G4LVH5_SCHMA Loading...

Serine/threonine-protein

Serine/threonine-protein kinase. Involved in the specific phosphorylation of microtubule-associated proteins for MAP2 and MAP4. Phosphorylates the microtubule-associated protein MAPT/TAU. Phosphorylates CDC25C on 'Ser-216'. Regulates localization and activity of some histone deacetylases by mediating phosphorylation of HDAC7, promoting subsequent interaction between HDAC7 and 14-3-3 and export from the nucleus. Regulates localization and activity of MITF by mediating its phosphorylation, promoting subsequent interaction between MITF and 14-3-3 and retention in the cytosol. Negatively regulates the Hippo signaling pathway and antagonizes the phosphorylation of LATS1. Cooperates with DLG5 to inhibit the kinase activity of STK3/MST2 toward LATS1. Phosphorylates PKP2 and KSR1.

AlphaFold DB (A0A3Q0KCJ0), UniProt , Accession G4LVH5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,152 aa.

						>G4LVH5_SCHMA|G4LVH5
MATAALAPVAARPPSRSDQQHNGNIQEPNRPLRWRVIDDQPHVGKYRFIRTIGKGNFAKVKLASHVITGQQVAIKIIDKTQLSPSSRQKLFREVRLMKLLDHPNIVKLFEIIDNDKILYLVMEYASGGEVFDYLVAHGRMKEKEARAKFRQIVSAVQYCHQKHIIHRDLKAENLLLDADMNIKLADFGFSNEFSPGTKLDTFCGSPPYAAPELFQGKKYDGPEVDVWSLGVILYTLVSGSLPFDGQTLRELRERVLRGKYRIPFYMSTDCESLLKKMLVLNPSKRYTLEMVMKDRWMNTGYEDNVLSPYIEPEPDYTDPVRIEIMVNMGFSRDEIEKSLTQGNFDDIMATYLLLDRRRSSLDTSSRDGSSLSLRQSTHLLSATSNPAASPLISTGGVNCASVEHTSNICPDDTLSVLPTNADTGPMNQNAHSSSKFTVNPGSATRSTSTTPPSTVTVVNNGANNKPAVNIITPSSCTSGSESSGTTGTSTISPISPVSLASTNTYSSSSGNANVNYNTALNAIEASCPSSNVESIKLMRNDLVRASDRPGREESSRILARLRGFTDEMATPVVGGGGLTAYPNVPGQRTSIDAGTSTVRPTTAGQRKPIPITSQGLGANTKSSPNSNSAMARRTHTMNYGTTTPTSGDQQHSVRRQPINANASGRNTCAFDNANPRNSVALSGITGLSGGSALSPSSDKSTSGSSSGSANNQVTTNGAGRLPSHEIRSHVTPALVPMTTRTNKVHHGANISSGTGGAYHAGLLLERSATLNTAGSGTSGNGTSSNQCASSTRGSDVVGAGELHRNQPCANIAGRSGVNDHAVTSFNRNDLTYSSLRMGTSTSQAGCHTTSVAARRLITNTNNNTSSGFNNGIGTILETTPFPRLTPERRTIHSTNSPNIDFDFDTNNQNSNNTVAARCINVSLAGAGATNSSGVTHLTPGTGLTFFKALTSKIGRRGPNSGAMGNMSQALTGGTDISNVPFSTADSNIGASTTSSGSGYLPGDSVFSDSSVHGAYTEPVSQLTPGGSSAGSPVPQGGNQTVPHTDDNVNDQTKPRSLRFTWSMKTTSSMCPDNMIKEIKKVLTANNCEYDQRERYLLICEHGDPSTDANVQWEMEVCKLPRLSLNGVRFKRISGTSIGFKSIASQIANDLKL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.9	Very low	36.2	Very low	246 Å²	246	126.1 Å²	126.1	100%	1.212	84%	0.843	S	S	*	*				0	146.3	0	-55.4	169.1	-175.5	0	0	107.1
2	A	30	Very low	36.6	Very low	82 Å²	82	134 Å²	134	68%	0.678	84%	0.842	S	S	*	*			cis	-176.3	154.3	-24.2	0	0	0	0	0	105.7
3	T	33.5	Very low	37	Very low	131 Å²	131	132.2 Å²	132.2	80%	0.804	83%	0.833	S	S	*	*			trans	40.7	102.5	164.5	48.8	0	0	0	0	117.8
4	A	31.7	Very low	37.5	Very low	97 Å²	97	131.4 Å²	131.4	80%	0.802	83%	0.829	S	S	*	*				57.8	126.7	62.7	0	0	0	0	0	115.1
5	A	34	Very low	37.4	Very low	90 Å²	90	129.7 Å²	129.7	74%	0.744	82%	0.823	S	S	*	*			trans	155.9	144.7	130.4	0	0	0	0	0	114.9
6	L	35	Very low	37.7	Very low	177 Å²	177	137.8 Å²	137.8	93%	0.927	83%	0.833	S	S	*	*			trans	72.3	136.6	151.7	-66.9	157.5	0	0	0	121.2
7	A	39.6	Very low	37.6	Very low	87 Å²	87	135.4 Å²	135.4	72%	0.719	82%	0.824	S	S	*	*			trans	-118.2	177.6	167.5	0	0	0	0	0	109.5
8	P	45	Very low	37.5	Very low	133 Å²	133	135.6 Å²	135.6	86%	0.864	82%	0.819	S	S	*	*			trans	-134.7	166.1	141.5	37	-25.2	0	0	0	114.7
9	V	37.3	Very low	37.5	Very low	146 Å²	146	139.1 Å²	139.1	89%	0.885	83%	0.826	S	S	*	*			trans	-105.8	145.2	-177.8	170.2	0	0	0	0	110.6
10	A	36.9	Very low	37.4	Very low	94 Å²	94	141.3 Å²	141.3	78%	0.777	83%	0.827	S	S	*	*			trans	-157.4	147.9	160.1	0	0	0	0	0	115.6
11	A	38.7	Very low	37.4	Very low	104 Å²	104	142.6 Å²	142.6	86%	0.86	83%	0.825	S	S	*	*			trans	68.7	113.2	151.2	0	0	0	0	0	122.2
12	R	40.4	Very low	37.5	Very low	221 Å²	221	137.6 Å²	137.6	83%	0.834	80%	0.803	S	S	*	*			trans	-142.2	129.3	155.3	176.7	-166.8	-179.9	-119.5	1.3	109.1
13	P	42.3	Very low	37.7	Very low	111 Å²	111	137.3 Å²	137.3	72%	0.721	81%	0.808	S	S	*	*			trans	-149.5	-176	142.9	38.7	-22.3	0	0	0	112.8
14	P	43.4	Very low	37.7	Very low	120 Å²	120	138.2 Å²	138.2	78%	0.779	81%	0.808	S	S	*	*			cis	-124	-172.6	-34.1	28.1	-7.9	0	0	0	111.9
15	S	35.8	Very low	38.3	Very low	107 Å²	107	140.8 Å²	140.8	75%	0.748	81%	0.807	S	S	*	*			trans	-122.4	145.4	171.3	51.4	0	0	0	0	111.7
16	R	43	Very low	38.2	Very low	259 Å²	259	145 Å²	145	98%	0.977	81%	0.812	S	S	*	*			trans	-143.9	162.7	164.5	-91.1	-168	172.9	-176.8	-2.4	110.7
17	S	35.8	Very low	38.3	Very low	96 Å²	96	144.7 Å²	144.7	67%	0.671	81%	0.805	S	S	*	*			trans	-124.5	173.3	-165.3	61.3	0	0	0	0	113.6
18	D	35	Very low	38	Very low	139 Å²	139	146.2 Å²	146.2	74%	0.743	81%	0.808	S	S	*	*			trans	61.1	107.7	155.4	-48.7	-49.5	0	0	0	120.2
19	Q	39.1	Very low	37.5	Very low	203 Å²	203	147.1 Å²	147.1	95%	0.949	81%	0.805	S	S	*	*				-160.4	156.8	121.8	-108.6	169.4	28	0	0	111.9
20	Q	33.9	Very low	37.7	Very low	183 Å²	183	150.5 Å²	150.5	86%	0.855	80%	0.802	S	S	*	*			trans	-116	139.2	-174	-59.6	171.5	-11	0	0	111.3
21	H	39.2	Very low	37.6	Very low	168 Å²	168	151.7 Å²	151.7	78%	0.778	80%	0.802	S	S	*	*				-175.8	160.7	127	-117.4	-73.4	0	0	0	113.1
22	N	37.6	Very low	37.4	Very low	142 Å²	142	154.9 Å²	154.9	76%	0.759	80%	0.804	S	S	*	*			trans	21.6	116.7	159.9	-61.5	1.8	0	0	0	117.8
23	G	33.6	Very low	37.1	Very low	76 Å²	76	155.4 Å²	155.4	78%	0.784	81%	0.806	S	S	*	*			cis	93.9	112.2	20.8	0	0	0	0	0	111.6
24	N	35.2	Very low	36.9	Very low	150 Å²	150	159.3 Å²	159.3	80%	0.802	81%	0.806	S	S	*	*			trans	-158.7	133.2	160.5	-140.5	1.5	0	0	0	112.9
25	I	42.9	Very low	36.6	Very low	151 Å²	151	164.7 Å²	164.7	77%	0.774	81%	0.811	S	S	*	*			trans	59.1	131.7	158.7	-63.6	154.6	0	0	0	119.3
26	Q	33.2	Very low	36.6	Very low	179 Å²	179	166.4 Å²	166.4	84%	0.836	82%	0.817	S	S	*	*			trans	-102.1	143.2	173.5	-63.1	163.3	-44.8	0	0	110.4
27	E	35.6	Very low	36.6	Very low	169 Å²	169	157.4 Å²	157.4	79%	0.79	79%	0.787	S	S	*	*			trans	-102	117.2	161.8	-84.1	-154.3	138.5	0	0	111.1	N29	E27-N29 PolarHBondContact O-N 3.27Å
28	P	34	Very low	37.1	Very low	120 Å²	120	158 Å²	158	78%	0.779	78%	0.783	S	S	*	*			trans	-98.5	63	178.6	38.2	-34.2	0	0	0	112.6
29	N	35.3	Very low	38.1	Very low	152 Å²	152	159.8 Å²	159.8	81%	0.813	79%	0.793	S	S	*	*			trans	-168.5	115	158.6	-109.3	-39.5	0	0	0	113.9	E27	E27-N29 PolarHBondContact O-N 3.27Å
30	R	39.8	Very low	39.1	Very low	216 Å²	216	154.6 Å²	154.6	82%	0.815	77%	0.768	S	S	*	*			trans	-139.8	132.2	152.6	-73	-168.7	178.2	-112.2	-5.2	109
31	P	35.7	Very low	41.4	Very low	120 Å²	120	149.6 Å²	149.6	78%	0.779	75%	0.752	S	S	*	*			trans	-63.5	160.9	178.4	28.1	-35.3	0	0	0	110.9	R33	P31-R33 VanDerWaalsContact C-N 3.28Å; P31-R33 PolarHBondContact O-N 3.26Å
32	L	35.3	Very low	43.7	Very low	171 Å²	171	148.4 Å²	148.4	90%	0.895	75%	0.746	S	S	*	*			trans	-61.6	83	-176.1	-68.4	171.3	0	0	0	112.1	W34	L32-W34 PolarHBondContact O-N 3.08Å
33	R	34	Very low	46.3	Very low	232 Å²	232	142.3 Å²	142.3	88%	0.875	71%	0.714	S	S	*	*			trans	-66.4	103.2	174.1	-176.6	178.8	-177.6	179.8	1.3	108.2	P31 R35	P31-R33 VanDerWaalsContact C-N 3.28Å; P31-R33 PolarHBondContact O-N 3.26Å; R33-R35 PolarHBondContact O-N 3.39Å
34	W	37.1	Very low	49.1	Very low	192 Å²	192	141 Å²	141	73%	0.727	70%	0.701	S	S	*	*			trans	-38.6	111.6	175.1	-59.5	100.1	0	0	0	110.7	L32 V66	L32-W34 PolarHBondContact O-N 3.08Å; W34-V66 HydrophobicContact CZ3-CG1 4.13Å
35	R	36.8	Very low	51.9	Low	233 Å²	233	137.6 Å²	137.6	88%	0.879	68%	0.679	S	S	*	*			trans	-67.4	146.3	169.5	-67.9	-167.7	-176.7	-155.9	3.6	108	R33 I37	R33-R35 PolarHBondContact O-N 3.39Å; R35-I37 PolarHBondContact O-N 3.33Å
36	V	36.5	Very low	54.5	Low	143 Å²	143	130.4 Å²	130.4	87%	0.867	64%	0.642	S	S	*	*			trans	-42.9	120.8	-177.9	-177.8	0	0	0	0	110.1
37	I	42.9	Very low	57.5	Low	71 Å²	71	125.3 Å²	125.3	36%	0.364	62%	0.615	S	S	.	*			trans	-84.1	132.9	169.9	-63.1	178.6	0	0	0	106.3	R35 R47 V66	R35-I37 PolarHBondContact O-N 3.33Å; I37-R47 VanDerWaalsContact CG2-CZ 3.5Å; I37-V66 HydrophobicContact CD1-CG1 4.15Å
38	D	47.3	Very low	60.3	Low	108 Å²	108	118.1 Å²	118.1	58%	0.578	58%	0.581	S	S	*	*			trans	-53.7	160.2	178.9	-46	-83.4	0	0	0	112.5	Q40	D38-Q40 PolarHBondContact O-N 3.23Å
39	D	56.1	Low	63.3	Low	177 Å²	177	116.5 Å²	116.5	95%	0.947	57%	0.565	S	S	*	*	S	Bend	trans	-62.1	19.5	-173.5	-57.8	-70.2	0	0	0	116.7
40	Q	59.9	Low	66.1	Low	93 Å²	93	115.6 Å²	115.6	44%	0.435	55%	0.55	S	S	.	*			trans	-71.8	129.6	172.8	-63.5	-177.9	1.7	0	0	110.6	D38 H42 R47	D38-Q40 PolarHBondContact O-N 3.23Å; Q40-H42 PolarHBondContact O-N 2.58Å; Q40-R47 HydrophobicContact CB-CG 4.18Å
41	P	81.3	Confident	68.6	Low	79 Å²	79	108.1 Å²	108.1	51%	0.513	53%	0.529	S	S	.	.			trans	-64.3	138.9	-177.9	25.8	-34.3	0	0	0	111.6	F48	P41-F48 HydrophobicContact CB-CD2 4.27Å; P41-F48 HydrophobicContact CG-CD2 4.31Å; P41-F48 WeakPolarHBondContact O-CB 3.05Å; P41-F48 WeakPolarHBondContact O-CD2 3.46Å; P41-F48 PolarHBondContact O-N 3.24Å
42	H	87.1	Confident	71.3	Confident	143 Å²	143	105.3 Å²	105.3	66%	0.662	51%	0.507	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.6	163.6	176.4	64.8	94.2	0	0	0	111.8	Q40 Y46	Q40-H42 PolarHBondContact O-N 2.58Å; H42-Y46 CarbonylContact C-O 3.53Å; H42-Y46 WeakPolarHBondContact CA-O 3.15Å; H42-Y46 VanDerWaalsContact CB-O 3.23Å; H42-Y46 WeakPolarHBondContact CB-O 3.3Å
43	V	92.4	Very high	73.8	Confident	13 Å²	13	98.4 Å²	98.4	8%	0.079	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	133.4	168.2	67.8	0	0	0	0	108.2	K45 Y46 F48 I74 I112 Y119	V43-K45 PolarHBondContact O-N 3.45Å; V43-Y46 PolarHBondContact N-O 3.03Å; V43-Y46 WeakPolarHBondContact O-CA 3.12Å; V43-Y46 WeakPolarHBondContact O-CB 3.41Å; V43-Y46 WeakPolarHBondContact O-CD2 3.28Å; V43-Y46 PolarHBondContact O-N 2.82Å; V43-F48 HydrophobicContact CB-CE2 4.05Å; V43-F48 HydrophobicContact CB-CZ 3.93Å; V43-F48 HydrophobicContact CG1-CE1 3.92Å; V43-F48 HydrophobicContact CG1-CE2 3.94Å; V43-F48 HydrophobicContact CG1-CZ 3.39Å; V43-I74 HydrophobicContact CG1-CD1 4.03Å; V43-I112 HydrophobicContact CG1-CD1 4.36Å; V43-I112 HydrophobicContact CG2-CD1 3.92Å; V43-Y119 HydrophobicContact CB-CD1 4.43Å; V43-Y119 HydrophobicContact CB-CE1 4.27Å; V43-Y119 HydrophobicContact CG1-CD1 4.12Å; V43-Y119 HydrophobicContact CG1-CE1 4.36Å; V43-Y119 HydrophobicContact CG2-CD1 3.94Å; V43-Y119 HydrophobicContact CG2-CD2 4.12Å; V43-Y119 HydrophobicContact CG2-CE1 3.83Å; V43-Y119 HydrophobicContact CG2-CE2 4.02Å; V43-Y119 HydrophobicContact CG2-CG 4.11Å
44	G	92.7	Very high	76.2	Confident	49 Å²	49	95.3 Å²	95.3	51%	0.505	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.5	-126.5	-172.6	0	0	0	0	0	111.3
45	K	93.5	Very high	77.9	Confident	78 Å²	78	88.8 Å²	88.8	34%	0.339	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	15.5	174.5	-48.3	-62	-179.7	167.9	0	114.1	V43 H65 V66 I67 D346	V43-K45 PolarHBondContact O-N 3.45Å; K45-H65 WeakPolarHBondContact CB-NE2 3.26Å; K45-H65 PolarHBondContact O-CD2 2.67Å; K45-V66 VanDerWaalsContact O-CB 3.31Å; K45-V66 WeakPolarHBondContact O-CB 3.09Å; K45-V66 VanDerWaalsContact O-CG2 3.29Å; K45-V66 WeakPolarHBondContact O-CG2 3.36Å; K45-V66 PolarHBondContact O-N 3Å; K45-I67 HydrophobicContact CB-CD1 4.38Å; K45-I67 HydrophobicContact CB-CG1 4.48Å; K45-I67 HydrophobicContact CD-CD1 4.02Å; K45-I67 HydrophobicContact CG-CD1 4Å; K45-D346 WeakPolarHBondContact CE-OD2 3.46Å; K45-D346 HydrophobicContact CG-CB 4.08Å; K45-D346 IonicContact NZ-OD2 3.1Å; K45-D346 PolarHBondContact NZ-OD2 3.43Å
46	Y	97.4	Very high	79.6	Confident	0 Å²	0	83.5 Å²	83.5	0%	0	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	128.4	-169.1	-55.7	-83.4	0	0	0	113.5	H42 V43 S64 H65 V72 I74 E110 I112 V121 L353	H42-Y46 CarbonylContact C-O 3.53Å; H42-Y46 WeakPolarHBondContact CA-O 3.15Å; H42-Y46 VanDerWaalsContact CB-O 3.23Å; H42-Y46 WeakPolarHBondContact CB-O 3.3Å; V43-Y46 PolarHBondContact N-O 3.03Å; V43-Y46 WeakPolarHBondContact O-CA 3.12Å; V43-Y46 WeakPolarHBondContact O-CB 3.41Å; V43-Y46 WeakPolarHBondContact O-CD2 3.28Å; V43-Y46 PolarHBondContact O-N 2.82Å; Y46-S64 WeakPolarHBondContact CA-O 3.3Å; Y46-H65 HydrophobicContact CD1-CB 3.83Å; Y46-H65 AromaticContact CD1-CD2 3.83Å; Y46-H65 HydrophobicContact CE1-CB 3.61Å; Y46-H65 AromaticContact CE1-CD2 3.37Å; Y46-H65 WeakPolarHBondContact CE1-CD2 3.3Å; Y46-H65 AromaticContact CE1-CG 3.65Å; Y46-H65 AromaticContact CZ-CD2 3.7Å; Y46-V72 HydrophobicContact CD1-CG2 3.58Å; Y46-V72 HydrophobicContact CE1-CG1 4.42Å; Y46-V72 HydrophobicContact CE1-CG2 3.81Å; Y46-I74 HydrophobicContact CD1-CD1 4.39Å; Y46-I74 HydrophobicContact CD2-CD1 4.28Å; Y46-I74 HydrophobicContact CG-CD1 3.86Å; Y46-E110 VanDerWaalsContact CE2-OE2 3.24Å; Y46-E110 WeakPolarHBondContact CE2-OE2 3.11Å; Y46-E110 PolarHBondContact OH-OE2 3.04Å; Y46-I112 HydrophobicContact CD2-CD1 4.41Å; Y46-V121 HydrophobicContact CD1-CG1 4.39Å; Y46-V121 HydrophobicContact CD2-CG2 4.17Å; Y46-V121 HydrophobicContact CE1-CG1 3.78Å; Y46-V121 HydrophobicContact CE2-CG1 4.23Å; Y46-V121 HydrophobicContact CE2-CG2 3.8Å; Y46-L353 HydrophobicContact CE1-CD1 4.06Å
47	R	96.3	Very high	81.6	Confident	72 Å²	72	81.9 Å²	81.9	27%	0.272	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	121.8	172.9	-165.1	-171	-47.8	-171.7	3.8	109.6	I37 Q40 A63 S64 V66	I37-R47 VanDerWaalsContact CG2-CZ 3.5Å; Q40-R47 HydrophobicContact CB-CG 4.18Å; R47-A63 CarbonylContact O-C 3.57Å; R47-A63 WeakPolarHBondContact O-CA 3.33Å; R47-A63 VanDerWaalsContact O-CB 3.25Å; R47-A63 WeakPolarHBondContact O-CB 3.22Å; R47-S64 PolarHBondContact N-O 3.42Å; R47-S64 PolarHBondContact O-N 3.07Å; R47-V66 HydrophobicContact CB-CG2 4.14Å
48	F	96	Very high	83.6	Confident	18 Å²	18	79.7 Å²	79.7	8%	0.079	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	132.5	177.7	-69.6	-56.7	0	0	0	111.5	P41 V43 K61 A63 I74 I76 Y119	P41-F48 HydrophobicContact CB-CD2 4.27Å; P41-F48 HydrophobicContact CG-CD2 4.31Å; P41-F48 WeakPolarHBondContact O-CB 3.05Å; P41-F48 WeakPolarHBondContact O-CD2 3.46Å; P41-F48 PolarHBondContact O-N 3.24Å; V43-F48 HydrophobicContact CB-CE2 4.05Å; V43-F48 HydrophobicContact CB-CZ 3.93Å; V43-F48 HydrophobicContact CG1-CE1 3.92Å; V43-F48 HydrophobicContact CG1-CE2 3.94Å; V43-F48 HydrophobicContact CG1-CZ 3.39Å; F48-K61 HydrophobicContact CB-CD 3.97Å; F48-K61 HydrophobicContact CD1-CB 3.77Å; F48-K61 HydrophobicContact CD1-CD 3.35Å; F48-K61 HydrophobicContact CD1-CG 4.23Å; F48-K61 HydrophobicContact CD2-CD 4.17Å; F48-K61 HydrophobicContact CE1-CB 4.11Å; F48-K61 HydrophobicContact CE1-CD 3.74Å; F48-K61 HydrophobicContact CE1-CG 4.49Å; F48-K61 HydrophobicContact CG-CD 3.58Å; F48-K61 HydrophobicContact CZ-CD 4.31Å; F48-A63 HydrophobicContact CD1-CB 4.18Å; F48-I74 HydrophobicContact CD1-CD1 4.45Å; F48-I74 HydrophobicContact CE1-CB 4.2Å; F48-I74 HydrophobicContact CE1-CD1 3.92Å; F48-I74 HydrophobicContact CE1-CG2 4.24Å; F48-I76 HydrophobicContact CE1-CD1 3.88Å; F48-I76 HydrophobicContact CZ-CD1 3.76Å; F48-Y119 HydrophobicContact CZ-CD1 4.3Å; F48-Y119 HydrophobicContact CZ-CE1 4.06Å
49	I	95.1	Very high	85.7	Confident	87 Å²	87	79.2 Å²	79.2	45%	0.446	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	-61.9	179.6	-61.4	172.3	0	0	0	110.5	L62	I49-L62 HydrophobicContact CB-CD2 4.5Å; I49-L62 HydrophobicContact CB-CG 4.28Å; I49-L62 HydrophobicContact CD1-CG 4.27Å; I49-L62 HydrophobicContact CG2-CD2 4.34Å; I49-L62 PolarHBondContact N-O 2.84Å
50	R	94.3	Very high	87.6	Confident	132 Å²	132	72.4 Å²	72.4	50%	0.498	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	158.3	-176.9	63.6	-176.5	-179.4	109.6	0.5	112.3	I52 K61 L62 Y124	R50-I52 HydrophobicContact CG-CG2 4.08Å; R50-K61 CarbonylContact O-C 3.55Å; R50-K61 VanDerWaalsContact O-CA 3.25Å; R50-K61 WeakPolarHBondContact O-CA 3.18Å; R50-L62 HydrophobicContact CG-CB 4.01Å; R50-L62 HydrophobicContact CG-CD2 4.14Å; R50-L62 PolarHBondContact N-O 3.25Å; R50-L62 PolarHBondContact O-N 2.89Å; R50-Y124 PolarHBondContact NH2-OH 2.99Å; R50-Y124 VanDerWaalsContact NH2-OH 3.13Å
51	T	93.6	Very high	89.3	Confident	59 Å²	59	70 Å²	70	36%	0.362	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	130.2	168.4	-56.2	0	0	0	0	109	G53 K54 K59	T51-G53 WeakPolarHBondContact CG2-O 3.5Å; T51-K54 HydrophobicContact CG2-CG 3.89Å; T51-K59 HydrophobicContact CG2-CD 4.18Å; T51-K59 HydrophobicContact CG2-CG 3.77Å
52	I	92.5	Very high	90	Very high	62 Å²	62	66.5 Å²	66.5	32%	0.318	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	-18.4	177	60.5	176	0	0	0	113	R50 V60 L62 A73 Y124	R50-I52 HydrophobicContact CG-CG2 4.08Å; I52-V60 HydrophobicContact CD1-CG1 3.9Å; I52-V60 HydrophobicContact CG1-CB 4.08Å; I52-V60 HydrophobicContact CG1-CG1 3.74Å; I52-V60 PolarHBondContact N-O 3.16Å; I52-L62 HydrophobicContact CD1-CB 4.4Å; I52-L62 HydrophobicContact CG2-CB 3.74Å; I52-A73 HydrophobicContact CD1-CB 4.09Å; I52-Y124 HydrophobicContact CD1-CD2 3.97Å; I52-Y124 HydrophobicContact CD1-CE2 3.88Å
53	G	87.1	Confident	90.5	Very high	26 Å²	26	59.7 Å²	59.7	27%	0.268	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	150.7	174.4	0	0	0	0	0	113.1	T51 V60	T51-G53 WeakPolarHBondContact CG2-O 3.5Å; G53-V60 PolarHBondContact N-O 3.37Å; G53-V60 PolarHBondContact O-N 2.92Å
54	K	84.1	Confident	90.7	Very high	167 Å²	167	60.4 Å²	60.4	73%	0.726	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.7	112.7	175.2	-64	178.7	-175.7	175.3	0	109.1	T51	T51-K54 HydrophobicContact CG2-CG 3.89Å
55	G	73.3	Confident	90.9	Very high	54 Å²	54	58.1 Å²	58.1	56%	0.557	30%	0.298	S	S	*	.			trans	-105.4	-174.9	171	0	0	0	0	0	111.9	A58	G55-A58 WeakPolarHBondContact CA-O 3.4Å; G55-A58 PolarHBondContact N-O 3.1Å
56	N	73.2	Confident	90.9	Very high	122 Å²	122	56.5 Å²	56.5	65%	0.652	29%	0.294	S	S	*	.	S	Bend	trans	-67.6	-37.6	-178.7	-70.8	-33.7	0	0	0	113.6
57	F	76.9	Confident	90.6	Very high	110 Å²	110	58.6 Å²	58.6	48%	0.482	31%	0.305	S	S	.	.	S	Bend	trans	-122.6	3.8	-175.8	-51.5	-71.4	0	0	0	113.2	L82	F57-L82 HydrophobicContact CB-CD2 3.86Å; F57-L82 HydrophobicContact CD1-CD2 4.37Å; F57-L82 HydrophobicContact CG-CD2 4.09Å
58	A	86.5	Confident	90.4	Very high	24 Å²	24	56.9 Å²	56.9	20%	0.198	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	149.5	-170.7	0	0	0	0	0	111.9	G55 K75 I76 I77	G55-A58 WeakPolarHBondContact CA-O 3.4Å; G55-A58 PolarHBondContact N-O 3.1Å; A58-K75 HydrophobicContact CB-CG 4.35Å; A58-I76 CarbonylContact C-O 3.51Å; A58-I76 WeakPolarHBondContact CA-O 3.42Å; A58-I77 HydrophobicContact CB-CG1 3.98Å
59	K	91.4	Very high	90.3	Very high	98 Å²	98	58.3 Å²	58.3	43%	0.426	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	124.4	175.8	-174.9	179.4	-64.9	170.2	0	109	T51 I76	T51-K59 HydrophobicContact CG2-CD 4.18Å; T51-K59 HydrophobicContact CG2-CG 3.77Å; K59-I76 PolarHBondContact N-O 3.13Å; K59-I76 WeakPolarHBondContact O-CB 3.36Å; K59-I76 WeakPolarHBondContact O-CG1 3.17Å; K59-I76 PolarHBondContact O-N 2.98Å
60	V	94.3	Very high	90.2	Very high	35 Å²	35	59.2 Å²	59.2	21%	0.212	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	124.9	178.6	-167.8	0	0	0	0	109	I52 G53 A73 I74 K75 M122	I52-V60 HydrophobicContact CD1-CG1 3.9Å; I52-V60 HydrophobicContact CG1-CB 4.08Å; I52-V60 HydrophobicContact CG1-CG1 3.74Å; I52-V60 PolarHBondContact N-O 3.16Å; G53-V60 PolarHBondContact N-O 3.37Å; G53-V60 PolarHBondContact O-N 2.92Å; V60-A73 HydrophobicContact CG1-CB 4.21Å; V60-I74 CarbonylContact C-O 3.58Å; V60-I74 VanDerWaalsContact CA-O 3.32Å; V60-I74 WeakPolarHBondContact CA-O 3.13Å; V60-K75 HydrophobicContact CG2-CB 4.37Å; V60-K75 HydrophobicContact CG2-CG 4.25Å; V60-M122 HydrophobicContact CG1-CE 4.46Å
61	K	96.3	Very high	90.3	Very high	42 Å²	42	57.3 Å²	57.3	18%	0.183	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	140.8	173.3	-71.3	-170.8	-178.8	-179.6	0	110.9	F48 R50 I74 I76	F48-K61 HydrophobicContact CB-CD 3.97Å; F48-K61 HydrophobicContact CD1-CB 3.77Å; F48-K61 HydrophobicContact CD1-CD 3.35Å; F48-K61 HydrophobicContact CD1-CG 4.23Å; F48-K61 HydrophobicContact CD2-CD 4.17Å; F48-K61 HydrophobicContact CE1-CB 4.11Å; F48-K61 HydrophobicContact CE1-CD 3.74Å; F48-K61 HydrophobicContact CE1-CG 4.49Å; F48-K61 HydrophobicContact CG-CD 3.58Å; F48-K61 HydrophobicContact CZ-CD 4.31Å; R50-K61 CarbonylContact O-C 3.55Å; R50-K61 VanDerWaalsContact O-CA 3.25Å; R50-K61 WeakPolarHBondContact O-CA 3.18Å; K61-I74 PolarHBondContact N-O 3.2Å; K61-I74 PolarHBondContact O-N 3.48Å; K61-I76 HydrophobicContact CD-CD1 3.83Å; K61-I76 HydrophobicContact CG-CD1 3.98Å
62	L	96.7	Very high	90.5	Very high	5 Å²	5	54.5 Å²	54.5	3%	0.026	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	134.6	158.9	178.1	61.7	0	0	0	108.6	I49 R50 I52 Q71 Y124	I49-L62 HydrophobicContact CB-CD2 4.5Å; I49-L62 HydrophobicContact CB-CG 4.28Å; I49-L62 HydrophobicContact CD1-CG 4.27Å; I49-L62 HydrophobicContact CG2-CD2 4.34Å; I49-L62 PolarHBondContact N-O 2.84Å; R50-L62 HydrophobicContact CG-CB 4.01Å; R50-L62 HydrophobicContact CG-CD2 4.14Å; R50-L62 PolarHBondContact N-O 3.25Å; R50-L62 PolarHBondContact O-N 2.89Å; I52-L62 HydrophobicContact CD1-CB 4.4Å; I52-L62 HydrophobicContact CG2-CB 3.74Å; L62-Q71 HydrophobicContact CD1-CB 4.11Å; L62-Y124 HydrophobicContact CD1-CD1 3.44Å; L62-Y124 VanDerWaalsContact CD1-CD1 3.44Å; L62-Y124 HydrophobicContact CD1-CD2 4Å; L62-Y124 HydrophobicContact CD1-CE1 3.53Å; L62-Y124 HydrophobicContact CD1-CE2 4.12Å; L62-Y124 HydrophobicContact CD1-CG 3.69Å; L62-Y124 HydrophobicContact CD2-CE1 4.16Å; L62-Y124 HydrophobicContact CG-CE1 4.48Å
63	A	97.4	Very high	90.7	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	164.7	173.4	0	0	0	0	0	110.5	R47 F48 Q71 V72 I74	R47-A63 CarbonylContact O-C 3.57Å; R47-A63 WeakPolarHBondContact O-CA 3.33Å; R47-A63 VanDerWaalsContact O-CB 3.25Å; R47-A63 WeakPolarHBondContact O-CB 3.22Å; F48-A63 HydrophobicContact CD1-CB 4.18Å; A63-Q71 WeakPolarHBondContact O-CA 3.32Å; A63-V72 HydrophobicContact CB-CG2 4.06Å; A63-V72 PolarHBondContact N-O 3.35Å; A63-V72 PolarHBondContact O-N 3.18Å; A63-I74 HydrophobicContact CB-CD1 3.58Å; A63-I74 HydrophobicContact CB-CG1 4.04Å
64	S	96.6	Very high	91.2	Very high	29 Å²	29	50.6 Å²	50.6	20%	0.203	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	134.6	166.7	169.2	0	0	0	0	109.2	Y46 R47 V66 G69 Q70	Y46-S64 WeakPolarHBondContact CA-O 3.3Å; R47-S64 PolarHBondContact N-O 3.42Å; R47-S64 PolarHBondContact O-N 3.07Å; S64-V66 PolarHBondContact O-N 3.15Å; S64-G69 PolarHBondContact OG-O 3.1Å; S64-Q70 WeakPolarHBondContact CA-O 3.19Å
65	H	95.9	Very high	91.7	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	119.1	171.3	-173.5	-139.2	0	0	0	109.4	K45 Y46 I67 T68 G69 Q70 T350 L353	K45-H65 WeakPolarHBondContact CB-NE2 3.26Å; K45-H65 PolarHBondContact O-CD2 2.67Å; Y46-H65 HydrophobicContact CD1-CB 3.83Å; Y46-H65 AromaticContact CD1-CD2 3.83Å; Y46-H65 HydrophobicContact CE1-CB 3.61Å; Y46-H65 AromaticContact CE1-CD2 3.37Å; Y46-H65 WeakPolarHBondContact CE1-CD2 3.3Å; Y46-H65 AromaticContact CE1-CG 3.65Å; Y46-H65 AromaticContact CZ-CD2 3.7Å; H65-I67 VanDerWaalsContact C-N 3.26Å; H65-I67 PolarHBondContact O-N 3Å; H65-T68 PolarHBondContact ND1-OG1 2.91Å; H65-G69 CarbonylContact O-C 3.46Å; H65-G69 WeakPolarHBondContact O-CA 3.25Å; H65-G69 PolarHBondContact O-N 3.31Å; H65-Q70 PolarHBondContact N-O 3.14Å; H65-T350 PolarHBondContact CE1-OG1 3.4Å; H65-L353 HydrophobicContact CB-CD1 4.05Å
66	V	93.6	Very high	92.7	Very high	44 Å²	44	42.4 Å²	42.4	27%	0.267	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-26	-170.4	175.9	0	0	0	0	112.4	W34 I37 K45 R47 S64	W34-V66 HydrophobicContact CZ3-CG1 4.13Å; I37-V66 HydrophobicContact CD1-CG1 4.15Å; K45-V66 VanDerWaalsContact O-CB 3.31Å; K45-V66 WeakPolarHBondContact O-CB 3.09Å; K45-V66 VanDerWaalsContact O-CG2 3.29Å; K45-V66 WeakPolarHBondContact O-CG2 3.36Å; K45-V66 PolarHBondContact O-N 3Å; R47-V66 HydrophobicContact CB-CG2 4.14Å; S64-V66 PolarHBondContact O-N 3.15Å
67	I	91	Very high	93.6	Very high	44 Å²	44	37 Å²	37	23%	0.226	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-49.8	-179.7	-52.8	177.4	0	0	0	111.6	K45 H65 M328 F330 T350	K45-I67 HydrophobicContact CB-CD1 4.38Å; K45-I67 HydrophobicContact CB-CG1 4.48Å; K45-I67 HydrophobicContact CD-CD1 4.02Å; K45-I67 HydrophobicContact CG-CD1 4Å; H65-I67 VanDerWaalsContact C-N 3.26Å; H65-I67 PolarHBondContact O-N 3Å; I67-M328 HydrophobicContact CG2-CE 3.86Å; I67-M328 HydrophobicContact CG2-CG 4.24Å; I67-M328 HydrophobicContact CG2-SD 3.41Å; I67-M328 WeakPolarHBondContact CG2-SD 3.45Å; I67-F330 HydrophobicContact CD1-CE2 4.32Å; I67-F330 HydrophobicContact CD1-CZ 4Å; I67-T350 HydrophobicContact CG2-CG2 4.35Å
68	T	92.7	Very high	94.2	Very high	37 Å²	37	33.9 Å²	33.9	23%	0.227	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-6.7	-175.3	65.9	0	0	0	0	114.2	H65 Q70 T350 L353 L354	H65-T68 PolarHBondContact ND1-OG1 2.91Å; T68-Q70 PolarHBondContact O-N 3.21Å; T68-Q70 VanDerWaalsContact O-N 3.12Å; T68-T350 HydrophobicContact CG2-CG2 4.26Å; T68-L353 HydrophobicContact CG2-CB 4.3Å; T68-L353 PolarHBondContact OG1-O 3.31Å; T68-L354 HydrophobicContact CG2-CD2 3.83Å; T68-L354 HydrophobicContact CG2-CG 3.87Å
69	G	92.9	Very high	94.4	Very high	47 Å²	47	34.1 Å²	34.1	49%	0.485	18%	0.184	S	C	.	.			trans	74.8	-18.1	-173.5	0	0	0	0	0	114.8	S64 H65	S64-G69 PolarHBondContact OG-O 3.1Å; H65-G69 CarbonylContact O-C 3.46Å; H65-G69 WeakPolarHBondContact O-CA 3.25Å; H65-G69 PolarHBondContact O-N 3.31Å
70	Q	94.5	Very high	94.3	Very high	106 Å²	106	33.7 Å²	33.7	50%	0.495	19%	0.19	S	C	.	.			trans	-59.9	140.9	-169.7	-176.1	58.5	6	0	0	113.2	S64 H65 T68 L353	S64-Q70 WeakPolarHBondContact CA-O 3.19Å; H65-Q70 PolarHBondContact N-O 3.14Å; T68-Q70 PolarHBondContact O-N 3.21Å; T68-Q70 VanDerWaalsContact O-N 3.12Å; Q70-L353 HydrophobicContact CB-CD2 4.26Å; Q70-L353 HydrophobicContact CG-CD2 3.81Å
71	Q	96.4	Very high	93.8	Very high	92 Å²	92	37.8 Å²	37.8	43%	0.43	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	136.7	178	-69.8	-176	41	0	0	111.8	L62 A63 Y124	L62-Q71 HydrophobicContact CD1-CB 4.11Å; A63-Q71 WeakPolarHBondContact O-CA 3.32Å; Q71-Y124 HydrophobicContact CB-CD1 4.06Å
72	V	97.2	Very high	93.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	155.1	-175.7	-63	0	0	0	0	111.7	Y46 A63 I74 F109 V121 L353	Y46-V72 HydrophobicContact CD1-CG2 3.58Å; Y46-V72 HydrophobicContact CE1-CG1 4.42Å; Y46-V72 HydrophobicContact CE1-CG2 3.81Å; A63-V72 HydrophobicContact CB-CG2 4.06Å; A63-V72 PolarHBondContact N-O 3.35Å; A63-V72 PolarHBondContact O-N 3.18Å; V72-I74 HydrophobicContact CG2-CD1 4.39Å; V72-I74 HydrophobicContact CG2-CG1 4.16Å; V72-F109 HydrophobicContact CG1-CD2 4.12Å; V72-F109 HydrophobicContact CG1-CE2 4.22Å; V72-V121 HydrophobicContact CB-CG1 3.84Å; V72-V121 HydrophobicContact CG1-CG1 4.15Å; V72-V121 HydrophobicContact CG2-CG1 3.76Å; V72-L353 HydrophobicContact CG1-CD1 4.17Å; V72-L353 HydrophobicContact CG1-CD2 3.68Å
73	A	97.1	Very high	92.5	Very high	6 Å²	6	38.8 Å²	38.8	5%	0.05	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	117.3	174.9	0	0	0	0	0	110.1	I52 V60 M122 Y124	I52-A73 HydrophobicContact CD1-CB 4.09Å; V60-A73 HydrophobicContact CG1-CB 4.21Å; A73-M122 HydrophobicContact CB-CE 4.18Å; A73-M122 PolarHBondContact N-O 3.38Å; A73-M122 WeakPolarHBondContact O-CA 3.32Å; A73-M122 WeakPolarHBondContact O-CB 3.48Å; A73-M122 PolarHBondContact O-N 3.28Å; A73-Y124 HydrophobicContact CB-CD2 4.42Å
74	I	96.9	Very high	91.9	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	111.6	-178.3	-53.6	-173	0	0	0	109.8	V43 Y46 F48 V60 K61 A63 V72 I76 Y119 L120 V121	V43-I74 HydrophobicContact CG1-CD1 4.03Å; Y46-I74 HydrophobicContact CD1-CD1 4.39Å; Y46-I74 HydrophobicContact CD2-CD1 4.28Å; Y46-I74 HydrophobicContact CG-CD1 3.86Å; F48-I74 HydrophobicContact CD1-CD1 4.45Å; F48-I74 HydrophobicContact CE1-CB 4.2Å; F48-I74 HydrophobicContact CE1-CD1 3.92Å; F48-I74 HydrophobicContact CE1-CG2 4.24Å; V60-I74 CarbonylContact C-O 3.58Å; V60-I74 VanDerWaalsContact CA-O 3.32Å; V60-I74 WeakPolarHBondContact CA-O 3.13Å; K61-I74 PolarHBondContact N-O 3.2Å; K61-I74 PolarHBondContact O-N 3.48Å; A63-I74 HydrophobicContact CB-CD1 3.58Å; A63-I74 HydrophobicContact CB-CG1 4.04Å; V72-I74 HydrophobicContact CG2-CD1 4.39Å; V72-I74 HydrophobicContact CG2-CG1 4.16Å; I74-I76 HydrophobicContact CG2-CG1 4.12Å; I74-I76 PolarHBondContact O-N 3.47Å; I74-Y119 HydrophobicContact CG2-CD1 4.06Å; I74-L120 CarbonylContact C-O 3.17Å; I74-L120 WeakPolarHBondContact CA-O 3.37Å; I74-V121 HydrophobicContact CD1-CG2 4.15Å; I74-V121 HydrophobicContact CG1-CG1 4.28Å; I74-V121 HydrophobicContact CG1-CG2 4.12Å; I74-V121 HydrophobicContact CG2-CG2 4.47Å
75	K	94.6	Very high	91	Very high	22 Å²	22	46 Å²	46	10%	0.096	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	105.6	173.3	-171.7	174.6	179	-179.1	0	108.5	A58 V60 I77 E93 L120 M122 D186	A58-K75 HydrophobicContact CB-CG 4.35Å; V60-K75 HydrophobicContact CG2-CB 4.37Å; V60-K75 HydrophobicContact CG2-CG 4.25Å; K75-I77 HydrophobicContact CD-CD1 4.28Å; K75-I77 HydrophobicContact CG-CD1 4.09Å; K75-I77 HydrophobicContact CG-CG1 4.09Å; K75-E93 IonicContact NZ-OE1 3.15Å; K75-E93 PolarHBondContact NZ-OE1 2.71Å; K75-E93 IonicContact NZ-OE2 2.62Å; K75-E93 PolarHBondContact NZ-OE2 3.25Å; K75-L120 HydrophobicContact CB-CB 4.35Å; K75-L120 PolarHBondContact N-O 3.1Å; K75-L120 PolarHBondContact O-N 3.32Å; K75-M122 HydrophobicContact CB-CE 3.8Å; K75-M122 HydrophobicContact CB-SD 4.19Å; K75-D186 IonicContact NZ-OD1 2.74Å; K75-D186 PolarHBondContact NZ-OD1 2.99Å
76	I	94.5	Very high	90.3	Very high	27 Å²	27	47.3 Å²	47.3	14%	0.138	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	123.9	-178.1	-47.5	176.6	0	0	0	108.7	F48 A58 K59 K61 I74 I117 Y119	F48-I76 HydrophobicContact CE1-CD1 3.88Å; F48-I76 HydrophobicContact CZ-CD1 3.76Å; A58-I76 CarbonylContact C-O 3.51Å; A58-I76 WeakPolarHBondContact CA-O 3.42Å; K59-I76 PolarHBondContact N-O 3.13Å; K59-I76 WeakPolarHBondContact O-CB 3.36Å; K59-I76 WeakPolarHBondContact O-CG1 3.17Å; K59-I76 PolarHBondContact O-N 2.98Å; K61-I76 HydrophobicContact CD-CD1 3.83Å; K61-I76 HydrophobicContact CG-CD1 3.98Å; I74-I76 HydrophobicContact CG2-CG1 4.12Å; I74-I76 PolarHBondContact O-N 3.47Å; I76-I117 HydrophobicContact CG2-CG2 3.6Å; I76-Y119 HydrophobicContact CB-CD1 4.32Å; I76-Y119 HydrophobicContact CB-CE1 4.47Å; I76-Y119 HydrophobicContact CD1-CD1 4.41Å; I76-Y119 HydrophobicContact CD1-CE1 4.27Å; I76-Y119 HydrophobicContact CG1-CD1 3.85Å; I76-Y119 HydrophobicContact CG1-CE1 4.12Å; I76-Y119 HydrophobicContact CG2-CD1 3.95Å; I76-Y119 HydrophobicContact CG2-CE1 3.71Å
77	I	91.9	Very high	89.8	Confident	8 Å²	8	50 Å²	50	4%	0.041	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	122	-171	-51.1	175.4	0	0	0	109.9	A58 K75 K79 L82 L90 I117 L118 L120	A58-I77 HydrophobicContact CB-CG1 3.98Å; K75-I77 HydrophobicContact CD-CD1 4.28Å; K75-I77 HydrophobicContact CG-CD1 4.09Å; K75-I77 HydrophobicContact CG-CG1 4.09Å; I77-K79 PolarHBondContact O-N 2.81Å; I77-L82 HydrophobicContact CG2-CD1 4.13Å; I77-L90 HydrophobicContact CD1-CD1 3.51Å; I77-L90 HydrophobicContact CG2-CD2 4.03Å; I77-I117 WeakPolarHBondContact O-CA 3.45Å; I77-L118 PolarHBondContact N-O 2.99Å; I77-L118 PolarHBondContact O-N 3.48Å; I77-L120 HydrophobicContact CD1-CD1 4.21Å
78	D	90.2	Very high	89.4	Confident	45 Å²	45	54 Å²	54	24%	0.241	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	107.4	178.5	-175.9	-21.7	0	0	0	110.3	T80 Q81 L82	D78-T80 PolarHBondContact O-N 3.07Å; D78-T80 WeakPolarHBondContact OD1-CA 3.43Å; D78-T80 VanDerWaalsContact OD1-CB 3.28Å; D78-T80 WeakPolarHBondContact OD1-CB 3.22Å; D78-T80 PolarHBondContact OD1-N 3.23Å; D78-T80 PolarHBondContact OD1-OG1 3.05Å; D78-T80 PolarHBondContact OD2-OG1 3.28Å; D78-Q81 HydrophobicContact CB-CG 4.38Å; D78-Q81 PolarHBondContact O-N 2.71Å; D78-Q81 PolarHBondContact OD2-NE2 2.92Å; D78-L82 WeakPolarHBondContact O-CG 3.48Å
79	K	90.2	Very high	88.9	Confident	29 Å²	29	55.9 Å²	55.9	13%	0.126	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-68.2	-19.5	-178.4	-65.2	-169.7	-63.2	-173.4	0	113.2	I77 R87 D113 N114 D115 K116 L118	I77-K79 PolarHBondContact O-N 2.81Å; K79-R87 PolarHBondContact O-NH2 2.97Å; K79-D113 VanDerWaalsContact CE-OD1 3.22Å; K79-D113 WeakPolarHBondContact CE-OD1 3.34Å; K79-D113 IonicContact NZ-OD1 2.69Å; K79-D113 PolarHBondContact NZ-OD1 3.02Å; K79-D113 IonicContact NZ-OD2 2.68Å; K79-D113 PolarHBondContact NZ-OD2 3.45Å; K79-N114 WeakPolarHBondContact CE-O 3.39Å; K79-N114 PolarHBondContact NZ-O 3.25Å; K79-D115 WeakPolarHBondContact CE-O 3.5Å; K79-K116 PolarHBondContact N-O 3.11Å; K79-L118 HydrophobicContact CD-CB 4.26Å; K79-L118 HydrophobicContact CG-CB 4.27Å
80	T	89	Confident	88.6	Confident	90 Å²	90	54.1 Å²	54.1	55%	0.552	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-74.9	-30.6	179.4	75.7	0	0	0	0	112	D78 L82 K116	D78-T80 PolarHBondContact O-N 3.07Å; D78-T80 WeakPolarHBondContact OD1-CA 3.43Å; D78-T80 VanDerWaalsContact OD1-CB 3.28Å; D78-T80 WeakPolarHBondContact OD1-CB 3.22Å; D78-T80 PolarHBondContact OD1-N 3.23Å; D78-T80 PolarHBondContact OD1-OG1 3.05Å; D78-T80 PolarHBondContact OD2-OG1 3.28Å; T80-L82 VanDerWaalsContact C-N 3.31Å; T80-L82 PolarHBondContact O-N 3.43Å; T80-K116 HydrophobicContact CG2-CB 3.96Å; T80-K116 HydrophobicContact CG2-CG 4Å
81	Q	84.1	Confident	88.2	Confident	120 Å²	120	54.9 Å²	54.9	56%	0.561	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-85.4	-0.2	178.4	-61	-177.2	50.6	0	0	113.4	D78	D78-Q81 HydrophobicContact CB-CG 4.38Å; D78-Q81 PolarHBondContact O-N 2.71Å; D78-Q81 PolarHBondContact OD2-NE2 2.92Å
82	L	81.2	Confident	87.8	Confident	13 Å²	13	52.7 Å²	52.7	7%	0.068	27%	0.273	C	S	.	.			trans	-91.6	121.3	-178.8	-60.6	-177.5	0	0	0	112.5	F57 I77 D78 T80 R87 L90	F57-L82 HydrophobicContact CB-CD2 3.86Å; F57-L82 HydrophobicContact CD1-CD2 4.37Å; F57-L82 HydrophobicContact CG-CD2 4.09Å; I77-L82 HydrophobicContact CG2-CD1 4.13Å; D78-L82 WeakPolarHBondContact O-CG 3.48Å; T80-L82 VanDerWaalsContact C-N 3.31Å; T80-L82 PolarHBondContact O-N 3.43Å; L82-R87 HydrophobicContact CB-CB 4.37Å; L82-R87 PolarHBondContact O-NH2 3.34Å; L82-L90 HydrophobicContact CD1-CB 4.43Å; L82-L90 HydrophobicContact CD1-CD2 3.48Å; L82-L90 VanDerWaalsContact CD1-CD2 3.48Å
83	S	84.7	Confident	87.4	Confident	55 Å²	55	53.3 Å²	53.3	39%	0.385	28%	0.276	S	S	.	.			trans	-56.4	157	162.1	80.8	0	0	0	0	111.3	S85 S86 R87	S83-S85 PolarHBondContact O-N 2.78Å; S83-S86 CarbonylContact O-C 3.51Å; S83-S86 WeakPolarHBondContact O-CA 3.29Å; S83-S86 WeakPolarHBondContact O-CB 3.26Å; S83-S86 PolarHBondContact O-N 3.12Å; S83-S86 PolarHBondContact OG-N 3.41Å; S83-S86 VanDerWaalsContact OG-N 3.08Å; S83-S86 PolarHBondContact OG-OG 3.1Å; S83-R87 PolarHBondContact O-N 2.88Å
84	P	83.6	Confident	87.1	Confident	108 Å²	108	54.1 Å²	54.1	70%	0.701	28%	0.28	S	S	*	.	H	α-helix	trans	-53.9	-38.4	175.9	-27.8	35.9	0	0	0	113.5	R87 Q88	P84-R87 PolarHBondContact O-N 3.2Å; P84-Q88 PolarHBondContact O-N 3.47Å
85	S	78	Confident	86.9	Confident	73 Å²	73	59.5 Å²	59.5	51%	0.51	30%	0.3	S	S	.	.	H	α-helix	trans	-67	-40.1	174.9	-174.7	0	0	0	0	112.4	S83 R87 Q88 K89	S83-S85 PolarHBondContact O-N 2.78Å; S85-R87 VanDerWaalsContact C-N 3.32Å; S85-Q88 PolarHBondContact O-N 3.29Å; S85-K89 WeakPolarHBondContact O-CG 3.41Å; S85-K89 PolarHBondContact O-N 2.97Å; S85-K89 VanDerWaalsContact O-N 3.11Å
86	S	81.2	Confident	86.8	Confident	28 Å²	28	58.5 Å²	58.5	20%	0.196	30%	0.296	C	S	.	.	H	α-helix	trans	-64.5	-38	174.4	-51.2	0	0	0	0	111.6	S83 K89 L90	S83-S86 CarbonylContact O-C 3.51Å; S83-S86 WeakPolarHBondContact O-CA 3.29Å; S83-S86 WeakPolarHBondContact O-CB 3.26Å; S83-S86 PolarHBondContact O-N 3.12Å; S83-S86 PolarHBondContact OG-N 3.41Å; S83-S86 VanDerWaalsContact OG-N 3.08Å; S83-S86 PolarHBondContact OG-OG 3.1Å; S86-K89 PolarHBondContact O-N 3.34Å; S86-L90 PolarHBondContact O-N 3.42Å
87	R	84.3	Confident	86.6	Confident	101 Å²	101	58 Å²	58	38%	0.381	29%	0.293	S	S	.	.	H	α-helix	trans	-68.9	-38.5	177.7	-162.4	179.2	-63.2	157.7	2.4	112.1	K79 L82 S83 P84 S85 L90 F91	K79-R87 PolarHBondContact O-NH2 2.97Å; L82-R87 HydrophobicContact CB-CB 4.37Å; L82-R87 PolarHBondContact O-NH2 3.34Å; S83-R87 PolarHBondContact O-N 2.88Å; P84-R87 PolarHBondContact O-N 3.2Å; S85-R87 VanDerWaalsContact C-N 3.32Å; R87-L90 WeakPolarHBondContact O-CB 3.28Å; R87-L90 PolarHBondContact O-N 2.95Å; R87-F91 HydrophobicContact CG-CD2 4.17Å; R87-F91 HydrophobicContact CG-CE2 3.72Å; R87-F91 HydrophobicContact CG-CZ 4.39Å; R87-F91 VanDerWaalsContact O-CD2 3.32Å; R87-F91 WeakPolarHBondContact O-CD2 3.39Å; R87-F91 PolarHBondContact O-N 3.25Å
88	Q	82.6	Confident	86.7	Confident	126 Å²	126	61.4 Å²	61.4	59%	0.589	31%	0.308	S	S	*	.	H	α-helix	trans	-65.1	-38.5	173	-168.7	62.7	22.4	0	0	112.3	P84 S85 L90 R92	P84-Q88 PolarHBondContact O-N 3.47Å; S85-Q88 PolarHBondContact O-N 3.29Å; Q88-L90 VanDerWaalsContact C-N 3.33Å; Q88-R92 PolarHBondContact O-N 3.44Å; Q88-R92 VanDerWaalsContact O-N 3.12Å
89	K	81	Confident	86.7	Confident	78 Å²	78	63.1 Å²	63.1	34%	0.339	32%	0.317	S	S	.	.	H	α-helix	trans	-61.7	-42.6	172.4	-69.6	173.4	-172.7	-177.7	0	111.3	S85 S86 R92 E93	S85-K89 WeakPolarHBondContact O-CG 3.41Å; S85-K89 PolarHBondContact O-N 2.97Å; S85-K89 VanDerWaalsContact O-N 3.11Å; S86-K89 PolarHBondContact O-N 3.34Å; K89-R92 PolarHBondContact O-N 3.16Å; K89-E93 WeakPolarHBondContact O-CB 2.67Å; K89-E93 PolarHBondContact O-N 3.03Å
90	L	86.9	Confident	86.8	Confident	10 Å²	10	62.2 Å²	62.2	5%	0.052	31%	0.313	C	S	.	.	H	α-helix	trans	-62.6	-47.7	177.4	176.9	59.8	0	0	0	112.7	I77 L82 S86 R87 Q88 R92 E93 V94 L118	I77-L90 HydrophobicContact CD1-CD1 3.51Å; I77-L90 HydrophobicContact CG2-CD2 4.03Å; L82-L90 HydrophobicContact CD1-CB 4.43Å; L82-L90 HydrophobicContact CD1-CD2 3.48Å; L82-L90 VanDerWaalsContact CD1-CD2 3.48Å; S86-L90 PolarHBondContact O-N 3.42Å; R87-L90 WeakPolarHBondContact O-CB 3.28Å; R87-L90 PolarHBondContact O-N 2.95Å; Q88-L90 VanDerWaalsContact C-N 3.33Å; L90-R92 VanDerWaalsContact C-N 3.26Å; L90-R92 PolarHBondContact O-N 3Å; L90-E93 WeakPolarHBondContact O-CB 3.45Å; L90-E93 PolarHBondContact O-N 3.18Å; L90-E93 VanDerWaalsContact O-N 3.14Å; L90-V94 HydrophobicContact CD1-CG2 4.24Å; L90-V94 WeakPolarHBondContact O-CG2 3.32Å; L90-V94 PolarHBondContact O-N 2.96Å; L90-L118 HydrophobicContact CD1-CD2 3.85Å; L90-L118 HydrophobicContact CD2-CD2 3.78Å; L90-L118 HydrophobicContact CG-CD2 3.96Å
91	F	87.6	Confident	87	Confident	121 Å²	121	60.2 Å²	60.2	53%	0.531	30%	0.299	S	S	.	.	H	α-helix	trans	-60.9	-37	176.5	-73.3	-53.8	0	0	0	112.2	R87 R95	R87-F91 HydrophobicContact CG-CD2 4.17Å; R87-F91 HydrophobicContact CG-CE2 3.72Å; R87-F91 HydrophobicContact CG-CZ 4.39Å; R87-F91 VanDerWaalsContact O-CD2 3.32Å; R87-F91 WeakPolarHBondContact O-CD2 3.39Å; R87-F91 PolarHBondContact O-N 3.25Å; F91-R95 WeakPolarHBondContact O-CB 3.34Å; F91-R95 PolarHBondContact O-N 2.95Å
92	R	87.3	Confident	87.6	Confident	47 Å²	47	54.7 Å²	54.7	18%	0.177	27%	0.273	C	S	.	.	H	α-helix	trans	-67.3	-43.8	172.3	-169.8	177.3	65.2	-127.8	-12.6	111.9	Q88 K89 L90 V94 R95 L96 S190 N191	Q88-R92 PolarHBondContact O-N 3.44Å; Q88-R92 VanDerWaalsContact O-N 3.12Å; K89-R92 PolarHBondContact O-N 3.16Å; L90-R92 VanDerWaalsContact C-N 3.26Å; L90-R92 PolarHBondContact O-N 3Å; R92-V94 VanDerWaalsContact C-N 3.32Å; R92-V94 PolarHBondContact O-N 3.41Å; R92-R95 PolarHBondContact O-N 3.31Å; R92-L96 HydrophobicContact CG-CD1 4.12Å; R92-L96 HydrophobicContact CG-CG 4.16Å; R92-L96 VanDerWaalsContact O-CG 3.29Å; R92-L96 WeakPolarHBondContact O-CG 3.22Å; R92-L96 PolarHBondContact O-N 3.19Å; R92-S190 PolarHBondContact NE-O 3.17Å; R92-S190 PolarHBondContact NH2-O 2.97Å; R92-N191 WeakPolarHBondContact CD-OD1 3.27Å; R92-N191 PolarHBondContact NE-OD1 3.48Å; R92-N191 PolarHBondContact NH1-OD1 3.46Å
93	E	88.1	Confident	88.3	Confident	13 Å²	13	57.4 Å²	57.4	6%	0.061	29%	0.291	C	S	.	.	H	α-helix	trans	-54.7	-48.4	176.2	-169.6	-172.2	143.4	0	0	111	K75 K89 L90 L96 M97 F187 G188	K75-E93 IonicContact NZ-OE1 3.15Å; K75-E93 PolarHBondContact NZ-OE1 2.71Å; K75-E93 IonicContact NZ-OE2 2.62Å; K75-E93 PolarHBondContact NZ-OE2 3.25Å; K89-E93 WeakPolarHBondContact O-CB 2.67Å; K89-E93 PolarHBondContact O-N 3.03Å; L90-E93 WeakPolarHBondContact O-CB 3.45Å; L90-E93 PolarHBondContact O-N 3.18Å; L90-E93 VanDerWaalsContact O-N 3.14Å; E93-L96 PolarHBondContact O-N 2.86Å; E93-M97 HydrophobicContact CG-SD 4.11Å; E93-M97 WeakPolarHBondContact O-CB 3.19Å; E93-M97 VanDerWaalsContact O-CG 3.29Å; E93-M97 WeakPolarHBondContact O-CG 2.94Å; E93-M97 PolarHBondContact O-N 3.04Å; E93-F187 HydrophobicContact CG-CB 4.36Å; E93-G188 WeakPolarHBondContact OE2-CA 3.29Å
94	V	91.8	Very high	88.9	Confident	22 Å²	22	55.5 Å²	55.5	13%	0.133	28%	0.277	C	S	.	.	H	α-helix	trans	-61.9	-44.5	175.8	175.7	0	0	0	0	112	L90 R92 L96 M97 K98 I111 L118 L120	L90-V94 HydrophobicContact CD1-CG2 4.24Å; L90-V94 WeakPolarHBondContact O-CG2 3.32Å; L90-V94 PolarHBondContact O-N 2.96Å; R92-V94 VanDerWaalsContact C-N 3.32Å; R92-V94 PolarHBondContact O-N 3.41Å; V94-L96 VanDerWaalsContact C-N 3.35Å; V94-L96 PolarHBondContact O-N 3.24Å; V94-M97 PolarHBondContact O-N 2.67Å; V94-K98 PolarHBondContact O-N 2.75Å; V94-I111 HydrophobicContact CG1-CD1 3.64Å; V94-L118 HydrophobicContact CG2-CD2 4.08Å; V94-L120 HydrophobicContact CG2-CD1 3.98Å; V94-L120 HydrophobicContact CG2-CD2 3.85Å
