 4.43Å; H834-F842 HydrophobicContact CB-CE2 3.92Å; H834-F842 HydrophobicContact CB-CZ 4.05Å; H834-F842 AromaticContact ND1-CZ 3.81Å; H834-P850 HydrophobicContact CB-CB 4.38Å; H834-P850 HydrophobicContact CB-CG 4.39Å
835	G	81.9	Confident	80.2	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.01	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-25	-171.8	0	0	0	0	0	116	R831 V832 M833 Q837	R831-G835 PolarHBondContact O-N 3.12Å; V832-G835 WeakPolarHBondContact O-CA 3.49Å; V832-G835 PolarHBondContact O-N 3.25Å; M833-G835 PolarHBondContact O-N 3.35Å; G835-Q837 VanDerWaalsContact C-N 3.34Å
836	K	80.4	Confident	79.1	Confident	70 Å²	70	58 Å²	58	30%	0.304	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-8.7	173	-70	-168.2	-177.9	-173.8	0	113.8	H834 F935 M973 E976	H834-K836 VanDerWaalsContact C-N 3.29Å; H834-K836 PolarHBondContact O-N 3.33Å; K836-F935 HydrophobicContact CG-CD2 4.43Å; K836-F935 HydrophobicContact CG-CE1 4.36Å; K836-F935 HydrophobicContact CG-CE2 4.19Å; K836-F935 HydrophobicContact CG-CZ 4.15Å; K836-M973 WeakPolarHBondContact CE-SD 3.4Å; K836-E976 IonicContact NZ-OE2 3.93Å; K836-E976 PolarHBondContact NZ-OE2 2.93Å
837	Q	81.9	Confident	78.2	Confident	87 Å²	87	64.1 Å²	64.1	41%	0.407	31%	0.31	S	S	.	.			trans	-111.7	95.9	-169.7	-66.5	151.1	-18.2	0	0	110.2	H834 G835 D839 V840 P850	H834-Q837 PolarHBondContact CD2-OE1 2.86Å; H834-Q837 WeakPolarHBondContact O-CB 3.48Å; H834-Q837 PolarHBondContact O-N 2.86Å; G835-Q837 VanDerWaalsContact C-N 3.34Å; Q837-D839 PolarHBondContact O-N 2.76Å; Q837-V840 HydrophobicContact CB-CG2 3.83Å; Q837-V840 PolarHBondContact O-N 2.77Å; Q837-P850 WeakPolarHBondContact O-CG 3.14Å
838	L	76.3	Confident	77.8	Confident	27 Å²	27	63.3 Å²	63.3	14%	0.141	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-10.2	-173.9	-56	-176.3	0	0	0	113.7	M849 V885 K889 Q891	L838-M849 HydrophobicContact CB-SD 4.34Å; L838-M849 HydrophobicContact CD1-SD 4.49Å; L838-M849 HydrophobicContact CD2-CG 4.49Å; L838-M849 HydrophobicContact CD2-SD 3.86Å; L838-M849 HydrophobicContact CG-SD 4.45Å; L838-V885 HydrophobicContact CD1-CG1 4.49Å; L838-V885 HydrophobicContact CD2-CB 4.46Å; L838-V885 HydrophobicContact CD2-CG1 3.73Å; L838-V885 HydrophobicContact CG-CG1 4.16Å; L838-K889 HydrophobicContact CD1-CB 3.83Å; L838-K889 HydrophobicContact CD1-CG 3.83Å; L838-K889 HydrophobicContact CG-CG 4.35Å; L838-Q891 HydrophobicContact CD1-CG 4.41Å
839	D	72.1	Confident	77.3	Confident	134 Å²	134	64.2 Å²	64.2	72%	0.717	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-12.2	179	54	-54.9	0	0	0	113.9	Q837	Q837-D839 PolarHBondContact O-N 2.76Å
840	V	74.2	Confident	77.1	Confident	37 Å²	37	63.8 Å²	63.8	22%	0.224	31%	0.305	C	S	.	.			trans	-88.7	116.6	-178.8	-176.6	0	0	0	0	110.8	H834 Q837 F842 P850	H834-V840 HydrophobicContact CB-CB 4.35Å; H834-V840 HydrophobicContact CB-CG1 4.23Å; H834-V840 HydrophobicContact CB-CG2 4.43Å; Q837-V840 HydrophobicContact CB-CG2 3.83Å; Q837-V840 PolarHBondContact O-N 2.77Å; V840-F842 HydrophobicContact CB-CE2 4.34Å; V840-F842 HydrophobicContact CG1-CD2 4.1Å; V840-F842 HydrophobicContact CG1-CE2 3.48Å; V840-F842 VanDerWaalsContact CG1-CE2 3.48Å; V840-F842 HydrophobicContact CG1-CZ 3.95Å; V840-P850 HydrophobicContact CB-CG 4.14Å; V840-P850 WeakPolarHBondContact O-CD 3.47Å; V840-P850 VanDerWaalsContact O-CG 3.26Å; V840-P850 WeakPolarHBondContact O-CG 3.31Å
841	L	72.7	Confident	77.2	Confident	80 Å²	80	62 Å²	62	42%	0.419	29%	0.289	S	S	.	.			trans	-102.1	114.9	-178.6	-64.3	179.4	0	0	0	112.5	E846	L841-E846 HydrophobicContact CD1-CB 4.18Å; L841-E846 HydrophobicContact CD1-CG 3.96Å
842	F	73.7	Confident	77	Confident	60 Å²	60	60.4 Å²	60.4	26%	0.263	28%	0.284	S	S	.	.			trans	-93.7	-21.1	174.2	-71.1	-90	0	0	0	113.5	R831 H834 V840 P850	R831-F842 HydrophobicContact CG-CB 4.38Å; R831-F842 HydrophobicContact CG-CD1 3.65Å; R831-F842 HydrophobicContact CG-CD2 4.1Å; R831-F842 HydrophobicContact CG-CE1 3.86Å; R831-F842 HydrophobicContact CG-CE2 4.29Å; R831-F842 HydrophobicContact CG-CG 3.77Å; R831-F842 HydrophobicContact CG-CZ 4.18Å; H834-F842 HydrophobicContact CB-CE2 3.92Å; H834-F842 HydrophobicContact CB-CZ 4.05Å; H834-F842 AromaticContact ND1-CZ 3.81Å; V840-F842 HydrophobicContact CB-CE2 4.34Å; V840-F842 HydrophobicContact CG1-CD2 4.1Å; V840-F842 HydrophobicContact CG1-CE2 3.48Å; V840-F842 VanDerWaalsContact CG1-CE2 3.48Å; V840-F842 HydrophobicContact CG1-CZ 3.95Å; F842-P850 HydrophobicContact CD2-CB 4.01Å; F842-P850 HydrophobicContact CD2-CG 4.01Å; F842-P850 HydrophobicContact CE2-CB 3.81Å; F842-P850 HydrophobicContact CE2-CG 3.86Å
843	E	76.4	Confident	76.8	Confident	81 Å²	81	60.4 Å²	60.4	38%	0.379	28%	0.283	S	S	.	.	S	Bend	trans	-116.2	166.7	-176.5	-59.2	-53.3	144.9	0	0	112.3	R831 D845 V848 S853	R831-E843 IonicContact CZ-OE1 2.72Å; R831-E843 IonicContact NE-OE1 3.21Å; R831-E843 IonicContact NH2-OE1 2.64Å; R831-E843 PolarHBondContact NH2-OE1 3.28Å; E843-D845 VanDerWaalsContact C-N 3.32Å; E843-D845 PolarHBondContact O-N 3.24Å; E843-V848 HydrophobicContact CB-CB 4.16Å; E843-V848 HydrophobicContact CB-CG1 4.42Å; E843-V848 HydrophobicContact CG-CB 4.23Å; E843-V848 HydrophobicContact CG-CG1 3.93Å; E843-S853 PolarHBondContact OE1-OG 3.06Å
844	K	56.9	Low	77	Confident	153 Å²	153	58.7 Å²	58.7	67%	0.665	28%	0.275	S	S	*	.	S	Bend	trans	-76.3	-11.6	178.1	-66	-178.5	-178.4	175.6	0	114.7
845	D	69.1	Low	77.2	Confident	60 Å²	60	55.5 Å²	55.5	32%	0.321	26%	0.261	S	S	.	.	S	Bend	trans	-102.6	112.1	174.9	-177.8	13.6	0	0	0	108	E843 R847 V848	E843-D845 VanDerWaalsContact C-N 3.32Å; E843-D845 PolarHBondContact O-N 3.24Å; D845-R847 PolarHBondContact O-N 2.98Å; D845-R847 IonicContact OD1-CZ 2.76Å; D845-R847 IonicContact OD1-NE 3.6Å; D845-R847 PolarHBondContact OD1-NE 3.44Å; D845-R847 IonicContact OD1-NH2 3.61Å; D845-R847 PolarHBondContact OD1-NH2 2.89Å; D845-R847 IonicContact OD2-NE 2.66Å; D845-R847 IonicContact OD2-NH2 3.17Å; D845-V848 HydrophobicContact CB-CG2 4.16Å; D845-V848 PolarHBondContact O-N 3.47Å
846	E	63.1	Low	77.4	Confident	158 Å²	158	58.3 Å²	58.3	74%	0.738	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-10	-174.4	-56.5	179.5	154.6	0	0	113.5	L841	L841-E846 HydrophobicContact CD1-CB 4.18Å; L841-E846 HydrophobicContact CD1-CG 3.96Å
847	R	65.9	Low	77.7	Confident	177 Å²	177	55.7 Å²	55.7	67%	0.668	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-0.1	175.3	-68.2	167.8	-69.5	-141.8	-7.8	114.3	D845 M852	D845-R847 PolarHBondContact O-N 2.98Å; D845-R847 IonicContact OD1-CZ 2.76Å; D845-R847 IonicContact OD1-NE 3.6Å; D845-R847 PolarHBondContact OD1-NE 3.44Å; D845-R847 IonicContact OD1-NH2 3.61Å; D845-R847 PolarHBondContact OD1-NH2 2.89Å; D845-R847 IonicContact OD2-NE 2.66Å; D845-R847 IonicContact OD2-NH2 3.17Å; R847-M852 WeakPolarHBondContact O-CE 3.38Å
848	V	75.6	Confident	78.1	Confident	6 Å²	6	51.6 Å²	51.6	4%	0.036	25%	0.249	C	C	.	.			trans	-103.9	94.1	178.7	-172.3	0	0	0	0	110.3	E843 D845 M852 W901	E843-V848 HydrophobicContact CB-CB 4.16Å; E843-V848 HydrophobicContact CB-CG1 4.42Å; E843-V848 HydrophobicContact CG-CB 4.23Å; E843-V848 HydrophobicContact CG-CG1 3.93Å; D845-V848 HydrophobicContact CB-CG2 4.16Å; D845-V848 PolarHBondContact O-N 3.47Å; V848-M852 HydrophobicContact CG1-CB 3.9Å; V848-W901 HydrophobicContact CG1-CZ2 3.96Å; V848-W901 HydrophobicContact CG2-CZ2 4.42Å
849	M	82.6	Confident	78.5	Confident	19 Å²	19	52.3 Å²	52.3	9%	0.094	26%	0.256	C	S	.	.			trans	-73	162.8	-180	-67	169.6	-67.5	0	0	112	L838 L851 M852 S853 C886 V898	L838-M849 HydrophobicContact CB-SD 4.34Å; L838-M849 HydrophobicContact CD1-SD 4.49Å; L838-M849 HydrophobicContact CD2-CG 4.49Å; L838-M849 HydrophobicContact CD2-SD 3.86Å; L838-M849 HydrophobicContact CG-SD 4.45Å; M849-L851 PolarHBondContact O-N 3.27Å; M849-M852 HydrophobicContact CB-SD 4.02Å; M849-M852 HydrophobicContact CE-SD 3.56Å; M849-M852 VanDerWaalsContact CE-SD 3.56Å; M849-M852 HydrophobicContact CG-SD 4.48Å; M849-M852 PolarHBondContact N-SD 3.01Å; M849-M852 WeakPolarHBondContact O-CA 3.37Å; M849-M852 WeakPolarHBondContact O-CB 3.37Å; M849-M852 PolarHBondContact O-N 3.38Å; M849-S853 PolarHBondContact O-N 3.14Å; M849-S853 VanDerWaalsContact O-N 3.07Å; M849-C886 WeakPolarHBondContact CE-SG 3.33Å; M849-V898 HydrophobicContact CE-CG2 3.28Å
850	P	85.4	Confident	79.2	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.006	24%	0.243	C	C	.	.	H	α-helix	trans	-52.5	-45.5	-170.1	-31.6	37.2	0	0	0	115.5	R831 H834 Q837 V840 F842 M852 S853 A854	R831-P850 WeakPolarHBondContact O-CB 3.45Å; H834-P850 HydrophobicContact CB-CB 4.38Å; H834-P850 HydrophobicContact CB-CG 4.39Å; Q837-P850 WeakPolarHBondContact O-CG 3.14Å; V840-P850 HydrophobicContact CB-CG 4.14Å; V840-P850 WeakPolarHBondContact O-CD 3.47Å; V840-P850 VanDerWaalsContact O-CG 3.26Å; V840-P850 WeakPolarHBondContact O-CG 3.31Å; F842-P850 HydrophobicContact CD2-CB 4.01Å; F842-P850 HydrophobicContact CD2-CG 4.01Å; F842-P850 HydrophobicContact CE2-CB 3.81Å; F842-P850 HydrophobicContact CE2-CG 3.86Å; P850-M852 VanDerWaalsContact C-N 3.32Å; P850-M852 PolarHBondContact O-N 3.21Å; P850-S853 PolarHBondContact O-N 2.94Å; P850-A854 WeakPolarHBondContact O-CB 3.47Å; P850-A854 PolarHBondContact O-N 3.5Å
851	L	87.1	Confident	79.7	Confident	5 Å²	5	47.2 Å²	47.2	3%	0.026	23%	0.233	C	C	.	.	H	α-helix	trans	-67.7	-28	178	-66.5	179.8	0	0	0	113.8	M849 A855 L878 Q881 A882 V885 F935 L938	M849-L851 PolarHBondContact O-N 3.27Å; L851-A855 PolarHBondContact O-N 2.88Å; L851-A855 VanDerWaalsContact O-N 3.14Å; L851-L878 HydrophobicContact CD2-CD2 4.21Å; L851-Q881 HydrophobicContact CD1-CB 3.84Å; L851-A882 HydrophobicContact CB-CB 3.89Å; L851-A882 HydrophobicContact CD1-CB 4.47Å; L851-V885 HydrophobicContact CD1-CG2 4.33Å; L851-F935 HydrophobicContact CD1-CE2 4.12Å; L851-F935 HydrophobicContact CD2-CE2 4.18Å; L851-L938 HydrophobicContact CD2-CD2 4.29Å
852	M	84.6	Confident	80.3	Confident	3 Å²	3	48.9 Å²	48.9	2%	0.015	24%	0.238	C	C	.	.	H	α-helix	trans	-71.1	-45	173.9	-57.6	165.8	67.4	0	0	110.1	R847 V848 M849 P850 A854 A855 V856 A882 V898 W901 F902	R847-M852 WeakPolarHBondContact O-CE 3.38Å; V848-M852 HydrophobicContact CG1-CB 3.9Å; M849-M852 HydrophobicContact CB-SD 4.02Å; M849-M852 HydrophobicContact CE-SD 3.56Å; M849-M852 VanDerWaalsContact CE-SD 3.56Å; M849-M852 HydrophobicContact CG-SD 4.48Å; M849-M852 PolarHBondContact N-SD 3.01Å; M849-M852 WeakPolarHBondContact O-CA 3.37Å; M849-M852 WeakPolarHBondContact O-CB 3.37Å; M849-M852 PolarHBondContact O-N 3.38Å; P850-M852 VanDerWaalsContact C-N 3.32Å; P850-M852 PolarHBondContact O-N 3.21Å; M852-A854 VanDerWaalsContact C-N 3.33Å; M852-A855 PolarHBondContact O-N 2.79Å; M852-V856 PolarHBondContact O-N 2.88Å; M852-A882 HydrophobicContact CG-CB 4.5Å; M852-V898 HydrophobicContact CG-CG2 4.42Å; M852-V898 HydrophobicContact SD-CG2 3.83Å; M852-W901 HydrophobicContact CB-CE3 4.39Å; M852-W901 HydrophobicContact CB-CH2 3.92Å; M852-W901 HydrophobicContact CB-CZ2 4.18Å; M852-W901 HydrophobicContact CB-CZ3 4.04Å; M852-W901 HydrophobicContact CE-CB 3.73Å; M852-W901 HydrophobicContact CE-CD2 3.34Å; M852-W901 HydrophobicContact CE-CE3 3.81Å; M852-W901 HydrophobicContact CE-CG 3.32Å; M852-W901 HydrophobicContact CE-CZ2 4.36Å; M852-W901 VanDerWaalsContact O-CH2 3.28Å; M852-W901 WeakPolarHBondContact O-CH2 3.41Å; M852-F902 HydrophobicContact CB-CE2 4.45Å; M852-F902 HydrophobicContact CG-CE2 3.98Å
853	S	86.4	Confident	80.6	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-65	-37.5	174.6	-177.2	0	0	0	0	111.3	R831 E843 M849 P850 A855 V856 V857	R831-S853 WeakPolarHBondContact CD-OG 3.48Å; R831-S853 PolarHBondContact NE-OG 3.4Å; E843-S853 PolarHBondContact OE1-OG 3.06Å; M849-S853 PolarHBondContact O-N 3.14Å; M849-S853 VanDerWaalsContact O-N 3.07Å; P850-S853 PolarHBondContact O-N 2.94Å; S853-A855 VanDerWaalsContact C-N 3.32Å; S853-A855 PolarHBondContact O-N 3.02Å; S853-V856 PolarHBondContact O-N 3.32Å; S853-V856 VanDerWaalsContact O-N 3.16Å; S853-V857 PolarHBondContact O-N 3.48Å
854	A	88.6	Confident	80.6	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-57.9	-42.3	174	0	0	0	0	0	112	F828 R831 V832 P850 M852 V856 V857 W858 L878	F828-A854 HydrophobicContact CD2-CB 4.14Å; F828-A854 WeakPolarHBondContact CD2-O 3.38Å; F828-A854 HydrophobicContact CE2-CB 4.12Å; R831-A854 HydrophobicContact CB-CB 3.77Å; V832-A854 HydrophobicContact CG2-CB 3.86Å; P850-A854 WeakPolarHBondContact O-CB 3.47Å; P850-A854 PolarHBondContact O-N 3.5Å; M852-A854 VanDerWaalsContact C-N 3.33Å; A854-V856 VanDerWaalsContact C-N 3.31Å; A854-V856 PolarHBondContact O-N 2.9Å; A854-V857 PolarHBondContact O-N 3.49Å; A854-W858 WeakPolarHBondContact O-CB 3.44Å; A854-W858 PolarHBondContact O-N 3.02Å; A854-L878 HydrophobicContact CB-CD2 4.21Å
855	A	86.7	Confident	81.9	Confident	6 Å²	6	44.6 Å²	44.6	5%	0.05	23%	0.231	C	C	.	.	H	α-helix	trans	-63.4	-32.2	177.2	0	0	0	0	0	113.6	L851 M852 S853 W858 S859 F902	L851-A855 PolarHBondContact O-N 2.88Å; L851-A855 VanDerWaalsContact O-N 3.14Å; M852-A855 PolarHBondContact O-N 2.79Å; S853-A855 VanDerWaalsContact C-N 3.32Å; S853-A855 PolarHBondContact O-N 3.02Å; A855-W858 PolarHBondContact O-N 3.03Å; A855-S859 PolarHBondContact O-N 3.48Å; A855-S859 PolarHBondContact O-OG 2.98Å; A855-F902 HydrophobicContact CB-CE1 3.61Å; A855-F902 HydrophobicContact CB-CZ 3.74Å