95	R	92	Very high	89.5	Confident	113 Å²	113	50.5 Å²	50.5	43%	0.426	24%	0.244	S	C	.	.	H	α-helix	trans	-58.4	-45.6	176	-173.7	-171.7	-174.4	-149.7	4.5	111.6	F91 R92 K98 L99 E192	F91-R95 WeakPolarHBondContact O-CB 3.34Å; F91-R95 PolarHBondContact O-N 2.95Å; R92-R95 PolarHBondContact O-N 3.31Å; R95-K98 PolarHBondContact O-N 3.32Å; R95-L99 HydrophobicContact CG-CD1 4.24Å; R95-L99 WeakPolarHBondContact O-CD1 3.41Å; R95-L99 WeakPolarHBondContact O-CG 3.43Å; R95-L99 PolarHBondContact O-N 2.88Å; R95-E192 IonicContact CZ-OE1 3.7Å; R95-E192 IonicContact CZ-OE2 3Å; R95-E192 IonicContact NH1-OE1 2.67Å; R95-E192 PolarHBondContact NH1-OE1 2.62Å; R95-E192 IonicContact NH1-OE2 2.61Å; R95-E192 PolarHBondContact NH1-OE2 2.76Å
96	L	91.9	Very high	90.4	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-68.1	-41.1	179.8	-64.3	-176.6	0	0	0	111.5	R92 E93 V94 K98 L99 L100 I164 E192	R92-L96 HydrophobicContact CG-CD1 4.12Å; R92-L96 HydrophobicContact CG-CG 4.16Å; R92-L96 VanDerWaalsContact O-CG 3.29Å; R92-L96 WeakPolarHBondContact O-CG 3.22Å; R92-L96 PolarHBondContact O-N 3.19Å; E93-L96 PolarHBondContact O-N 2.86Å; V94-L96 VanDerWaalsContact C-N 3.35Å; V94-L96 PolarHBondContact O-N 3.24Å; L96-K98 VanDerWaalsContact C-N 3.28Å; L96-K98 PolarHBondContact O-N 2.68Å; L96-L99 PolarHBondContact O-N 2.97Å; L96-L100 WeakPolarHBondContact O-CD1 3.47Å; L96-L100 VanDerWaalsContact O-CG 3.31Å; L96-L100 WeakPolarHBondContact O-CG 3.3Å; L96-L100 PolarHBondContact O-N 2.7Å; L96-I164 HydrophobicContact CD1-CG2 4.02Å; L96-I164 HydrophobicContact CD2-CD1 3.75Å; L96-I164 HydrophobicContact CD2-CG1 3.76Å; L96-I164 HydrophobicContact CD2-CG2 4.45Å; L96-E192 HydrophobicContact CD2-CG 4.14Å
97	M	91.7	Very high	91	Very high	17 Å²	17	49 Å²	49	8%	0.084	23%	0.227	C	C	.	.	H	α-helix	trans	-64.5	-28.7	175.9	-72	176.4	71.9	0	0	113.5	E93 V94 L99 L108 L120 M122 F187	E93-M97 HydrophobicContact CG-SD 4.11Å; E93-M97 WeakPolarHBondContact O-CB 3.19Å; E93-M97 VanDerWaalsContact O-CG 3.29Å; E93-M97 WeakPolarHBondContact O-CG 2.94Å; E93-M97 PolarHBondContact O-N 3.04Å; V94-M97 PolarHBondContact O-N 2.67Å; M97-L99 VanDerWaalsContact C-N 3.27Å; M97-L99 PolarHBondContact O-N 2.74Å; M97-L108 HydrophobicContact CB-CB 4.37Å; M97-L108 HydrophobicContact CB-CD2 4.1Å; M97-L108 HydrophobicContact CE-CB 4.33Å; M97-L108 HydrophobicContact CE-CD1 3.92Å; M97-L120 HydrophobicContact SD-CD1 4.2Å; M97-M122 HydrophobicContact CE-CG 3.87Å; M97-M122 HydrophobicContact CE-SD 3.55Å; M97-M122 VanDerWaalsContact CE-SD 3.55Å; M97-F187 HydrophobicContact CG-CD2 4.48Å
98	K	92.6	Very high	91.6	Very high	79 Å²	79	44.4 Å²	44.4	34%	0.343	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-18.3	170.1	-78.1	-155.1	169.9	-154.8	0	113.9	V94 R95 L96 L108 I111 G342 N343 F344	V94-K98 PolarHBondContact O-N 2.75Å; R95-K98 PolarHBondContact O-N 3.32Å; L96-K98 VanDerWaalsContact C-N 3.28Å; L96-K98 PolarHBondContact O-N 2.68Å; K98-L108 HydrophobicContact CG-CD2 4.09Å; K98-I111 HydrophobicContact CD-CD1 4.38Å; K98-I111 HydrophobicContact CG-CD1 4.33Å; K98-G342 PolarHBondContact NZ-O 3.36Å; K98-N343 PolarHBondContact NZ-O 2.81Å; K98-F344 HydrophobicContact CB-CE2 3.99Å; K98-F344 HydrophobicContact CB-CZ 4.13Å; K98-F344 HydrophobicContact CD-CD2 3.64Å; K98-F344 HydrophobicContact CD-CE2 3.61Å; K98-F344 HydrophobicContact CD-CZ 4.48Å; K98-F344 HydrophobicContact CG-CD2 3.84Å; K98-F344 HydrophobicContact CG-CE2 3.55Å; K98-F344 HydrophobicContact CG-CG 4.44Å; K98-F344 HydrophobicContact CG-CZ 3.93Å
99	L	90.3	Very high	92.2	Very high	82 Å²	82	39.5 Å²	39.5	43%	0.429	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-1.9	-172.1	-69.4	170.4	0	0	0	114.1	R95 L96 M97 K162	R95-L99 HydrophobicContact CG-CD1 4.24Å; R95-L99 WeakPolarHBondContact O-CD1 3.41Å; R95-L99 WeakPolarHBondContact O-CG 3.43Å; R95-L99 PolarHBondContact O-N 2.88Å; L96-L99 PolarHBondContact O-N 2.97Å; M97-L99 VanDerWaalsContact C-N 3.27Å; M97-L99 PolarHBondContact O-N 2.74Å; L99-K162 WeakPolarHBondContact O-CD 3.37Å; L99-K162 PolarHBondContact O-NZ 2.87Å
100	L	92.9	Very high	93	Very high	9 Å²	9	36.2 Å²	36.2	5%	0.047	17%	0.172	C	C	.	.			trans	-116.1	108.9	-172.4	-68.5	168.9	0	0	0	110.8	L96 I105 Y158 I164 F187	L96-L100 WeakPolarHBondContact O-CD1 3.47Å; L96-L100 VanDerWaalsContact O-CG 3.31Å; L96-L100 WeakPolarHBondContact O-CG 3.3Å; L96-L100 PolarHBondContact O-N 2.7Å; L100-I105 HydrophobicContact CB-CD1 4.48Å; L100-I105 HydrophobicContact CB-CG2 4.45Å; L100-I105 HydrophobicContact CD2-CD1 4.33Å; L100-Y158 HydrophobicContact CB-CE1 4.29Å; L100-Y158 HydrophobicContact CD2-CD1 4.03Å; L100-Y158 HydrophobicContact CD2-CE1 3.48Å; L100-Y158 VanDerWaalsContact CD2-CE1 3.48Å; L100-Y158 HydrophobicContact CG-CE1 4.5Å; L100-I164 HydrophobicContact CD2-CD1 3.87Å; L100-I164 HydrophobicContact CG-CD1 4.27Å; L100-F187 HydrophobicContact CD1-CD1 3.88Å; L100-F187 HydrophobicContact CD1-CD2 4.41Å; L100-F187 HydrophobicContact CD1-CE1 3.48Å; L100-F187 VanDerWaalsContact CD1-CE1 3.48Å; L100-F187 HydrophobicContact CD1-CE2 4.08Å; L100-F187 HydrophobicContact CD1-CG 4.34Å; L100-F187 HydrophobicContact CD1-CZ 3.61Å
101	D	93.5	Very high	93.4	Very high	49 Å²	49	37.6 Å²	37.6	26%	0.262	18%	0.179	S	C	.	.			trans	-124.1	101.9	171.5	-158	2.9	0	0	0	109.4	K107 Y158	D101-K107 VanDerWaalsContact OD1-CE 3.32Å; D101-K107 WeakPolarHBondContact OD1-CE 3.43Å; D101-K107 IonicContact OD1-NZ 2.65Å; D101-K107 PolarHBondContact OD1-NZ 2.97Å; D101-K107 IonicContact OD2-NZ 3.28Å; D101-K107 PolarHBondContact OD2-NZ 2.83Å; D101-Y158 PolarHBondContact N-OH 3.31Å; D101-Y158 PolarHBondContact O-OH 3.19Å
102	H	96	Very high	93.9	Very high	4 Å²	4	33.1 Å²	33.1	2%	0.019	16%	0.16	C	C	.	.			trans	-149.4	136.4	-177.6	177.7	-80.8	0	0	0	108.5	N104 I105 S154 A155 Y158 Y309	H102-N104 PolarHBondContact ND1-N 3.04Å; H102-N104 PolarHBondContact O-N 3.15Å; H102-I105 HydrophobicContact CB-CB 4.25Å; H102-I105 HydrophobicContact CB-CD1 3.87Å; H102-I105 HydrophobicContact CB-CG1 3.94Å; H102-I105 PolarHBondContact O-N 2.85Å; H102-S154 PolarHBondContact NE2-OG 3.24Å; H102-A155 VanDerWaalsContact CE1-CA 3.46Å; H102-A155 WeakPolarHBondContact CE1-CA 3.38Å; H102-A155 PolarHBondContact CE1-N 3.44Å; H102-Y158 HydrophobicContact CB-CD1 3.67Å; H102-Y158 HydrophobicContact CB-CE1 3.73Å; H102-Y158 HydrophobicContact CB-CG 4.23Å; H102-Y158 AromaticContact CD2-CG 3.83Å; H102-Y309 HydrophobicContact CB-CE1 4.39Å; H102-Y309 AromaticContact CD2-CD1 3.43Å; H102-Y309 VanDerWaalsContact CD2-CD1 3.43Å; H102-Y309 WeakPolarHBondContact CD2-CD1 3.38Å; H102-Y309 AromaticContact CD2-CD2 4Å; H102-Y309 AromaticContact CD2-CE1 3.9Å; H102-Y309 AromaticContact CD2-CG 3.46Å; H102-Y309 VanDerWaalsContact CD2-CG 3.46Å; H102-Y309 AromaticContact NE2-CG 3.85Å
103	P	96.4	Very high	94.2	Very high	69 Å²	69	34.9 Å²	34.9	45%	0.448	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-22.9	-171.5	22.3	-34.9	0	0	0	114.4	K183 Y309	P103-K183 WeakPolarHBondContact O-CE 3.41Å; P103-K183 PolarHBondContact O-NZ 2.76Å; P103-Y309 HydrophobicContact CG-CE2 4.14Å
104	N	97.5	Very high	94.3	Very high	15 Å²	15	38.6 Å²	38.6	8%	0.08	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.5	20.4	176	-54.1	115.2	0	0	0	115.1	H102 Q151 A155 I182 L184	H102-N104 PolarHBondContact ND1-N 3.04Å; H102-N104 PolarHBondContact O-N 3.15Å; N104-Q151 HydrophobicContact CB-CB 4.26Å; N104-Q151 WeakPolarHBondContact OD1-CB 3.49Å; N104-A155 HydrophobicContact CB-CB 4.29Å; N104-I182 WeakPolarHBondContact CA-O 3.19Å; N104-I182 HydrophobicContact CB-CG2 4.43Å; N104-I182 VanDerWaalsContact CB-O 3.22Å; N104-I182 WeakPolarHBondContact CB-O 3.46Å; N104-I182 PolarHBondContact ND2-O 2.97Å; N104-L184 WeakPolarHBondContact O-CB 3.35Å; N104-L184 PolarHBondContact O-N 2.87Å
105	I	96.7	Very high	94.3	Very high	4 Å²	4	45 Å²	45	2%	0.021	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-114.5	144.4	167.4	-62.6	-179.1	0	0	0	108.1	L100 H102 K107 A155 Y158 L184 F187	L100-I105 HydrophobicContact CB-CD1 4.48Å; L100-I105 HydrophobicContact CB-CG2 4.45Å; L100-I105 HydrophobicContact CD2-CD1 4.33Å; H102-I105 HydrophobicContact CB-CB 4.25Å; H102-I105 HydrophobicContact CB-CD1 3.87Å; H102-I105 HydrophobicContact CB-CG1 3.94Å; H102-I105 PolarHBondContact O-N 2.85Å; I105-K107 PolarHBondContact O-N 2.66Å; I105-A155 HydrophobicContact CD1-CB 4.34Å; I105-A155 HydrophobicContact CG1-CB 3.85Å; I105-Y158 HydrophobicContact CD1-CD1 3.75Å; I105-Y158 HydrophobicContact CD1-CE1 4.06Å; I105-L184 HydrophobicContact CG1-CB 4.36Å; I105-L184 HydrophobicContact CG1-CD2 4.47Å; I105-F187 HydrophobicContact CD1-CZ 4.26Å; I105-F187 HydrophobicContact CG2-CE2 3.69Å; I105-F187 HydrophobicContact CG2-CZ 3.73Å
106	V	95.7	Very high	94.2	Very high	15 Å²	15	46.6 Å²	46.6	9%	0.091	24%	0.237	C	C	.	.			trans	-66.5	111.3	174.7	170.1	0	0	0	0	109.9	M122 E123 K183 L184 A185	V106-M122 HydrophobicContact CG1-CB 3.78Å; V106-M122 HydrophobicContact CG1-SD 4.48Å; V106-E123 HydrophobicContact CG1-CB 4.23Å; V106-K183 HydrophobicContact CG2-CB 3.9Å; V106-L184 PolarHBondContact N-O 3.21Å; V106-A185 HydrophobicContact CG2-CB 3.95Å
107	K	95.1	Very high	94.3	Very high	55 Å²	55	49 Å²	49	24%	0.239	25%	0.249	C	C	.	.			trans	-71.3	144.2	-179.5	-166.3	161.5	-171.8	156.8	0	112.3	D101 I105 F109 M122 E123	D101-K107 VanDerWaalsContact OD1-CE 3.32Å; D101-K107 WeakPolarHBondContact OD1-CE 3.43Å; D101-K107 IonicContact OD1-NZ 2.65Å; D101-K107 PolarHBondContact OD1-NZ 2.97Å; D101-K107 IonicContact OD2-NZ 3.28Å; D101-K107 PolarHBondContact OD2-NZ 2.83Å; I105-K107 PolarHBondContact O-N 2.66Å; K107-F109 HydrophobicContact CB-CE1 4.49Å; K107-F109 HydrophobicContact CD-CE1 4.38Å; K107-F109 HydrophobicContact CG-CE1 4.31Å; K107-M122 CarbonylContact O-C 3.41Å; K107-M122 VanDerWaalsContact O-CA 3.28Å; K107-M122 WeakPolarHBondContact O-CA 3.36Å; K107-E123 HydrophobicContact CB-CB 4.45Å; K107-E123 PolarHBondContact O-N 3.02Å
108	L	95.9	Very high	94.4	Very high	3 Å²	3	48.7 Å²	48.7	2%	0.016	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	138.4	169.9	-177.1	71	0	0	0	109.7	M97 K98 I111 L120 V121 M122 F344	M97-L108 HydrophobicContact CB-CB 4.37Å; M97-L108 HydrophobicContact CB-CD2 4.1Å; M97-L108 HydrophobicContact CE-CB 4.33Å; M97-L108 HydrophobicContact CE-CD1 3.92Å; K98-L108 HydrophobicContact CG-CD2 4.09Å; L108-I111 HydrophobicContact CD1-CG1 4.48Å; L108-I111 HydrophobicContact CD2-CD1 4.03Å; L108-I111 HydrophobicContact CD2-CG1 3.98Å; L108-L120 HydrophobicContact CD1-CB 4.07Å; L108-V121 WeakPolarHBondContact CD1-O 3.31Å; L108-M122 HydrophobicContact CD1-CG 4.37Å; L108-F344 HydrophobicContact CB-CD1 4.24Å; L108-F344 HydrophobicContact CB-CE1 4.01Å; L108-F344 HydrophobicContact CD2-CD1 3.73Å; L108-F344 HydrophobicContact CD2-CE1 3.9Å; L108-F344 HydrophobicContact CD2-CG 4.32Å; L108-F344 HydrophobicContact CG-CD1 3.76Å; L108-F344 HydrophobicContact CG-CE1 4.01Å; L108-F344 WeakPolarHBondContact O-CE1 3.42Å
109	F	95.8	Very high	94.6	Very high	23 Å²	23	46.6 Å²	46.6	10%	0.101	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	-48.2	177.3	-59.3	-55	0	0	0	112.7	V72 K107 V121 E123 A349 L352 L353	V72-F109 HydrophobicContact CG1-CD2 4.12Å; V72-F109 HydrophobicContact CG1-CE2 4.22Å; K107-F109 HydrophobicContact CB-CE1 4.49Å; K107-F109 HydrophobicContact CD-CE1 4.38Å; K107-F109 HydrophobicContact CG-CE1 4.31Å; F109-V121 HydrophobicContact CB-CG1 4.48Å; F109-V121 PolarHBondContact N-O 2.66Å; F109-E123 HydrophobicContact CE2-CB 4.19Å; F109-E123 HydrophobicContact CZ-CB 4.27Å; F109-A349 HydrophobicContact CB-CB 4.24Å; F109-L352 HydrophobicContact CD1-CB 3.8Å; F109-L352 HydrophobicContact CD1-CD1 4.18Å; F109-L352 HydrophobicContact CE1-CB 4.19Å; F109-L353 HydrophobicContact CD1-CD2 4.34Å; F109-L353 HydrophobicContact CD1-CG 4.44Å; F109-L353 HydrophobicContact CD2-CD2 3.71Å; F109-L353 HydrophobicContact CD2-CG 4.3Å; F109-L353 HydrophobicContact CE1-CD2 4.24Å; F109-L353 HydrophobicContact CE2-CD2 3.57Å; F109-L353 HydrophobicContact CG-CD2 4.09Å; F109-L353 HydrophobicContact CG-CG 4.23Å; F109-L353 HydrophobicContact CZ-CD2 3.87Å
110	E	97	Very high	94.9	Very high	9 Å²	9	42.7 Å²	42.7	4%	0.042	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	149.4	-173.9	-155.6	177.1	116.7	0	0	111.7	Y46 I112 V121 F344 D346 A349	Y46-E110 VanDerWaalsContact CE2-OE2 3.24Å; Y46-E110 WeakPolarHBondContact CE2-OE2 3.11Å; Y46-E110 PolarHBondContact OH-OE2 3.04Å; E110-I112 HydrophobicContact CG-CG1 4.28Å; E110-I112 VanDerWaalsContact OE1-CD1 3.24Å; E110-I112 WeakPolarHBondContact OE1-CD1 2.91Å; E110-I112 WeakPolarHBondContact OE1-CG1 3.31Å; E110-V121 HydrophobicContact CB-CB 3.79Å; E110-V121 HydrophobicContact CB-CG2 3.83Å; E110-V121 PolarHBondContact N-O 2.56Å; E110-V121 PolarHBondContact O-N 2.91Å; E110-F344 CarbonylContact C-O 3.54Å; E110-F344 WeakPolarHBondContact CA-O 3.49Å; E110-D346 VanDerWaalsContact OE2-CA 3.28Å; E110-D346 WeakPolarHBondContact OE2-CA 3.35Å; E110-A349 HydrophobicContact CB-CB 3.73Å; E110-A349 HydrophobicContact CG-CB 4.02Å; E110-A349 WeakPolarHBondContact OE2-CB 3.46Å
111	I	96.7	Very high	95.1	Very high	40 Å²	40	42.2 Å²	42.2	21%	0.205	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	110.6	170.7	-55.9	171.8	0	0	0	108.6	V94 K98 L108 L118 L120 F344	V94-I111 HydrophobicContact CG1-CD1 3.64Å; K98-I111 HydrophobicContact CD-CD1 4.38Å; K98-I111 HydrophobicContact CG-CD1 4.33Å; L108-I111 HydrophobicContact CD1-CG1 4.48Å; L108-I111 HydrophobicContact CD2-CD1 4.03Å; L108-I111 HydrophobicContact CD2-CG1 3.98Å; I111-L118 HydrophobicContact CG2-CD1 3.65Å; I111-L120 HydrophobicContact CG1-CD2 4.1Å; I111-L120 HydrophobicContact CG2-CD2 4.06Å; I111-F344 HydrophobicContact CD1-CB 4.18Å; I111-F344 HydrophobicContact CG1-CB 4.06Å; I111-F344 PolarHBondContact N-O 3.39Å
112	I	96.3	Very high	95.2	Very high	27 Å²	27	40.9 Å²	40.9	14%	0.138	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	111.2	172.7	-46.3	170.7	0	0	0	107.4	V43 Y46 E110 Y119	V43-I112 HydrophobicContact CG1-CD1 4.36Å; V43-I112 HydrophobicContact CG2-CD1 3.92Å; Y46-I112 HydrophobicContact CD2-CD1 4.41Å; E110-I112 HydrophobicContact CG-CG1 4.28Å; E110-I112 VanDerWaalsContact OE1-CD1 3.24Å; E110-I112 WeakPolarHBondContact OE1-CD1 2.91Å; E110-I112 WeakPolarHBondContact OE1-CG1 3.31Å; I112-Y119 HydrophobicContact CB-CD2 4.29Å; I112-Y119 HydrophobicContact CG2-CD2 4.49Å; I112-Y119 PolarHBondContact N-O 3.3Å; I112-Y119 PolarHBondContact O-N 2.74Å
113	D	94.2	Very high	95.2	Very high	83 Å²	83	43.1 Å²	43.1	44%	0.444	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	121.1	179.5	-164.3	40.1	0	0	0	112.6	K79 L118	K79-D113 VanDerWaalsContact CE-OD1 3.22Å; K79-D113 WeakPolarHBondContact CE-OD1 3.34Å; K79-D113 IonicContact NZ-OD1 2.69Å; K79-D113 PolarHBondContact NZ-OD1 3.02Å; K79-D113 IonicContact NZ-OD2 2.68Å; K79-D113 PolarHBondContact NZ-OD2 3.45Å; D113-L118 HydrophobicContact CB-CD1 3.63Å; D113-L118 WeakPolarHBondContact OD1-CB 3.32Å; D113-L118 WeakPolarHBondContact OD1-CD1 3.41Å
114	N	90.7	Very high	95.2	Very high	92 Å²	92	42 Å²	42	49%	0.492	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	155.7	173	-67.1	-32.7	0	0	0	108.8	K79 K116 I117	K79-N114 WeakPolarHBondContact CE-O 3.39Å; K79-N114 PolarHBondContact NZ-O 3.25Å; N114-K116 PolarHBondContact O-N 3.32Å; N114-I117 PolarHBondContact N-O 3.46Å; N114-I117 PolarHBondContact O-N 3.45Å; N114-I117 VanDerWaalsContact O-O 3.11Å
115	D	90.8	Very high	95.1	Very high	157 Å²	157	41.8 Å²	41.8	84%	0.84	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-41.2	-40.2	-174.9	-60.7	-36.4	0	0	0	115.6	K79	K79-D115 WeakPolarHBondContact CE-O 3.5Å
116	K	91.4	Very high	95	Very high	146 Å²	146	44.2 Å²	44.2	64%	0.635	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-26.6	-176.1	-59.8	179.3	-175.1	176.4	0	114.4	K79 T80 N114	K79-K116 PolarHBondContact N-O 3.11Å; T80-K116 HydrophobicContact CG2-CB 3.96Å; T80-K116 HydrophobicContact CG2-CG 4Å; N114-K116 PolarHBondContact O-N 3.32Å
117	I	93.3	Very high	94.8	Very high	51 Å²	51	45.2 Å²	45.2	26%	0.262	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	129.4	-168.4	-52.5	178.7	0	0	0	110.3	I76 I77 N114 Y119	I76-I117 HydrophobicContact CG2-CG2 3.6Å; I77-I117 WeakPolarHBondContact O-CA 3.45Å; N114-I117 PolarHBondContact N-O 3.46Å; N114-I117 PolarHBondContact O-N 3.45Å; N114-I117 VanDerWaalsContact O-O 3.11Å; I117-Y119 HydrophobicContact CB-CE2 3.86Å; I117-Y119 HydrophobicContact CG2-CD2 3.97Å; I117-Y119 HydrophobicContact CG2-CE1 4.17Å; I117-Y119 HydrophobicContact CG2-CE2 3.45Å; I117-Y119 VanDerWaalsContact CG2-CE2 3.45Å
118	L	94.3	Very high	94.6	Very high	11 Å²	11	43.9 Å²	43.9	6%	0.058	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	135.7	168.6	178.9	69.2	0	0	0	109.4	I77 K79 L90 V94 I111 D113 L120	I77-L118 PolarHBondContact N-O 2.99Å; I77-L118 PolarHBondContact O-N 3.48Å; K79-L118 HydrophobicContact CD-CB 4.26Å; K79-L118 HydrophobicContact CG-CB 4.27Å; L90-L118 HydrophobicContact CD1-CD2 3.85Å; L90-L118 HydrophobicContact CD2-CD2 3.78Å; L90-L118 HydrophobicContact CG-CD2 3.96Å; V94-L118 HydrophobicContact CG2-CD2 4.08Å; I111-L118 HydrophobicContact CG2-CD1 3.65Å; D113-L118 HydrophobicContact CB-CD1 3.63Å; D113-L118 WeakPolarHBondContact OD1-CB 3.32Å; D113-L118 WeakPolarHBondContact OD1-CD1 3.41Å; L118-L120 HydrophobicContact CD1-CD2 4.19Å; L118-L120 HydrophobicContact CD2-CD2 4.05Å; L118-L120 HydrophobicContact CD2-CG 4.39Å; L118-L120 HydrophobicContact CG-CD2 4.03Å; L118-L120 HydrophobicContact CG-CG 4.38Å
119	Y	96.4	Very high	94.4	Very high	34 Å²	34	46.2 Å²	46.2	13%	0.133	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	122.7	173	-53.2	-107.5	0	0	0	108.6	V43 F48 I74 I76 I112 I117	V43-Y119 HydrophobicContact CB-CD1 4.43Å; V43-Y119 HydrophobicContact CB-CE1 4.27Å; V43-Y119 HydrophobicContact CG1-CD1 4.12Å; V43-Y119 HydrophobicContact CG1-CE1 4.36Å; V43-Y119 HydrophobicContact CG2-CD1 3.94Å; V43-Y119 HydrophobicContact CG2-CD2 4.12Å; V43-Y119 HydrophobicContact CG2-CE1 3.83Å; V43-Y119 HydrophobicContact CG2-CE2 4.02Å; V43-Y119 HydrophobicContact CG2-CG 4.11Å; F48-Y119 HydrophobicContact CZ-CD1 4.3Å; F48-Y119 HydrophobicContact CZ-CE1 4.06Å; I74-Y119 HydrophobicContact CG2-CD1 4.06Å; I76-Y119 HydrophobicContact CB-CD1 4.32Å; I76-Y119 HydrophobicContact CB-CE1 4.47Å; I76-Y119 HydrophobicContact CD1-CD1 4.41Å; I76-Y119 HydrophobicContact CD1-CE1 4.27Å; I76-Y119 HydrophobicContact CG1-CD1 3.85Å; I76-Y119 HydrophobicContact CG1-CE1 4.12Å; I76-Y119 HydrophobicContact CG2-CD1 3.95Å; I76-Y119 HydrophobicContact CG2-CE1 3.71Å; I112-Y119 HydrophobicContact CB-CD2 4.29Å; I112-Y119 HydrophobicContact CG2-CD2 4.49Å; I112-Y119 PolarHBondContact N-O 3.3Å; I112-Y119 PolarHBondContact O-N 2.74Å; I117-Y119 HydrophobicContact CB-CE2 3.86Å; I117-Y119 HydrophobicContact CG2-CD2 3.97Å; I117-Y119 HydrophobicContact CG2-CE1 4.17Å; I117-Y119 HydrophobicContact CG2-CE2 3.45Å; I117-Y119 VanDerWaalsContact CG2-CE2 3.45Å
120	L	95.9	Very high	94.1	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	116.9	172	-53.9	177.9	0	0	0	108.2	I74 K75 I77 V94 M97 L108 I111 L118 M122	I74-L120 CarbonylContact C-O 3.17Å; I74-L120 WeakPolarHBondContact CA-O 3.37Å; K75-L120 HydrophobicContact CB-CB 4.35Å; K75-L120 PolarHBondContact N-O 3.1Å; K75-L120 PolarHBondContact O-N 3.32Å; I77-L120 HydrophobicContact CD1-CD1 4.21Å; V94-L120 HydrophobicContact CG2-CD1 3.98Å; V94-L120 HydrophobicContact CG2-CD2 3.85Å; M97-L120 HydrophobicContact SD-CD1 4.2Å; L108-L120 HydrophobicContact CD1-CB 4.07Å; I111-L120 HydrophobicContact CG1-CD2 4.1Å; I111-L120 HydrophobicContact CG2-CD2 4.06Å; L118-L120 HydrophobicContact CD1-CD2 4.19Å; L118-L120 HydrophobicContact CD2-CD2 4.05Å; L118-L120 HydrophobicContact CD2-CG 4.39Å; L118-L120 HydrophobicContact CG-CD2 4.03Å; L118-L120 HydrophobicContact CG-CG 4.38Å; L120-M122 HydrophobicContact CB-CG 4.43Å
121	V	97.2	Very high	93.5	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	121.6	178.5	-174.8	0	0	0	0	108.9	Y46 V72 I74 L108 F109 E110	Y46-V121 HydrophobicContact CD1-CG1 4.39Å; Y46-V121 HydrophobicContact CD2-CG2 4.17Å; Y46-V121 HydrophobicContact CE1-CG1 3.78Å; Y46-V121 HydrophobicContact CE2-CG1 4.23Å; Y46-V121 HydrophobicContact CE2-CG2 3.8Å; V72-V121 HydrophobicContact CB-CG1 3.84Å; V72-V121 HydrophobicContact CG1-CG1 4.15Å; V72-V121 HydrophobicContact CG2-CG1 3.76Å; I74-V121 HydrophobicContact CD1-CG2 4.15Å; I74-V121 HydrophobicContact CG1-CG1 4.28Å; I74-V121 HydrophobicContact CG1-CG2 4.12Å; I74-V121 HydrophobicContact CG2-CG2 4.47Å; L108-V121 WeakPolarHBondContact CD1-O 3.31Å; F109-V121 HydrophobicContact CB-CG1 4.48Å; F109-V121 PolarHBondContact N-O 2.66Å; E110-V121 HydrophobicContact CB-CB 3.79Å; E110-V121 HydrophobicContact CB-CG2 3.83Å; E110-V121 PolarHBondContact N-O 2.56Å; E110-V121 PolarHBondContact O-N 2.91Å
122	M	96.6	Very high	93	Very high	21 Å²	21	46.6 Å²	46.6	10%	0.103	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	165.9	-167.5	-46.6	175.5	-57.4	0	0	111.8	V60 A73 K75 M97 V106 K107 L108 L120	V60-M122 HydrophobicContact CG1-CE 4.46Å; A73-M122 HydrophobicContact CB-CE 4.18Å; A73-M122 PolarHBondContact N-O 3.38Å; A73-M122 WeakPolarHBondContact O-CA 3.32Å; A73-M122 WeakPolarHBondContact O-CB 3.48Å; A73-M122 PolarHBondContact O-N 3.28Å; K75-M122 HydrophobicContact CB-CE 3.8Å; K75-M122 HydrophobicContact CB-SD 4.19Å; M97-M122 HydrophobicContact CE-CG 3.87Å; M97-M122 HydrophobicContact CE-SD 3.55Å; M97-M122 VanDerWaalsContact CE-SD 3.55Å; V106-M122 HydrophobicContact CG1-CB 3.78Å; V106-M122 HydrophobicContact CG1-SD 4.48Å; K107-M122 CarbonylContact O-C 3.41Å; K107-M122 VanDerWaalsContact O-CA 3.28Å; K107-M122 WeakPolarHBondContact O-CA 3.36Å; L108-M122 HydrophobicContact CD1-CG 4.37Å; L120-M122 HydrophobicContact CB-CG 4.43Å
123	E	96	Very high	92.6	Very high	50 Å²	50	48 Å²	48	23%	0.234	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.1	137	168.8	-173	178	-155.1	0	0	112.5	V106 K107 F109 K183	V106-E123 HydrophobicContact CG1-CB 4.23Å; K107-E123 HydrophobicContact CB-CB 4.45Å; K107-E123 PolarHBondContact O-N 3.02Å; F109-E123 HydrophobicContact CE2-CB 4.19Å; F109-E123 HydrophobicContact CZ-CB 4.27Å; E123-K183 VanDerWaalsContact CD-CE 3.5Å; E123-K183 WeakPolarHBondContact OE1-CE 3.15Å; E123-K183 IonicContact OE1-NZ 2.7Å; E123-K183 PolarHBondContact OE1-NZ 3.02Å; E123-K183 WeakPolarHBondContact OE2-CD 3.44Å; E123-K183 VanDerWaalsContact OE2-CE 3.27Å; E123-K183 WeakPolarHBondContact OE2-CE 3.19Å; E123-K183 IonicContact OE2-NZ 2.74Å; E123-K183 PolarHBondContact OE2-NZ 3.13Å
124	Y	96.2	Very high	92.3	Very high	45 Å²	45	44.5 Å²	44.5	18%	0.176	24%	0.238	C	C	.	.			trans	-96.2	104.4	177	176.3	-132.3	0	0	0	112.1	R50 I52 L62 Q71 A73 S126	R50-Y124 PolarHBondContact NH2-OH 2.99Å; R50-Y124 VanDerWaalsContact NH2-OH 3.13Å; I52-Y124 HydrophobicContact CD1-CD2 3.97Å; I52-Y124 HydrophobicContact CD1-CE2 3.88Å; L62-Y124 HydrophobicContact CD1-CD1 3.44Å; L62-Y124 VanDerWaalsContact CD1-CD1 3.44Å; L62-Y124 HydrophobicContact CD1-CD2 4Å; L62-Y124 HydrophobicContact CD1-CE1 3.53Å; L62-Y124 HydrophobicContact CD1-CE2 4.12Å; L62-Y124 HydrophobicContact CD1-CG 3.69Å; L62-Y124 HydrophobicContact CD2-CE1 4.16Å; L62-Y124 HydrophobicContact CG-CE1 4.48Å; Q71-Y124 HydrophobicContact CB-CD1 4.06Å; A73-Y124 HydrophobicContact CB-CD2 4.42Å; Y124-S126 PolarHBondContact O-N 3.37Å
125	A	95.5	Very high	92.1	Very high	11 Å²	11	43.8 Å²	43.8	9%	0.091	24%	0.237	C	C	.	.			trans	-78.2	101.1	169.7	0	0	0	0	0	110.3	L175 L176 K183	A125-L175 HydrophobicContact CB-CB 3.53Å; A125-L175 HydrophobicContact CB-CD1 3.95Å; A125-L175 HydrophobicContact CB-CG 4.4Å; A125-L176 CarbonylContact C-O 3.51Å; A125-L176 WeakPolarHBondContact CB-O 3.45Å; A125-K183 HydrophobicContact CB-CB 4.04Å; A125-K183 HydrophobicContact CB-CG 4.16Å
126	S	94.1	Very high	92	Very high	56 Å²	56	40 Å²	40	39%	0.392	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-16.1	-169.6	58.5	0	0	0	0	115.9	Y124 G128 L176 A178	Y124-S126 PolarHBondContact O-N 3.37Å; S126-G128 VanDerWaalsContact C-N 3.29Å; S126-G128 PolarHBondContact O-N 3.49Å; S126-L176 PolarHBondContact N-O 3.29Å; S126-A178 WeakPolarHBondContact OG-CA 3.23Å; S126-A178 WeakPolarHBondContact OG-CB 3.14Å; S126-A178 PolarHBondContact OG-N 2.8Å
127	G	91.6	Very high	91.8	Very high	35 Å²	35	38.9 Å²	38.9	36%	0.361	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-3.1	-179.6	0	0	0	0	0	115.1	L176	G127-L176 VanDerWaalsContact CA-O 3.28Å; G127-L176 WeakPolarHBondContact CA-O 3.43Å; G127-L176 PolarHBondContact N-O 2.84Å
128	G	91.5	Very high	91.7	Very high	27 Å²	27	38 Å²	38	28%	0.278	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	81.5	-161.6	178.8	0	0	0	0	0	113.7	S126 L175 L176	S126-G128 VanDerWaalsContact C-N 3.29Å; S126-G128 PolarHBondContact O-N 3.49Å; G128-L175 CarbonylContact O-C 3.59Å; G128-L175 VanDerWaalsContact O-CA 3.32Å; G128-L175 WeakPolarHBondContact O-CA 3.32Å; G128-L176 PolarHBondContact O-N 2.92Å
129	E	91	Very high	91.6	Very high	53 Å²	53	42.3 Å²	42.3	25%	0.248	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	143.8	176.5	-62.1	177	-169.7	0	0	111.3	F131 D132 Y133 L175 R1058	E129-F131 PolarHBondContact O-N 3.31Å; E129-F131 VanDerWaalsContact O-N 3.15Å; E129-D132 HydrophobicContact CB-CB 4.32Å; E129-D132 PolarHBondContact N-OD2 3.48Å; E129-D132 WeakPolarHBondContact O-CB 3.37Å; E129-D132 PolarHBondContact O-N 3.36Å; E129-Y133 PolarHBondContact O-N 2.92Å; E129-L175 HydrophobicContact CG-CD2 4.14Å; E129-R1058 IonicContact OE2-NE 2.76Å; E129-R1058 PolarHBondContact OE2-NE 2.99Å
130	V	90.4	Very high	91.5	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.012	24%	0.237	C	C	.	.	H	α-helix	trans	-55	-32.3	167.1	171.6	0	0	0	0	111.1	Y133 L134 M140 L174 L176 I182 L236	V130-Y133 WeakPolarHBondContact O-CB 3.43Å; V130-Y133 PolarHBondContact O-N 3.43Å; V130-L134 WeakPolarHBondContact O-CG 3.42Å; V130-L134 PolarHBondContact O-N 3.02Å; V130-L134 VanDerWaalsContact O-N 3.14Å; V130-M140 HydrophobicContact CG1-CE 4.46Å; V130-L174 HydrophobicContact CB-CB 4.05Å; V130-L174 HydrophobicContact CG2-CB 3.75Å; V130-L174 WeakPolarHBondContact CG2-O 3.14Å; V130-L174 PolarHBondContact N-O 3.28Å; V130-L176 HydrophobicContact CG2-CD1 4.15Å; V130-L176 HydrophobicContact CG2-CD2 3.91Å; V130-L176 HydrophobicContact CG2-CG 3.76Å; V130-I182 HydrophobicContact CG2-CD1 3.43Å; V130-I182 VanDerWaalsContact CG2-CD1 3.43Å; V130-L236 HydrophobicContact CG1-CD2 3.63Å
131	F	83.1	Confident	91.5	Very high	9 Å²	9	48.7 Å²	48.7	4%	0.039	27%	0.271	C	S	.	.	H	α-helix	trans	-72.2	-32.4	176.6	-160	-140.4	0	0	0	113	E129 Y133 L134 V135 A171 R1058 F1059	E129-F131 PolarHBondContact O-N 3.31Å; E129-F131 VanDerWaalsContact O-N 3.15Å; F131-Y133 VanDerWaalsContact C-N 3.34Å; F131-L134 HydrophobicContact CD2-CB 4.31Å; F131-L134 HydrophobicContact CD2-CD1 4.23Å; F131-L134 PolarHBondContact O-N 3.32Å; F131-V135 HydrophobicContact CE2-CG2 4.48Å; F131-V135 HydrophobicContact CZ-CG2 4.47Å; F131-V135 PolarHBondContact O-N 2.67Å; F131-V135 VanDerWaalsContact O-N 3.1Å; F131-A171 HydrophobicContact CB-CB 3.79Å; F131-A171 HydrophobicContact CD2-CB 4.4Å; F131-A171 HydrophobicContact CG-CB 4.14Å; F131-R1058 VanDerWaalsContact C-CZ 3.44Å; F131-R1058 HydrophobicContact CD1-CG 3.81Å; F131-R1058 HydrophobicContact CE1-CG 3.77Å; F131-R1058 VanDerWaalsContact CE1-NH2 3.27Å; F131-R1058 PolarHBondContact O-NH2 2.95Å; F131-F1059 AromaticContact CD1-CE1 3.99Å; F131-F1059 HydrophobicContact CD1-CE1 3.99Å; F131-F1059 AromaticContact CD1-CE2 3.88Å; F131-F1059 HydrophobicContact CD1-CE2 3.88Å; F131-F1059 AromaticContact CD1-CZ 3.36Å; F131-F1059 HydrophobicContact CD1-CZ 3.36Å; F131-F1059 HydrophobicContact CE1-CD1 4.06Å; F131-F1059 AromaticContact CE1-CE1 3.29Å; F131-F1059 HydrophobicContact CE1-CE1 3.29Å; F131-F1059 AromaticContact CE1-CE2 3.81Å; F131-F1059 HydrophobicContact CE1-CE2 3.81Å; F131-F1059 AromaticContact CE1-CZ 3.15Å; F131-F1059 HydrophobicContact CE1-CZ 3.15Å; F131-F1059 AromaticContact CZ-CE1 3.9Å; F131-F1059 HydrophobicContact CZ-CE1 3.9Å; F131-F1059 HydrophobicContact CZ-CZ 4.14Å
132	D	86.2	Confident	91.6	Very high	69 Å²	69	50.1 Å²	50.1	37%	0.369	28%	0.278	S	S	.	.	H	α-helix	trans	-58.8	-47.7	170.6	-70.4	-39.8	0	0	0	110.6	E129 L134 V135 A136 R1058	E129-D132 HydrophobicContact CB-CB 4.32Å; E129-D132 PolarHBondContact N-OD2 3.48Å; E129-D132 WeakPolarHBondContact O-CB 3.37Å; E129-D132 PolarHBondContact O-N 3.36Å; D132-L134 VanDerWaalsContact C-N 3.34Å; D132-L134 PolarHBondContact O-N 2.87Å; D132-V135 PolarHBondContact O-N 3.39Å; D132-V135 VanDerWaalsContact O-N 3.09Å; D132-A136 PolarHBondContact O-N 3.03Å; D132-R1058 IonicContact OD1-CZ 3.82Å; D132-R1058 IonicContact OD1-NE 2.84Å; D132-R1058 PolarHBondContact OD1-NE 2.92Å; D132-R1058 VanDerWaalsContact OD1-NE 3.15Å; D132-R1058 IonicContact OD1-NH1 2.67Å; D132-R1058 PolarHBondContact OD1-NH1 2.96Å
133	Y	87.7	Confident	91.6	Very high	57 Å²	57	57 Å²	57	22%	0.224	31%	0.307	C	S	.	.	H	α-helix	trans	-55.9	-46.3	176.1	-172	-90.3	0	0	0	112.4	E129 V130 F131 V135 A136 H137 M140 E144 L176 M180	E129-Y133 PolarHBondContact O-N 2.92Å; V130-Y133 WeakPolarHBondContact O-CB 3.43Å; V130-Y133 PolarHBondContact O-N 3.43Å; F131-Y133 VanDerWaalsContact C-N 3.34Å; Y133-V135 VanDerWaalsContact C-N 3.28Å; Y133-V135 PolarHBondContact O-N 2.88Å; Y133-A136 PolarHBondContact O-N 2.9Å; Y133-H137 AromaticContact CD1-ND1 3.89Å; Y133-H137 AromaticContact CD2-CE1 3.43Å; Y133-H137 VanDerWaalsContact CD2-CE1 3.43Å; Y133-H137 WeakPolarHBondContact CD2-CE1 3.22Å; Y133-H137 AromaticContact CD2-ND1 3.27Å; Y133-H137 VanDerWaalsContact CD2-ND1 3.27Å; Y133-H137 WeakPolarHBondContact CD2-ND1 3.13Å; Y133-H137 HydrophobicContact CE1-CB 4.09Å; Y133-H137 AromaticContact CE1-ND1 3.83Å; Y133-H137 AromaticContact CE2-CE1 3.27Å; Y133-H137 WeakPolarHBondContact CE2-CE1 3.29Å; Y133-H137 AromaticContact CE2-CG 3.88Å; Y133-H137 AromaticContact CE2-ND1 3.21Å; Y133-H137 WeakPolarHBondContact CE2-ND1 3.48Å; Y133-H137 AromaticContact CE2-NE2 3.95Å; Y133-H137 AromaticContact CG-ND1 3.62Å; Y133-H137 AromaticContact CZ-CE1 3.93Å; Y133-H137 AromaticContact CZ-CG 3.74Å; Y133-H137 AromaticContact CZ-ND1 3.49Å; Y133-H137 PolarHBondContact O-N 3.36Å; Y133-H137 PolarHBondContact O-ND1 3.36Å; Y133-M140 HydrophobicContact CD1-CE 3.54Å; Y133-M140 HydrophobicContact CE1-CE 3.88Å; Y133-M140 HydrophobicContact CE1-CG 4.39Å; Y133-M140 HydrophobicContact CG-CE 4.47Å; Y133-E144 WeakPolarHBondContact CE1-OE1 3.42Å; Y133-E144 PolarHBondContact OH-OE1 2.81Å; Y133-L176 HydrophobicContact CG-CD1 4.47Å; Y133-M180 HydrophobicContact CD2-CE 3.42Å; Y133-M180 VanDerWaalsContact CD2-CE 3.42Å; Y133-M180 HydrophobicContact CE2-CE 3.45Å; Y133-M180 VanDerWaalsContact CE2-CE 3.45Å; Y133-M180 HydrophobicContact CG-CE 4.23Å
134	L	89.3	Confident	91.6	Very high	9 Å²	9	57.4 Å²	57.4	5%	0.047	31%	0.309	C	S	.	.	H	α-helix	trans	-66.1	-24.1	178.2	-70.5	175.5	0	0	0	114.2	V130 F131 D132 G138 M140 T235 L236	V130-L134 WeakPolarHBondContact O-CG 3.42Å; V130-L134 PolarHBondContact O-N 3.02Å; V130-L134 VanDerWaalsContact O-N 3.14Å; F131-L134 HydrophobicContact CD2-CB 4.31Å; F131-L134 HydrophobicContact CD2-CD1 4.23Å; F131-L134 PolarHBondContact O-N 3.32Å; D132-L134 VanDerWaalsContact C-N 3.34Å; D132-L134 PolarHBondContact O-N 2.87Å; L134-G138 WeakPolarHBondContact CA-O 3.49Å; L134-G138 WeakPolarHBondContact CD2-O 3.24Å; L134-G138 CarbonylContact O-C 3.56Å; L134-G138 WeakPolarHBondContact O-CA 3.5Å; L134-G138 PolarHBondContact O-N 3.45Å; L134-G138 VanDerWaalsContact O-N 3.11Å; L134-G138 VanDerWaalsContact O-O 3.13Å; L134-M140 HydrophobicContact CD2-CE 4.4Å; L134-M140 HydrophobicContact CD2-CG 3.84Å; L134-M140 HydrophobicContact CD2-SD 4.45Å; L134-T235 HydrophobicContact CD1-CG2 4.16Å; L134-L236 HydrophobicContact CD1-CD2 4.23Å
135	V	85.9	Confident	91.7	Very high	77 Å²	77	55.3 Å²	55.3	47%	0.467	30%	0.301	S	S	.	.	H	α-helix	trans	-84.8	-31.1	175.2	160	0	0	0	0	112	F131 D132 Y133	F131-V135 HydrophobicContact CE2-CG2 4.48Å; F131-V135 HydrophobicContact CZ-CG2 4.47Å; F131-V135 PolarHBondContact O-N 2.67Å; F131-V135 VanDerWaalsContact O-N 3.1Å; D132-V135 PolarHBondContact O-N 3.39Å; D132-V135 VanDerWaalsContact O-N 3.09Å; Y133-V135 VanDerWaalsContact C-N 3.28Å; Y133-V135 PolarHBondContact O-N 2.88Å
136	A	88.3	Confident	91.8	Very high	76 Å²	76	55.8 Å²	55.8	63%	0.628	30%	0.3	S	S	*	.	H	α-helix	trans	-76.4	-41.6	175.4	0	0	0	0	0	113.1	D132 Y133	D132-A136 PolarHBondContact O-N 3.03Å; Y133-A136 PolarHBondContact O-N 2.9Å
137	H	88.4	Confident	92	Very high	123 Å²	123	54.5 Å²	54.5	57%	0.569	29%	0.292	S	S	*	.	H	α-helix	trans	-107.6	-8.8	-172.2	-52.8	91.6	0	0	0	113.9	Y133	Y133-H137 AromaticContact CD1-ND1 3.89Å; Y133-H137 AromaticContact CD2-CE1 3.43Å; Y133-H137 VanDerWaalsContact CD2-CE1 3.43Å; Y133-H137 WeakPolarHBondContact CD2-CE1 3.22Å; Y133-H137 AromaticContact CD2-ND1 3.27Å; Y133-H137 VanDerWaalsContact CD2-ND1 3.27Å; Y133-H137 WeakPolarHBondContact CD2-ND1 3.13Å; Y133-H137 HydrophobicContact CE1-CB 4.09Å; Y133-H137 AromaticContact CE1-ND1 3.83Å; Y133-H137 AromaticContact CE2-CE1 3.27Å; Y133-H137 WeakPolarHBondContact CE2-CE1 3.29Å; Y133-H137 AromaticContact CE2-CG 3.88Å; Y133-H137 AromaticContact CE2-ND1 3.21Å; Y133-H137 WeakPolarHBondContact CE2-ND1 3.48Å; Y133-H137 AromaticContact CE2-NE2 3.95Å; Y133-H137 AromaticContact CG-ND1 3.62Å; Y133-H137 AromaticContact CZ-CE1 3.93Å; Y133-H137 AromaticContact CZ-CG 3.74Å; Y133-H137 AromaticContact CZ-ND1 3.49Å; Y133-H137 PolarHBondContact O-N 3.36Å; Y133-H137 PolarHBondContact O-ND1 3.36Å
138	G	89.5	Confident	92.3	Very high	32 Å²	32	54.2 Å²	54.2	33%	0.33	28%	0.282	S	S	.	.			trans	78.7	-152.8	-170.6	0	0	0	0	0	112.3	L134	L134-G138 WeakPolarHBondContact CA-O 3.49Å; L134-G138 WeakPolarHBondContact CD2-O 3.24Å; L134-G138 CarbonylContact O-C 3.56Å; L134-G138 WeakPolarHBondContact O-CA 3.5Å; L134-G138 PolarHBondContact O-N 3.45Å; L134-G138 VanDerWaalsContact O-N 3.11Å; L134-G138 VanDerWaalsContact O-O 3.13Å
139	R	93.2	Very high	92.6	Very high	102 Å²	102	53 Å²	53	39%	0.385	27%	0.268	S	S	.	.	S	Bend	trans	-70.6	140.8	-179.1	74	-170.1	-171.9	79.5	-0.4	111.7	V237 Y265	R139-V237 WeakPolarHBondContact CD-O 3.48Å; R139-V237 PolarHBondContact NH1-O 2.98Å; R139-Y265 VanDerWaalsContact CD-CZ 3.5Å; R139-Y265 WeakPolarHBondContact CD-OH 3.35Å; R139-Y265 VanDerWaalsContact CZ-CE2 3.44Å
140	M	94.7	Very high	92.9	Very high	5 Å²	5	51.4 Å²	51.4	3%	0.025	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-68.3	154.8	172.3	-70.6	178.1	175.1	0	0	111.3	V130 Y133 L134 E144 A145 K148 L236	V130-M140 HydrophobicContact CG1-CE 4.46Å; Y133-M140 HydrophobicContact CD1-CE 3.54Å; Y133-M140 HydrophobicContact CE1-CE 3.88Å; Y133-M140 HydrophobicContact CE1-CG 4.39Å; Y133-M140 HydrophobicContact CG-CE 4.47Å; L134-M140 HydrophobicContact CD2-CE 4.4Å; L134-M140 HydrophobicContact CD2-CG 3.84Å; L134-M140 HydrophobicContact CD2-SD 4.45Å; M140-E144 HydrophobicContact CB-CG 4.38Å; M140-E144 WeakPolarHBondContact CB-OE2 3.45Å; M140-E144 HydrophobicContact CG-CG 4.28Å; M140-E144 HydrophobicContact SD-CG 4.29Å; M140-A145 HydrophobicContact CB-CB 3.99Å; M140-A145 HydrophobicContact SD-CB 4.48Å; M140-K148 HydrophobicContact CE-CG 4.48Å; M140-K148 HydrophobicContact SD-CG 4.43Å; M140-L236 HydrophobicContact CE-CD2 4.15Å; M140-L236 PolarHBondContact N-O 2.89Å; M140-L236 HydrophobicContact SD-CB 4.46Å; M140-L236 HydrophobicContact SD-CD2 3.66Å
141	K	96.3	Very high	93.3	Very high	163 Å²	163	53 Å²	53	71%	0.709	27%	0.268	S	S	*	.	P	Polyproline II helix	trans	-76	148.6	166.4	-68.8	177	-178.2	172.8	0	109.2	K143 E144 A145	K141-K143 VanDerWaalsContact C-N 3.27Å; K141-K143 PolarHBondContact O-N 2.93Å; K141-K143 VanDerWaalsContact O-N 3.14Å; K141-E144 PolarHBondContact N-OE2 3.29Å; K141-E144 WeakPolarHBondContact O-CB 3.45Å; K141-E144 PolarHBondContact O-N 3.21Å; K141-A145 PolarHBondContact O-N 2.79Å
142	E	98	Very high	94	Very high	31 Å²	31	52.7 Å²	52.7	15%	0.145	27%	0.266	C	S	.	.	H	α-helix	trans	-59	-33.2	-174.4	-71.2	-169.2	-164.9	0	0	114.4	E144 R146 V237 M266 S267 W296	E142-E144 VanDerWaalsContact C-N 3.32Å; E142-E144 PolarHBondContact O-N 3.38Å; E142-R146 WeakPolarHBondContact O-CB 3.38Å; E142-R146 PolarHBondContact O-N 3Å; E142-V237 HydrophobicContact CG-CG1 4.18Å; E142-M266 WeakPolarHBondContact OE1-CA 3.24Å; E142-S267 PolarHBondContact OE1-N 3.17Å; E142-S267 PolarHBondContact OE1-OG 2.68Å; E142-S267 WeakPolarHBondContact OE2-CB 3.07Å; E142-S267 PolarHBondContact OE2-OG 2.76Å; E142-W296 HydrophobicContact CB-CZ2 3.97Å; E142-W296 HydrophobicContact CG-CZ2 4.22Å; E142-W296 PolarHBondContact OE2-NE1 3.08Å
143	K	97.5	Very high	94.6	Very high	166 Å²	166	49.4 Å²	49.4	72%	0.722	25%	0.249	S	C	*	.	H	α-helix	trans	-61.4	-39	173.8	-179.7	173.6	179.2	175.1	0	112.6	K141 A147	K141-K143 VanDerWaalsContact C-N 3.27Å; K141-K143 PolarHBondContact O-N 2.93Å; K141-K143 VanDerWaalsContact O-N 3.14Å; K143-A147 PolarHBondContact O-N 3.39Å
144	E	96.4	Very high	95.1	Very high	58 Å²	58	47.4 Å²	47.4	27%	0.271	24%	0.243	S	C	.	.	H	α-helix	trans	-76.1	-49.1	178.9	177.4	-162.5	-179.6	0	0	110.7	Y133 M140 K141 E142 R146 A147 K148	Y133-E144 WeakPolarHBondContact CE1-OE1 3.42Å; Y133-E144 PolarHBondContact OH-OE1 2.81Å; M140-E144 HydrophobicContact CB-CG 4.38Å; M140-E144 WeakPolarHBondContact CB-OE2 3.45Å; M140-E144 HydrophobicContact CG-CG 4.28Å; M140-E144 HydrophobicContact SD-CG 4.29Å; K141-E144 PolarHBondContact N-OE2 3.29Å; K141-E144 WeakPolarHBondContact O-CB 3.45Å; K141-E144 PolarHBondContact O-N 3.21Å; E142-E144 VanDerWaalsContact C-N 3.32Å; E142-E144 PolarHBondContact O-N 3.38Å; E144-R146 PolarHBondContact O-N 2.82Å; E144-A147 WeakPolarHBondContact O-CB 3.48Å; E144-A147 PolarHBondContact O-N 2.95Å; E144-K148 PolarHBondContact O-N 2.98Å; E144-K148 VanDerWaalsContact O-N 3.13Å
145	A	97.4	Very high	95.5	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-55.9	-39.7	175.6	0	0	0	0	0	111.4	M140 K141 K148 F149 L236 V237 W296	M140-A145 HydrophobicContact CB-CB 3.99Å; M140-A145 HydrophobicContact SD-CB 4.48Å; K141-A145 PolarHBondContact O-N 2.79Å; A145-K148 PolarHBondContact O-N 3.17Å; A145-F149 WeakPolarHBondContact O-CB 3.46Å; A145-F149 PolarHBondContact O-N 3.33Å; A145-L236 HydrophobicContact CB-CB 4.14Å; A145-V237 HydrophobicContact CB-CG1 3.68Å; A145-W296 HydrophobicContact CB-CH2 4.31Å
146	R	98.1	Very high	96	Very high	22 Å²	22	43.3 Å²	43.3	8%	0.083	22%	0.219	C	C	.	.	H	α-helix	trans	-60.4	-47.4	173.5	179.4	-177.5	-58.2	134.1	12.7	112.3	E142 E144 K148 F149 R150 W296 T299 Y301	E142-R146 WeakPolarHBondContact O-CB 3.38Å; E142-R146 PolarHBondContact O-N 3Å; E144-R146 PolarHBondContact O-N 2.82Å; R146-K148 VanDerWaalsContact C-N 3.31Å; R146-K148 PolarHBondContact O-N 3.14Å; R146-F149 PolarHBondContact O-N 3.12Å; R146-R150 HydrophobicContact CG-CG 4.39Å; R146-R150 WeakPolarHBondContact O-CB 3.44Å; R146-R150 VanDerWaalsContact O-CG 3.25Å; R146-R150 WeakPolarHBondContact O-CG 3.42Å; R146-R150 PolarHBondContact O-N 3.24Å; R146-W296 HydrophobicContact CB-CH2 3.79Å; R146-W296 HydrophobicContact CB-CZ2 4.18Å; R146-W296 HydrophobicContact CB-CZ3 4.04Å; R146-W296 WeakPolarHBondContact CD-O 3.21Å; R146-W296 HydrophobicContact CG-CZ3 4.41Å; R146-W296 PolarHBondContact NE-O 2.89Å; R146-T299 WeakPolarHBondContact CD-O 3.42Å; R146-T299 PolarHBondContact NE-O 2.99Å; R146-T299 PolarHBondContact NH1-O 2.89Å; R146-Y301 HydrophobicContact CG-CD2 4.39Å; R146-Y301 HydrophobicContact CG-CE2 4.08Å
147	A	97.4	Very high	96.5	Very high	28 Å²	28	40.3 Å²	40.3	23%	0.231	19%	0.191	C	C	.	.	H	α-helix	trans	-58.4	-43.9	178.9	0	0	0	0	0	111.6	K143 E144	K143-A147 PolarHBondContact O-N 3.39Å; E144-A147 WeakPolarHBondContact O-CB 3.48Å; E144-A147 PolarHBondContact O-N 2.95Å
148	K	97.3	Very high	96.9	Very high	30 Å²	30	34.6 Å²	34.6	13%	0.13	17%	0.165	C	C	.	.	H	α-helix	trans	-71.8	-41.3	176	-52.6	-49.8	170.3	-169	0	112.2	M140 E144 A145 R146 R150 Q151 I152 M180 I182	M140-K148 HydrophobicContact CE-CG 4.48Å; M140-K148 HydrophobicContact SD-CG 4.43Å; E144-K148 PolarHBondContact O-N 2.98Å; E144-K148 VanDerWaalsContact O-N 3.13Å; A145-K148 PolarHBondContact O-N 3.17Å; R146-K148 VanDerWaalsContact C-N 3.31Å; R146-K148 PolarHBondContact O-N 3.14Å; K148-R150 PolarHBondContact O-N 3.01Å; K148-Q151 WeakPolarHBondContact O-CB 3.32Å; K148-Q151 PolarHBondContact O-N 2.85Å; K148-Q151 VanDerWaalsContact O-N 3.15Å; K148-I152 WeakPolarHBondContact O-CG1 3.38Å; K148-I152 PolarHBondContact O-N 2.83Å; K148-M180 VanDerWaalsContact CE-O 3.3Å; K148-M180 WeakPolarHBondContact CE-O 3.26Å; K148-M180 PolarHBondContact NZ-O 2.63Å; K148-I182 HydrophobicContact CB-CD1 4.1Å; K148-I182 HydrophobicContact CB-CG1 3.93Å; K148-I182 HydrophobicContact CD-CG1 4.34Å