856	V	85.2	Confident	82.2	Confident	60 Å²	60	49.4 Å²	49.4	36%	0.364	25%	0.251	S	S	.	.	H	α-helix	trans	-67.7	-43.7	174.1	-171.9	0	0	0	0	111.1	M852 S853 A854 W858 S859 S860 W901	M852-V856 PolarHBondContact O-N 2.88Å; S853-V856 PolarHBondContact O-N 3.32Å; S853-V856 VanDerWaalsContact O-N 3.16Å; A854-V856 VanDerWaalsContact C-N 3.31Å; A854-V856 PolarHBondContact O-N 2.9Å; V856-W858 VanDerWaalsContact C-N 3.33Å; V856-S859 PolarHBondContact O-N 3.3Å; V856-S860 PolarHBondContact O-N 2.83Å; V856-S860 PolarHBondContact O-OG 3.16Å; V856-S860 VanDerWaalsContact O-OG 3.07Å; V856-W901 HydrophobicContact CG2-CH2 3.64Å; V856-W901 HydrophobicContact CG2-CZ2 4.09Å
857	V	87.2	Confident	83.2	Confident	15 Å²	15	46 Å²	46	9%	0.091	24%	0.238	C	C	.	.	H	α-helix	trans	-67.6	-37	176.7	-173.2	0	0	0	0	110.6	L824 A827 F828 S853 A854 S860 L861	L824-V857 HydrophobicContact CD2-CG1 4.06Å; L824-V857 WeakPolarHBondContact O-CG1 3.45Å; A827-V857 HydrophobicContact CB-CG1 4.38Å; F828-V857 HydrophobicContact CB-CB 4.33Å; F828-V857 HydrophobicContact CB-CG1 3.84Å; S853-V857 PolarHBondContact O-N 3.48Å; A854-V857 PolarHBondContact O-N 3.49Å; V857-S860 WeakPolarHBondContact O-CA 3.49Å; V857-S860 VanDerWaalsContact O-CB 3.3Å; V857-S860 WeakPolarHBondContact O-CB 3.32Å; V857-S860 PolarHBondContact O-N 3.21Å; V857-L861 PolarHBondContact O-N 2.66Å
858	W	90.4	Very high	84.1	Confident	1 Å²	1	43.8 Å²	43.8	0%	0.004	24%	0.235	C	C	.	.	H	α-helix	trans	-61.6	-45.2	175.2	-170.5	-110.7	0	0	0	112.4	F828 A854 A855 V856 S860 L861 V865 F871 I874 T875 L878 F945	F828-W858 AromaticContact CD1-CE3 3.79Å; F828-W858 HydrophobicContact CD1-CE3 3.79Å; F828-W858 HydrophobicContact CD1-CZ3 4.04Å; F828-W858 HydrophobicContact CD2-CB 4.06Å; F828-W858 HydrophobicContact CD2-CE3 4.08Å; F828-W858 HydrophobicContact CE1-CD2 4.39Å; F828-W858 AromaticContact CE1-CE3 3.41Å; F828-W858 HydrophobicContact CE1-CE3 3.41Å; F828-W858 VanDerWaalsContact CE1-CE3 3.41Å; F828-W858 AromaticContact CE1-CZ3 3.61Å; F828-W858 HydrophobicContact CE1-CZ3 3.61Å; F828-W858 HydrophobicContact CE2-CB 3.77Å; F828-W858 HydrophobicContact CE2-CD2 4.12Å; F828-W858 AromaticContact CE2-CE3 3.74Å; F828-W858 HydrophobicContact CE2-CE3 3.74Å; F828-W858 HydrophobicContact CE2-CG 4.16Å; F828-W858 HydrophobicContact CG-CE3 4.1Å; F828-W858 HydrophobicContact CZ-CB 4.47Å; F828-W858 AromaticContact CZ-CD2 3.93Å; F828-W858 HydrophobicContact CZ-CD2 3.93Å; F828-W858 AromaticContact CZ-CE3 3.38Å; F828-W858 HydrophobicContact CZ-CE3 3.38Å; F828-W858 HydrophobicContact CZ-CG 4.39Å; F828-W858 AromaticContact CZ-CZ3 3.98Å; F828-W858 HydrophobicContact CZ-CZ3 3.98Å; A854-W858 WeakPolarHBondContact O-CB 3.44Å; A854-W858 PolarHBondContact O-N 3.02Å; A855-W858 PolarHBondContact O-N 3.03Å; V856-W858 VanDerWaalsContact C-N 3.33Å; W858-S860 PolarHBondContact O-N 2.79Å; W858-S860 VanDerWaalsContact O-N 3.14Å; W858-L861 HydrophobicContact CE3-CD1 4.06Å; W858-L861 HydrophobicContact CZ3-CD1 4.26Å; W858-L861 WeakPolarHBondContact O-CA 3.48Å; W858-L861 WeakPolarHBondContact O-CB 3.49Å; W858-L861 PolarHBondContact O-N 3.2Å; W858-V865 HydrophobicContact CH2-CG2 3.68Å; W858-V865 HydrophobicContact CZ2-CG2 3.88Å; W858-V865 HydrophobicContact CZ3-CG2 4.47Å; W858-F871 AromaticContact CD1-CE2 3.72Å; W858-F871 HydrophobicContact CD2-CE2 4.44Å; W858-F871 AromaticContact CE2-CD2 3.62Å; W858-F871 AromaticContact CE2-CE2 3.86Å; W858-F871 HydrophobicContact CG-CE2 4.35Å; W858-F871 AromaticContact CZ2-CD2 3.79Å; W858-F871 HydrophobicContact CZ2-CD2 3.79Å; W858-F871 HydrophobicContact CZ2-CE2 4.42Å; W858-F871 AromaticContact NE1-CD2 3.31Å; W858-F871 VanDerWaalsContact NE1-CD2 3.31Å; W858-F871 AromaticContact NE1-CE2 3.39Å; W858-F871 PolarHBondContact NE1-O 2.86Å; W858-F871 WeakPolarHBondContact O-CE2 3.41Å; W858-I874 HydrophobicContact CD2-CG2 3.85Å; W858-I874 VanDerWaalsContact CE2-CG2 3.48Å; W858-I874 HydrophobicContact CE3-CG2 4.35Å; W858-I874 HydrophobicContact CG-CG2 4.34Å; W858-I874 HydrophobicContact CH2-CD1 3.56Å; W858-I874 HydrophobicContact CH2-CG2 4.24Å; W858-I874 HydrophobicContact CZ2-CB 3.73Å; W858-I874 HydrophobicContact CZ2-CD1 3.5Å; W858-I874 VanDerWaalsContact CZ2-CD1 3.5Å; W858-I874 HydrophobicContact CZ2-CG1 4.17Å; W858-I874 HydrophobicContact CZ2-CG2 3.71Å; W858-I874 HydrophobicContact CZ3-CD1 4.48Å; W858-T875 VanDerWaalsContact CD1-OG1 3.28Å; W858-T875 PolarHBondContact NE1-OG1 3.04Å; W858-L878 HydrophobicContact CB-CD1 3.97Å; W858-L878 HydrophobicContact CG-CD1 3.94Å; W858-F945 AromaticContact CH2-CD1 3.89Å; W858-F945 HydrophobicContact CH2-CD1 3.89Å; W858-F945 HydrophobicContact CH2-CD2 4.23Å; W858-F945 HydrophobicContact CH2-CE1 4.15Å; W858-F945 HydrophobicContact CH2-CE2 4.49Å; W858-F945 AromaticContact CH2-CG 3.93Å; W858-F945 HydrophobicContact CH2-CG 3.93Å; W858-F945 HydrophobicContact CH2-CZ 4.44Å; W858-F945 AromaticContact CZ3-CD1 3.89Å; W858-F945 HydrophobicContact CZ3-CD1 3.89Å; W858-F945 AromaticContact CZ3-CE1 3.85Å; W858-F945 HydrophobicContact CZ3-CE1 3.85Å; W858-F945 HydrophobicContact CZ3-CG 4.4Å; W858-F945 HydrophobicContact CZ3-CZ 4.34Å
859	S	85.3	Confident	84.4	Confident	43 Å²	43	45.5 Å²	45.5	30%	0.301	25%	0.254	S	S	.	.	H	α-helix	trans	-63.5	-16.7	172.4	-64.5	0	0	0	0	113.9	A855 V856 L861 H906	A855-S859 PolarHBondContact O-N 3.48Å; A855-S859 PolarHBondContact O-OG 2.98Å; V856-S859 PolarHBondContact O-N 3.3Å; S859-L861 VanDerWaalsContact C-N 3.32Å; S859-H906 PolarHBondContact OG-CE1 3.21Å; S859-H906 VanDerWaalsContact OG-CE1 3.31Å; S859-H906 PolarHBondContact OG-ND1 3.46Å
860	S	85.8	Confident	84.7	Confident	62 Å²	62	45.3 Å²	45.3	43%	0.434	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-7.8	171.7	-49.6	0	0	0	0	113.1	V856 V857 W858	V856-S860 PolarHBondContact O-N 2.83Å; V856-S860 PolarHBondContact O-OG 3.16Å; V856-S860 VanDerWaalsContact O-OG 3.07Å; V857-S860 WeakPolarHBondContact O-CA 3.49Å; V857-S860 VanDerWaalsContact O-CB 3.3Å; V857-S860 WeakPolarHBondContact O-CB 3.32Å; V857-S860 PolarHBondContact O-N 3.21Å; W858-S860 PolarHBondContact O-N 2.79Å; W858-S860 VanDerWaalsContact O-N 3.14Å
861	L	85.9	Confident	84.8	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.01	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	9	177.2	-72.6	168.4	0	0	0	112.9	E821 L824 I825 F828 V857 W858 S859 N863 A864 V865	E821-L861 HydrophobicContact CG-CD2 4.46Å; L824-L861 HydrophobicContact CB-CD1 4.47Å; L824-L861 HydrophobicContact CB-CD2 3.62Å; L824-L861 HydrophobicContact CB-CG 4.05Å; L824-L861 HydrophobicContact CD1-CD2 4.23Å; I825-L861 HydrophobicContact CG1-CD1 4.15Å; I825-L861 HydrophobicContact CG1-CD2 3.86Å; F828-L861 HydrophobicContact CB-CD1 4.13Å; F828-L861 HydrophobicContact CG-CD1 4.42Å; V857-L861 PolarHBondContact O-N 2.66Å; W858-L861 HydrophobicContact CE3-CD1 4.06Å; W858-L861 HydrophobicContact CZ3-CD1 4.26Å; W858-L861 WeakPolarHBondContact O-CA 3.48Å; W858-L861 WeakPolarHBondContact O-CB 3.49Å; W858-L861 PolarHBondContact O-N 3.2Å; S859-L861 VanDerWaalsContact C-N 3.32Å; L861-N863 VanDerWaalsContact C-N 3.27Å; L861-N863 PolarHBondContact O-N 2.91Å; L861-A864 HydrophobicContact CB-CB 4.34Å; L861-A864 HydrophobicContact CD2-CB 3.93Å; L861-A864 WeakPolarHBondContact O-CA 3.46Å; L861-A864 VanDerWaalsContact O-CB 3.31Å; L861-A864 WeakPolarHBondContact O-CB 3.48Å; L861-A864 PolarHBondContact O-N 3.11Å; L861-V865 PolarHBondContact O-N 2.9Å
862	E	83.9	Confident	84.8	Confident	115 Å²	115	51.3 Å²	51.3	54%	0.537	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-54	-42	-179.5	-170.7	162.9	-141.9	0	0	112.4	A864 V865 F871	E862-A864 VanDerWaalsContact C-N 3.25Å; E862-A864 PolarHBondContact O-N 3.47Å; E862-V865 PolarHBondContact O-N 2.83Å; E862-F871 HydrophobicContact CB-CE1 4.15Å; E862-F871 HydrophobicContact CB-CE2 3.92Å; E862-F871 HydrophobicContact CB-CZ 3.58Å; E862-F871 HydrophobicContact CG-CD1 4.3Å; E862-F871 HydrophobicContact CG-CE1 3.69Å; E862-F871 HydrophobicContact CG-CE2 4.28Å; E862-F871 HydrophobicContact CG-CZ 3.68Å; E862-F871 WeakPolarHBondContact OE1-CE1 3.46Å
863	N	79.9	Confident	84.9	Confident	170 Å²	170	54.3 Å²	54.3	91%	0.909	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-73.3	-10.3	176.2	-61.4	-45.3	0	0	0	114.6	L861	L861-N863 VanDerWaalsContact C-N 3.27Å; L861-N863 PolarHBondContact O-N 2.91Å
864	A	77.8	Confident	85.1	Confident	18 Å²	18	54.3 Å²	54.3	15%	0.149	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-94.3	-11.9	179.1	0	0	0	0	0	112.9	E821 L861 E862	E821-A864 HydrophobicContact CG-CB 3.97Å; E821-A864 WeakPolarHBondContact OE1-CB 3.46Å; L861-A864 HydrophobicContact CB-CB 4.34Å; L861-A864 HydrophobicContact CD2-CB 3.93Å; L861-A864 WeakPolarHBondContact O-CA 3.46Å; L861-A864 VanDerWaalsContact O-CB 3.31Å; L861-A864 WeakPolarHBondContact O-CB 3.48Å; L861-A864 PolarHBondContact O-N 3.11Å; E862-A864 VanDerWaalsContact C-N 3.25Å; E862-A864 PolarHBondContact O-N 3.47Å
865	V	83.2	Confident	85	Confident	15 Å²	15	56.1 Å²	56.1	9%	0.091	31%	0.305	C	S	.	.			trans	-108.6	101.4	-176.7	-172.4	0	0	0	0	109.5	W858 L861 E862 D867 F871 F945	W858-V865 HydrophobicContact CH2-CG2 3.68Å; W858-V865 HydrophobicContact CZ2-CG2 3.88Å; W858-V865 HydrophobicContact CZ3-CG2 4.47Å; L861-V865 PolarHBondContact O-N 2.9Å; E862-V865 PolarHBondContact O-N 2.83Å; V865-D867 WeakPolarHBondContact CG1-O 3.28Å; V865-D867 PolarHBondContact O-N 3.19Å; V865-F871 HydrophobicContact CB-CB 4.29Å; V865-F871 HydrophobicContact CB-CD2 4.23Å; V865-F871 HydrophobicContact CG1-CB 3.96Å; V865-F871 HydrophobicContact CG2-CD2 4.09Å; V865-F945 HydrophobicContact CG1-CD2 4.47Å; V865-F945 HydrophobicContact CG2-CD2 3.97Å; V865-F945 HydrophobicContact CG2-CE2 3.67Å; V865-F945 HydrophobicContact CG2-CZ 4.33Å
866	E	76.2	Confident	85	Confident	161 Å²	161	56.7 Å²	56.7	75%	0.752	31%	0.311	S	S	*	.	S	Bend	trans	-66	-22.1	-179.9	-62.7	179.9	164.8	0	0	113.4	K952	E866-K952 IonicContact OE1-NZ 3.01Å; E866-K952 PolarHBondContact OE1-NZ 3.46Å
867	D	83.6	Confident	85.1	Confident	87 Å²	87	53.8 Å²	53.8	47%	0.465	29%	0.293	S	S	.	.			trans	-97.1	99.1	177.5	-176.2	-16.6	0	0	0	111.1	V865 G869 L870 F871	V865-D867 WeakPolarHBondContact CG1-O 3.28Å; V865-D867 PolarHBondContact O-N 3.19Å; D867-G869 PolarHBondContact O-N 3.19Å; D867-G869 VanDerWaalsContact OD1-CA 3.27Å; D867-G869 WeakPolarHBondContact OD1-CA 3.42Å; D867-G869 PolarHBondContact OD1-N 3.38Å; D867-L870 HydrophobicContact CB-CB 3.72Å; D867-L870 HydrophobicContact CB-CD2 4.48Å; D867-L870 VanDerWaalsContact CG-CB 3.5Å; D867-L870 PolarHBondContact O-N 3.27Å; D867-L870 PolarHBondContact OD1-N 2.9Å; D867-F871 PolarHBondContact O-N 2.83Å
868	E	84	Confident	85.2	Confident	130 Å²	130	53.1 Å²	53.1	61%	0.607	29%	0.289	S	S	*	.	H	α-helix	trans	-60.1	-25.8	177.4	-155	-146	-175.1	0	0	112.8	K872	E868-K872 VanDerWaalsContact CD-CE 3.47Å; E868-K872 WeakPolarHBondContact O-CB 3.32Å; E868-K872 VanDerWaalsContact O-CD 3.28Å; E868-K872 WeakPolarHBondContact O-CD 3.24Å; E868-K872 WeakPolarHBondContact O-CG 3.5Å; E868-K872 PolarHBondContact O-N 2.96Å; E868-K872 VanDerWaalsContact OE1-CE 3.27Å; E868-K872 WeakPolarHBondContact OE1-CE 3.42Å; E868-K872 IonicContact OE1-NZ 3.17Å; E868-K872 PolarHBondContact OE1-NZ 3.11Å; E868-K872 IonicContact OE2-NZ 2.71Å; E868-K872 PolarHBondContact OE2-NZ 3.36Å
869	G	83.8	Confident	85	Confident	42 Å²	42	53.3 Å²	53.3	43%	0.433	29%	0.29	S	S	.	.	H	α-helix	trans	-73.1	-48	174.4	0	0	0	0	0	111.9	D867 F871 K872 E873	D867-G869 PolarHBondContact O-N 3.19Å; D867-G869 VanDerWaalsContact OD1-CA 3.27Å; D867-G869 WeakPolarHBondContact OD1-CA 3.42Å; D867-G869 PolarHBondContact OD1-N 3.38Å; G869-F871 VanDerWaalsContact C-N 3.31Å; G869-F871 PolarHBondContact O-N 3.2Å; G869-K872 PolarHBondContact O-N 2.99Å; G869-E873 PolarHBondContact O-N 3.11Å
870	L	86.9	Confident	85.1	Confident	16 Å²	16	51.3 Å²	51.3	8%	0.084	28%	0.276	C	S	.	.	H	α-helix	trans	-59.4	-42	174.7	-169.9	70	0	0	0	111.5	D867 K872 E873 I874 T941 F945	D867-L870 HydrophobicContact CB-CB 3.72Å; D867-L870 HydrophobicContact CB-CD2 4.48Å; D867-L870 VanDerWaalsContact CG-CB 3.5Å; D867-L870 PolarHBondContact O-N 3.27Å; D867-L870 PolarHBondContact OD1-N 2.9Å; L870-K872 VanDerWaalsContact C-N 3.35Å; L870-K872 PolarHBondContact O-N 3.03Å; L870-E873 PolarHBondContact O-N 3.48Å; L870-I874 HydrophobicContact CG-CD1 4.16Å; L870-I874 WeakPolarHBondContact O-CG1 3.47Å; L870-I874 PolarHBondContact O-N 2.94Å; L870-T941 HydrophobicContact CD1-CG2 3.47Å; L870-T941 VanDerWaalsContact CD1-CG2 3.47Å; L870-T941 HydrophobicContact CG-CG2 4.49Å; L870-F945 HydrophobicContact CD2-CB 3.93Å