149	F	98.2	Very high	97.2	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-70.9	-28.9	-177.7	-161.5	-114	0	0	0	113.2	A145 R146 I152 V153 L229 I232 L233 L236 M277 W296 M297	A145-F149 WeakPolarHBondContact O-CB 3.46Å; A145-F149 PolarHBondContact O-N 3.33Å; R146-F149 PolarHBondContact O-N 3.12Å; F149-I152 HydrophobicContact CD2-CB 4.46Å; F149-I152 HydrophobicContact CD2-CD1 4.1Å; F149-I152 PolarHBondContact O-N 3.34Å; F149-V153 HydrophobicContact CD1-CG2 4.04Å; F149-V153 HydrophobicContact CE1-CG2 3.77Å; F149-V153 HydrophobicContact CE2-CG2 4.49Å; F149-V153 HydrophobicContact CG-CG2 4.5Å; F149-V153 HydrophobicContact CZ-CG2 4.02Å; F149-V153 WeakPolarHBondContact O-CB 3.48Å; F149-V153 VanDerWaalsContact O-CG2 3.32Å; F149-V153 WeakPolarHBondContact O-CG2 3.28Å; F149-V153 PolarHBondContact O-N 2.96Å; F149-L229 HydrophobicContact CE2-CB 4.2Å; F149-L229 HydrophobicContact CE2-CD2 4.18Å; F149-L229 VanDerWaalsContact CE2-O 3.31Å; F149-L229 WeakPolarHBondContact CE2-O 3.45Å; F149-L229 HydrophobicContact CZ-CB 4.02Å; F149-L229 WeakPolarHBondContact CZ-O 3.33Å; F149-I232 HydrophobicContact CD2-CG2 4.47Å; F149-I232 HydrophobicContact CE2-CG2 4.33Å; F149-L233 HydrophobicContact CD1-CB 4.49Å; F149-L233 HydrophobicContact CD1-CD1 4.03Å; F149-L233 HydrophobicContact CD1-CD2 4.37Å; F149-L233 HydrophobicContact CD2-CB 4.25Å; F149-L233 HydrophobicContact CE1-CB 4.06Å; F149-L233 HydrophobicContact CE1-CD1 4.33Å; F149-L233 HydrophobicContact CE1-CD2 3.93Å; F149-L233 HydrophobicContact CE1-CG 4.33Å; F149-L233 HydrophobicContact CE2-CB 3.79Å; F149-L233 HydrophobicContact CG-CD1 4.16Å; F149-L233 HydrophobicContact CZ-CB 3.69Å; F149-L233 HydrophobicContact CZ-CD2 4.32Å; F149-L233 HydrophobicContact CZ-CG 4.44Å; F149-L236 HydrophobicContact CB-CD1 4.41Å; F149-L236 HydrophobicContact CD2-CD1 4.11Å; F149-M277 HydrophobicContact CE1-CE 4.34Å; F149-M277 HydrophobicContact CE1-SD 4.21Å; F149-M277 HydrophobicContact CZ-CE 3.9Å; F149-M277 HydrophobicContact CZ-SD 4.19Å; F149-W296 HydrophobicContact CB-CZ3 4.46Å; F149-W296 HydrophobicContact CD1-CZ3 4.17Å; F149-M297 HydrophobicContact CD1-CE 3.97Å; F149-M297 HydrophobicContact CD1-SD 3.57Å; F149-M297 VanDerWaalsContact CD1-SD 3.57Å; F149-M297 HydrophobicContact CE1-SD 4.11Å
150	R	98.4	Very high	97.3	Very high	20 Å²	20	29.4 Å²	29.4	8%	0.075	14%	0.137	C	C	.	.	H	α-helix	trans	-59.2	-46.1	166.5	-73.2	170.7	67	91.7	0.2	111.7	R146 K148 V153 S154 M297 N298 N304 L306	R146-R150 HydrophobicContact CG-CG 4.39Å; R146-R150 WeakPolarHBondContact O-CB 3.44Å; R146-R150 VanDerWaalsContact O-CG 3.25Å; R146-R150 WeakPolarHBondContact O-CG 3.42Å; R146-R150 PolarHBondContact O-N 3.24Å; K148-R150 PolarHBondContact O-N 3.01Å; R150-V153 PolarHBondContact O-N 3.39Å; R150-S154 WeakPolarHBondContact O-CB 3.45Å; R150-S154 PolarHBondContact O-N 2.78Å; R150-M297 HydrophobicContact CB-CE 4.44Å; R150-M297 WeakPolarHBondContact CD-O 3.43Å; R150-M297 HydrophobicContact CG-CE 3.92Å; R150-M297 PolarHBondContact NH1-O 3.11Å; R150-N298 PolarHBondContact NH1-OD1 2.78Å; R150-N304 PolarHBondContact NH2-O 2.89Å; R150-L306 HydrophobicContact CB-CD2 4.16Å; R150-L306 HydrophobicContact CG-CD2 4.2Å
151	Q	98.1	Very high	97.2	Very high	37 Å²	37	33.9 Å²	33.9	17%	0.173	16%	0.158	C	C	.	.	H	α-helix	trans	-62.5	-43.7	176.1	-68.9	177.5	-24.7	0	0	112.1	N104 K148 S154 A155 N181 I182	N104-Q151 HydrophobicContact CB-CB 4.26Å; N104-Q151 WeakPolarHBondContact OD1-CB 3.49Å; K148-Q151 WeakPolarHBondContact O-CB 3.32Å; K148-Q151 PolarHBondContact O-N 2.85Å; K148-Q151 VanDerWaalsContact O-N 3.15Å; Q151-S154 PolarHBondContact O-N 3.45Å; Q151-A155 PolarHBondContact O-N 3.08Å; Q151-A155 VanDerWaalsContact O-N 3.08Å; Q151-N181 PolarHBondContact NE2-OD1 2.91Å; Q151-I182 HydrophobicContact CB-CB 3.92Å; Q151-I182 HydrophobicContact CB-CG1 4.14Å
152	I	98.1	Very high	97.1	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-62.4	-48.4	176.5	-60.2	162.1	0	0	0	111	K148 F149 S154 A155 V156 L174 I182 L229 I232 L236	K148-I152 WeakPolarHBondContact O-CG1 3.38Å; K148-I152 PolarHBondContact O-N 2.83Å; F149-I152 HydrophobicContact CD2-CB 4.46Å; F149-I152 HydrophobicContact CD2-CD1 4.1Å; F149-I152 PolarHBondContact O-N 3.34Å; I152-S154 VanDerWaalsContact C-N 3.34Å; I152-S154 PolarHBondContact O-N 2.96Å; I152-A155 PolarHBondContact O-N 2.97Å; I152-V156 HydrophobicContact CG2-CG2 4.45Å; I152-V156 WeakPolarHBondContact O-CG2 3.31Å; I152-V156 PolarHBondContact O-N 3.41Å; I152-L174 HydrophobicContact CD1-CD1 3.68Å; I152-L174 HydrophobicContact CD1-CD2 4.47Å; I152-L174 HydrophobicContact CG1-CD1 4.25Å; I152-L174 HydrophobicContact CG1-CD2 4.13Å; I152-L174 HydrophobicContact CG2-CD2 4.26Å; I152-I182 HydrophobicContact CD1-CD1 4.09Å; I152-I182 HydrophobicContact CD1-CG1 4.37Å; I152-I182 HydrophobicContact CG1-CB 4.36Å; I152-I182 HydrophobicContact CG1-CD1 4.05Å; I152-I182 HydrophobicContact CG1-CG1 3.91Å; I152-I182 HydrophobicContact CG1-CG2 3.74Å; I152-L229 HydrophobicContact CG2-CD2 3.3Å; I152-I232 HydrophobicContact CD1-CG2 4.16Å; I152-L236 HydrophobicContact CD1-CD1 4.35Å
153	V	98.4	Very high	96.8	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-64.5	-38	-179.3	167.4	0	0	0	0	111.5	F149 R150 Q157 V291 M292 M297 L306	F149-V153 HydrophobicContact CD1-CG2 4.04Å; F149-V153 HydrophobicContact CE1-CG2 3.77Å; F149-V153 HydrophobicContact CE2-CG2 4.49Å; F149-V153 HydrophobicContact CG-CG2 4.5Å; F149-V153 HydrophobicContact CZ-CG2 4.02Å; F149-V153 WeakPolarHBondContact O-CB 3.48Å; F149-V153 VanDerWaalsContact O-CG2 3.32Å; F149-V153 WeakPolarHBondContact O-CG2 3.28Å; F149-V153 PolarHBondContact O-N 2.96Å; R150-V153 PolarHBondContact O-N 3.39Å; V153-Q157 WeakPolarHBondContact O-CB 3.28Å; V153-Q157 PolarHBondContact O-N 2.94Å; V153-V291 HydrophobicContact CG1-CG1 4.22Å; V153-V291 HydrophobicContact CG2-CG1 4.05Å; V153-M292 HydrophobicContact CG1-CE 4.4Å; V153-M292 HydrophobicContact CG1-CG 3.61Å; V153-M297 HydrophobicContact CB-CE 3.93Å; V153-M297 HydrophobicContact CG1-CE 4.25Å; V153-M297 HydrophobicContact CG2-CE 3.82Å; V153-L306 HydrophobicContact CB-CD2 4.34Å; V153-L306 HydrophobicContact CG1-CD2 4.07Å
154	S	98.2	Very high	96.5	Very high	15 Å²	15	24.7 Å²	24.7	11%	0.105	12%	0.118	C	C	.	.	H	α-helix	trans	-58.7	-51.8	172.3	-169.3	0	0	0	0	111.6	H102 R150 Q151 I152 V156 Q157 Y158	H102-S154 PolarHBondContact NE2-OG 3.24Å; R150-S154 WeakPolarHBondContact O-CB 3.45Å; R150-S154 PolarHBondContact O-N 2.78Å; Q151-S154 PolarHBondContact O-N 3.45Å; I152-S154 VanDerWaalsContact C-N 3.34Å; I152-S154 PolarHBondContact O-N 2.96Å; S154-V156 PolarHBondContact O-N 3.34Å; S154-Q157 PolarHBondContact O-N 2.86Å; S154-Y158 VanDerWaalsContact O-CB 3.31Å; S154-Y158 WeakPolarHBondContact O-CB 3.37Å; S154-Y158 PolarHBondContact O-N 3.37Å
155	A	97.7	Very high	96.3	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-61.3	-43.4	-178.8	0	0	0	0	0	113	H102 N104 I105 Q151 I152 C159 L184	H102-A155 VanDerWaalsContact CE1-CA 3.46Å; H102-A155 WeakPolarHBondContact CE1-CA 3.38Å; H102-A155 PolarHBondContact CE1-N 3.44Å; N104-A155 HydrophobicContact CB-CB 4.29Å; I105-A155 HydrophobicContact CD1-CB 4.34Å; I105-A155 HydrophobicContact CG1-CB 3.85Å; Q151-A155 PolarHBondContact O-N 3.08Å; Q151-A155 VanDerWaalsContact O-N 3.08Å; I152-A155 PolarHBondContact O-N 2.97Å; A155-C159 PolarHBondContact O-N 2.84Å; A155-C159 VanDerWaalsContact O-N 3.16Å; A155-C159 PolarHBondContact O-SG 2.86Å; A155-L184 HydrophobicContact CB-CD2 4.23Å
156	V	97.3	Very high	95.9	Very high	1 Å²	1	22 Å²	22	1%	0.006	11%	0.106	C	C	.	.	H	α-helix	trans	-75.4	-35.5	-179.4	-176.9	0	0	0	0	111.7	I152 S154 C159 H160 L169 L184 D225 L229 L288	I152-V156 HydrophobicContact CG2-CG2 4.45Å; I152-V156 WeakPolarHBondContact O-CG2 3.31Å; I152-V156 PolarHBondContact O-N 3.41Å; S154-V156 PolarHBondContact O-N 3.34Å; V156-C159 WeakPolarHBondContact O-CB 3.16Å; V156-C159 PolarHBondContact O-N 3.49Å; V156-H160 WeakPolarHBondContact CG1-NE2 3.45Å; V156-H160 PolarHBondContact O-CD2 2.83Å; V156-H160 PolarHBondContact O-N 3.43Å; V156-L169 HydrophobicContact CG1-CD1 3.94Å; V156-L169 HydrophobicContact CG2-CD1 3.89Å; V156-L169 HydrophobicContact CG2-CD2 3.97Å; V156-L184 HydrophobicContact CG2-CD2 4.06Å; V156-D225 HydrophobicContact CG1-CB 4.15Å; V156-L229 HydrophobicContact CB-CD1 4.14Å; V156-L229 HydrophobicContact CG1-CD1 4.05Å; V156-L229 HydrophobicContact CG2-CD1 4.33Å; V156-L229 HydrophobicContact CG2-CD2 4.36Å; V156-L288 HydrophobicContact CB-CD1 4.05Å; V156-L288 HydrophobicContact CG1-CD1 3.77Å
157	Q	97.4	Very high	95.5	Very high	12 Å²	12	21.9 Å²	21.9	6%	0.056	11%	0.105	C	C	.	.	H	α-helix	trans	-65.2	-40.3	174.2	-178.3	-81	-32.5	0	0	111.4	V153 S154 C159 H160 Q161 L288 M292 P308	V153-Q157 WeakPolarHBondContact O-CB 3.28Å; V153-Q157 PolarHBondContact O-N 2.94Å; S154-Q157 PolarHBondContact O-N 2.86Å; Q157-C159 PolarHBondContact O-N 2.6Å; Q157-H160 PolarHBondContact O-N 2.86Å; Q157-H160 VanDerWaalsContact O-N 3.14Å; Q157-Q161 WeakPolarHBondContact O-CB 3.46Å; Q157-Q161 PolarHBondContact O-N 3.37Å; Q157-L288 HydrophobicContact CB-CB 3.99Å; Q157-L288 HydrophobicContact CB-CD1 3.95Å; Q157-L288 HydrophobicContact CG-CB 4.16Å; Q157-M292 HydrophobicContact CB-CE 3.74Å; Q157-M292 HydrophobicContact CB-SD 4.26Å; Q157-M292 HydrophobicContact CG-CE 3.81Å; Q157-M292 HydrophobicContact CG-SD 3.83Å; Q157-P308 VanDerWaalsContact OE1-CA 3.32Å
158	Y	97.2	Very high	95	Very high	4 Å²	4	20.8 Å²	20.8	2%	0.016	10%	0.096	C	C	.	.	H	α-helix	trans	-57.8	-45.9	172.8	167.8	-103	0	0	0	112.2	L100 D101 H102 I105 S154 H160 Q161 K162 Y309 E311	L100-Y158 HydrophobicContact CB-CE1 4.29Å; L100-Y158 HydrophobicContact CD2-CD1 4.03Å; L100-Y158 HydrophobicContact CD2-CE1 3.48Å; L100-Y158 VanDerWaalsContact CD2-CE1 3.48Å; L100-Y158 HydrophobicContact CG-CE1 4.5Å; D101-Y158 PolarHBondContact N-OH 3.31Å; D101-Y158 PolarHBondContact O-OH 3.19Å; H102-Y158 HydrophobicContact CB-CD1 3.67Å; H102-Y158 HydrophobicContact CB-CE1 3.73Å; H102-Y158 HydrophobicContact CB-CG 4.23Å; H102-Y158 AromaticContact CD2-CG 3.83Å; I105-Y158 HydrophobicContact CD1-CD1 3.75Å; I105-Y158 HydrophobicContact CD1-CE1 4.06Å; S154-Y158 VanDerWaalsContact O-CB 3.31Å; S154-Y158 WeakPolarHBondContact O-CB 3.37Å; S154-Y158 PolarHBondContact O-N 3.37Å; Y158-H160 PolarHBondContact O-N 2.73Å; Y158-Q161 PolarHBondContact O-N 3.45Å; Y158-K162 HydrophobicContact CE2-CD 4.27Å; Y158-K162 PolarHBondContact O-N 2.97Å; Y158-K162 VanDerWaalsContact OH-CE 3.31Å; Y158-K162 WeakPolarHBondContact OH-CE 3.5Å; Y158-K162 PolarHBondContact OH-NZ 3.47Å; Y158-Y309 AromaticContact CD2-CD1 3.69Å; Y158-Y309 HydrophobicContact CD2-CD1 3.69Å; Y158-Y309 HydrophobicContact CD2-CE1 4.47Å; Y158-Y309 HydrophobicContact CE2-CD1 4.02Å; Y158-Y309 HydrophobicContact CE2-CE1 4.4Å; Y158-Y309 HydrophobicContact CG-CD1 4.3Å; Y158-E311 HydrophobicContact CE2-CB 4.35Å; Y158-E311 WeakPolarHBondContact CE2-OE2 3.43Å; Y158-E311 VanDerWaalsContact CZ-OE2 3.24Å; Y158-E311 VanDerWaalsContact OH-CD 3.27Å; Y158-E311 PolarHBondContact OH-OE2 3.32Å
159	C	95.5	Very high	94.8	Very high	2 Å²	2	19.5 Å²	19.5	1%	0.014	9%	0.09	C	C	.	.	H	α-helix	trans	-57.3	-47.2	171.4	-68.3	0	0	0	0	111.8	A155 V156 Q157 Q161 K162 H163 I164	A155-C159 PolarHBondContact O-N 2.84Å; A155-C159 VanDerWaalsContact O-N 3.16Å; A155-C159 PolarHBondContact O-SG 2.86Å; V156-C159 WeakPolarHBondContact O-CB 3.16Å; V156-C159 PolarHBondContact O-N 3.49Å; Q157-C159 PolarHBondContact O-N 2.6Å; C159-Q161 VanDerWaalsContact C-N 3.29Å; C159-Q161 PolarHBondContact O-N 3.26Å; C159-K162 CarbonylContact O-C 3.2Å; C159-K162 PolarHBondContact O-N 2.61Å; C159-K162 VanDerWaalsContact O-N 3.15Å; C159-H163 PolarHBondContact O-N 3.12Å; C159-I164 CarbonylContact C-O 3.58Å; C159-I164 HydrophobicContact CB-CB 4.28Å; C159-I164 HydrophobicContact CB-CG2 4.48Å; C159-I164 WeakPolarHBondContact O-CA 3.42Å; C159-I164 WeakPolarHBondContact O-CB 3.29Å; C159-I164 PolarHBondContact O-N 3.49Å; C159-I164 VanDerWaalsContact O-O 3.13Å
160	H	94.8	Very high	94.3	Very high	22 Å²	22	20.6 Å²	20.6	10%	0.102	10%	0.095	C	C	.	.	H	α-helix	trans	-62.8	-35.4	-180	-69.2	-170.8	0	0	0	112.1	V156 Q157 Y158 H163 I164 P222 D225	V156-H160 WeakPolarHBondContact CG1-NE2 3.45Å; V156-H160 PolarHBondContact O-CD2 2.83Å; V156-H160 PolarHBondContact O-N 3.43Å; Q157-H160 PolarHBondContact O-N 2.86Å; Q157-H160 VanDerWaalsContact O-N 3.14Å; Y158-H160 PolarHBondContact O-N 2.73Å; H160-H163 WeakPolarHBondContact O-CA 3.4Å; H160-H163 PolarHBondContact O-N 3.15Å; H160-H163 VanDerWaalsContact O-N 3.1Å; H160-I164 PolarHBondContact CD2-O 3.36Å; H160-I164 VanDerWaalsContact CD2-O 3.29Å; H160-I164 PolarHBondContact N-O 2.86Å; H160-P222 PolarHBondContact CE1-O 3.29Å; H160-D225 IonicContact CD2-OD2 3.02Å; H160-D225 IonicContact CE1-OD2 3.35Å; H160-D225 IonicContact NE2-OD2 3.15Å; H160-D225 PolarHBondContact NE2-OD2 3.45Å
161	Q	93.8	Very high	93.6	Very high	100 Å²	100	19.8 Å²	19.8	47%	0.467	9%	0.093	S	C	.	.	H	α-helix	trans	-68.1	-35	174.7	-179.4	175.3	-35.6	0	0	112.6	Q157 Y158 C159 H163	Q157-Q161 WeakPolarHBondContact O-CB 3.46Å; Q157-Q161 PolarHBondContact O-N 3.37Å; Y158-Q161 PolarHBondContact O-N 3.45Å; C159-Q161 VanDerWaalsContact C-N 3.29Å; C159-Q161 PolarHBondContact O-N 3.26Å; Q161-H163 PolarHBondContact O-N 3.02Å
162	K	93.1	Very high	92.8	Very high	73 Å²	73	20.6 Å²	20.6	32%	0.317	10%	0.096	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	17.3	167.7	-75.1	-163.7	173.3	-174.7	0	113.7	L99 Y158 C159 I164 E311	L99-K162 WeakPolarHBondContact O-CD 3.37Å; L99-K162 PolarHBondContact O-NZ 2.87Å; Y158-K162 HydrophobicContact CE2-CD 4.27Å; Y158-K162 PolarHBondContact O-N 2.97Å; Y158-K162 VanDerWaalsContact OH-CE 3.31Å; Y158-K162 WeakPolarHBondContact OH-CE 3.5Å; Y158-K162 PolarHBondContact OH-NZ 3.47Å; C159-K162 CarbonylContact O-C 3.2Å; C159-K162 PolarHBondContact O-N 2.61Å; C159-K162 VanDerWaalsContact O-N 3.15Å; K162-I164 VanDerWaalsContact C-N 3.32Å; K162-I164 HydrophobicContact CB-CD1 4.04Å; K162-I164 PolarHBondContact O-N 2.77Å; K162-E311 WeakPolarHBondContact CE-OE2 3.47Å; K162-E311 IonicContact NZ-OE1 3.41Å; K162-E311 PolarHBondContact NZ-OE1 2.77Å; K162-E311 IonicContact NZ-OE2 2.98Å; K162-E311 PolarHBondContact NZ-OE2 3.06Å
163	H	92	Very high	92.4	Very high	90 Å²	90	21 Å²	21	42%	0.417	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	33	-179.3	-67.7	-56.8	0	0	0	115.2	C159 H160 Q161 E192 F193	C159-H163 PolarHBondContact O-N 3.12Å; H160-H163 WeakPolarHBondContact O-CA 3.4Å; H160-H163 PolarHBondContact O-N 3.15Å; H160-H163 VanDerWaalsContact O-N 3.1Å; Q161-H163 PolarHBondContact O-N 3.02Å; H163-E192 CarbonylContact O-C 3.59Å; H163-E192 WeakPolarHBondContact O-CA 3.29Å; H163-F193 VanDerWaalsContact CA-CE1 3.46Å; H163-F193 HydrophobicContact CB-CD1 4.43Å; H163-F193 HydrophobicContact CB-CE1 4.33Å; H163-F193 AromaticContact ND1-CE2 4Å; H163-F193 AromaticContact ND1-CZ 3.89Å; H163-F193 WeakPolarHBondContact O-CD1 3.31Å; H163-F193 PolarHBondContact O-N 3.08Å
164	I	91.8	Very high	92.2	Very high	3 Å²	3	21.1 Å²	21.1	2%	0.015	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	128.6	179.9	-60.6	158.4	0	0	0	110.2	L96 L100 C159 H160 K162	L96-I164 HydrophobicContact CD1-CG2 4.02Å; L96-I164 HydrophobicContact CD2-CD1 3.75Å; L96-I164 HydrophobicContact CD2-CG1 3.76Å; L96-I164 HydrophobicContact CD2-CG2 4.45Å; L100-I164 HydrophobicContact CD2-CD1 3.87Å; L100-I164 HydrophobicContact CG-CD1 4.27Å; C159-I164 CarbonylContact C-O 3.58Å; C159-I164 HydrophobicContact CB-CB 4.28Å; C159-I164 HydrophobicContact CB-CG2 4.48Å; C159-I164 WeakPolarHBondContact O-CA 3.42Å; C159-I164 WeakPolarHBondContact O-CB 3.29Å; C159-I164 PolarHBondContact O-N 3.49Å; C159-I164 VanDerWaalsContact O-O 3.13Å; H160-I164 PolarHBondContact CD2-O 3.36Å; H160-I164 VanDerWaalsContact CD2-O 3.29Å; H160-I164 PolarHBondContact N-O 2.86Å; K162-I164 VanDerWaalsContact C-N 3.32Å; K162-I164 HydrophobicContact CB-CD1 4.04Å; K162-I164 PolarHBondContact O-N 2.77Å
165	I	91.4	Very high	92.1	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	137.8	170.8	-51.6	137.9	0	0	0	108.7	R167 S190 N191 F193 L199 V224 D225	I165-R167 HydrophobicContact CB-CG 4.02Å; I165-R167 HydrophobicContact CG2-CG 3.51Å; I165-S190 CarbonylContact O-C 3.52Å; I165-S190 WeakPolarHBondContact O-CA 3.34Å; I165-S190 WeakPolarHBondContact O-CB 3.31Å; I165-N191 PolarHBondContact N-O 2.85Å; I165-N191 PolarHBondContact O-N 2.86Å; I165-F193 HydrophobicContact CD1-CB 3.52Å; I165-F193 HydrophobicContact CD1-CD1 3.5Å; I165-F193 HydrophobicContact CD1-CE1 4.34Å; I165-F193 HydrophobicContact CD1-CG 3.64Å; I165-F193 HydrophobicContact CG1-CB 4.43Å; I165-F193 HydrophobicContact CG1-CD1 3.42Å; I165-F193 VanDerWaalsContact CG1-CD1 3.42Å; I165-F193 HydrophobicContact CG1-CE1 3.83Å; I165-F193 HydrophobicContact CG1-CG 4.06Å; I165-L199 HydrophobicContact CD1-CD1 3.72Å; I165-V224 HydrophobicContact CG2-CG2 4.43Å; I165-D225 HydrophobicContact CG2-CB 4.5Å; I165-D225 VanDerWaalsContact CG2-OD2 3.22Å; I165-D225 WeakPolarHBondContact CG2-OD2 3.42Å
166	H	90.5	Very high	92	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.005	11%	0.106	C	C	.	.			trans	-77.1	-44.4	-176.5	-167	-83.3	0	0	0	113	D168 L169 A185 F187 S190 D225	H166-D168 PolarHBondContact CE1-O 3.14Å; H166-D168 VanDerWaalsContact CE1-O 3.24Å; H166-D168 VanDerWaalsContact ND1-C 3.3Å; H166-D168 PolarHBondContact ND1-O 3.27Å; H166-D168 PolarHBondContact O-N 2.83Å; H166-L169 HydrophobicContact CB-CD1 4.29Å; H166-L169 HydrophobicContact CB-CD2 3.83Å; H166-L169 HydrophobicContact CB-CG 3.78Å; H166-A185 PolarHBondContact NE2-O 2.87Å; H166-F187 AromaticContact CD2-CD1 3.75Å; H166-F187 AromaticContact CD2-CE1 3.65Å; H166-S190 WeakPolarHBondContact CA-OG 3.42Å; H166-S190 VanDerWaalsContact O-CA 3.32Å; H166-S190 WeakPolarHBondContact O-CA 3.18Å; H166-S190 PolarHBondContact O-N 2.81Å; H166-S190 PolarHBondContact O-OG 3.46Å; H166-S190 VanDerWaalsContact O-OG 3.09Å; H166-D225 PolarHBondContact N-OD2 3.24Å
167	R	88.6	Confident	91.9	Very high	20 Å²	20	23.7 Å²	23.7	8%	0.075	11%	0.111	C	C	.	.	S	Bend	trans	63.8	-13.8	176	-53	-167.3	-57.9	175.7	-2.8	118.1	I165 F189 G204 Y219 D225	I165-R167 HydrophobicContact CB-CG 4.02Å; I165-R167 HydrophobicContact CG2-CG 3.51Å; R167-F189 VanDerWaalsContact CZ-O 3.31Å; R167-F189 PolarHBondContact NE-O 2.96Å; R167-F189 PolarHBondContact NH2-O 3.45Å; R167-G204 WeakPolarHBondContact O-CA 3.4Å; R167-Y219 PolarHBondContact NH1-OH 3.39Å; R167-D225 PolarHBondContact N-OD1 3.23Å
168	D	88	Confident	91.7	Very high	6 Å²	6	26 Å²	26	3%	0.032	13%	0.133	C	C	.	.			trans	-125.9	57.5	165.5	-167.3	32.3	0	0	0	111.1	H166 K170 N173 F189 G204 S205	H166-D168 PolarHBondContact CE1-O 3.14Å; H166-D168 VanDerWaalsContact CE1-O 3.24Å; H166-D168 VanDerWaalsContact ND1-C 3.3Å; H166-D168 PolarHBondContact ND1-O 3.27Å; H166-D168 PolarHBondContact O-N 2.83Å; D168-K170 PolarHBondContact O-N 3.49Å; D168-K170 WeakPolarHBondContact OD2-CE 3.33Å; D168-K170 IonicContact OD2-NZ 2.73Å; D168-K170 PolarHBondContact OD2-NZ 3.33Å; D168-N173 PolarHBondContact O-ND2 3.16Å; D168-F189 HydrophobicContact CB-CB 3.93Å; D168-F189 HydrophobicContact CB-CD2 3.74Å; D168-F189 HydrophobicContact CB-CG 4.06Å; D168-G204 VanDerWaalsContact OD1-CA 3.27Å; D168-G204 WeakPolarHBondContact OD1-CA 3.4Å; D168-S205 PolarHBondContact OD1-N 3.22Å
169	L	92.5	Very high	91.5	Very high	2 Å²	2	29.5 Å²	29.5	1%	0.01	15%	0.152	C	C	.	.			trans	-78.1	115.1	172.1	-71.3	174.4	0	0	0	109.8	V156 H166 L184 Y208 D225 L229 I232	V156-L169 HydrophobicContact CG1-CD1 3.94Å; V156-L169 HydrophobicContact CG2-CD1 3.89Å; V156-L169 HydrophobicContact CG2-CD2 3.97Å; H166-L169 HydrophobicContact CB-CD1 4.29Å; H166-L169 HydrophobicContact CB-CD2 3.83Å; H166-L169 HydrophobicContact CB-CG 3.78Å; L169-L184 HydrophobicContact CD2-CD1 3.72Å; L169-Y208 VanDerWaalsContact O-CB 3.29Å; L169-Y208 WeakPolarHBondContact O-CB 3.44Å; L169-D225 HydrophobicContact CD1-CB 3.61Å; L169-L229 HydrophobicContact CD1-CD1 4.35Å; L169-L229 HydrophobicContact CD1-CD2 4.2Å; L169-L229 HydrophobicContact CD1-CG 3.95Å; L169-I232 HydrophobicContact CB-CD1 4.06Å
170	K	88.1	Confident	91.4	Very high	23 Å²	23	32.6 Å²	32.6	10%	0.1	17%	0.167	C	C	.	.			trans	-151.9	159.2	-176.4	57.1	179.2	-176.9	168.2	0	109.6	D168 E172 N173 Y208	D168-K170 PolarHBondContact O-N 3.49Å; D168-K170 WeakPolarHBondContact OD2-CE 3.33Å; D168-K170 IonicContact OD2-NZ 2.73Å; D168-K170 PolarHBondContact OD2-NZ 3.33Å; K170-E172 HydrophobicContact CD-CB 4.08Å; K170-E172 HydrophobicContact CD-CG 4.42Å; K170-E172 WeakPolarHBondContact CD-OE2 3.47Å; K170-E172 WeakPolarHBondContact CE-OE2 3.41Å; K170-E172 HydrophobicContact CG-CB 4.16Å; K170-E172 IonicContact NZ-OE2 3.37Å; K170-E172 PolarHBondContact NZ-OE2 2.83Å; K170-E172 PolarHBondContact O-N 2.94Å; K170-E172 VanDerWaalsContact O-N 3.17Å; K170-N173 WeakPolarHBondContact CE-ND2 3.21Å; K170-N173 WeakPolarHBondContact CE-OD1 3.24Å; K170-N173 HydrophobicContact CG-CB 4Å; K170-N173 PolarHBondContact O-N 3.5Å; K170-Y208 HydrophobicContact CB-CD1 4.34Å; K170-Y208 HydrophobicContact CB-CD2 3.61Å; K170-Y208 HydrophobicContact CB-CE1 4.24Å; K170-Y208 HydrophobicContact CB-CE2 3.49Å; K170-Y208 VanDerWaalsContact CB-CE2 3.49Å; K170-Y208 HydrophobicContact CB-CG 4.05Å
171	A	83.6	Confident	91.5	Very high	4 Å²	4	33.8 Å²	33.8	3%	0.033	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-67	-16.1	-176.4	0	0	0	0	0	114.7	F131 Y208	F131-A171 HydrophobicContact CB-CB 3.79Å; F131-A171 HydrophobicContact CD2-CB 4.4Å; F131-A171 HydrophobicContact CG-CB 4.14Å; A171-Y208 WeakPolarHBondContact CB-OH 3.43Å; A171-Y208 PolarHBondContact N-OH 2.89Å
172	E	80.3	Confident	91.7	Very high	53 Å²	53	29 Å²	29	25%	0.248	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-70	-33.5	169.7	-62.2	149.3	-123.7	0	0	112.2	K170 L174 F1059	K170-E172 HydrophobicContact CD-CB 4.08Å; K170-E172 HydrophobicContact CD-CG 4.42Å; K170-E172 WeakPolarHBondContact CD-OE2 3.47Å; K170-E172 WeakPolarHBondContact CE-OE2 3.41Å; K170-E172 HydrophobicContact CG-CB 4.16Å; K170-E172 IonicContact NZ-OE2 3.37Å; K170-E172 PolarHBondContact NZ-OE2 2.83Å; K170-E172 PolarHBondContact O-N 2.94Å; K170-E172 VanDerWaalsContact O-N 3.17Å; E172-L174 VanDerWaalsContact C-N 3.25Å; E172-L174 PolarHBondContact O-N 2.8Å; E172-F1059 HydrophobicContact CG-CE2 3.93Å; E172-F1059 HydrophobicContact CG-CZ 4.37Å; E172-F1059 WeakPolarHBondContact OE1-CE2 3.27Å
173	N	91.4	Very high	91.9	Very high	11 Å²	11	26.2 Å²	26.2	6%	0.059	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-88.2	6.2	-177.6	-74.1	0.6	0	0	0	112.4	D168 K170 A185	D168-N173 PolarHBondContact O-ND2 3.16Å; K170-N173 WeakPolarHBondContact CE-ND2 3.21Å; K170-N173 WeakPolarHBondContact CE-OD1 3.24Å; K170-N173 HydrophobicContact CG-CB 4Å; K170-N173 PolarHBondContact O-N 3.5Å; N173-A185 WeakPolarHBondContact CB-O 3.22Å; N173-A185 PolarHBondContact O-N 2.61Å
174	L	94.2	Very high	92.1	Very high	1 Å²	1	22 Å²	22	1%	0.005	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	105	174.4	-63	178.1	0	0	0	108.3	V130 I152 E172 I182 L184 I232	V130-L174 HydrophobicContact CB-CB 4.05Å; V130-L174 HydrophobicContact CG2-CB 3.75Å; V130-L174 WeakPolarHBondContact CG2-O 3.14Å; V130-L174 PolarHBondContact N-O 3.28Å; I152-L174 HydrophobicContact CD1-CD1 3.68Å; I152-L174 HydrophobicContact CD1-CD2 4.47Å; I152-L174 HydrophobicContact CG1-CD1 4.25Å; I152-L174 HydrophobicContact CG1-CD2 4.13Å; I152-L174 HydrophobicContact CG2-CD2 4.26Å; E172-L174 VanDerWaalsContact C-N 3.25Å; E172-L174 PolarHBondContact O-N 2.8Å; L174-I182 HydrophobicContact CD2-CG2 4.35Å; L174-L184 HydrophobicContact CD2-CD1 3.87Å; L174-I232 HydrophobicContact CD1-CD1 4.17Å; L174-I232 HydrophobicContact CD1-CG1 4.48Å; L174-I232 HydrophobicContact CD1-CG2 3.8Å
175	L	95.2	Very high	92.1	Very high	46 Å²	46	22.6 Å²	22.6	24%	0.241	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	166.6	176.3	-52.1	-179.5	0	0	0	110.7	A125 G128 E129 I182 K183 A185	A125-L175 HydrophobicContact CB-CB 3.53Å; A125-L175 HydrophobicContact CB-CD1 3.95Å; A125-L175 HydrophobicContact CB-CG 4.4Å; G128-L175 CarbonylContact O-C 3.59Å; G128-L175 VanDerWaalsContact O-CA 3.32Å; G128-L175 WeakPolarHBondContact O-CA 3.32Å; E129-L175 HydrophobicContact CG-CD2 4.14Å; L175-I182 WeakPolarHBondContact O-CA 3.44Å; L175-K183 HydrophobicContact CB-CB 4.26Å; L175-K183 WeakPolarHBondContact CB-O 3.34Å; L175-K183 PolarHBondContact N-O 2.94Å; L175-K183 PolarHBondContact O-N 3.34Å; L175-A185 HydrophobicContact CD1-CB 4.02Å; L175-A185 HydrophobicContact CG-CB 4.28Å
176	L	95.4	Very high	91.7	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.005	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	135.9	175.5	-68.2	164	0	0	0	110	A125 S126 G127 G128 V130 Y133 M180 N181 I182	A125-L176 CarbonylContact C-O 3.51Å; A125-L176 WeakPolarHBondContact CB-O 3.45Å; S126-L176 PolarHBondContact N-O 3.29Å; G127-L176 VanDerWaalsContact CA-O 3.28Å; G127-L176 WeakPolarHBondContact CA-O 3.43Å; G127-L176 PolarHBondContact N-O 2.84Å; G128-L176 PolarHBondContact O-N 2.92Å; V130-L176 HydrophobicContact CG2-CD1 4.15Å; V130-L176 HydrophobicContact CG2-CD2 3.91Å; V130-L176 HydrophobicContact CG2-CG 3.76Å; Y133-L176 HydrophobicContact CG-CD1 4.47Å; L176-M180 HydrophobicContact CD1-CE 3.79Å; L176-M180 HydrophobicContact CD1-SD 4.4Å; L176-M180 VanDerWaalsContact CD2-O 3.31Å; L176-M180 WeakPolarHBondContact CD2-O 3.33Å; L176-N181 CarbonylContact C-O 3.5Å; L176-N181 VanDerWaalsContact CA-O 3.31Å; L176-N181 WeakPolarHBondContact CA-O 3.21Å; L176-I182 HydrophobicContact CD2-CD1 4.16Å
177	D	94.7	Very high	91.2	Very high	23 Å²	23	25.6 Å²	25.6	12%	0.123	14%	0.141	C	C	.	.			trans	-81.4	-177.4	170.3	71.2	19.7	0	0	0	112.5	D179 M180 N181 K183	D177-D179 PolarHBondContact O-N 2.93Å; D177-D179 VanDerWaalsContact OD1-C 3.25Å; D177-D179 WeakPolarHBondContact OD1-CA 3.2Å; D177-D179 PolarHBondContact OD1-N 2.83Å; D177-M180 PolarHBondContact O-N 3.17Å; D177-M180 VanDerWaalsContact O-N 3.11Å; D177-M180 PolarHBondContact OD1-N 2.67Å; D177-N181 PolarHBondContact N-O 3.09Å; D177-N181 PolarHBondContact OD1-N 2.83Å; D177-N181 PolarHBondContact OD1-ND2 3.22Å; D177-N181 WeakPolarHBondContact OD2-CB 3.32Å; D177-N181 PolarHBondContact OD2-ND2 3.45Å; D177-K183 HydrophobicContact CB-CG 4.18Å
178	A	93.3	Very high	90.1	Very high	61 Å²	61	25.2 Å²	25.2	50%	0.504	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-25.2	178.8	0	0	0	0	0	113.6	S126 M180	S126-A178 WeakPolarHBondContact OG-CA 3.23Å; S126-A178 WeakPolarHBondContact OG-CB 3.14Å; S126-A178 PolarHBondContact OG-N 2.8Å; A178-M180 VanDerWaalsContact C-N 3.29Å
179	D	94.6	Very high	89.1	Confident	78 Å²	78	28.5 Å²	28.5	42%	0.417	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	13	-178.5	-51.4	-5.1	0	0	0	109.8	D177 N181 R357	D177-D179 PolarHBondContact O-N 2.93Å; D177-D179 VanDerWaalsContact OD1-C 3.25Å; D177-D179 WeakPolarHBondContact OD1-CA 3.2Å; D177-D179 PolarHBondContact OD1-N 2.83Å; D179-N181 VanDerWaalsContact C-N 3.28Å; D179-N181 PolarHBondContact O-N 3.04Å; D179-R357 VanDerWaalsContact CG-NH1 3.26Å; D179-R357 IonicContact OD1-CZ 2.76Å; D179-R357 VanDerWaalsContact OD1-CZ 3.29Å; D179-R357 IonicContact OD1-NH1 3.7Å; D179-R357 PolarHBondContact OD1-NH1 2.97Å; D179-R357 IonicContact OD1-NH2 2.66Å; D179-R357 PolarHBondContact OD1-NH2 2.74Å; D179-R357 IonicContact OD2-CZ 3.69Å; D179-R357 IonicContact OD2-NH1 3.83Å; D179-R357 PolarHBondContact OD2-NH1 3.5Å; D179-R357 IonicContact OD2-NH2 2.87Å
180	M	93.2	Very high	88.2	Confident	66 Å²	66	28.4 Å²	28.4	33%	0.325	16%	0.157	S	C	.	.			trans	62.6	19.5	-178.6	-61.8	-69.8	-69.7	0	0	115.1	Y133 K148 L176 D177 A178	Y133-M180 HydrophobicContact CD2-CE 3.42Å; Y133-M180 VanDerWaalsContact CD2-CE 3.42Å; Y133-M180 HydrophobicContact CE2-CE 3.45Å; Y133-M180 VanDerWaalsContact CE2-CE 3.45Å; Y133-M180 HydrophobicContact CG-CE 4.23Å; K148-M180 VanDerWaalsContact CE-O 3.3Å; K148-M180 WeakPolarHBondContact CE-O 3.26Å; K148-M180 PolarHBondContact NZ-O 2.63Å; L176-M180 HydrophobicContact CD1-CE 3.79Å; L176-M180 HydrophobicContact CD1-SD 4.4Å; L176-M180 VanDerWaalsContact CD2-O 3.31Å; L176-M180 WeakPolarHBondContact CD2-O 3.33Å; D177-M180 PolarHBondContact O-N 3.17Å; D177-M180 VanDerWaalsContact O-N 3.11Å; D177-M180 PolarHBondContact OD1-N 2.67Å; A178-M180 VanDerWaalsContact C-N 3.29Å
181	N	96.9	Very high	87.6	Confident	47 Å²	47	28.9 Å²	28.9	25%	0.251	16%	0.161	S	C	.	.			trans	-77.4	152.6	173.4	-53.3	-69.9	0	0	0	111.5	Q151 L176 D177 D179	Q151-N181 PolarHBondContact NE2-OD1 2.91Å; L176-N181 CarbonylContact C-O 3.5Å; L176-N181 VanDerWaalsContact CA-O 3.31Å; L176-N181 WeakPolarHBondContact CA-O 3.21Å; D177-N181 PolarHBondContact N-O 3.09Å; D177-N181 PolarHBondContact OD1-N 2.83Å; D177-N181 PolarHBondContact OD1-ND2 3.22Å; D177-N181 WeakPolarHBondContact OD2-CB 3.32Å; D177-N181 PolarHBondContact OD2-ND2 3.45Å; D179-N181 VanDerWaalsContact C-N 3.28Å; D179-N181 PolarHBondContact O-N 3.04Å
182	I	97.6	Very high	87.3	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	138.4	175.9	-67	-70.2	0	0	0	110.9	N104 V130 K148 Q151 I152 L174 L175 L176	N104-I182 WeakPolarHBondContact CA-O 3.19Å; N104-I182 HydrophobicContact CB-CG2 4.43Å; N104-I182 VanDerWaalsContact CB-O 3.22Å; N104-I182 WeakPolarHBondContact CB-O 3.46Å; N104-I182 PolarHBondContact ND2-O 2.97Å; V130-I182 HydrophobicContact CG2-CD1 3.43Å; V130-I182 VanDerWaalsContact CG2-CD1 3.43Å; K148-I182 HydrophobicContact CB-CD1 4.1Å; K148-I182 HydrophobicContact CB-CG1 3.93Å; K148-I182 HydrophobicContact CD-CG1 4.34Å; Q151-I182 HydrophobicContact CB-CB 3.92Å; Q151-I182 HydrophobicContact CB-CG1 4.14Å; I152-I182 HydrophobicContact CD1-CD1 4.09Å; I152-I182 HydrophobicContact CD1-CG1 4.37Å; I152-I182 HydrophobicContact CG1-CB 4.36Å; I152-I182 HydrophobicContact CG1-CD1 4.05Å; I152-I182 HydrophobicContact CG1-CG1 3.91Å; I152-I182 HydrophobicContact CG1-CG2 3.74Å; L174-I182 HydrophobicContact CD2-CG2 4.35Å; L175-I182 WeakPolarHBondContact O-CA 3.44Å; L176-I182 HydrophobicContact CD2-CD1 4.16Å
183	K	96.9	Very high	87.3	Confident	14 Å²	14	30.4 Å²	30.4	6%	0.061	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	104.4	168.2	-65.4	-65.6	-171.8	165.8	0	109.2	P103 V106 E123 A125 L175 D177	P103-K183 WeakPolarHBondContact O-CE 3.41Å; P103-K183 PolarHBondContact O-NZ 2.76Å; V106-K183 HydrophobicContact CG2-CB 3.9Å; E123-K183 VanDerWaalsContact CD-CE 3.5Å; E123-K183 WeakPolarHBondContact OE1-CE 3.15Å; E123-K183 IonicContact OE1-NZ 2.7Å; E123-K183 PolarHBondContact OE1-NZ 3.02Å; E123-K183 WeakPolarHBondContact OE2-CD 3.44Å; E123-K183 VanDerWaalsContact OE2-CE 3.27Å; E123-K183 WeakPolarHBondContact OE2-CE 3.19Å; E123-K183 IonicContact OE2-NZ 2.74Å; E123-K183 PolarHBondContact OE2-NZ 3.13Å; A125-K183 HydrophobicContact CB-CB 4.04Å; A125-K183 HydrophobicContact CB-CG 4.16Å; L175-K183 HydrophobicContact CB-CB 4.26Å; L175-K183 WeakPolarHBondContact CB-O 3.34Å; L175-K183 PolarHBondContact N-O 2.94Å; L175-K183 PolarHBondContact O-N 3.34Å; D177-K183 HydrophobicContact CB-CG 4.18Å
184	L	96.5	Very high	86.1	Confident	2 Å²	2	33.4 Å²	33.4	1%	0.01	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	134.3	176.4	176.5	64.4	0	0	0	110.5	N104 I105 V106 A155 V156 L169 L174 F187	N104-L184 WeakPolarHBondContact O-CB 3.35Å; N104-L184 PolarHBondContact O-N 2.87Å; I105-L184 HydrophobicContact CG1-CB 4.36Å; I105-L184 HydrophobicContact CG1-CD2 4.47Å; V106-L184 PolarHBondContact N-O 3.21Å; A155-L184 HydrophobicContact CB-CD2 4.23Å; V156-L184 HydrophobicContact CG2-CD2 4.06Å; L169-L184 HydrophobicContact CD2-CD1 3.72Å; L174-L184 HydrophobicContact CD2-CD1 3.87Å; L184-F187 HydrophobicContact CD2-CZ 4.16Å; L184-F187 HydrophobicContact CG-CZ 4.29Å
185	A	92.1	Very high	85.2	Confident	16 Å²	16	38.2 Å²	38.2	13%	0.132	22%	0.22	C	C	.	.			trans	-137.5	164.9	-172.8	0	0	0	0	0	113.8	V106 H166 N173 L175	V106-A185 HydrophobicContact CG2-CB 3.95Å; H166-A185 PolarHBondContact NE2-O 2.87Å; N173-A185 WeakPolarHBondContact CB-O 3.22Å; N173-A185 PolarHBondContact O-N 2.61Å; L175-A185 HydrophobicContact CD1-CB 4.02Å; L175-A185 HydrophobicContact CG-CB 4.28Å
186	D	81.8	Confident	84	Confident	58 Å²	58	39.4 Å²	39.4	31%	0.31	24%	0.243	S	C	.	.			trans	66.8	68.4	172.1	-155	40.2	0	0	0	117.4	K75 G188	K75-D186 IonicContact NZ-OD1 2.74Å; K75-D186 PolarHBondContact NZ-OD1 2.99Å; D186-G188 PolarHBondContact O-N 2.88Å
187	F	80.4	Confident	83	Confident	6 Å²	6	42.9 Å²	42.9	3%	0.026	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-72	12.3	176.5	-65.8	-92.4	0	0	0	115.1	E93 M97 L100 I105 H166 L184 F189 S190	E93-F187 HydrophobicContact CG-CB 4.36Å; M97-F187 HydrophobicContact CG-CD2 4.48Å; L100-F187 HydrophobicContact CD1-CD1 3.88Å; L100-F187 HydrophobicContact CD1-CD2 4.41Å; L100-F187 HydrophobicContact CD1-CE1 3.48Å; L100-F187 VanDerWaalsContact CD1-CE1 3.48Å; L100-F187 HydrophobicContact CD1-CE2 4.08Å; L100-F187 HydrophobicContact CD1-CG 4.34Å; L100-F187 HydrophobicContact CD1-CZ 3.61Å; I105-F187 HydrophobicContact CD1-CZ 4.26Å; I105-F187 HydrophobicContact CG2-CE2 3.69Å; I105-F187 HydrophobicContact CG2-CZ 3.73Å; H166-F187 AromaticContact CD2-CD1 3.75Å; H166-F187 AromaticContact CD2-CE1 3.65Å; L184-F187 HydrophobicContact CD2-CZ 4.16Å; L184-F187 HydrophobicContact CG-CZ 4.29Å; F187-F189 PolarHBondContact O-N 2.92Å; F187-F189 VanDerWaalsContact O-N 3.13Å; F187-S190 VanDerWaalsContact CA-OG 3.27Å; F187-S190 WeakPolarHBondContact CA-OG 3.46Å; F187-S190 WeakPolarHBondContact CD1-OG 3.41Å; F187-S190 VanDerWaalsContact O-CB 3.24Å; F187-S190 WeakPolarHBondContact O-CB 3.46Å; F187-S190 PolarHBondContact O-N 3.39Å; F187-S190 PolarHBondContact O-OG 2.87Å
188	G	66.1	Low	82.2	Confident	11 Å²	11	46.7 Å²	46.7	11%	0.113	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-63.4	-20.4	-174.6	0	0	0	0	0	115.2	E93 D186	E93-G188 WeakPolarHBondContact OE2-CA 3.29Å; D186-G188 PolarHBondContact O-N 2.88Å
189	F	67	Low	81.3	Confident	75 Å²	75	45 Å²	45	33%	0.329	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-98.6	-11.3	171.7	-70.3	-76.4	0	0	0	114.1	R167 D168 F187 C203	R167-F189 VanDerWaalsContact CZ-O 3.31Å; R167-F189 PolarHBondContact NE-O 2.96Å; R167-F189 PolarHBondContact NH2-O 3.45Å; D168-F189 HydrophobicContact CB-CB 3.93Å; D168-F189 HydrophobicContact CB-CD2 3.74Å; D168-F189 HydrophobicContact CB-CG 4.06Å; F187-F189 PolarHBondContact O-N 2.92Å; F187-F189 VanDerWaalsContact O-N 3.13Å; F189-C203 HydrophobicContact CD1-CB 4.17Å
190	S	73.3	Confident	80.3	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	27%	0.267	C	S	.	.			trans	-66.3	159.8	-175	-50	0	0	0	0	112.2	R92 I165 H166 F187	R92-S190 PolarHBondContact NE-O 3.17Å; R92-S190 PolarHBondContact NH2-O 2.97Å; I165-S190 CarbonylContact O-C 3.52Å; I165-S190 WeakPolarHBondContact O-CA 3.34Å; I165-S190 WeakPolarHBondContact O-CB 3.31Å; H166-S190 WeakPolarHBondContact CA-OG 3.42Å; H166-S190 VanDerWaalsContact O-CA 3.32Å; H166-S190 WeakPolarHBondContact O-CA 3.18Å; H166-S190 PolarHBondContact O-N 2.81Å; H166-S190 PolarHBondContact O-OG 3.46Å; H166-S190 VanDerWaalsContact O-OG 3.09Å; F187-S190 VanDerWaalsContact CA-OG 3.27Å; F187-S190 WeakPolarHBondContact CA-OG 3.46Å; F187-S190 WeakPolarHBondContact CD1-OG 3.41Å; F187-S190 VanDerWaalsContact O-CB 3.24Å; F187-S190 WeakPolarHBondContact O-CB 3.46Å; F187-S190 PolarHBondContact O-N 3.39Å; F187-S190 PolarHBondContact O-OG 2.87Å
191	N	76.2	Confident	79.2	Confident	34 Å²	34	45.9 Å²	45.9	18%	0.182	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	152.2	178.3	-158.5	63.4	0	0	0	110.8	R92 I165	R92-N191 WeakPolarHBondContact CD-OD1 3.27Å; R92-N191 PolarHBondContact NE-OD1 3.48Å; R92-N191 PolarHBondContact NH1-OD1 3.46Å; I165-N191 PolarHBondContact N-O 2.85Å; I165-N191 PolarHBondContact O-N 2.86Å
192	E	76.8	Confident	78.1	Confident	63 Å²	63	48.4 Å²	48.4	29%	0.294	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	154	163.9	-69.5	150.3	-118.2	0	0	110.4	R95 L96 H163	R95-E192 IonicContact CZ-OE1 3.7Å; R95-E192 IonicContact CZ-OE2 3Å; R95-E192 IonicContact NH1-OE1 2.67Å; R95-E192 PolarHBondContact NH1-OE1 2.62Å; R95-E192 IonicContact NH1-OE2 2.61Å; R95-E192 PolarHBondContact NH1-OE2 2.76Å; L96-E192 HydrophobicContact CD2-CG 4.14Å; H163-E192 CarbonylContact O-C 3.59Å; H163-E192 WeakPolarHBondContact O-CA 3.29Å
193	F	79.9	Confident	76.7	Confident	25 Å²	25	49.2 Å²	49.2	11%	0.11	29%	0.286	C	S	.	.			trans	-137.7	141.6	170.7	71.4	-79.4	0	0	0	111.8	H163 I165 P222	H163-F193 VanDerWaalsContact CA-CE1 3.46Å; H163-F193 HydrophobicContact CB-CD1 4.43Å; H163-F193 HydrophobicContact CB-CE1 4.33Å; H163-F193 AromaticContact ND1-CE2 4Å; H163-F193 AromaticContact ND1-CZ 3.89Å; H163-F193 WeakPolarHBondContact O-CD1 3.31Å; H163-F193 PolarHBondContact O-N 3.08Å; I165-F193 HydrophobicContact CD1-CB 3.52Å; I165-F193 HydrophobicContact CD1-CD1 3.5Å; I165-F193 HydrophobicContact CD1-CE1 4.34Å; I165-F193 HydrophobicContact CD1-CG 3.64Å; I165-F193 HydrophobicContact CG1-CB 4.43Å; I165-F193 HydrophobicContact CG1-CD1 3.42Å; I165-F193 VanDerWaalsContact CG1-CD1 3.42Å; I165-F193 HydrophobicContact CG1-CE1 3.83Å; I165-F193 HydrophobicContact CG1-CG 4.06Å; F193-P222 HydrophobicContact CE1-CG 4.15Å; F193-P222 HydrophobicContact CE2-CG 3.8Å; F193-P222 HydrophobicContact CZ-CG 3.58Å
194	S	67	Low	75.3	Confident	74 Å²	74	49.4 Å²	49.4	52%	0.517	29%	0.291	S	S	.	.			trans	-107.4	125.4	170	-50.6	0	0	0	0	108	G196 T197	S194-G196 PolarHBondContact O-N 3.05Å; S194-T197 PolarHBondContact N-OG1 2.98Å; S194-T197 WeakPolarHBondContact O-CB 3.45Å; S194-T197 PolarHBondContact O-N 3.49Å; S194-T197 PolarHBondContact O-OG1 2.93Å
195	P	74.2	Confident	74.6	Confident	103 Å²	103	50.8 Å²	50.8	67%	0.669	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49	130.5	176.7	-30	36.2	0	0	0	112.4	T197	P195-T197 VanDerWaalsContact C-N 3.35Å
196	G	71.1	Confident	74.3	Confident	71 Å²	71	51.1 Å²	51.1	73%	0.732	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.9	-19.4	-174.5	0	0	0	0	0	115.1	S194	S194-G196 PolarHBondContact O-N 3.05Å
197	T	74.2	Confident	74.8	Confident	73 Å²	73	48.7 Å²	48.7	45%	0.448	29%	0.29	S	S	.	.			trans	-83.3	137.2	165.3	69.9	0	0	0	0	109.6	S194 P195	S194-T197 PolarHBondContact N-OG1 2.98Å; S194-T197 WeakPolarHBondContact O-CB 3.45Å; S194-T197 PolarHBondContact O-N 3.49Å; S194-T197 PolarHBondContact O-OG1 2.93Å; P195-T197 VanDerWaalsContact C-N 3.35Å
198	K	76.6	Confident	75.4	Confident	104 Å²	104	48.7 Å²	48.7	45%	0.452	29%	0.289	S	S	.	.			trans	-115	131.1	-179.6	-59.6	-168.8	-172	-65.2	0	112.1	K218 Y219 D220	K198-K218 HydrophobicContact CB-CB 3.77Å; K198-K218 HydrophobicContact CB-CD 4.45Å; K198-K218 HydrophobicContact CD-CB 4.06Å; K198-Y219 CarbonylContact C-O 3.6Å; K198-Y219 WeakPolarHBondContact CA-O 3.22Å; K198-D220 IonicContact NZ-OD1 2.97Å; K198-D220 PolarHBondContact NZ-OD1 2.82Å; K198-D220 IonicContact NZ-OD2 2.75Å; K198-D220 PolarHBondContact NZ-OD2 3.4Å
199	L	75.5	Confident	76.7	Confident	25 Å²	25	48.3 Å²	48.3	13%	0.131	29%	0.285	C	S	.	.	B	Isolated β-bridge	trans	-77.1	146.3	172.8	-57.2	176.8	0	0	0	110.1	I165 K218 Y219	I165-L199 HydrophobicContact CD1-CD1 3.72Å; L199-K218 CarbonylContact O-C 3.57Å; L199-K218 WeakPolarHBondContact O-CA 3.08Å; L199-Y219 HydrophobicContact CB-CD1 4.4Å; L199-Y219 HydrophobicContact CB-CD2 4.14Å; L199-Y219 HydrophobicContact CB-CE1 3.95Å; L199-Y219 HydrophobicContact CB-CE2 3.67Å; L199-Y219 HydrophobicContact CB-CG 4.48Å; L199-Y219 HydrophobicContact CD1-CE2 3.79Å; L199-Y219 HydrophobicContact CG-CE2 4.33Å; L199-Y219 PolarHBondContact N-O 2.96Å; L199-Y219 VanDerWaalsContact O-CD1 3.26Å; L199-Y219 WeakPolarHBondContact O-CD1 3.2Å; L199-Y219 PolarHBondContact O-N 2.62Å
200	D	72.9	Confident	78	Confident	95 Å²	95	44.8 Å²	44.8	51%	0.508	27%	0.27	S	S	.	.			trans	-123.5	-6.8	179	52.8	23.1	0	0	0	114	F202 K218	D200-F202 PolarHBondContact O-N 2.99Å; D200-K218 HydrophobicContact CB-CD 4.03Å; D200-K218 HydrophobicContact CB-CG 3.97Å; D200-K218 IonicContact OD2-NZ 3.78Å; D200-K218 PolarHBondContact OD2-NZ 2.9Å
201	T	71.1	Confident	79	Confident	67 Å²	67	44.8 Å²	44.8	41%	0.411	27%	0.27	S	S	.	.			trans	-77.5	123.3	-174.5	-35.3	0	0	0	0	111.4	C203 Y219	T201-C203 PolarHBondContact O-N 2.87Å; T201-Y219 PolarHBondContact O-OH 3.34Å
202	F	73	Confident	79.8	Confident	100 Å²	100	43.4 Å²	43.4	44%	0.439	26%	0.262	S	S	.	.			trans	-69.8	118.8	164.6	-170.4	-78.2	0	0	0	109.3	D200 A209 L213 F214	D200-F202 PolarHBondContact O-N 2.99Å; F202-A209 HydrophobicContact CZ-CB 4.4Å; F202-L213 HydrophobicContact CD2-CB 3.74Å; F202-L213 WeakPolarHBondContact CD2-O 3.48Å; F202-L213 HydrophobicContact CE2-CB 3.76Å; F202-F214 HydrophobicContact CE2-CD1 4.43Å
203	C	67.9	Low	80.4	Confident	18 Å²	18	41.1 Å²	41.1	12%	0.122	25%	0.252	C	S	.	.			trans	-144.8	164.8	176.8	-79.1	0	0	0	0	109.3	F189 T201	F189-C203 HydrophobicContact CD1-CB 4.17Å; T201-C203 PolarHBondContact O-N 2.87Å
204	G	67.3	Low	80.8	Confident	18 Å²	18	40.8 Å²	40.8	19%	0.186	25%	0.251	C	S	.	.	S	Bend	trans	93.2	158.4	178.4	0	0	0	0	0	115.1	R167 D168 P206	R167-G204 WeakPolarHBondContact O-CA 3.4Å; D168-G204 VanDerWaalsContact OD1-CA 3.27Å; D168-G204 WeakPolarHBondContact OD1-CA 3.4Å; G204-P206 WeakPolarHBondContact O-CD 3.47Å
205	S	81.3	Confident	81.8	Confident	30 Å²	30	41.2 Å²	41.2	21%	0.21	24%	0.244	C	C	.	.			trans	-64	120.1	176.7	-92.8	0	0	0	0	111.7	D168 P207 Y208 A209	D168-S205 PolarHBondContact OD1-N 3.22Å; S205-P207 WeakPolarHBondContact O-CD 3.16Å; S205-P207 VanDerWaalsContact O-N 3.09Å; S205-Y208 PolarHBondContact O-N 2.94Å; S205-A209 PolarHBondContact O-N 3.42Å