871	F	88.4	Confident	85.2	Confident	17 Å²	17	48.6 Å²	48.6	8%	0.075	26%	0.256	C	S	.	.	H	α-helix	trans	-59.4	-43.7	175.3	-175.9	-107.2	0	0	0	112.4	W858 E862 V865 D867 G869 T875	W858-F871 AromaticContact CD1-CE2 3.72Å; W858-F871 HydrophobicContact CD2-CE2 4.44Å; W858-F871 AromaticContact CE2-CD2 3.62Å; W858-F871 AromaticContact CE2-CE2 3.86Å; W858-F871 HydrophobicContact CG-CE2 4.35Å; W858-F871 AromaticContact CZ2-CD2 3.79Å; W858-F871 HydrophobicContact CZ2-CD2 3.79Å; W858-F871 HydrophobicContact CZ2-CE2 4.42Å; W858-F871 AromaticContact NE1-CD2 3.31Å; W858-F871 VanDerWaalsContact NE1-CD2 3.31Å; W858-F871 AromaticContact NE1-CE2 3.39Å; W858-F871 PolarHBondContact NE1-O 2.86Å; W858-F871 WeakPolarHBondContact O-CE2 3.41Å; E862-F871 HydrophobicContact CB-CE1 4.15Å; E862-F871 HydrophobicContact CB-CE2 3.92Å; E862-F871 HydrophobicContact CB-CZ 3.58Å; E862-F871 HydrophobicContact CG-CD1 4.3Å; E862-F871 HydrophobicContact CG-CE1 3.69Å; E862-F871 HydrophobicContact CG-CE2 4.28Å; E862-F871 HydrophobicContact CG-CZ 3.68Å; E862-F871 WeakPolarHBondContact OE1-CE1 3.46Å; V865-F871 HydrophobicContact CB-CB 4.29Å; V865-F871 HydrophobicContact CB-CD2 4.23Å; V865-F871 HydrophobicContact CG1-CB 3.96Å; V865-F871 HydrophobicContact CG2-CD2 4.09Å; D867-F871 PolarHBondContact O-N 2.83Å; G869-F871 VanDerWaalsContact C-N 3.31Å; G869-F871 PolarHBondContact O-N 3.2Å; F871-T875 WeakPolarHBondContact O-CB 3.43Å; F871-T875 PolarHBondContact O-N 3.23Å; F871-T875 VanDerWaalsContact O-N 3.08Å; F871-T875 PolarHBondContact O-OG1 3.27Å
872	K	86.4	Confident	85.3	Confident	114 Å²	114	48.7 Å²	48.7	50%	0.496	26%	0.258	S	S	.	.	H	α-helix	trans	-69.4	-37.8	176.7	-72.6	166.2	-172.9	171.9	0	112.4	E868 G869 L870 G876	E868-K872 VanDerWaalsContact CD-CE 3.47Å; E868-K872 WeakPolarHBondContact O-CB 3.32Å; E868-K872 VanDerWaalsContact O-CD 3.28Å; E868-K872 WeakPolarHBondContact O-CD 3.24Å; E868-K872 WeakPolarHBondContact O-CG 3.5Å; E868-K872 PolarHBondContact O-N 2.96Å; E868-K872 VanDerWaalsContact OE1-CE 3.27Å; E868-K872 WeakPolarHBondContact OE1-CE 3.42Å; E868-K872 IonicContact OE1-NZ 3.17Å; E868-K872 PolarHBondContact OE1-NZ 3.11Å; E868-K872 IonicContact OE2-NZ 2.71Å; E868-K872 PolarHBondContact OE2-NZ 3.36Å; G869-K872 PolarHBondContact O-N 2.99Å; L870-K872 VanDerWaalsContact C-N 3.35Å; L870-K872 PolarHBondContact O-N 3.03Å; K872-G876 PolarHBondContact O-N 3.49Å
873	E	87.8	Confident	85.4	Confident	67 Å²	67	43.2 Å²	43.2	31%	0.313	23%	0.232	S	C	.	.	H	α-helix	trans	-66.3	-48.4	176.7	-173.8	173.5	-162	0	0	111.6	G869 L870 T875 G876 L877 R937 T941	G869-E873 PolarHBondContact O-N 3.11Å; L870-E873 PolarHBondContact O-N 3.48Å; E873-T875 VanDerWaalsContact C-N 3.33Å; E873-T875 PolarHBondContact O-N 3.11Å; E873-G876 PolarHBondContact O-N 3.03Å; E873-G876 VanDerWaalsContact O-N 3.13Å; E873-L877 HydrophobicContact CG-CD1 3.73Å; E873-L877 HydrophobicContact CG-CG 4.43Å; E873-L877 PolarHBondContact O-N 3.18Å; E873-R937 IonicContact OE1-CZ 2.68Å; E873-R937 VanDerWaalsContact OE1-CZ 3.3Å; E873-R937 IonicContact OE1-NE 3.61Å; E873-R937 PolarHBondContact OE1-NE 3.27Å; E873-R937 VanDerWaalsContact OE1-NE 3.15Å; E873-R937 IonicContact OE1-NH2 3.44Å; E873-R937 PolarHBondContact OE1-NH2 2.95Å; E873-T941 HydrophobicContact CB-CG2 4.42Å; E873-T941 HydrophobicContact CG-CG2 4.2Å
874	I	89.4	Confident	85.7	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61	-43	177.4	-66.4	171.8	0	0	0	110.5	F828 W858 L870 G876 L877 L878 L938 T941 I942 F945	F828-I874 HydrophobicContact CZ-CG2 4.14Å; W858-I874 HydrophobicContact CD2-CG2 3.85Å; W858-I874 VanDerWaalsContact CE2-CG2 3.48Å; W858-I874 HydrophobicContact CE3-CG2 4.35Å; W858-I874 HydrophobicContact CG-CG2 4.34Å; W858-I874 HydrophobicContact CH2-CD1 3.56Å; W858-I874 HydrophobicContact CH2-CG2 4.24Å; W858-I874 HydrophobicContact CZ2-CB 3.73Å; W858-I874 HydrophobicContact CZ2-CD1 3.5Å; W858-I874 VanDerWaalsContact CZ2-CD1 3.5Å; W858-I874 HydrophobicContact CZ2-CG1 4.17Å; W858-I874 HydrophobicContact CZ2-CG2 3.71Å; W858-I874 HydrophobicContact CZ3-CD1 4.48Å; L870-I874 HydrophobicContact CG-CD1 4.16Å; L870-I874 WeakPolarHBondContact O-CG1 3.47Å; L870-I874 PolarHBondContact O-N 2.94Å; I874-G876 VanDerWaalsContact C-N 3.32Å; I874-G876 PolarHBondContact O-N 2.63Å; I874-L877 PolarHBondContact O-N 3.05Å; I874-L878 HydrophobicContact CG2-CD1 3.86Å; I874-L878 HydrophobicContact CG2-CG 4.25Å; I874-L878 WeakPolarHBondContact O-CB 3.31Å; I874-L878 VanDerWaalsContact O-CG 3.26Å; I874-L878 WeakPolarHBondContact O-CG 3.17Å; I874-L878 PolarHBondContact O-N 3.39Å; I874-L938 HydrophobicContact CG2-CD1 4.46Å; I874-T941 HydrophobicContact CD1-CG2 4.05Å; I874-T941 HydrophobicContact CG1-CG2 3.47Å; I874-T941 VanDerWaalsContact CG1-CG2 3.47Å; I874-I942 HydrophobicContact CD1-CG1 4.14Å; I874-I942 HydrophobicContact CG1-CG1 4.36Å; I874-I942 HydrophobicContact CG2-CD1 4.47Å; I874-I942 HydrophobicContact CG2-CG1 4.12Å; I874-F945 HydrophobicContact CD1-CB 4.08Å
875	T	87.9	Confident	86	Confident	38 Å²	38	34.4 Å²	34.4	23%	0.233	18%	0.183	C	C	.	.	H	α-helix	trans	-58.8	-42	174.8	-57.7	0	0	0	0	112.1	W858 F871 E873 F879	W858-T875 VanDerWaalsContact CD1-OG1 3.28Å; W858-T875 PolarHBondContact NE1-OG1 3.04Å; F871-T875 WeakPolarHBondContact O-CB 3.43Å; F871-T875 PolarHBondContact O-N 3.23Å; F871-T875 VanDerWaalsContact O-N 3.08Å; F871-T875 PolarHBondContact O-OG1 3.27Å; E873-T875 VanDerWaalsContact C-N 3.33Å; E873-T875 PolarHBondContact O-N 3.11Å; T875-F879 PolarHBondContact O-N 2.87Å
876	G	85.7	Confident	86.1	Confident	17 Å²	17	33.7 Å²	33.7	18%	0.175	18%	0.178	C	C	.	.	H	α-helix	trans	-65.9	-44.9	176.2	0	0	0	0	0	113.2	K872 E873 I874 F879 V880	K872-G876 PolarHBondContact O-N 3.49Å; E873-G876 PolarHBondContact O-N 3.03Å; E873-G876 VanDerWaalsContact O-N 3.13Å; I874-G876 VanDerWaalsContact C-N 3.32Å; I874-G876 PolarHBondContact O-N 2.63Å; G876-F879 PolarHBondContact O-N 3.31Å; G876-V880 WeakPolarHBondContact O-CG2 3.41Å; G876-V880 PolarHBondContact O-N 3.05Å
877	L	88.6	Confident	86.4	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-63.6	-44.7	177.9	-76.1	159.5	0	0	0	111.7	E873 I874 F879 V880 Q881 F933 R937 L938 T941	E873-L877 HydrophobicContact CG-CD1 3.73Å; E873-L877 HydrophobicContact CG-CG 4.43Å; E873-L877 PolarHBondContact O-N 3.18Å; I874-L877 PolarHBondContact O-N 3.05Å; L877-F879 VanDerWaalsContact C-N 3.34Å; L877-F879 PolarHBondContact O-N 3.38Å; L877-V880 PolarHBondContact O-N 3.49Å; L877-Q881 VanDerWaalsContact O-CB 3.3Å; L877-Q881 WeakPolarHBondContact O-CB 3.24Å; L877-Q881 PolarHBondContact O-N 2.78Å; L877-F933 HydrophobicContact CD2-CB 3.96Å; L877-F933 HydrophobicContact CD2-CD1 3.67Å; L877-F933 HydrophobicContact CD2-CG 4.22Å; L877-F933 HydrophobicContact CG-CD1 4.09Å; L877-R937 HydrophobicContact CD1-CG 4.14Å; L877-R937 HydrophobicContact CD2-CB 4.24Å; L877-R937 HydrophobicContact CD2-CG 3.99Å; L877-L938 HydrophobicContact CB-CB 4.14Å; L877-L938 HydrophobicContact CB-CD1 3.71Å; L877-L938 HydrophobicContact CB-CG 4.47Å; L877-T941 HydrophobicContact CD1-CG2 4.46Å; L877-T941 WeakPolarHBondContact CD1-OG1 3.28Å
878	L	88.6	Confident	86.3	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-56.8	-45.4	174.8	-73.6	167.6	0	0	0	111.8	F828 V832 L851 A854 W858 I874 A882 L938	F828-L878 HydrophobicContact CE2-CD1 3.84Å; F828-L878 HydrophobicContact CE2-CD2 4.24Å; F828-L878 HydrophobicContact CZ-CD1 4.17Å; V832-L878 HydrophobicContact CG2-CD2 4.05Å; L851-L878 HydrophobicContact CD2-CD2 4.21Å; A854-L878 HydrophobicContact CB-CD2 4.21Å; W858-L878 HydrophobicContact CB-CD1 3.97Å; W858-L878 HydrophobicContact CG-CD1 3.94Å; I874-L878 HydrophobicContact CG2-CD1 3.86Å; I874-L878 HydrophobicContact CG2-CG 4.25Å; I874-L878 WeakPolarHBondContact O-CB 3.31Å; I874-L878 VanDerWaalsContact O-CG 3.26Å; I874-L878 WeakPolarHBondContact O-CG 3.17Å; I874-L878 PolarHBondContact O-N 3.39Å; L878-A882 VanDerWaalsContact O-CB 3.3Å; L878-A882 WeakPolarHBondContact O-CB 3.37Å; L878-A882 PolarHBondContact O-N 2.67Å; L878-L938 HydrophobicContact CD2-CD1 3.93Å; L878-L938 HydrophobicContact CD2-CD2 4.07Å; L878-L938 HydrophobicContact CG-CD1 3.9Å
879	F	86.1	Confident	86.2	Confident	5 Å²	5	27.6 Å²	27.6	2%	0.022	15%	0.145	C	C	.	.	H	α-helix	trans	-66.4	-45.7	179.9	175.8	-129.8	0	0	0	112.7	T875 G876 L877 V883 L899 F902 Y908 L912 L916	T875-F879 PolarHBondContact O-N 2.87Å; G876-F879 PolarHBondContact O-N 3.31Å; L877-F879 VanDerWaalsContact C-N 3.34Å; L877-F879 PolarHBondContact O-N 3.38Å; F879-V883 PolarHBondContact O-N 3.38Å; F879-L899 HydrophobicContact CE2-CD2 3.97Å; F879-L899 HydrophobicContact CZ-CD2 3.71Å; F879-F902 HydrophobicContact CD2-CB 3.82Å; F879-F902 AromaticContact CD2-CD1 3.85Å; F879-F902 HydrophobicContact CD2-CD1 3.85Å; F879-F902 AromaticContact CD2-CD2 3.56Å; F879-F902 HydrophobicContact CD2-CD2 3.56Å; F879-F902 HydrophobicContact CD2-CE1 4.27Å; F879-F902 AromaticContact CD2-CE2 4Å; F879-F902 HydrophobicContact CD2-CE2 4Å; F879-F902 AromaticContact CD2-CG 3.47Å; F879-F902 HydrophobicContact CD2-CG 3.47Å; F879-F902 VanDerWaalsContact CD2-CG 3.47Å; F879-F902 HydrophobicContact CD2-CZ 4.33Å; F879-F902 HydrophobicContact CE2-CB 3.52Å; F879-F902 HydrophobicContact CE2-CD1 4.44Å; F879-F902 AromaticContact CE2-CD2 3.86Å; F879-F902 HydrophobicContact CE2-CD2 3.86Å; F879-F902 AromaticContact CE2-CG 3.71Å; F879-F902 HydrophobicContact CE2-CG 3.71Å; F879-F902 HydrophobicContact CZ-CB 4.44Å; F879-Y908 HydrophobicContact CD1-CD2 4.24Å; F879-Y908 HydrophobicContact CD1-CG 4.27Å; F879-Y908 HydrophobicContact CE1-CD1 4.36Å; F879-Y908 AromaticContact CE1-CD2 3.63Å; F879-Y908 HydrophobicContact CE1-CD2 3.63Å; F879-Y908 HydrophobicContact CE1-CE1 4.35Å; F879-Y908 AromaticContact CE1-CE2 3.63Å; F879-Y908 HydrophobicContact CE1-CE2 3.63Å; F879-Y908 HydrophobicContact CE1-CG 4.03Å; F879-Y908 AromaticContact CE1-CZ 4Å; F879-Y908 HydrophobicContact CE2-CE1 4.38Å; F879-Y908 HydrophobicContact CZ-CD1 4.42Å; F879-Y908 HydrophobicContact CZ-CD2 4.17Å; F879-Y908 HydrophobicContact CZ-CE1 4.01Å; F879-Y908 AromaticContact CZ-CE2 3.74Å; F879-Y908 HydrophobicContact CZ-CE2 3.74Å; F879-Y908 HydrophobicContact CZ-CG 4.5Å; F879-Y908 AromaticContact CZ-CZ 3.65Å; F879-L912 HydrophobicContact CD1-CD2 4.17Å; F879-L916 HydrophobicContact CD1-CD1 3.97Å; F879-L916 HydrophobicContact CE1-CD1 3.52Å; F879-L916 HydrophobicContact CZ-CD1 3.9Å
880	V	86.8	Confident	85.9	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-65	-43.4	177.9	177.9	0	0	0	0	110.7	G876 L877 V883 A884 L912 L916 L930 F933	G876-V880 WeakPolarHBondContact O-CG2 3.41Å; G876-V880 PolarHBondContact O-N 3.05Å; L877-V880 PolarHBondContact O-N 3.49Å; V880-V883 PolarHBondContact O-N 3.06Å; V880-A884 WeakPolarHBondContact O-CB 3.41Å; V880-A884 PolarHBondContact O-N 2.83Å; V880-L912 HydrophobicContact CG2-CD1 4.23Å; V880-L912 HydrophobicContact CG2-CD2 3.96Å; V880-L912 HydrophobicContact CG2-CG 4.39Å; V880-L916 HydrophobicContact CG1-CD2 4.28Å; V880-L916 HydrophobicContact CG2-CD1 4.26Å; V880-L930 HydrophobicContact CG1-CD2 3.96Å; V880-F933 HydrophobicContact CB-CB 3.97Å; V880-F933 HydrophobicContact CB-CG 4.4Å; V880-F933 HydrophobicContact CG1-CB 3.67Å; V880-F933 HydrophobicContact CG1-CG 4.36Å; V880-F933 HydrophobicContact CG2-CB 4.28Å; V880-F933 HydrophobicContact CG2-CD1 4.18Å; V880-F933 HydrophobicContact CG2-CG 4.17Å
881	Q	88.9	Confident	85.7	Confident	5 Å²	5	31.6 Å²	31.6	2%	0.023	17%	0.169	C	C	.	.	H	α-helix	trans	-69.9	-34.3	-179.1	-78.1	-63.2	-46.9	0	0	113.6	L851 L877 V883 A884 V885 F933 F935 L938	L851-Q881 HydrophobicContact CD1-CB 3.84Å; L877-Q881 VanDerWaalsContact O-CB 3.3Å; L877-Q881 WeakPolarHBondContact O-CB 3.24Å; L877-Q881 PolarHBondContact O-N 2.78Å; Q881-V883 PolarHBondContact O-N 3.15Å; Q881-A884 PolarHBondContact O-N 3.27Å; Q881-V885 WeakPolarHBondContact O-CG2 3.27Å; Q881-V885 PolarHBondContact O-N 3.01Å; Q881-F933 WeakPolarHBondContact CG-O 3.5Å; Q881-F933 PolarHBondContact NE2-O 2.69Å; Q881-F935 HydrophobicContact CB-CD2 4.43Å; Q881-F935 VanDerWaalsContact CD-N 3.32Å; Q881-F935 HydrophobicContact CG-CB 4.45Å; Q881-F935 HydrophobicContact CG-CD2 4.4Å; Q881-L938 HydrophobicContact CB-CD2 4.3Å; Q881-L938 HydrophobicContact CG-CD2 4.41Å
882	A	87.1	Confident	85.3	Confident	5 Å²	5	36 Å²	36	4%	0.041	19%	0.185	C	C	.	.	H	α-helix	trans	-58.5	-30.8	171.7	0	0	0	0	0	112.6	L851 M852 L878 C886 V898 F902	L851-A882 HydrophobicContact CB-CB 3.89Å; L851-A882 HydrophobicContact CD1-CB 4.47Å; M852-A882 HydrophobicContact CG-CB 4.5Å; L878-A882 VanDerWaalsContact O-CB 3.3Å; L878-A882 WeakPolarHBondContact O-CB 3.37Å; L878-A882 PolarHBondContact O-N 2.67Å; A882-C886 PolarHBondContact O-SG 2.98Å; A882-V898 HydrophobicContact CB-CG1 3.82Å; A882-F902 HydrophobicContact CB-CE2 3.93Å; A882-F902 HydrophobicContact CB-CZ 4.46Å
883	V	86.5	Confident	84.8	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-83.9	-40.8	173.7	-178.9	0	0	0	0	111.5	F879 V880 Q881 C886 L887 A895 V898 L899 L916 V920	F879-V883 PolarHBondContact O-N 3.38Å; V880-V883 PolarHBondContact O-N 3.06Å; Q881-V883 PolarHBondContact O-N 3.15Å; V883-C886 PolarHBondContact O-N 3.32Å; V883-L887 HydrophobicContact CG1-CD1 4.21Å; V883-L887 PolarHBondContact O-N 2.98Å; V883-A895 HydrophobicContact CG1-CB 4.5Å; V883-V898 HydrophobicContact CG2-CB 4.3Å; V883-V898 HydrophobicContact CG2-CG1 3.65Å; V883-L899 HydrophobicContact CG2-CD2 3.78Å; V883-L899 HydrophobicContact CG2-CG 4.06Å; V883-L916 HydrophobicContact CG1-CD2 4.46Å; V883-V920 HydrophobicContact CG1-CG2 3.64Å
884	A	85.5	Confident	84.6	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.008	18%	0.184	C	C	.	.	H	α-helix	trans	-60.4	-53	-177.9	0	0	0	0	0	112.5	V880 Q881 C886 L887 E888 L930	V880-A884 WeakPolarHBondContact O-CB 3.41Å; V880-A884 PolarHBondContact O-N 2.83Å; Q881-A884 PolarHBondContact O-N 3.27Å; A884-C886 PolarHBondContact O-N 3.04Å; A884-L887 WeakPolarHBondContact O-CA 3.2Å; A884-L887 WeakPolarHBondContact O-CB 3.49Å; A884-L887 PolarHBondContact O-N 3.31Å; A884-E888 WeakPolarHBondContact O-CG 3.43Å; A884-E888 PolarHBondContact O-N 3.37Å; A884-L930 HydrophobicContact CB-CD2 4.25Å