206	P	87.5	Confident	82.2	Confident	24 Å²	24	39.4 Å²	39.4	16%	0.156	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-25.4	-169.4	-28.5	36.1	0	0	0	118.7	G204 Y208 A209 F214 L248 L251 W1061	G204-P206 WeakPolarHBondContact O-CD 3.47Å; P206-Y208 VanDerWaalsContact C-N 3.25Å; P206-Y208 PolarHBondContact O-N 3.38Å; P206-A209 PolarHBondContact O-N 2.9Å; P206-F214 HydrophobicContact CB-CZ 3.95Å; P206-F214 WeakPolarHBondContact O-CZ 3.22Å; P206-L248 HydrophobicContact CB-CD2 3.95Å; P206-L248 HydrophobicContact CG-CD2 4.01Å; P206-L251 HydrophobicContact CB-CD2 3.97Å; P206-W1061 HydrophobicContact CB-CH2 3.86Å; P206-W1061 HydrophobicContact CB-CZ3 4.03Å; P206-W1061 HydrophobicContact CG-CH2 4.28Å; P206-W1061 HydrophobicContact CG-CZ3 3.93Å
207	P	90.7	Very high	82.9	Confident	7 Å²	7	41.8 Å²	41.8	5%	0.045	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-29.2	172	-24.6	35.6	0	0	0	114.2	S205 L241 L251 W1061	S205-P207 WeakPolarHBondContact O-CD 3.16Å; S205-P207 VanDerWaalsContact O-N 3.09Å; P207-L241 HydrophobicContact CB-CD1 3.98Å; P207-L241 HydrophobicContact CB-CD2 4.17Å; P207-L241 HydrophobicContact CG-CD1 4.41Å; P207-L251 HydrophobicContact CG-CD2 4.37Å; P207-W1061 HydrophobicContact CG-CH2 3.92Å; P207-W1061 HydrophobicContact CG-CZ2 3.45Å; P207-W1061 VanDerWaalsContact CG-CZ2 3.45Å
208	Y	94	Very high	83.3	Confident	5 Å²	5	44.2 Å²	44.2	2%	0.02	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-16.8	180	-54.7	-92.6	0	0	0	111.7	L169 K170 A171 S205 P206 S228 V231 I232 L241	L169-Y208 VanDerWaalsContact O-CB 3.29Å; L169-Y208 WeakPolarHBondContact O-CB 3.44Å; K170-Y208 HydrophobicContact CB-CD1 4.34Å; K170-Y208 HydrophobicContact CB-CD2 3.61Å; K170-Y208 HydrophobicContact CB-CE1 4.24Å; K170-Y208 HydrophobicContact CB-CE2 3.49Å; K170-Y208 VanDerWaalsContact CB-CE2 3.49Å; K170-Y208 HydrophobicContact CB-CG 4.05Å; A171-Y208 WeakPolarHBondContact CB-OH 3.43Å; A171-Y208 PolarHBondContact N-OH 2.89Å; S205-Y208 PolarHBondContact O-N 2.94Å; P206-Y208 VanDerWaalsContact C-N 3.25Å; P206-Y208 PolarHBondContact O-N 3.38Å; Y208-S228 PolarHBondContact O-OG 2.78Å; Y208-V231 HydrophobicContact CD1-CB 3.99Å; Y208-V231 HydrophobicContact CD1-CG1 3.44Å; Y208-V231 VanDerWaalsContact CD1-CG1 3.44Å; Y208-V231 HydrophobicContact CE1-CG1 3.81Å; Y208-V231 HydrophobicContact CG-CG1 4.14Å; Y208-I232 HydrophobicContact CD1-CG1 4.07Å; Y208-I232 HydrophobicContact CE1-CG1 3.92Å; Y208-L241 HydrophobicContact CE1-CD2 4.4Å
209	A	93.3	Very high	83.6	Confident	4 Å²	4	39.7 Å²	39.7	3%	0.033	22%	0.219	C	C	.	.			trans	-63	134.3	-177.3	0	0	0	0	0	113.2	F202 S205 P206 L213 F214 W227	F202-A209 HydrophobicContact CZ-CB 4.4Å; S205-A209 PolarHBondContact O-N 3.42Å; P206-A209 PolarHBondContact O-N 2.9Å; A209-L213 HydrophobicContact CB-CD1 4.01Å; A209-F214 HydrophobicContact CB-CD2 4.46Å; A209-F214 HydrophobicContact CB-CE2 3.84Å; A209-F214 HydrophobicContact CB-CZ 4.39Å; A209-W227 PolarHBondContact O-NE1 2.85Å
210	A	94.3	Very high	83.8	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.227	C	C	.	.			trans	-68.2	150.2	179.7	0	0	0	0	0	113	E212 L213 V224 W227	A210-E212 VanDerWaalsContact CB-CD 3.46Å; A210-E212 HydrophobicContact CB-CG 4.11Å; A210-E212 WeakPolarHBondContact CB-OE1 3.39Å; A210-E212 PolarHBondContact O-N 2.81Å; A210-L213 HydrophobicContact CB-CD1 4.48Å; A210-L213 HydrophobicContact CB-CG 4.49Å; A210-L213 WeakPolarHBondContact O-CB 3.49Å; A210-L213 PolarHBondContact O-N 3.31Å; A210-V224 HydrophobicContact CB-CB 3.97Å; A210-V224 HydrophobicContact CB-CG1 4.04Å; A210-W227 VanDerWaalsContact CA-CD1 3.49Å; A210-W227 HydrophobicContact CB-CB 3.92Å; A210-W227 HydrophobicContact CB-CD2 4.45Å; A210-W227 HydrophobicContact CB-CG 3.83Å
211	P	94.6	Very high	84.3	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-27.4	-174.2	24.1	-34.1	0	0	0	113.6	L213 F214 Q215 W227 V255 L256 L280	P211-L213 VanDerWaalsContact C-N 3.35Å; P211-F214 PolarHBondContact O-N 3.41Å; P211-Q215 VanDerWaalsContact O-CG 3.29Å; P211-Q215 WeakPolarHBondContact O-CG 3.32Å; P211-Q215 PolarHBondContact O-N 3.07Å; P211-Q215 PolarHBondContact O-NE2 2.97Å; P211-W227 HydrophobicContact CG-CE3 4.14Å; P211-W227 HydrophobicContact CG-CH2 4Å; P211-W227 HydrophobicContact CG-CZ2 4.39Å; P211-W227 HydrophobicContact CG-CZ3 3.85Å; P211-V255 HydrophobicContact CB-CG1 4.07Å; P211-L256 HydrophobicContact CB-CD2 4.03Å; P211-L256 WeakPolarHBondContact O-CD2 3.25Å; P211-L280 HydrophobicContact CB-CD2 4.02Å; P211-L280 HydrophobicContact CG-CD2 3.87Å
212	E	92.9	Very high	85.3	Confident	6 Å²	6	34.7 Å²	34.7	3%	0.028	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-34.7	172.5	53.3	-91.6	-147.4	0	0	113.5	A210 Q215 G216 K217 V224 R285	A210-E212 VanDerWaalsContact CB-CD 3.46Å; A210-E212 HydrophobicContact CB-CG 4.11Å; A210-E212 WeakPolarHBondContact CB-OE1 3.39Å; A210-E212 PolarHBondContact O-N 2.81Å; E212-Q215 CarbonylContact O-C 3.55Å; E212-Q215 WeakPolarHBondContact O-CA 3.25Å; E212-Q215 WeakPolarHBondContact O-CB 3.37Å; E212-Q215 PolarHBondContact O-N 2.91Å; E212-G216 PolarHBondContact O-N 2.74Å; E212-K217 HydrophobicContact CB-CB 4.38Å; E212-K217 PolarHBondContact O-N 2.7Å; E212-K217 VanDerWaalsContact O-N 3.16Å; E212-V224 HydrophobicContact CG-CG1 4.24Å; E212-R285 IonicContact OE1-CZ 2.78Å; E212-R285 IonicContact OE1-NH1 3.65Å; E212-R285 PolarHBondContact OE1-NH1 3.21Å; E212-R285 IonicContact OE1-NH2 2.86Å; E212-R285 PolarHBondContact OE1-NH2 2.68Å; E212-R285 IonicContact OE2-CZ 2.91Å; E212-R285 IonicContact OE2-NH1 3.47Å; E212-R285 IonicContact OE2-NH2 3.24Å; E212-R285 PolarHBondContact OE2-NH2 2.69Å
213	L	89.5	Confident	86.3	Confident	15 Å²	15	32.3 Å²	32.3	8%	0.079	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-65	-45.3	174.4	-59.4	175.2	0	0	0	109.8	F202 A209 A210 P211 Q215 G216 Y219 V224	F202-L213 HydrophobicContact CD2-CB 3.74Å; F202-L213 WeakPolarHBondContact CD2-O 3.48Å; F202-L213 HydrophobicContact CE2-CB 3.76Å; A209-L213 HydrophobicContact CB-CD1 4.01Å; A210-L213 HydrophobicContact CB-CD1 4.48Å; A210-L213 HydrophobicContact CB-CG 4.49Å; A210-L213 WeakPolarHBondContact O-CB 3.49Å; A210-L213 PolarHBondContact O-N 3.31Å; P211-L213 VanDerWaalsContact C-N 3.35Å; L213-Q215 PolarHBondContact O-N 2.96Å; L213-Q215 VanDerWaalsContact O-N 3.11Å; L213-G216 PolarHBondContact O-N 2.86Å; L213-Y219 HydrophobicContact CD2-CD1 3.63Å; L213-Y219 HydrophobicContact CD2-CE1 3.34Å; L213-Y219 HydrophobicContact CD2-CE2 4.44Å; L213-Y219 HydrophobicContact CD2-CG 4.32Å; L213-V224 HydrophobicContact CG-CG1 4.5Å
214	F	87.8	Confident	87.6	Confident	18 Å²	18	31.6 Å²	31.6	8%	0.079	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-64.3	-10.3	172.4	-74.6	-74.6	0	0	0	114.5	F202 P206 A209 P211 L251 R252 V255 L256	F202-F214 HydrophobicContact CE2-CD1 4.43Å; P206-F214 HydrophobicContact CB-CZ 3.95Å; P206-F214 WeakPolarHBondContact O-CZ 3.22Å; A209-F214 HydrophobicContact CB-CD2 4.46Å; A209-F214 HydrophobicContact CB-CE2 3.84Å; A209-F214 HydrophobicContact CB-CZ 4.39Å; P211-F214 PolarHBondContact O-N 3.41Å; F214-L251 HydrophobicContact CZ-CD2 4.42Å; F214-R252 HydrophobicContact CB-CG 4.08Å; F214-R252 HydrophobicContact CD1-CB 3.73Å; F214-R252 HydrophobicContact CD1-CG 3.63Å; F214-R252 HydrophobicContact CE1-CB 3.92Å; F214-R252 HydrophobicContact CE1-CG 4.34Å; F214-R252 HydrophobicContact CG-CB 4.46Å; F214-R252 HydrophobicContact CG-CG 4.09Å; F214-R252 VanDerWaalsContact O-CZ 3.29Å; F214-R252 PolarHBondContact O-NE 3.03Å; F214-R252 PolarHBondContact O-NH2 3.19Å; F214-V255 HydrophobicContact CD2-CB 4.34Å; F214-V255 HydrophobicContact CD2-CG1 3.71Å; F214-V255 HydrophobicContact CE2-CB 4.2Å; F214-V255 HydrophobicContact CE2-CG1 3.83Å; F214-V255 HydrophobicContact CE2-CG2 4.18Å; F214-L256 HydrophobicContact CB-CD2 4.15Å; F214-L256 HydrophobicContact CB-CG 4.44Å
215	Q	87.7	Confident	88.9	Confident	82 Å²	82	30.7 Å²	30.7	38%	0.383	17%	0.168	S	C	.	.	G	3₁₀ helix	trans	-99.8	-6.4	173.6	-68.1	164.7	40.3	0	0	112.8	P211 E212 L213 K217 L256	P211-Q215 VanDerWaalsContact O-CG 3.29Å; P211-Q215 WeakPolarHBondContact O-CG 3.32Å; P211-Q215 PolarHBondContact O-N 3.07Å; P211-Q215 PolarHBondContact O-NE2 2.97Å; E212-Q215 CarbonylContact O-C 3.55Å; E212-Q215 WeakPolarHBondContact O-CA 3.25Å; E212-Q215 WeakPolarHBondContact O-CB 3.37Å; E212-Q215 PolarHBondContact O-N 2.91Å; L213-Q215 PolarHBondContact O-N 2.96Å; L213-Q215 VanDerWaalsContact O-N 3.11Å; Q215-K217 HydrophobicContact CB-CD 4.15Å; Q215-K217 HydrophobicContact CB-CG 4.01Å; Q215-K217 PolarHBondContact O-N 2.84Å; Q215-L256 HydrophobicContact CG-CD2 3.71Å; Q215-L256 VanDerWaalsContact NE2-CD2 3.31Å
216	G	83.7	Confident	89.7	Confident	66 Å²	66	29.4 Å²	29.4	68%	0.68	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.8	23.8	-174	0	0	0	0	0	113.3	E212 L213	E212-G216 PolarHBondContact O-N 2.74Å; L213-G216 PolarHBondContact O-N 2.86Å
217	K	84.3	Confident	90.2	Very high	120 Å²	120	28.2 Å²	28.2	52%	0.522	15%	0.151	S	C	.	.			trans	-80.7	142.5	179.1	-75.7	177.7	174.6	169.2	0	110.3	E212 Q215	E212-K217 HydrophobicContact CB-CB 4.38Å; E212-K217 PolarHBondContact O-N 2.7Å; E212-K217 VanDerWaalsContact O-N 3.16Å; Q215-K217 HydrophobicContact CB-CD 4.15Å; Q215-K217 HydrophobicContact CB-CG 4.01Å; Q215-K217 PolarHBondContact O-N 2.84Å
218	K	83.4	Confident	90.5	Very high	124 Å²	124	28.2 Å²	28.2	54%	0.539	15%	0.151	S	C	.	.			trans	-65.9	134.4	167.1	-55.8	-147.6	178.4	-143.8	0	109.6	K198 L199 D200	K198-K218 HydrophobicContact CB-CB 3.77Å; K198-K218 HydrophobicContact CB-CD 4.45Å; K198-K218 HydrophobicContact CD-CB 4.06Å; L199-K218 CarbonylContact O-C 3.57Å; L199-K218 WeakPolarHBondContact O-CA 3.08Å; D200-K218 HydrophobicContact CB-CD 4.03Å; D200-K218 HydrophobicContact CB-CG 3.97Å; D200-K218 IonicContact OD2-NZ 3.78Å; D200-K218 PolarHBondContact OD2-NZ 2.9Å
219	Y	82.4	Confident	90.6	Very high	9 Å²	9	28 Å²	28	4%	0.035	15%	0.15	C	C	.	.	B	Isolated β-bridge	trans	-124.1	149.4	-174.4	58.4	-82.2	0	0	0	110.4	R167 K198 L199 T201 L213 V224	R167-Y219 PolarHBondContact NH1-OH 3.39Å; K198-Y219 CarbonylContact C-O 3.6Å; K198-Y219 WeakPolarHBondContact CA-O 3.22Å; L199-Y219 HydrophobicContact CB-CD1 4.4Å; L199-Y219 HydrophobicContact CB-CD2 4.14Å; L199-Y219 HydrophobicContact CB-CE1 3.95Å; L199-Y219 HydrophobicContact CB-CE2 3.67Å; L199-Y219 HydrophobicContact CB-CG 4.48Å; L199-Y219 HydrophobicContact CD1-CE2 3.79Å; L199-Y219 HydrophobicContact CG-CE2 4.33Å; L199-Y219 PolarHBondContact N-O 2.96Å; L199-Y219 VanDerWaalsContact O-CD1 3.26Å; L199-Y219 WeakPolarHBondContact O-CD1 3.2Å; L199-Y219 PolarHBondContact O-N 2.62Å; T201-Y219 PolarHBondContact O-OH 3.34Å; L213-Y219 HydrophobicContact CD2-CD1 3.63Å; L213-Y219 HydrophobicContact CD2-CE1 3.34Å; L213-Y219 HydrophobicContact CD2-CE2 4.44Å; L213-Y219 HydrophobicContact CD2-CG 4.32Å; Y219-V224 HydrophobicContact CD2-CG1 3.68Å; Y219-V224 HydrophobicContact CD2-CG2 4.38Å; Y219-V224 HydrophobicContact CE2-CG1 4.23Å; Y219-V224 HydrophobicContact CE2-CG2 4.22Å; Y219-V224 HydrophobicContact CG-CG1 4.06Å
220	D	79.7	Confident	90.9	Very high	54 Å²	54	27.8 Å²	27.8	29%	0.289	15%	0.149	S	C	.	.			trans	-75.5	-49.5	-178	-63.5	-83.1	0	0	0	110.6	K198	K198-D220 IonicContact NZ-OD1 2.97Å; K198-D220 PolarHBondContact NZ-OD1 2.82Å; K198-D220 IonicContact NZ-OD2 2.75Å; K198-D220 PolarHBondContact NZ-OD2 3.4Å
221	G	84.1	Confident	91	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.149	C	C	.	.	S	Bend	trans	153.5	-71	164.4	0	0	0	0	0	115.2	E223 V224	G221-E223 PolarHBondContact N-OE2 3Å; G221-E223 PolarHBondContact O-N 2.87Å; G221-V224 WeakPolarHBondContact O-CG2 3.04Å; G221-V224 PolarHBondContact O-N 3.13Å; G221-V224 VanDerWaalsContact O-N 3.08Å
222	P	92.4	Very high	91.1	Very high	28 Å²	28	27.9 Å²	27.9	18%	0.182	15%	0.149	C	C	.	.	H	α-helix	trans	-48	-32.3	-174.6	-33.9	39.6	0	0	0	114.7	H160 F193 V224 D225 V226	H160-P222 PolarHBondContact CE1-O 3.29Å; F193-P222 HydrophobicContact CE1-CG 4.15Å; F193-P222 HydrophobicContact CE2-CG 3.8Å; F193-P222 HydrophobicContact CZ-CG 3.58Å; P222-V224 VanDerWaalsContact C-N 3.32Å; P222-V224 PolarHBondContact O-N 3.44Å; P222-D225 PolarHBondContact O-N 2.86Å; P222-V226 WeakPolarHBondContact O-CG2 3.45Å; P222-V226 PolarHBondContact O-N 2.82Å; P222-V226 VanDerWaalsContact O-N 3.13Å
223	E	94.2	Very high	91.4	Very high	50 Å²	50	27.6 Å²	27.6	23%	0.234	15%	0.148	C	C	.	.	H	α-helix	trans	-64.7	-32.9	-175.7	-48.8	72.5	-152.9	0	0	112.4	G221 V226 W227 P282 R285	G221-E223 PolarHBondContact N-OE2 3Å; G221-E223 PolarHBondContact O-N 2.87Å; E223-V226 PolarHBondContact O-N 2.91Å; E223-W227 PolarHBondContact O-N 3.47Å; E223-P282 HydrophobicContact CB-CB 3.84Å; E223-P282 HydrophobicContact CG-CB 4.04Å; E223-R285 VanDerWaalsContact C-NH1 3.29Å; E223-R285 WeakPolarHBondContact O-CD 3.35Å; E223-R285 PolarHBondContact O-NH1 2.91Å
224	V	93.9	Very high	91.8	Very high	3 Å²	3	27.4 Å²	27.4	2%	0.018	15%	0.146	C	C	.	.	H	α-helix	trans	-72.7	-32.8	-179.2	-48	0	0	0	0	111.5	I165 A210 E212 L213 Y219 G221 P222 S228	I165-V224 HydrophobicContact CG2-CG2 4.43Å; A210-V224 HydrophobicContact CB-CB 3.97Å; A210-V224 HydrophobicContact CB-CG1 4.04Å; E212-V224 HydrophobicContact CG-CG1 4.24Å; L213-V224 HydrophobicContact CG-CG1 4.5Å; Y219-V224 HydrophobicContact CD2-CG1 3.68Å; Y219-V224 HydrophobicContact CD2-CG2 4.38Å; Y219-V224 HydrophobicContact CE2-CG1 4.23Å; Y219-V224 HydrophobicContact CE2-CG2 4.22Å; Y219-V224 HydrophobicContact CG-CG1 4.06Å; G221-V224 WeakPolarHBondContact O-CG2 3.04Å; G221-V224 PolarHBondContact O-N 3.13Å; G221-V224 VanDerWaalsContact O-N 3.08Å; P222-V224 VanDerWaalsContact C-N 3.32Å; P222-V224 PolarHBondContact O-N 3.44Å; V224-S228 PolarHBondContact O-N 3.08Å; V224-S228 VanDerWaalsContact O-N 3.07Å; V224-S228 PolarHBondContact O-OG 3.38Å
225	D	95.6	Very high	92.1	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-67.9	-40.7	171	-79.5	-3.5	0	0	0	110.4	V156 H160 I165 H166 R167 L169 P222 W227 S228 L229	V156-D225 HydrophobicContact CG1-CB 4.15Å; H160-D225 IonicContact CD2-OD2 3.02Å; H160-D225 IonicContact CE1-OD2 3.35Å; H160-D225 IonicContact NE2-OD2 3.15Å; H160-D225 PolarHBondContact NE2-OD2 3.45Å; I165-D225 HydrophobicContact CG2-CB 4.5Å; I165-D225 VanDerWaalsContact CG2-OD2 3.22Å; I165-D225 WeakPolarHBondContact CG2-OD2 3.42Å; H166-D225 PolarHBondContact N-OD2 3.24Å; R167-D225 PolarHBondContact N-OD1 3.23Å; L169-D225 HydrophobicContact CD1-CB 3.61Å; P222-D225 PolarHBondContact O-N 2.86Å; D225-W227 VanDerWaalsContact C-N 3.35Å; D225-W227 PolarHBondContact O-N 2.8Å; D225-S228 WeakPolarHBondContact O-CB 3.27Å; D225-S228 PolarHBondContact O-N 2.88Å; D225-S228 VanDerWaalsContact O-N 3.16Å; D225-L229 WeakPolarHBondContact O-CB 3.48Å; D225-L229 VanDerWaalsContact O-CG 3.28Å; D225-L229 WeakPolarHBondContact O-CG 3.44Å; D225-L229 PolarHBondContact O-N 2.98Å
226	V	97.6	Very high	92.5	Very high	2 Å²	2	23 Å²	23	1%	0.012	13%	0.126	C	C	.	.	H	α-helix	trans	-59.4	-43.1	174.9	178.2	0	0	0	0	112	P222 E223 L229 G230 M277 R285 Y286 L288	P222-V226 WeakPolarHBondContact O-CG2 3.45Å; P222-V226 PolarHBondContact O-N 2.82Å; P222-V226 VanDerWaalsContact O-N 3.13Å; E223-V226 PolarHBondContact O-N 2.91Å; V226-L229 PolarHBondContact O-N 2.67Å; V226-G230 PolarHBondContact O-N 2.92Å; V226-M277 HydrophobicContact CG1-CB 4.25Å; V226-M277 HydrophobicContact CG1-CE 3.98Å; V226-M277 HydrophobicContact CG1-CG 4.23Å; V226-M277 WeakPolarHBondContact O-CE 3.22Å; V226-R285 HydrophobicContact CB-CG 4.41Å; V226-R285 HydrophobicContact CG1-CG 3.88Å; V226-Y286 WeakPolarHBondContact CG1-O 3.4Å; V226-L288 HydrophobicContact CG2-CD2 3.78Å; V226-L288 HydrophobicContact CG2-CG 3.95Å
227	W	97.5	Very high	93.2	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-61.5	-46.5	174.7	173.7	-79.3	0	0	0	111.1	A209 A210 P211 E223 D225 L229 G230 V231 F243 V255 L278 L280	A209-W227 PolarHBondContact O-NE1 2.85Å; A210-W227 VanDerWaalsContact CA-CD1 3.49Å; A210-W227 HydrophobicContact CB-CB 3.92Å; A210-W227 HydrophobicContact CB-CD2 4.45Å; A210-W227 HydrophobicContact CB-CG 3.83Å; P211-W227 HydrophobicContact CG-CE3 4.14Å; P211-W227 HydrophobicContact CG-CH2 4Å; P211-W227 HydrophobicContact CG-CZ2 4.39Å; P211-W227 HydrophobicContact CG-CZ3 3.85Å; E223-W227 PolarHBondContact O-N 3.47Å; D225-W227 VanDerWaalsContact C-N 3.35Å; D225-W227 PolarHBondContact O-N 2.8Å; W227-L229 VanDerWaalsContact C-N 3.26Å; W227-L229 PolarHBondContact O-N 2.86Å; W227-G230 WeakPolarHBondContact O-CA 3.44Å; W227-G230 PolarHBondContact O-N 2.85Å; W227-V231 PolarHBondContact O-N 3.35Å; W227-F243 AromaticContact CH2-CE2 3.9Å; W227-F243 HydrophobicContact CH2-CE2 3.9Å; W227-F243 AromaticContact CH2-CZ 3.98Å; W227-F243 HydrophobicContact CH2-CZ 3.98Å; W227-F243 HydrophobicContact CZ2-CD2 4.04Å; W227-F243 AromaticContact CZ2-CE2 3.35Å; W227-F243 HydrophobicContact CZ2-CE2 3.35Å; W227-F243 AromaticContact CZ2-CZ 3.91Å; W227-F243 HydrophobicContact CZ2-CZ 3.91Å; W227-V255 HydrophobicContact CZ2-CG1 3.98Å; W227-L278 HydrophobicContact CD2-CD2 4.01Å; W227-L278 HydrophobicContact CE3-CD2 4.21Å; W227-L278 HydrophobicContact CG-CD2 4.44Å; W227-L278 HydrophobicContact CZ2-CD2 4.41Å; W227-L278 VanDerWaalsContact CZ3-C 3.42Å; W227-L278 HydrophobicContact CZ3-CB 4.28Å; W227-L278 WeakPolarHBondContact CZ3-O 3.43Å; W227-L280 HydrophobicContact CH2-CD2 4.05Å; W227-L280 HydrophobicContact CZ3-CD2 4.23Å
228	S	97	Very high	93.6	Very high	6 Å²	6	14.8 Å²	14.8	4%	0.042	7%	0.073	C	C	.	.	H	α-helix	trans	-58.9	-38.7	178	-53.5	0	0	0	0	111.7	Y208 V224 D225 V231 I232	Y208-S228 PolarHBondContact O-OG 2.78Å; V224-S228 PolarHBondContact O-N 3.08Å; V224-S228 VanDerWaalsContact O-N 3.07Å; V224-S228 PolarHBondContact O-OG 3.38Å; D225-S228 WeakPolarHBondContact O-CB 3.27Å; D225-S228 PolarHBondContact O-N 2.88Å; D225-S228 VanDerWaalsContact O-N 3.16Å; S228-V231 WeakPolarHBondContact O-CB 3.37Å; S228-V231 PolarHBondContact O-N 3.06Å; S228-I232 WeakPolarHBondContact O-CG1 3.31Å; S228-I232 PolarHBondContact O-N 2.69Å
229	L	97.9	Very high	94	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-67.2	-35.4	173.9	-71.4	169.6	0	0	0	112.9	F149 I152 V156 L169 D225 V226 W227 V231 I232 L233 M277 L288	F149-L229 HydrophobicContact CE2-CB 4.2Å; F149-L229 HydrophobicContact CE2-CD2 4.18Å; F149-L229 VanDerWaalsContact CE2-O 3.31Å; F149-L229 WeakPolarHBondContact CE2-O 3.45Å; F149-L229 HydrophobicContact CZ-CB 4.02Å; F149-L229 WeakPolarHBondContact CZ-O 3.33Å; I152-L229 HydrophobicContact CG2-CD2 3.3Å; V156-L229 HydrophobicContact CB-CD1 4.14Å; V156-L229 HydrophobicContact CG1-CD1 4.05Å; V156-L229 HydrophobicContact CG2-CD1 4.33Å; V156-L229 HydrophobicContact CG2-CD2 4.36Å; L169-L229 HydrophobicContact CD1-CD1 4.35Å; L169-L229 HydrophobicContact CD1-CD2 4.2Å; L169-L229 HydrophobicContact CD1-CG 3.95Å; D225-L229 WeakPolarHBondContact O-CB 3.48Å; D225-L229 VanDerWaalsContact O-CG 3.28Å; D225-L229 WeakPolarHBondContact O-CG 3.44Å; D225-L229 PolarHBondContact O-N 2.98Å; V226-L229 PolarHBondContact O-N 2.67Å; W227-L229 VanDerWaalsContact C-N 3.26Å; W227-L229 PolarHBondContact O-N 2.86Å; L229-V231 VanDerWaalsContact C-N 3.31Å; L229-V231 PolarHBondContact O-N 3.38Å; L229-I232 HydrophobicContact CD2-CD1 4.2Å; L229-I232 PolarHBondContact O-N 2.83Å; L229-L233 WeakPolarHBondContact O-CB 3.25Å; L229-L233 PolarHBondContact O-N 2.97Å; L229-M277 HydrophobicContact CB-CE 3.6Å; L229-L288 HydrophobicContact CD1-CD1 4.32Å; L229-L288 HydrophobicContact CD1-CD2 3.7Å
230	G	98.1	Very high	94.4	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-62.1	-38.5	170.2	0	0	0	0	0	112.5	V226 W227 Y234 L274	V226-G230 PolarHBondContact O-N 2.92Å; W227-G230 WeakPolarHBondContact O-CA 3.44Å; W227-G230 PolarHBondContact O-N 2.85Å; G230-Y234 PolarHBondContact O-N 3.31Å; G230-Y234 VanDerWaalsContact O-N 3.13Å; G230-L274 WeakPolarHBondContact O-CD2 3.22Å
231	V	97.5	Very high	95.1	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-65.9	-42.2	173.6	175.4	0	0	0	0	111.2	Y208 W227 S228 L229 T235 L241 P242 F243 L278	Y208-V231 HydrophobicContact CD1-CB 3.99Å; Y208-V231 HydrophobicContact CD1-CG1 3.44Å; Y208-V231 VanDerWaalsContact CD1-CG1 3.44Å; Y208-V231 HydrophobicContact CE1-CG1 3.81Å; Y208-V231 HydrophobicContact CG-CG1 4.14Å; W227-V231 PolarHBondContact O-N 3.35Å; S228-V231 WeakPolarHBondContact O-CB 3.37Å; S228-V231 PolarHBondContact O-N 3.06Å; L229-V231 VanDerWaalsContact C-N 3.31Å; L229-V231 PolarHBondContact O-N 3.38Å; V231-T235 WeakPolarHBondContact O-CB 3.47Å; V231-T235 PolarHBondContact O-N 3.13Å; V231-T235 PolarHBondContact O-OG1 3.07Å; V231-L241 HydrophobicContact CG1-CD2 4Å; V231-P242 HydrophobicContact CB-CG 4.25Å; V231-P242 HydrophobicContact CG1-CG 4.02Å; V231-P242 HydrophobicContact CG2-CG 3.99Å; V231-F243 HydrophobicContact CG2-CE2 4.44Å; V231-L278 HydrophobicContact CG2-CD2 3.97Å
232	I	96.8	Very high	95.6	Very high	3 Å²	3	10.7 Å²	10.7	2%	0.015	7%	0.065	C	C	.	.	H	α-helix	trans	-62.5	-49.4	175.5	-71.5	159.5	0	0	0	111.2	F149 I152 L169 L174 Y208 S228 L229 Y234 T235 L236	F149-I232 HydrophobicContact CD2-CG2 4.47Å; F149-I232 HydrophobicContact CE2-CG2 4.33Å; I152-I232 HydrophobicContact CD1-CG2 4.16Å; L169-I232 HydrophobicContact CB-CD1 4.06Å; L174-I232 HydrophobicContact CD1-CD1 4.17Å; L174-I232 HydrophobicContact CD1-CG1 4.48Å; L174-I232 HydrophobicContact CD1-CG2 3.8Å; Y208-I232 HydrophobicContact CD1-CG1 4.07Å; Y208-I232 HydrophobicContact CE1-CG1 3.92Å; S228-I232 WeakPolarHBondContact O-CG1 3.31Å; S228-I232 PolarHBondContact O-N 2.69Å; L229-I232 HydrophobicContact CD2-CD1 4.2Å; L229-I232 PolarHBondContact O-N 2.83Å; I232-Y234 PolarHBondContact O-N 2.74Å; I232-T235 WeakPolarHBondContact O-CA 3.49Å; I232-T235 WeakPolarHBondContact O-CB 3.38Å; I232-T235 PolarHBondContact O-N 2.98Å; I232-L236 HydrophobicContact CG2-CD1 4.02Å; I232-L236 HydrophobicContact CG2-CG 4.39Å; I232-L236 WeakPolarHBondContact O-CG 3.43Å; I232-L236 PolarHBondContact O-N 3.15Å
233	L	98	Very high	95.8	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-55.2	-50.8	178.2	175.3	58	0	0	0	111.7	F149 L229 T235 L236 V237 L273 L274 M277 W296	F149-L233 HydrophobicContact CD1-CB 4.49Å; F149-L233 HydrophobicContact CD1-CD1 4.03Å; F149-L233 HydrophobicContact CD1-CD2 4.37Å; F149-L233 HydrophobicContact CD2-CB 4.25Å; F149-L233 HydrophobicContact CE1-CB 4.06Å; F149-L233 HydrophobicContact CE1-CD1 4.33Å; F149-L233 HydrophobicContact CE1-CD2 3.93Å; F149-L233 HydrophobicContact CE1-CG 4.33Å; F149-L233 HydrophobicContact CE2-CB 3.79Å; F149-L233 HydrophobicContact CG-CD1 4.16Å; F149-L233 HydrophobicContact CZ-CB 3.69Å; F149-L233 HydrophobicContact CZ-CD2 4.32Å; F149-L233 HydrophobicContact CZ-CG 4.44Å; L229-L233 WeakPolarHBondContact O-CB 3.25Å; L229-L233 PolarHBondContact O-N 2.97Å; L233-T235 PolarHBondContact O-N 2.82Å; L233-L236 PolarHBondContact O-N 3.02Å; L233-V237 HydrophobicContact CD1-CG1 4.24Å; L233-V237 WeakPolarHBondContact O-CG2 3.44Å; L233-V237 PolarHBondContact O-N 2.76Å; L233-L273 HydrophobicContact CD2-CD2 3.7Å; L233-L273 HydrophobicContact CD2-CG 3.92Å; L233-L274 HydrophobicContact CB-CD2 4.12Å; L233-L274 HydrophobicContact CD2-CD2 3.89Å; L233-L274 HydrophobicContact CD2-CG 4.09Å; L233-L274 HydrophobicContact CG-CD2 3.97Å; L233-L274 HydrophobicContact CG-CG 4.43Å; L233-M277 HydrophobicContact CD2-SD 4.5Å; L233-W296 HydrophobicContact CD1-CE3 4.44Å; L233-W296 HydrophobicContact CD1-CH2 3.48Å; L233-W296 VanDerWaalsContact CD1-CH2 3.48Å; L233-W296 HydrophobicContact CD1-CZ2 4.23Å; L233-W296 HydrophobicContact CD1-CZ3 3.62Å
234	Y	97.8	Very high	95.6	Very high	11 Å²	11	10.9 Å²	10.9	4%	0.043	7%	0.066	C	C	.	.	H	α-helix	trans	-57.9	-38.9	176.8	-179.3	-82.4	0	0	0	111.8	G230 I232 S238 S240 L241 P242 Y260 R261 M266 L274	G230-Y234 PolarHBondContact O-N 3.31Å; G230-Y234 VanDerWaalsContact O-N 3.13Å; I232-Y234 PolarHBondContact O-N 2.74Å; Y234-S238 WeakPolarHBondContact CD1-OG 3.48Å; Y234-S238 WeakPolarHBondContact CE1-OG 3.46Å; Y234-S238 VanDerWaalsContact O-CB 3.25Å; Y234-S238 WeakPolarHBondContact O-CB 3.38Å; Y234-S238 PolarHBondContact O-N 3.25Å; Y234-S238 PolarHBondContact O-OG 2.84Å; Y234-S240 WeakPolarHBondContact CD1-O 3.42Å; Y234-S240 VanDerWaalsContact CE1-O 3.25Å; Y234-S240 WeakPolarHBondContact CE1-O 3.49Å; Y234-L241 VanDerWaalsContact CE1-C 3.46Å; Y234-P242 HydrophobicContact CD1-CB 3.61Å; Y234-P242 VanDerWaalsContact CD1-CD 3.48Å; Y234-P242 HydrophobicContact CD1-CG 3.96Å; Y234-P242 VanDerWaalsContact CD1-N 3.33Å; Y234-P242 HydrophobicContact CD2-CB 4.08Å; Y234-P242 VanDerWaalsContact CE1-CA 3.43Å; Y234-P242 HydrophobicContact CE1-CB 3.88Å; Y234-P242 VanDerWaalsContact CE1-N 3.35Å; Y234-P242 HydrophobicContact CE2-CB 4.31Å; Y234-P242 HydrophobicContact CG-CB 3.73Å; Y234-P242 HydrophobicContact CG-CG 4.15Å; Y234-Y260 AromaticContact CD2-CD2 3.99Å; Y234-Y260 HydrophobicContact CD2-CD2 3.99Å; Y234-Y260 AromaticContact CE2-CD2 3.87Å; Y234-Y260 HydrophobicContact CE2-CD2 3.87Å; Y234-R261 VanDerWaalsContact CE2-O 3.29Å; Y234-R261 WeakPolarHBondContact CE2-O 3.22Å; Y234-R261 PolarHBondContact OH-O 2.97Å; Y234-R261 VanDerWaalsContact OH-O 3.12Å; Y234-M266 HydrophobicContact CD2-CE 4.07Å; Y234-M266 HydrophobicContact CE2-CE 4.26Å; Y234-L274 HydrophobicContact CD2-CD1 4.12Å
235	T	95.2	Very high	95.3	Very high	3 Å²	3	11.4 Å²	11.4	2%	0.018	7%	0.072	C	C	.	.	H	α-helix	trans	-68.3	-40.8	179.7	-54.2	0	0	0	0	112	L134 V231 I232 L233 G239 S240	L134-T235 HydrophobicContact CD1-CG2 4.16Å; V231-T235 WeakPolarHBondContact O-CB 3.47Å; V231-T235 PolarHBondContact O-N 3.13Å; V231-T235 PolarHBondContact O-OG1 3.07Å; I232-T235 WeakPolarHBondContact O-CA 3.49Å; I232-T235 WeakPolarHBondContact O-CB 3.38Å; I232-T235 PolarHBondContact O-N 2.98Å; L233-T235 PolarHBondContact O-N 2.82Å; T235-G239 WeakPolarHBondContact O-CA 3.2Å; T235-G239 PolarHBondContact O-N 3.19Å; T235-S240 WeakPolarHBondContact CA-O 3.21Å; T235-S240 PolarHBondContact OG1-O 3.46Å
236	L	96.1	Very high	94.9	Very high	3 Å²	3	17.9 Å²	17.9	2%	0.016	10%	0.102	C	C	.	.	H	α-helix	trans	-59.5	-50.4	175.7	-66.8	164.7	0	0	0	111.7	V130 L134 M140 A145 F149 I152 I232 L233	V130-L236 HydrophobicContact CG1-CD2 3.63Å; L134-L236 HydrophobicContact CD1-CD2 4.23Å; M140-L236 HydrophobicContact CE-CD2 4.15Å; M140-L236 PolarHBondContact N-O 2.89Å; M140-L236 HydrophobicContact SD-CB 4.46Å; M140-L236 HydrophobicContact SD-CD2 3.66Å; A145-L236 HydrophobicContact CB-CB 4.14Å; F149-L236 HydrophobicContact CB-CD1 4.41Å; F149-L236 HydrophobicContact CD2-CD1 4.11Å; I152-L236 HydrophobicContact CD1-CD1 4.35Å; I232-L236 HydrophobicContact CG2-CD1 4.02Å; I232-L236 HydrophobicContact CG2-CG 4.39Å; I232-L236 WeakPolarHBondContact O-CG 3.43Å; I232-L236 PolarHBondContact O-N 3.15Å; L233-L236 PolarHBondContact O-N 3.02Å
237	V	97	Very high	94.5	Very high	2 Å²	2	20.9 Å²	20.9	1%	0.012	12%	0.121	C	C	.	.	H	α-helix	trans	-83	-17.7	-172.4	-55.9	0	0	0	0	114.5	R139 E142 A145 L233 Y265 M266 W296	R139-V237 WeakPolarHBondContact CD-O 3.48Å; R139-V237 PolarHBondContact NH1-O 2.98Å; E142-V237 HydrophobicContact CG-CG1 4.18Å; A145-V237 HydrophobicContact CB-CG1 3.68Å; L233-V237 HydrophobicContact CD1-CG1 4.24Å; L233-V237 WeakPolarHBondContact O-CG2 3.44Å; L233-V237 PolarHBondContact O-N 2.76Å; V237-Y265 WeakPolarHBondContact O-CE2 3.12Å; V237-M266 HydrophobicContact CG2-CE 3.58Å; V237-W296 HydrophobicContact CG1-CZ2 4.36Å
238	S	94.6	Very high	94	Very high	12 Å²	12	25.9 Å²	25.9	8%	0.084	15%	0.147	C	C	.	.	H	α-helix	trans	-113.1	-21.3	-179.1	78.2	0	0	0	0	115.6	Y234 S240	Y234-S238 WeakPolarHBondContact CD1-OG 3.48Å; Y234-S238 WeakPolarHBondContact CE1-OG 3.46Å; Y234-S238 VanDerWaalsContact O-CB 3.25Å; Y234-S238 WeakPolarHBondContact O-CB 3.38Å; Y234-S238 PolarHBondContact O-N 3.25Å; Y234-S238 PolarHBondContact O-OG 2.84Å; S238-S240 PolarHBondContact O-N 2.89Å; S238-S240 PolarHBondContact OG-N 2.83Å; S238-S240 VanDerWaalsContact OG-N 3.15Å; S238-S240 PolarHBondContact OG-O 3.45Å; S238-S240 VanDerWaalsContact OG-O 3.07Å; S238-S240 PolarHBondContact OG-OG 2.8Å
239	G	91.2	Very high	93.6	Very high	13 Å²	13	34 Å²	34	13%	0.134	18%	0.177	C	C	.	.	S	Bend	trans	72.9	12.8	-171.6	0	0	0	0	0	114.5	T235 R1121	T235-G239 WeakPolarHBondContact O-CA 3.2Å; T235-G239 PolarHBondContact O-N 3.19Å; G239-R1121 PolarHBondContact O-NH2 3.02Å
240	S	91.1	Very high	93.3	Very high	44 Å²	44	36.5 Å²	36.5	31%	0.308	19%	0.188	S	C	.	.	S	Bend	trans	-141	156.5	-174.8	67	0	0	0	0	111.6	Y234 T235 S238	Y234-S240 WeakPolarHBondContact CD1-O 3.42Å; Y234-S240 VanDerWaalsContact CE1-O 3.25Å; Y234-S240 WeakPolarHBondContact CE1-O 3.49Å; T235-S240 WeakPolarHBondContact CA-O 3.21Å; T235-S240 PolarHBondContact OG1-O 3.46Å; S238-S240 PolarHBondContact O-N 2.89Å; S238-S240 PolarHBondContact OG-N 2.83Å; S238-S240 VanDerWaalsContact OG-N 3.15Å; S238-S240 PolarHBondContact OG-O 3.45Å; S238-S240 VanDerWaalsContact OG-O 3.07Å; S238-S240 PolarHBondContact OG-OG 2.8Å
241	L	92.9	Very high	93.1	Very high	32 Å²	32	36.5 Å²	36.5	17%	0.168	19%	0.188	C	C	.	.			trans	-77.1	146.1	172.5	-70.9	164	0	0	0	110.4	P207 Y208 V231 Y234 F243 D244	P207-L241 HydrophobicContact CB-CD1 3.98Å; P207-L241 HydrophobicContact CB-CD2 4.17Å; P207-L241 HydrophobicContact CG-CD1 4.41Å; Y208-L241 HydrophobicContact CE1-CD2 4.4Å; V231-L241 HydrophobicContact CG1-CD2 4Å; Y234-L241 VanDerWaalsContact CE1-C 3.46Å; L241-F243 VanDerWaalsContact C-N 3.31Å; L241-D244 HydrophobicContact CB-CB 4.43Å
242	P	96	Very high	92.9	Very high	13 Å²	13	42.3 Å²	42.3	8%	0.084	21%	0.21	C	C	.	.	S	Bend	trans	-72.6	-27.5	176.6	27.9	-30.7	0	0	0	112.4	V231 Y234 Y260 L278	V231-P242 HydrophobicContact CB-CG 4.25Å; V231-P242 HydrophobicContact CG1-CG 4.02Å; V231-P242 HydrophobicContact CG2-CG 3.99Å; Y234-P242 HydrophobicContact CD1-CB 3.61Å; Y234-P242 VanDerWaalsContact CD1-CD 3.48Å; Y234-P242 HydrophobicContact CD1-CG 3.96Å; Y234-P242 VanDerWaalsContact CD1-N 3.33Å; Y234-P242 HydrophobicContact CD2-CB 4.08Å; Y234-P242 VanDerWaalsContact CE1-CA 3.43Å; Y234-P242 HydrophobicContact CE1-CB 3.88Å; Y234-P242 VanDerWaalsContact CE1-N 3.35Å; Y234-P242 HydrophobicContact CE2-CB 4.31Å; Y234-P242 HydrophobicContact CG-CB 3.73Å; Y234-P242 HydrophobicContact CG-CG 4.15Å; P242-Y260 HydrophobicContact CB-CG 4.28Å; P242-L278 HydrophobicContact CB-CD1 4.48Å
243	F	95.5	Very high	92.8	Very high	3 Å²	3	46.7 Å²	46.7	1%	0.013	23%	0.23	C	C	.	.	S	Bend	trans	-133.7	124.1	176.8	-39.5	-68.8	0	0	0	108	W227 V231 L241 L251 V255 Y260 L278	W227-F243 AromaticContact CH2-CE2 3.9Å; W227-F243 HydrophobicContact CH2-CE2 3.9Å; W227-F243 AromaticContact CH2-CZ 3.98Å; W227-F243 HydrophobicContact CH2-CZ 3.98Å; W227-F243 HydrophobicContact CZ2-CD2 4.04Å; W227-F243 AromaticContact CZ2-CE2 3.35Å; W227-F243 HydrophobicContact CZ2-CE2 3.35Å; W227-F243 AromaticContact CZ2-CZ 3.91Å; W227-F243 HydrophobicContact CZ2-CZ 3.91Å; V231-F243 HydrophobicContact CG2-CE2 4.44Å; L241-F243 VanDerWaalsContact C-N 3.31Å; F243-L251 HydrophobicContact CB-CD1 4.03Å; F243-L251 WeakPolarHBondContact O-CD1 3.4Å; F243-V255 HydrophobicContact CB-CG2 3.67Å; F243-V255 HydrophobicContact CD2-CG2 4.01Å; F243-V255 HydrophobicContact CG-CG2 3.92Å; F243-Y260 HydrophobicContact CE1-CD1 4.04Å; F243-Y260 HydrophobicContact CE1-CG 4.5Å; F243-Y260 AromaticContact CZ-CD1 3.92Å; F243-Y260 HydrophobicContact CZ-CD1 3.92Å; F243-L278 HydrophobicContact CE2-CD1 4.44Å; F243-L278 HydrophobicContact CE2-CD2 4.3Å; F243-L278 HydrophobicContact CZ-CD1 4.36Å
244	D	90.8	Very high	92.6	Very high	79 Å²	79	50.8 Å²	50.8	42%	0.422	25%	0.246	S	C	.	.			trans	-145.6	161.7	178.5	-165.3	9.5	0	0	0	109.6	L241 R254	L241-D244 HydrophobicContact CB-CB 4.43Å; D244-R254 WeakPolarHBondContact O-CD 3.45Å; D244-R254 PolarHBondContact O-NH1 3.03Å
245	G	86.9	Confident	92.5	Very high	13 Å²	13	50.2 Å²	50.2	13%	0.134	24%	0.244	C	C	.	.			trans	-177.3	149.9	175.5	0	0	0	0	0	115.4	T247	G245-T247 PolarHBondContact O-N 3.4Å; G245-T247 VanDerWaalsContact O-N 3.11Å
246	Q	87.4	Confident	92.5	Very high	136 Å²	136	52.9 Å²	52.9	64%	0.636	26%	0.257	S	S	*	.	S	Bend	trans	-64.7	-19.4	-175.7	-164.7	60.9	27.6	0	0	112.6
247	T	88.9	Confident	92.5	Very high	66 Å²	66	59.5 Å²	59.5	41%	0.405	28%	0.282	S	S	.	.	S	Bend	trans	-131.7	151.6	173.8	63.5	0	0	0	0	111.9	G245 R249 E250 L251	G245-T247 PolarHBondContact O-N 3.4Å; G245-T247 VanDerWaalsContact O-N 3.11Å; T247-R249 PolarHBondContact O-N 3.32Å; T247-R249 VanDerWaalsContact O-N 3.08Å; T247-E250 PolarHBondContact N-OE1 2.95Å; T247-E250 PolarHBondContact O-N 3.3Å; T247-E250 VanDerWaalsContact O-N 3.12Å; T247-E250 WeakPolarHBondContact OG1-CG 3.21Å; T247-E250 PolarHBondContact OG1-N 3.08Å; T247-E250 PolarHBondContact OG1-OE1 3.03Å; T247-E250 VanDerWaalsContact OG1-OE1 3.08Å; T247-L251 PolarHBondContact O-N 3.46Å
248	L	87.1	Confident	92.4	Very high	105 Å²	105	60.1 Å²	60.1	55%	0.55	29%	0.289	S	S	.	.	H	α-helix	trans	-54.3	-26.9	169.9	-74.4	173.7	0	0	0	112.9	P206 R252 W1061	P206-L248 HydrophobicContact CB-CD2 3.95Å; P206-L248 HydrophobicContact CG-CD2 4.01Å; L248-R252 WeakPolarHBondContact O-CB 3.47Å; L248-R252 PolarHBondContact O-N 2.92Å; L248-W1061 HydrophobicContact CD2-CH2 3.67Å; L248-W1061 HydrophobicContact CD2-CZ3 3.7Å
249	R	88.9	Confident	92.4	Very high	177 Å²	177	66.8 Å²	66.8	67%	0.668	32%	0.316	S	S	*	.	H	α-helix	trans	-68.4	-53.9	175.3	178.4	-179.6	169.5	-170.7	-9.2	111.1	T247 L251 R252 E253	T247-R249 PolarHBondContact O-N 3.32Å; T247-R249 VanDerWaalsContact O-N 3.08Å; R249-L251 VanDerWaalsContact C-N 3.32Å; R249-L251 PolarHBondContact O-N 3.47Å; R249-R252 WeakPolarHBondContact O-CB 3.43Å; R249-R252 PolarHBondContact O-N 3.44Å; R249-E253 WeakPolarHBondContact CG-OE1 3.46Å; R249-E253 IonicContact CZ-OE1 3.33Å; R249-E253 IonicContact NE-OE1 3.24Å; R249-E253 PolarHBondContact NE-OE1 2.84Å; R249-E253 IonicContact NH2-OE1 3.39Å; R249-E253 PolarHBondContact NH2-OE1 2.85Å; R249-E253 WeakPolarHBondContact O-CG 3.47Å; R249-E253 PolarHBondContact O-N 3.26Å
250	E	92.7	Very high	92.7	Very high	52 Å²	52	68.3 Å²	68.3	24%	0.243	32%	0.318	C	S	.	.	H	α-helix	trans	-60.4	-42.2	177.2	-76.5	168.8	-104.1	0	0	112.3	T247 E253 R254	T247-E250 PolarHBondContact N-OE1 2.95Å; T247-E250 PolarHBondContact O-N 3.3Å; T247-E250 VanDerWaalsContact O-N 3.12Å; T247-E250 WeakPolarHBondContact OG1-CG 3.21Å; T247-E250 PolarHBondContact OG1-N 3.08Å; T247-E250 PolarHBondContact OG1-OE1 3.03Å; T247-E250 VanDerWaalsContact OG1-OE1 3.08Å; E250-E253 PolarHBondContact O-N 2.8Å; E250-R254 WeakPolarHBondContact O-CB 3.02Å; E250-R254 WeakPolarHBondContact O-CG 3.28Å; E250-R254 PolarHBondContact O-N 3.3Å; E250-R254 IonicContact OE2-CZ 3.82Å; E250-R254 VanDerWaalsContact OE2-CZ 3.24Å; E250-R254 IonicContact OE2-NH1 3.39Å; E250-R254 PolarHBondContact OE2-NH1 3.28Å; E250-R254 IonicContact OE2-NH2 2.68Å; E250-R254 PolarHBondContact OE2-NH2 3.09Å
251	L	92.8	Very high	92.9	Very high	0 Å²	0	75.4 Å²	75.4	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-59.5	-48.9	176.6	176.6	65.8	0	0	0	110.3	P206 P207 F214 F243 T247 R249 E253 R254 V255 W1061	P206-L251 HydrophobicContact CB-CD2 3.97Å; P207-L251 HydrophobicContact CG-CD2 4.37Å; F214-L251 HydrophobicContact CZ-CD2 4.42Å; F243-L251 HydrophobicContact CB-CD1 4.03Å; F243-L251 WeakPolarHBondContact O-CD1 3.4Å; T247-L251 PolarHBondContact O-N 3.46Å; R249-L251 VanDerWaalsContact C-N 3.32Å; R249-L251 PolarHBondContact O-N 3.47Å; L251-E253 VanDerWaalsContact C-N 3.33Å; L251-E253 PolarHBondContact O-N 3.09Å; L251-R254 PolarHBondContact O-N 3.01Å; L251-R254 VanDerWaalsContact O-N 3.14Å; L251-V255 HydrophobicContact CD1-CG2 3.94Å; L251-V255 HydrophobicContact CG-CG2 4.22Å; L251-V255 WeakPolarHBondContact O-CB 3.48Å; L251-V255 WeakPolarHBondContact O-CG2 3.46Å; L251-V255 PolarHBondContact O-N 3.37Å; L251-W1061 HydrophobicContact CD2-CH2 3.55Å; L251-W1061 HydrophobicContact CD2-CZ2 3.76Å
252	R	92.5	Very high	93.1	Very high	121 Å²	121	76.6 Å²	76.6	46%	0.457	34%	0.344	S	S	.	.	H	α-helix	trans	-56.3	-45.9	174.9	178	174.4	-169.7	-141.1	6.6	111.6	F214 L248 R249 R254 V255 L256	F214-R252 HydrophobicContact CB-CG 4.08Å; F214-R252 HydrophobicContact CD1-CB 3.73Å; F214-R252 HydrophobicContact CD1-CG 3.63Å; F214-R252 HydrophobicContact CE1-CB 3.92Å; F214-R252 HydrophobicContact CE1-CG 4.34Å; F214-R252 HydrophobicContact CG-CB 4.46Å; F214-R252 HydrophobicContact CG-CG 4.09Å; F214-R252 VanDerWaalsContact O-CZ 3.29Å; F214-R252 PolarHBondContact O-NE 3.03Å; F214-R252 PolarHBondContact O-NH2 3.19Å; L248-R252 WeakPolarHBondContact O-CB 3.47Å; L248-R252 PolarHBondContact O-N 2.92Å; R249-R252 WeakPolarHBondContact O-CB 3.43Å; R249-R252 PolarHBondContact O-N 3.44Å; R252-R254 VanDerWaalsContact C-N 3.32Å; R252-R254 PolarHBondContact O-N 2.86Å; R252-V255 PolarHBondContact O-N 3.06Å; R252-L256 HydrophobicContact CG-CD1 3.66Å; R252-L256 HydrophobicContact CG-CG 4.23Å; R252-L256 VanDerWaalsContact O-CB 3.26Å; R252-L256 WeakPolarHBondContact O-CB 3.29Å; R252-L256 WeakPolarHBondContact O-CG 3.34Å; R252-L256 PolarHBondContact O-N 2.97Å
253	E	94.7	Very high	93.1	Very high	95 Å²	95	76.5 Å²	76.5	44%	0.444	34%	0.344	S	S	.	.	H	α-helix	trans	-62.9	-36.2	177.5	-72.1	170.1	-178.2	0	0	112.1	R249 E250 L251 R257	R249-E253 WeakPolarHBondContact CG-OE1 3.46Å; R249-E253 IonicContact CZ-OE1 3.33Å; R249-E253 IonicContact NE-OE1 3.24Å; R249-E253 PolarHBondContact NE-OE1 2.84Å; R249-E253 IonicContact NH2-OE1 3.39Å; R249-E253 PolarHBondContact NH2-OE1 2.85Å; R249-E253 WeakPolarHBondContact O-CG 3.47Å; R249-E253 PolarHBondContact O-N 3.26Å; E250-E253 PolarHBondContact O-N 2.8Å; L251-E253 VanDerWaalsContact C-N 3.33Å; L251-E253 PolarHBondContact O-N 3.09Å; E253-R257 VanDerWaalsContact O-CB 3.27Å; E253-R257 WeakPolarHBondContact O-CB 3.47Å; E253-R257 PolarHBondContact O-N 3.06Å
254	R	95.4	Very high	93.1	Very high	86 Å²	86	85.8 Å²	85.8	33%	0.325	39%	0.385	S	S	.	.	H	α-helix	trans	-75.5	-42	176.7	-71.5	169.1	-173.3	133.6	15.7	113.1	D244 E250 L251 R252 R257 G258	D244-R254 WeakPolarHBondContact O-CD 3.45Å; D244-R254 PolarHBondContact O-NH1 3.03Å; E250-R254 WeakPolarHBondContact O-CB 3.02Å; E250-R254 WeakPolarHBondContact O-CG 3.28Å; E250-R254 PolarHBondContact O-N 3.3Å; E250-R254 IonicContact OE2-CZ 3.82Å; E250-R254 VanDerWaalsContact OE2-CZ 3.24Å; E250-R254 IonicContact OE2-NH1 3.39Å; E250-R254 PolarHBondContact OE2-NH1 3.28Å; E250-R254 IonicContact OE2-NH2 2.68Å; E250-R254 PolarHBondContact OE2-NH2 3.09Å; L251-R254 PolarHBondContact O-N 3.01Å; L251-R254 VanDerWaalsContact O-N 3.14Å; R252-R254 VanDerWaalsContact C-N 3.32Å; R252-R254 PolarHBondContact O-N 2.86Å; R254-R257 WeakPolarHBondContact O-CB 3.19Å; R254-R257 PolarHBondContact O-N 3.41Å; R254-G258 PolarHBondContact O-N 3.32Å
255	V	95.3	Very high	93.4	Very high	0 Å²	0	85.6 Å²	85.6	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-63.1	-49.2	175.3	167.2	0	0	0	0	110.7	P211 F214 W227 F243 L251 R252 R257 G258 L280	P211-V255 HydrophobicContact CB-CG1 4.07Å; F214-V255 HydrophobicContact CD2-CB 4.34Å; F214-V255 HydrophobicContact CD2-CG1 3.71Å; F214-V255 HydrophobicContact CE2-CB 4.2Å; F214-V255 HydrophobicContact CE2-CG1 3.83Å; F214-V255 HydrophobicContact CE2-CG2 4.18Å; W227-V255 HydrophobicContact CZ2-CG1 3.98Å; F243-V255 HydrophobicContact CB-CG2 3.67Å; F243-V255 HydrophobicContact CD2-CG2 4.01Å; F243-V255 HydrophobicContact CG-CG2 3.92Å; L251-V255 HydrophobicContact CD1-CG2 3.94Å; L251-V255 HydrophobicContact CG-CG2 4.22Å; L251-V255 WeakPolarHBondContact O-CB 3.48Å; L251-V255 WeakPolarHBondContact O-CG2 3.46Å; L251-V255 PolarHBondContact O-N 3.37Å; R252-V255 PolarHBondContact O-N 3.06Å; V255-R257 PolarHBondContact O-N 2.75Å; V255-G258 PolarHBondContact O-N 2.84Å; V255-L280 WeakPolarHBondContact O-CD2 3.38Å
256	L	95.3	Very high	93.9	Very high	58 Å²	58	85.8 Å²	85.8	30%	0.304	38%	0.376	S	S	.	.	H	α-helix	trans	-63.6	-24.3	177.5	-68.3	174.1	0	0	0	113.2	P211 F214 Q215 R252	P211-L256 HydrophobicContact CB-CD2 4.03Å; P211-L256 WeakPolarHBondContact O-CD2 3.25Å; F214-L256 HydrophobicContact CB-CD2 4.15Å; F214-L256 HydrophobicContact CB-CG 4.44Å; Q215-L256 HydrophobicContact CG-CD2 3.71Å; Q215-L256 VanDerWaalsContact NE2-CD2 3.31Å; R252-L256 HydrophobicContact CG-CD1 3.66Å; R252-L256 HydrophobicContact CG-CG 4.23Å; R252-L256 VanDerWaalsContact O-CB 3.26Å; R252-L256 WeakPolarHBondContact O-CB 3.29Å; R252-L256 WeakPolarHBondContact O-CG 3.34Å; R252-L256 PolarHBondContact O-N 2.97Å
257	R	95.9	Very high	94.4	Very high	143 Å²	143	81.1 Å²	81.1	54%	0.54	36%	0.358	S	S	.	.	H	α-helix	trans	-80.1	-22	174	-170.3	-176.5	70.8	171.5	5.1	112.9	E253 R254 V255 K259	E253-R257 VanDerWaalsContact O-CB 3.27Å; E253-R257 WeakPolarHBondContact O-CB 3.47Å; E253-R257 PolarHBondContact O-N 3.06Å; R254-R257 WeakPolarHBondContact O-CB 3.19Å; R254-R257 PolarHBondContact O-N 3.41Å; V255-R257 PolarHBondContact O-N 2.75Å; R257-K259 HydrophobicContact CG-CB 4.36Å; R257-K259 HydrophobicContact CG-CD 4.29Å; R257-K259 HydrophobicContact CG-CG 4.22Å; R257-K259 PolarHBondContact O-N 3.16Å; R257-K259 VanDerWaalsContact O-N 3.1Å
258	G	94.7	Very high	94.9	Very high	15 Å²	15	83 Å²	83	16%	0.155	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.9	14.2	176.5	0	0	0	0	0	116	R254 V255	R254-G258 PolarHBondContact O-N 3.32Å; V255-G258 PolarHBondContact O-N 2.84Å
259	K	95.4	Very high	95.4	Very high	151 Å²	151	79.7 Å²	79.7	66%	0.657	35%	0.353	S	S	*	.			trans	-103.6	108.9	-176.4	-69.5	-173.6	-179	-171.7	0	111.9	R257	R257-K259 HydrophobicContact CG-CB 4.36Å; R257-K259 HydrophobicContact CG-CD 4.29Å; R257-K259 HydrophobicContact CG-CG 4.22Å; R257-K259 PolarHBondContact O-N 3.16Å; R257-K259 VanDerWaalsContact O-N 3.1Å
260	Y	96.7	Very high	95.8	Very high	45 Å²	45	71.3 Å²	71.3	18%	0.176	32%	0.321	C	S	.	.			trans	-108.9	169	173.2	55.5	-80.9	0	0	0	110.9	Y234 P242 F243 I262 L274 K275 L278	Y234-Y260 AromaticContact CD2-CD2 3.99Å; Y234-Y260 HydrophobicContact CD2-CD2 3.99Å; Y234-Y260 AromaticContact CE2-CD2 3.87Å; Y234-Y260 HydrophobicContact CE2-CD2 3.87Å; P242-Y260 HydrophobicContact CB-CG 4.28Å; F243-Y260 HydrophobicContact CE1-CD1 4.04Å; F243-Y260 HydrophobicContact CE1-CG 4.5Å; F243-Y260 AromaticContact CZ-CD1 3.92Å; F243-Y260 HydrophobicContact CZ-CD1 3.92Å; Y260-I262 HydrophobicContact CD2-CD1 3.95Å; Y260-I262 HydrophobicContact CE2-CD1 3.52Å; Y260-L274 HydrophobicContact CE2-CB 4.24Å; Y260-K275 PolarHBondContact OH-N 3.35Å; Y260-L278 HydrophobicContact CD1-CD1 3.99Å; Y260-L278 HydrophobicContact CE1-CB 4Å; Y260-L278 HydrophobicContact CE1-CD1 3.76Å; Y260-L278 HydrophobicContact CE2-CD1 4.36Å; Y260-L278 HydrophobicContact CG-CD1 4.42Å
261	R	95.8	Very high	96.1	Very high	193 Å²	193	71 Å²	71	73%	0.728	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-97.7	131.1	-179	176.9	-179.1	-179.9	179	2	110.4	Y234 P263	Y234-R261 VanDerWaalsContact CE2-O 3.29Å; Y234-R261 WeakPolarHBondContact CE2-O 3.22Å; Y234-R261 PolarHBondContact OH-O 2.97Å; Y234-R261 VanDerWaalsContact OH-O 3.12Å; R261-P263 WeakPolarHBondContact O-CD 3.27Å
262	I	97	Very high	96.3	Very high	57 Å²	57	73.2 Å²	73.2	29%	0.292	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-84.5	122.3	167	-52.6	-54.8	0	0	0	108.9	Y260 M266 E271	Y260-I262 HydrophobicContact CD2-CD1 3.95Å; Y260-I262 HydrophobicContact CE2-CD1 3.52Å; I262-M266 HydrophobicContact CD1-SD 4.05Å; I262-M266 HydrophobicContact CG2-CB 4.27Å; I262-M266 HydrophobicContact CG2-SD 3.95Å; I262-E271 HydrophobicContact CD1-CB 4.42Å; I262-E271 HydrophobicContact CD1-CG 3.77Å; I262-E271 HydrophobicContact CG1-CG 4.04Å; I262-E271 HydrophobicContact CG2-CG 4.49Å
263	P	95.7	Very high	96.6	Very high	12 Å²	12	67.5 Å²	67.5	8%	0.078	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-75.1	147.1	170.7	-13.2	29.6	0	0	0	111.2	R261 Y265 M266	R261-P263 WeakPolarHBondContact O-CD 3.27Å; P263-Y265 HydrophobicContact CB-CD1 3.93Å; P263-Y265 HydrophobicContact CB-CD2 3.92Å; P263-Y265 HydrophobicContact CB-CE1 3.54Å; P263-Y265 HydrophobicContact CB-CE2 3.51Å; P263-Y265 HydrophobicContact CB-CG 4.12Å; P263-Y265 HydrophobicContact CG-CE1 4.44Å; P263-Y265 HydrophobicContact CG-CE2 3.82Å; P263-Y265 PolarHBondContact O-N 2.89Å; P263-M266 HydrophobicContact CG-CE 4.37Å; P263-M266 WeakPolarHBondContact O-CB 3.5Å; P263-M266 PolarHBondContact O-N 2.92Å
264	F	96.1	Very high	96.8	Very high	198 Å²	198	63 Å²	63	87%	0.868	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-15.3	-179.4	70.8	-93.3	0	0	0	114.9
265	Y	96.3	Very high	96.9	Very high	75 Å²	75	64.5 Å²	64.5	29%	0.294	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	0.9	-179.3	57	-113.7	0	0	0	113.8	R139 V237 P263	R139-Y265 VanDerWaalsContact CD-CZ 3.5Å; R139-Y265 WeakPolarHBondContact CD-OH 3.35Å; R139-Y265 VanDerWaalsContact CZ-CE2 3.44Å; V237-Y265 WeakPolarHBondContact O-CE2 3.12Å; P263-Y265 HydrophobicContact CB-CD1 3.93Å; P263-Y265 HydrophobicContact CB-CD2 3.92Å; P263-Y265 HydrophobicContact CB-CE1 3.54Å; P263-Y265 HydrophobicContact CB-CE2 3.51Å; P263-Y265 HydrophobicContact CB-CG 4.12Å; P263-Y265 HydrophobicContact CG-CE1 4.44Å; P263-Y265 HydrophobicContact CG-CE2 3.82Å; P263-Y265 PolarHBondContact O-N 2.89Å
266	M	97.6	Very high	97.1	Very high	17 Å²	17	66.9 Å²	66.9	8%	0.084	31%	0.312	C	S	.	.	S	Bend	trans	-87.2	134.9	177.5	-179.4	-178	-80	0	0	109.2	E142 Y234 V237 I262 P263 C270 E271 L274	E142-M266 WeakPolarHBondContact OE1-CA 3.24Å; Y234-M266 HydrophobicContact CD2-CE 4.07Å; Y234-M266 HydrophobicContact CE2-CE 4.26Å; V237-M266 HydrophobicContact CG2-CE 3.58Å; I262-M266 HydrophobicContact CD1-SD 4.05Å; I262-M266 HydrophobicContact CG2-CB 4.27Å; I262-M266 HydrophobicContact CG2-SD 3.95Å; P263-M266 HydrophobicContact CG-CE 4.37Å; P263-M266 WeakPolarHBondContact O-CB 3.5Å; P263-M266 PolarHBondContact O-N 2.92Å; M266-C270 HydrophobicContact CG-CB 3.83Å; M266-E271 HydrophobicContact SD-CB 4.44Å; M266-L274 HydrophobicContact CE-CD1 3.61Å; M266-L274 HydrophobicContact SD-CD1 3.7Å
267	S	98	Very high	97.2	Very high	37 Å²	37	64.1 Å²	64.1	26%	0.259	30%	0.297	S	S	.	.			trans	-70.5	152.6	178.1	69	0	0	0	0	112	E142 D269 C270 E271	E142-S267 PolarHBondContact OE1-N 3.17Å; E142-S267 PolarHBondContact OE1-OG 2.68Å; E142-S267 WeakPolarHBondContact OE2-CB 3.07Å; E142-S267 PolarHBondContact OE2-OG 2.76Å; S267-D269 PolarHBondContact O-N 3.07Å; S267-C270 WeakPolarHBondContact O-CB 3.41Å; S267-C270 PolarHBondContact O-N 2.81Å; S267-C270 VanDerWaalsContact O-N 3.11Å; S267-C270 VanDerWaalsContact OG-CB 3.28Å; S267-C270 WeakPolarHBondContact OG-CB 3.42Å; S267-C270 PolarHBondContact OG-N 3.2Å; S267-C270 VanDerWaalsContact OG-N 3.07Å; S267-E271 PolarHBondContact O-N 2.86Å
268	T	98	Very high	97.3	Very high	105 Å²	105	57.8 Å²	57.8	64%	0.644	27%	0.274	S	S	*	.	H	α-helix	trans	-61	-31.5	173.8	46.1	0	0	0	0	112.3	S272	T268-S272 VanDerWaalsContact O-CB 3.24Å; T268-S272 WeakPolarHBondContact O-CB 2.97Å; T268-S272 PolarHBondContact O-N 3.16Å
269	D	98.2	Very high	97.4	Very high	37 Å²	37	58.5 Å²	58.5	20%	0.198	28%	0.276	C	S	.	.	H	α-helix	trans	-68.9	-40.8	173	-66.8	-53	0	0	0	111.7	S267 S272 L273 R295 W296	S267-D269 PolarHBondContact O-N 3.07Å; D269-S272 WeakPolarHBondContact O-CB 3.48Å; D269-S272 PolarHBondContact O-N 3.44Å; D269-L273 PolarHBondContact O-N 2.86Å; D269-R295 WeakPolarHBondContact OD1-CD 3.19Å; D269-R295 IonicContact OD1-CZ 3.29Å; D269-R295 IonicContact OD1-NE 3.38Å; D269-R295 IonicContact OD1-NH1 3.85Å; D269-R295 PolarHBondContact OD1-NH1 3.35Å; D269-R295 IonicContact OD2-CZ 2.83Å; D269-R295 IonicContact OD2-NH1 2.8Å; D269-R295 PolarHBondContact OD2-NH1 2.88Å; D269-W296 HydrophobicContact CB-CB 4.06Å; D269-W296 HydrophobicContact CB-CG 4.46Å
270	C	98.5	Very high	97.5	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-64.9	-43.9	174.1	-169.3	0	0	0	0	111.7	M266 S267 S272 L273 L274 W296	M266-C270 HydrophobicContact CG-CB 3.83Å; S267-C270 WeakPolarHBondContact O-CB 3.41Å; S267-C270 PolarHBondContact O-N 2.81Å; S267-C270 VanDerWaalsContact O-N 3.11Å; S267-C270 VanDerWaalsContact OG-CB 3.28Å; S267-C270 WeakPolarHBondContact OG-CB 3.42Å; S267-C270 PolarHBondContact OG-N 3.2Å; S267-C270 VanDerWaalsContact OG-N 3.07Å; C270-S272 VanDerWaalsContact C-N 3.32Å; C270-S272 PolarHBondContact O-N 3.06Å; C270-L273 PolarHBondContact O-N 3.19Å; C270-L274 WeakPolarHBondContact O-CB 3.38Å; C270-L274 WeakPolarHBondContact O-CG 3.29Å; C270-L274 PolarHBondContact O-N 3.22Å; C270-W296 HydrophobicContact CB-CG 4.33Å; C270-W296 VanDerWaalsContact N-CD1 3.35Å
271	E	98.1	Very high	97.4	Very high	47 Å²	47	56.1 Å²	56.1	22%	0.22	27%	0.273	C	S	.	.	H	α-helix	trans	-60.1	-41.6	173.4	179.5	-177.8	-177	0	0	111.5	I262 M266 S267 L274 K275	I262-E271 HydrophobicContact CD1-CB 4.42Å; I262-E271 HydrophobicContact CD1-CG 3.77Å; I262-E271 HydrophobicContact CG1-CG 4.04Å; I262-E271 HydrophobicContact CG2-CG 4.49Å; M266-E271 HydrophobicContact SD-CB 4.44Å; S267-E271 PolarHBondContact O-N 2.86Å; E271-L274 PolarHBondContact O-N 3.19Å; E271-K275 VanDerWaalsContact CD-NZ 3.26Å; E271-K275 HydrophobicContact CG-CD 4.13Å; E271-K275 WeakPolarHBondContact O-CB 3.37Å; E271-K275 VanDerWaalsContact O-CG 3.31Å; E271-K275 WeakPolarHBondContact O-CG 3.41Å; E271-K275 PolarHBondContact O-N 3Å; E271-K275 WeakPolarHBondContact OE1-CE 3.41Å; E271-K275 IonicContact OE1-NZ 2.92Å; E271-K275 PolarHBondContact OE1-NZ 3.39Å
272	S	98.1	Very high	97.3	Very high	46 Å²	46	48.7 Å²	48.7	32%	0.322	25%	0.249	S	C	.	.	H	α-helix	trans	-60.3	-48.9	176.5	-172.4	0	0	0	0	111.4	T268 D269 C270 K275 K276	T268-S272 VanDerWaalsContact O-CB 3.24Å; T268-S272 WeakPolarHBondContact O-CB 2.97Å; T268-S272 PolarHBondContact O-N 3.16Å; D269-S272 WeakPolarHBondContact O-CB 3.48Å; D269-S272 PolarHBondContact O-N 3.44Å; C270-S272 VanDerWaalsContact C-N 3.32Å; C270-S272 PolarHBondContact O-N 3.06Å; S272-K275 PolarHBondContact O-N 3.16Å; S272-K276 VanDerWaalsContact O-CD 3.28Å; S272-K276 WeakPolarHBondContact O-CD 3.25Å; S272-K276 VanDerWaalsContact O-CG 3.27Å; S272-K276 WeakPolarHBondContact O-CG 3.41Å; S272-K276 PolarHBondContact O-N 2.74Å
273	L	98.5	Very high	97.1	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-60.2	-46.5	175.4	180	54.5	0	0	0	112	L233 D269 C270 K275 K276 M277 V291 D294 W296 M297	L233-L273 HydrophobicContact CD2-CD2 3.7Å; L233-L273 HydrophobicContact CD2-CG 3.92Å; D269-L273 PolarHBondContact O-N 2.86Å; C270-L273 PolarHBondContact O-N 3.19Å; L273-K275 VanDerWaalsContact C-N 3.32Å; L273-K275 PolarHBondContact O-N 2.8Å; L273-K276 WeakPolarHBondContact O-CB 3.36Å; L273-K276 PolarHBondContact O-N 3.04Å; L273-M277 HydrophobicContact CD1-CG 4.06Å; L273-M277 HydrophobicContact CD1-SD 3.82Å; L273-M277 HydrophobicContact CG-SD 4.01Å; L273-M277 WeakPolarHBondContact O-CG 3.28Å; L273-M277 PolarHBondContact O-N 3.11Å; L273-M277 VanDerWaalsContact O-N 3.12Å; L273-V291 HydrophobicContact CD1-CG1 4.22Å; L273-V291 HydrophobicContact CD1-CG2 4.39Å; L273-D294 HydrophobicContact CD1-CB 4.05Å; L273-W296 HydrophobicContact CB-CB 4.34Å; L273-W296 HydrophobicContact CD2-CB 4.16Å; L273-W296 HydrophobicContact CD2-CD2 4.28Å; L273-W296 HydrophobicContact CD2-CE3 3.63Å; L273-W296 HydrophobicContact CD2-CZ3 4.42Å; L273-M297 HydrophobicContact CD2-CG 3.99Å; L273-M297 HydrophobicContact CD2-SD 4.04Å
274	L	98.6	Very high	97.1	Very high	0 Å²	0	58 Å²	58	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-59.8	-40.7	176.9	-74.2	168	0	0	0	112.4	G230 L233 Y234 Y260 M266 C270 E271 K276 M277 L278	G230-L274 WeakPolarHBondContact O-CD2 3.22Å; L233-L274 HydrophobicContact CB-CD2 4.12Å; L233-L274 HydrophobicContact CD2-CD2 3.89Å; L233-L274 HydrophobicContact CD2-CG 4.09Å; L233-L274 HydrophobicContact CG-CD2 3.97Å; L233-L274 HydrophobicContact CG-CG 4.43Å; Y234-L274 HydrophobicContact CD2-CD1 4.12Å; Y260-L274 HydrophobicContact CE2-CB 4.24Å; M266-L274 HydrophobicContact CE-CD1 3.61Å; M266-L274 HydrophobicContact SD-CD1 3.7Å; C270-L274 WeakPolarHBondContact O-CB 3.38Å; C270-L274 WeakPolarHBondContact O-CG 3.29Å; C270-L274 PolarHBondContact O-N 3.22Å; E271-L274 PolarHBondContact O-N 3.19Å; L274-K276 PolarHBondContact O-N 2.84Å; L274-M277 PolarHBondContact O-N 2.77Å; L274-L278 HydrophobicContact CD2-CD1 4.24Å; L274-L278 WeakPolarHBondContact O-CB 3.19Å; L274-L278 PolarHBondContact O-N 2.98Å
275	K	97.7	Very high	97.2	Very high	119 Å²	119	49.4 Å²	49.4	52%	0.517	26%	0.262	S	S	.	.	H	α-helix	trans	-63.1	-23.5	175.3	-77.5	170.5	178.6	167.2	0	113.6	Y260 E271 S272 L273 V279	Y260-K275 PolarHBondContact OH-N 3.35Å; E271-K275 VanDerWaalsContact CD-NZ 3.26Å; E271-K275 HydrophobicContact CG-CD 4.13Å; E271-K275 WeakPolarHBondContact O-CB 3.37Å; E271-K275 VanDerWaalsContact O-CG 3.31Å; E271-K275 WeakPolarHBondContact O-CG 3.41Å; E271-K275 PolarHBondContact O-N 3Å; E271-K275 WeakPolarHBondContact OE1-CE 3.41Å; E271-K275 IonicContact OE1-NZ 2.92Å; E271-K275 PolarHBondContact OE1-NZ 3.39Å; S272-K275 PolarHBondContact O-N 3.16Å; L273-K275 VanDerWaalsContact C-N 3.32Å; L273-K275 PolarHBondContact O-N 2.8Å; K275-V279 WeakPolarHBondContact O-CG2 3.32Å
276	K	98	Very high	97.2	Very high	49 Å²	49	49.2 Å²	49.2	21%	0.213	26%	0.261	C	S	.	.	H	α-helix	trans	-88	-25.4	177.9	-65	156.9	172.3	-155.3	0	113.1	S272 L273 L274 V279 Y286 D294	S272-K276 VanDerWaalsContact O-CD 3.28Å; S272-K276 WeakPolarHBondContact O-CD 3.25Å; S272-K276 VanDerWaalsContact O-CG 3.27Å; S272-K276 WeakPolarHBondContact O-CG 3.41Å; S272-K276 PolarHBondContact O-N 2.74Å; L273-K276 WeakPolarHBondContact O-CB 3.36Å; L273-K276 PolarHBondContact O-N 3.04Å; L274-K276 PolarHBondContact O-N 2.84Å; K276-V279 WeakPolarHBondContact O-CG2 3.38Å; K276-Y286 HydrophobicContact CB-CD1 3.79Å; K276-Y286 HydrophobicContact CB-CD2 3.94Å; K276-Y286 HydrophobicContact CB-CE1 3.96Å; K276-Y286 HydrophobicContact CB-CE2 4.12Å; K276-Y286 HydrophobicContact CB-CG 3.8Å; K276-Y286 HydrophobicContact CD-CD2 4.15Å; K276-Y286 HydrophobicContact CD-CE1 4.08Å; K276-Y286 HydrophobicContact CD-CE2 3.53Å; K276-Y286 VanDerWaalsContact CD-CZ 3.48Å; K276-Y286 VanDerWaalsContact CE-OH 3.28Å; K276-Y286 WeakPolarHBondContact CE-OH 3.41Å; K276-Y286 HydrophobicContact CG-CD1 4.18Å; K276-Y286 HydrophobicContact CG-CD2 4.42Å; K276-Y286 HydrophobicContact CG-CE1 3.8Å; K276-Y286 HydrophobicContact CG-CE2 4.09Å; K276-Y286 HydrophobicContact CG-CG 4.49Å; K276-Y286 PolarHBondContact NZ-OH 2.94Å; K276-Y286 VanDerWaalsContact NZ-OH 3.08Å; K276-Y286 PolarHBondContact O-N 3.03Å; K276-Y286 VanDerWaalsContact O-N 3.09Å; K276-D294 IonicContact NZ-OD2 3.81Å; K276-D294 PolarHBondContact NZ-OD2 3Å
277	M	98.3	Very high	97.1	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-94.8	-40.6	179.5	-60.7	-177	79.1	0	0	113	F149 V226 L229 L233 L273 L274 V279 R285 V291	F149-M277 HydrophobicContact CE1-CE 4.34Å; F149-M277 HydrophobicContact CE1-SD 4.21Å; F149-M277 HydrophobicContact CZ-CE 3.9Å; F149-M277 HydrophobicContact CZ-SD 4.19Å; V226-M277 HydrophobicContact CG1-CB 4.25Å; V226-M277 HydrophobicContact CG1-CE 3.98Å; V226-M277 HydrophobicContact CG1-CG 4.23Å; V226-M277 WeakPolarHBondContact O-CE 3.22Å; L229-M277 HydrophobicContact CB-CE 3.6Å; L233-M277 HydrophobicContact CD2-SD 4.5Å; L273-M277 HydrophobicContact CD1-CG 4.06Å; L273-M277 HydrophobicContact CD1-SD 3.82Å; L273-M277 HydrophobicContact CG-SD 4.01Å; L273-M277 WeakPolarHBondContact O-CG 3.28Å; L273-M277 PolarHBondContact O-N 3.11Å; L273-M277 VanDerWaalsContact O-N 3.12Å; L274-M277 PolarHBondContact O-N 2.77Å; M277-V279 PolarHBondContact O-N 3Å; M277-R285 WeakPolarHBondContact O-CD 3.38Å; M277-R285 WeakPolarHBondContact O-CG 3.31Å; M277-V291 HydrophobicContact CE-CG1 4.31Å; M277-V291 HydrophobicContact CE-CG2 4.01Å; M277-V291 HydrophobicContact CG-CG2 4Å; M277-V291 HydrophobicContact SD-CG1 4.27Å; M277-V291 HydrophobicContact SD-CG2 4.07Å
278	L	98.1	Very high	97.1	Very high	10 Å²	10	50.3 Å²	50.3	5%	0.052	27%	0.267	C	S	.	.	S	Bend	trans	-86.8	42.4	-178.6	-63.3	179.1	0	0	0	112.7	W227 V231 P242 F243 Y260 L274	W227-L278 HydrophobicContact CD2-CD2 4.01Å; W227-L278 HydrophobicContact CE3-CD2 4.21Å; W227-L278 HydrophobicContact CG-CD2 4.44Å; W227-L278 HydrophobicContact CZ2-CD2 4.41Å; W227-L278 VanDerWaalsContact CZ3-C 3.42Å; W227-L278 HydrophobicContact CZ3-CB 4.28Å; W227-L278 WeakPolarHBondContact CZ3-O 3.43Å; V231-L278 HydrophobicContact CG2-CD2 3.97Å; P242-L278 HydrophobicContact CB-CD1 4.48Å; F243-L278 HydrophobicContact CE2-CD1 4.44Å; F243-L278 HydrophobicContact CE2-CD2 4.3Å; F243-L278 HydrophobicContact CZ-CD1 4.36Å; Y260-L278 HydrophobicContact CD1-CD1 3.99Å; Y260-L278 HydrophobicContact CE1-CB 4Å; Y260-L278 HydrophobicContact CE1-CD1 3.76Å; Y260-L278 HydrophobicContact CE2-CD1 4.36Å; Y260-L278 HydrophobicContact CG-CD1 4.42Å; L274-L278 HydrophobicContact CD2-CD1 4.24Å; L274-L278 WeakPolarHBondContact O-CB 3.19Å; L274-L278 PolarHBondContact O-N 2.98Å
279	V	97.6	Very high	97	Very high	31 Å²	31	50.2 Å²	50.2	19%	0.188	26%	0.259	C	S	.	.			trans	-85.4	126.1	-179	-175.1	0	0	0	0	110.7	K275 K276 M277 N281 K284 R285	K275-V279 WeakPolarHBondContact O-CG2 3.32Å; K276-V279 WeakPolarHBondContact O-CG2 3.38Å; M277-V279 PolarHBondContact O-N 3Å; V279-N281 VanDerWaalsContact C-N 3.26Å; V279-N281 WeakPolarHBondContact CG1-O 3.35Å; V279-N281 PolarHBondContact O-N 2.61Å; V279-K284 HydrophobicContact CG1-CB 3.87Å; V279-R285 HydrophobicContact CB-CB 4.25Å; V279-R285 HydrophobicContact CB-CG 4.33Å; V279-R285 PolarHBondContact O-NE 2.86Å; V279-R285 PolarHBondContact O-NH2 3.07Å
280	L	96.3	Very high	96.9	Very high	74 Å²	74	53.1 Å²	53.1	39%	0.387	27%	0.273	S	S	.	.	S	Bend	trans	-64.8	-23	-178.4	-70.8	178.8	0	0	0	114.7	P211 W227 V255	P211-L280 HydrophobicContact CB-CD2 4.02Å; P211-L280 HydrophobicContact CG-CD2 3.87Å; W227-L280 HydrophobicContact CH2-CD2 4.05Å; W227-L280 HydrophobicContact CZ3-CD2 4.23Å; V255-L280 WeakPolarHBondContact O-CD2 3.38Å
281	N	94.3	Very high	96.9	Very high	72 Å²	72	53.1 Å²	53.1	39%	0.385	27%	0.273	S	S	.	.	S	Bend	trans	-101.3	114.1	173	-179.6	-8.9	0	0	0	108.6	V279 S283 K284 R285	V279-N281 VanDerWaalsContact C-N 3.26Å; V279-N281 WeakPolarHBondContact CG1-O 3.35Å; V279-N281 PolarHBondContact O-N 2.61Å; N281-S283 VanDerWaalsContact C-N 3.26Å; N281-S283 PolarHBondContact O-N 2.79Å; N281-S283 PolarHBondContact OD1-N 3.21Å; N281-S283 VanDerWaalsContact OD1-N 3.09Å; N281-K284 HydrophobicContact CB-CB 4.37Å; N281-K284 HydrophobicContact CB-CG 4.49Å; N281-K284 PolarHBondContact O-N 3.43Å; N281-R285 PolarHBondContact O-N 2.82Å
282	P	94.4	Very high	96.9	Very high	36 Å²	36	51 Å²	51	23%	0.234	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-57.6	-37.7	-178.8	21.2	-31.7	0	0	0	112.4	E223 K284 R285	E223-P282 HydrophobicContact CB-CB 3.84Å; E223-P282 HydrophobicContact CG-CB 4.04Å; P282-K284 PolarHBondContact O-N 3.04Å; P282-R285 WeakPolarHBondContact O-CB 3.3Å; P282-R285 PolarHBondContact O-N 3.35Å
283	S	92.6	Very high	96.8	Very high	108 Å²	108	55.6 Å²	55.6	76%	0.755	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-68.8	-2	178.1	-40.3	0	0	0	0	114.6	N281	N281-S283 VanDerWaalsContact C-N 3.26Å; N281-S283 PolarHBondContact O-N 2.79Å; N281-S283 PolarHBondContact OD1-N 3.21Å; N281-S283 VanDerWaalsContact OD1-N 3.09Å
284	K	95.8	Very high	96.8	Very high	158 Å²	158	56 Å²	56	69%	0.687	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-119	3.8	172	-67.2	-168	174.3	-168.2	0	112.7	V279 N281 P282	V279-K284 HydrophobicContact CG1-CB 3.87Å; N281-K284 HydrophobicContact CB-CB 4.37Å; N281-K284 HydrophobicContact CB-CG 4.49Å; N281-K284 PolarHBondContact O-N 3.43Å; P282-K284 PolarHBondContact O-N 3.04Å
285	R	97.3	Very high	96.8	Very high	17 Å²	17	64 Å²	64	6%	0.064	31%	0.31	C	S	.	.	S	Bend	trans	-78.9	146.4	174.9	-156	173.4	-65.2	146.9	4.4	108.4	E212 E223 V226 M277 V279 N281 P282	E212-R285 IonicContact OE1-CZ 2.78Å; E212-R285 IonicContact OE1-NH1 3.65Å; E212-R285 PolarHBondContact OE1-NH1 3.21Å; E212-R285 IonicContact OE1-NH2 2.86Å; E212-R285 PolarHBondContact OE1-NH2 2.68Å; E212-R285 IonicContact OE2-CZ 2.91Å; E212-R285 IonicContact OE2-NH1 3.47Å; E212-R285 IonicContact OE2-NH2 3.24Å; E212-R285 PolarHBondContact OE2-NH2 2.69Å; E223-R285 VanDerWaalsContact C-NH1 3.29Å; E223-R285 WeakPolarHBondContact O-CD 3.35Å; E223-R285 PolarHBondContact O-NH1 2.91Å; V226-R285 HydrophobicContact CB-CG 4.41Å; V226-R285 HydrophobicContact CG1-CG 3.88Å; M277-R285 WeakPolarHBondContact O-CD 3.38Å; M277-R285 WeakPolarHBondContact O-CG 3.31Å; V279-R285 HydrophobicContact CB-CB 4.25Å; V279-R285 HydrophobicContact CB-CG 4.33Å; V279-R285 PolarHBondContact O-NE 2.86Å; V279-R285 PolarHBondContact O-NH2 3.07Å; N281-R285 PolarHBondContact O-N 2.82Å; P282-R285 WeakPolarHBondContact O-CB 3.3Å; P282-R285 PolarHBondContact O-N 3.35Å
286	Y	96.7	Very high	96.8	Very high	71 Å²	71	58.4 Å²	58.4	28%	0.278	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-62.1	147.2	174.6	-92.8	26	0	0	0	111.5	V226 K276 M290 V291	V226-Y286 WeakPolarHBondContact CG1-O 3.4Å; K276-Y286 HydrophobicContact CB-CD1 3.79Å; K276-Y286 HydrophobicContact CB-CD2 3.94Å; K276-Y286 HydrophobicContact CB-CE1 3.96Å; K276-Y286 HydrophobicContact CB-CE2 4.12Å; K276-Y286 HydrophobicContact CB-CG 3.8Å; K276-Y286 HydrophobicContact CD-CD2 4.15Å; K276-Y286 HydrophobicContact CD-CE1 4.08Å; K276-Y286 HydrophobicContact CD-CE2 3.53Å; K276-Y286 VanDerWaalsContact CD-CZ 3.48Å; K276-Y286 VanDerWaalsContact CE-OH 3.28Å; K276-Y286 WeakPolarHBondContact CE-OH 3.41Å; K276-Y286 HydrophobicContact CG-CD1 4.18Å; K276-Y286 HydrophobicContact CG-CD2 4.42Å; K276-Y286 HydrophobicContact CG-CE1 3.8Å; K276-Y286 HydrophobicContact CG-CE2 4.09Å; K276-Y286 HydrophobicContact CG-CG 4.49Å; K276-Y286 PolarHBondContact NZ-OH 2.94Å; K276-Y286 VanDerWaalsContact NZ-OH 3.08Å; K276-Y286 PolarHBondContact O-N 3.03Å; K276-Y286 VanDerWaalsContact O-N 3.09Å; Y286-M290 HydrophobicContact CD1-CB 4.38Å; Y286-M290 HydrophobicContact CD1-SD 4.19Å; Y286-M290 HydrophobicContact CD2-CB 3.41Å; Y286-M290 VanDerWaalsContact CD2-CB 3.41Å; Y286-M290 HydrophobicContact CE2-CB 3.83Å; Y286-M290 HydrophobicContact CG-CB 3.7Å; Y286-M290 HydrophobicContact CG-SD 4.31Å; Y286-V291 HydrophobicContact CD2-CG2 4.31Å
287	T	96.2	Very high	96.8	Very high	69 Å²	69	56 Å²	56	42%	0.423	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-76.9	163.1	161.3	66.5	0	0	0	0	109.8	E289 M290 V291	T287-E289 VanDerWaalsContact C-N 3.25Å; T287-E289 PolarHBondContact O-N 3.05Å; T287-M290 WeakPolarHBondContact O-CB 3.37Å; T287-M290 PolarHBondContact O-N 2.85Å; T287-M290 WeakPolarHBondContact OG1-CG 3.31Å; T287-M290 PolarHBondContact OG1-N 3.01Å; T287-V291 PolarHBondContact O-N 3.01Å
288	L	97.1	Very high	96.8	Very high	8 Å²	8	56.8 Å²	56.8	4%	0.042	28%	0.279	C	S	.	.	H	α-helix	trans	-63.6	-30.6	177.6	-69	-176.9	0	0	0	113.1	V156 Q157 V226 L229 M290 V291 M292	V156-L288 HydrophobicContact CB-CD1 4.05Å; V156-L288 HydrophobicContact CG1-CD1 3.77Å; Q157-L288 HydrophobicContact CB-CB 3.99Å; Q157-L288 HydrophobicContact CB-CD1 3.95Å; Q157-L288 HydrophobicContact CG-CB 4.16Å; V226-L288 HydrophobicContact CG2-CD2 3.78Å; V226-L288 HydrophobicContact CG2-CG 3.95Å; L229-L288 HydrophobicContact CD1-CD1 4.32Å; L229-L288 HydrophobicContact CD1-CD2 3.7Å; L288-M290 VanDerWaalsContact C-N 3.3Å; L288-M290 PolarHBondContact O-N 3.42Å; L288-V291 HydrophobicContact CD2-CG2 4.48Å; L288-V291 WeakPolarHBondContact O-CB 3.47Å; L288-V291 PolarHBondContact O-N 3.4Å; L288-M292 WeakPolarHBondContact O-CB 3.31Å; L288-M292 VanDerWaalsContact O-CG 3.25Å; L288-M292 WeakPolarHBondContact O-CG 3.47Å; L288-M292 PolarHBondContact O-N 3.3Å
289	E	95.9	Very high	96.7	Very high	103 Å²	103	58.6 Å²	58.6	48%	0.481	29%	0.29	S	S	.	.	H	α-helix	trans	-62	-35.3	170.8	-65	177.9	-146.2	0	0	113.3	T287 K293	T287-E289 VanDerWaalsContact C-N 3.25Å; T287-E289 PolarHBondContact O-N 3.05Å; E289-K293 WeakPolarHBondContact O-CD 3.4Å; E289-K293 VanDerWaalsContact O-CG 3.31Å; E289-K293 WeakPolarHBondContact O-CG 3.28Å; E289-K293 PolarHBondContact O-N 2.71Å
290	M	97.2	Very high	96.6	Very high	98 Å²	98	59.7 Å²	59.7	48%	0.483	31%	0.308	S	S	.	.	H	α-helix	trans	-74.1	-33.5	175	-64.1	175.7	-176.4	0	0	111.5	Y286 T287 L288 D294	Y286-M290 HydrophobicContact CD1-CB 4.38Å; Y286-M290 HydrophobicContact CD1-SD 4.19Å; Y286-M290 HydrophobicContact CD2-CB 3.41Å; Y286-M290 VanDerWaalsContact CD2-CB 3.41Å; Y286-M290 HydrophobicContact CE2-CB 3.83Å; Y286-M290 HydrophobicContact CG-CB 3.7Å; Y286-M290 HydrophobicContact CG-SD 4.31Å; T287-M290 WeakPolarHBondContact O-CB 3.37Å; T287-M290 PolarHBondContact O-N 2.85Å; T287-M290 WeakPolarHBondContact OG1-CG 3.31Å; T287-M290 PolarHBondContact OG1-N 3.01Å; L288-M290 VanDerWaalsContact C-N 3.3Å; L288-M290 PolarHBondContact O-N 3.42Å; M290-D294 PolarHBondContact O-N 3.37Å
291	V	98.2	Very high	96.6	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-65.6	-49.2	172.1	171.2	0	0	0	0	110.5	V153 L273 M277 Y286 T287 L288 K293 D294 M297	V153-V291 HydrophobicContact CG1-CG1 4.22Å; V153-V291 HydrophobicContact CG2-CG1 4.05Å; L273-V291 HydrophobicContact CD1-CG1 4.22Å; L273-V291 HydrophobicContact CD1-CG2 4.39Å; M277-V291 HydrophobicContact CE-CG1 4.31Å; M277-V291 HydrophobicContact CE-CG2 4.01Å; M277-V291 HydrophobicContact CG-CG2 4Å; M277-V291 HydrophobicContact SD-CG1 4.27Å; M277-V291 HydrophobicContact SD-CG2 4.07Å; Y286-V291 HydrophobicContact CD2-CG2 4.31Å; T287-V291 PolarHBondContact O-N 3.01Å; L288-V291 HydrophobicContact CD2-CG2 4.48Å; L288-V291 WeakPolarHBondContact O-CB 3.47Å; L288-V291 PolarHBondContact O-N 3.4Å; V291-K293 PolarHBondContact O-N 3.43Å; V291-K293 VanDerWaalsContact O-N 3.16Å; V291-D294 VanDerWaalsContact O-CB 3.22Å; V291-D294 WeakPolarHBondContact O-CB 3.36Å; V291-D294 PolarHBondContact O-N 3.35Å; V291-M297 HydrophobicContact CG1-CE 4.48Å; V291-M297 HydrophobicContact CG1-CG 4.26Å; V291-M297 WeakPolarHBondContact O-CG 3.48Å
292	M	98	Very high	96.5	Very high	2 Å²	2	61.9 Å²	61.9	1%	0.01	31%	0.312	C	S	.	.	H	α-helix	trans	-53.4	-36.5	178.7	-76.1	175.3	142.8	0	0	112.7	V153 Q157 L288 N298 L306 S307 P308	V153-M292 HydrophobicContact CG1-CE 4.4Å; V153-M292 HydrophobicContact CG1-CG 3.61Å; Q157-M292 HydrophobicContact CB-CE 3.74Å; Q157-M292 HydrophobicContact CB-SD 4.26Å; Q157-M292 HydrophobicContact CG-CE 3.81Å; Q157-M292 HydrophobicContact CG-SD 3.83Å; L288-M292 WeakPolarHBondContact O-CB 3.31Å; L288-M292 VanDerWaalsContact O-CG 3.25Å; L288-M292 WeakPolarHBondContact O-CG 3.47Å; L288-M292 PolarHBondContact O-N 3.3Å; M292-N298 PolarHBondContact O-ND2 3.27Å; M292-L306 HydrophobicContact CB-CB 4.43Å; M292-L306 HydrophobicContact CB-CD2 4.34Å; M292-L306 HydrophobicContact CB-CG 4.23Å; M292-L306 HydrophobicContact CE-CD1 4.44Å; M292-L306 HydrophobicContact CE-CD2 4.39Å; M292-L306 HydrophobicContact CE-CG 4.08Å; M292-L306 HydrophobicContact CG-CD2 3.83Å; M292-L306 HydrophobicContact CG-CG 3.9Å; M292-S307 WeakPolarHBondContact CE-O 3.29Å; M292-P308 HydrophobicContact SD-CG 4.39Å
293	K	96.8	Very high	96.3	Very high	142 Å²	142	68.5 Å²	68.5	62%	0.617	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	1.4	179.3	-64.1	166.8	-167.6	168.3	0	114	E289 V291	E289-K293 WeakPolarHBondContact O-CD 3.4Å; E289-K293 VanDerWaalsContact O-CG 3.31Å; E289-K293 WeakPolarHBondContact O-CG 3.28Å; E289-K293 PolarHBondContact O-N 2.71Å; V291-K293 PolarHBondContact O-N 3.43Å; V291-K293 VanDerWaalsContact O-N 3.16Å
294	D	98	Very high	96.4	Very high	9 Å²	9	68.4 Å²	68.4	5%	0.048	34%	0.336	C	S	.	.			trans	-70.7	148.4	-177.6	-169.3	-89	0	0	0	112.7	L273 K276 M290 V291 W296 M297 N298	L273-D294 HydrophobicContact CD1-CB 4.05Å; K276-D294 IonicContact NZ-OD2 3.81Å; K276-D294 PolarHBondContact NZ-OD2 3Å; M290-D294 PolarHBondContact O-N 3.37Å; V291-D294 VanDerWaalsContact O-CB 3.22Å; V291-D294 WeakPolarHBondContact O-CB 3.36Å; V291-D294 PolarHBondContact O-N 3.35Å; D294-W296 VanDerWaalsContact C-N 3.32Å; D294-W296 PolarHBondContact O-N 3.09Å; D294-W296 PolarHBondContact OD1-N 2.77Å; D294-M297 HydrophobicContact CB-CG 4.28Å; D294-M297 PolarHBondContact O-N 2.97Å; D294-M297 VanDerWaalsContact O-N 3.09Å; D294-N298 PolarHBondContact O-N 2.94Å; D294-N298 PolarHBondContact O-ND2 3.44Å
295	R	97.5	Very high	96.4	Very high	168 Å²	168	64.5 Å²	64.5	63%	0.634	33%	0.325	S	S	*	.	H	α-helix	trans	-57.1	-42.2	178.7	-173.1	173.2	-175.1	-124.1	3.4	112.2	D269 M297 N298 T299	D269-R295 WeakPolarHBondContact OD1-CD 3.19Å; D269-R295 IonicContact OD1-CZ 3.29Å; D269-R295 IonicContact OD1-NE 3.38Å; D269-R295 IonicContact OD1-NH1 3.85Å; D269-R295 PolarHBondContact OD1-NH1 3.35Å; D269-R295 IonicContact OD2-CZ 2.83Å; D269-R295 IonicContact OD2-NH1 2.8Å; D269-R295 PolarHBondContact OD2-NH1 2.88Å; R295-M297 VanDerWaalsContact C-N 3.29Å; R295-M297 PolarHBondContact O-N 2.86Å; R295-N298 PolarHBondContact O-N 3.45Å; R295-T299 PolarHBondContact O-N 3.15Å; R295-T299 VanDerWaalsContact O-N 3.09Å; R295-T299 PolarHBondContact O-OG1 3.16Å
296	W	98.3	Very high	96.3	Very high	1 Å²	1	64.6 Å²	64.6	0%	0.004	33%	0.327	C	S	.	.	H	α-helix	trans	-68	-29.1	178.8	-170.3	86.9	0	0	0	112.4	E142 A145 R146 F149 L233 V237 D269 C270 L273 D294 N298	E142-W296 HydrophobicContact CB-CZ2 3.97Å; E142-W296 HydrophobicContact CG-CZ2 4.22Å; E142-W296 PolarHBondContact OE2-NE1 3.08Å; A145-W296 HydrophobicContact CB-CH2 4.31Å; R146-W296 HydrophobicContact CB-CH2 3.79Å; R146-W296 HydrophobicContact CB-CZ2 4.18Å; R146-W296 HydrophobicContact CB-CZ3 4.04Å; R146-W296 WeakPolarHBondContact CD-O 3.21Å; R146-W296 HydrophobicContact CG-CZ3 4.41Å; R146-W296 PolarHBondContact NE-O 2.89Å; F149-W296 HydrophobicContact CB-CZ3 4.46Å; F149-W296 HydrophobicContact CD1-CZ3 4.17Å; L233-W296 HydrophobicContact CD1-CE3 4.44Å; L233-W296 HydrophobicContact CD1-CH2 3.48Å; L233-W296 VanDerWaalsContact CD1-CH2 3.48Å; L233-W296 HydrophobicContact CD1-CZ2 4.23Å; L233-W296 HydrophobicContact CD1-CZ3 3.62Å; V237-W296 HydrophobicContact CG1-CZ2 4.36Å; D269-W296 HydrophobicContact CB-CB 4.06Å; D269-W296 HydrophobicContact CB-CG 4.46Å; C270-W296 HydrophobicContact CB-CG 4.33Å; C270-W296 VanDerWaalsContact N-CD1 3.35Å; L273-W296 HydrophobicContact CB-CB 4.34Å; L273-W296 HydrophobicContact CD2-CB 4.16Å; L273-W296 HydrophobicContact CD2-CD2 4.28Å; L273-W296 HydrophobicContact CD2-CE3 3.63Å; L273-W296 HydrophobicContact CD2-CZ3 4.42Å; D294-W296 VanDerWaalsContact C-N 3.32Å; D294-W296 PolarHBondContact O-N 3.09Å; D294-W296 PolarHBondContact OD1-N 2.77Å; W296-N298 VanDerWaalsContact C-N 3.35Å
297	M	98	Very high	96.3	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-72.5	-27.9	178.8	-70.2	-62.2	-77.3	0	0	113.3	F149 R150 V153 L273 V291 D294 R295 L306	F149-M297 HydrophobicContact CD1-CE 3.97Å; F149-M297 HydrophobicContact CD1-SD 3.57Å; F149-M297 VanDerWaalsContact CD1-SD 3.57Å; F149-M297 HydrophobicContact CE1-SD 4.11Å; R150-M297 HydrophobicContact CB-CE 4.44Å; R150-M297 WeakPolarHBondContact CD-O 3.43Å; R150-M297 HydrophobicContact CG-CE 3.92Å; R150-M297 PolarHBondContact NH1-O 3.11Å; V153-M297 HydrophobicContact CB-CE 3.93Å; V153-M297 HydrophobicContact CG1-CE 4.25Å; V153-M297 HydrophobicContact CG2-CE 3.82Å; L273-M297 HydrophobicContact CD2-CG 3.99Å; L273-M297 HydrophobicContact CD2-SD 4.04Å; V291-M297 HydrophobicContact CG1-CE 4.48Å; V291-M297 HydrophobicContact CG1-CG 4.26Å; V291-M297 WeakPolarHBondContact O-CG 3.48Å; D294-M297 HydrophobicContact CB-CG 4.28Å; D294-M297 PolarHBondContact O-N 2.97Å; D294-M297 VanDerWaalsContact O-N 3.09Å; R295-M297 VanDerWaalsContact C-N 3.29Å; R295-M297 PolarHBondContact O-N 2.86Å; M297-L306 HydrophobicContact CE-CD2 3.79Å
298	N	97.9	Very high	96.3	Very high	15 Å²	15	64.1 Å²	64.1	8%	0.08	34%	0.336	C	S	.	.	H	α-helix	trans	-113.8	1.4	-171.5	-58.5	-68.2	0	0	0	114.5	R150 M292 D294 R295 W296 G300 Y301 E302 V305 L306	R150-N298 PolarHBondContact NH1-OD1 2.78Å; M292-N298 PolarHBondContact O-ND2 3.27Å; D294-N298 PolarHBondContact O-N 2.94Å; D294-N298 PolarHBondContact O-ND2 3.44Å; R295-N298 PolarHBondContact O-N 3.45Å; W296-N298 VanDerWaalsContact C-N 3.35Å; N298-G300 PolarHBondContact O-N 2.88Å; N298-Y301 CarbonylContact O-C 3.49Å; N298-Y301 WeakPolarHBondContact O-CA 3.46Å; N298-Y301 PolarHBondContact O-N 3.41Å; N298-E302 PolarHBondContact O-N 3.35Å; N298-V305 WeakPolarHBondContact OD1-CA 3.36Å; N298-L306 PolarHBondContact OD1-N 2.96Å
299	T	96.9	Very high	96.3	Very high	48 Å²	48	66.3 Å²	66.3	29%	0.294	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	115.5	173	-59.7	0	0	0	0	110.4	R146 R295 E302	R146-T299 WeakPolarHBondContact CD-O 3.42Å; R146-T299 PolarHBondContact NE-O 2.99Å; R146-T299 PolarHBondContact NH1-O 2.89Å; R295-T299 PolarHBondContact O-N 3.15Å; R295-T299 VanDerWaalsContact O-N 3.09Å; R295-T299 PolarHBondContact O-OG1 3.16Å; T299-E302 WeakPolarHBondContact CA-OE1 3.38Å
300	G	95.8	Very high	96.3	Very high	55 Å²	55	68.3 Å²	68.3	57%	0.567	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.9	19.6	-171.7	0	0	0	0	0	114.3	N298 E302	N298-G300 PolarHBondContact O-N 2.88Å; G300-E302 VanDerWaalsContact C-OE2 3.24Å; G300-E302 WeakPolarHBondContact CA-OE2 3.32Å; G300-E302 VanDerWaalsContact N-CD 3.29Å; G300-E302 PolarHBondContact N-OE1 2.69Å; G300-E302 PolarHBondContact N-OE2 3.36Å
301	Y	95.8	Very high	96	Very high	73 Å²	73	66.6 Å²	66.6	29%	0.286	35%	0.347	S	S	.	.			trans	-143.9	33.6	176.1	-67.1	-84.7	0	0	0	110.4	R146 N298 D303 N304 V305	R146-Y301 HydrophobicContact CG-CD2 4.39Å; R146-Y301 HydrophobicContact CG-CE2 4.08Å; N298-Y301 CarbonylContact O-C 3.49Å; N298-Y301 WeakPolarHBondContact O-CA 3.46Å; N298-Y301 PolarHBondContact O-N 3.41Å; Y301-D303 VanDerWaalsContact C-N 3.34Å; Y301-D303 PolarHBondContact O-N 3.02Å; Y301-N304 CarbonylContact O-C 3.36Å; Y301-N304 PolarHBondContact O-N 3.11Å; Y301-N304 VanDerWaalsContact O-O 3.1Å; Y301-V305 PolarHBondContact O-N 3.12Å
302	E	91.7	Very high	95.7	Very high	119 Å²	119	70.5 Å²	70.5	56%	0.556	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-39.5	-173.5	-70	71.6	-164.1	0	0	112.1	N298 T299 G300 N304	N298-E302 PolarHBondContact O-N 3.35Å; T299-E302 WeakPolarHBondContact CA-OE1 3.38Å; G300-E302 VanDerWaalsContact C-OE2 3.24Å; G300-E302 WeakPolarHBondContact CA-OE2 3.32Å; G300-E302 VanDerWaalsContact N-CD 3.29Å; G300-E302 PolarHBondContact N-OE1 2.69Å; G300-E302 PolarHBondContact N-OE2 3.36Å; E302-N304 VanDerWaalsContact C-N 3.26Å; E302-N304 PolarHBondContact O-N 2.82Å
303	D	91.6	Very high	95.2	Very high	174 Å²	174	78.8 Å²	78.8	93%	0.93	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-4.5	175.3	-50	-60.6	0	0	0	113.7	Y301	Y301-D303 VanDerWaalsContact C-N 3.34Å; Y301-D303 PolarHBondContact O-N 3.02Å
304	N	93.5	Very high	94.6	Very high	107 Å²	107	75.1 Å²	75.1	57%	0.572	40%	0.401	S	S	*	.	S	Bend	trans	-141.7	62.3	-176.4	-169.6	-36.1	0	0	0	109.1	R150 Y301 E302 L306	R150-N304 PolarHBondContact NH2-O 2.89Å; Y301-N304 CarbonylContact O-C 3.36Å; Y301-N304 PolarHBondContact O-N 3.11Å; Y301-N304 VanDerWaalsContact O-O 3.1Å; E302-N304 VanDerWaalsContact C-N 3.26Å; E302-N304 PolarHBondContact O-N 2.82Å; N304-L306 PolarHBondContact O-N 3.29Å
305	V	95	Very high	93.9	Very high	75 Å²	75	78.8 Å²	78.8	46%	0.455	42%	0.421	S	S	.	.			trans	-61.4	132.5	176.7	177.9	0	0	0	0	109.4	N298 Y301 S307	N298-V305 WeakPolarHBondContact OD1-CA 3.36Å; Y301-V305 PolarHBondContact O-N 3.12Å; V305-S307 PolarHBondContact O-N 3.24Å
306	L	96.4	Very high	93.4	Very high	20 Å²	20	74.4 Å²	74.4	11%	0.105	41%	0.405	C	S	.	.			trans	-64.7	123.5	-178.6	-176	61.6	0	0	0	110.3	R150 V153 M292 M297 N298 N304	R150-L306 HydrophobicContact CB-CD2 4.16Å; R150-L306 HydrophobicContact CG-CD2 4.2Å; V153-L306 HydrophobicContact CB-CD2 4.34Å; V153-L306 HydrophobicContact CG1-CD2 4.07Å; M292-L306 HydrophobicContact CB-CB 4.43Å; M292-L306 HydrophobicContact CB-CD2 4.34Å; M292-L306 HydrophobicContact CB-CG 4.23Å; M292-L306 HydrophobicContact CE-CD1 4.44Å; M292-L306 HydrophobicContact CE-CD2 4.39Å; M292-L306 HydrophobicContact CE-CG 4.08Å; M292-L306 HydrophobicContact CG-CD2 3.83Å; M292-L306 HydrophobicContact CG-CG 3.9Å; M297-L306 HydrophobicContact CE-CD2 3.79Å; N298-L306 PolarHBondContact OD1-N 2.96Å; N304-L306 PolarHBondContact O-N 3.29Å
307	S	95.7	Very high	92.8	Very high	77 Å²	77	79.6 Å²	79.6	54%	0.538	44%	0.437	S	S	.	.			trans	-123	163.4	179.6	51.2	0	0	0	0	111	M292 V305	M292-S307 WeakPolarHBondContact CE-O 3.29Å; V305-S307 PolarHBondContact O-N 3.24Å
308	P	96.7	Very high	92.5	Very high	53 Å²	53	81.1 Å²	81.1	34%	0.344	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-51.2	136.5	171.7	-31.8	39.2	0	0	0	113.2	Q157 M292 I310	Q157-P308 VanDerWaalsContact OE1-CA 3.32Å; M292-P308 HydrophobicContact SD-CG 4.39Å; P308-I310 PolarHBondContact O-N 3.24Å
309	Y	97.1	Very high	92.1	Very high	53 Å²	53	84.7 Å²	84.7	21%	0.208	47%	0.469	C	S	.	.	P	Polyproline II helix	trans	-72.7	126.2	178.3	-179.1	-102.4	0	0	0	110.6	H102 P103 Y158 E311 P312	H102-Y309 HydrophobicContact CB-CE1 4.39Å; H102-Y309 AromaticContact CD2-CD1 3.43Å; H102-Y309 VanDerWaalsContact CD2-CD1 3.43Å; H102-Y309 WeakPolarHBondContact CD2-CD1 3.38Å; H102-Y309 AromaticContact CD2-CD2 4Å; H102-Y309 AromaticContact CD2-CE1 3.9Å; H102-Y309 AromaticContact CD2-CG 3.46Å; H102-Y309 VanDerWaalsContact CD2-CG 3.46Å; H102-Y309 AromaticContact NE2-CG 3.85Å; P103-Y309 HydrophobicContact CG-CE2 4.14Å; Y158-Y309 AromaticContact CD2-CD1 3.69Å; Y158-Y309 HydrophobicContact CD2-CD1 3.69Å; Y158-Y309 HydrophobicContact CD2-CE1 4.47Å; Y158-Y309 HydrophobicContact CE2-CD1 4.02Å; Y158-Y309 HydrophobicContact CE2-CE1 4.4Å; Y158-Y309 HydrophobicContact CG-CD1 4.3Å; Y309-E311 HydrophobicContact CE1-CB 4.18Å; Y309-P312 WeakPolarHBondContact OH-CD 3.42Å
310	I	95.4	Very high	91.9	Very high	146 Å²	146	87 Å²	87	75%	0.749	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-98.2	120.3	169.9	-56.6	177.8	0	0	0	106.9	P308	P308-I310 PolarHBondContact O-N 3.24Å
311	E	92	Very high	91.7	Very high	62 Å²	62	86.4 Å²	86.4	29%	0.29	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-70.5	130	177.1	-172.3	168.5	154.4	0	0	109.6	Y158 K162 Y309	Y158-E311 HydrophobicContact CE2-CB 4.35Å; Y158-E311 WeakPolarHBondContact CE2-OE2 3.43Å; Y158-E311 VanDerWaalsContact CZ-OE2 3.24Å; Y158-E311 VanDerWaalsContact OH-CD 3.27Å; Y158-E311 PolarHBondContact OH-OE2 3.32Å; K162-E311 WeakPolarHBondContact CE-OE2 3.47Å; K162-E311 IonicContact NZ-OE1 3.41Å; K162-E311 PolarHBondContact NZ-OE1 2.77Å; K162-E311 IonicContact NZ-OE2 2.98Å; K162-E311 PolarHBondContact NZ-OE2 3.06Å; Y309-E311 HydrophobicContact CE1-CB 4.18Å
312	P	90.8	Very high	91.6	Very high	82 Å²	82	83.4 Å²	83.4	53%	0.532	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-71.1	146.7	174.8	30.6	-34.3	0	0	0	110.3	Y309	Y309-P312 WeakPolarHBondContact OH-CD 3.42Å
313	E	87.7	Confident	91.6	Very high	176 Å²	176	81.7 Å²	81.7	82%	0.822	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-57.1	129.8	170.8	-66.4	-61.7	153.5	0	0	110.1	D315	E313-D315 PolarHBondContact O-N 3Å
314	P	83.8	Confident	91.7	Very high	64 Å²	64	76.6 Å²	76.6	42%	0.416	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-65.3	116.6	-177.3	-24.6	35	0	0	0	113.2	Y316	P314-Y316 HydrophobicContact CB-CD2 3.99Å; P314-Y316 HydrophobicContact CB-CE1 4.25Å; P314-Y316 HydrophobicContact CB-CE2 3.48Å; P314-Y316 VanDerWaalsContact CB-CE2 3.48Å; P314-Y316 HydrophobicContact CG-CE2 4.3Å; P314-Y316 PolarHBondContact O-N 2.86Å; P314-Y316 VanDerWaalsContact O-N 3.12Å
315	D	84.7	Confident	91.7	Very high	86 Å²	86	71.5 Å²	71.5	46%	0.46	39%	0.389	S	S	.	.			trans	-77.6	96.7	170	-174.7	4.7	0	0	0	110.6	E313 T317 D318 Y351	E313-D315 PolarHBondContact O-N 3Å; D315-T317 WeakPolarHBondContact OD1-CA 3.19Å; D315-T317 PolarHBondContact OD1-N 3.03Å; D315-T317 PolarHBondContact OD1-OG1 3.29Å; D315-D318 PolarHBondContact OD1-N 3.49Å; D315-D318 VanDerWaalsContact OD1-N 3.11Å; D315-Y351 WeakPolarHBondContact O-CE1 3.15Å; D315-Y351 PolarHBondContact O-OH 3.35Å
316	Y	86.3	Confident	91.7	Very high	77 Å²	77	70.4 Å²	70.4	30%	0.302	38%	0.382	S	S	.	.			trans	-99.1	16.4	169.1	-63.6	-45.7	0	0	0	112.8	P314 L339 M348 Y351	P314-Y316 HydrophobicContact CB-CD2 3.99Å; P314-Y316 HydrophobicContact CB-CE1 4.25Å; P314-Y316 HydrophobicContact CB-CE2 3.48Å; P314-Y316 VanDerWaalsContact CB-CE2 3.48Å; P314-Y316 HydrophobicContact CG-CE2 4.3Å; P314-Y316 PolarHBondContact O-N 2.86Å; P314-Y316 VanDerWaalsContact O-N 3.12Å; Y316-L339 HydrophobicContact CD1-CB 4.06Å; Y316-L339 HydrophobicContact CD1-CD1 4.41Å; Y316-L339 HydrophobicContact CD1-CD2 4Å; Y316-L339 HydrophobicContact CD1-CG 4.37Å; Y316-L339 HydrophobicContact CE1-CD2 4.44Å; Y316-L339 HydrophobicContact CG-CB 3.94Å; Y316-M348 HydrophobicContact CE1-CE 4.3Å; Y316-Y351 WeakPolarHBondContact CA-OH 3.47Å; Y316-Y351 HydrophobicContact CD1-CD1 4.42Å; Y316-Y351 AromaticContact CD1-CE1 3.98Å; Y316-Y351 HydrophobicContact CD1-CE1 3.98Å
317	T	86.9	Confident	91.5	Very high	110 Å²	110	75.5 Å²	75.5	68%	0.675	41%	0.41	S	S	*	.			trans	-119.6	0.7	-171.4	52.7	0	0	0	0	114.2	D315 P319 Y351	D315-T317 WeakPolarHBondContact OD1-CA 3.19Å; D315-T317 PolarHBondContact OD1-N 3.03Å; D315-T317 PolarHBondContact OD1-OG1 3.29Å; T317-P319 WeakPolarHBondContact O-CD 3.36Å; T317-Y351 PolarHBondContact N-OH 2.85Å
318	D	90.3	Very high	91.2	Very high	31 Å²	31	75.6 Å²	75.6	17%	0.166	40%	0.403	C	S	.	.			trans	-54.2	106.9	-179.7	-177.5	-26.6	0	0	0	110.6	D315 V320 R321 I322 Y351	D315-D318 PolarHBondContact OD1-N 3.49Å; D315-D318 VanDerWaalsContact OD1-N 3.11Å; D318-V320 PolarHBondContact O-N 3.23Å; D318-V320 WeakPolarHBondContact OD1-CA 3.23Å; D318-V320 VanDerWaalsContact OD1-CB 3.3Å; D318-V320 WeakPolarHBondContact OD1-CB 3.13Å; D318-V320 PolarHBondContact OD1-N 3.44Å; D318-R321 HydrophobicContact CB-CB 4.16Å; D318-R321 HydrophobicContact CB-CG 4.04Å; D318-R321 PolarHBondContact O-N 2.94Å; D318-R321 PolarHBondContact OD1-N 2.87Å; D318-R321 VanDerWaalsContact OD1-N 3.15Å; D318-R321 WeakPolarHBondContact OD2-CD 3.15Å; D318-R321 WeakPolarHBondContact OD2-CG 3.32Å; D318-R321 IonicContact OD2-CZ 3.5Å; D318-R321 IonicContact OD2-NE 3.35Å; D318-R321 PolarHBondContact OD2-NE 2.85Å; D318-R321 IonicContact OD2-NH2 3.57Å; D318-I322 VanDerWaalsContact O-CG1 3.32Å; D318-I322 WeakPolarHBondContact O-CG1 3.39Å; D318-I322 PolarHBondContact O-N 3.05Å; D318-Y351 HydrophobicContact CB-CE2 4.49Å; D318-Y351 WeakPolarHBondContact CB-OH 3.43Å; D318-Y351 PolarHBondContact N-OH 3.33Å
319	P	90.5	Very high	91	Very high	90 Å²	90	76.3 Å²	76.3	58%	0.584	42%	0.42	S	S	*	.	H	α-helix	trans	-69.4	-22.9	-173.3	29.3	-35	0	0	0	111.5	T317 E323	T317-P319 WeakPolarHBondContact O-CD 3.36Å; P319-E323 WeakPolarHBondContact O-CB 3.39Å; P319-E323 PolarHBondContact O-N 3.28Å