885	V	85.4	Confident	84.3	Confident	2 Å²	2	32.8 Å²	32.8	1%	0.012	18%	0.184	C	C	.	.	H	α-helix	trans	-59.7	-35.8	-179	180	0	0	0	0	111.3	L838 L851 Q881 L887 E888 K889 F935	L838-V885 HydrophobicContact CD1-CG1 4.49Å; L838-V885 HydrophobicContact CD2-CB 4.46Å; L838-V885 HydrophobicContact CD2-CG1 3.73Å; L838-V885 HydrophobicContact CG-CG1 4.16Å; L851-V885 HydrophobicContact CD1-CG2 4.33Å; Q881-V885 WeakPolarHBondContact O-CG2 3.27Å; Q881-V885 PolarHBondContact O-N 3.01Å; V885-L887 VanDerWaalsContact C-N 3.34Å; V885-L887 PolarHBondContact O-N 3.45Å; V885-E888 PolarHBondContact O-N 3.49Å; V885-K889 HydrophobicContact CG1-CG 4.37Å; V885-K889 WeakPolarHBondContact O-CB 3.46Å; V885-K889 VanDerWaalsContact O-CG 3.3Å; V885-K889 WeakPolarHBondContact O-CG 3.49Å; V885-K889 PolarHBondContact O-N 3.49Å; V885-F935 HydrophobicContact CG2-CD2 4.42Å
886	C	83.6	Confident	84	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-64.8	-35.9	174.5	-66.4	0	0	0	0	112.8	M849 A882 V883 A884 G890 Q891 A895	M849-C886 WeakPolarHBondContact CE-SG 3.33Å; A882-C886 PolarHBondContact O-SG 2.98Å; V883-C886 PolarHBondContact O-N 3.32Å; A884-C886 PolarHBondContact O-N 3.04Å; C886-G890 PolarHBondContact O-N 3.27Å; C886-Q891 CarbonylContact O-C 3.59Å; C886-Q891 WeakPolarHBondContact O-CA 3.28Å; C886-Q891 PolarHBondContact O-N 3.31Å; C886-A895 HydrophobicContact CB-CB 3.67Å
887	L	83.7	Confident	83.8	Confident	11 Å²	11	35.2 Å²	35.2	6%	0.058	20%	0.2	C	C	.	.	H	α-helix	trans	-75.3	-41.2	176.6	-68.3	173.5	0	0	0	111.8	V883 A884 V885 K889 G890 A895 I919 V920 T925 L930	V883-L887 HydrophobicContact CG1-CD1 4.21Å; V883-L887 PolarHBondContact O-N 2.98Å; A884-L887 WeakPolarHBondContact O-CA 3.2Å; A884-L887 WeakPolarHBondContact O-CB 3.49Å; A884-L887 PolarHBondContact O-N 3.31Å; V885-L887 VanDerWaalsContact C-N 3.34Å; V885-L887 PolarHBondContact O-N 3.45Å; L887-K889 VanDerWaalsContact C-N 3.31Å; L887-K889 PolarHBondContact O-N 2.85Å; L887-G890 WeakPolarHBondContact O-CA 3.43Å; L887-G890 PolarHBondContact O-N 2.88Å; L887-A895 HydrophobicContact CD2-CB 3.97Å; L887-A895 HydrophobicContact CG-CB 4.13Å; L887-I919 HydrophobicContact CD1-CG2 4.02Å; L887-V920 HydrophobicContact CD1-CG2 4.08Å; L887-V920 HydrophobicContact CD2-CG2 4.23Å; L887-V920 HydrophobicContact CG-CG2 4.45Å; L887-T925 HydrophobicContact CB-CG2 4.28Å; L887-L930 HydrophobicContact CD1-CD1 4.03Å
888	E	82.3	Confident	83.6	Confident	111 Å²	111	35.2 Å²	35.2	52%	0.519	20%	0.2	S	C	.	.	H	α-helix	trans	-59.5	-38.9	174.6	-70.5	170.5	-170.3	0	0	112.3	A884 V885 G890	A884-E888 WeakPolarHBondContact O-CG 3.43Å; A884-E888 PolarHBondContact O-N 3.37Å; V885-E888 PolarHBondContact O-N 3.49Å; E888-G890 PolarHBondContact O-N 3.44Å
889	K	80.1	Confident	83.3	Confident	128 Å²	128	35.8 Å²	35.8	56%	0.557	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.7	7.9	173.7	-58.9	-63.7	-177.6	-177.7	0	113.7	L838 V885 L887 Q891	L838-K889 HydrophobicContact CD1-CB 3.83Å; L838-K889 HydrophobicContact CD1-CG 3.83Å; L838-K889 HydrophobicContact CG-CG 4.35Å; V885-K889 HydrophobicContact CG1-CG 4.37Å; V885-K889 WeakPolarHBondContact O-CB 3.46Å; V885-K889 VanDerWaalsContact O-CG 3.3Å; V885-K889 WeakPolarHBondContact O-CG 3.49Å; V885-K889 PolarHBondContact O-N 3.49Å; L887-K889 VanDerWaalsContact C-N 3.31Å; L887-K889 PolarHBondContact O-N 2.85Å; K889-Q891 HydrophobicContact CB-CG 4.36Å; K889-Q891 PolarHBondContact O-N 3.04Å
890	G	78.6	Confident	83.1	Confident	61 Å²	61	42.2 Å²	42.2	63%	0.629	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.3	3	179.7	0	0	0	0	0	115.9	C886 L887 E888 R892	C886-G890 PolarHBondContact O-N 3.27Å; L887-G890 WeakPolarHBondContact O-CA 3.43Å; L887-G890 PolarHBondContact O-N 2.88Å; E888-G890 PolarHBondContact O-N 3.44Å; G890-R892 VanDerWaalsContact C-N 3.33Å; G890-R892 PolarHBondContact O-N 2.96Å
891	Q	82	Confident	82.8	Confident	80 Å²	80	43.6 Å²	43.6	37%	0.374	24%	0.236	S	C	.	.			trans	-83.1	70.2	-173.6	-61.8	-164.9	6.2	0	0	112.7	L838 C886 K889 S893 S894 A895	L838-Q891 HydrophobicContact CD1-CG 4.41Å; C886-Q891 CarbonylContact O-C 3.59Å; C886-Q891 WeakPolarHBondContact O-CA 3.28Å; C886-Q891 PolarHBondContact O-N 3.31Å; K889-Q891 HydrophobicContact CB-CG 4.36Å; K889-Q891 PolarHBondContact O-N 3.04Å; Q891-S893 VanDerWaalsContact C-N 3.31Å; Q891-S893 PolarHBondContact O-N 3.23Å; Q891-S894 WeakPolarHBondContact O-CB 3.5Å; Q891-S894 PolarHBondContact O-N 2.94Å; Q891-S894 VanDerWaalsContact O-N 3.13Å; Q891-S894 PolarHBondContact OE1-OG 3.2Å; Q891-A895 PolarHBondContact O-N 3.19Å
892	R	79.5	Confident	82.3	Confident	110 Å²	110	43.7 Å²	43.7	42%	0.415	24%	0.236	S	C	.	.	H	α-helix	trans	-59.5	-35.6	-176.3	-164.4	-178.4	-167.2	167.8	11.9	114.5	G890 S896 V920 T921 T923	G890-R892 VanDerWaalsContact C-N 3.33Å; G890-R892 PolarHBondContact O-N 2.96Å; R892-S896 PolarHBondContact O-N 2.83Å; R892-S896 VanDerWaalsContact O-N 3.1Å; R892-V920 HydrophobicContact CG-CG1 4.41Å; R892-V920 PolarHBondContact NE-O 3.21Å; R892-V920 PolarHBondContact NH2-O 3.24Å; R892-T921 PolarHBondContact NH2-O 3.03Å; R892-T923 HydrophobicContact CG-CG2 4.22Å
893	S	77.9	Confident	81.7	Confident	89 Å²	89	50.1 Å²	50.1	62%	0.622	27%	0.265	S	S	*	.	H	α-helix	trans	-67.3	-41.4	175.8	44.8	0	0	0	0	111.7	Q891 S896 S897	Q891-S893 VanDerWaalsContact C-N 3.31Å; Q891-S893 PolarHBondContact O-N 3.23Å; S893-S896 PolarHBondContact O-N 2.87Å; S893-S897 WeakPolarHBondContact O-CB 3.21Å; S893-S897 PolarHBondContact O-N 3.24Å; S893-S897 VanDerWaalsContact O-N 3.07Å; S893-S897 PolarHBondContact O-OG 3.41Å
894	S	81.6	Confident	81	Confident	25 Å²	25	59 Å²	59	18%	0.175	30%	0.304	C	S	.	.	H	α-helix	trans	-60.9	-49.8	172.5	-50.4	0	0	0	0	110.3	Q891 S896 S897 V898	Q891-S894 WeakPolarHBondContact O-CB 3.5Å; Q891-S894 PolarHBondContact O-N 2.94Å; Q891-S894 VanDerWaalsContact O-N 3.13Å; Q891-S894 PolarHBondContact OE1-OG 3.2Å; S894-S896 VanDerWaalsContact C-N 3.33Å; S894-S896 PolarHBondContact O-N 3.31Å; S894-S897 CarbonylContact O-C 3.53Å; S894-S897 WeakPolarHBondContact O-CA 3.42Å; S894-S897 WeakPolarHBondContact O-CB 3.39Å; S894-S897 PolarHBondContact O-N 3.21Å; S894-V898 WeakPolarHBondContact O-CG2 3.39Å; S894-V898 PolarHBondContact O-N 2.9Å
895	A	83.3	Confident	80.1	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-57	-40.3	178.3	0	0	0	0	0	113.6	V883 C886 L887 Q891 S897 L899 V920	V883-A895 HydrophobicContact CG1-CB 4.5Å; C886-A895 HydrophobicContact CB-CB 3.67Å; L887-A895 HydrophobicContact CD2-CB 3.97Å; L887-A895 HydrophobicContact CG-CB 4.13Å; Q891-A895 PolarHBondContact O-N 3.19Å; A895-S897 VanDerWaalsContact C-N 3.33Å; A895-L899 PolarHBondContact O-N 3.36Å; A895-V920 HydrophobicContact CB-CG1 4.17Å; A895-V920 HydrophobicContact CB-CG2 4.01Å
896	S	81.7	Confident	79	Confident	44 Å²	44	67.5 Å²	67.5	31%	0.308	34%	0.337	S	S	.	.	H	α-helix	trans	-70.3	-30.4	174.7	-172.3	0	0	0	0	112.7	R892 S893 S894 K900	R892-S896 PolarHBondContact O-N 2.83Å; R892-S896 VanDerWaalsContact O-N 3.1Å; S893-S896 PolarHBondContact O-N 2.87Å; S894-S896 VanDerWaalsContact C-N 3.33Å; S894-S896 PolarHBondContact O-N 3.31Å; S896-K900 WeakPolarHBondContact O-CG 3.41Å; S896-K900 PolarHBondContact O-N 3.39Å
897	S	82.2	Confident	77.6	Confident	61 Å²	61	75 Å²	75	43%	0.427	38%	0.384	S	S	.	.	H	α-helix	trans	-72.5	-38.8	176.4	-56.1	0	0	0	0	111.9	S893 S894 A895 K900 W901	S893-S897 WeakPolarHBondContact O-CB 3.21Å; S893-S897 PolarHBondContact O-N 3.24Å; S893-S897 VanDerWaalsContact O-N 3.07Å; S893-S897 PolarHBondContact O-OG 3.41Å; S894-S897 CarbonylContact O-C 3.53Å; S894-S897 WeakPolarHBondContact O-CA 3.42Å; S894-S897 WeakPolarHBondContact O-CB 3.39Å; S894-S897 PolarHBondContact O-N 3.21Å; A895-S897 VanDerWaalsContact C-N 3.33Å; S897-K900 PolarHBondContact O-N 3Å; S897-W901 VanDerWaalsContact O-CB 3.25Å; S897-W901 WeakPolarHBondContact O-CB 3.14Å; S897-W901 PolarHBondContact O-N 2.66Å
898	V	83.6	Confident	76.6	Confident	0 Å²	0	76.6 Å²	76.6	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-54	-53.4	171.4	174.3	0	0	0	0	110.5	M849 M852 A882 V883 S894 K900 W901 F902	M849-V898 HydrophobicContact CE-CG2 3.28Å; M852-V898 HydrophobicContact CG-CG2 4.42Å; M852-V898 HydrophobicContact SD-CG2 3.83Å; A882-V898 HydrophobicContact CB-CG1 3.82Å; V883-V898 HydrophobicContact CG2-CB 4.3Å; V883-V898 HydrophobicContact CG2-CG1 3.65Å; S894-V898 WeakPolarHBondContact O-CG2 3.39Å; S894-V898 PolarHBondContact O-N 2.9Å; V898-K900 PolarHBondContact O-N 3.46Å; V898-W901 PolarHBondContact O-N 2.88Å; V898-W901 VanDerWaalsContact O-N 3.17Å; V898-F902 HydrophobicContact CG1-CD2 3.66Å; V898-F902 HydrophobicContact CG1-CE2 3.8Å; V898-F902 WeakPolarHBondContact O-CD2 3.33Å; V898-F902 PolarHBondContact O-N 3.41Å
899	L	82.7	Confident	75.7	Confident	13 Å²	13	75.6 Å²	75.6	7%	0.068	39%	0.392	C	S	.	.	H	α-helix	trans	-55.9	-50.8	-179.1	-72.1	173.5	0	0	0	112	F879 V883 A895 W901 F902 E903 L916 V920	F879-L899 HydrophobicContact CE2-CD2 3.97Å; F879-L899 HydrophobicContact CZ-CD2 3.71Å; V883-L899 HydrophobicContact CG2-CD2 3.78Å; V883-L899 HydrophobicContact CG2-CG 4.06Å; A895-L899 PolarHBondContact O-N 3.36Å; L899-W901 VanDerWaalsContact C-N 3.3Å; L899-W901 PolarHBondContact O-N 2.86Å; L899-F902 PolarHBondContact O-N 3.1Å; L899-E903 VanDerWaalsContact O-CB 3.26Å; L899-E903 WeakPolarHBondContact O-CB 3.31Å; L899-E903 PolarHBondContact O-N 2.89Å; L899-L916 HydrophobicContact CD2-CB 3.78Å; L899-L916 HydrophobicContact CD2-CD1 4.33Å; L899-V920 HydrophobicContact CD1-CB 4.29Å; L899-V920 HydrophobicContact CD1-CG2 3.85Å
900	K	81.3	Confident	74.9	Confident	140 Å²	140	79.7 Å²	79.7	61%	0.609	40%	0.404	S	S	*	.	H	α-helix	trans	-65.3	-30.5	179.4	-69.4	174.8	179.4	176.7	0	113.5	S896 S897 V898 K904	S896-K900 WeakPolarHBondContact O-CG 3.41Å; S896-K900 PolarHBondContact O-N 3.39Å; S897-K900 PolarHBondContact O-N 3Å; V898-K900 PolarHBondContact O-N 3.46Å; K900-K904 WeakPolarHBondContact O-CB 3.46Å; K900-K904 PolarHBondContact O-N 3.34Å
901	W	80.8	Confident	74.6	Confident	30 Å²	30	82.7 Å²	82.7	11%	0.114	41%	0.406	C	S	.	.	H	α-helix	trans	-72.8	-44.2	178	-179	106.2	0	0	0	111.2	V848 M852 V856 S897 V898 L899 K904 R905	V848-W901 HydrophobicContact CG1-CZ2 3.96Å; V848-W901 HydrophobicContact CG2-CZ2 4.42Å; M852-W901 HydrophobicContact CB-CE3 4.39Å; M852-W901 HydrophobicContact CB-CH2 3.92Å; M852-W901 HydrophobicContact CB-CZ2 4.18Å; M852-W901 HydrophobicContact CB-CZ3 4.04Å; M852-W901 HydrophobicContact CE-CB 3.73Å; M852-W901 HydrophobicContact CE-CD2 3.34Å; M852-W901 HydrophobicContact CE-CE3 3.81Å; M852-W901 HydrophobicContact CE-CG 3.32Å; M852-W901 HydrophobicContact CE-CZ2 4.36Å; M852-W901 VanDerWaalsContact O-CH2 3.28Å; M852-W901 WeakPolarHBondContact O-CH2 3.41Å; V856-W901 HydrophobicContact CG2-CH2 3.64Å; V856-W901 HydrophobicContact CG2-CZ2 4.09Å; S897-W901 VanDerWaalsContact O-CB 3.25Å; S897-W901 WeakPolarHBondContact O-CB 3.14Å; S897-W901 PolarHBondContact O-N 2.66Å; V898-W901 PolarHBondContact O-N 2.88Å; V898-W901 VanDerWaalsContact O-N 3.17Å; L899-W901 VanDerWaalsContact C-N 3.3Å; L899-W901 PolarHBondContact O-N 2.86Å; W901-K904 PolarHBondContact O-N 3.3Å; W901-R905 PolarHBondContact O-N 2.86Å
902	F	78.2	Confident	74.2	Confident	6 Å²	6	80.1 Å²	80.1	3%	0.026	40%	0.395	C	S	.	.	H	α-helix	trans	-68.1	-43.3	176.4	-88.6	-80	0	0	0	111.5	M852 A855 F879 A882 V898 L899 K904 R905 H906 Y908	M852-F902 HydrophobicContact CB-CE2 4.45Å; M852-F902 HydrophobicContact CG-CE2 3.98Å; A855-F902 HydrophobicContact CB-CE1 3.61Å; A855-F902 HydrophobicContact CB-CZ 3.74Å; F879-F902 HydrophobicContact CD2-CB 3.82Å; F879-F902 AromaticContact CD2-CD1 3.85Å; F879-F902 HydrophobicContact CD2-CD1 3.85Å; F879-F902 AromaticContact CD2-CD2 3.56Å; F879-F902 HydrophobicContact CD2-CD2 3.56Å; F879-F902 HydrophobicContact CD2-CE1 4.27Å; F879-F902 AromaticContact CD2-CE2 4Å; F879-F902 HydrophobicContact CD2-CE2 4Å; F879-F902 AromaticContact CD2-CG 3.47Å; F879-F902 HydrophobicContact CD2-CG 3.47Å; F879-F902 VanDerWaalsContact CD2-CG 3.47Å; F879-F902 HydrophobicContact CD2-CZ 4.33Å; F879-F902 HydrophobicContact CE2-CB 3.52Å; F879-F902 HydrophobicContact CE2-CD1 4.44Å; F879-F902 AromaticContact CE2-CD2 3.86Å; F879-F902 HydrophobicContact CE2-CD2 3.86Å; F879-F902 AromaticContact CE2-CG 3.71Å; F879-F902 HydrophobicContact CE2-CG 3.71Å; F879-F902 HydrophobicContact CZ-CB 4.44Å; A882-F902 HydrophobicContact CB-CE2 3.93Å; A882-F902 HydrophobicContact CB-CZ 4.46Å; V898-F902 HydrophobicContact CG1-CD2 3.66Å; V898-F902 HydrophobicContact CG1-CE2 3.8Å; V898-F902 WeakPolarHBondContact O-CD2 3.33Å; V898-F902 PolarHBondContact O-N 3.41Å; L899-F902 PolarHBondContact O-N 3.1Å; F902-K904 PolarHBondContact O-N 2.72Å; F902-K904 VanDerWaalsContact O-N 3.08Å; F902-R905 PolarHBondContact O-N 3.21Å; F902-H906 HydrophobicContact CD1-CB 4.5Å; F902-H906 AromaticContact CD1-CD2 3.71Å; F902-H906 PolarHBondContact O-N 3.33Å; F902-Y908 HydrophobicContact CB-CE1 3.97Å
903	E	75.4	Confident	74	Confident	140 Å²	140	75.4 Å²	75.4	65%	0.654	38%	0.38	S	S	*	.	H	α-helix	trans	-56.2	-25.6	176.9	-172.1	167.5	-137.4	0	0	112.8	L899 Y908	L899-E903 VanDerWaalsContact O-CB 3.26Å; L899-E903 WeakPolarHBondContact O-CB 3.31Å; L899-E903 PolarHBondContact O-N 2.89Å; E903-Y908 WeakPolarHBondContact CA-OH 3.47Å; E903-Y908 WeakPolarHBondContact CB-OH 3.35Å
904	K	72.5	Confident	74	Confident	187 Å²	187	76.4 Å²	76.4	81%	0.813	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-10.7	177.1	-172.1	168.7	179.7	178.2	0	114.4	K900 W901 F902	K900-K904 WeakPolarHBondContact O-CB 3.46Å; K900-K904 PolarHBondContact O-N 3.34Å; W901-K904 PolarHBondContact O-N 3.3Å; F902-K904 PolarHBondContact O-N 2.72Å; F902-K904 VanDerWaalsContact O-N 3.08Å
905	R	66.5	Low	73.9	Confident	145 Å²	145	80.8 Å²	80.8	55%	0.547	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.5	-27.3	-168.8	-73.7	-173.6	173.2	-166.2	-1.9	116.5	W901 F902	W901-R905 PolarHBondContact O-N 2.86Å; F902-R905 PolarHBondContact O-N 3.21Å
906	H	61.6	Low	73.7	Confident	37 Å²	37	80.8 Å²	80.8	17%	0.171	39%	0.393	C	S	.	.			trans	-134.7	140.7	-175.2	-60.3	-94.5	0	0	0	112.3	S859 F902 Y908	S859-H906 PolarHBondContact OG-CE1 3.21Å; S859-H906 VanDerWaalsContact OG-CE1 3.31Å; S859-H906 PolarHBondContact OG-ND1 3.46Å; F902-H906 HydrophobicContact CD1-CB 4.5Å; F902-H906 AromaticContact CD1-CD2 3.71Å; F902-H906 PolarHBondContact O-N 3.33Å; H906-Y908 VanDerWaalsContact O-CD1 3.24Å; H906-Y908 WeakPolarHBondContact O-CD1 3.45Å; H906-Y908 PolarHBondContact O-N 2.71Å; H906-Y908 VanDerWaalsContact O-N 3.15Å
907	T	53.5	Low	73.6	Confident	158 Å²	158	81.5 Å²	81.5	97%	0.969	40%	0.398	S	S	*	.			trans	-84.9	78.8	178.3	47.3	0	0	0	0	112
908	Y	63.2	Low	73.5	Confident	43 Å²	43	81.5 Å²	81.5	17%	0.169	40%	0.396	C	S	.	.			trans	-96.5	160.9	174.9	62.9	-95.6	0	0	0	112.1	F879 F902 E903 H906 R910	F879-Y908 HydrophobicContact CD1-CD2 4.24Å; F879-Y908 HydrophobicContact CD1-CG 4.27Å; F879-Y908 HydrophobicContact CE1-CD1 4.36Å; F879-Y908 AromaticContact CE1-CD2 3.63Å; F879-Y908 HydrophobicContact CE1-CD2 3.63Å; F879-Y908 HydrophobicContact CE1-CE1 4.35Å; F879-Y908 AromaticContact CE1-CE2 3.63Å; F879-Y908 HydrophobicContact CE1-CE2 3.63Å; F879-Y908 HydrophobicContact CE1-CG 4.03Å; F879-Y908 AromaticContact CE1-CZ 4Å; F879-Y908 HydrophobicContact CE2-CE1 4.38Å; F879-Y908 HydrophobicContact CZ-CD1 4.42Å; F879-Y908 HydrophobicContact CZ-CD2 4.17Å; F879-Y908 HydrophobicContact CZ-CE1 4.01Å; F879-Y908 AromaticContact CZ-CE2 3.74Å; F879-Y908 HydrophobicContact CZ-CE2 3.74Å; F879-Y908 HydrophobicContact CZ-CG 4.5Å; F879-Y908 AromaticContact CZ-CZ 3.65Å; F902-Y908 HydrophobicContact CB-CE1 3.97Å; E903-Y908 WeakPolarHBondContact CA-OH 3.47Å; E903-Y908 WeakPolarHBondContact CB-OH 3.35Å; H906-Y908 VanDerWaalsContact O-CD1 3.24Å; H906-Y908 WeakPolarHBondContact O-CD1 3.45Å; H906-Y908 PolarHBondContact O-N 2.71Å; H906-Y908 VanDerWaalsContact O-N 3.15Å; Y908-R910 PolarHBondContact O-N 3.38Å; Y908-R910 VanDerWaalsContact O-N 3.1Å
909	P	64.6	Low	73.3	Confident	91 Å²	91	81.7 Å²	81.7	59%	0.591	40%	0.396	S	S	*	.			trans	-61.5	114.6	178.9	22.4	-34.2	0	0	0	112.3	N911 L912	P909-N911 PolarHBondContact O-N 3.31Å; P909-L912 HydrophobicContact CG-CB 4.37Å; P909-L912 WeakPolarHBondContact O-CB 3.45Å; P909-L912 PolarHBondContact O-N 3.05Å
910	R	62.8	Low	73.3	Confident	213 Å²	213	81.4 Å²	81.4	80%	0.804	40%	0.395	S	S	*	.	H	α-helix	trans	-47.8	-36.9	-178.4	-67.7	178.8	176.9	160.5	-0.3	113.7	Y908 L912 G913 I914	Y908-R910 PolarHBondContact O-N 3.38Å; Y908-R910 VanDerWaalsContact O-N 3.1Å; R910-L912 PolarHBondContact O-N 2.95Å; R910-G913 PolarHBondContact O-N 3.3Å; R910-G913 VanDerWaalsContact O-N 3.16Å; R910-I914 WeakPolarHBondContact O-CG1 3.3Å; R910-I914 PolarHBondContact O-N 3.13Å
911	N	71.3	Confident	73.2	Confident	124 Å²	124	79.2 Å²	79.2	66%	0.663	39%	0.394	S	S	*	.	H	α-helix	trans	-58.5	-28.3	178.4	-62.5	-10.2	0	0	0	113.7	P909 K915	P909-N911 PolarHBondContact O-N 3.31Å; N911-K915 WeakPolarHBondContact O-CG 3.34Å
912	L	74.1	Confident	73	Confident	27 Å²	27	85 Å²	85	14%	0.141	42%	0.42	C	S	.	.	H	α-helix	trans	-80	-43	176.4	-173.3	61.5	0	0	0	111.1	F879 V880 P909 R910 I914 K915 L916 V929	F879-L912 HydrophobicContact CD1-CD2 4.17Å; V880-L912 HydrophobicContact CG2-CD1 4.23Å; V880-L912 HydrophobicContact CG2-CD2 3.96Å; V880-L912 HydrophobicContact CG2-CG 4.39Å; P909-L912 HydrophobicContact CG-CB 4.37Å; P909-L912 WeakPolarHBondContact O-CB 3.45Å; P909-L912 PolarHBondContact O-N 3.05Å; R910-L912 PolarHBondContact O-N 2.95Å; L912-I914 PolarHBondContact O-N 3.19Å; L912-K915 PolarHBondContact O-N 3.06Å; L912-L916 HydrophobicContact CG-CD1 4.12Å; L912-L916 WeakPolarHBondContact O-CG 3.38Å; L912-L916 PolarHBondContact O-N 2.77Å; L912-V929 HydrophobicContact CD1-CG1 4.11Å
913	G	75.5	Confident	72.5	Confident	10 Å²	10	88.1 Å²	88.1	10%	0.103	44%	0.44	C	S	.	.	H	α-helix	trans	-61	-42.1	176.4	0	0	0	0	0	113.4	R910 K915 L916 S917	R910-G913 PolarHBondContact O-N 3.3Å; R910-G913 VanDerWaalsContact O-N 3.16Å; G913-K915 VanDerWaalsContact C-N 3.32Å; G913-K915 PolarHBondContact O-N 2.98Å; G913-L916 PolarHBondContact O-N 3.48Å; G913-S917 WeakPolarHBondContact O-CB 3.26Å; G913-S917 PolarHBondContact O-N 3.35Å
914	I	77.1	Confident	72.3	Confident	110 Å²	110	84.3 Å²	84.3	56%	0.564	42%	0.424	S	S	*	.	H	α-helix	trans	-62.3	-40.7	176.1	-64.6	165	0	0	0	110.9	R910 L912 T918	R910-I914 WeakPolarHBondContact O-CG1 3.3Å; R910-I914 PolarHBondContact O-N 3.13Å; L912-I914 PolarHBondContact O-N 3.19Å; I914-T918 PolarHBondContact O-N 3.48Å; I914-T918 PolarHBondContact O-OG1 2.9Å
915	K	79.3	Confident	71.8	Confident	117 Å²	117	77.6 Å²	77.6	51%	0.509	40%	0.398	S	S	.	.	H	α-helix	trans	-64.7	-49.2	174.9	-74.2	176.7	179.7	-176.9	0	111.5	N911 L912 G913 S917 T918 I919	N911-K915 WeakPolarHBondContact O-CG 3.34Å; L912-K915 PolarHBondContact O-N 3.06Å; G913-K915 VanDerWaalsContact C-N 3.32Å; G913-K915 PolarHBondContact O-N 2.98Å; K915-S917 VanDerWaalsContact C-N 3.35Å; K915-S917 PolarHBondContact O-N 2.86Å; K915-T918 CarbonylContact O-C 3.57Å; K915-T918 WeakPolarHBondContact O-CA 3.43Å; K915-T918 WeakPolarHBondContact O-CB 3.4Å; K915-T918 PolarHBondContact O-N 2.91Å; K915-T918 VanDerWaalsContact O-N 3.1Å; K915-I919 VanDerWaalsContact O-CG1 3.26Å; K915-I919 WeakPolarHBondContact O-CG1 3.36Å; K915-I919 PolarHBondContact O-N 3.3Å
916	L	79.6	Confident	71.8	Confident	0 Å²	0	79.2 Å²	79.2	0%	0	41%	0.406	C	S	.	.	H	α-helix	trans	-62.5	-38.9	178.2	-68	167.7	0	0	0	112.5	F879 V880 V883 L899 L912 G913 T918 I919 V920 L930	F879-L916 HydrophobicContact CD1-CD1 3.97Å; F879-L916 HydrophobicContact CE1-CD1 3.52Å; F879-L916 HydrophobicContact CZ-CD1 3.9Å; V880-L916 HydrophobicContact CG1-CD2 4.28Å; V880-L916 HydrophobicContact CG2-CD1 4.26Å; V883-L916 HydrophobicContact CG1-CD2 4.46Å; L899-L916 HydrophobicContact CD2-CB 3.78Å; L899-L916 HydrophobicContact CD2-CD1 4.33Å; L912-L916 HydrophobicContact CG-CD1 4.12Å; L912-L916 WeakPolarHBondContact O-CG 3.38Å; L912-L916 PolarHBondContact O-N 2.77Å; G913-L916 PolarHBondContact O-N 3.48Å; L916-T918 VanDerWaalsContact C-N 3.33Å; L916-T918 PolarHBondContact O-N 3.4Å; L916-I919 HydrophobicContact CD2-CD1 4.3Å; L916-I919 PolarHBondContact O-N 3.39Å; L916-I919 VanDerWaalsContact O-N 3.12Å; L916-V920 WeakPolarHBondContact O-CG2 3.27Å; L916-V920 PolarHBondContact O-N 3.42Å; L916-L930 HydrophobicContact CD2-CD2 3.78Å
917	S	80.6	Confident	72.5	Confident	60 Å²	60	80.1 Å²	80.1	42%	0.42	41%	0.41	S	S	.	.	H	α-helix	trans	-61.1	-40.6	172	-172.2	0	0	0	0	112	G913 K915 I919 V920 T921	G913-S917 WeakPolarHBondContact O-CB 3.26Å; G913-S917 PolarHBondContact O-N 3.35Å; K915-S917 VanDerWaalsContact C-N 3.35Å; K915-S917 PolarHBondContact O-N 2.86Å; S917-I919 VanDerWaalsContact C-N 3.31Å; S917-I919 PolarHBondContact O-N 2.87Å; S917-V920 PolarHBondContact O-N 3.08Å; S917-T921 WeakPolarHBondContact O-CB 3.3Å; S917-T921 WeakPolarHBondContact O-CG2 3.44Å; S917-T921 PolarHBondContact O-N 2.89Å; S917-T921 PolarHBondContact O-OG1 2.74Å
918	T	79.7	Confident	73.4	Confident	61 Å²	61	77 Å²	77	37%	0.374	39%	0.393	S	S	.	.	H	α-helix	trans	-63.7	-34.9	173.1	-52.6	0	0	0	0	112.2	I914 K915 L916 T921 K922	I914-T918 PolarHBondContact O-N 3.48Å; I914-T918 PolarHBondContact O-OG1 2.9Å; K915-T918 CarbonylContact O-C 3.57Å; K915-T918 WeakPolarHBondContact O-CA 3.43Å; K915-T918 WeakPolarHBondContact O-CB 3.4Å; K915-T918 PolarHBondContact O-N 2.91Å; K915-T918 VanDerWaalsContact O-N 3.1Å; L916-T918 VanDerWaalsContact C-N 3.33Å; L916-T918 PolarHBondContact O-N 3.4Å; T918-T921 VanDerWaalsContact CA-OG1 3.31Å; T918-T921 WeakPolarHBondContact CA-OG1 3.44Å; T918-T921 PolarHBondContact O-OG1 3.42Å; T918-T921 VanDerWaalsContact O-OG1 3.1Å; T918-K922 HydrophobicContact CG2-CD 4.27Å; T918-K922 WeakPolarHBondContact O-CB 3.46Å; T918-K922 WeakPolarHBondContact O-CG 3.34Å; T918-K922 PolarHBondContact O-N 2.82Å; T918-K922 VanDerWaalsContact O-N 3.11Å
919	I	80.3	Confident	73.9	Confident	3 Å²	3	76.1 Å²	76.1	2%	0.015	39%	0.391	C	S	.	.	H	α-helix	trans	-72.8	-46.5	178	-64.8	160.6	0	0	0	110.7	L887 K915 L916 S917 T921 K922 T923 D924 H927 V929 L930	L887-I919 HydrophobicContact CD1-CG2 4.02Å; K915-I919 VanDerWaalsContact O-CG1 3.26Å; K915-I919 WeakPolarHBondContact O-CG1 3.36Å; K915-I919 PolarHBondContact O-N 3.3Å; L916-I919 HydrophobicContact CD2-CD1 4.3Å; L916-I919 PolarHBondContact O-N 3.39Å; L916-I919 VanDerWaalsContact O-N 3.12Å; S917-I919 VanDerWaalsContact C-N 3.31Å; S917-I919 PolarHBondContact O-N 2.87Å; I919-T921 VanDerWaalsContact C-N 3.29Å; I919-T921 PolarHBondContact O-N 3.13Å; I919-K922 CarbonylContact O-C 3.6Å; I919-K922 PolarHBondContact O-N 2.98Å; I919-T923 PolarHBondContact O-N 3.47Å; I919-D924 HydrophobicContact CG2-CB 4.49Å; I919-D924 VanDerWaalsContact CG2-O 3.25Å; I919-D924 WeakPolarHBondContact CG2-O 3.48Å; I919-H927 HydrophobicContact CD1-CB 4.1Å; I919-H927 WeakPolarHBondContact CD1-ND1 3.37Å; I919-H927 HydrophobicContact CG1-CB 4.05Å; I919-H927 HydrophobicContact CG2-CB 4.18Å; I919-V929 HydrophobicContact CD1-CB 4.21Å; I919-L930 HydrophobicContact CG2-CD1 3.94Å; I919-L930 HydrophobicContact CG2-CG 4.37Å
920	V	81.9	Confident	74.4	Confident	7 Å²	7	72 Å²	72	4%	0.042	36%	0.364	C	S	.	.	H	α-helix	trans	-63.1	-33.5	175.9	175	0	0	0	0	111.8	V883 L887 R892 A895 L899 L916 S917	V883-V920 HydrophobicContact CG1-CG2 3.64Å; L887-V920 HydrophobicContact CD1-CG2 4.08Å; L887-V920 HydrophobicContact CD2-CG2 4.23Å; L887-V920 HydrophobicContact CG-CG2 4.45Å; R892-V920 HydrophobicContact CG-CG1 4.41Å; R892-V920 PolarHBondContact NE-O 3.21Å; R892-V920 PolarHBondContact NH2-O 3.24Å; A895-V920 HydrophobicContact CB-CG1 4.17Å; A895-V920 HydrophobicContact CB-CG2 4.01Å; L899-V920 HydrophobicContact CD1-CB 4.29Å; L899-V920 HydrophobicContact CD1-CG2 3.85Å; L916-V920 WeakPolarHBondContact O-CG2 3.27Å; L916-V920 PolarHBondContact O-N 3.42Å; S917-V920 PolarHBondContact O-N 3.08Å
921	T	78.8	Confident	74.8	Confident	95 Å²	95	66.5 Å²	66.5	58%	0.583	35%	0.349	S	S	*	.	H	α-helix	trans	-78	-16.3	173.8	50.4	0	0	0	0	114	R892 S917 T918 I919	R892-T921 PolarHBondContact NH2-O 3.03Å; S917-T921 WeakPolarHBondContact O-CB 3.3Å; S917-T921 WeakPolarHBondContact O-CG2 3.44Å; S917-T921 PolarHBondContact O-N 2.89Å; S917-T921 PolarHBondContact O-OG1 2.74Å; T918-T921 VanDerWaalsContact CA-OG1 3.31Å; T918-T921 WeakPolarHBondContact CA-OG1 3.44Å; T918-T921 PolarHBondContact O-OG1 3.42Å; T918-T921 VanDerWaalsContact O-OG1 3.1Å; I919-T921 VanDerWaalsContact C-N 3.29Å; I919-T921 PolarHBondContact O-N 3.13Å
922	K	76.7	Confident	74.7	Confident	150 Å²	150	63.3 Å²	63.3	65%	0.652	34%	0.337	S	S	*	.	H	α-helix	trans	-100.8	-12.2	171.7	-71.1	-179.1	179	-174.2	0	115.3	T918 I919 D924	T918-K922 HydrophobicContact CG2-CD 4.27Å; T918-K922 WeakPolarHBondContact O-CB 3.46Å; T918-K922 WeakPolarHBondContact O-CG 3.34Å; T918-K922 PolarHBondContact O-N 2.82Å; T918-K922 VanDerWaalsContact O-N 3.11Å; I919-K922 CarbonylContact O-C 3.6Å; I919-K922 PolarHBondContact O-N 2.98Å; K922-D924 HydrophobicContact CB-CB 4.48Å; K922-D924 PolarHBondContact O-N 3.39Å
923	T	66.9	Low	74.7	Confident	73 Å²	73	64.7 Å²	64.7	45%	0.448	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	33.8	-175.2	25.8	0	0	0	0	113.4	R892 I919 T925	R892-T923 HydrophobicContact CG-CG2 4.22Å; I919-T923 PolarHBondContact O-N 3.47Å; T923-T925 PolarHBondContact O-N 3.39Å
924	D	71.7	Confident	75	Confident	60 Å²	60	66.2 Å²	66.2	32%	0.321	35%	0.351	S	S	.	.			trans	-87.3	94	179.7	-176.7	0.8	0	0	0	110.8	I919 K922 Y926 H927	I919-D924 HydrophobicContact CG2-CB 4.49Å; I919-D924 VanDerWaalsContact CG2-O 3.25Å; I919-D924 WeakPolarHBondContact CG2-O 3.48Å; K922-D924 HydrophobicContact CB-CB 4.48Å; K922-D924 PolarHBondContact O-N 3.39Å; D924-Y926 VanDerWaalsContact C-N 3.26Å; D924-Y926 PolarHBondContact O-N 3.24Å; D924-Y926 PolarHBondContact OD1-N 3.16Å; D924-Y926 VanDerWaalsContact OD1-N 3.14Å; D924-H927 HydrophobicContact CB-CB 4.23Å; D924-H927 PolarHBondContact OD1-N 3.31Å; D924-H927 WeakPolarHBondContact OD2-CB 3.47Å; D924-H927 IonicContact OD2-CD2 2.78Å; D924-H927 PolarHBondContact OD2-CD2 3.35Å; D924-H927 IonicContact OD2-CG 2.77Å
925	T	62.3	Low	75.3	Confident	45 Å²	45	61.9 Å²	61.9	28%	0.276	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-19.7	178.3	47.8	0	0	0	0	113.5	L887 T923 M931	L887-T925 HydrophobicContact CB-CG2 4.28Å; T923-T925 PolarHBondContact O-N 3.39Å; T925-M931 WeakPolarHBondContact O-CE 3.45Å