320	V	91.8	Very high	90.8	Very high	96 Å²	96	75.2 Å²	75.2	58%	0.582	42%	0.416	S	S	*	.	H	α-helix	trans	-73	-42.3	178.2	-173.1	0	0	0	0	109.9	D318 I324	D318-V320 PolarHBondContact O-N 3.23Å; D318-V320 WeakPolarHBondContact OD1-CA 3.23Å; D318-V320 VanDerWaalsContact OD1-CB 3.3Å; D318-V320 WeakPolarHBondContact OD1-CB 3.13Å; D318-V320 PolarHBondContact OD1-N 3.44Å; V320-I324 HydrophobicContact CG1-CD1 4.06Å; V320-I324 WeakPolarHBondContact O-CB 3.31Å; V320-I324 WeakPolarHBondContact O-CD1 3.41Å; V320-I324 WeakPolarHBondContact O-CG1 3.09Å; V320-I324 PolarHBondContact O-N 3.36Å
321	R	92.5	Very high	90.7	Very high	43 Å²	43	70.6 Å²	70.6	16%	0.162	40%	0.397	C	S	.	.	H	α-helix	trans	-65.3	-47.3	173.9	-66.9	175	-152.6	-140.9	-0.9	111.6	D318 E323 I324 M325 Y351 D355	D318-R321 HydrophobicContact CB-CB 4.16Å; D318-R321 HydrophobicContact CB-CG 4.04Å; D318-R321 PolarHBondContact O-N 2.94Å; D318-R321 PolarHBondContact OD1-N 2.87Å; D318-R321 VanDerWaalsContact OD1-N 3.15Å; D318-R321 WeakPolarHBondContact OD2-CD 3.15Å; D318-R321 WeakPolarHBondContact OD2-CG 3.32Å; D318-R321 IonicContact OD2-CZ 3.5Å; D318-R321 IonicContact OD2-NE 3.35Å; D318-R321 PolarHBondContact OD2-NE 2.85Å; D318-R321 IonicContact OD2-NH2 3.57Å; R321-E323 VanDerWaalsContact C-N 3.31Å; R321-E323 PolarHBondContact O-N 3.3Å; R321-I324 PolarHBondContact O-N 3Å; R321-M325 WeakPolarHBondContact O-CG 3.43Å; R321-M325 PolarHBondContact O-N 3.25Å; R321-Y351 HydrophobicContact CB-CD2 3.75Å; R321-Y351 HydrophobicContact CB-CE2 3.52Å; R321-Y351 HydrophobicContact CG-CE2 4.26Å; R321-D355 IonicContact CZ-OD2 2.68Å; R321-D355 VanDerWaalsContact CZ-OD2 3.24Å; R321-D355 IonicContact NH1-OD2 2.74Å; R321-D355 PolarHBondContact NH1-OD2 2.92Å; R321-D355 IonicContact NH2-OD1 3.5Å; R321-D355 PolarHBondContact NH2-OD1 3.25Å; R321-D355 IonicContact NH2-OD2 3.79Å; R321-D355 PolarHBondContact NH2-OD2 3.44Å
322	I	93.2	Very high	90.8	Very high	10 Å²	10	72.6 Å²	72.6	5%	0.051	40%	0.402	C	S	.	.	H	α-helix	trans	-59.7	-44.8	179	-63.5	166.3	0	0	0	109.8	D318 M325 V326 R332 I335 Y351	D318-I322 VanDerWaalsContact O-CG1 3.32Å; D318-I322 WeakPolarHBondContact O-CG1 3.39Å; D318-I322 PolarHBondContact O-N 3.05Å; I322-M325 PolarHBondContact O-N 3.44Å; I322-V326 WeakPolarHBondContact O-CG2 3.28Å; I322-V326 PolarHBondContact O-N 3.13Å; I322-R332 HydrophobicContact CG2-CG 4.35Å; I322-I335 HydrophobicContact CG1-CG2 4.18Å; I322-I335 HydrophobicContact CG2-CD1 4.23Å; I322-Y351 HydrophobicContact CG1-CE2 4.19Å
323	E	92.8	Very high	90.9	Very high	84 Å²	84	74.6 Å²	74.6	39%	0.393	41%	0.408	S	S	.	.	H	α-helix	trans	-66.8	-38.7	178.5	-165.7	57.7	-142.3	0	0	112.4	P319 R321 M325 V326 N327 R332	P319-E323 WeakPolarHBondContact O-CB 3.39Å; P319-E323 PolarHBondContact O-N 3.28Å; R321-E323 VanDerWaalsContact C-N 3.31Å; R321-E323 PolarHBondContact O-N 3.3Å; E323-M325 VanDerWaalsContact C-N 3.3Å; E323-M325 PolarHBondContact O-N 3.35Å; E323-V326 PolarHBondContact O-N 3.24Å; E323-N327 PolarHBondContact O-N 3.12Å; E323-N327 PolarHBondContact O-ND2 2.68Å; E323-N327 PolarHBondContact OE1-ND2 2.74Å; E323-N327 VanDerWaalsContact OE1-ND2 3.1Å; E323-R332 IonicContact OE2-NH2 3.1Å; E323-R332 PolarHBondContact OE2-NH2 3.02Å; E323-R332 VanDerWaalsContact OE2-NH2 3.1Å
324	I	92.3	Very high	91.2	Very high	67 Å²	67	71 Å²	71	34%	0.344	39%	0.391	S	S	.	.	H	α-helix	trans	-59.9	-41.3	171.8	-71.1	164	0	0	0	110.9	V320 R321 N327 M328 L354	V320-I324 HydrophobicContact CG1-CD1 4.06Å; V320-I324 WeakPolarHBondContact O-CB 3.31Å; V320-I324 WeakPolarHBondContact O-CD1 3.41Å; V320-I324 WeakPolarHBondContact O-CG1 3.09Å; V320-I324 PolarHBondContact O-N 3.36Å; R321-I324 PolarHBondContact O-N 3Å; I324-N327 CarbonylContact O-C 3.58Å; I324-N327 PolarHBondContact O-N 2.98Å; I324-M328 HydrophobicContact CG2-CE 3.76Å; I324-M328 HydrophobicContact CG2-SD 4.12Å; I324-M328 VanDerWaalsContact O-CG 3.31Å; I324-M328 WeakPolarHBondContact O-CG 3.4Å; I324-M328 PolarHBondContact O-N 3.17Å; I324-L354 HydrophobicContact CB-CD1 4.31Å; I324-L354 HydrophobicContact CG2-CD1 3.81Å; I324-L354 HydrophobicContact CG2-CD2 3.75Å; I324-L354 HydrophobicContact CG2-CG 4.47Å
325	M	94.2	Very high	91.7	Very high	0 Å²	0	67.9 Å²	67.9	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-70.1	-37	177.9	-69.2	174.2	71.1	0	0	113	R321 I322 E323 N327 M328 G329 F330 I335 I347 T350 Y351 L354	R321-M325 WeakPolarHBondContact O-CG 3.43Å; R321-M325 PolarHBondContact O-N 3.25Å; I322-M325 PolarHBondContact O-N 3.44Å; E323-M325 VanDerWaalsContact C-N 3.3Å; E323-M325 PolarHBondContact O-N 3.35Å; M325-N327 VanDerWaalsContact C-N 3.31Å; M325-N327 PolarHBondContact O-N 3.41Å; M325-M328 CarbonylContact O-C 3.57Å; M325-M328 WeakPolarHBondContact O-CA 3.13Å; M325-M328 WeakPolarHBondContact O-CB 3.13Å; M325-M328 PolarHBondContact O-N 2.98Å; M325-G329 PolarHBondContact O-N 3.42Å; M325-F330 HydrophobicContact CB-CD2 4.1Å; M325-F330 HydrophobicContact CE-CD2 4.37Å; M325-F330 WeakPolarHBondContact O-CD2 3.27Å; M325-F330 PolarHBondContact O-N 3.28Å; M325-I335 HydrophobicContact CB-CD1 3.58Å; M325-I335 HydrophobicContact CB-CG1 4.38Å; M325-I335 HydrophobicContact CE-CD1 4.37Å; M325-I335 HydrophobicContact CE-CG1 3.93Å; M325-I335 HydrophobicContact CE-CG2 4.31Å; M325-I335 HydrophobicContact SD-CG2 4.38Å; M325-I347 HydrophobicContact CE-CG2 3.6Å; M325-I347 WeakPolarHBondContact CE-O 3.36Å; M325-T350 HydrophobicContact CE-CG2 4.18Å; M325-T350 HydrophobicContact CG-CG2 4.12Å; M325-T350 HydrophobicContact SD-CG2 4.47Å; M325-Y351 HydrophobicContact SD-CD2 3.84Å; M325-Y351 HydrophobicContact SD-CG 4.24Å; M325-L354 HydrophobicContact CG-CD1 3.47Å; M325-L354 VanDerWaalsContact CG-CD1 3.47Å; M325-L354 HydrophobicContact SD-CD1 4.14Å
326	V	94.1	Very high	92.1	Very high	51 Å²	51	68.3 Å²	68.3	31%	0.309	37%	0.37	S	S	.	.	H	α-helix	trans	-60.7	-42.6	171.1	169.4	0	0	0	0	110.6	I322 E323 M328 G329 F330 R332 I335	I322-V326 WeakPolarHBondContact O-CG2 3.28Å; I322-V326 PolarHBondContact O-N 3.13Å; E323-V326 PolarHBondContact O-N 3.24Å; V326-M328 PolarHBondContact O-N 3.42Å; V326-G329 PolarHBondContact O-N 2.97Å; V326-F330 WeakPolarHBondContact CA-O 3.21Å; V326-R332 HydrophobicContact CG2-CB 4.37Å; V326-I335 HydrophobicContact CG2-CD1 4.11Å
327	N	92	Very high	92.4	Very high	127 Å²	127	70.8 Å²	70.8	68%	0.679	38%	0.383	S	S	*	.	H	α-helix	trans	-70.1	-14	174	-75.4	-84.6	0	0	0	113.9	E323 I324 M325	E323-N327 PolarHBondContact O-N 3.12Å; E323-N327 PolarHBondContact O-ND2 2.68Å; E323-N327 PolarHBondContact OE1-ND2 2.74Å; E323-N327 VanDerWaalsContact OE1-ND2 3.1Å; I324-N327 CarbonylContact O-C 3.58Å; I324-N327 PolarHBondContact O-N 2.98Å; M325-N327 VanDerWaalsContact C-N 3.31Å; M325-N327 PolarHBondContact O-N 3.41Å
328	M	90.3	Very high	92.8	Very high	80 Å²	80	65.6 Å²	65.6	39%	0.394	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-7.5	168	-69.9	169.7	170.4	0	0	113.4	I67 I324 M325 V326 F330 T350 L354	I67-M328 HydrophobicContact CG2-CE 3.86Å; I67-M328 HydrophobicContact CG2-CG 4.24Å; I67-M328 HydrophobicContact CG2-SD 3.41Å; I67-M328 WeakPolarHBondContact CG2-SD 3.45Å; I324-M328 HydrophobicContact CG2-CE 3.76Å; I324-M328 HydrophobicContact CG2-SD 4.12Å; I324-M328 VanDerWaalsContact O-CG 3.31Å; I324-M328 WeakPolarHBondContact O-CG 3.4Å; I324-M328 PolarHBondContact O-N 3.17Å; M325-M328 CarbonylContact O-C 3.57Å; M325-M328 WeakPolarHBondContact O-CA 3.13Å; M325-M328 WeakPolarHBondContact O-CB 3.13Å; M325-M328 PolarHBondContact O-N 2.98Å; V326-M328 PolarHBondContact O-N 3.42Å; M328-F330 HydrophobicContact CB-CD2 4.15Å; M328-F330 HydrophobicContact CB-CE2 4.24Å; M328-T350 HydrophobicContact SD-CG2 4.29Å; M328-L354 HydrophobicContact CE-CD2 4.12Å
329	G	91.8	Very high	92.9	Very high	68 Å²	68	64.3 Å²	64.3	70%	0.701	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.1	11.9	175.2	0	0	0	0	0	116.1	M325 V326	M325-G329 PolarHBondContact O-N 3.42Å; V326-G329 PolarHBondContact O-N 2.97Å
330	F	92.7	Very high	92.8	Very high	29 Å²	29	65.7 Å²	65.7	13%	0.127	35%	0.351	C	S	.	.			trans	-83.2	143.9	169.2	-61.1	-81.5	0	0	0	110.2	I67 M325 V326 M328 I335 I347 T350	I67-F330 HydrophobicContact CD1-CE2 4.32Å; I67-F330 HydrophobicContact CD1-CZ 4Å; M325-F330 HydrophobicContact CB-CD2 4.1Å; M325-F330 HydrophobicContact CE-CD2 4.37Å; M325-F330 WeakPolarHBondContact O-CD2 3.27Å; M325-F330 PolarHBondContact O-N 3.28Å; V326-F330 WeakPolarHBondContact CA-O 3.21Å; M328-F330 HydrophobicContact CB-CD2 4.15Å; M328-F330 HydrophobicContact CB-CE2 4.24Å; F330-I335 HydrophobicContact CB-CD1 3.98Å; F330-I335 HydrophobicContact CB-CG1 4Å; F330-I347 HydrophobicContact CD1-CD1 4.17Å; F330-I347 HydrophobicContact CD1-CG1 3.86Å; F330-I347 HydrophobicContact CD1-CG2 4.47Å; F330-I347 HydrophobicContact CE1-CG1 3.83Å; F330-T350 HydrophobicContact CE2-CG2 4.08Å
331	S	94.5	Very high	92.7	Very high	50 Å²	50	66.5 Å²	66.5	35%	0.35	35%	0.348	S	S	.	.			trans	-79.3	149.3	172.7	72.7	0	0	0	0	111.8	D333 E334 I335	S331-D333 VanDerWaalsContact C-N 3.3Å; S331-D333 PolarHBondContact O-N 3.38Å; S331-E334 VanDerWaalsContact CB-OE2 3.3Å; S331-E334 WeakPolarHBondContact CB-OE2 3.46Å; S331-E334 PolarHBondContact N-OE2 2.88Å; S331-E334 VanDerWaalsContact N-OE2 3.14Å; S331-E334 PolarHBondContact O-N 2.8Å; S331-E334 WeakPolarHBondContact OG-CB 3.36Å; S331-E334 WeakPolarHBondContact OG-CG 3.49Å; S331-E334 PolarHBondContact OG-N 2.85Å; S331-E334 PolarHBondContact OG-OE2 2.6Å; S331-I335 VanDerWaalsContact O-CG1 3.3Å; S331-I335 WeakPolarHBondContact O-CG1 3.32Å; S331-I335 PolarHBondContact O-N 2.8Å; S331-I335 VanDerWaalsContact O-N 3.1Å
332	R	93.6	Very high	92.5	Very high	103 Å²	103	65.5 Å²	65.5	39%	0.389	35%	0.351	S	S	.	.	H	α-helix	trans	-58.5	-42.8	178.2	176.4	164.4	-80.6	133.2	5.6	111.4	I322 E323 V326 E334 I335 E336	I322-R332 HydrophobicContact CG2-CG 4.35Å; E323-R332 IonicContact OE2-NH2 3.1Å; E323-R332 PolarHBondContact OE2-NH2 3.02Å; E323-R332 VanDerWaalsContact OE2-NH2 3.1Å; V326-R332 HydrophobicContact CG2-CB 4.37Å; R332-E334 VanDerWaalsContact C-N 3.33Å; R332-E334 PolarHBondContact O-N 3.44Å; R332-I335 WeakPolarHBondContact O-CB 3.47Å; R332-I335 PolarHBondContact O-N 3.32Å; R332-I335 VanDerWaalsContact O-N 3.16Å; R332-E336 VanDerWaalsContact CD-OE1 3.28Å; R332-E336 WeakPolarHBondContact CD-OE1 3.4Å; R332-E336 HydrophobicContact CG-CG 4.22Å; R332-E336 WeakPolarHBondContact CG-OE1 3.43Å; R332-E336 WeakPolarHBondContact O-CG 3.43Å; R332-E336 PolarHBondContact O-N 3.18Å
333	D	93.9	Very high	92.3	Very high	124 Å²	124	68 Å²	68	66%	0.663	37%	0.365	S	S	*	.	H	α-helix	trans	-59.9	-38.8	178.1	-55.3	9.5	0	0	0	112.8	S331 K337	S331-D333 VanDerWaalsContact C-N 3.3Å; S331-D333 PolarHBondContact O-N 3.38Å; D333-K337 WeakPolarHBondContact O-CB 3.48Å; D333-K337 PolarHBondContact O-N 3.44Å; D333-K337 VanDerWaalsContact O-N 3.08Å
334	E	94.1	Very high	92.4	Very high	100 Å²	100	65 Å²	65	47%	0.467	35%	0.351	S	S	.	.	H	α-helix	trans	-70.5	-38.5	175.5	-72.2	165.4	133.2	0	0	112.2	S331 R332 S338 I347	S331-E334 VanDerWaalsContact CB-OE2 3.3Å; S331-E334 WeakPolarHBondContact CB-OE2 3.46Å; S331-E334 PolarHBondContact N-OE2 2.88Å; S331-E334 VanDerWaalsContact N-OE2 3.14Å; S331-E334 PolarHBondContact O-N 2.8Å; S331-E334 WeakPolarHBondContact OG-CB 3.36Å; S331-E334 WeakPolarHBondContact OG-CG 3.49Å; S331-E334 PolarHBondContact OG-N 2.85Å; S331-E334 PolarHBondContact OG-OE2 2.6Å; R332-E334 VanDerWaalsContact C-N 3.33Å; R332-E334 PolarHBondContact O-N 3.44Å; E334-S338 VanDerWaalsContact O-CB 3.25Å; E334-S338 WeakPolarHBondContact O-CB 3.4Å; E334-S338 PolarHBondContact O-N 3Å; E334-I347 HydrophobicContact CB-CD1 3.89Å
335	I	93.9	Very high	92.5	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-63	-56.3	175.6	-61.8	161.8	0	0	0	110	I322 M325 V326 F330 S331 R332 K337 S338 L339 I347	I322-I335 HydrophobicContact CG1-CG2 4.18Å; I322-I335 HydrophobicContact CG2-CD1 4.23Å; M325-I335 HydrophobicContact CB-CD1 3.58Å; M325-I335 HydrophobicContact CB-CG1 4.38Å; M325-I335 HydrophobicContact CE-CD1 4.37Å; M325-I335 HydrophobicContact CE-CG1 3.93Å; M325-I335 HydrophobicContact CE-CG2 4.31Å; M325-I335 HydrophobicContact SD-CG2 4.38Å; V326-I335 HydrophobicContact CG2-CD1 4.11Å; F330-I335 HydrophobicContact CB-CD1 3.98Å; F330-I335 HydrophobicContact CB-CG1 4Å; S331-I335 VanDerWaalsContact O-CG1 3.3Å; S331-I335 WeakPolarHBondContact O-CG1 3.32Å; S331-I335 PolarHBondContact O-N 2.8Å; S331-I335 VanDerWaalsContact O-N 3.1Å; R332-I335 WeakPolarHBondContact O-CB 3.47Å; R332-I335 PolarHBondContact O-N 3.32Å; R332-I335 VanDerWaalsContact O-N 3.16Å; I335-K337 VanDerWaalsContact C-N 3.28Å; I335-K337 PolarHBondContact O-N 3.06Å; I335-S338 PolarHBondContact O-N 3.4Å; I335-L339 HydrophobicContact CG2-CD1 3.74Å; I335-L339 HydrophobicContact CG2-CG 4.3Å; I335-L339 VanDerWaalsContact O-CG 3.3Å; I335-L339 WeakPolarHBondContact O-CG 3.44Å; I335-L339 PolarHBondContact O-N 3.31Å; I335-I347 HydrophobicContact CB-CG2 4.32Å; I335-I347 HydrophobicContact CG1-CG2 3.91Å
336	E	92.5	Very high	92.6	Very high	94 Å²	94	66.1 Å²	66.1	44%	0.439	36%	0.358	S	S	.	.	H	α-helix	trans	-57.8	-42.1	-178.7	-71.9	177.8	-164.2	0	0	111.4	R332 T340	R332-E336 VanDerWaalsContact CD-OE1 3.28Å; R332-E336 WeakPolarHBondContact CD-OE1 3.4Å; R332-E336 HydrophobicContact CG-CG 4.22Å; R332-E336 WeakPolarHBondContact CG-OE1 3.43Å; R332-E336 WeakPolarHBondContact O-CG 3.43Å; R332-E336 PolarHBondContact O-N 3.18Å; E336-T340 WeakPolarHBondContact O-CB 3.37Å; E336-T340 PolarHBondContact O-N 3.01Å; E336-T340 PolarHBondContact O-OG1 3.02Å
337	K	93.4	Very high	92.6	Very high	129 Å²	129	64.7 Å²	64.7	56%	0.561	35%	0.348	S	S	*	.	H	α-helix	trans	-64.7	-48.5	175.3	-179	-176.1	172.4	-168	0	113.1	D333 I335 Q341	D333-K337 WeakPolarHBondContact O-CB 3.48Å; D333-K337 PolarHBondContact O-N 3.44Å; D333-K337 VanDerWaalsContact O-N 3.08Å; I335-K337 VanDerWaalsContact C-N 3.28Å; I335-K337 PolarHBondContact O-N 3.06Å; K337-Q341 WeakPolarHBondContact O-CB 3.49Å; K337-Q341 VanDerWaalsContact O-CG 3.22Å; K337-Q341 WeakPolarHBondContact O-CG 3.46Å; K337-Q341 PolarHBondContact O-N 2.83Å
338	S	94.4	Very high	92.8	Very high	2 Å²	2	58.7 Å²	58.7	1%	0.014	32%	0.316	C	S	.	.	H	α-helix	trans	-60.2	-46.9	-179	163.4	0	0	0	0	111.5	E334 I335 Q341 G342 N343 D345 M348	E334-S338 VanDerWaalsContact O-CB 3.25Å; E334-S338 WeakPolarHBondContact O-CB 3.4Å; E334-S338 PolarHBondContact O-N 3Å; I335-S338 PolarHBondContact O-N 3.4Å; S338-Q341 PolarHBondContact O-N 3.49Å; S338-G342 PolarHBondContact O-N 3.09Å; S338-N343 PolarHBondContact O-N 2.92Å; S338-D345 VanDerWaalsContact OG-CG 3.25Å; S338-D345 PolarHBondContact OG-OD1 3.46Å; S338-D345 PolarHBondContact OG-OD2 2.65Å; S338-D345 VanDerWaalsContact OG-OD2 3.13Å; S338-M348 WeakPolarHBondContact OG-CB 3.48Å; S338-M348 PolarHBondContact OG-N 3.25Å
339	L	92.5	Very high	93	Very high	3 Å²	3	54.9 Å²	54.9	2%	0.016	30%	0.297	C	S	.	.	H	α-helix	trans	-66.8	-46.9	-179.9	-61.6	178	0	0	0	111.8	Y316 I335 Q341 G342 M348 Y351	Y316-L339 HydrophobicContact CD1-CB 4.06Å; Y316-L339 HydrophobicContact CD1-CD1 4.41Å; Y316-L339 HydrophobicContact CD1-CD2 4Å; Y316-L339 HydrophobicContact CD1-CG 4.37Å; Y316-L339 HydrophobicContact CE1-CD2 4.44Å; Y316-L339 HydrophobicContact CG-CB 3.94Å; I335-L339 HydrophobicContact CG2-CD1 3.74Å; I335-L339 HydrophobicContact CG2-CG 4.3Å; I335-L339 VanDerWaalsContact O-CG 3.3Å; I335-L339 WeakPolarHBondContact O-CG 3.44Å; I335-L339 PolarHBondContact O-N 3.31Å; L339-Q341 PolarHBondContact O-N 2.9Å; L339-G342 PolarHBondContact O-N 3.02Å; L339-G342 VanDerWaalsContact O-N 3.15Å; L339-M348 HydrophobicContact CD2-CB 4.21Å; L339-M348 HydrophobicContact CD2-CG 4.01Å; L339-Y351 HydrophobicContact CD1-CD1 4.11Å; L339-Y351 HydrophobicContact CD1-CD2 3.66Å; L339-Y351 HydrophobicContact CD1-CE1 4.23Å; L339-Y351 HydrophobicContact CD1-CE2 3.79Å; L339-Y351 HydrophobicContact CD1-CG 3.83Å; L339-Y351 HydrophobicContact CD2-CD1 3.77Å; L339-Y351 HydrophobicContact CD2-CD2 4.45Å; L339-Y351 HydrophobicContact CD2-CE1 4.46Å; L339-Y351 HydrophobicContact CD2-CG 3.77Å; L339-Y351 HydrophobicContact CG-CG 4.44Å
340	T	89.4	Confident	93.2	Very high	119 Å²	119	51.7 Å²	51.7	73%	0.73	26%	0.264	S	S	*	.	H	α-helix	trans	-61.7	-30.3	178.8	-57.5	0	0	0	0	112.5	E336	E336-T340 WeakPolarHBondContact O-CB 3.37Å; E336-T340 PolarHBondContact O-N 3.01Å; E336-T340 PolarHBondContact O-OG1 3.02Å
341	Q	89.1	Confident	93.3	Very high	113 Å²	113	50.4 Å²	50.4	53%	0.528	26%	0.258	S	S	.	.	H	α-helix	trans	-86.2	-14	179.5	-69.5	-178.2	-25.7	0	0	114.1	K337 S338 L339 N343	K337-Q341 WeakPolarHBondContact O-CB 3.49Å; K337-Q341 VanDerWaalsContact O-CG 3.22Å; K337-Q341 WeakPolarHBondContact O-CG 3.46Å; K337-Q341 PolarHBondContact O-N 2.83Å; S338-Q341 PolarHBondContact O-N 3.49Å; L339-Q341 PolarHBondContact O-N 2.9Å; Q341-N343 VanDerWaalsContact C-N 3.33Å; Q341-N343 VanDerWaalsContact CB-OD1 3.26Å; Q341-N343 WeakPolarHBondContact CB-OD1 3.44Å; Q341-N343 PolarHBondContact O-N 3.2Å; Q341-N343 PolarHBondContact OE1-ND2 2.84Å
342	G	88.4	Confident	93.3	Very high	22 Å²	22	49.1 Å²	49.1	23%	0.227	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	43.4	-176.1	0	0	0	0	0	112.2	K98 S338 L339 F344	K98-G342 PolarHBondContact NZ-O 3.36Å; S338-G342 PolarHBondContact O-N 3.09Å; L339-G342 PolarHBondContact O-N 3.02Å; L339-G342 VanDerWaalsContact O-N 3.15Å; G342-F344 WeakPolarHBondContact O-CD2 3.34Å
343	N	88.7	Confident	93.3	Very high	62 Å²	62	44.8 Å²	44.8	33%	0.332	23%	0.232	S	C	.	.			trans	-66.9	-39.6	-171.1	-77.1	-17.7	0	0	0	113.2	K98 S338 Q341 D345	K98-N343 PolarHBondContact NZ-O 2.81Å; S338-N343 PolarHBondContact O-N 2.92Å; Q341-N343 VanDerWaalsContact C-N 3.33Å; Q341-N343 VanDerWaalsContact CB-OD1 3.26Å; Q341-N343 WeakPolarHBondContact CB-OD1 3.44Å; Q341-N343 PolarHBondContact O-N 3.2Å; Q341-N343 PolarHBondContact OE1-ND2 2.84Å; N343-D345 HydrophobicContact CB-CB 4.21Å; N343-D345 WeakPolarHBondContact CB-OD2 3.4Å; N343-D345 PolarHBondContact ND2-OD2 3.38Å
344	F	94.5	Very high	93.2	Very high	23 Å²	23	40.3 Å²	40.3	10%	0.101	21%	0.208	C	C	.	.			trans	60.2	44.8	-163.6	-59.8	-108	0	0	0	111.6	K98 L108 E110 I111 G342 M348	K98-F344 HydrophobicContact CB-CE2 3.99Å; K98-F344 HydrophobicContact CB-CZ 4.13Å; K98-F344 HydrophobicContact CD-CD2 3.64Å; K98-F344 HydrophobicContact CD-CE2 3.61Å; K98-F344 HydrophobicContact CD-CZ 4.48Å; K98-F344 HydrophobicContact CG-CD2 3.84Å; K98-F344 HydrophobicContact CG-CE2 3.55Å; K98-F344 HydrophobicContact CG-CG 4.44Å; K98-F344 HydrophobicContact CG-CZ 3.93Å; L108-F344 HydrophobicContact CB-CD1 4.24Å; L108-F344 HydrophobicContact CB-CE1 4.01Å; L108-F344 HydrophobicContact CD2-CD1 3.73Å; L108-F344 HydrophobicContact CD2-CE1 3.9Å; L108-F344 HydrophobicContact CD2-CG 4.32Å; L108-F344 HydrophobicContact CG-CD1 3.76Å; L108-F344 HydrophobicContact CG-CE1 4.01Å; L108-F344 WeakPolarHBondContact O-CE1 3.42Å; E110-F344 CarbonylContact C-O 3.54Å; E110-F344 WeakPolarHBondContact CA-O 3.49Å; I111-F344 HydrophobicContact CD1-CB 4.18Å; I111-F344 HydrophobicContact CG1-CB 4.06Å; I111-F344 PolarHBondContact N-O 3.39Å; G342-F344 WeakPolarHBondContact O-CD2 3.34Å; F344-M348 HydrophobicContact CD2-CE 4.32Å; F344-M348 HydrophobicContact CD2-SD 3.97Å; F344-M348 HydrophobicContact CE1-CE 4.5Å; F344-M348 HydrophobicContact CE2-CE 4.09Å; F344-M348 HydrophobicContact CE2-SD 4.33Å; F344-M348 HydrophobicContact CG-SD 4.12Å; F344-M348 HydrophobicContact CZ-CE 4.2Å; F344-M348 PolarHBondContact N-SD 3.36Å
345	D	95.3	Very high	92.3	Very high	42 Å²	42	40 Å²	40	23%	0.225	21%	0.209	C	C	.	.	S	Bend	trans	-92.2	-179.9	168.7	57.3	35.2	0	0	0	111.4	S338 N343 I347 M348 A349	S338-D345 VanDerWaalsContact OG-CG 3.25Å; S338-D345 PolarHBondContact OG-OD1 3.46Å; S338-D345 PolarHBondContact OG-OD2 2.65Å; S338-D345 VanDerWaalsContact OG-OD2 3.13Å; N343-D345 HydrophobicContact CB-CB 4.21Å; N343-D345 WeakPolarHBondContact CB-OD2 3.4Å; N343-D345 PolarHBondContact ND2-OD2 3.38Å; D345-I347 PolarHBondContact O-N 2.68Å; D345-I347 WeakPolarHBondContact OD1-CB 3.26Å; D345-I347 PolarHBondContact OD1-N 2.79Å; D345-M348 PolarHBondContact O-N 3.26Å; D345-M348 PolarHBondContact OD1-N 3.03Å; D345-A349 VanDerWaalsContact O-CB 3.29Å; D345-A349 WeakPolarHBondContact O-CB 3.47Å; D345-A349 PolarHBondContact O-N 2.7Å
346	D	94.7	Very high	90.3	Very high	48 Å²	48	50.9 Å²	50.9	26%	0.257	25%	0.25	S	S	.	.	H	α-helix	trans	-66.3	-20.2	-176.9	64.7	-45.4	0	0	0	113.8	K45 E110 T350	K45-D346 WeakPolarHBondContact CE-OD2 3.46Å; K45-D346 HydrophobicContact CG-CB 4.08Å; K45-D346 IonicContact NZ-OD2 3.1Å; K45-D346 PolarHBondContact NZ-OD2 3.43Å; E110-D346 VanDerWaalsContact OE2-CA 3.28Å; E110-D346 WeakPolarHBondContact OE2-CA 3.35Å; D346-T350 VanDerWaalsContact O-CB 3.26Å; D346-T350 WeakPolarHBondContact O-CB 3.21Å; D346-T350 PolarHBondContact O-N 2.87Å; D346-T350 PolarHBondContact O-OG1 3.27Å
347	I	95.7	Very high	88.3	Confident	20 Å²	20	53.2 Å²	53.2	10%	0.103	26%	0.255	C	S	.	.	H	α-helix	trans	-75.3	-53.7	174.6	-51.4	-174.1	0	0	0	109.2	M325 F330 E334 I335 D345 A349 T350 Y351	M325-I347 HydrophobicContact CE-CG2 3.6Å; M325-I347 WeakPolarHBondContact CE-O 3.36Å; F330-I347 HydrophobicContact CD1-CD1 4.17Å; F330-I347 HydrophobicContact CD1-CG1 3.86Å; F330-I347 HydrophobicContact CD1-CG2 4.47Å; F330-I347 HydrophobicContact CE1-CG1 3.83Å; E334-I347 HydrophobicContact CB-CD1 3.89Å; I335-I347 HydrophobicContact CB-CG2 4.32Å; I335-I347 HydrophobicContact CG1-CG2 3.91Å; D345-I347 PolarHBondContact O-N 2.68Å; D345-I347 WeakPolarHBondContact OD1-CB 3.26Å; D345-I347 PolarHBondContact OD1-N 2.79Å; I347-A349 VanDerWaalsContact C-N 3.31Å; I347-A349 PolarHBondContact O-N 3.13Å; I347-T350 PolarHBondContact O-N 3.06Å; I347-T350 VanDerWaalsContact O-N 3.17Å; I347-Y351 PolarHBondContact O-N 3.33Å
348	M	95.1	Very high	85.7	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.01	27%	0.268	C	S	.	.	H	α-helix	trans	-60.2	-41.9	175.8	-176.4	173.2	-171.6	0	0	111.5	Y316 S338 L339 F344 D345 T350 Y351 L352	Y316-M348 HydrophobicContact CE1-CE 4.3Å; S338-M348 WeakPolarHBondContact OG-CB 3.48Å; S338-M348 PolarHBondContact OG-N 3.25Å; L339-M348 HydrophobicContact CD2-CB 4.21Å; L339-M348 HydrophobicContact CD2-CG 4.01Å; F344-M348 HydrophobicContact CD2-CE 4.32Å; F344-M348 HydrophobicContact CD2-SD 3.97Å; F344-M348 HydrophobicContact CE1-CE 4.5Å; F344-M348 HydrophobicContact CE2-CE 4.09Å; F344-M348 HydrophobicContact CE2-SD 4.33Å; F344-M348 HydrophobicContact CG-SD 4.12Å; F344-M348 HydrophobicContact CZ-CE 4.2Å; F344-M348 PolarHBondContact N-SD 3.36Å; D345-M348 PolarHBondContact O-N 3.26Å; D345-M348 PolarHBondContact OD1-N 3.03Å; M348-T350 PolarHBondContact O-N 3.29Å; M348-Y351 PolarHBondContact O-N 2.95Å; M348-L352 HydrophobicContact CE-CD1 4.29Å; M348-L352 HydrophobicContact CG-CD1 4.09Å; M348-L352 WeakPolarHBondContact O-CG 3.43Å; M348-L352 PolarHBondContact O-N 3.13Å
349	A	95.7	Very high	82.8	Confident	0 Å²	0	61 Å²	61	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-62.8	-40.7	176.2	0	0	0	0	0	111.9	F109 E110 D345 I347 L352 L353	F109-A349 HydrophobicContact CB-CB 4.24Å; E110-A349 HydrophobicContact CB-CB 3.73Å; E110-A349 HydrophobicContact CG-CB 4.02Å; E110-A349 WeakPolarHBondContact OE2-CB 3.46Å; D345-A349 VanDerWaalsContact O-CB 3.29Å; D345-A349 WeakPolarHBondContact O-CB 3.47Å; D345-A349 PolarHBondContact O-N 2.7Å; I347-A349 VanDerWaalsContact C-N 3.31Å; I347-A349 PolarHBondContact O-N 3.13Å; A349-L352 PolarHBondContact O-N 3.41Å; A349-L353 WeakPolarHBondContact O-CB 3.17Å; A349-L353 WeakPolarHBondContact O-CD1 3.38Å; A349-L353 WeakPolarHBondContact O-CG 3.32Å; A349-L353 PolarHBondContact O-N 3.06Å
350	T	95.5	Very high	79.8	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-63.7	-43.8	175.3	-62.9	0	0	0	0	111.7	H65 I67 T68 M325 M328 F330 D346 I347 M348 L352 L353 L354	H65-T350 PolarHBondContact CE1-OG1 3.4Å; I67-T350 HydrophobicContact CG2-CG2 4.35Å; T68-T350 HydrophobicContact CG2-CG2 4.26Å; M325-T350 HydrophobicContact CE-CG2 4.18Å; M325-T350 HydrophobicContact CG-CG2 4.12Å; M325-T350 HydrophobicContact SD-CG2 4.47Å; M328-T350 HydrophobicContact SD-CG2 4.29Å; F330-T350 HydrophobicContact CE2-CG2 4.08Å; D346-T350 VanDerWaalsContact O-CB 3.26Å; D346-T350 WeakPolarHBondContact O-CB 3.21Å; D346-T350 PolarHBondContact O-N 2.87Å; D346-T350 PolarHBondContact O-OG1 3.27Å; I347-T350 PolarHBondContact O-N 3.06Å; I347-T350 VanDerWaalsContact O-N 3.17Å; M348-T350 PolarHBondContact O-N 3.29Å; T350-L352 PolarHBondContact O-N 2.7Å; T350-L353 CarbonylContact O-C 3.59Å; T350-L353 PolarHBondContact O-N 2.92Å; T350-L354 HydrophobicContact CG2-CD1 4.2Å; T350-L354 HydrophobicContact CG2-CG 4.47Å; T350-L354 WeakPolarHBondContact O-CB 3.38Å; T350-L354 VanDerWaalsContact O-CG 3.32Å; T350-L354 WeakPolarHBondContact O-CG 3.45Å; T350-L354 PolarHBondContact O-N 3.36Å
351	Y	94.8	Very high	77.2	Confident	2 Å²	2	66 Å²	66	1%	0.008	32%	0.322	C	S	.	.	H	α-helix	trans	-59.5	-44.8	176.3	-177.2	-93.1	0	0	0	112.5	D315 Y316 T317 D318 R321 I322 M325 L339 I347 M348 L354	D315-Y351 WeakPolarHBondContact O-CE1 3.15Å; D315-Y351 PolarHBondContact O-OH 3.35Å; Y316-Y351 WeakPolarHBondContact CA-OH 3.47Å; Y316-Y351 HydrophobicContact CD1-CD1 4.42Å; Y316-Y351 AromaticContact CD1-CE1 3.98Å; Y316-Y351 HydrophobicContact CD1-CE1 3.98Å; T317-Y351 PolarHBondContact N-OH 2.85Å; D318-Y351 HydrophobicContact CB-CE2 4.49Å; D318-Y351 WeakPolarHBondContact CB-OH 3.43Å; D318-Y351 PolarHBondContact N-OH 3.33Å; R321-Y351 HydrophobicContact CB-CD2 3.75Å; R321-Y351 HydrophobicContact CB-CE2 3.52Å; R321-Y351 HydrophobicContact CG-CE2 4.26Å; I322-Y351 HydrophobicContact CG1-CE2 4.19Å; M325-Y351 HydrophobicContact SD-CD2 3.84Å; M325-Y351 HydrophobicContact SD-CG 4.24Å; L339-Y351 HydrophobicContact CD1-CD1 4.11Å; L339-Y351 HydrophobicContact CD1-CD2 3.66Å; L339-Y351 HydrophobicContact CD1-CE1 4.23Å; L339-Y351 HydrophobicContact CD1-CE2 3.79Å; L339-Y351 HydrophobicContact CD1-CG 3.83Å; L339-Y351 HydrophobicContact CD2-CD1 3.77Å; L339-Y351 HydrophobicContact CD2-CD2 4.45Å; L339-Y351 HydrophobicContact CD2-CE1 4.46Å; L339-Y351 HydrophobicContact CD2-CG 3.77Å; L339-Y351 HydrophobicContact CG-CG 4.44Å; I347-Y351 PolarHBondContact O-N 3.33Å; M348-Y351 PolarHBondContact O-N 2.95Å; Y351-L354 PolarHBondContact O-N 3.36Å
352	L	93.7	Very high	74.5	Confident	23 Å²	23	66.4 Å²	66.4	12%	0.12	33%	0.327	C	S	.	.	H	α-helix	trans	-70.4	-34.6	177.9	-66.6	173	0	0	0	112.6	F109 M348 A349 T350 L354 D355	F109-L352 HydrophobicContact CD1-CB 3.8Å; F109-L352 HydrophobicContact CD1-CD1 4.18Å; F109-L352 HydrophobicContact CE1-CB 4.19Å; M348-L352 HydrophobicContact CE-CD1 4.29Å; M348-L352 HydrophobicContact CG-CD1 4.09Å; M348-L352 WeakPolarHBondContact O-CG 3.43Å; M348-L352 PolarHBondContact O-N 3.13Å; A349-L352 PolarHBondContact O-N 3.41Å; T350-L352 PolarHBondContact O-N 2.7Å; L352-L354 VanDerWaalsContact C-N 3.31Å; L352-D355 WeakPolarHBondContact O-CB 3.37Å; L352-D355 PolarHBondContact O-N 3.04Å
353	L	94.1	Very high	71.8	Confident	13 Å²	13	72.1 Å²	72.1	7%	0.068	36%	0.358	C	S	.	.	H	α-helix	trans	-83	-3.4	178.1	-68.5	169.4	0	0	0	113.9	Y46 H65 T68 Q70 V72 F109 A349 T350 D355	Y46-L353 HydrophobicContact CE1-CD1 4.06Å; H65-L353 HydrophobicContact CB-CD1 4.05Å; T68-L353 HydrophobicContact CG2-CB 4.3Å; T68-L353 PolarHBondContact OG1-O 3.31Å; Q70-L353 HydrophobicContact CB-CD2 4.26Å; Q70-L353 HydrophobicContact CG-CD2 3.81Å; V72-L353 HydrophobicContact CG1-CD1 4.17Å; V72-L353 HydrophobicContact CG1-CD2 3.68Å; F109-L353 HydrophobicContact CD1-CD2 4.34Å; F109-L353 HydrophobicContact CD1-CG 4.44Å; F109-L353 HydrophobicContact CD2-CD2 3.71Å; F109-L353 HydrophobicContact CD2-CG 4.3Å; F109-L353 HydrophobicContact CE1-CD2 4.24Å; F109-L353 HydrophobicContact CE2-CD2 3.57Å; F109-L353 HydrophobicContact CG-CD2 4.09Å; F109-L353 HydrophobicContact CG-CG 4.23Å; F109-L353 HydrophobicContact CZ-CD2 3.87Å; A349-L353 WeakPolarHBondContact O-CB 3.17Å; A349-L353 WeakPolarHBondContact O-CD1 3.38Å; A349-L353 WeakPolarHBondContact O-CG 3.32Å; A349-L353 PolarHBondContact O-N 3.06Å; T350-L353 CarbonylContact O-C 3.59Å; T350-L353 PolarHBondContact O-N 2.92Å; L353-D355 VanDerWaalsContact C-N 3.35Å
354	L	91.4	Very high	69.1	Low	30 Å²	30	73.7 Å²	73.7	16%	0.157	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-6.5	168.4	-82.6	171.9	0	0	0	113.1	T68 I324 M325 M328 T350 Y351 L352 R356	T68-L354 HydrophobicContact CG2-CD2 3.83Å; T68-L354 HydrophobicContact CG2-CG 3.87Å; I324-L354 HydrophobicContact CB-CD1 4.31Å; I324-L354 HydrophobicContact CG2-CD1 3.81Å; I324-L354 HydrophobicContact CG2-CD2 3.75Å; I324-L354 HydrophobicContact CG2-CG 4.47Å; M325-L354 HydrophobicContact CG-CD1 3.47Å; M325-L354 VanDerWaalsContact CG-CD1 3.47Å; M325-L354 HydrophobicContact SD-CD1 4.14Å; M328-L354 HydrophobicContact CE-CD2 4.12Å; T350-L354 HydrophobicContact CG2-CD1 4.2Å; T350-L354 HydrophobicContact CG2-CG 4.47Å; T350-L354 WeakPolarHBondContact O-CB 3.38Å; T350-L354 VanDerWaalsContact O-CG 3.32Å; T350-L354 WeakPolarHBondContact O-CG 3.45Å; T350-L354 PolarHBondContact O-N 3.36Å; Y351-L354 PolarHBondContact O-N 3.36Å; L352-L354 VanDerWaalsContact C-N 3.31Å; L354-R356 PolarHBondContact O-N 3.22Å
355	D	74.8	Confident	66.1	Low	93 Å²	93	77.7 Å²	77.7	50%	0.497	40%	0.404	S	S	.	.			trans	-66.8	91.1	179.8	-151.4	-38.2	0	0	0	111.6	R321 L352 L353 R357	R321-D355 IonicContact CZ-OD2 2.68Å; R321-D355 VanDerWaalsContact CZ-OD2 3.24Å; R321-D355 IonicContact NH1-OD2 2.74Å; R321-D355 PolarHBondContact NH1-OD2 2.92Å; R321-D355 IonicContact NH2-OD1 3.5Å; R321-D355 PolarHBondContact NH2-OD1 3.25Å; R321-D355 IonicContact NH2-OD2 3.79Å; R321-D355 PolarHBondContact NH2-OD2 3.44Å; L352-D355 WeakPolarHBondContact O-CB 3.37Å; L352-D355 PolarHBondContact O-N 3.04Å; L353-D355 VanDerWaalsContact C-N 3.35Å; D355-R357 PolarHBondContact O-N 3.15Å
356	R	52.7	Low	63.3	Low	228 Å²	228	87 Å²	87	86%	0.86	44%	0.436	S	S	*	.			trans	-68.6	114.8	177.4	-73.6	-173.2	173.5	-155.5	0.2	109.3	L354 R358	L354-R356 PolarHBondContact O-N 3.22Å; R356-R358 PolarHBondContact O-N 2.62Å
357	R	50.3	Low	60.5	Low	143 Å²	143	92.9 Å²	92.9	54%	0.54	47%	0.468	S	S	.	.			trans	-21.4	103.6	168.1	-85.7	-172.4	175.3	-130.2	3.6	112.8	D179 D355 S359	D179-R357 VanDerWaalsContact CG-NH1 3.26Å; D179-R357 IonicContact OD1-CZ 2.76Å; D179-R357 VanDerWaalsContact OD1-CZ 3.29Å; D179-R357 IonicContact OD1-NH1 3.7Å; D179-R357 PolarHBondContact OD1-NH1 2.97Å; D179-R357 IonicContact OD1-NH2 2.66Å; D179-R357 PolarHBondContact OD1-NH2 2.74Å; D179-R357 IonicContact OD2-CZ 3.69Å; D179-R357 IonicContact OD2-NH1 3.83Å; D179-R357 PolarHBondContact OD2-NH1 3.5Å; D179-R357 IonicContact OD2-NH2 2.87Å; D355-R357 PolarHBondContact O-N 3.15Å; R357-S359 PolarHBondContact O-N 3.14Å
358	R	38.4	Very low	57.7	Low	221 Å²	221	95.8 Å²	95.8	83%	0.834	50%	0.503	S	S	*	.	S	Bend	trans	-75.2	39.4	170.3	-156.2	176.4	-173.1	163.6	5.3	111.9	R356	R356-R358 PolarHBondContact O-N 2.62Å
359	S	33.1	Very low	55	Low	74 Å²	74	101 Å²	101	52%	0.517	54%	0.54	S	S	.	.	S	Bend	trans	-140.4	24.4	-166.2	61.2	0	0	0	0	114.4	R357	R357-S359 PolarHBondContact O-N 3.14Å
360	S	31.2	Very low	52.4	Low	101 Å²	101	106.1 Å²	106.1	71%	0.706	58%	0.575	S	S	*	*	S	Bend	trans	-133.5	7.8	172.4	76.9	0	0	0	0	115.5
361	L	33.6	Very low	49.7	Very low	127 Å²	127	114 Å²	114	67%	0.665	62%	0.617	S	S	*	*	S	Bend	trans	-138.1	-26.3	-175.6	-86.4	165.4	0	0	0	115.5	T363	L361-T363 PolarHBondContact O-N 3.15Å
362	D	32.2	Very low	47	Very low	121 Å²	121	119.5 Å²	119.5	65%	0.647	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	25.3	-176.2	-68.4	-32.8	0	0	0	114.7
363	T	32.7	Very low	44.2	Very low	142 Å²	142	126.2 Å²	126.2	87%	0.871	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.9	28.9	178.2	-32.9	0	0	0	0	113.2	L361	L361-T363 PolarHBondContact O-N 3.15Å
364	S	30.5	Very low	41.7	Very low	94 Å²	94	136.9 Å²	136.9	66%	0.657	73%	0.73	S	S	*	*	S	Bend	trans	-151.6	48.4	174.7	63.9	0	0	0	0	113.2
365	S	33.3	Very low	39	Very low	107 Å²	107	143 Å²	143	75%	0.748	76%	0.758	S	S	*	*			trans	-143.9	42.8	-175.2	-57.7	0	0	0	0	114.2
366	R	36.6	Very low	36.9	Very low	237 Å²	237	144.5 Å²	144.5	89%	0.894	78%	0.775	S	S	*	*	S	Bend	trans	-137.5	79.8	162.8	-81.4	-171.1	174.2	175.6	-1.5	109.2
367	D	35.4	Very low	36.2	Very low	172 Å²	172	139.5 Å²	139.5	92%	0.92	77%	0.77	S	S	*	*	S	Bend	trans	167.4	117.9	152.3	-85.3	-18.2	0	0	0	106.6
368	G	37.5	Very low	35.6	Very low	81 Å²	81	141.4 Å²	141.4	84%	0.835	79%	0.785	S	S	*	*			trans	157	33.6	-169.9	0	0	0	0	0	115.8
369	S	38	Very low	35.4	Very low	112 Å²	112	138.5 Å²	138.5	78%	0.783	79%	0.785	S	S	*	*			trans	-82	137.5	171.4	45.4	0	0	0	0	110.9
370	S	40.7	Very low	35.5	Very low	108 Å²	108	143 Å²	143	76%	0.755	80%	0.802	S	S	*	*			trans	70.9	144.8	-178.3	87	0	0	0	0	114.6
371	L	38	Very low	35.8	Very low	165 Å²	165	144 Å²	144	86%	0.864	81%	0.81	S	S	*	*			cis	-129.9	160.2	4.8	-76.1	167.2	0	0	0	111.8
372	S	38.8	Very low	35.9	Very low	118 Å²	118	142.2 Å²	142.2	83%	0.825	81%	0.813	S	S	*	*			trans	-74.7	155.9	178.8	-56	0	0	0	0	114.2
373	L	35.3	Very low	36.1	Very low	164 Å²	164	143 Å²	143	86%	0.859	82%	0.823	S	S	*	*			trans	-59.4	143.2	176.2	-71.5	67.4	0	0	0	112.7
374	R	40.6	Very low	36.5	Very low	236 Å²	236	140.9 Å²	140.9	89%	0.891	81%	0.813	S	S	*	*			trans	-112.6	106.1	138.5	-74.8	-175.8	172.6	-168.8	-3.1	106.4
375	Q	35.4	Very low	36.8	Very low	160 Å²	160	144 Å²	144	75%	0.748	82%	0.823	S	S	*	*				79.7	75.4	79.5	-170.3	178.1	25.5	0	0	111.3
376	S	30.6	Very low	37.4	Very low	123 Å²	123	144.6 Å²	144.6	86%	0.86	82%	0.824	S	S	*	*			trans	-88.3	114.7	166	-55	0	0	0	0	109.1
377	T	38	Very low	37.3	Very low	123 Å²	123	138.1 Å²	138.1	76%	0.755	82%	0.821	S	S	*	*			trans	-85.7	140.4	178	44.8	0	0	0	0	112.4
378	H	37.6	Very low	37.4	Very low	183 Å²	183	134.2 Å²	134.2	85%	0.847	81%	0.812	S	S	*	*			trans	-39.9	151.7	-179.6	-87.4	-115.9	0	0	0	118.2
379	L	34.4	Very low	37.4	Very low	160 Å²	160	135.7 Å²	135.7	84%	0.838	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-67.1	157.8	159.1	-70.2	164.2	0	0	0	111.9
380	L	36.1	Very low	37.5	Very low	168 Å²	168	135.4 Å²	135.4	88%	0.88	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-91.4	160	-178.7	-65.7	98.4	0	0	0	113.7
381	S	36.6	Very low	37	Very low	124 Å²	124	137.1 Å²	137.1	87%	0.867	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-68.4	147.4	164.9	-48	0	0	0	0	111.7
382	A	36.2	Very low	36.6	Very low	88 Å²	88	136.3 Å²	136.3	73%	0.727	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-95	156.9	-175	0	0	0	0	0	113.9
383	T	36.5	Very low	36.3	Very low	139 Å²	139	134.8 Å²	134.8	85%	0.853	79%	0.79	S	S	*	*			trans	-161.6	154.5	134.2	12.9	0	0	0	0	114
384	S	39.6	Very low	36.2	Very low	96 Å²	96	133.6 Å²	133.6	67%	0.671	79%	0.79	S	S	*	*			trans	65.3	101.4	152.5	63.1	0	0	0	0	122.4
385	N	38.2	Very low	35.9	Very low	160 Å²	160	126.3 Å²	126.3	86%	0.856	79%	0.788	S	S	*	*				81.8	154.7	117	-71.5	9.5	0	0	0	121.5
386	P	44.5	Very low	35.7	Very low	120 Å²	120	122.1 Å²	122.1	78%	0.779	79%	0.787	S	S	*	*			trans	-137.4	-171.9	-133.3	46.1	-30.6	0	0	0	117.5
387	A	34.3	Very low	36.1	Very low	100 Å²	100	122.9 Å²	122.9	83%	0.826	79%	0.787	S	S	*	*			trans	98.5	161.4	152.1	0	0	0	0	0	119.1
388	A	38	Very low	35.8	Very low	90 Å²	90	124.1 Å²	124.1	74%	0.744	79%	0.789	S	S	*	*			trans	73.3	89.2	-179.4	0	0	0	0	0	118.4
389	S	37	Very low	35.4	Very low	113 Å²	113	120.4 Å²	120.4	79%	0.79	78%	0.782	S	S	*	*				25	156	106.2	-50.4	0	0	0	0	120.8
390	P	41.4	Very low	35.2	Very low	106 Å²	106	116.7 Å²	116.7	69%	0.688	78%	0.775	S	S	*	*			cis	-146.2	-163.7	-30.2	37.3	-15.6	0	0	0	114
391	L	29.9	Very low	34.9	Very low	144 Å²	144	114 Å²	114	75%	0.754	77%	0.77	S	S	*	*			trans	80.3	136.8	151.7	-69.8	166.6	0	0	0	122
392	I	29.9	Very low	34.7	Very low	148 Å²	148	113 Å²	113	76%	0.759	76%	0.758	S	S	*	*			trans	70.4	138.3	137.5	-74	168.8	0	0	0	118.8
393	S	31.1	Very low	34.4	Very low	86 Å²	86	115.7 Å²	115.7	60%	0.601	76%	0.756	S	S	*	*			cis	-179.5	173	-13.4	-174.8	0	0	0	0	110.7
394	T	33.4	Very low	34.3	Very low	139 Å²	139	116 Å²	116	85%	0.853	75%	0.747	S	S	*	*			trans	75.7	135.4	145.4	22	0	0	0	0	121.9
395	G	34.6	Very low	33.8	Very low	82 Å²	82	116.8 Å²	116.8	85%	0.845	75%	0.748	S	S	*	*			trans	107.2	86.6	160.7	0	0	0	0	0	115.6
396	G	32.7	Very low	33.6	Very low	72 Å²	72	114.4 Å²	114.4	74%	0.742	74%	0.744	S	S	*	*			cis	118.5	67.4	-7.6	0	0	0	0	0	116.3
397	V	38.6	Very low	32.7	Very low	140 Å²	140	115.5 Å²	115.5	85%	0.848	74%	0.743	S	S	*	*			trans	-155.4	125.4	157.9	-101.2	0	0	0	0	106.4
398	N	30.7	Very low	32.5	Very low	148 Å²	148	118 Å²	118	79%	0.791	74%	0.741	S	S	*	*			cis	63	137.2	34.1	-70.2	2.5	0	0	0	113.9
399	C	28.9	Very low	32.2	Very low	106 Å²	106	119.1 Å²	119.1	72%	0.716	74%	0.742	S	S	*	*			cis	-154.3	147.2	10.8	-130.9	0	0	0	0	113.6
400	A	30.7	Very low	32.2	Very low	82 Å²	82	118.8 Å²	118.8	68%	0.678	74%	0.738	S	S	*	*				54.8	169	128.8	0	0	0	0	0	123.6
401	S	30.9	Very low	31.5	Very low	112 Å²	112	120.6 Å²	120.6	78%	0.783	74%	0.742	S	S	*	*			trans	89	136.3	148.6	-64.8	0	0	0	0	118.6
402	V	31.4	Very low	31.4	Very low	101 Å²	101	120.5 Å²	120.5	61%	0.612	74%	0.742	S	S	*	*			cis	-163.7	143.2	-9.1	100.1	0	0	0	0	111.1
403	E	30.6	Very low	31.3	Very low	145 Å²	145	118.7 Å²	118.7	68%	0.678	74%	0.738	S	S	*	*			trans	46.9	174.8	151	-64.5	151	-175.3	0	0	120.3
404	H	34.7	Very low	31	Very low	147 Å²	147	121.9 Å²	121.9	68%	0.681	75%	0.747	S	S	*	*			cis	-128.7	130.9	-16.3	-93.8	-53.2	0	0	0	105.6
405	T	28.6	Very low	30.7	Very low	111 Å²	111	120.1 Å²	120.1	68%	0.681	74%	0.74	S	S	*	*				58.6	145.1	71.1	69.2	0	0	0	0	116.6
406	S	33.6	Very low	30.4	Very low	111 Å²	111	121.7 Å²	121.7	78%	0.776	73%	0.733	S	S	*	*			trans	84.9	154.6	172.2	84.5	0	0	0	0	117.2
407	N	26.4	Very low	30.5	Very low	142 Å²	142	125.7 Å²	125.7	76%	0.759	74%	0.737	S	S	*	*			cis	-174.1	163.1	-47.5	-114.9	-4.4	0	0	0	111.3
408	I	29.2	Very low	30.4	Very low	153 Å²	153	123.7 Å²	123.7	79%	0.785	73%	0.727	S	S	*	*			trans	71.8	158.3	151.3	-66.7	158.2	0	0	0	117.4
409	C	32.5	Very low	30.4	Very low	114 Å²	114	121.7 Å²	121.7	77%	0.77	72%	0.72	S	S	*	*			trans	-83	-151.3	176.3	-37.9	0	0	0	0	109.9
410	P	36.6	Very low	30.4	Very low	106 Å²	106	123.6 Å²	123.6	69%	0.688	72%	0.723	S	S	*	*			cis	-135.1	-157.1	0.3	41.5	-19.2	0	0	0	113.7
411	D	27	Very low	30.6	Very low	144 Å²	144	123.9 Å²	123.9	77%	0.77	73%	0.726	S	S	*	*			trans	32	136.7	145.8	-70.5	-27.8	0	0	0	123.9
412	D	27	Very low	30.5	Very low	141 Å²	141	125.3 Å²	125.3	75%	0.754	73%	0.725	S	S	*	*				27.3	139	127.4	-104.9	-19.6	0	0	0	122.7
413	T	27.2	Very low	30.5	Very low	111 Å²	111	126.1 Å²	126.1	68%	0.681	73%	0.73	S	S	*	*			trans	71.7	118.2	152.1	60.5	0	0	0	0	121.4
414	L	26.1	Very low	30.4	Very low	153 Å²	153	122.9 Å²	122.9	80%	0.801	74%	0.736	S	S	*	*				65.5	98.3	129.8	-62.4	172.8	0	0	0	120.7
415	S	26.5	Very low	30.6	Very low	101 Å²	101	121.6 Å²	121.6	71%	0.706	74%	0.74	S	S	*	*				95.2	162.8	106.2	81.2	0	0	0	0	121.1
416	V	28	Very low	30.9	Very low	115 Å²	115	124 Å²	124	70%	0.697	75%	0.746	S	S	*	*			trans	69.6	84.9	159.9	-179.4	0	0	0	0	117.1
417	L	34.5	Very low	30.9	Very low	156 Å²	156	124.4 Å²	124.4	82%	0.817	74%	0.739	S	S	*	*				65.6	178.8	123.9	-73.1	160.7	0	0	0	117.2
418	P	37.8	Very low	31.5	Very low	98 Å²	98	124.3 Å²	124.3	64%	0.636	73%	0.734	S	S	*	*			cis	-125.6	163.4	-3.4	43.1	-29.3	0	0	0	115.4
419	T	29.6	Very low	31.8	Very low	107 Å²	107	123.6 Å²	123.6	66%	0.656	73%	0.732	S	S	*	*			trans	50.1	144.7	137.7	59.8	0	0	0	0	121.6
420	N	29.2	Very low	32.2	Very low	146 Å²	146	121.3 Å²	121.3	78%	0.781	72%	0.721	S	S	*	*			cis	-167	165.2	5.9	-118.6	-7.2	0	0	0	112.4
421	A	34.3	Very low	32.4	Very low	88 Å²	88	125 Å²	125	73%	0.727	73%	0.729	S	S	*	*			trans	68.3	150.4	143.9	0	0	0	0	0	121.3
422	D	28.6	Very low	33	Very low	142 Å²	142	122.6 Å²	122.6	76%	0.759	72%	0.723	S	S	*	*			cis	-166.6	173.6	-35.6	-142.3	-30.1	0	0	0	111.6
423	T	31.7	Very low	33.5	Very low	117 Å²	117	120.9 Å²	120.9	72%	0.718	72%	0.723	S	S	*	*			trans	57.6	81.2	150	53.7	0	0	0	0	121.2
424	G	29.7	Very low	34.1	Very low	78 Å²	78	120.1 Å²	120.1	80%	0.804	72%	0.722	S	S	*	*			trans	19.6	-138.3	144.4	0	0	0	0	0	121.7
425	P	39.1	Very low	34.7	Very low	120 Å²	120	121 Å²	121	78%	0.779	72%	0.719	S	S	*	*			cis	-131.3	-176.8	-25	39.8	-24	0	0	0	114.3
426	M	34.1	Very low	35.1	Very low	161 Å²	161	125.1 Å²	125.1	79%	0.793	73%	0.725	S	S	*	*			trans	74.6	103.4	148.8	-99.8	-179.5	51.8	0	0	122.6
427	N	33.3	Very low	35.3	Very low	119 Å²	119	125 Å²	125	64%	0.636	73%	0.725	S	S	*	*				113.7	141.8	98.6	-121.6	-9	0	0	0	123.1
428	Q	39.6	Very low	35.3	Very low	141 Å²	141	123.2 Å²	123.2	66%	0.659	72%	0.72	S	S	*	*			trans	82	114.2	144.9	-83.9	174.3	73.2	0	0	124.1
429	N	35.3	Very low	35.1	Very low	137 Å²	137	125.1 Å²	125.1	73%	0.733	73%	0.725	S	S	*	*				78.5	143.8	128.2	-68.2	-8.3	0	0	0	120.9
430	A	40	Very low	35.6	Very low	67 Å²	67	126.2 Å²	126.2	55%	0.554	73%	0.733	S	S	*	*			cis	-167.5	155.5	-10.8	0	0	0	0	0	114.4
431	H	42	Very low	35.9	Very low	182 Å²	182	122.8 Å²	122.8	84%	0.843	73%	0.733	S	S	*	*			trans	58.2	152.3	155.6	-56.8	-42.6	0	0	0	119.4
432	S	38.3	Very low	36	Very low	94 Å²	94	124.5 Å²	124.5	66%	0.657	74%	0.74	S	S	*	*			cis	-148.4	131.5	1.9	-128	0	0	0	0	108.6
433	S	39.2	Very low	36.4	Very low	106 Å²	106	121.3 Å²	121.3	74%	0.741	73%	0.733	S	S	*	*				64.4	142.3	91.4	88.5	0	0	0	0	115.5
434	S	39.7	Very low	36.5	Very low	94 Å²	94	122.4 Å²	122.4	66%	0.657	74%	0.739	S	S	*	*			cis	-150.4	139.2	12.5	67.3	0	0	0	0	112.7