926	Y	66.4	Low	75.5	Confident	179 Å²	179	59.8 Å²	59.8	70%	0.702	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107	9.3	-175.1	-62.1	-75.9	0	0	0	112.9	D924 M931	D924-Y926 VanDerWaalsContact C-N 3.26Å; D924-Y926 PolarHBondContact O-N 3.24Å; D924-Y926 PolarHBondContact OD1-N 3.16Å; D924-Y926 VanDerWaalsContact OD1-N 3.14Å; Y926-M931 HydrophobicContact CD1-SD 4.37Å
927	H	76.4	Confident	75.8	Confident	56 Å²	56	64.1 Å²	64.1	26%	0.259	34%	0.335	S	S	.	.			trans	-54.3	133.1	-179.3	-169.2	-96.2	0	0	0	111.2	I919 D924 V929 L930 M931	I919-H927 HydrophobicContact CD1-CB 4.1Å; I919-H927 WeakPolarHBondContact CD1-ND1 3.37Å; I919-H927 HydrophobicContact CG1-CB 4.05Å; I919-H927 HydrophobicContact CG2-CB 4.18Å; D924-H927 HydrophobicContact CB-CB 4.23Å; D924-H927 PolarHBondContact OD1-N 3.31Å; D924-H927 WeakPolarHBondContact OD2-CB 3.47Å; D924-H927 IonicContact OD2-CD2 2.78Å; D924-H927 PolarHBondContact OD2-CD2 3.35Å; D924-H927 IonicContact OD2-CG 2.77Å; H927-V929 PolarHBondContact ND1-N 3Å; H927-V929 PolarHBondContact O-N 3.23Å; H927-L930 PolarHBondContact O-N 3.31Å; H927-M931 PolarHBondContact O-N 3.01Å
928	P	72.9	Confident	76.2	Confident	94 Å²	94	61.2 Å²	61.2	61%	0.61	32%	0.315	S	S	*	.	H	α-helix	trans	-55	-24.9	-172.3	-30.7	36	0	0	0	115.8	S932	P928-S932 WeakPolarHBondContact O-CB 3.3Å; P928-S932 PolarHBondContact O-N 3.32Å; P928-S932 PolarHBondContact O-OG 2.72Å
929	V	73.1	Confident	76.6	Confident	23 Å²	23	58.4 Å²	58.4	14%	0.139	30%	0.298	C	S	.	.	H	α-helix	trans	-69.6	-34.6	175	177.2	0	0	0	0	112.6	L912 I919 H927 S932 F933	L912-V929 HydrophobicContact CD1-CG1 4.11Å; I919-V929 HydrophobicContact CD1-CB 4.21Å; H927-V929 PolarHBondContact ND1-N 3Å; H927-V929 PolarHBondContact O-N 3.23Å; V929-S932 PolarHBondContact O-OG 3.07Å; V929-F933 WeakPolarHBondContact O-CD2 3.38Å
930	L	75.3	Confident	77	Confident	5 Å²	5	62.6 Å²	62.6	3%	0.026	32%	0.317	C	S	.	.	H	α-helix	trans	-73.2	-43.7	175.3	-58.8	-175.3	0	0	0	110.1	V880 A884 L887 L916 I919 H927 S932 F933	V880-L930 HydrophobicContact CG1-CD2 3.96Å; A884-L930 HydrophobicContact CB-CD2 4.25Å; L887-L930 HydrophobicContact CD1-CD1 4.03Å; L916-L930 HydrophobicContact CD2-CD2 3.78Å; I919-L930 HydrophobicContact CG2-CD1 3.94Å; I919-L930 HydrophobicContact CG2-CG 4.37Å; H927-L930 PolarHBondContact O-N 3.31Å; L930-S932 VanDerWaalsContact C-N 3.33Å; L930-S932 PolarHBondContact O-N 3.47Å; L930-F933 CarbonylContact O-C 3.5Å; L930-F933 PolarHBondContact O-N 2.67Å
931	M	71.4	Confident	77.3	Confident	97 Å²	97	62.9 Å²	62.9	48%	0.478	32%	0.319	S	S	.	.	H	α-helix	trans	-63.2	-34.6	180	-58.1	-66.5	94.8	0	0	113.3	T925 Y926 H927	T925-M931 WeakPolarHBondContact O-CE 3.45Å; Y926-M931 HydrophobicContact CD1-SD 4.37Å; H927-M931 PolarHBondContact O-N 3.01Å
932	S	69.7	Low	77.9	Confident	58 Å²	58	58.4 Å²	58.4	41%	0.406	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-11.2	-179.6	48.8	0	0	0	0	115.1	P928 V929 L930 R937	P928-S932 WeakPolarHBondContact O-CB 3.3Å; P928-S932 PolarHBondContact O-N 3.32Å; P928-S932 PolarHBondContact O-OG 2.72Å; V929-S932 PolarHBondContact O-OG 3.07Å; L930-S932 VanDerWaalsContact C-N 3.33Å; L930-S932 PolarHBondContact O-N 3.47Å; S932-R937 PolarHBondContact O-NH1 3.14Å
933	F	73.6	Confident	78.5	Confident	55 Å²	55	52.1 Å²	52.1	24%	0.241	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.7	49.7	179	-77.3	-99	0	0	0	110.1	L877 V880 Q881 V929 L930	L877-F933 HydrophobicContact CD2-CB 3.96Å; L877-F933 HydrophobicContact CD2-CD1 3.67Å; L877-F933 HydrophobicContact CD2-CG 4.22Å; L877-F933 HydrophobicContact CG-CD1 4.09Å; V880-F933 HydrophobicContact CB-CB 3.97Å; V880-F933 HydrophobicContact CB-CG 4.4Å; V880-F933 HydrophobicContact CG1-CB 3.67Å; V880-F933 HydrophobicContact CG1-CG 4.36Å; V880-F933 HydrophobicContact CG2-CB 4.28Å; V880-F933 HydrophobicContact CG2-CD1 4.18Å; V880-F933 HydrophobicContact CG2-CG 4.17Å; Q881-F933 WeakPolarHBondContact CG-O 3.5Å; Q881-F933 PolarHBondContact NE2-O 2.69Å; V929-F933 WeakPolarHBondContact O-CD2 3.38Å; L930-F933 CarbonylContact O-C 3.5Å; L930-F933 PolarHBondContact O-N 2.67Å
934	S	81.1	Confident	79.5	Confident	43 Å²	43	51.3 Å²	51.3	30%	0.301	26%	0.262	S	S	.	.			trans	-66.6	157.8	-172.4	69.3	0	0	0	0	114	K936 R937 L938	S934-K936 PolarHBondContact O-N 2.9Å; S934-R937 WeakPolarHBondContact O-CB 3.26Å; S934-R937 PolarHBondContact O-N 3.38Å; S934-R937 VanDerWaalsContact O-N 3.11Å; S934-R937 PolarHBondContact OG-N 3.41Å; S934-L938 PolarHBondContact O-N 3.41Å
935	F	83.9	Confident	80.4	Confident	18 Å²	18	48.8 Å²	48.8	8%	0.079	25%	0.248	C	C	.	.	H	α-helix	trans	-61	-31.4	173.7	-159.3	-85.1	0	0	0	112.3	V832 K836 L851 Q881 V885 L938 L939 M973	V832-F935 WeakPolarHBondContact O-CZ 3.45Å; K836-F935 HydrophobicContact CG-CD2 4.43Å; K836-F935 HydrophobicContact CG-CE1 4.36Å; K836-F935 HydrophobicContact CG-CE2 4.19Å; K836-F935 HydrophobicContact CG-CZ 4.15Å; L851-F935 HydrophobicContact CD1-CE2 4.12Å; L851-F935 HydrophobicContact CD2-CE2 4.18Å; Q881-F935 HydrophobicContact CB-CD2 4.43Å; Q881-F935 VanDerWaalsContact CD-N 3.32Å; Q881-F935 HydrophobicContact CG-CB 4.45Å; Q881-F935 HydrophobicContact CG-CD2 4.4Å; V885-F935 HydrophobicContact CG2-CD2 4.42Å; F935-L938 HydrophobicContact CD2-CD2 4.46Å; F935-L938 WeakPolarHBondContact O-CB 3.43Å; F935-L938 PolarHBondContact O-N 3.37Å; F935-L939 HydrophobicContact CD1-CD1 3.78Å; F935-L939 HydrophobicContact CD1-CG 4.42Å; F935-L939 HydrophobicContact CE1-CD1 3.62Å; F935-L939 HydrophobicContact CE1-CG 4.27Å; F935-L939 PolarHBondContact O-N 2.84Å; F935-M973 HydrophobicContact CD1-CE 3.9Å; F935-M973 HydrophobicContact CD1-SD 3.49Å; F935-M973 WeakPolarHBondContact CD1-SD 3.46Å; F935-M973 HydrophobicContact CE1-SD 4.02Å; F935-M973 HydrophobicContact CG-SD 4.45Å
936	K	84.2	Confident	81.6	Confident	73 Å²	73	46.6 Å²	46.6	32%	0.317	24%	0.235	S	C	.	.	H	α-helix	trans	-58.7	-48.7	171.2	-175.8	-179	171.6	150.8	0	111.5	S934 L938 L939 E940 Q970 M973 D974	S934-K936 PolarHBondContact O-N 2.9Å; K936-L938 PolarHBondContact O-N 3.43Å; K936-L939 PolarHBondContact O-N 2.68Å; K936-E940 WeakPolarHBondContact CE-OE1 3.42Å; K936-E940 WeakPolarHBondContact CG-OE1 3.49Å; K936-E940 PolarHBondContact O-N 3.02Å; K936-Q970 PolarHBondContact O-NE2 3.1Å; K936-M973 HydrophobicContact CB-CE 4.12Å; K936-D974 VanDerWaalsContact CD-OD1 3.31Å; K936-D974 WeakPolarHBondContact CD-OD1 3.43Å; K936-D974 WeakPolarHBondContact CE-OD1 3.49Å; K936-D974 IonicContact NZ-OD1 3.03Å; K936-D974 PolarHBondContact NZ-OD1 2.84Å; K936-D974 IonicContact NZ-OD2 2.71Å; K936-D974 PolarHBondContact NZ-OD2 3.34Å
937	R	85.1	Confident	82.6	Confident	91 Å²	91	41.9 Å²	41.9	34%	0.343	22%	0.222	S	C	.	.	H	α-helix	trans	-63.7	-39.9	177.3	-177.4	177.5	173.3	168.9	7.9	112	E873 L877 S932 S934 L939 E940 T941	E873-R937 IonicContact OE1-CZ 2.68Å; E873-R937 VanDerWaalsContact OE1-CZ 3.3Å; E873-R937 IonicContact OE1-NE 3.61Å; E873-R937 PolarHBondContact OE1-NE 3.27Å; E873-R937 VanDerWaalsContact OE1-NE 3.15Å; E873-R937 IonicContact OE1-NH2 3.44Å; E873-R937 PolarHBondContact OE1-NH2 2.95Å; L877-R937 HydrophobicContact CD1-CG 4.14Å; L877-R937 HydrophobicContact CD2-CB 4.24Å; L877-R937 HydrophobicContact CD2-CG 3.99Å; S932-R937 PolarHBondContact O-NH1 3.14Å; S934-R937 WeakPolarHBondContact O-CB 3.26Å; S934-R937 PolarHBondContact O-N 3.38Å; S934-R937 VanDerWaalsContact O-N 3.11Å; S934-R937 PolarHBondContact OG-N 3.41Å; R937-L939 VanDerWaalsContact C-N 3.31Å; R937-L939 PolarHBondContact O-N 3.19Å; R937-E940 PolarHBondContact O-N 3.48Å; R937-T941 PolarHBondContact O-N 2.8Å; R937-T941 PolarHBondContact O-OG1 3.4Å; R937-T941 VanDerWaalsContact O-OG1 3.06Å
938	L	88.8	Confident	83	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-54.5	-46.2	174	173.4	61.8	0	0	0	111.9	V832 L851 I874 L877 L878 Q881 S934 F935 K936 I942	V832-L938 HydrophobicContact CG1-CD2 4.37Å; L851-L938 HydrophobicContact CD2-CD2 4.29Å; I874-L938 HydrophobicContact CG2-CD1 4.46Å; L877-L938 HydrophobicContact CB-CB 4.14Å; L877-L938 HydrophobicContact CB-CD1 3.71Å; L877-L938 HydrophobicContact CB-CG 4.47Å; L878-L938 HydrophobicContact CD2-CD1 3.93Å; L878-L938 HydrophobicContact CD2-CD2 4.07Å; L878-L938 HydrophobicContact CG-CD1 3.9Å; Q881-L938 HydrophobicContact CB-CD2 4.3Å; Q881-L938 HydrophobicContact CG-CD2 4.41Å; S934-L938 PolarHBondContact O-N 3.41Å; F935-L938 HydrophobicContact CD2-CD2 4.46Å; F935-L938 WeakPolarHBondContact O-CB 3.43Å; F935-L938 PolarHBondContact O-N 3.37Å; K936-L938 PolarHBondContact O-N 3.43Å; L938-I942 HydrophobicContact CD1-CD1 3.69Å; L938-I942 HydrophobicContact CD1-CG1 4.34Å; L938-I942 HydrophobicContact CG-CD1 4Å; L938-I942 WeakPolarHBondContact O-CB 3.3Å; L938-I942 WeakPolarHBondContact O-CD1 3.34Å; L938-I942 VanDerWaalsContact O-CG1 3.24Å; L938-I942 WeakPolarHBondContact O-CG1 3.41Å; L938-I942 PolarHBondContact O-N 3.21Å
939	L	89	Confident	83.6	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.01	20%	0.204	C	C	.	.	H	α-helix	trans	-72	-33	178.3	-76.9	165.7	0	0	0	113.1	V832 M833 F935 K936 R937 N943 V966 M973	V832-L939 HydrophobicContact CG1-CD2 4.13Å; M833-L939 HydrophobicContact SD-CD2 4.08Å; F935-L939 HydrophobicContact CD1-CD1 3.78Å; F935-L939 HydrophobicContact CD1-CG 4.42Å; F935-L939 HydrophobicContact CE1-CD1 3.62Å; F935-L939 HydrophobicContact CE1-CG 4.27Å; F935-L939 PolarHBondContact O-N 2.84Å; K936-L939 PolarHBondContact O-N 2.68Å; R937-L939 VanDerWaalsContact C-N 3.31Å; R937-L939 PolarHBondContact O-N 3.19Å; L939-N943 PolarHBondContact O-N 3.03Å; L939-N943 PolarHBondContact O-ND2 3.19Å; L939-V966 HydrophobicContact CD2-CG1 3.7Å; L939-M973 HydrophobicContact CD1-CE 3.48Å; L939-M973 VanDerWaalsContact CD1-CE 3.48Å; L939-M973 HydrophobicContact CD1-SD 4.17Å
940	E	88.2	Confident	84.1	Confident	90 Å²	90	39.4 Å²	39.4	42%	0.421	20%	0.204	S	C	.	.	H	α-helix	trans	-61.9	-50.6	170.5	-91	144.4	-153.5	0	0	112.4	K936 R937 I942 N943 S944 Q970	K936-E940 WeakPolarHBondContact CE-OE1 3.42Å; K936-E940 WeakPolarHBondContact CG-OE1 3.49Å; K936-E940 PolarHBondContact O-N 3.02Å; R937-E940 PolarHBondContact O-N 3.48Å; E940-I942 VanDerWaalsContact C-N 3.28Å; E940-I942 PolarHBondContact O-N 3.37Å; E940-N943 PolarHBondContact O-N 3.21Å; E940-S944 PolarHBondContact O-N 3.29Å; E940-Q970 VanDerWaalsContact CD-NE2 3.33Å; E940-Q970 PolarHBondContact OE1-NE2 3.02Å
941	T	88.8	Confident	84.6	Confident	14 Å²	14	47.7 Å²	47.7	9%	0.086	24%	0.24	C	C	.	.	H	α-helix	trans	-63.4	-35.8	178.2	-47.4	0	0	0	0	111.4	L870 E873 I874 L877 R937 S944 F945	L870-T941 HydrophobicContact CD1-CG2 3.47Å; L870-T941 VanDerWaalsContact CD1-CG2 3.47Å; L870-T941 HydrophobicContact CG-CG2 4.49Å; E873-T941 HydrophobicContact CB-CG2 4.42Å; E873-T941 HydrophobicContact CG-CG2 4.2Å; I874-T941 HydrophobicContact CD1-CG2 4.05Å; I874-T941 HydrophobicContact CG1-CG2 3.47Å; I874-T941 VanDerWaalsContact CG1-CG2 3.47Å; L877-T941 HydrophobicContact CD1-CG2 4.46Å; L877-T941 WeakPolarHBondContact CD1-OG1 3.28Å; R937-T941 PolarHBondContact O-N 2.8Å; R937-T941 PolarHBondContact O-OG1 3.4Å; R937-T941 VanDerWaalsContact O-OG1 3.06Å; T941-S944 WeakPolarHBondContact O-CB 3.25Å; T941-S944 PolarHBondContact O-N 3.47Å; T941-F945 PolarHBondContact O-N 3.02Å
942	I	91	Very high	84.9	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-68.1	-40.5	174	-72.7	170.1	0	0	0	112.2	F828 L829 V832 I874 L938 E940 S944 F945 L946	F828-I942 HydrophobicContact CE1-CD1 3.79Å; F828-I942 HydrophobicContact CE1-CG1 4.05Å; F828-I942 HydrophobicContact CE1-CG2 4.3Å; F828-I942 HydrophobicContact CZ-CD1 3.65Å; F828-I942 HydrophobicContact CZ-CG1 4.18Å; L829-I942 HydrophobicContact CD2-CG2 3.53Å; V832-I942 HydrophobicContact CB-CD1 4.46Å; V832-I942 HydrophobicContact CG1-CD1 3.82Å; V832-I942 HydrophobicContact CG2-CD1 4.04Å; I874-I942 HydrophobicContact CD1-CG1 4.14Å; I874-I942 HydrophobicContact CG1-CG1 4.36Å; I874-I942 HydrophobicContact CG2-CD1 4.47Å; I874-I942 HydrophobicContact CG2-CG1 4.12Å; L938-I942 HydrophobicContact CD1-CD1 3.69Å; L938-I942 HydrophobicContact CD1-CG1 4.34Å; L938-I942 HydrophobicContact CG-CD1 4Å; L938-I942 WeakPolarHBondContact O-CB 3.3Å; L938-I942 WeakPolarHBondContact O-CD1 3.34Å; L938-I942 VanDerWaalsContact O-CG1 3.24Å; L938-I942 WeakPolarHBondContact O-CG1 3.41Å; L938-I942 PolarHBondContact O-N 3.21Å; E940-I942 VanDerWaalsContact C-N 3.28Å; E940-I942 PolarHBondContact O-N 3.37Å; I942-S944 VanDerWaalsContact C-N 3.31Å; I942-S944 PolarHBondContact O-N 2.72Å; I942-F945 WeakPolarHBondContact O-CB 3.47Å; I942-F945 PolarHBondContact O-N 3.07Å; I942-L946 HydrophobicContact CG2-CD1 4.36Å; I942-L946 HydrophobicContact CG2-CG 4.46Å; I942-L946 WeakPolarHBondContact O-CG 3.39Å; I942-L946 PolarHBondContact O-N 3.31Å
943	N	89.4	Confident	85.4	Confident	18 Å²	18	48.8 Å²	48.8	10%	0.096	24%	0.237	C	C	.	.	H	α-helix	trans	-60	-41.8	173.8	-79.8	-58.9	0	0	0	111.3	L939 E940 F945 L946 D947 V966	L939-N943 PolarHBondContact O-N 3.03Å; L939-N943 PolarHBondContact O-ND2 3.19Å; E940-N943 PolarHBondContact O-N 3.21Å; N943-F945 VanDerWaalsContact C-N 3.3Å; N943-F945 PolarHBondContact O-N 2.93Å; N943-L946 PolarHBondContact O-N 3.14Å; N943-D947 PolarHBondContact O-N 3.44Å; N943-V966 WeakPolarHBondContact ND2-CG1 3.34Å; N943-V966 VanDerWaalsContact OD1-CG1 3.28Å; N943-V966 WeakPolarHBondContact OD1-CG1 3.48Å