435	K	38.1	Very low	36.7	Very low	172 Å²	172	130.1 Å²	130.1	75%	0.748	74%	0.744	S	S	*	*				69.9	145.9	107.3	-61.2	-179.5	-178	179.3	0	116.3
436	F	35.5	Very low	36.4	Very low	187 Å²	187	129.1 Å²	129.1	82%	0.82	74%	0.74	S	S	*	*			cis	-126.9	155	22.8	-111.6	-91.2	0	0	0	115.1
437	T	32.1	Very low	36.4	Very low	114 Å²	114	127.9 Å²	127.9	70%	0.699	74%	0.742	S	S	*	*			trans	-113.2	-174.8	174.8	-22.4	0	0	0	0	109
438	V	33.5	Very low	36.2	Very low	117 Å²	117	126.8 Å²	126.8	71%	0.709	74%	0.743	S	S	*	*				-179.4	129.8	72.3	162.2	0	0	0	0	110.3
439	N	33.6	Very low	35.8	Very low	139 Å²	139	125.2 Å²	125.2	74%	0.743	74%	0.744	S	S	*	*			trans	44.7	157.6	145.5	-60.4	7.7	0	0	0	125.1
440	P	41	Very low	35.6	Very low	129 Å²	129	124.3 Å²	124.3	84%	0.838	74%	0.744	S	S	*	*			trans	-98.4	173.5	173.2	40.5	-36.7	0	0	0	113.9
441	G	34.7	Very low	35.8	Very low	75 Å²	75	126.9 Å²	126.9	77%	0.773	76%	0.755	S	S	*	*			trans	154.4	122.3	154.5	0	0	0	0	0	118.9
442	S	37.3	Very low	35.7	Very low	124 Å²	124	124.3 Å²	124.3	87%	0.867	75%	0.754	S	S	*	*			trans	82	137.6	146.6	-145.8	0	0	0	0	123.3
443	A	36.3	Very low	35.3	Very low	75 Å²	75	125 Å²	125	62%	0.62	76%	0.758	S	S	*	*			trans	65.2	105.4	145.5	0	0	0	0	0	123.1
444	T	33.2	Very low	34.8	Very low	139 Å²	139	126.1 Å²	126.1	85%	0.853	76%	0.761	S	S	*	*			trans	48.7	122.4	132.6	61.3	0	0	0	0	119.4
445	R	34.4	Very low	34.3	Very low	240 Å²	240	127.2 Å²	127.2	91%	0.906	76%	0.764	S	S	*	*				-172.4	157.8	73.8	172.8	169.5	161.2	-179.5	-6.1	112
446	S	32.3	Very low	33.7	Very low	100 Å²	100	125.1 Å²	125.1	70%	0.699	77%	0.765	S	S	*	*			trans	-47.5	156.6	175.7	-35.8	0	0	0	0	114.3
447	T	34.4	Very low	33.4	Very low	134 Å²	134	122.4 Å²	122.4	82%	0.822	76%	0.764	S	S	*	*			cis	-151.2	176.7	43.1	27.4	0	0	0	0	115.5
448	S	29.6	Very low	33.2	Very low	96 Å²	96	122.2 Å²	122.2	67%	0.671	76%	0.762	S	S	*	*			trans	-44.7	173.6	168.5	62.5	0	0	0	0	116.3
449	T	31.8	Very low	33	Very low	109 Å²	109	123.4 Å²	123.4	67%	0.669	77%	0.765	S	S	*	*			cis	-167.1	148.2	37.1	-26.8	0	0	0	0	113.2
450	T	31.5	Very low	32.9	Very low	118 Å²	118	124 Å²	124	72%	0.724	77%	0.768	S	S	*	*			trans	48.6	140.1	150.5	43.8	0	0	0	0	123
451	P	42.6	Very low	32.5	Very low	121 Å²	121	121.1 Å²	121.1	79%	0.786	76%	0.761	S	S	*	*			trans	-85.1	158.1	164.2	37.3	-34.7	0	0	0	112.7
452	P	41.1	Very low	32.4	Very low	127 Å²	127	121.8 Å²	121.8	83%	0.825	76%	0.76	S	S	*	*			trans	-123.3	161.3	158.1	37.8	-27.3	0	0	0	113.5
453	S	29.7	Very low	32.1	Very low	108 Å²	108	123 Å²	123	76%	0.755	76%	0.756	S	S	*	*			trans	-117.5	154.9	178.4	-52.5	0	0	0	0	111.7
454	T	27.9	Very low	32	Very low	130 Å²	130	127 Å²	127	80%	0.798	77%	0.767	S	S	*	*			trans	74.9	165.3	152.4	-45.7	0	0	0	0	117.2
455	V	28.9	Very low	32.2	Very low	118 Å²	118	129.5 Å²	129.5	72%	0.715	77%	0.767	S	S	*	*			trans	77.3	102.9	177.2	-164.5	0	0	0	0	112.5
456	T	27	Very low	32.4	Very low	127 Å²	127	123.8 Å²	123.8	78%	0.779	76%	0.76	S	S	*	*				77.3	152.1	58	-54.8	0	0	0	0	112.5
457	V	28.1	Very low	32.4	Very low	130 Å²	130	123.1 Å²	123.1	79%	0.788	76%	0.761	S	S	*	*			trans	96.9	134.5	-180	-178.5	0	0	0	0	114.1
458	V	29.3	Very low	32.4	Very low	110 Å²	110	122.8 Å²	122.8	67%	0.667	76%	0.758	S	S	*	*			cis	-169.5	142.1	-32.6	128.8	0	0	0	0	108.6
459	N	28.5	Very low	32.6	Very low	142 Å²	142	124.9 Å²	124.9	76%	0.759	76%	0.762	S	S	*	*			trans	59.7	171.3	168.7	-66.3	-5.3	0	0	0	116.5
460	N	30.9	Very low	32.8	Very low	153 Å²	153	125.9 Å²	125.9	82%	0.818	76%	0.762	S	S	*	*			cis	-151.3	162.3	4.3	-141.5	-2.8	0	0	0	111.8
461	G	33.3	Very low	32.9	Very low	67 Å²	67	127.5 Å²	127.5	69%	0.691	77%	0.765	S	S	*	*			trans	81.4	115.9	170	0	0	0	0	0	115.1
462	A	32.9	Very low	32.2	Very low	90 Å²	90	127.9 Å²	127.9	74%	0.744	77%	0.765	S	S	*	*			cis	86.3	115.7	24.9	0	0	0	0	0	116.1
463	N	30.8	Very low	32.1	Very low	148 Å²	148	127.2 Å²	127.2	79%	0.791	76%	0.761	S	S	*	*			trans	57.6	122.5	156.8	-54.9	-18.1	0	0	0	117.6
464	N	35.1	Very low	32.3	Very low	160 Å²	160	127.7 Å²	127.7	86%	0.856	76%	0.764	S	S	*	*				-163.3	167.3	55.6	-103.4	-42.4	0	0	0	115.5
465	K	37.1	Very low	32.5	Very low	192 Å²	192	126 Å²	126	84%	0.835	76%	0.757	S	S	*	*			trans	-87.3	160	166.9	-114.7	176.5	-176.1	178.2	0	110.4
466	P	38.1	Very low	32.4	Very low	119 Å²	119	125.6 Å²	125.6	77%	0.773	76%	0.759	S	S	*	*				-141.7	153.8	81.9	35	-15.8	0	0	0	114.6
467	A	31.8	Very low	32.5	Very low	86 Å²	86	125.4 Å²	125.4	71%	0.711	76%	0.757	S	S	*	*				57.9	131.5	104.5	0	0	0	0	0	114.9
468	V	35.5	Very low	32.6	Very low	127 Å²	127	124.8 Å²	124.8	77%	0.77	76%	0.759	S	S	*	*				-151.7	125.2	70.2	154.9	0	0	0	0	108.5
469	N	34	Very low	32.8	Very low	140 Å²	140	123.2 Å²	123.2	75%	0.749	77%	0.765	S	S	*	*				68.3	132.2	97	-136.7	14.6	0	0	0	112.5
470	I	34.6	Very low	32.9	Very low	131 Å²	131	121.5 Å²	121.5	67%	0.672	76%	0.764	S	S	*	*				-165.6	141.7	60.1	-84.9	-175.6	0	0	0	112.8
471	I	33.3	Very low	32.9	Very low	152 Å²	152	122.8 Å²	122.8	78%	0.779	77%	0.765	S	S	*	*			trans	67.2	142.6	156.1	-72.3	165.9	0	0	0	122.4
472	T	28.3	Very low	32.9	Very low	129 Å²	129	124.5 Å²	124.5	79%	0.791	77%	0.767	S	S	*	*			trans	-151.1	-155.7	170.2	-37.7	0	0	0	0	109.5
473	P	39.9	Very low	33	Very low	113 Å²	113	125.5 Å²	125.5	73%	0.734	77%	0.768	S	S	*	*				-94.6	171.4	-123.6	42.9	-31.8	0	0	0	117.1
474	S	33.6	Very low	33	Very low	118 Å²	118	121.6 Å²	121.6	83%	0.825	76%	0.763	S	S	*	*			trans	179.1	173.7	158.7	-81.5	0	0	0	0	109.3
475	S	32.7	Very low	33	Very low	94 Å²	94	120.4 Å²	120.4	66%	0.657	76%	0.761	S	S	*	*			cis	-176.6	136.8	-48.7	58	0	0	0	0	108.3
476	C	25.3	Very low	32.9	Very low	110 Å²	110	117.6 Å²	117.6	74%	0.743	76%	0.761	S	S	*	*			trans	36	148.6	158.4	56.2	0	0	0	0	124.7
477	T	29.7	Very low	32.7	Very low	122 Å²	122	115.1 Å²	115.1	75%	0.748	76%	0.757	S	S	*	*			trans	71.5	113.6	148	41.5	0	0	0	0	123.1
478	S	31.2	Very low	32.9	Very low	117 Å²	117	117.1 Å²	117.1	82%	0.818	76%	0.76	S	S	*	*				67.9	108.6	121.3	-50.9	0	0	0	0	123.3
479	G	31.7	Very low	32.9	Very low	77 Å²	77	116 Å²	116	79%	0.794	76%	0.758	S	S	*	*			trans	75.7	168.9	152.5	0	0	0	0	0	117
480	S	31.7	Very low	32.8	Very low	106 Å²	106	114.8 Å²	114.8	74%	0.741	76%	0.756	S	S	*	*			cis	-172.4	155.3	-22.8	43.7	0	0	0	0	109.5
481	E	31.1	Very low	32.9	Very low	181 Å²	181	115.9 Å²	115.9	85%	0.846	76%	0.761	S	S	*	*			trans	70.1	125.8	172.4	-61.4	175.8	173.6	0	0	115.4
482	S	33	Very low	33	Very low	103 Å²	103	113.4 Å²	113.4	72%	0.72	76%	0.757	S	S	*	*				84.9	151.1	76.2	110.7	0	0	0	0	113.3
483	S	34.2	Very low	33.4	Very low	111 Å²	111	113 Å²	113	78%	0.776	76%	0.757	S	S	*	*			cis	-162.6	169.3	1.3	29.8	0	0	0	0	112.3
484	G	31.9	Very low	33.2	Very low	66 Å²	66	115 Å²	115	68%	0.68	76%	0.76	S	S	*	*			trans	85.7	153.7	172.1	0	0	0	0	0	115.3
485	T	34.6	Very low	33.2	Very low	135 Å²	135	114.4 Å²	114.4	83%	0.828	76%	0.756	S	S	*	*			cis	-169.5	164.4	-7.7	-3.4	0	0	0	0	107.2
486	T	35	Very low	33.4	Very low	133 Å²	133	115.8 Å²	115.8	82%	0.816	76%	0.763	S	S	*	*			cis	-157.7	149.6	12.6	-23	0	0	0	0	110.2
487	G	34.2	Very low	33.9	Very low	67 Å²	67	117.6 Å²	117.6	69%	0.691	77%	0.77	S	S	*	*			trans	77	161.4	156.8	0	0	0	0	0	118.4
488	T	34.8	Very low	33.8	Very low	128 Å²	128	117.1 Å²	117.1	79%	0.785	77%	0.771	S	S	*	*			cis	-159.3	146.8	-12.6	-50.9	0	0	0	0	109
489	S	35.4	Very low	33.9	Very low	102 Å²	102	119.4 Å²	119.4	71%	0.713	77%	0.774	S	S	*	*			trans	64	148.2	162.8	37.4	0	0	0	0	117.7
490	T	33.8	Very low	33.9	Very low	115 Å²	115	119.9 Å²	119.9	71%	0.706	77%	0.77	S	S	*	*			cis	-162.9	147.3	-0.9	10.5	0	0	0	0	110.4
491	I	36.9	Very low	34	Very low	154 Å²	154	119.9 Å²	119.9	79%	0.79	77%	0.77	S	S	*	*			trans	64	144.5	143.9	-65.5	163.9	0	0	0	118.6
492	S	33.8	Very low	34	Very low	100 Å²	100	117 Å²	117	70%	0.699	77%	0.765	S	S	*	*			cis	-167.7	158.4	-29.1	-85.5	0	0	0	0	108.5
493	P	37	Very low	33.9	Very low	121 Å²	121	118.7 Å²	118.7	79%	0.786	77%	0.766	S	S	*	*			trans	-104.2	138.2	-177.8	37.2	-31.1	0	0	0	115
494	I	36.2	Very low	33.7	Very low	156 Å²	156	117.9 Å²	117.9	80%	0.8	76%	0.756	S	S	*	*			trans	-147.5	109.5	171.7	-58.9	-176.7	0	0	0	106.3
495	S	32.3	Very low	33.8	Very low	105 Å²	105	125.1 Å²	125.1	73%	0.734	76%	0.764	S	S	*	*				75.4	138.2	78.1	-58.3	0	0	0	0	114.8
496	P	38.1	Very low	33.6	Very low	123 Å²	123	123.7 Å²	123.7	80%	0.799	76%	0.76	S	S	*	*			trans	-88.3	157.5	-175.9	36.3	-36.3	0	0	0	113.4
497	V	35.1	Very low	33.6	Very low	147 Å²	147	122.7 Å²	122.7	89%	0.891	76%	0.758	S	S	*	*			trans	-150.9	148.2	163.6	-109	0	0	0	0	111.1
498	S	27.3	Very low	33.6	Very low	112 Å²	112	125.1 Å²	125.1	78%	0.783	77%	0.765	S	S	*	*			trans	-112.8	138.7	-180	-52.4	0	0	0	0	111.7
499	L	33.4	Very low	33.6	Very low	166 Å²	166	125.1 Å²	125.1	87%	0.869	77%	0.77	S	S	*	*			trans	-134.9	115	145.7	-77.1	99.8	0	0	0	105.7
500	A	32.2	Very low	33.5	Very low	86 Å²	86	123.6 Å²	123.6	71%	0.711	77%	0.77	S	S	*	*				63.4	118.2	81.9	0	0	0	0	0	111.2
501	S	32.9	Very low	33.3	Very low	107 Å²	107	126.2 Å²	126.2	75%	0.748	78%	0.78	S	S	*	*			cis	-146.3	152.2	48.4	-56	0	0	0	0	114.9
502	T	31.6	Very low	33.1	Very low	119 Å²	119	123 Å²	123	73%	0.73	78%	0.777	S	S	*	*			trans	20.7	134.1	146.3	56.5	0	0	0	0	119.9
503	N	31.7	Very low	32.9	Very low	140 Å²	140	125.2 Å²	125.2	75%	0.749	78%	0.78	S	S	*	*			cis	-155.5	161.1	18.9	-113.6	-7.4	0	0	0	114.7
504	T	29.4	Very low	32.8	Very low	93 Å²	93	124.1 Å²	124.1	57%	0.571	77%	0.771	S	S	*	*			trans	-26.6	145.7	158.9	50.7	0	0	0	0	115.7
505	Y	33.3	Very low	32.6	Very low	218 Å²	218	122.2 Å²	122.2	86%	0.855	76%	0.763	S	S	*	*				-148.8	165.1	50.5	-95.3	-83.2	0	0	0	116.2
506	S	31.4	Very low	32.6	Very low	106 Å²	106	127.2 Å²	127.2	74%	0.741	77%	0.767	S	S	*	*			trans	-74	146.3	-175.7	52.3	0	0	0	0	117.3
507	S	34.6	Very low	32.3	Very low	111 Å²	111	127.7 Å²	127.7	78%	0.776	76%	0.763	S	S	*	*				-163.1	121.6	127.8	60.4	0	0	0	0	113.7
508	S	34.6	Very low	32.2	Very low	118 Å²	118	126.4 Å²	126.4	83%	0.825	76%	0.756	S	S	*	*			trans	6.8	119.3	156.4	54.8	0	0	0	0	120.3
509	S	35.3	Very low	32.5	Very low	129 Å²	129	126 Å²	126	90%	0.902	76%	0.759	S	S	*	*			trans	-84.9	145.5	158.4	49.9	0	0	0	0	111.8
510	G	31.9	Very low	32.6	Very low	69 Å²	69	124.1 Å²	124.1	71%	0.711	75%	0.749	S	S	*	*			trans	-159	148.2	177.2	0	0	0	0	0	111.6	A512	G510-A512 PolarHBondContact O-N 3Å
511	N	29.6	Very low	32.6	Very low	171 Å²	171	127.2 Å²	127.2	91%	0.914	75%	0.754	S	S	*	*			trans	-47.4	104	-167	-68.4	-16.6	0	0	0	115.4	N513	N511-N513 PolarHBondContact O-N 3.1Å
512	A	32.9	Very low	32.6	Very low	87 Å²	87	126 Å²	126	72%	0.719	75%	0.75	S	S	*	*			trans	-84.2	86.6	166.2	0	0	0	0	0	110.3	G510 V514	G510-A512 PolarHBondContact O-N 3Å; A512-V514 VanDerWaalsContact C-N 3.34Å; A512-V514 HydrophobicContact CB-CG2 4.18Å; A512-V514 PolarHBondContact O-N 3.17Å
513	N	30	Very low	32.7	Very low	145 Å²	145	127.8 Å²	127.8	78%	0.775	75%	0.754	S	S	*	*			trans	-76.2	87.3	167.5	-171.6	16.6	0	0	0	108.8	N511 N515	N511-N513 PolarHBondContact O-N 3.1Å; N513-N515 PolarHBondContact O-N 3.22Å
514	V	35.7	Very low	32.7	Very low	98 Å²	98	130.6 Å²	130.6	59%	0.594	76%	0.762	S	S	*	*			trans	-73.5	90.4	-169.6	-175	0	0	0	0	111.4	A512 Y516	A512-V514 VanDerWaalsContact C-N 3.34Å; A512-V514 HydrophobicContact CB-CG2 4.18Å; A512-V514 PolarHBondContact O-N 3.17Å; V514-Y516 HydrophobicContact CG1-CD2 4.36Å; V514-Y516 HydrophobicContact CG1-CE2 4.23Å; V514-Y516 PolarHBondContact O-N 3.31Å; V514-Y516 VanDerWaalsContact O-N 3.16Å
515	N	31.4	Very low	32.6	Very low	117 Å²	117	130.7 Å²	130.7	63%	0.626	77%	0.773	S	S	*	*			trans	-62.5	108.3	163.7	-89.8	-34.6	0	0	0	110.1	N513 N517	N513-N515 PolarHBondContact O-N 3.22Å; N515-N517 PolarHBondContact O-N 3.28Å
516	Y	32.2	Very low	32.5	Very low	209 Å²	209	125.2 Å²	125.2	82%	0.82	77%	0.766	S	S	*	*	S	Bend	trans	-71.3	65.2	165.2	-79.6	-91.3	0	0	0	110.8	V514	V514-Y516 HydrophobicContact CG1-CD2 4.36Å; V514-Y516 HydrophobicContact CG1-CE2 4.23Å; V514-Y516 PolarHBondContact O-N 3.31Å; V514-Y516 VanDerWaalsContact O-N 3.16Å
517	N	32.2	Very low	32.5	Very low	134 Å²	134	125.9 Å²	125.9	72%	0.717	77%	0.769	S	S	*	*			trans	-147.2	45	-174.2	-87.8	-55.9	0	0	0	113.5	N515	N515-N517 PolarHBondContact O-N 3.28Å
518	T	33	Very low	32.4	Very low	120 Å²	120	126.7 Å²	126.7	74%	0.736	77%	0.772	S	S	*	*	S	Bend	trans	-135.4	-25.7	173.8	-32	0	0	0	0	114.5	L520	T518-L520 VanDerWaalsContact C-N 3.34Å; T518-L520 PolarHBondContact O-N 2.91Å
519	A	32.4	Very low	32.2	Very low	102 Å²	102	126.8 Å²	126.8	84%	0.843	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-6.9	-173.7	0	0	0	0	0	115.6
520	L	35.7	Very low	32.1	Very low	128 Å²	128	126.1 Å²	126.1	67%	0.67	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	-8.8	-176.2	-101.4	167.2	0	0	0	115.1	T518	T518-L520 VanDerWaalsContact C-N 3.34Å; T518-L520 PolarHBondContact O-N 2.91Å
521	N	32.4	Very low	32.2	Very low	151 Å²	151	129.9 Å²	129.9	81%	0.807	77%	0.772	S	S	*	*	S	Bend	trans	-110.8	50.6	-174.9	-66.6	-14.5	0	0	0	112.1
522	A	33	Very low	32.5	Very low	82 Å²	82	128.8 Å²	128.8	68%	0.678	77%	0.771	S	S	*	*	S	Bend	trans	-141.2	5.1	-175.5	0	0	0	0	0	115.9
523	I	33.3	Very low	32.5	Very low	155 Å²	155	132.7 Å²	132.7	80%	0.795	78%	0.775	S	S	*	*			trans	-134.3	51.5	178.7	-40.2	-179	0	0	0	111.4
524	E	31.3	Very low	32.6	Very low	199 Å²	199	130.6 Å²	130.6	93%	0.93	77%	0.771	S	S	*	*			trans	-120.8	51.1	169.5	-71.7	-160.1	129	0	0	111.2
525	A	29.2	Very low	32.5	Very low	96 Å²	96	132.6 Å²	132.6	79%	0.793	78%	0.777	S	S	*	*			trans	-145.9	21.4	-170.6	0	0	0	0	0	116.9
526	S	30.8	Very low	32.5	Very low	103 Å²	103	135.4 Å²	135.4	72%	0.72	78%	0.784	S	S	*	*			trans	-150.4	60.2	-175.4	64.1	0	0	0	0	116.1
527	C	30.1	Very low	32.5	Very low	119 Å²	119	132.3 Å²	132.3	80%	0.804	78%	0.781	S	S	*	*			trans	-152.6	107.3	157.8	-109.6	0	0	0	0	109.6	S529	C527-S529 PolarHBondContact O-N 3.49Å
528	P	34.4	Very low	32.6	Very low	128 Å²	128	132.3 Å²	132.3	83%	0.831	78%	0.778	S	S	*	*			trans	-77.9	110.3	-175	29.7	-33.5	0	0	0	112	S530	P528-S530 PolarHBondContact O-N 2.81Å
529	S	29.7	Very low	32.6	Very low	120 Å²	120	135.9 Å²	135.9	84%	0.839	78%	0.778	S	S	*	*			trans	-75.5	102.6	169.3	-63.5	0	0	0	0	110.7	C527	C527-S529 PolarHBondContact O-N 3.49Å
530	S	33.7	Very low	32.7	Very low	115 Å²	115	137.5 Å²	137.5	80%	0.804	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-94.3	124	169.3	47.5	0	0	0	0	111.1	P528	P528-S530 PolarHBondContact O-N 2.81Å
531	N	33.7	Very low	32.6	Very low	148 Å²	148	138.7 Å²	138.7	79%	0.791	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-72.7	154.2	-179.2	-61.8	-57.1	0	0	0	111.9
532	V	36.4	Very low	32.6	Very low	149 Å²	149	139 Å²	139	90%	0.903	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-93.8	131	149.2	178.8	0	0	0	0	107.3
533	E	31.6	Very low	32.7	Very low	169 Å²	169	141.9 Å²	141.9	79%	0.79	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-79.8	166.3	-165.2	-53.8	164.9	94	0	0	113.7
534	S	33.6	Very low	32.5	Very low	100 Å²	100	145.3 Å²	145.3	70%	0.699	79%	0.792	S	S	*	*				-165.9	116	118.1	-86.3	0	0	0	0	114.3
535	I	32.3	Very low	32.6	Very low	141 Å²	141	139.9 Å²	139.9	72%	0.723	78%	0.781	S	S	*	*				64.6	117.2	129.1	-58	166.5	0	0	0	115.7
536	K	32.7	Very low	32.9	Very low	175 Å²	175	140.2 Å²	140.2	76%	0.761	78%	0.778	S	S	*	*				-173.9	137.4	65.5	-142.4	156.2	-170.6	175	0	113.1
537	L	30.9	Very low	33.1	Very low	145 Å²	145	142.9 Å²	142.9	76%	0.759	78%	0.784	S	S	*	*			trans	64	146.2	159	-62.1	157.7	0	0	0	116.8
538	M	34.5	Very low	33.4	Very low	134 Å²	134	148.6 Å²	148.6	66%	0.66	79%	0.789	S	S	*	*			cis	-153.9	148.7	13.8	-138.4	178.7	-150.8	0	0	112.4
539	R	33.4	Very low	33.6	Very low	195 Å²	195	148.8 Å²	148.8	74%	0.736	79%	0.79	S	S	*	*			trans	63.5	119.4	160.6	-73.6	-179.1	169.6	96.4	-0.8	120.5
540	N	33.4	Very low	34	Very low	135 Å²	135	146.7 Å²	146.7	72%	0.722	79%	0.787	S	S	*	*				42.1	128.6	125.7	-51.9	22.5	0	0	0	118.6
541	D	35.3	Very low	33.9	Very low	153 Å²	153	152.2 Å²	152.2	82%	0.818	79%	0.79	S	S	*	*				-147.3	-175	57.4	-95.3	-42.6	0	0	0	115.3
542	L	31.2	Very low	34	Very low	157 Å²	157	153.1 Å²	153.1	82%	0.822	79%	0.79	S	S	*	*			trans	-97.6	179.6	-167.7	-97.2	75.6	0	0	0	115.2
543	V	34.9	Very low	34	Very low	143 Å²	143	152.7 Å²	152.7	87%	0.867	78%	0.778	S	S	*	*			trans	87.9	136.6	166.2	-170	0	0	0	0	115.2
544	R	30.5	Very low	34	Very low	227 Å²	227	149.7 Å²	149.7	86%	0.857	78%	0.775	S	S	*	*			cis	168.1	142	-44.1	168.5	176.5	-177.7	176.8	2.4	107
545	A	33.2	Very low	34.1	Very low	86 Å²	86	150.2 Å²	150.2	71%	0.711	78%	0.779	S	S	*	*			trans	70.7	148.4	171.8	0	0	0	0	0	115.1
546	S	34.1	Very low	34.4	Very low	102 Å²	102	152.6 Å²	152.6	71%	0.713	78%	0.779	S	S	*	*			cis	-160.7	178	-6.8	-123.2	0	0	0	0	113.2
547	D	34.7	Very low	34.5	Very low	160 Å²	160	152.3 Å²	152.3	86%	0.856	78%	0.784	S	S	*	*			trans	89	135.6	154.7	-59.5	-17.3	0	0	0	122.1
548	R	37	Very low	34.7	Very low	239 Å²	239	153.6 Å²	153.6	90%	0.902	79%	0.791	S	S	*	*			trans	-161.6	135.4	179.4	-140.1	-173.3	-168.3	-172.6	5.9	105.7
549	P	39.3	Very low	34.6	Very low	132 Å²	132	151.6 Å²	151.6	86%	0.857	80%	0.795	S	S	*	*				-144.3	-179.3	106	35.1	-17.9	0	0	0	111.6
550	G	37.3	Very low	34.7	Very low	75 Å²	75	153.9 Å²	153.9	77%	0.773	80%	0.804	S	S	*	*			cis	-152.7	-174.9	1.8	0	0	0	0	0	111.6
551	R	32	Very low	34.6	Very low	232 Å²	232	155.5 Å²	155.5	88%	0.875	81%	0.812	S	S	*	*			trans	-146.3	96.2	-173.7	-177.5	-169.8	-177.1	-173.1	2.2	111.2
552	E	37	Very low	34.4	Very low	166 Å²	166	160.4 Å²	160.4	78%	0.776	82%	0.819	S	S	*	*			trans	-128.8	132.2	166.2	-69.8	-164.9	101.6	0	0	109.5	R556	E552-R556 IonicContact OE1-NH2 3.94Å
553	E	34.8	Very low	34.4	Very low	141 Å²	141	156.8 Å²	156.8	66%	0.659	82%	0.82	S	S	*	*	S	Bend	trans	169.5	-33	144.9	-158	58.9	-99.8	0	0	109.1	S555	E553-S555 VanDerWaalsContact C-N 3.27Å; E553-S555 PolarHBondContact O-N 3.44Å
554	S	32.5	Very low	34.4	Very low	105 Å²	105	159.5 Å²	159.5	73%	0.734	82%	0.82	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	50.3	-174.2	-44.9	0	0	0	0	116
555	S	34.7	Very low	34.6	Very low	112 Å²	112	154.5 Å²	154.5	78%	0.783	82%	0.815	S	S	*	*	T	Hydrogen-bonded Turn	trans	-156.4	6.5	169.7	-81.3	0	0	0	0	117.9	E553	E553-S555 VanDerWaalsContact C-N 3.27Å; E553-S555 PolarHBondContact O-N 3.44Å
556	R	38.1	Very low	34.5	Very low	190 Å²	190	158.3 Å²	158.3	72%	0.717	82%	0.823	S	S	*	*	S	Bend	trans	-93.6	2.3	-168	-77.5	-176.4	175.1	155.1	4.3	118.6	E552	E552-R556 IonicContact OE1-NH2 3.94Å
557	I	36.8	Very low	34.3	Very low	170 Å²	170	162 Å²	162	87%	0.872	83%	0.83	S	S	*	*	S	Bend	trans	-128.6	43.1	-178.6	-36.3	-177.8	0	0	0	113.3
558	L	33.9	Very low	34.1	Very low	172 Å²	172	163 Å²	163	90%	0.901	83%	0.831	S	S	*	*	S	Bend	trans	-144.3	12.5	169.6	-118	170.9	0	0	0	114.9
559	A	32.8	Very low	34	Very low	91 Å²	91	156.5 Å²	156.5	75%	0.752	83%	0.828	S	S	*	*			trans	-129.8	77.2	-176.3	0	0	0	0	0	111.9
560	R	34.5	Very low	33.7	Very low	243 Å²	243	156.6 Å²	156.6	92%	0.917	83%	0.827	S	S	*	*	S	Bend	trans	-155.3	2.9	168	-126.2	171.1	-173.2	156.3	4.1	117.5
561	L	32.6	Very low	33.7	Very low	170 Å²	170	158.5 Å²	158.5	89%	0.89	83%	0.825	S	S	*	*	S	Bend	trans	-141.9	64.5	177.9	-76.9	176.3	0	0	0	112.3
562	R	31.6	Very low	33.6	Very low	256 Å²	256	153.4 Å²	153.4	97%	0.966	82%	0.82	S	S	*	*	S	Bend	trans	168.8	133.9	156	-97.3	164.2	-172.2	-164.6	2	107
563	G	30.8	Very low	33.4	Very low	81 Å²	81	152.2 Å²	152.2	84%	0.835	82%	0.824	S	S	*	*			trans	136.1	43.5	-175.2	0	0	0	0	0	114.8
564	F	35.3	Very low	33.3	Very low	199 Å²	199	149.2 Å²	149.2	87%	0.873	83%	0.83	S	S	*	*			trans	-92.2	107.9	155.7	-108.2	-82.2	0	0	0	107.8
565	T	34.3	Very low	33.3	Very low	123 Å²	123	148 Å²	148	76%	0.755	84%	0.835	S	S	*	*			trans	41.7	107.3	151.1	56.1	0	0	0	0	118.7
566	D	30	Very low	33.2	Very low	165 Å²	165	146.9 Å²	146.9	88%	0.882	84%	0.841	S	S	*	*			trans	-153	109.7	144.1	-143.4	-7.4	0	0	0	110.5
567	E	30.9	Very low	33.2	Very low	181 Å²	181	141.5 Å²	141.5	85%	0.846	85%	0.845	S	S	*	*			trans	174.9	162.8	146.7	-101.7	-152.1	125.6	0	0	111.8
568	M	31.1	Very low	33.1	Very low	179 Å²	179	141 Å²	141	88%	0.882	84%	0.843	S	S	*	*			trans	71.3	70	171.9	-56.2	-165.8	-177.8	0	0	119.1
569	A	33.9	Very low	33.1	Very low	103 Å²	103	139 Å²	139	85%	0.851	84%	0.838	S	S	*	*			trans	-160.9	138.4	132.1	0	0	0	0	0	112.7
570	T	33.2	Very low	33.3	Very low	135 Å²	135	138.8 Å²	138.8	83%	0.828	84%	0.837	S	S	*	*			trans	-112.7	171	165.2	56.4	0	0	0	0	108.6
571	P	37.2	Very low	33.3	Very low	114 Å²	114	137 Å²	137	74%	0.74	83%	0.831	S	S	*	*			cis	-134.4	-155.2	-6	29.7	-4.2	0	0	0	113
572	V	30.3	Very low	34	Very low	125 Å²	125	134 Å²	134	76%	0.758	82%	0.822	S	S	*	*			trans	88.6	101.4	149.8	170.5	0	0	0	0	120.7
573	V	31.5	Very low	34.4	Very low	141 Å²	141	128.4 Å²	128.4	86%	0.855	81%	0.811	S	S	*	*			trans	67	122	131	-178.7	0	0	0	0	122.6
574	G	32.9	Very low	35	Very low	78 Å²	78	130.7 Å²	130.7	80%	0.804	81%	0.809	S	S	*	*			trans	112.7	125.9	140.8	0	0	0	0	0	116.5
575	G	32.8	Very low	35.3	Very low	80 Å²	80	127.2 Å²	127.2	83%	0.825	81%	0.806	S	S	*	*			cis	174.2	157.4	-7.8	0	0	0	0	0	113.5
576	G	32.3	Very low	35.5	Very low	89 Å²	89	124.7 Å²	124.7	92%	0.918	81%	0.805	S	S	*	*			trans	95.3	144.1	178.5	0	0	0	0	0	114.3
577	G	38	Very low	35.9	Very low	77 Å²	77	126 Å²	126	79%	0.794	81%	0.805	S	S	*	*			cis	-126.4	-167.2	1.1	0	0	0	0	0	114
578	L	35.4	Very low	35.8	Very low	158 Å²	158	128.7 Å²	128.7	83%	0.827	81%	0.808	S	S	*	*			trans	-124.1	141.4	-155.4	-73	168.1	0	0	0	116.3
579	T	34.8	Very low	36.2	Very low	131 Å²	131	126.3 Å²	126.3	80%	0.804	80%	0.804	S	S	*	*			trans	66.2	152.4	144.4	56.1	0	0	0	0	119.8
580	A	35.5	Very low	36.1	Very low	87 Å²	87	125.9 Å²	125.9	72%	0.719	79%	0.794	S	S	*	*			cis	-147.7	155.4	5.7	0	0	0	0	0	114.9
581	Y	35.8	Very low	36.3	Very low	205 Å²	205	126.5 Å²	126.5	80%	0.804	79%	0.791	S	S	*	*			trans	-6.3	165.4	142.4	-69.7	-71.9	0	0	0	121.7
582	P	46.6	Very low	36.1	Very low	106 Å²	106	128.5 Å²	128.5	69%	0.688	80%	0.795	S	S	*	*			cis	-147.6	155.3	28.2	42.1	-21.7	0	0	0	121.7
583	N	40.2	Very low	36.2	Very low	139 Å²	139	127.3 Å²	127.3	74%	0.743	80%	0.799	S	S	*	*			trans	61.8	158.3	136.3	-69.8	-18.1	0	0	0	122.4
584	V	43.5	Very low	36.3	Very low	130 Å²	130	124.4 Å²	124.4	79%	0.788	80%	0.797	S	S	*	*			cis	-145.2	164.2	1.7	-117.1	0	0	0	0	112
585	P	41.8	Very low	36.2	Very low	125 Å²	125	127.2 Å²	127.2	81%	0.812	80%	0.799	S	S	*	*			trans	-137.5	-172.1	-157.9	45.6	-29.1	0	0	0	118.2
586	G	38.3	Very low	36.1	Very low	71 Å²	71	127.9 Å²	127.9	73%	0.732	79%	0.791	S	S	*	*			trans	103.6	160.1	155.2	0	0	0	0	0	116.7
587	Q	37.2	Very low	35.9	Very low	192 Å²	192	129.5 Å²	129.5	90%	0.897	78%	0.783	S	S	*	*			cis	-149.6	144.7	-15.6	-79.7	177.3	-21.2	0	0	105.7
588	R	30.6	Very low	35.7	Very low	238 Å²	238	131.3 Å²	131.3	90%	0.898	78%	0.779	S	S	*	*				76.9	145.4	59.8	-145.2	-179.6	-164.2	-118.1	3.3	114.6
589	T	38.6	Very low	36	Very low	129 Å²	129	135.5 Å²	135.5	79%	0.791	78%	0.783	S	S	*	*			trans	80.8	140.2	-167.3	77.4	0	0	0	0	115
590	S	32	Very low	35.9	Very low	94 Å²	94	133.6 Å²	133.6	66%	0.657	77%	0.773	S	S	*	*			cis	113.7	141.3	-6.3	78.6	0	0	0	0	117.1
591	I	37.7	Very low	35.6	Very low	147 Å²	147	135 Å²	135	75%	0.754	77%	0.773	S	S	*	*			trans	104.4	125	160.1	-59.8	161.9	0	0	0	117.1
592	D	33.4	Very low	35.3	Very low	156 Å²	156	131.1 Å²	131.1	83%	0.834	77%	0.771	S	S	*	*			trans	54.8	147.4	152.8	-62.6	-12.5	0	0	0	127.6
593	A	31.3	Very low	34.4	Very low	101 Å²	101	129.7 Å²	129.7	84%	0.835	77%	0.768	S	S	*	*			trans	-47.8	152.5	169.1	0	0	0	0	0	116.3
594	G	33	Very low	34.1	Very low	79 Å²	79	127 Å²	127	81%	0.814	77%	0.773	S	S	*	*			trans	-160.1	92.4	174	0	0	0	0	0	112.2
595	T	30.9	Very low	33.6	Very low	137 Å²	137	126.8 Å²	126.8	84%	0.84	76%	0.763	S	S	*	*			trans	-62.2	158.7	178.8	-42	0	0	0	0	113
596	S	30.5	Very low	33	Very low	94 Å²	94	130.9 Å²	130.9	66%	0.657	76%	0.763	S	S	*	*			trans	88.8	113.7	146.7	-118.8	0	0	0	0	120.8
597	T	29.8	Very low	33.1	Very low	123 Å²	123	137.2 Å²	137.2	76%	0.755	77%	0.77	S	S	*	*				77.4	177.6	123.4	-54.4	0	0	0	0	117.1
598	V	33.7	Very low	32.8	Very low	116 Å²	116	132.8 Å²	132.8	70%	0.703	76%	0.758	S	S	*	*			trans	73.8	68.7	174.8	-163.7	0	0	0	0	115.4
599	R	41.2	Very low	33.1	Very low	245 Å²	245	127.4 Å²	127.4	93%	0.925	75%	0.746	S	S	*	*			trans	-49.9	138.6	131.5	-152.8	-166	-166.4	-159.1	6.2	107.1
600	P	33	Very low	32.7	Very low	91 Å²	91	127.1 Å²	127.1	59%	0.591	75%	0.746	S	S	*	*				-155.5	-173.5	100.4	40.1	-19.2	0	0	0	114.7
601	T	28.6	Very low	32.5	Very low	118 Å²	118	128.1 Å²	128.1	72%	0.724	74%	0.743	S	S	*	*			trans	16	150.7	139.1	61.8	0	0	0	0	121.5
602	T	28.7	Very low	32	Very low	122 Å²	122	127.3 Å²	127.3	75%	0.748	75%	0.745	S	S	*	*			cis	-175.7	156.8	-4	-96.7	0	0	0	0	109.7
603	A	28.8	Very low	31.6	Very low	77 Å²	77	124.2 Å²	124.2	64%	0.636	74%	0.735	S	S	*	*			trans	36.5	113.4	158.6	0	0	0	0	0	120.8	Q605	A603-Q605 HydrophobicContact CB-CG 3.99Å
604	G	34	Very low	31.4	Very low	81 Å²	81	128.8 Å²	128.8	84%	0.835	74%	0.739	S	S	*	*			trans	-144.6	46.1	156.8	0	0	0	0	0	110.7
605	Q	32.1	Very low	31.1	Very low	126 Å²	126	128.3 Å²	128.3	59%	0.589	74%	0.735	S	S	*	*				68.1	120.3	97.7	-83.3	-134.4	7.9	0	0	115.6	A603	A603-Q605 HydrophobicContact CB-CG 3.99Å
606	R	30.6	Very low	31	Very low	211 Å²	211	130.8 Å²	130.8	80%	0.796	74%	0.742	S	S	*	*			trans	67.3	134.8	152.8	-59.9	172.1	175.9	172.4	0.9	115.1
607	K	39.7	Very low	30.9	Very low	204 Å²	204	129.6 Å²	129.6	89%	0.887	74%	0.744	S	S	*	*			cis	-129.6	164.7	45.9	-74.9	174.2	175	175.4	0	115.5
608	P	31.5	Very low	31	Very low	99 Å²	99	128.1 Å²	128.1	64%	0.643	75%	0.745	S	S	*	*			trans	-131.1	-174.4	-163.4	41.9	-23.1	0	0	0	114.9
609	I	35.6	Very low	30.9	Very low	125 Å²	125	129.5 Å²	129.5	64%	0.641	75%	0.748	S	S	*	*			trans	43.6	118.2	137.9	-70.6	165.7	0	0	0	117.6	I611	I609-I611 HydrophobicContact CB-CD1 4.49Å; I609-I611 HydrophobicContact CD1-CD1 3.99Å; I609-I611 HydrophobicContact CG1-CD1 3.99Å; I609-I611 HydrophobicContact CG1-CG1 4.29Å; I609-I611 HydrophobicContact CG2-CB 4Å; I609-I611 HydrophobicContact CG2-CD1 3.68Å; I609-I611 HydrophobicContact CG2-CG1 3.84Å
610	P	30.7	Very low	30.3	Very low	124 Å²	124	122.4 Å²	122.4	81%	0.805	73%	0.732	S	S	*	*				-118.9	153.9	77.7	-3	25.1	0	0	0	112.9
611	I	28.2	Very low	30.1	Very low	115 Å²	115	126.8 Å²	126.8	59%	0.59	74%	0.742	S	S	*	*			cis	67.4	131.8	16.5	-56.9	-175.4	0	0	0	115.5	I609	I609-I611 HydrophobicContact CB-CD1 4.49Å; I609-I611 HydrophobicContact CD1-CD1 3.99Å; I609-I611 HydrophobicContact CG1-CD1 3.99Å; I609-I611 HydrophobicContact CG1-CG1 4.29Å; I609-I611 HydrophobicContact CG2-CB 4Å; I609-I611 HydrophobicContact CG2-CD1 3.68Å; I609-I611 HydrophobicContact CG2-CG1 3.84Å
612	T	26	Very low	30	Very low	129 Å²	129	125.7 Å²	125.7	79%	0.791	74%	0.739	S	S	*	*			trans	61.5	145.7	174.7	41.3	0	0	0	0	116.4
613	S	26	Very low	30.6	Very low	91 Å²	91	125.5 Å²	125.5	64%	0.636	74%	0.743	S	S	*	*			cis	-172.3	155.3	-19.2	43	0	0	0	0	110.6
614	Q	26.7	Very low	30.7	Very low	197 Å²	197	126.7 Å²	126.7	92%	0.921	74%	0.744	S	S	*	*			trans	44.3	119.6	148.6	-66.8	179.6	-3.9	0	0	120.3
615	G	27.7	Very low	30.3	Very low	70 Å²	70	129.5 Å²	129.5	72%	0.722	74%	0.74	S	S	*	*			trans	113.7	135.2	137.4	0	0	0	0	0	117
616	L	28.3	Very low	30	Very low	189 Å²	189	127.8 Å²	127.8	99%	0.99	74%	0.742	S	S	*	*			trans	62.9	130.3	159	-45.3	174.9	0	0	0	116.3
617	G	28.7	Very low	29.9	Very low	68 Å²	68	124.2 Å²	124.2	70%	0.701	74%	0.739	S	S	*	*			cis	163.2	157	-2.4	0	0	0	0	0	109.8
618	A	31.9	Very low	29.3	Very low	93 Å²	93	119.5 Å²	119.5	77%	0.769	73%	0.731	S	S	*	*			trans	62.9	148.2	-177.6	0	0	0	0	0	115.7
619	N	31	Very low	29.2	Very low	144 Å²	144	118.9 Å²	118.9	77%	0.77	74%	0.735	S	S	*	*			cis	-155.4	149	-12.8	-92.8	-16.2	0	0	0	106
620	T	29.2	Very low	28.9	Very low	97 Å²	97	122 Å²	122	60%	0.595	75%	0.749	S	S	*	*			cis	-163.7	148.6	-7.9	13.8	0	0	0	0	109.5
621	K	28	Very low	28.9	Very low	183 Å²	183	119.7 Å²	119.7	80%	0.796	74%	0.74	S	S	*	*			trans	57.9	108.8	143.7	-64.6	168	-176	177.5	0	118.2
622	S	26.7	Very low	29	Very low	95 Å²	95	125.1 Å²	125.1	66%	0.664	75%	0.753	S	S	*	*				89.2	126.7	50.8	73.5	0	0	0	0	114.7
623	S	40.3	Very low	29.4	Very low	118 Å²	118	129 Å²	129	83%	0.825	75%	0.753	S	S	*	*			trans	-51.7	139.3	142.7	-43.4	0	0	0	0	108.2
624	P	31.2	Very low	29.6	Very low	101 Å²	101	129.5 Å²	129.5	66%	0.656	75%	0.752	S	S	*	*				-156.4	-179.5	89.1	43.4	-25.6	0	0	0	115.5
625	N	25.5	Very low	30	Very low	140 Å²	140	127.6 Å²	127.6	75%	0.749	74%	0.743	S	S	*	*			trans	37.9	122.5	136.9	-71	3.4	0	0	0	121.8
626	S	27.2	Very low	30.2	Very low	90 Å²	90	129.6 Å²	129.6	63%	0.629	74%	0.741	S	S	*	*				88.3	159.6	116.8	75.6	0	0	0	0	120
627	N	27.4	Very low	30.7	Very low	137 Å²	137	128.3 Å²	128.3	73%	0.733	73%	0.732	S	S	*	*			trans	64.3	104.7	159.8	-57	-21.2	0	0	0	114.2
628	S	28	Very low	30.7	Very low	105 Å²	105	130.5 Å²	130.5	73%	0.734	73%	0.728	S	S	*	*				112.7	105.7	76.3	-83.1	0	0	0	0	105.8
629	A	28.7	Very low	30.7	Very low	86 Å²	86	135.6 Å²	135.6	71%	0.711	73%	0.729	S	S	*	*				89	138.2	79.4	0	0	0	0	0	111.4
630	M	29.1	Very low	30.7	Very low	191 Å²	191	131.6 Å²	131.6	94%	0.941	72%	0.722	S	S	*	*			trans	66.5	144.9	174	-64	-170.7	176.5	0	0	116.7
631	A	30.7	Very low	30.7	Very low	74 Å²	74	133 Å²	133	61%	0.612	73%	0.73	S	S	*	*			cis	-166.3	179.1	-18.2	0	0	0	0	0	109.8
632	R	30.9	Very low	30.7	Very low	229 Å²	229	129.9 Å²	129.9	86%	0.864	73%	0.727	S	S	*	*			trans	78.6	134.8	162.7	-60.3	166.2	-170.4	-155.2	-1	113.8
633	R	34.2	Very low	30.8	Very low	212 Å²	212	131 Å²	131	80%	0.8	73%	0.73	S	S	*	*			cis	-147.2	131	8.8	-121.1	168.2	176.6	170.8	-3.5	111.3
634	T	31	Very low	30.8	Very low	101 Å²	101	130.3 Å²	130.3	62%	0.62	72%	0.723	S	S	*	*				30.5	134.6	129.3	63.3	0	0	0	0	119
635	H	35.1	Very low	30.7	Very low	156 Å²	156	131.8 Å²	131.8	72%	0.722	73%	0.73	S	S	*	*			cis	-151.9	140.7	39	-90.1	-73.4	0	0	0	110.1
636	T	31.5	Very low	31	Very low	112 Å²	112	130.7 Å²	130.7	69%	0.687	73%	0.733	S	S	*	*				45.4	130.4	83.7	72	0	0	0	0	114.3
637	M	37.4	Very low	31.3	Very low	163 Å²	163	129.4 Å²	129.4	80%	0.803	73%	0.734	S	S	*	*			cis	-135.4	161.8	18.1	-77.9	-160.8	-153.2	0	0	111.1
638	N	30.5	Very low	31.5	Very low	113 Å²	113	129.6 Å²	129.6	60%	0.604	74%	0.735	S	S	*	*			cis	101.5	139	24.7	-161.3	23.6	0	0	0	114.1
639	Y	31.2	Very low	31.7	Very low	200 Å²	200	130.8 Å²	130.8	78%	0.784	73%	0.729	S	S	*	*			trans	64.5	153.9	-174.9	-49.9	-67.3	0	0	0	116.8
640	G	30.7	Very low	31.9	Very low	61 Å²	61	133.4 Å²	133.4	63%	0.629	73%	0.727	S	S	*	*			cis	-176.7	131.7	-10.7	0	0	0	0	0	109.7
641	T	28.9	Very low	32.3	Very low	126 Å²	126	131.7 Å²	131.7	77%	0.773	72%	0.716	S	S	*	*				75.4	138.1	87.6	-32.9	0	0	0	0	115
642	T	29.2	Very low	32.4	Very low	118 Å²	118	133 Å²	133	72%	0.724	72%	0.72	S	S	*	*			trans	63.2	137.6	171.2	49.3	0	0	0	0	117.2
643	T	29.1	Very low	32.7	Very low	119 Å²	119	127.6 Å²	127.6	73%	0.73	71%	0.712	S	S	*	*			cis	71.5	153.7	33.6	74.7	0	0	0	0	115.4
644	P	39.6	Very low	32.7	Very low	103 Å²	103	127.4 Å²	127.4	67%	0.669	71%	0.712	S	S	*	*				-126.9	-150.2	-56.9	34.9	-15.3	0	0	0	109.7
645	T	29.5	Very low	33	Very low	131 Å²	131	132.3 Å²	132.3	80%	0.804	72%	0.719	S	S	*	*			trans	65.1	166.5	171.6	65.6	0	0	0	0	116.2
646	S	30.8	Very low	32.9	Very low	117 Å²	117	133.6 Å²	133.6	82%	0.818	73%	0.725	S	S	*	*			cis	-169.5	163.5	-35.3	-85.6	0	0	0	0	107.2
647	G	33.1	Very low	33.4	Very low	63 Å²	63	132.8 Å²	132.8	65%	0.649	72%	0.722	S	S	*	*			trans	116.7	133.7	178.3	0	0	0	0	0	111.7
648	D	31.5	Very low	33.3	Very low	142 Å²	142	132.9 Å²	132.9	76%	0.759	72%	0.724	S	S	*	*				82.1	135.9	59.2	-80	13.6	0	0	0	111.4
649	Q	33.5	Very low	33.4	Very low	130 Å²	130	133.9 Å²	133.9	61%	0.607	73%	0.73	S	S	*	*			cis	-158.1	152.7	11.5	-123.2	163	61.4	0	0	110.8
650	Q	32.9	Very low	33.6	Very low	141 Å²	141	128.6 Å²	128.6	66%	0.659	73%	0.727	S	S	*	*			trans	64.2	160.9	151.9	-66.3	157.5	23.3	0	0	117.7
651	H	36.1	Very low	33.6	Very low	155 Å²	155	132.8 Å²	132.8	72%	0.718	74%	0.735	S	S	*	*			cis	-128.8	148.5	-3.9	-101.9	-41.8	0	0	0	109.2
652	S	34.3	Very low	33.9	Very low	100 Å²	100	130.4 Å²	130.4	70%	0.699	73%	0.728	S	S	*	*				52	126.4	93.5	-139.7	0	0	0	0	113.5
653	V	37.5	Very low	34.3	Very low	116 Å²	116	130.5 Å²	130.5	70%	0.703	73%	0.734	S	S	*	*				-158.1	131.6	54.1	163.4	0	0	0	0	111.1
654	R	32.5	Very low	34.3	Very low	208 Å²	208	127.9 Å²	127.9	79%	0.785	73%	0.731	S	S	*	*				35.1	135.2	121.6	-120	177.6	173.6	-176.9	-2.1	117.5
655	R	37.4	Very low	34.1	Very low	205 Å²	205	134.4 Å²	134.4	77%	0.774	74%	0.742	S	S	*	*			cis	-151.7	134.1	36.8	-71.4	175.5	-173.9	-144.5	2.4	108.5
656	Q	33.8	Very low	34.4	Very low	182 Å²	182	134.4 Å²	134.4	85%	0.85	74%	0.737	S	S	*	*				78.5	142	71.2	-82.6	-87.7	-26.6	0	0	115.2
657	P	41.5	Very low	34.3	Very low	96 Å²	96	134.4 Å²	134.4	62%	0.623	73%	0.732	S	S	*	*			trans	-120	-178.4	-159.9	44	-31.1	0	0	0	115.1
658	I	36.5	Very low	34.3	Very low	165 Å²	165	137.5 Å²	137.5	85%	0.846	74%	0.742	S	S	*	*			trans	-150.8	135.4	154.2	-86.8	120.8	0	0	0	106.7
659	N	31.5	Very low	34.3	Very low	134 Å²	134	133.7 Å²	133.7	72%	0.717	73%	0.731	S	S	*	*			cis	105.3	87.6	14.7	-171.8	34.3	0	0	0	115.7
660	A	36.3	Very low	34.4	Very low	89 Å²	89	136.4 Å²	136.4	74%	0.736	74%	0.741	S	S	*	*			trans	-162.6	137.7	147.7	0	0	0	0	0	107.8
661	N	31.1	Very low	34.4	Very low	148 Å²	148	135.8 Å²	135.8	79%	0.791	74%	0.742	S	S	*	*			cis	68.2	132.3	47.5	-75.1	-14.5	0	0	0	113.8
662	A	34.9	Very low	34.4	Very low	77 Å²	77	134.6 Å²	134.6	64%	0.636	74%	0.741	S	S	*	*			cis	-162	178.5	-2.5	0	0	0	0	0	112.2
663	S	36	Very low	34.5	Very low	120 Å²	120	133.2 Å²	133.2	84%	0.839	74%	0.736	S	S	*	*			trans	62	137.8	160.6	50.5	0	0	0	0	119.2
664	G	30.5	Very low	34.5	Very low	64 Å²	64	135.1 Å²	135.1	66%	0.66	74%	0.742	S	S	*	*			cis	107.6	152.1	-0.3	0	0	0	0	0	114.2
665	R	35.7	Very low	35.1	Very low	239 Å²	239	129.8 Å²	129.8	90%	0.902	73%	0.734	S	S	*	*			trans	83.9	140.5	-166.4	-58.8	174.2	176.5	171.4	-1.1	113.3
666	N	35.1	Very low	35	Very low	131 Å²	131	130.3 Å²	130.3	70%	0.701	74%	0.736	S	S	*	*			cis	-142.4	144.7	-15.6	-83.4	-19.9	0	0	0	105.7
667	T	29.5	Very low	35.1	Very low	117 Å²	117	128.2 Å²	128.2	72%	0.718	73%	0.731	S	S	*	*			cis	70.9	144	45.5	66.4	0	0	0	0	116
668	C	33	Very low	34.6	Very low	128 Å²	128	128.2 Å²	128.2	87%	0.865	73%	0.733	S	S	*	*			trans	77.9	147.5	178.1	92.1	0	0	0	0	117.9
669	A	31.6	Very low	34.5	Very low	62 Å²	62	126.8 Å²	126.8	51%	0.512	73%	0.732	S	S	.	*			cis	-172.1	169.8	-25.8	0	0	0	0	0	110
670	F	33.8	Very low	34.5	Very low	187 Å²	187	124.3 Å²	124.3	82%	0.82	73%	0.73	S	S	*	*			trans	66.7	161.2	169.5	-46.2	-72.6	0	0	0	114.2
671	D	33.8	Very low	34.3	Very low	128 Å²	128	128.1 Å²	128.1	68%	0.684	74%	0.737	S	S	*	*			cis	-162.4	168.9	-15.2	-120.7	21.8	0	0	0	109.2
672	N	36.1	Very low	34.4	Very low	131 Å²	131	126.7 Å²	126.7	70%	0.701	74%	0.739	S	S	*	*			cis	-141.7	-152.4	-9.2	-163.2	-84.4	0	0	0	107.2
673	A	37.1	Very low	34.3	Very low	71 Å²	71	126.3 Å²	126.3	59%	0.587	74%	0.743	S	S	*	*			trans	-117.3	157.6	174.1	0	0	0	0	0	112.4
674	N	37.6	Very low	34.2	Very low	155 Å²	155	128 Å²	128	83%	0.829	74%	0.74	S	S	*	*				-174.8	161.5	120.3	-106.7	-33.2	0	0	0	113.7
675	P	44.4	Very low	34.4	Very low	97 Å²	97	131.6 Å²	131.6	63%	0.63	75%	0.75	S	S	*	*			trans	-116.7	-156.2	179.2	38.3	-22	0	0	0	112.5
676	R	35.3	Very low	34.3	Very low	216 Å²	216	123.5 Å²	123.5	82%	0.815	74%	0.741	S	S	*	*			trans	84.8	148.6	171.4	-57.8	175.6	176.4	158.3	-1.8	115.1
677	N	34.8	Very low	34.5	Very low	137 Å²	137	125 Å²	125	73%	0.733	75%	0.748	S	S	*	*			cis	-156.6	179.9	-10.7	-117.3	6.8	0	0	0	111.7
678	S	31.6	Very low	34.9	Very low	97 Å²	97	125 Å²	125	68%	0.678	75%	0.753	S	S	*	*			trans	-54	165.4	151.6	56.1	0	0	0	0	111.5
679	V	35	Very low	35.2	Very low	135 Å²	135	122.8 Å²	122.8	82%	0.818	75%	0.751	S	S	*	*				-151.6	156.2	65.4	-155.1	0	0	0	0	110.4
680	A	30.4	Very low	35.5	Very low	82 Å²	82	123.3 Å²	123.3	68%	0.678	76%	0.763	S	S	*	*			trans	-76.1	155.2	162.5	0	0	0	0	0	111.1
681	L	33.7	Very low	35.7	Very low	168 Å²	168	120.1 Å²	120.1	88%	0.88	76%	0.764	S	S	*	*				-159.5	158.9	128.6	-133	71.4	0	0	0	112.9
682	S	31.6	Very low	35.9	Very low	118 Å²	118	118.5 Å²	118.5	83%	0.825	77%	0.768	S	S	*	*			trans	-56.9	155.3	171.7	-39.2	0	0	0	0	113.4
683	G	33.5	Very low	36	Very low	70 Å²	70	120.4 Å²	120.4	72%	0.722	78%	0.777	S	S	*	*			trans	165.8	87.4	160.5	0	0	0	0	0	118.1
684	I	34.1	Very low	36	Very low	154 Å²	154	122.3 Å²	122.3	79%	0.79	79%	0.786	S	S	*	*			trans	7.7	129	141.7	50.5	168.8	0	0	0	120.8
685	T	33.7	Very low	36.6	Very low	140 Å²	140	120.4 Å²	120.4	86%	0.859	78%	0.782	S	S	*	*			trans	55.6	131.8	138.1	61.1	0	0	0	0	121.7
686	G	35	Very low	36.4	Very low	69 Å²	69	121.1 Å²	121.1	71%	0.711	79%	0.79	S	S	*	*			trans	150.5	95	142.8	0	0	0	0	0	118.7
687	L	38	Very low	36.7	Very low	164 Å²	164	115.3 Å²	115.3	86%	0.859	78%	0.782	S	S	*	*			trans	44.3	107.8	132.4	-63.9	168.4	0	0	0	121
688	S	39.1	Very low	37.1	Very low	117 Å²	117	114.5 Å²	114.5	82%	0.818	78%	0.778	S	S	*	*				53.4	129.7	127.1	65.7	0	0	0	0	122.9
689	G	38	Very low	37.4	Very low	80 Å²	80	118.2 Å²	118.2	83%	0.825	78%	0.782	S	S	*	*				131.8	108.8	118.3	0	0	0	0	0	118.9
690	G	37.9	Very low	37.5	Very low	74 Å²	74	116 Å²	116	76%	0.763	77%	0.772	S	S	*	*			trans	70.1	170.3	155.8	0	0	0	0	0	118.8
691	S	39.1	Very low	38.1	Very low	120 Å²	120	118.2 Å²	118.2	84%	0.839	78%	0.778	S	S	*	*			cis	179	123.6	-42.7	-103.4	0	0	0	0	109.8
692	A	38.6	Very low	38.4	Very low	93 Å²	93	115.6 Å²	115.6	77%	0.769	77%	0.774	S	S	*	*			trans	55.4	134.8	158.1	0	0	0	0	0	121.4
693	L	37.1	Very low	38.8	Very low	171 Å²	171	113.6 Å²	113.6	90%	0.895	77%	0.771	S	S	*	*				-176	176	105.8	-92.7	166.6	0	0	0	111.5
694	S	38.5	Very low	39.1	Very low	111 Å²	111	116 Å²	116	78%	0.776	78%	0.777	S	S	*	*			trans	-125.2	-138.2	-152.5	-55.4	0	0	0	0	116.5
695	P	48.9	Very low	39.3	Very low	115 Å²	115	113.6 Å²	113.6	75%	0.747	77%	0.774	S	S	*	*				-130.8	-154.1	-109.9	42.6	-22.9	0	0	0	116.6
696	S	40.1	Very low	39.5	Very low	113 Å²	113	113.1 Å²	113.1	79%	0.79	78%	0.777	S	S	*	*			trans	89.3	152.5	165.4	74.1	0	0	0	0	119.7
697	S	41.8	Very low	39.6	Very low	93 Å²	93	113.7 Å²	113.7	65%	0.65	78%	0.782	S	S	*	*			cis	-169.5	175	-20.8	54.1	0	0	0	0	114.6
698	D	42.5	Very low	39.5	Very low	121 Å²	121	112 Å²	112	65%	0.647	78%	0.784	S	S	*	*			trans	76.6	165.7	157.7	-62.2	-59.4	0	0	0	121.1
699	K	38.6	Very low	39.4	Very low	174 Å²	174	110.7 Å²	110.7	76%	0.757	78%	0.78	S	S	*	*			cis	-171.7	177.1	-16.4	-103.9	-179.3	-176.5	80.2	0	108.7
700	S	38	Very low	39.4	Very low	89 Å²	89	113.8 Å²	113.8	62%	0.622	78%	0.778	S	S	*	*			cis	-174.5	178.2	-22	55.1	0	0	0	0	112.9
701	T	42.9	Very low	39.3	Very low	128 Å²	128	116.7 Å²	116.7	79%	0.785	78%	0.776	S	S	*	*			trans	70.6	154.5	158.9	56	0	0	0	0	122.9
702	S	40.1	Very low	39.1	Very low	114 Å²	114	118.3 Å²	118.3	80%	0.797	77%	0.77	S	S	*	*			cis	179.4	138.3	-45.7	51	0	0	0	0	115.8
703	G	39	Very low	39.1	Very low	75 Å²	75	118.9 Å²	118.9	77%	0.773	76%	0.764	S	S	*	*			trans	96.6	178.3	162.9	0	0	0	0	0	118.8
704	S	39.4	Very low	39	Very low	120 Å²	120	116.5 Å²	116.5	84%	0.839	76%	0.757	S	S	*	*			cis	175.3	163.9	-24.9	-82.4	0	0	0	0	110.1
705	S	38.9	Very low	39	Very low	104 Å²	104	116.3 Å²	116.3	73%	0.727	75%	0.751	S	S	*	*			cis	-177.9	150.9	-24.1	56.4	0	0	0	0	114.2
706	S	38.6	Very low	38.4	Very low	131 Å²	131	118.5 Å²	118.5	92%	0.916	76%	0.757	S	S	*	*			trans	82.7	152	161.1	82.1	0	0	0	0	123.8
707	G	36.9	Very low	38.3	Very low	80 Å²	80	116.3 Å²	116.3	83%	0.825	75%	0.752	S	S	*	*			trans	142	134.7	163.6	0	0	0	0	0	118.6
708	S	36.2	Very low	38.2	Very low	128 Å²	128	117.4 Å²	117.4	90%	0.895	77%	0.767	S	S	*	*			trans	-114.7	161.9	-169.4	-57	0	0	0	0	117.5
709	A	37.3	Very low	37.9	Very low	91 Å²	91	115.3 Å²	115.3	75%	0.752	77%	0.774	S	S	*	*			trans	122.5	116.3	132.7	0	0	0	0	0	122.5
710	N	36.2	Very low	37.8	Very low	145 Å²	145	118 Å²	118	78%	0.775	78%	0.779	S	S	*	*			trans	55.6	141.6	135.7	-65.9	-3.3	0	0	0	127
711	N	36.1	Very low	37.8	Very low	135 Å²	135	121.4 Å²	121.4	72%	0.722	79%	0.789	S	S	*	*			trans	70.9	148.3	150.1	-71.8	-5.3	0	0	0	119.7
712	Q	36	Very low	37.5	Very low	154 Å²	154	120.6 Å²	120.6	72%	0.72	79%	0.786	S	S	*	*			cis	-164.4	158.7	-13.9	-120.5	-173.6	25	0	0	112.9
713	V	37.1	Very low	37.3	Very low	104 Å²	104	120 Å²	120	63%	0.63	78%	0.782	S	S	*	*			trans	75.5	141.4	142.4	167.3	0	0	0	0	122.6
714	T	36.3	Very low	37.2	Very low	121 Å²	121	124.2 Å²	124.2	74%	0.742	78%	0.781	S	S	*	*			trans	66.5	147.5	163	48.7	0	0	0	0	121
715	T	38.4	Very low	36.9	Very low	107 Å²	107	126.1 Å²	126.1	66%	0.656	78%	0.777	S	S	*	*			cis	-167	149.5	-25.5	20.2	0	0	0	0	110.1
716	N	36.7	Very low	36.8	Very low	162 Å²	162	127.8 Å²	127.8	87%	0.866	78%	0.776	S	S	*	*			trans	62.8	151.6	156.8	-54.6	-20.1	0	0	0	118.7
717	G	37	Very low	36.5	Very low	67 Å²	67	130.2 Å²	130.2	69%	0.691	77%	0.765	S	S	*	*			cis	166.9	135.7	-10.2	0	0	0	0	0	113.1
718	A	40.2	Very low	36.5	Very low	116 Å²	116	130.9 Å²	130.9	96%	0.959	76%	0.757	S	S	*	*			trans	61.3	145.1	-177.9	0	0	0	0	0	116.1
719	G	36.1	Very low	36.4	Very low	77 Å²	77	133.3 Å²	133.3	79%	0.794	75%	0.754	S	S	*	*			cis	-179.1	-163.6	0.5	0	0	0	0	0	109
720	R	35.9	Very low	36.3	Very low	231 Å²	231	135 Å²	135	87%	0.872	76%	0.755	S	S	*	*			cis	-171	117.4	-8.2	169.3	-161.6	177.7	-157.2	0.4	108
721	L	39.6	Very low	36.4	Very low	159 Å²	159	133.8 Å²	133.8	83%	0.832	75%	0.753	S	S	*	*			trans	165.4	112.9	143.2	-93.6	173.2	0	0	0	112.4