944	S	87.8	Confident	85.2	Confident	57 Å²	57	50.7 Å²	50.7	40%	0.399	26%	0.255	S	S	.	.	H	α-helix	trans	-57.6	-40.8	174.8	-172.1	0	0	0	0	112.5	E940 T941 I942 N948	E940-S944 PolarHBondContact O-N 3.29Å; T941-S944 WeakPolarHBondContact O-CB 3.25Å; T941-S944 PolarHBondContact O-N 3.47Å; I942-S944 VanDerWaalsContact C-N 3.31Å; I942-S944 PolarHBondContact O-N 2.72Å; S944-N948 WeakPolarHBondContact O-CB 3.19Å; S944-N948 PolarHBondContact O-N 3.44Å; S944-N948 VanDerWaalsContact O-N 3.13Å; S944-N948 PolarHBondContact O-ND2 3.37Å
945	F	89.7	Confident	84.2	Confident	6 Å²	6	54.4 Å²	54.4	3%	0.026	28%	0.279	C	S	.	.	H	α-helix	trans	-62	-47.2	171.1	162.4	-111.4	0	0	0	112.4	I825 W858 V865 L870 I874 T941 I942 N943 D947 N948 Y949	I825-F945 HydrophobicContact CD1-CE1 4.47Å; I825-F945 HydrophobicContact CD1-CZ 4.08Å; I825-F945 HydrophobicContact CG1-CE1 4.3Å; I825-F945 HydrophobicContact CG1-CZ 4.19Å; I825-F945 HydrophobicContact CG2-CE1 4.43Å; W858-F945 AromaticContact CH2-CD1 3.89Å; W858-F945 HydrophobicContact CH2-CD1 3.89Å; W858-F945 HydrophobicContact CH2-CD2 4.23Å; W858-F945 HydrophobicContact CH2-CE1 4.15Å; W858-F945 HydrophobicContact CH2-CE2 4.49Å; W858-F945 AromaticContact CH2-CG 3.93Å; W858-F945 HydrophobicContact CH2-CG 3.93Å; W858-F945 HydrophobicContact CH2-CZ 4.44Å; W858-F945 AromaticContact CZ3-CD1 3.89Å; W858-F945 HydrophobicContact CZ3-CD1 3.89Å; W858-F945 AromaticContact CZ3-CE1 3.85Å; W858-F945 HydrophobicContact CZ3-CE1 3.85Å; W858-F945 HydrophobicContact CZ3-CG 4.4Å; W858-F945 HydrophobicContact CZ3-CZ 4.34Å; V865-F945 HydrophobicContact CG1-CD2 4.47Å; V865-F945 HydrophobicContact CG2-CD2 3.97Å; V865-F945 HydrophobicContact CG2-CE2 3.67Å; V865-F945 HydrophobicContact CG2-CZ 4.33Å; L870-F945 HydrophobicContact CD2-CB 3.93Å; I874-F945 HydrophobicContact CD1-CB 4.08Å; T941-F945 PolarHBondContact O-N 3.02Å; I942-F945 WeakPolarHBondContact O-CB 3.47Å; I942-F945 PolarHBondContact O-N 3.07Å; N943-F945 VanDerWaalsContact C-N 3.3Å; N943-F945 PolarHBondContact O-N 2.93Å; F945-D947 PolarHBondContact O-N 3.14Å; F945-N948 PolarHBondContact O-N 3.31Å; F945-Y949 WeakPolarHBondContact O-CB 3.46Å; F945-Y949 PolarHBondContact O-N 3.45Å
946	L	88.5	Confident	83.8	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-65.1	-39.1	-178.9	-64.6	177.9	0	0	0	113	I825 L829 I942 N943 Y949 L950 I959 T963 V966	I825-L946 HydrophobicContact CG2-CD2 3.68Å; L829-L946 HydrophobicContact CD1-CD1 3.77Å; L829-L946 HydrophobicContact CD1-CD2 3.93Å; L829-L946 HydrophobicContact CD1-CG 4.49Å; L829-L946 HydrophobicContact CD2-CD1 3.99Å; L829-L946 HydrophobicContact CD2-CD2 4.42Å; I942-L946 HydrophobicContact CG2-CD1 4.36Å; I942-L946 HydrophobicContact CG2-CG 4.46Å; I942-L946 WeakPolarHBondContact O-CG 3.39Å; I942-L946 PolarHBondContact O-N 3.31Å; N943-L946 PolarHBondContact O-N 3.14Å; L946-Y949 PolarHBondContact O-N 2.96Å; L946-L950 WeakPolarHBondContact O-CB 3.39Å; L946-L950 WeakPolarHBondContact O-CG 3.4Å; L946-L950 PolarHBondContact O-N 3.01Å; L946-I959 HydrophobicContact CD2-CG2 4.24Å; L946-T963 HydrophobicContact CB-CG2 4.25Å; L946-T963 HydrophobicContact CD1-CG2 4.31Å; L946-V966 HydrophobicContact CD1-CG2 4.08Å
947	D	86.4	Confident	83.3	Confident	80 Å²	80	58.9 Å²	58.9	43%	0.428	30%	0.3	S	S	.	.	H	α-helix	trans	-68.8	-38.7	177.7	-74.9	-29.8	0	0	0	111.3	N943 F945 L950 K951	N943-D947 PolarHBondContact O-N 3.44Å; F945-D947 PolarHBondContact O-N 3.14Å; D947-L950 PolarHBondContact O-N 3.01Å; D947-K951 VanDerWaalsContact O-CB 3.3Å; D947-K951 WeakPolarHBondContact O-CB 3.48Å; D947-K951 PolarHBondContact O-N 2.89Å
948	N	85.6	Confident	82.6	Confident	84 Å²	84	60.1 Å²	60.1	45%	0.449	31%	0.313	S	S	.	.	H	α-helix	trans	-62.8	-42.4	170.6	-77.3	-29.9	0	0	0	111.9	S944 F945 K951 K952	S944-N948 WeakPolarHBondContact O-CB 3.19Å; S944-N948 PolarHBondContact O-N 3.44Å; S944-N948 VanDerWaalsContact O-N 3.13Å; S944-N948 PolarHBondContact O-ND2 3.37Å; F945-N948 PolarHBondContact O-N 3.31Å; N948-K951 WeakPolarHBondContact O-CB 3.49Å; N948-K951 PolarHBondContact O-N 3.32Å; N948-K952 PolarHBondContact O-N 3.38Å
949	Y	84.6	Confident	82.2	Confident	12 Å²	12	60.1 Å²	60.1	5%	0.047	31%	0.313	C	S	.	.	H	α-helix	trans	-64.3	-44.5	176.5	-172.1	-90.3	0	0	0	112.4	E821 I825 F945 L946 K951 K952 N953 I959	E821-Y949 VanDerWaalsContact CD-CE2 3.45Å; E821-Y949 HydrophobicContact CG-CE2 4.13Å; E821-Y949 VanDerWaalsContact OE2-CE2 3.23Å; E821-Y949 WeakPolarHBondContact OE2-CE2 3.5Å; E821-Y949 VanDerWaalsContact OE2-CZ 3.3Å; E821-Y949 PolarHBondContact OE2-OH 3.18Å; I825-Y949 HydrophobicContact CD1-CD1 4.09Å; I825-Y949 HydrophobicContact CD1-CD2 3.87Å; I825-Y949 HydrophobicContact CD1-CE1 3.89Å; I825-Y949 HydrophobicContact CD1-CE2 3.68Å; I825-Y949 HydrophobicContact CD1-CG 4.07Å; F945-Y949 WeakPolarHBondContact O-CB 3.46Å; F945-Y949 PolarHBondContact O-N 3.45Å; L946-Y949 PolarHBondContact O-N 2.96Å; Y949-K951 VanDerWaalsContact C-N 3.32Å; Y949-K951 PolarHBondContact O-N 3.34Å; Y949-K952 PolarHBondContact O-N 2.88Å; Y949-N953 HydrophobicContact CD1-CB 4.46Å; Y949-N953 HydrophobicContact CE1-CB 4.1Å; Y949-N953 WeakPolarHBondContact CE1-ND2 3.4Å; Y949-N953 PolarHBondContact O-N 2.92Å; Y949-I959 HydrophobicContact CD1-CG1 4.44Å; Y949-I959 HydrophobicContact CD1-CG2 4.14Å; Y949-I959 HydrophobicContact CE1-CG1 4.11Å
950	L	84.9	Confident	81.5	Confident	25 Å²	25	66.6 Å²	66.6	13%	0.131	34%	0.341	C	S	.	.	H	α-helix	trans	-68.2	-29.1	177.3	-77.6	172.1	0	0	0	113.1	L946 D947 K952 N953 P954 I959 K960 T963	L946-L950 WeakPolarHBondContact O-CB 3.39Å; L946-L950 WeakPolarHBondContact O-CG 3.4Å; L946-L950 PolarHBondContact O-N 3.01Å; D947-L950 PolarHBondContact O-N 3.01Å; L950-K952 VanDerWaalsContact C-N 3.28Å; L950-K952 PolarHBondContact O-N 3.41Å; L950-N953 CarbonylContact O-C 3.6Å; L950-N953 VanDerWaalsContact O-C 3.23Å; L950-N953 PolarHBondContact O-N 3.48Å; L950-P954 VanDerWaalsContact O-CA 3.26Å; L950-P954 WeakPolarHBondContact O-CA 3.43Å; L950-P954 VanDerWaalsContact O-N 3.14Å; L950-I959 HydrophobicContact CD1-CG2 4.36Å; L950-I959 HydrophobicContact CD2-CB 3.95Å; L950-I959 HydrophobicContact CD2-CG2 3.95Å; L950-I959 HydrophobicContact CG-CG2 3.96Å; L950-K960 HydrophobicContact CD2-CB 4.21Å; L950-T963 HydrophobicContact CD1-CG2 4.49Å; L950-T963 WeakPolarHBondContact CD1-OG1 3.36Å
951	K	84.1	Confident	80.9	Confident	178 Å²	178	66.1 Å²	66.1	77%	0.774	34%	0.344	S	S	*	.	H	α-helix	trans	-64.8	-33.3	171.9	-175	-178.5	177.7	-172.9	0	112	D947 N948 Y949	D947-K951 VanDerWaalsContact O-CB 3.3Å; D947-K951 WeakPolarHBondContact O-CB 3.48Å; D947-K951 PolarHBondContact O-N 2.89Å; N948-K951 WeakPolarHBondContact O-CB 3.49Å; N948-K951 PolarHBondContact O-N 3.32Å; Y949-K951 VanDerWaalsContact C-N 3.32Å; Y949-K951 PolarHBondContact O-N 3.34Å
952	K	79.4	Confident	80.1	Confident	132 Å²	132	66.4 Å²	66.4	57%	0.574	35%	0.348	S	S	*	.	H	α-helix	trans	-80	-36	172.8	-169.6	174.5	177.7	-179.5	0	112.3	E866 N948 Y949 L950 P954	E866-K952 IonicContact OE1-NZ 3.01Å; E866-K952 PolarHBondContact OE1-NZ 3.46Å; N948-K952 PolarHBondContact O-N 3.38Å; Y949-K952 PolarHBondContact O-N 2.88Å; L950-K952 VanDerWaalsContact C-N 3.28Å; L950-K952 PolarHBondContact O-N 3.41Å; K952-P954 VanDerWaalsContact C-CD 3.47Å; K952-P954 VanDerWaalsContact O-CD 3.32Å; K952-P954 WeakPolarHBondContact O-CD 3.43Å
953	N	78.7	Confident	79.4	Confident	47 Å²	47	66.6 Å²	66.6	25%	0.251	35%	0.35	S	S	.	.			trans	-121.1	66.5	-175.8	-65.5	-60.3	0	0	0	113.1	Y949 L950 C955 D956	Y949-N953 HydrophobicContact CD1-CB 4.46Å; Y949-N953 HydrophobicContact CE1-CB 4.1Å; Y949-N953 WeakPolarHBondContact CE1-ND2 3.4Å; Y949-N953 PolarHBondContact O-N 2.92Å; L950-N953 CarbonylContact O-C 3.6Å; L950-N953 VanDerWaalsContact O-C 3.23Å; L950-N953 PolarHBondContact O-N 3.48Å; N953-C955 PolarHBondContact O-N 3.21Å; N953-C955 VanDerWaalsContact O-N 3.08Å; N953-D956 PolarHBondContact O-N 2.79Å
954	P	69.9	Low	78.8	Confident	95 Å²	95	67.4 Å²	67.4	62%	0.617	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-14.1	-169.2	26.5	-36.4	0	0	0	115.4	L950 K952	L950-P954 VanDerWaalsContact O-CA 3.26Å; L950-P954 WeakPolarHBondContact O-CA 3.43Å; L950-P954 VanDerWaalsContact O-N 3.14Å; K952-P954 VanDerWaalsContact C-CD 3.47Å; K952-P954 VanDerWaalsContact O-CD 3.32Å; K952-P954 WeakPolarHBondContact O-CD 3.43Å
955	C	60.3	Low	78.2	Confident	120 Å²	120	70.6 Å²	70.6	81%	0.811	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-8.6	-179.4	-64.8	0	0	0	0	114.1	N953 F957	N953-C955 PolarHBondContact O-N 3.21Å; N953-C955 VanDerWaalsContact O-N 3.08Å; C955-F957 PolarHBondContact O-N 3.17Å
956	D	75.4	Confident	77.6	Confident	28 Å²	28	70.4 Å²	70.4	15%	0.15	37%	0.368	C	S	.	.			trans	-79.1	86.8	-172.6	-84.7	-46.8	0	0	0	113.8	K822 N953 L958 I959 K960	K822-D956 WeakPolarHBondContact CD-OD1 3.39Å; K822-D956 WeakPolarHBondContact CE-OD1 3.39Å; K822-D956 WeakPolarHBondContact CE-OD2 3.26Å; K822-D956 IonicContact NZ-OD1 3.3Å; K822-D956 PolarHBondContact NZ-OD1 3.39Å; K822-D956 IonicContact NZ-OD2 2.86Å; K822-D956 PolarHBondContact NZ-OD2 2.88Å; N953-D956 PolarHBondContact O-N 2.79Å; D956-L958 PolarHBondContact O-N 3.21Å; D956-I959 HydrophobicContact CB-CB 4.37Å; D956-I959 HydrophobicContact CB-CG1 4.23Å; D956-I959 PolarHBondContact O-N 3.22Å; D956-K960 WeakPolarHBondContact O-CB 3.24Å; D956-K960 PolarHBondContact O-N 2.91Å
957	F	73.4	Confident	76.9	Confident	158 Å²	158	74.6 Å²	74.6	69%	0.693	39%	0.388	S	S	*	.	H	α-helix	trans	-54.3	-34.1	177.1	-175.3	-95.6	0	0	0	113.8	C955 T961	C955-F957 PolarHBondContact O-N 3.17Å; F957-T961 WeakPolarHBondContact O-CB 3.32Å; F957-T961 PolarHBondContact O-N 3.2Å; F957-T961 PolarHBondContact O-OG1 2.96Å
958	L	71.4	Confident	76.4	Confident	117 Å²	117	73.5 Å²	73.5	61%	0.613	39%	0.386	S	S	*	.	H	α-helix	trans	-65.5	-52	177.9	-70	174.7	0	0	0	111.8	D956 K960 T961 A962	D956-L958 PolarHBondContact O-N 3.21Å; L958-K960 VanDerWaalsContact C-N 3.32Å; L958-K960 PolarHBondContact O-N 3.22Å; L958-T961 WeakPolarHBondContact O-CB 3.47Å; L958-T961 PolarHBondContact O-N 2.89Å; L958-A962 PolarHBondContact O-N 3.16Å
959	I	79	Confident	75.5	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-67.1	-36.4	179.1	-53	-53.9	0	0	0	110.7	K822 I825 L946 Y949 L950 D956 T961 A962 T963	K822-I959 HydrophobicContact CB-CD1 4.27Å; I825-I959 HydrophobicContact CB-CD1 4.07Å; I825-I959 HydrophobicContact CG2-CD1 3.88Å; L946-I959 HydrophobicContact CD2-CG2 4.24Å; Y949-I959 HydrophobicContact CD1-CG1 4.44Å; Y949-I959 HydrophobicContact CD1-CG2 4.14Å; Y949-I959 HydrophobicContact CE1-CG1 4.11Å; L950-I959 HydrophobicContact CD1-CG2 4.36Å; L950-I959 HydrophobicContact CD2-CB 3.95Å; L950-I959 HydrophobicContact CD2-CG2 3.95Å; L950-I959 HydrophobicContact CG-CG2 3.96Å; D956-I959 HydrophobicContact CB-CB 4.37Å; D956-I959 HydrophobicContact CB-CG1 4.23Å; D956-I959 PolarHBondContact O-N 3.22Å; I959-T961 VanDerWaalsContact C-N 3.29Å; I959-T961 PolarHBondContact O-N 3.47Å; I959-A962 PolarHBondContact O-N 3.1Å; I959-T963 PolarHBondContact O-N 3.02Å; I959-T963 PolarHBondContact O-OG1 3.08Å
960	K	75.3	Confident	74.6	Confident	137 Å²	137	70.5 Å²	70.5	60%	0.596	37%	0.372	S	S	*	.	H	α-helix	trans	-61.7	-35.6	173.5	-169.1	168.9	-171.4	162.9	0	112.8	L950 D956 L958 G964	L950-K960 HydrophobicContact CD2-CB 4.21Å; D956-K960 WeakPolarHBondContact O-CB 3.24Å; D956-K960 PolarHBondContact O-N 2.91Å; L958-K960 VanDerWaalsContact C-N 3.32Å; L958-K960 PolarHBondContact O-N 3.22Å; K960-G964 PolarHBondContact O-N 3.47Å
961	T	74.6	Confident	73.6	Confident	80 Å²	80	74.3 Å²	74.3	49%	0.491	39%	0.393	S	S	.	.	H	α-helix	trans	-72.2	-41.7	173.4	-56.7	0	0	0	0	111.2	F957 L958 I959 G964 F965	F957-T961 WeakPolarHBondContact O-CB 3.32Å; F957-T961 PolarHBondContact O-N 3.2Å; F957-T961 PolarHBondContact O-OG1 2.96Å; L958-T961 WeakPolarHBondContact O-CB 3.47Å; L958-T961 PolarHBondContact O-N 2.89Å; I959-T961 VanDerWaalsContact C-N 3.29Å; I959-T961 PolarHBondContact O-N 3.47Å; T961-G964 PolarHBondContact O-N 2.92Å; T961-F965 PolarHBondContact O-N 3.27Å
962	A	72.8	Confident	72.6	Confident	20 Å²	20	70 Å²	70	17%	0.165	38%	0.381	C	S	.	.	H	α-helix	trans	-64.1	-42.1	178.2	0	0	0	0	0	112.5	L829 L958 I959 G964 F965 V966	L829-A962 HydrophobicContact CD1-CB 3.69Å; L958-A962 PolarHBondContact O-N 3.16Å; I959-A962 PolarHBondContact O-N 3.1Å; A962-G964 VanDerWaalsContact C-N 3.3Å; A962-G964 PolarHBondContact O-N 3.15Å; A962-F965 WeakPolarHBondContact O-CA 3.47Å; A962-F965 WeakPolarHBondContact O-CB 3.48Å; A962-F965 PolarHBondContact O-N 2.96Å; A962-V966 WeakPolarHBondContact O-CG2 3.31Å; A962-V966 PolarHBondContact O-N 2.82Å
963	T	76.9	Confident	71.6	Confident	5 Å²	5	64.8 Å²	64.8	3%	0.031	36%	0.359	C	S	.	.	H	α-helix	trans	-59.4	-41.5	175.4	-50.5	0	0	0	0	111.2	L946 L950 I959 F965 V966 Q967	L946-T963 HydrophobicContact CB-CG2 4.25Å; L946-T963 HydrophobicContact CD1-CG2 4.31Å; L950-T963 HydrophobicContact CD1-CG2 4.49Å; L950-T963 WeakPolarHBondContact CD1-OG1 3.36Å; I959-T963 PolarHBondContact O-N 3.02Å; I959-T963 PolarHBondContact O-OG1 3.08Å; T963-F965 VanDerWaalsContact C-N 3.28Å; T963-F965 PolarHBondContact O-N 3.36Å; T963-V966 PolarHBondContact O-N 2.97Å; T963-Q967 HydrophobicContact CG2-CG 4.49Å; T963-Q967 WeakPolarHBondContact O-CB 3.4Å; T963-Q967 WeakPolarHBondContact O-CG 3.33Å; T963-Q967 PolarHBondContact O-N 3.05Å
964	G	75.9	Confident	70.1	Confident	35 Å²	35	65.2 Å²	65.2	36%	0.361	36%	0.361	S	S	.	.	H	α-helix	trans	-61.3	-33.4	173	0	0	0	0	0	113.7	K960 T961 A962 S968	K960-G964 PolarHBondContact O-N 3.47Å; T961-G964 PolarHBondContact O-N 2.92Å; A962-G964 VanDerWaalsContact C-N 3.3Å; A962-G964 PolarHBondContact O-N 3.15Å; G964-S968 WeakPolarHBondContact O-CB 3.25Å; G964-S968 PolarHBondContact O-N 2.97Å; G964-S968 PolarHBondContact O-OG 2.88Å
965	F	74.8	Confident	68.9	Low	124 Å²	124	64.2 Å²	64.2	54%	0.544	36%	0.357	S	S	.	.	H	α-helix	trans	-70	-45	174.6	-168.1	-93.8	0	0	0	111.7	M833 T961 A962 T963 S968 S969	M833-F965 HydrophobicContact CB-CE1 4.26Å; M833-F965 HydrophobicContact CE-CE1 4.1Å; M833-F965 HydrophobicContact CG-CD1 3.96Å; M833-F965 HydrophobicContact CG-CE1 3.85Å; M833-F965 HydrophobicContact SD-CD1 4.35Å; M833-F965 HydrophobicContact SD-CE1 4.36Å; T961-F965 PolarHBondContact O-N 3.27Å; A962-F965 WeakPolarHBondContact O-CA 3.47Å; A962-F965 WeakPolarHBondContact O-CB 3.48Å; A962-F965 PolarHBondContact O-N 2.96Å; T963-F965 VanDerWaalsContact C-N 3.28Å; T963-F965 PolarHBondContact O-N 3.36Å; F965-S968 PolarHBondContact O-N 3.1Å; F965-S968 PolarHBondContact O-OG 3.12Å; F965-S969 PolarHBondContact O-N 2.94Å; F965-S969 PolarHBondContact O-OG 3.1Å
966	V	76.6	Confident	68.1	Low	2 Å²	2	63.2 Å²	63.2	1%	0.012	34%	0.34	C	S	.	.	H	α-helix	trans	-59.2	-48.8	175.2	-179	0	0	0	0	110.6	L829 L939 N943 L946 A962 T963 S968 S969 Q970	L829-V966 HydrophobicContact CD1-CG2 4.22Å; L829-V966 HydrophobicContact CD2-CG2 3.98Å; L939-V966 HydrophobicContact CD2-CG1 3.7Å; N943-V966 WeakPolarHBondContact ND2-CG1 3.34Å; N943-V966 VanDerWaalsContact OD1-CG1 3.28Å; N943-V966 WeakPolarHBondContact OD1-CG1 3.48Å; L946-V966 HydrophobicContact CD1-CG2 4.08Å; A962-V966 WeakPolarHBondContact O-CG2 3.31Å; A962-V966 PolarHBondContact O-N 2.82Å; T963-V966 PolarHBondContact O-N 2.97Å; V966-S968 PolarHBondContact O-N 3.48Å; V966-S969 PolarHBondContact O-N 3.44Å; V966-S969 VanDerWaalsContact O-N 3.16Å; V966-Q970 PolarHBondContact O-N 3.46Å
967	Q	75.4	Confident	66.3	Low	87 Å²	87	64.7 Å²	64.7	41%	0.407	35%	0.353	S	S	.	.	H	α-helix	trans	-60.2	-43.7	175.3	-71.1	174.7	-2.8	0	0	112.4	T963 S969 Q970 N971	T963-Q967 HydrophobicContact CG2-CG 4.49Å; T963-Q967 WeakPolarHBondContact O-CB 3.4Å; T963-Q967 WeakPolarHBondContact O-CG 3.33Å; T963-Q967 PolarHBondContact O-N 3.05Å; Q967-S969 PolarHBondContact O-N 3.35Å; Q967-Q970 PolarHBondContact O-N 3.29Å; Q967-N971 PolarHBondContact O-N 3.13Å; Q967-N971 PolarHBondContact O-ND2 2.77Å
968	S	74.8	Confident	64.6	Low	57 Å²	57	61.6 Å²	61.6	40%	0.399	35%	0.347	S	S	.	.	H	α-helix	trans	-61	-31.3	176.7	75.3	0	0	0	0	112.8	G964 F965 V966	G964-S968 WeakPolarHBondContact O-CB 3.25Å; G964-S968 PolarHBondContact O-N 2.97Å; G964-S968 PolarHBondContact O-OG 2.88Å; F965-S968 PolarHBondContact O-N 3.1Å; F965-S968 PolarHBondContact O-OG 3.12Å; V966-S968 PolarHBondContact O-N 3.48Å
969	S	67.2	Low	62.9	Low	18 Å²	18	61.4 Å²	61.4	13%	0.126	34%	0.343	C	S	.	.	H	α-helix	trans	-80.9	-32.4	-179	-50.9	0	0	0	0	112.9	M833 F965 V966 Q967 N971 V972 M973	M833-S969 WeakPolarHBondContact CE-OG 3.26Å; F965-S969 PolarHBondContact O-N 2.94Å; F965-S969 PolarHBondContact O-OG 3.1Å; V966-S969 PolarHBondContact O-N 3.44Å; V966-S969 VanDerWaalsContact O-N 3.16Å; Q967-S969 PolarHBondContact O-N 3.35Å; S969-N971 VanDerWaalsContact C-N 3.3Å; S969-N971 PolarHBondContact O-N 3.43Å; S969-V972 PolarHBondContact O-N 3.07Å; S969-M973 PolarHBondContact O-N 3.34Å
970	Q	65.4	Low	60.7	Low	15 Å²	15	64.5 Å²	64.5	7%	0.07	36%	0.364	C	S	.	.	H	α-helix	trans	-58.3	-45	171.6	-166.4	75.3	-20.5	0	0	110.7	K936 E940 V966 Q967 V972 M973 D974	K936-Q970 PolarHBondContact O-NE2 3.1Å; E940-Q970 VanDerWaalsContact CD-NE2 3.33Å; E940-Q970 PolarHBondContact OE1-NE2 3.02Å; V966-Q970 PolarHBondContact O-N 3.46Å; Q967-Q970 PolarHBondContact O-N 3.29Å; Q970-V972 VanDerWaalsContact C-N 3.26Å; Q970-V972 PolarHBondContact O-N 3.46Å; Q970-M973 PolarHBondContact O-N 3.28Å; Q970-M973 VanDerWaalsContact OE1-CE 3.3Å; Q970-D974 PolarHBondContact O-N 3.35Å
971	N	63.5	Low	58.6	Low	106 Å²	106	65.1 Å²	65.1	57%	0.567	37%	0.369	S	S	*	.	H	α-helix	trans	-61.6	-31.5	178.8	-60.9	-28.8	0	0	0	113.2	Q967 S969 S975	Q967-N971 PolarHBondContact O-N 3.13Å; Q967-N971 PolarHBondContact O-ND2 2.77Å; S969-N971 VanDerWaalsContact C-N 3.3Å; S969-N971 PolarHBondContact O-N 3.43Å; N971-S975 PolarHBondContact O-N 3.44Å; N971-S975 PolarHBondContact O-OG 3.37Å
972	V	64.3	Low	56.6	Low	88 Å²	88	67.6 Å²	67.6	53%	0.533	38%	0.38	S	S	.	.	H	α-helix	trans	-70.1	-46.4	175.5	174.7	0	0	0	0	110.4	S969 Q970 D974 S975 E976	S969-V972 PolarHBondContact O-N 3.07Å; Q970-V972 VanDerWaalsContact C-N 3.26Å; Q970-V972 PolarHBondContact O-N 3.46Å; V972-D974 VanDerWaalsContact C-N 3.32Å; V972-D974 PolarHBondContact O-N 2.94Å; V972-S975 WeakPolarHBondContact O-CA 3.33Å; V972-S975 VanDerWaalsContact O-CB 3.26Å; V972-S975 WeakPolarHBondContact O-CB 3.42Å; V972-S975 PolarHBondContact O-N 3.04Å; V972-S975 VanDerWaalsContact O-N 3.1Å; V972-E976 PolarHBondContact O-N 2.97Å; V972-E976 VanDerWaalsContact O-N 3.11Å
973	M	57.5	Low	54.6	Low	22 Å²	22	70.1 Å²	70.1	11%	0.108	40%	0.396	C	S	.	.	H	α-helix	trans	-66.9	-32.9	179.2	-64.5	-160.8	-48.4	0	0	113.5	K836 F935 K936 L939 S969 Q970 S975 E976 S977	K836-M973 WeakPolarHBondContact CE-SD 3.4Å; F935-M973 HydrophobicContact CD1-CE 3.9Å; F935-M973 HydrophobicContact CD1-SD 3.49Å; F935-M973 WeakPolarHBondContact CD1-SD 3.46Å; F935-M973 HydrophobicContact CE1-SD 4.02Å; F935-M973 HydrophobicContact CG-SD 4.45Å; K936-M973 HydrophobicContact CB-CE 4.12Å; L939-M973 HydrophobicContact CD1-CE 3.48Å; L939-M973 VanDerWaalsContact CD1-CE 3.48Å; L939-M973 HydrophobicContact CD1-SD 4.17Å; S969-M973 PolarHBondContact O-N 3.34Å; Q970-M973 PolarHBondContact O-N 3.28Å; Q970-M973 VanDerWaalsContact OE1-CE 3.3Å; M973-S975 PolarHBondContact O-N 2.91Å; M973-E976 PolarHBondContact O-N 3.41Å; M973-S977 WeakPolarHBondContact O-CB 3.39Å; M973-S977 PolarHBondContact O-N 3.38Å
974	D	47.1	Very low	52.5	Low	55 Å²	55	74.8 Å²	74.8	29%	0.294	43%	0.425	S	S	.	.	H	α-helix	trans	-61.7	-33.1	173.9	-82.6	16.3	0	0	0	111	K936 Q970 V972 S977	K936-D974 VanDerWaalsContact CD-OD1 3.31Å; K936-D974 WeakPolarHBondContact CD-OD1 3.43Å; K936-D974 WeakPolarHBondContact CE-OD1 3.49Å; K936-D974 IonicContact NZ-OD1 3.03Å; K936-D974 PolarHBondContact NZ-OD1 2.84Å; K936-D974 IonicContact NZ-OD2 2.71Å; K936-D974 PolarHBondContact NZ-OD2 3.34Å; Q970-D974 PolarHBondContact O-N 3.35Å; V972-D974 VanDerWaalsContact C-N 3.32Å; V972-D974 PolarHBondContact O-N 2.94Å; D974-S977 PolarHBondContact O-OG 2.88Å
975	S	44.9	Very low	50.6	Low	75 Å²	75	79 Å²	79	52%	0.524	44%	0.443	S	S	.	.	H	α-helix	trans	-68.5	-47.9	171.6	-49	0	0	0	0	111.8	N971 V972 M973 S977 V978	N971-S975 PolarHBondContact O-N 3.44Å; N971-S975 PolarHBondContact O-OG 3.37Å; V972-S975 WeakPolarHBondContact O-CA 3.33Å; V972-S975 VanDerWaalsContact O-CB 3.26Å; V972-S975 WeakPolarHBondContact O-CB 3.42Å; V972-S975 PolarHBondContact O-N 3.04Å; V972-S975 VanDerWaalsContact O-N 3.1Å; M973-S975 PolarHBondContact O-N 2.91Å; S975-S977 PolarHBondContact O-N 3.17Å; S975-V978 PolarHBondContact O-N 2.95Å
976	E	43	Very low	48.6	Very low	98 Å²	98	78.1 Å²	78.1	46%	0.458	45%	0.452	S	S	.	.	H	α-helix	trans	-57	-31.9	175.4	-62.6	-178.5	137.4	0	0	112.8	K836 V972 M973 V978 S980	K836-E976 IonicContact NZ-OE2 3.93Å; K836-E976 PolarHBondContact NZ-OE2 2.93Å; V972-E976 PolarHBondContact O-N 2.97Å; V972-E976 VanDerWaalsContact O-N 3.11Å; M973-E976 PolarHBondContact O-N 3.41Å; E976-V978 VanDerWaalsContact C-N 3.33Å; E976-V978 PolarHBondContact O-N 2.95Å; E976-S980 PolarHBondContact O-OG 3.42Å
977	S	37.8	Very low	46.4	Very low	59 Å²	59	86 Å²	86	41%	0.413	49%	0.489	S	S	.	.	H	α-helix	trans	-74.6	-19.1	-177.3	76.8	0	0	0	0	114.5	M973 D974 S975 S980	M973-S977 WeakPolarHBondContact O-CB 3.39Å; M973-S977 PolarHBondContact O-N 3.38Å; D974-S977 PolarHBondContact O-OG 2.88Å; S975-S977 PolarHBondContact O-N 3.17Å; S977-S980 PolarHBondContact O-OG 2.88Å
978	V	38.9	Very low	44.2	Very low	94 Å²	94	90.4 Å²	90.4	57%	0.57	51%	0.507	S	S	*	.	H	α-helix	trans	-85.6	-46.8	178.2	175	0	0	0	0	110.6	S975 E976 S980 Q981	S975-V978 PolarHBondContact O-N 2.95Å; E976-V978 VanDerWaalsContact C-N 3.33Å; E976-V978 PolarHBondContact O-N 2.95Å; V978-S980 PolarHBondContact O-N 3.44Å; V978-S980 VanDerWaalsContact O-N 3.16Å; V978-Q981 PolarHBondContact O-N 3.4Å
979	E	34.2	Very low	42.1	Very low	113 Å²	113	96.2 Å²	96.2	53%	0.528	53%	0.528	S	S	.	.	H	α-helix	trans	-61.2	-27	179	-66.7	-170.7	115.4	0	0	113.2	F557 S983	F557-E979 WeakPolarHBondContact CZ-OE1 2.87Å; E979-S983 WeakPolarHBondContact O-CB 3.43Å; E979-S983 PolarHBondContact O-N 2.81Å; E979-S983 PolarHBondContact O-OG 3.39Å
980	S	33.2	Very low	40.4	Very low	65 Å²	65	99.4 Å²	99.4	46%	0.455	55%	0.55	S	S	.	.	H	α-helix	trans	-79.5	-12.2	-178.4	43.2	0	0	0	0	114.7	E976 S977 V978 T984	E976-S980 PolarHBondContact O-OG 3.42Å; S977-S980 PolarHBondContact O-OG 2.88Å; V978-S980 PolarHBondContact O-N 3.44Å; V978-S980 VanDerWaalsContact O-N 3.16Å; S980-T984 PolarHBondContact O-OG1 2.98Å
981	Q	32	Very low	38.7	Very low	150 Å²	150	107.1 Å²	107.1	70%	0.701	59%	0.586	S	S	*	*	H	α-helix	trans	-91.6	-42.4	172.4	-68.6	-164.1	-16.8	0	0	112.9	V978 S983 T984	V978-Q981 PolarHBondContact O-N 3.4Å; Q981-S983 VanDerWaalsContact C-N 3.35Å; Q981-S983 PolarHBondContact O-N 2.88Å; Q981-T984 PolarHBondContact O-OG1 3.11Å
982	D	32	Very low	37.1	Very low	132 Å²	132	107.7 Å²	107.7	71%	0.706	59%	0.593	S	S	*	*	H	α-helix	trans	-68.4	-32.6	177.3	-83	-30.4	0	0	0	112.9	T984	D982-T984 VanDerWaalsContact C-N 3.31Å; D982-T984 PolarHBondContact O-N 2.95Å
983	S	31.7	Very low	35.5	Very low	72 Å²	72	109.2 Å²	109.2	50%	0.503	60%	0.603	S	S	.	*	H	α-helix	trans	-72.9	-13.9	-178.7	52.5	0	0	0	0	115.1	E979 Q981	E979-S983 WeakPolarHBondContact O-CB 3.43Å; E979-S983 PolarHBondContact O-N 2.81Å; E979-S983 PolarHBondContact O-OG 3.39Å; Q981-S983 VanDerWaalsContact C-N 3.35Å; Q981-S983 PolarHBondContact O-N 2.88Å
984	T	31.4	Very low	34.3	Very low	104 Å²	104	117.1 Å²	117.1	64%	0.638	64%	0.639	S	S	*	*	H	α-helix	trans	-95.5	-2.7	-174.9	44.2	0	0	0	0	115.5	S980 Q981 D982	S980-T984 PolarHBondContact O-OG1 2.98Å; Q981-T984 PolarHBondContact O-OG1 3.11Å; D982-T984 VanDerWaalsContact C-N 3.31Å; D982-T984 PolarHBondContact O-N 2.95Å
985	V	35.9	Very low	33.5	Very low	123 Å²	123	123.6 Å²	123.6	75%	0.745	67%	0.665	S	S	*	*	H	α-helix	trans	-102.3	-32.2	-177.5	-179.2	0	0	0	0	113.9
986	S	33.2	Very low	32.8	Very low	105 Å²	105	127.3 Å²	127.3	73%	0.734	68%	0.679	S	S	*	*	H	α-helix	trans	-95.4	-24.1	-172.4	-66.2	0	0	0	0	115.9	K988	S986-K988 PolarHBondContact O-N 2.74Å
987	E	31.7	Very low	32.2	Very low	168 Å²	168	132.3 Å²	132.3	79%	0.785	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	37.5	-167.5	-152.1	166.5	-131.8	0	0	114.3
988	K	29.4	Very low	32	Very low	180 Å²	180	137.9 Å²	137.9	78%	0.783	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.6	10	179.7	-110.1	173.8	-174.3	169.2	0	117.1	S986	S986-K988 PolarHBondContact O-N 2.74Å
989	Q	30.5	Very low	31.8	Very low	179 Å²	179	144.9 Å²	144.9	84%	0.836	73%	0.734	S	S	*	*	S	Bend	trans	-120.7	-3.9	176.9	-82.5	-172.8	-21	0	0	115.6
990	S	30.3	Very low	31.9	Very low	84 Å²	84	148 Å²	148	59%	0.587	75%	0.749	S	S	*	*	S	Bend	trans	-91.5	-43.1	-175.9	46.4	0	0	0	0	114.9
991	E	29.4	Very low	31.8	Very low	178 Å²	178	157.8 Å²	157.8	83%	0.832	78%	0.783	S	S	*	*	S	Bend	trans	-83.2	-22.1	-172.5	-70.7	-148.5	117.2	0	0	115.4	T993	E991-T993 VanDerWaalsContact C-N 3.27Å; E991-T993 PolarHBondContact O-N 2.77Å
992	T	30.3	Very low	31.8	Very low	117 Å²	117	158.2 Å²	158.2	72%	0.718	79%	0.787	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-13.7	-171.4	-34	0	0	0	0	113.9
993	T	31.6	Very low	31.8	Very low	121 Å²	121	159.6 Å²	159.6	74%	0.742	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.2	-7.7	-167.7	-44	0	0	0	0	113.9	E991	E991-T993 VanDerWaalsContact C-N 3.27Å; E991-T993 PolarHBondContact O-N 2.77Å
994	Q	31.6	Very low	31.8	Very low	187 Å²	187	164.4 Å²	164.4	87%	0.874	81%	0.807	S	S	*	*	S	Bend	trans	-109.4	4.5	-173.6	-127.3	-179.4	27.3	0	0	116.5
995	K	30	Very low	31.8	Very low	191 Å²	191	168 Å²	168	83%	0.83	82%	0.817	S	S	*	*	S	Bend	trans	-105.1	-18.1	173.5	-95.4	175	178.6	164.4	0	115.9
996	N	31.6	Very low	31.6	Very low	153 Å²	153	170.8 Å²	170.8	82%	0.818	82%	0.822	S	S	*	*	S	Bend	trans	-103.8	45.9	-177.7	-81.5	0.5	0	0	0	114.3
997	K	30.5	Very low	31.5	Very low	203 Å²	203	175.2 Å²	175.2	88%	0.883	83%	0.828	S	S	*	*	S	Bend	trans	-157.6	52	158.7	-123.3	170	-172.5	178.5	0	115.3
998	K	32.2	Very low	31.5	Very low	177 Å²	177	175.7 Å²	175.7	77%	0.77	83%	0.831	S	S	*	*	S	Bend	trans	-142.8	54.8	157.4	-153.7	170.5	-174	175.9	0	113.4
999	Y	35.2	Very low	31.6	Very low	241 Å²	241	175.4 Å²	175.4	95%	0.945	83%	0.834	S	S	*	*	S	Bend	trans	-139	45.7	161.7	-105.8	-72.7	0	0	0	110.7
1000	E	36.1	Very low	31.7	Very low	179 Å²	179	175.1 Å²	175.1	84%	0.836	83%	0.834	S	S	*	*			trans	-149.2	110.1	159.3	-116.5	-174.6	160.1	0	0	107.7
1001	K	31.9	Very low	31.9	Very low	270 Å²	270	183.4 Å²	183.4	100%	1.174	86%	0.857	S	S	*	*			trans	65.5	0	-166	-61	-177.4	179.9	177	0	115.1

Retrieved 1,001 of 1,001 residues in 1500.9 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).