722	P	36.1	Very low	36.8	Very low	111 Å²	111	132.2 Å²	132.2	72%	0.721	75%	0.75	S	S	*	*			trans	-123	-170.7	167.2	40.9	-29.1	0	0	0	113.2
723	S	36.4	Very low	36.9	Very low	101 Å²	101	129.3 Å²	129.3	71%	0.706	75%	0.752	S	S	*	*			trans	79.6	146.3	175.5	-48	0	0	0	0	115.4
724	H	36.6	Very low	36.7	Very low	164 Å²	164	132 Å²	132	76%	0.759	76%	0.762	S	S	*	*			cis	-128	139.3	11.6	-94.1	-86.1	0	0	0	114.3	I726	H724-I726 HydrophobicContact CB-CG1 4.26Å
725	E	32.3	Very low	37	Very low	161 Å²	161	132.1 Å²	132.1	75%	0.752	76%	0.762	S	S	*	*			trans	-83.9	133.2	148.7	-178	-174.3	163.4	0	0	108.2
726	I	37.6	Very low	36.7	Very low	139 Å²	139	131.8 Å²	131.8	71%	0.713	76%	0.762	S	S	*	*			trans	-131	107.8	167.3	-63.4	-177.1	0	0	0	109.1	H724 S728	H724-I726 HydrophobicContact CB-CG1 4.26Å; I726-S728 PolarHBondContact O-N 3.14Å
727	R	32.6	Very low	36.7	Very low	182 Å²	182	132.5 Å²	132.5	69%	0.687	76%	0.762	S	S	*	*			trans	-91.8	80.9	176.7	-177.4	178.4	179.6	161.7	-1.5	109.9	H729	R727-H729 PolarHBondContact NE-NE2 3.41Å; R727-H729 PolarHBondContact O-N 2.87Å
728	S	36.5	Very low	36.8	Very low	93 Å²	93	135.1 Å²	135.1	65%	0.65	77%	0.765	S	S	*	*			trans	-79.4	107.5	174.9	55.6	0	0	0	0	110.8	I726 V730	I726-S728 PolarHBondContact O-N 3.14Å; S728-V730 PolarHBondContact O-N 3.26Å
729	H	33.6	Very low	36.3	Very low	179 Å²	179	136.4 Å²	136.4	83%	0.829	76%	0.761	S	S	*	*			trans	-69	114.1	166.4	-73.2	-109.1	0	0	0	108.9	R727	R727-H729 PolarHBondContact NE-NE2 3.41Å; R727-H729 PolarHBondContact O-N 2.87Å
730	V	35.7	Very low	36.2	Very low	127 Å²	127	142.6 Å²	142.6	77%	0.77	76%	0.761	S	S	*	*			trans	-114.3	99.9	168.1	-179.5	0	0	0	0	107.4	S728	S728-V730 PolarHBondContact O-N 3.26Å
731	T	37.3	Very low	36.1	Very low	120 Å²	120	137.2 Å²	137.2	74%	0.736	75%	0.753	S	S	*	*			trans	-58	128.8	175.8	-45.4	0	0	0	0	109.5	A733	T731-A733 PolarHBondContact O-N 3.27Å; T731-A733 VanDerWaalsContact O-N 3.14Å
732	P	45.9	Very low	35.8	Very low	102 Å²	102	137 Å²	137	66%	0.662	75%	0.753	S	S	*	*			trans	-67.6	115.4	172.3	27.9	-32.4	0	0	0	108.6	L734	P732-L734 PolarHBondContact O-N 2.9Å; P732-L734 VanDerWaalsContact O-N 3.16Å
733	A	36.2	Very low	35.6	Very low	92 Å²	92	140.6 Å²	140.6	76%	0.76	76%	0.758	S	S	*	*			trans	-62.1	117.2	169.9	0	0	0	0	0	108.8	T731 V735	T731-A733 PolarHBondContact O-N 3.27Å; T731-A733 VanDerWaalsContact O-N 3.14Å; A733-V735 PolarHBondContact O-N 3.03Å; A733-V735 VanDerWaalsContact O-N 3.15Å
734	L	33.5	Very low	35.4	Very low	160 Å²	160	142.1 Å²	142.1	84%	0.838	76%	0.762	S	S	*	*			trans	-64.6	116.1	174.7	-85.8	74	0	0	0	108.8	P732 P736	P732-L734 PolarHBondContact O-N 2.9Å; P732-L734 VanDerWaalsContact O-N 3.16Å; L734-P736 VanDerWaalsContact O-CD 3.27Å; L734-P736 WeakPolarHBondContact O-CD 3.2Å
735	V	42.4	Very low	35.2	Very low	124 Å²	124	141.1 Å²	141.1	75%	0.752	76%	0.758	S	S	*	*			trans	-99.7	99.2	162.9	-177	0	0	0	0	107.4	A733 M737	A733-V735 PolarHBondContact O-N 3.03Å; A733-V735 VanDerWaalsContact O-N 3.15Å; V735-M737 PolarHBondContact O-N 3.45Å
736	P	32.9	Very low	35.2	Very low	101 Å²	101	142.2 Å²	142.2	66%	0.656	76%	0.762	S	S	*	*			trans	-75.8	104.5	178.5	30.2	-33.5	0	0	0	110.2	L734 T738	L734-P736 VanDerWaalsContact O-CD 3.27Å; L734-P736 WeakPolarHBondContact O-CD 3.2Å; P736-T738 HydrophobicContact CB-CG2 4.48Å
737	M	35.9	Very low	34.8	Very low	176 Å²	176	139.4 Å²	139.4	87%	0.867	77%	0.768	S	S	*	*			trans	-101.4	75.5	162.6	-91.2	-75.7	163.3	0	0	108.9	V735 T739	V735-M737 PolarHBondContact O-N 3.45Å; M737-T739 PolarHBondContact O-N 3Å
738	T	38.6	Very low	34.7	Very low	122 Å²	122	135.3 Å²	135.3	75%	0.748	77%	0.773	S	S	*	*			trans	-72.9	113.8	179.4	48.2	0	0	0	0	111.1	P736 R740	P736-T738 HydrophobicContact CB-CG2 4.48Å; T738-R740 PolarHBondContact O-N 3.18Å; T738-R740 VanDerWaalsContact O-N 3.13Å
739	T	31.5	Very low	34.2	Very low	144 Å²	144	138.4 Å²	138.4	88%	0.883	78%	0.782	S	S	*	*			trans	-68.5	104.3	162.7	47	0	0	0	0	109.9	M737	M737-T739 PolarHBondContact O-N 3Å
740	R	33.5	Very low	34.1	Very low	207 Å²	207	137.2 Å²	137.2	78%	0.781	78%	0.78	S	S	*	*			trans	-145	134.9	157.1	-153.9	171.4	-173.2	176.2	1.6	111.9	T738	T738-R740 PolarHBondContact O-N 3.18Å; T738-R740 VanDerWaalsContact O-N 3.13Å
741	T	32.6	Very low	33.8	Very low	117 Å²	117	136 Å²	136	72%	0.718	78%	0.778	S	S	*	*			trans	-74.4	148.4	172.7	49.1	0	0	0	0	111.3
742	N	33.7	Very low	33.6	Very low	155 Å²	155	136.3 Å²	136.3	83%	0.829	78%	0.784	S	S	*	*				-160.2	149.3	123.9	-104.1	-1.3	0	0	0	111.8
743	K	32.5	Very low	32.9	Very low	187 Å²	187	134.1 Å²	134.1	81%	0.813	78%	0.78	S	S	*	*			trans	-130.1	111.6	178.3	174.5	-164.8	176.3	-172.3	0	107.1
744	V	32.6	Very low	32.8	Very low	133 Å²	133	137.3 Å²	137.3	81%	0.806	79%	0.791	S	S	*	*			trans	-135.4	146	172.1	-174.6	0	0	0	0	108.4
745	H	32.6	Very low	32.6	Very low	143 Å²	143	133.4 Å²	133.4	66%	0.662	79%	0.79	S	S	*	*			trans	-98.4	-177.1	-176.2	-97.7	-56.9	0	0	0	112.3
746	H	31.9	Very low	32.1	Very low	183 Å²	183	131.7 Å²	131.7	85%	0.847	80%	0.797	S	S	*	*			trans	79.2	140.7	167.2	-42.4	-76.4	0	0	0	116.1
747	G	28.9	Very low	32	Very low	80 Å²	80	130.3 Å²	130.3	83%	0.825	79%	0.794	S	S	*	*			cis	144	114.9	-18.3	0	0	0	0	0	115.9
748	A	30.2	Very low	31.7	Very low	97 Å²	97	132.4 Å²	132.4	80%	0.802	79%	0.794	S	S	*	*			trans	-156.8	126.7	151.2	0	0	0	0	0	106.5
749	N	26.4	Very low	31.4	Very low	158 Å²	158	135.3 Å²	135.3	85%	0.845	80%	0.799	S	S	*	*				76.5	153.4	62.1	-118.3	4.1	0	0	0	114.5
750	I	31.9	Very low	31.3	Very low	153 Å²	153	132.9 Å²	132.9	79%	0.785	79%	0.793	S	S	*	*			trans	87.2	90.6	-160.6	-57.1	165	0	0	0	110.3
751	S	29.1	Very low	31.2	Very low	103 Å²	103	126.8 Å²	126.8	72%	0.72	80%	0.795	S	S	*	*				56.1	129.9	73.5	79.1	0	0	0	0	113.3
752	S	33.2	Very low	31	Very low	125 Å²	125	129.2 Å²	129.2	87%	0.874	80%	0.802	S	S	*	*			cis	-160.4	175.3	11.3	49.2	0	0	0	0	107.5
753	G	31.8	Very low	30.8	Very low	56 Å²	56	128.5 Å²	128.5	58%	0.577	80%	0.798	S	S	*	*			cis	160.1	159.4	1.6	0	0	0	0	0	108.6
754	T	33.5	Very low	30.6	Very low	159 Å²	159	126.6 Å²	126.6	98%	0.975	80%	0.796	S	S	*	*			trans	58.3	156.8	-178.9	69.1	0	0	0	0	116.3
755	G	29	Very low	30.4	Very low	79 Å²	79	125.7 Å²	125.7	81%	0.814	78%	0.783	S	S	*	*			cis	151.4	141.9	-8.8	0	0	0	0	0	111.1
756	G	31.3	Very low	30.4	Very low	88 Å²	88	128.6 Å²	128.6	91%	0.907	79%	0.788	S	S	*	*			trans	136.3	107.6	172	0	0	0	0	0	115.6
757	A	31.3	Very low	30.4	Very low	72 Å²	72	124.7 Å²	124.7	60%	0.595	78%	0.781	S	S	*	*			trans	-96.2	166.7	-178.3	0	0	0	0	0	114
758	Y	30.5	Very low	30.8	Very low	220 Å²	220	124.9 Å²	124.9	86%	0.863	78%	0.775	S	S	*	*			trans	66.5	153.1	169.4	-43.2	-64.3	0	0	0	114.8
759	H	31	Very low	31.2	Very low	183 Å²	183	126.2 Å²	126.2	85%	0.847	77%	0.773	S	S	*	*			cis	-154.4	-174.1	28	-164.6	-100.5	0	0	0	111.4
760	A	30.7	Very low	31.8	Very low	92 Å²	92	125.9 Å²	125.9	76%	0.76	77%	0.77	S	S	*	*			trans	-81	155.1	-178.9	0	0	0	0	0	114.9
761	G	31.4	Very low	32	Very low	80 Å²	80	125.1 Å²	125.1	83%	0.825	77%	0.768	S	S	*	*			trans	-165.1	157	175.1	0	0	0	0	0	113.6
762	L	28.6	Very low	32.5	Very low	167 Å²	167	125.6 Å²	125.6	87%	0.874	77%	0.767	S	S	*	*			trans	-125.7	165.7	-174.5	-108.1	165.5	0	0	0	111.1
763	L	27.7	Very low	32.8	Very low	140 Å²	140	124.6 Å²	124.6	73%	0.733	77%	0.766	S	S	*	*			trans	73.6	110	159.2	-71.5	161.9	0	0	0	121.4
764	L	29.6	Very low	33.1	Very low	147 Å²	147	125.3 Å²	125.3	77%	0.77	77%	0.774	S	S	*	*				78.5	159.1	114.1	-138.3	72.4	0	0	0	122.6
765	E	28.9	Very low	33.3	Very low	115 Å²	115	123.6 Å²	123.6	54%	0.537	77%	0.768	S	S	.	*			trans	85.1	110.7	158.5	-69.2	-91.9	98.1	0	0	121.1
766	R	31.4	Very low	33.7	Very low	204 Å²	204	123.4 Å²	123.4	77%	0.77	77%	0.766	S	S	*	*				65.9	152.6	126.8	-71.5	-172.1	175.5	138.6	-4.1	120.5
767	S	33	Very low	33.9	Very low	101 Å²	101	125.6 Å²	125.6	71%	0.706	76%	0.762	S	S	*	*			cis	-165.2	176.3	-4.4	-116	0	0	0	0	112.8
768	A	37	Very low	34	Very low	84 Å²	84	127.8 Å²	127.8	69%	0.694	77%	0.773	S	S	*	*			trans	90.5	139.8	147.1	0	0	0	0	0	119.5
769	T	37.6	Very low	34.3	Very low	124 Å²	124	121 Å²	121	76%	0.761	77%	0.769	S	S	*	*			cis	-164.5	171.8	-6.9	16.1	0	0	0	0	112.4
770	L	39.5	Very low	34.2	Very low	151 Å²	151	120.7 Å²	120.7	79%	0.791	77%	0.774	S	S	*	*			trans	79.9	146	165.2	-61.8	155.7	0	0	0	117.7
771	N	36.9	Very low	34.2	Very low	138 Å²	138	119.8 Å²	119.8	74%	0.738	77%	0.774	S	S	*	*			cis	-179.7	168.6	-30.2	-118	39.1	0	0	0	108.6
772	T	37.8	Very low	34.1	Very low	113 Å²	113	122.2 Å²	122.2	69%	0.693	77%	0.773	S	S	*	*			cis	-153.1	139.8	0.8	-58.6	0	0	0	0	109.7
773	A	40.2	Very low	34.2	Very low	104 Å²	104	119.1 Å²	119.1	86%	0.86	77%	0.765	S	S	*	*			trans	59.8	156.3	160.1	0	0	0	0	0	120.6
774	G	37.9	Very low	34.3	Very low	71 Å²	71	117.5 Å²	117.5	73%	0.732	77%	0.765	S	S	*	*			cis	167.6	165.7	-5	0	0	0	0	0	110.5
775	S	38.1	Very low	34.3	Very low	123 Å²	123	117 Å²	117	86%	0.86	76%	0.763	S	S	*	*			cis	-172	139.7	-4.8	51.5	0	0	0	0	112.4
776	G	37.4	Very low	34.2	Very low	74 Å²	74	119.1 Å²	119.1	76%	0.763	77%	0.773	S	S	*	*			trans	81.3	157.2	159.9	0	0	0	0	0	118.7
777	T	36	Very low	34	Very low	134 Å²	134	114.7 Å²	114.7	82%	0.822	77%	0.772	S	S	*	*			cis	-161	134.3	-10.9	-10.7	0	0	0	0	113.3
778	S	33.8	Very low	33.9	Very low	118 Å²	118	114.4 Å²	114.4	83%	0.825	78%	0.776	S	S	*	*			trans	23.4	136.5	147.8	60.3	0	0	0	0	124.2
779	G	35.3	Very low	33.9	Very low	77 Å²	77	115 Å²	115	79%	0.794	78%	0.776	S	S	*	*			trans	-178.8	131.4	155.1	0	0	0	0	0	115.2
780	N	30.4	Very low	33.8	Very low	178 Å²	178	114.1 Å²	114.1	95%	0.952	77%	0.774	S	S	*	*			trans	-104	157.7	174.5	-81.3	-20.2	0	0	0	111.1
781	G	30.7	Very low	33.6	Very low	73 Å²	73	111.9 Å²	111.9	75%	0.753	77%	0.767	S	S	*	*			trans	161.9	93.3	162.6	0	0	0	0	0	119.3
782	T	29	Very low	33.5	Very low	131 Å²	131	116.6 Å²	116.6	80%	0.804	78%	0.775	S	S	*	*			trans	-5.7	135.1	150	50.1	0	0	0	0	122.5
783	S	29.6	Very low	33.3	Very low	101 Å²	101	114.5 Å²	114.5	71%	0.706	78%	0.775	S	S	*	*			trans	70	124.3	131.9	67.2	0	0	0	0	124.3
784	S	29.6	Very low	33.2	Very low	106 Å²	106	114 Å²	114	74%	0.741	77%	0.766	S	S	*	*			trans	83.1	144.7	138.5	80	0	0	0	0	121.9
785	N	29.5	Very low	33.1	Very low	136 Å²	136	117.3 Å²	117.3	73%	0.727	77%	0.766	S	S	*	*			trans	61.8	118.7	153.9	-77.5	-22.3	0	0	0	122.8
786	Q	28.3	Very low	32.9	Very low	160 Å²	160	117 Å²	117	75%	0.748	76%	0.759	S	S	*	*				78.7	123.4	129.8	-70.7	-168.9	39	0	0	122.6
787	C	26.7	Very low	32.7	Very low	111 Å²	111	119.6 Å²	119.6	75%	0.75	76%	0.76	S	S	*	*			trans	81	142.5	130.4	-69.6	0	0	0	0	122.1
788	A	31.6	Very low	32.5	Very low	96 Å²	96	116.1 Å²	116.1	79%	0.793	75%	0.751	S	S	*	*			trans	71.2	139.8	152.2	0	0	0	0	0	119.5
789	S	35.8	Very low	32.3	Very low	97 Å²	97	115.8 Å²	115.8	68%	0.678	76%	0.755	S	S	*	*			cis	-169.5	147.9	-13.4	46.9	0	0	0	0	113.9
790	S	35	Very low	32	Very low	104 Å²	104	115.7 Å²	115.7	73%	0.727	75%	0.754	S	S	*	*			trans	71.6	159.4	141.4	73	0	0	0	0	118.5
791	T	36.3	Very low	31.9	Very low	105 Å²	105	115.7 Å²	115.7	64%	0.644	75%	0.748	S	S	*	*			cis	-147.1	135.3	14.5	-36.7	0	0	0	0	113
792	R	33.5	Very low	31.8	Very low	237 Å²	237	118.6 Å²	118.6	89%	0.894	75%	0.746	S	S	*	*			trans	38.2	142.4	150.7	-64	168.6	-179.8	147.8	-1.1	119.6
793	G	35.5	Very low	32	Very low	69 Å²	69	119.5 Å²	119.5	71%	0.711	74%	0.741	S	S	*	*			cis	106.2	149.3	31	0	0	0	0	0	109.4
794	S	37	Very low	32	Very low	93 Å²	93	124 Å²	124	65%	0.65	74%	0.742	S	S	*	*			cis	-171.5	140.4	11.6	-100.9	0	0	0	0	111.2
795	D	35.3	Very low	32.1	Very low	140 Å²	140	124.4 Å²	124.4	75%	0.749	74%	0.736	S	S	*	*				62.4	159	120.7	-53.6	-38.6	0	0	0	120.3
796	V	35	Very low	32.2	Very low	117 Å²	117	126.3 Å²	126.3	71%	0.709	74%	0.741	S	S	*	*			cis	-167.5	152.9	0	110.6	0	0	0	0	111.9
797	V	31.8	Very low	32.5	Very low	128 Å²	128	124 Å²	124	78%	0.776	74%	0.739	S	S	*	*			trans	48.3	152.1	148.2	175.2	0	0	0	0	120.4
798	G	32.5	Very low	32.5	Very low	62 Å²	62	124.6 Å²	124.6	64%	0.639	74%	0.744	S	S	*	*			cis	126	-178.3	1.4	0	0	0	0	0	113.2
799	A	29.8	Very low	32.5	Very low	110 Å²	110	124.4 Å²	124.4	91%	0.909	74%	0.742	S	S	*	*			trans	66.6	159.7	-171.3	0	0	0	0	0	115.3
800	G	29.3	Very low	32	Very low	75 Å²	75	127.5 Å²	127.5	77%	0.773	75%	0.751	S	S	*	*			cis	-160.1	149.1	1.1	0	0	0	0	0	114.5
801	E	28.3	Very low	32	Very low	178 Å²	178	130.5 Å²	130.5	83%	0.832	76%	0.757	S	S	*	*			trans	-59.9	153.1	177.2	-172.9	177.7	172.3	0	0	115.3
802	L	28	Very low	31.8	Very low	135 Å²	135	130.1 Å²	130.1	71%	0.707	76%	0.764	S	S	*	*			trans	151.5	153.3	134	-82.3	165.3	0	0	0	115.3
803	H	33.2	Very low	31.8	Very low	149 Å²	149	122.8 Å²	122.8	69%	0.69	76%	0.762	S	S	*	*			trans	68.1	157.3	156.8	-68.3	132.9	0	0	0	119
804	R	30.3	Very low	31.8	Very low	195 Å²	195	131.1 Å²	131.1	74%	0.736	77%	0.772	S	S	*	*			cis	-173.2	143.1	-21.5	175.9	171.3	-178.9	167.5	-3.1	110.7
805	N	32	Very low	31.6	Very low	115 Å²	115	131.7 Å²	131.7	62%	0.615	78%	0.777	S	S	*	*			trans	54.7	124	159.1	-69.7	17.4	0	0	0	123.4
806	Q	29.9	Very low	31.6	Very low	177 Å²	177	128.6 Å²	128.6	83%	0.827	78%	0.777	S	S	*	*				77.6	160.1	129.5	-72	178.2	-50.8	0	0	121.7
807	P	35.2	Very low	31.7	Very low	110 Å²	110	128.8 Å²	128.8	71%	0.714	78%	0.779	S	S	*	*			trans	-118.8	173.7	-162.2	43.3	-31.8	0	0	0	115
808	C	26.5	Very low	31.8	Very low	125 Å²	125	128.9 Å²	128.9	85%	0.845	78%	0.775	S	S	*	*			trans	165.4	162.9	132.5	-93.4	0	0	0	0	114.1
809	A	31.7	Very low	32	Very low	91 Å²	91	131 Å²	131	75%	0.752	77%	0.772	S	S	*	*			trans	58.1	128.8	160.7	0	0	0	0	0	119.3
810	N	26.9	Very low	32.3	Very low	163 Å²	163	133.9 Å²	133.9	87%	0.872	77%	0.766	S	S	*	*				78.3	81.4	50.2	-74.7	-4.8	0	0	0	116.2
811	I	34	Very low	32.5	Very low	167 Å²	167	134.4 Å²	134.4	86%	0.856	76%	0.763	S	S	*	*			trans	-144.7	121.8	146.1	-55.6	-177.1	0	0	0	105
812	A	31.7	Very low	32.7	Very low	96 Å²	96	131.6 Å²	131.6	79%	0.793	76%	0.758	S	S	*	*			cis	106.1	125	24.3	0	0	0	0	0	113
813	G	34	Very low	32.8	Very low	83 Å²	83	130.8 Å²	130.8	86%	0.856	76%	0.759	S	S	*	*			trans	108	139.2	-177.2	0	0	0	0	0	113.7
814	R	34.6	Very low	32.6	Very low	244 Å²	244	127.6 Å²	127.6	92%	0.921	75%	0.753	S	S	*	*			cis	-152.7	152.4	-2.3	-161.2	175.7	-179.6	-169.8	0	111.3
815	S	34.2	Very low	32.5	Very low	106 Å²	106	127.3 Å²	127.3	74%	0.741	76%	0.757	S	S	*	*			trans	-39.5	147.5	-177.8	52.2	0	0	0	0	119.2
816	G	34.3	Very low	32.5	Very low	74 Å²	74	129.3 Å²	129.3	76%	0.763	77%	0.768	S	S	*	*			trans	-145.7	-4.8	-179.4	0	0	0	0	0	120.4
817	V	36.7	Very low	32.4	Very low	122 Å²	122	130.2 Å²	130.2	74%	0.739	76%	0.764	S	S	*	*			trans	67.5	106.4	160.3	-172.7	0	0	0	0	119
818	N	35.6	Very low	32.2	Very low	129 Å²	129	131.9 Å²	131.9	69%	0.69	77%	0.767	S	S	*	*			trans	67.2	145.3	143.4	-65	41.5	0	0	0	120.9
819	D	35.5	Very low	32.5	Very low	108 Å²	108	133.2 Å²	133.2	58%	0.578	77%	0.765	S	S	*	*			cis	-151.2	154.4	-4.9	-101.7	-24.1	0	0	0	113.9
820	H	37	Very low	32.4	Very low	170 Å²	170	135.5 Å²	135.5	79%	0.787	76%	0.764	S	S	*	*			trans	27.2	140.9	152.3	-54.4	-47.1	0	0	0	122.2
821	A	33.6	Very low	32.7	Very low	86 Å²	86	134.5 Å²	134.5	71%	0.711	76%	0.764	S	S	*	*			cis	-153	128.5	1.4	0	0	0	0	0	108.7
822	V	31.8	Very low	32.3	Very low	119 Å²	119	136.6 Å²	136.6	72%	0.721	76%	0.763	S	S	*	*				70.6	101.5	75.2	171.7	0	0	0	0	110.7
823	T	29.9	Very low	32.3	Very low	118 Å²	118	136.3 Å²	136.3	72%	0.724	76%	0.755	S	S	*	*				59.5	146.1	58	79.7	0	0	0	0	112.2
824	S	28.5	Very low	32.1	Very low	81 Å²	81	137.9 Å²	137.9	57%	0.566	75%	0.753	S	S	*	*			cis	171.3	152.8	-9.2	47.9	0	0	0	0	106.1
825	F	28.9	Very low	32.1	Very low	189 Å²	189	133 Å²	133	83%	0.829	75%	0.745	S	S	*	*			trans	62.7	136.6	168.6	-53.5	-71.2	0	0	0	117
826	N	31.6	Very low	32	Very low	158 Å²	158	138.2 Å²	138.2	85%	0.845	75%	0.748	S	S	*	*				-163.7	176.9	83.2	-139.4	-25.2	0	0	0	112.6
827	R	29	Very low	31.8	Very low	196 Å²	196	142.3 Å²	142.3	74%	0.74	75%	0.749	S	S	*	*			trans	-81.3	160.8	173.7	-81.2	177.8	169.5	156.3	-5.1	112.3
828	N	29.8	Very low	31.6	Very low	144 Å²	144	140.4 Å²	140.4	77%	0.77	75%	0.754	S	S	*	*			trans	45.8	117.6	152.6	-56.9	9.5	0	0	0	118
829	D	32.2	Very low	31.3	Very low	153 Å²	153	139.5 Å²	139.5	82%	0.818	75%	0.753	S	S	*	*				-155.5	177.7	105	-133.9	-43.9	0	0	0	112.1
830	L	31.3	Very low	31.1	Very low	139 Å²	139	140.2 Å²	140.2	73%	0.728	77%	0.767	S	S	*	*			trans	-85.1	176.3	178.6	-70.5	92.2	0	0	0	113.1
831	T	31.8	Very low	30.8	Very low	142 Å²	142	138.9 Å²	138.9	87%	0.871	77%	0.771	S	S	*	*			trans	76.1	163.1	166.1	77.7	0	0	0	0	116.7
832	Y	26.4	Very low	30.7	Very low	211 Å²	211	139.9 Å²	139.9	83%	0.827	77%	0.773	S	S	*	*			cis	-177.6	156.9	-41.7	179.8	-103.7	0	0	0	106.1
833	S	31.7	Very low	30.7	Very low	91 Å²	91	143.2 Å²	143.2	64%	0.636	78%	0.78	S	S	*	*			trans	75.5	131.3	-172.1	-34.1	0	0	0	0	113.4
834	S	29.4	Very low	30.8	Very low	115 Å²	115	142.6 Å²	142.6	80%	0.804	79%	0.787	S	S	*	*			cis	81.9	170.7	28.2	-157.9	0	0	0	0	114.6
835	L	34.1	Very low	31	Very low	143 Å²	143	141.7 Å²	141.7	75%	0.749	79%	0.791	S	S	*	*			trans	83.4	132.7	-158	-50.9	169.9	0	0	0	113
836	R	32.5	Very low	31.1	Very low	215 Å²	215	138.1 Å²	138.1	81%	0.811	79%	0.788	S	S	*	*			cis	-149.5	130.7	-8.8	-111.9	175.3	179	175.3	-0.7	108.6
837	M	30.6	Very low	31.3	Very low	160 Å²	160	138.1 Å²	138.1	79%	0.788	78%	0.782	S	S	*	*				56.9	118.9	101.5	-70	-69.8	-75	0	0	116.1
838	G	31.9	Very low	31.6	Very low	81 Å²	81	134.4 Å²	134.4	84%	0.835	78%	0.782	S	S	*	*			trans	-166.7	53	176.9	0	0	0	0	0	111.9
839	T	29.4	Very low	31.8	Very low	110 Å²	110	134 Å²	134	68%	0.675	78%	0.784	S	S	*	*			trans	-80.5	132.1	-178.7	48.8	0	0	0	0	112.4
840	S	32.2	Very low	31.7	Very low	124 Å²	124	132 Å²	132	87%	0.867	78%	0.782	S	S	*	*			trans	-146	131.4	164	-73.8	0	0	0	0	110.8
841	T	30	Very low	31.9	Very low	141 Å²	141	132.3 Å²	132.3	87%	0.865	79%	0.79	S	S	*	*			trans	-122.1	117.9	-172.5	-55.7	0	0	0	0	111.4
842	S	32.5	Very low	31.9	Very low	108 Å²	108	130.3 Å²	130.3	76%	0.755	79%	0.788	S	S	*	*			trans	-170.6	122.5	160.5	49.7	0	0	0	0	107.5
843	Q	30.2	Very low	32.3	Very low	189 Å²	189	124.4 Å²	124.4	88%	0.883	78%	0.782	S	S	*	*			cis	82.2	129.5	46.5	-164.3	-178.6	52	0	0	112.9
844	A	33.1	Very low	32.4	Very low	104 Å²	104	131 Å²	131	86%	0.86	79%	0.794	S	S	*	*			trans	66.9	136.6	-173.9	0	0	0	0	0	116.1
845	G	31.7	Very low	32.5	Very low	63 Å²	63	136.4 Å²	136.4	65%	0.649	80%	0.796	S	S	*	*			cis	169.7	174.6	-9.5	0	0	0	0	0	113.7
846	C	31.4	Very low	32.5	Very low	114 Å²	114	137 Å²	137	77%	0.77	80%	0.8	S	S	*	*			trans	68.6	152.2	168.8	100.7	0	0	0	0	116.1
847	H	36.6	Very low	32.4	Very low	157 Å²	157	133.4 Å²	133.4	73%	0.727	80%	0.795	S	S	*	*			cis	-148	156.5	-5.6	-99	-54.1	0	0	0	109.7
848	T	34.3	Very low	32.5	Very low	118 Å²	118	132 Å²	132	72%	0.724	80%	0.796	S	S	*	*			trans	33.6	142.9	146.6	59.2	0	0	0	0	122
849	T	34.6	Very low	32.4	Very low	135 Å²	135	134.8 Å²	134.8	83%	0.828	79%	0.791	S	S	*	*			cis	-153.1	160	14	23.3	0	0	0	0	110.3
850	S	29.3	Very low	32.6	Very low	111 Å²	111	135.2 Å²	135.2	78%	0.776	79%	0.794	S	S	*	*			trans	-118.3	158.8	163.4	64.3	0	0	0	0	111.5
851	V	35.5	Very low	32.5	Very low	147 Å²	147	135.6 Å²	135.6	89%	0.891	79%	0.786	S	S	*	*			trans	-138.4	129.1	159.2	179.6	0	0	0	0	108.5
852	A	32	Very low	32.7	Very low	100 Å²	100	135.1 Å²	135.1	83%	0.826	78%	0.778	S	S	*	*			trans	-151.5	121.8	172.7	0	0	0	0	0	110.8
853	A	35.9	Very low	32.5	Very low	86 Å²	86	136.5 Å²	136.5	71%	0.711	78%	0.777	S	S	*	*			trans	-177.5	162.6	175.2	0	0	0	0	0	109.3
854	R	34	Very low	32.5	Very low	231 Å²	231	134.1 Å²	134.1	87%	0.872	78%	0.776	S	S	*	*			cis	-161.6	134.8	-24.1	-96.8	168.5	-174.3	-158.7	1.8	103.7
855	R	30.2	Very low	32.3	Very low	227 Å²	227	133.8 Å²	133.8	86%	0.857	77%	0.767	S	S	*	*				74.7	139.3	66.8	-144.9	-173.4	-152.9	-153.5	8.3	114.1
856	L	33.9	Very low	32.3	Very low	157 Å²	157	136.4 Å²	136.4	82%	0.822	78%	0.775	S	S	*	*			trans	92.2	131.7	179.5	-55.8	155.2	0	0	0	114
857	I	30.6	Very low	32.2	Very low	139 Å²	139	134 Å²	134	71%	0.713	77%	0.77	S	S	*	*			cis	116.4	147.4	9.6	-68.2	168.1	0	0	0	112.7
858	T	34.1	Very low	32	Very low	131 Å²	131	136 Å²	136	80%	0.804	78%	0.777	S	S	*	*			trans	78.8	123.5	-169.3	70.4	0	0	0	0	114
859	N	28.4	Very low	31.7	Very low	139 Å²	139	137.4 Å²	137.4	74%	0.743	78%	0.78	S	S	*	*			cis	85.1	103.9	16.8	-166.6	34.7	0	0	0	116.7
860	T	34.2	Very low	31.5	Very low	118 Å²	118	139 Å²	139	72%	0.724	78%	0.783	S	S	*	*				175.6	128.4	122	37.1	0	0	0	0	114.1
861	N	30.7	Very low	31.6	Very low	133 Å²	133	136.5 Å²	136.5	71%	0.711	78%	0.775	S	S	*	*			trans	51.7	144	135.1	-68	2.2	0	0	0	126.1
862	N	33.9	Very low	31.4	Very low	130 Å²	130	137.7 Å²	137.7	70%	0.695	78%	0.775	S	S	*	*			trans	82.1	103.9	141.5	-69.4	-4.3	0	0	0	122.4
863	N	28	Very low	31.3	Very low	138 Å²	138	135.5 Å²	135.5	74%	0.738	76%	0.762	S	S	*	*				57.5	154.4	119.5	-68.9	-10.5	0	0	0	122.6
864	T	30.3	Very low	31.1	Very low	139 Å²	139	137.7 Å²	137.7	85%	0.853	77%	0.767	S	S	*	*			trans	70.6	144.9	171.8	70.5	0	0	0	0	115.4
865	S	28.7	Very low	31	Very low	97 Å²	97	133.9 Å²	133.9	68%	0.678	76%	0.762	S	S	*	*			cis	-170.6	154.2	-17.9	45.9	0	0	0	0	109.7
866	S	32.3	Very low	30.9	Very low	117 Å²	117	130 Å²	130	82%	0.818	76%	0.757	S	S	*	*			trans	65.1	156.5	169.9	73.4	0	0	0	0	116
867	G	29.2	Very low	30.7	Very low	64 Å²	64	131.7 Å²	131.7	66%	0.66	76%	0.761	S	S	*	*			cis	166.5	178.2	-9.5	0	0	0	0	0	113.4
868	F	31.6	Very low	30.6	Very low	200 Å²	200	130.5 Å²	130.5	88%	0.877	76%	0.761	S	S	*	*			trans	73.5	88.8	170.1	-56.3	-72.7	0	0	0	118.9
869	N	28.4	Very low	30.5	Very low	147 Å²	147	131 Å²	131	79%	0.786	76%	0.764	S	S	*	*			trans	-63.5	154	146	-65.4	-40.8	0	0	0	111.1
870	N	31.3	Very low	30.7	Very low	167 Å²	167	129.6 Å²	129.6	89%	0.893	76%	0.762	S	S	*	*			trans	166.2	148.7	131	-82.1	-20.4	0	0	0	108.4
871	G	30.8	Very low	30.6	Very low	59 Å²	59	133.3 Å²	133.3	61%	0.608	77%	0.769	S	S	*	*			cis	138.9	161.8	6	0	0	0	0	0	110
872	I	30.5	Very low	30.9	Very low	173 Å²	173	132.8 Å²	132.8	89%	0.887	77%	0.772	S	S	*	*			trans	75.9	131.2	-177.1	-47.7	163.3	0	0	0	113.6
873	G	31.4	Very low	30.6	Very low	54 Å²	54	136.3 Å²	136.3	56%	0.557	78%	0.776	S	S	*	*			cis	132.2	139.4	-12.2	0	0	0	0	0	114.9
874	T	30.7	Very low	30.9	Very low	132 Å²	132	138.2 Å²	138.2	81%	0.81	79%	0.785	S	S	*	*			trans	61.5	161.6	170.5	61.1	0	0	0	0	115.5
875	I	31.1	Very low	31.3	Very low	150 Å²	150	136.7 Å²	136.7	77%	0.769	78%	0.776	S	S	*	*			cis	-129.4	156.2	22.6	-69	171.6	0	0	0	113.2
876	L	28.8	Very low	31.8	Very low	145 Å²	145	135.4 Å²	135.4	76%	0.759	77%	0.765	S	S	*	*			trans	-54.3	156.8	175	-57.5	115.5	0	0	0	115.6
877	E	29.3	Very low	31.9	Very low	194 Å²	194	135.9 Å²	135.9	91%	0.907	75%	0.754	S	S	*	*				-156.2	175	108.7	-130.5	179.9	-179.7	0	0	112.8
878	T	28.8	Very low	32	Very low	113 Å²	113	145 Å²	145	69%	0.693	77%	0.769	S	S	*	*			trans	-125.3	133.1	-164	52.6	0	0	0	0	114.1
879	T	33.2	Very low	32.2	Very low	143 Å²	143	143.8 Å²	143.8	88%	0.877	76%	0.759	S	S	*	*			trans	-145.6	137.5	159.7	46.8	0	0	0	0	111.9
880	P	32.5	Very low	32.4	Very low	109 Å²	109	143.2 Å²	143.2	71%	0.708	76%	0.761	S	S	*	*			trans	-114.5	148.2	177.2	38.3	-30.1	0	0	0	114.8
881	F	32.2	Very low	32.4	Very low	195 Å²	195	140.4 Å²	140.4	86%	0.855	74%	0.744	S	S	*	*			trans	66.1	169.7	162.5	-80.4	-58.4	0	0	0	116.6
882	P	35.8	Very low	32.6	Very low	122 Å²	122	145.9 Å²	145.9	79%	0.792	75%	0.754	S	S	*	*			cis	-124	178.8	14.9	42.8	-28	0	0	0	117.8
883	R	28.8	Very low	32.5	Very low	205 Å²	205	143.2 Å²	143.2	77%	0.774	75%	0.75	S	S	*	*			trans	-67.9	156.7	170.4	-70.7	174.4	168.6	163.2	-5.6	112.3
884	L	32.4	Very low	32.6	Very low	177 Å²	177	147.4 Å²	147.4	93%	0.927	77%	0.766	S	S	*	*			trans	-128.4	108.8	140.7	-77.8	177.5	0	0	0	111.2
885	T	39.8	Very low	32.6	Very low	108 Å²	108	148.9 Å²	148.9	66%	0.663	77%	0.768	S	S	*	*			trans	-150.6	134.3	163.8	52.6	0	0	0	0	107.6
886	P	38.8	Very low	32.9	Very low	69 Å²	69	146.9 Å²	146.9	45%	0.448	77%	0.768	S	S	.	*				-137.2	143.3	119.3	35	-23.2	0	0	0	111.4	T1023	P886-T1023 HydrophobicContact CG-CG2 3.27Å
887	E	35.1	Very low	33.1	Very low	127 Å²	127	145.7 Å²	145.7	59%	0.593	77%	0.769	S	S	*	*			cis	74.6	119.4	48.9	-172.8	177	-135.3	0	0	113.8	R889	E887-R889 HydrophobicContact CG-CB 4.19Å; E887-R889 HydrophobicContact CG-CG 4.4Å; E887-R889 WeakPolarHBondContact OE1-CD 3.28Å; E887-R889 WeakPolarHBondContact OE1-CG 3.34Å; E887-R889 IonicContact OE1-CZ 2.82Å; E887-R889 IonicContact OE1-NE 2.88Å; E887-R889 PolarHBondContact OE1-NE 3.49Å; E887-R889 IonicContact OE1-NH1 3.17Å; E887-R889 PolarHBondContact OE1-NH1 3.02Å
888	R	32	Very low	33.1	Very low	257 Å²	257	142.8 Å²	142.8	97%	0.97	76%	0.759	S	S	*	*			trans	-135.8	126.4	140.7	-152.6	174.6	-161.3	-126.7	1.7	109.1
889	R	34.4	Very low	33.3	Very low	173 Å²	173	144.2 Å²	144.2	65%	0.653	76%	0.761	S	S	*	*			trans	-119	152	-165.7	-126.8	-166.9	-172.1	136.8	-19.2	110.9	E887 I891	E887-R889 HydrophobicContact CG-CB 4.19Å; E887-R889 HydrophobicContact CG-CG 4.4Å; E887-R889 WeakPolarHBondContact OE1-CD 3.28Å; E887-R889 WeakPolarHBondContact OE1-CG 3.34Å; E887-R889 IonicContact OE1-CZ 2.82Å; E887-R889 IonicContact OE1-NE 2.88Å; E887-R889 PolarHBondContact OE1-NE 3.49Å; E887-R889 IonicContact OE1-NH1 3.17Å; E887-R889 PolarHBondContact OE1-NH1 3.02Å; R889-I891 HydrophobicContact CB-CD1 4.43Å; R889-I891 HydrophobicContact CB-CG1 4.39Å; R889-I891 HydrophobicContact CG-CG1 4.34Å
890	T	33.3	Very low	33	Very low	136 Å²	136	143.3 Å²	143.3	83%	0.834	75%	0.751	S	S	*	*			trans	-155.2	108.8	140.2	16.8	0	0	0	0	104.9
891	I	30.6	Very low	33	Very low	107 Å²	107	147.7 Å²	147.7	55%	0.549	76%	0.759	S	S	.	*				61	115.6	64.5	-50.7	169	0	0	0	108.1	R889	R889-I891 HydrophobicContact CB-CD1 4.43Å; R889-I891 HydrophobicContact CB-CG1 4.39Å; R889-I891 HydrophobicContact CG-CG1 4.34Å
892	H	34.8	Very low	32.9	Very low	175 Å²	175	146 Å²	146	81%	0.81	76%	0.759	S	S	*	*			cis	-127.7	173.3	47.8	-78.8	-98.4	0	0	0	117
893	S	29.2	Very low	32.5	Very low	116 Å²	116	149.2 Å²	149.2	81%	0.811	76%	0.761	S	S	*	*			trans	-130.6	146.3	162.5	-53.2	0	0	0	0	109.8
894	T	34.1	Very low	32.7	Very low	143 Å²	143	146.7 Å²	146.7	88%	0.877	76%	0.763	S	S	*	*			trans	-140.1	157.3	161.4	39.9	0	0	0	0	109.1
895	N	29.9	Very low	32.5	Very low	162 Å²	162	142.6 Å²	142.6	87%	0.866	75%	0.746	S	S	*	*			trans	-83.8	162.1	-167.8	-67.4	-30.4	0	0	0	113.9
896	S	37	Very low	32.1	Very low	109 Å²	109	144.4 Å²	144.4	76%	0.762	75%	0.751	S	S	*	*			trans	-57	166.8	165.7	-44.1	0	0	0	0	113.1
897	P	34.4	Very low	31.7	Very low	119 Å²	119	147.6 Å²	147.6	77%	0.773	76%	0.764	S	S	*	*				-124.7	159.7	114.8	36.4	-33.9	0	0	0	113.1
898	N	28.2	Very low	31.6	Very low	133 Å²	133	148.8 Å²	148.8	71%	0.711	77%	0.77	S	S	*	*			trans	-67.8	153.5	165.9	-70.4	-4.2	0	0	0	110.6
899	I	32.6	Very low	31.5	Very low	143 Å²	143	143.3 Å²	143.3	73%	0.733	76%	0.76	S	S	*	*			trans	-131.8	103	152.3	-59.6	-179.6	0	0	0	106.2	F901	I899-F901 HydrophobicContact CG2-CD2 3.89Å; I899-F901 HydrophobicContact CG2-CE2 3.9Å
900	D	26.7	Very low	31.6	Very low	124 Å²	124	141 Å²	141	66%	0.663	77%	0.771	S	S	*	*			trans	-68.3	148.5	166.8	-58.7	-73.8	0	0	0	109.6
901	F	32.3	Very low	31.5	Very low	201 Å²	201	141.7 Å²	141.7	88%	0.882	77%	0.769	S	S	*	*			trans	-134.3	102.4	163	-106.6	-77.3	0	0	0	109.5	I899	I899-F901 HydrophobicContact CG2-CD2 3.89Å; I899-F901 HydrophobicContact CG2-CE2 3.9Å
902	D	30.2	Very low	31.8	Very low	159 Å²	159	144.6 Å²	144.6	85%	0.85	79%	0.786	S	S	*	*			trans	-75	165.2	-176.7	-110.6	-47.2	0	0	0	113.3
903	F	28.3	Very low	31.6	Very low	190 Å²	190	142.3 Å²	142.3	83%	0.833	78%	0.784	S	S	*	*			trans	-97.1	109.6	-175.9	-170.4	-76.3	0	0	0	110.2
904	D	32.1	Very low	31.8	Very low	152 Å²	152	142.6 Å²	142.6	81%	0.813	78%	0.781	S	S	*	*			trans	-155.3	-179.1	161.1	-137.8	-24.9	0	0	0	115.8
905	T	29.1	Very low	31.5	Very low	92 Å²	92	139.7 Å²	139.7	56%	0.564	77%	0.772	S	S	*	*			trans	-132	126.3	-140	-42	0	0	0	0	111.9
906	N	31.8	Very low	31.6	Very low	146 Å²	146	136.2 Å²	136.2	78%	0.781	77%	0.765	S	S	*	*				166.9	126.1	127.7	-97	-66.9	0	0	0	116.8
907	N	29.1	Very low	31.2	Very low	135 Å²	135	142.7 Å²	142.7	72%	0.722	77%	0.773	S	S	*	*				80.7	148.5	127.5	-150.1	9.1	0	0	0	122.6
908	Q	34.2	Very low	31	Very low	153 Å²	153	142.7 Å²	142.7	72%	0.715	77%	0.774	S	S	*	*			trans	73.5	90.8	166.5	-53.8	-147.3	11.6	0	0	121.4
909	N	29.3	Very low	31.2	Very low	142 Å²	142	143.6 Å²	143.6	76%	0.759	78%	0.778	S	S	*	*				50.3	105.4	127.2	-65.7	-11.8	0	0	0	120.6
910	S	35.7	Very low	31	Very low	125 Å²	125	144.1 Å²	144.1	87%	0.874	78%	0.782	S	S	*	*				-150.8	139.2	124	-7	0	0	0	0	110.7
911	N	31.1	Very low	31.3	Very low	150 Å²	150	144.2 Å²	144.2	80%	0.802	79%	0.787	S	S	*	*			trans	-77.9	136.2	-167.5	-56.6	-56.1	0	0	0	113.2
912	N	36.8	Very low	31	Very low	167 Å²	167	139.5 Å²	139.5	89%	0.893	78%	0.779	S	S	*	*			trans	-160.3	101	132.2	-100.6	-20.9	0	0	0	111.3
913	T	30.5	Very low	30.8	Very low	128 Å²	128	140 Å²	140	79%	0.785	78%	0.78	S	S	*	*			trans	-77.4	172.1	160.5	43.6	0	0	0	0	109.1
914	V	34.4	Very low	30.7	Very low	121 Å²	121	135.7 Å²	135.7	73%	0.733	78%	0.78	S	S	*	*				-162.1	122.5	61.4	170.2	0	0	0	0	106.9
915	A	28.8	Very low	30.4	Very low	83 Å²	83	131.9 Å²	131.9	69%	0.686	78%	0.777	S	S	*	*				50.5	138.6	100.3	0	0	0	0	0	115.8
916	A	30.3	Very low	30.3	Very low	89 Å²	89	132.9 Å²	132.9	74%	0.736	79%	0.794	S	S	*	*			cis	82.7	127.9	24.5	0	0	0	0	0	116.4
917	R	29.9	Very low	30.2	Very low	244 Å²	244	129.5 Å²	129.5	92%	0.921	79%	0.794	S	S	*	*			trans	73.3	159.5	-180	-52.1	176.8	175.9	147.1	-0.8	113.2
918	C	29	Very low	30.2	Very low	119 Å²	119	127.9 Å²	127.9	80%	0.804	80%	0.799	S	S	*	*			cis	-124.8	-177.1	13.4	-60.2	0	0	0	0	110.7
919	I	33.5	Very low	30.2	Very low	153 Å²	153	127.3 Å²	127.3	79%	0.785	81%	0.807	S	S	*	*			cis	-138.4	150.9	17.2	-64.5	171.1	0	0	0	109.9	V921	I919-V921 HydrophobicContact CG2-CG2 3.75Å
920	N	28.3	Very low	30.1	Very low	154 Å²	154	128.7 Å²	128.7	82%	0.824	81%	0.814	S	S	*	*			trans	-128.8	117.6	169.1	-175.1	24.3	0	0	0	109.1
921	V	32.4	Very low	30.1	Very low	125 Å²	125	128.8 Å²	128.8	76%	0.758	82%	0.815	S	S	*	*			trans	-142.4	147.2	177.6	176.4	0	0	0	0	109.5	I919	I919-V921 HydrophobicContact CG2-CG2 3.75Å
922	S	25.7	Very low	30.1	Very low	103 Å²	103	127.3 Å²	127.3	72%	0.72	82%	0.816	S	S	*	*			trans	-106.2	151.8	-155.6	-44.9	0	0	0	0	115.7
923	L	25.5	Very low	30	Very low	168 Å²	168	123.1 Å²	123.1	88%	0.88	81%	0.813	S	S	*	*			trans	69.3	131.9	132.6	-167.9	66.7	0	0	0	121
924	A	26.6	Very low	30	Very low	100 Å²	100	123.5 Å²	123.5	83%	0.826	81%	0.814	S	S	*	*			trans	67.6	148.9	166.8	0	0	0	0	0	118.1
925	G	27.4	Very low	30	Very low	72 Å²	72	124.8 Å²	124.8	74%	0.742	82%	0.823	S	S	*	*			cis	167.5	143.5	-12.4	0	0	0	0	0	114.9
926	A	26.7	Very low	30.1	Very low	113 Å²	113	127.7 Å²	127.7	93%	0.934	82%	0.822	S	S	*	*			trans	62.3	147.5	164.2	0	0	0	0	0	120.8
927	G	30	Very low	30.1	Very low	75 Å²	75	130.4 Å²	130.4	77%	0.773	82%	0.823	S	S	*	*			trans	94.9	102.7	175.7	0	0	0	0	0	113.5
928	A	27.9	Very low	30.1	Very low	101 Å²	101	124.2 Å²	124.2	84%	0.835	81%	0.813	S	S	*	*			cis	79.6	82	17.6	0	0	0	0	0	116.7
929	T	34	Very low	30.2	Very low	142 Å²	142	125 Å²	125	87%	0.871	82%	0.816	S	S	*	*			trans	-142.6	136.9	152.6	45.8	0	0	0	0	110.4
930	N	28.6	Very low	30	Very low	170 Å²	170	120.9 Å²	120.9	91%	0.909	81%	0.812	S	S	*	*			trans	-86.1	150.7	175.7	-65.6	-36	0	0	0	111.8
931	S	34.4	Very low	30	Very low	127 Å²	127	120.7 Å²	120.7	89%	0.888	82%	0.816	S	S	*	*			trans	-151.7	150	136	63.3	0	0	0	0	110.5
932	S	31.8	Very low	29.9	Very low	119 Å²	119	118.4 Å²	118.4	83%	0.832	82%	0.818	S	S	*	*			trans	-111.6	137.2	-166.1	53.4	0	0	0	0	112.7
933	G	33.8	Very low	30.3	Very low	80 Å²	80	121 Å²	121	83%	0.825	82%	0.823	S	S	*	*			trans	-139.3	113.3	170.1	0	0	0	0	0	110.9
934	V	31.8	Very low	30.5	Very low	135 Å²	135	119.7 Å²	119.7	82%	0.818	82%	0.822	S	S	*	*			trans	-105	125.7	-174.1	175.6	0	0	0	0	111
935	T	34	Very low	30.5	Very low	148 Å²	148	123.6 Å²	123.6	91%	0.908	82%	0.821	S	S	*	*			trans	-137.7	158.8	150.9	43.8	0	0	0	0	110.5
936	H	30.1	Very low	30.6	Very low	145 Å²	145	130 Å²	130	67%	0.671	83%	0.828	S	S	*	*			trans	-132.4	142.8	-164.1	159.9	-84.7	0	0	0	108.5
937	L	30.9	Very low	30.6	Very low	146 Å²	146	134.7 Å²	134.7	76%	0.764	83%	0.828	S	S	*	*			trans	-179.4	131.2	149.6	-102.4	162.8	0	0	0	114.8
938	T	30.5	Very low	30.5	Very low	114 Å²	114	135.3 Å²	135.3	70%	0.699	83%	0.826	S	S	*	*			trans	48.9	128.9	151	41.7	0	0	0	0	122.8
939	P	29.9	Very low	30.7	Very low	136 Å²	136	138.5 Å²	138.5	88%	0.883	83%	0.828	S	S	*	*			trans	-84.2	128.4	158.3	33.8	-30.2	0	0	0	111.7
940	G	29.5	Very low	30.5	Very low	66 Å²	66	137 Å²	137	68%	0.68	82%	0.818	S	S	*	*			trans	178.7	160.4	175.3	0	0	0	0	0	116.3
941	T	29.5	Very low	30.6	Very low	149 Å²	149	134.5 Å²	134.5	91%	0.914	81%	0.814	S	S	*	*			trans	54.9	88.4	167.4	51.2	0	0	0	0	118.6
942	G	30.1	Very low	30.3	Very low	78 Å²	78	138.2 Å²	138.2	80%	0.804	81%	0.814	S	S	*	*			trans	-85.9	101.7	162.5	0	0	0	0	0	113
943	L	32.9	Very low	30.3	Very low	157 Å²	157	140.5 Å²	140.5	82%	0.822	82%	0.816	S	S	*	*			trans	41.2	87.4	165.7	-71.9	89.3	0	0	0	118.7
944	T	29.7	Very low	30.1	Very low	141 Å²	141	140.1 Å²	140.1	87%	0.865	81%	0.811	S	S	*	*			trans	-73.8	137.3	146.3	51.4	0	0	0	0	110.6
945	F	27.2	Very low	30.3	Very low	182 Å²	182	145 Å²	145	80%	0.798	82%	0.815	S	S	*	*			trans	-141.5	65.9	176.1	-144.2	-79.6	0	0	0	113.5
946	F	28.3	Very low	30.3	Very low	205 Å²	205	150.3 Å²	150.3	90%	0.899	82%	0.819	S	S	*	*			trans	-174.3	83.7	157	-107.4	-64.1	0	0	0	113.2
947	K	28.3	Very low	30.5	Very low	212 Å²	212	146.7 Å²	146.7	92%	0.922	82%	0.821	S	S	*	*			trans	-170.9	151.1	150.7	-116.5	175.2	-179.1	-178.5	0	113.1
948	A	28.3	Very low	30.8	Very low	88 Å²	88	145.6 Å²	145.6	73%	0.727	82%	0.822	S	S	*	*			trans	65.1	102.5	163.7	0	0	0	0	0	119.9
949	L	30.2	Very low	31.1	Very low	169 Å²	169	147.9 Å²	147.9	89%	0.885	83%	0.83	S	S	*	*			trans	-159.3	76.4	150.3	-114.9	162.9	0	0	0	106
950	T	31.6	Very low	31.3	Very low	109 Å²	109	147 Å²	147	67%	0.669	83%	0.828	S	S	*	*				54.4	80.4	88.9	69.3	0	0	0	0	115.5
951	S	29.1	Very low	31.5	Very low	118 Å²	118	147.7 Å²	147.7	83%	0.825	83%	0.834	S	S	*	*			trans	54.7	127.2	133.7	-56	0	0	0	0	122.9
952	K	28.6	Very low	31.6	Very low	205 Å²	205	144.9 Å²	144.9	89%	0.891	83%	0.826	S	S	*	*			trans	104.3	156.1	137	-138.8	168.9	-172	177.4	0	117.4
953	I	31.8	Very low	31.8	Very low	168 Å²	168	150.8 Å²	150.8	86%	0.862	84%	0.835	S	S	*	*			trans	75.7	119.8	-169.5	-50.8	170	0	0	0	113.5
954	G	29.3	Very low	31.8	Very low	71 Å²	71	146.7 Å²	146.7	73%	0.732	83%	0.831	S	S	*	*			cis	125.5	94.5	-20.1	0	0	0	0	0	116.9
955	R	36.5	Very low	31.9	Very low	239 Å²	239	147.1 Å²	147.1	90%	0.902	83%	0.828	S	S	*	*			trans	-142.4	113.6	157.2	-68.6	-170	177.7	-163.6	-0.4	107.3
956	R	34.4	Very low	32.1	Very low	258 Å²	258	146.5 Å²	146.5	97%	0.974	83%	0.829	S	S	*	*				68.5	135.8	98.1	-73.4	-171.8	175.5	-169.5	-1.4	113.8
957	G	33.7	Very low	32.1	Very low	70 Å²	70	141.2 Å²	141.2	72%	0.722	82%	0.818	S	S	*	*			cis	-146.5	-177	8.1	0	0	0	0	0	114.8
958	P	37	Very low	32.2	Very low	122 Å²	122	140.1 Å²	140.1	79%	0.792	82%	0.816	S	S	*	*			trans	-112.4	166.1	-166.8	40.6	-32.5	0	0	0	114.7
959	N	37.5	Very low	32.3	Very low	163 Å²	163	140.1 Å²	140.1	87%	0.872	82%	0.816	S	S	*	*			trans	-157.7	154	135.2	-118.6	-11.1	0	0	0	114.4
960	S	34.1	Very low	32.1	Very low	118 Å²	118	139.7 Å²	139.7	83%	0.825	81%	0.814	S	S	*	*			trans	-78.9	156.9	-160.9	-48.8	0	0	0	0	118.1
961	G	32.6	Very low	31.8	Very low	79 Å²	79	141 Å²	141	81%	0.814	82%	0.822	S	S	*	*			trans	99.5	155.9	149.8	0	0	0	0	0	117.1
962	A	32.2	Very low	31.8	Very low	90 Å²	90	139.4 Å²	139.4	74%	0.744	82%	0.824	S	S	*	*			cis	-164.8	154.5	-17.9	0	0	0	0	0	109.7
963	M	33.5	Very low	31.8	Very low	203 Å²	203	132.9 Å²	132.9	100%	1	82%	0.815	S	S	*	*			trans	62.8	151.7	178.1	-56.8	175.3	168.3	0	0	115.4
964	G	33.8	Very low	31.6	Very low	70 Å²	70	130.9 Å²	130.9	72%	0.722	81%	0.811	S	S	*	*			cis	-178.8	155	-9.9	0	0	0	0	0	112.5
965	N	32.1	Very low	31.5	Very low	151 Å²	151	133.8 Å²	133.8	81%	0.807	81%	0.809	S	S	*	*			trans	2.7	148.4	149.2	-72.5	9	0	0	0	119.7
966	M	32	Very low	31.2	Very low	169 Å²	169	128.7 Å²	128.7	83%	0.833	80%	0.799	S	S	*	*			cis	-164.9	175.1	8.9	158.9	171.8	-78.8	0	0	110.9
967	S	28.2	Very low	31	Very low	94 Å²	94	120.9 Å²	120.9	66%	0.657	78%	0.784	S	S	*	*			trans	-97	164.9	-172	-39.1	0	0	0	0	116.1
968	Q	29.2	Very low	30.9	Very low	188 Å²	188	124.2 Å²	124.2	88%	0.879	79%	0.785	S	S	*	*			trans	80.9	154.4	147.5	-73.6	176.8	47.7	0	0	122.1
969	A	30	Very low	30.7	Very low	89 Å²	89	124.1 Å²	124.1	74%	0.736	78%	0.782	S	S	*	*			trans	64.2	136	166.5	0	0	0	0	0	117.9
970	L	26	Very low	30.5	Very low	159 Å²	159	121.6 Å²	121.6	83%	0.832	77%	0.774	S	S	*	*			cis	104.4	131.9	23.4	-86.1	170.9	0	0	0	114.4
971	T	26.6	Very low	30.3	Very low	137 Å²	137	124.7 Å²	124.7	84%	0.84	77%	0.773	S	S	*	*			trans	68.4	139.4	165.4	60.3	0	0	0	0	119.3
972	G	28.2	Very low	30.1	Very low	84 Å²	84	125.6 Å²	125.6	87%	0.866	77%	0.767	S	S	*	*			trans	77.4	129.8	172.9	0	0	0	0	0	114.4
973	G	28.5	Very low	29.9	Very low	68 Å²	68	126.2 Å²	126.2	70%	0.701	76%	0.762	S	S	*	*			cis	170.8	173.3	-3.9	0	0	0	0	0	110.9
974	T	28.3	Very low	29.7	Very low	127 Å²	127	120.1 Å²	120.1	78%	0.779	74%	0.743	S	S	*	*			trans	7	132.7	141.7	51.7	0	0	0	0	117.3
975	D	27.7	Very low	29.4	Very low	131 Å²	131	123.2 Å²	123.2	70%	0.701	74%	0.744	S	S	*	*			cis	-174.4	-178.9	19	-132.2	-40.8	0	0	0	115
976	I	30.1	Very low	29.5	Very low	133 Å²	133	121.1 Å²	121.1	68%	0.682	74%	0.741	S	S	*	*			trans	68.7	130	145.6	-72.2	159.5	0	0	0	120.3
977	S	30.3	Very low	29.3	Very low	94 Å²	94	119.3 Å²	119.3	66%	0.657	74%	0.735	S	S	*	*			trans	69.5	150.2	154.9	72.2	0	0	0	0	119.8
978	N	31.7	Very low	29.5	Very low	139 Å²	139	122.6 Å²	122.6	74%	0.743	74%	0.743	S	S	*	*			cis	-153.1	130.3	-22.3	-98.7	-11.6	0	0	0	105.4
979	V	31.4	Very low	29.4	Very low	121 Å²	121	117 Å²	117	73%	0.733	74%	0.735	S	S	*	*				33.8	149.6	93.5	-49.3	0	0	0	0	116.7
980	P	34	Very low	29.4	Very low	109 Å²	109	117.2 Å²	117.2	71%	0.708	74%	0.737	S	S	*	*				-132.4	179.4	-61.7	39.1	-24.3	0	0	0	110.9
981	F	29.8	Very low	29.5	Very low	184 Å²	184	114.6 Å²	114.6	81%	0.807	73%	0.732	S	S	*	*			trans	-166.1	141.4	152.3	-125	-132.9	0	0	0	107
982	S	28	Very low	29.6	Very low	98 Å²	98	114 Å²	114	69%	0.685	73%	0.729	S	S	*	*			cis	60.4	149.1	38	-59.3	0	0	0	0	112.1
983	T	28	Very low	29.6	Very low	103 Å²	103	116.1 Å²	116.1	63%	0.632	73%	0.725	S	S	*	*			cis	-135.1	138.9	3.3	-5.1	0	0	0	0	105.6
984	A	29	Very low	29.7	Very low	74 Å²	74	117.5 Å²	117.5	61%	0.612	72%	0.724	S	S	*	*				61.1	147.3	92.9	0	0	0	0	0	115.9
985	D	27.8	Very low	29.7	Very low	136 Å²	136	117.4 Å²	117.4	73%	0.727	73%	0.728	S	S	*	*			trans	65.2	135.1	167.9	-48.2	-48.9	0	0	0	116.2
986	S	35.3	Very low	30	Very low	106 Å²	106	114.6 Å²	114.6	74%	0.741	73%	0.73	S	S	*	*			cis	-136.9	149	29.3	-53.9	0	0	0	0	110.2
987	N	28.2	Very low	30.1	Very low	132 Å²	132	114.3 Å²	114.3	71%	0.706	74%	0.74	S	S	*	*				41.6	109.1	73.5	-67.1	-37.5	0	0	0	110.5
988	I	31	Very low	30.2	Very low	163 Å²	163	113 Å²	113	84%	0.836	74%	0.741	S	S	*	*				-158.2	144.4	65.7	-78.1	147.6	0	0	0	105
989	G	28.4	Very low	30.3	Very low	69 Å²	69	117 Å²	117	71%	0.711	75%	0.748	S	S	*	*				68.2	147.6	77.1	0	0	0	0	0	112.1
990	A	29.5	Very low	30.5	Very low	94 Å²	94	118.8 Å²	118.8	78%	0.777	75%	0.752	S	S	*	*			cis	-150	164.2	2.5	0	0	0	0	0	111.4
991	S	27.8	Very low	30.9	Very low	105 Å²	105	119.2 Å²	119.2	73%	0.734	75%	0.754	S	S	*	*			trans	-45.9	145.6	161.2	50.7	0	0	0	0	115.2
992	T	29.3	Very low	31.2	Very low	124 Å²	124	113.4 Å²	113.4	76%	0.761	75%	0.747	S	S	*	*				-166.2	115	127.2	26.8	0	0	0	0	113.6
993	T	27.5	Very low	31.4	Very low	128 Å²	128	116.1 Å²	116.1	79%	0.785	75%	0.754	S	S	*	*			trans	60.9	162.7	133.6	62.7	0	0	0	0	124.6
994	S	30.2	Very low	31.6	Very low	98 Å²	98	116.2 Å²	116.2	69%	0.685	76%	0.759	S	S	*	*			trans	77.5	78	146.3	43.4	0	0	0	0	122.2
995	S	28.7	Very low	31.6	Very low	125 Å²	125	117.9 Å²	117.9	87%	0.874	76%	0.761	S	S	*	*				51.7	127.7	111.3	63.5	0	0	0	0	123.7
996	G	33.9	Very low	31.8	Very low	72 Å²	72	120.8 Å²	120.8	74%	0.742	77%	0.767	S	S	*	*			trans	151.7	104.9	159.4	0	0	0	0	0	110.7
997	S	32.4	Very low	31.6	Very low	127 Å²	127	120.1 Å²	120.1	89%	0.888	76%	0.763	S	S	*	*				62.5	124.4	63.2	-163.4	0	0	0	0	112.8
998	G	31.8	Very low	31.6	Very low	65 Å²	65	120.2 Å²	120.2	67%	0.67	76%	0.763	S	S	*	*			cis	-152.9	-165.7	-2.1	0	0	0	0	0	109
999	Y	35.1	Very low	31.6	Very low	225 Å²	225	116.6 Å²	116.6	88%	0.882	75%	0.753	S	S	*	*			cis	-149.9	-178.1	22.5	-119.5	-100	0	0	0	112.2
1000	L	33.6	Very low	31.7	Very low	158 Å²	158	118.2 Å²	118.2	83%	0.827	75%	0.753	S	S	*	*			trans	-131.4	-154.2	-168.9	-78.4	170.4	0	0	0	111.1
1001	P	44.3	Very low	31.8	Very low	117 Å²	117	119.5 Å²	119.5	76%	0.76	75%	0.751	S	S	*	*				-131.3	-164.1	-71.7	40.3	-24.4	0	0	0	114.2
1002	G	36.3	Very low	31.9	Very low	63 Å²	63	123.3 Å²	123.3	65%	0.649	76%	0.757	S	S	*	*			trans	149.1	118.6	159.6	0	0	0	0	0	111.3
1003	D	32.2	Very low	32	Very low	155 Å²	155	120.7 Å²	120.7	83%	0.829	75%	0.754	S	S	*	*				66.4	133.6	50.8	-59.8	-45.4	0	0	0	112.9
1004	S	31.4	Very low	32.1	Very low	105 Å²	105	119 Å²	119	73%	0.734	75%	0.753	S	S	*	*			cis	-157.1	147.4	21.9	46.5	0	0	0	0	116.5
1005	V	29.6	Very low	32.1	Very low	109 Å²	109	123.7 Å²	123.7	66%	0.661	76%	0.757	S	S	*	*			trans	41.2	121.9	131.9	-167.5	0	0	0	0	121.8
1006	F	31.9	Very low	32.2	Very low	196 Å²	196	124.8 Å²	124.8	86%	0.86	76%	0.759	S	S	*	*				-175.1	155.5	109.3	-105.9	-68.3	0	0	0	116.2
1007	S	30.7	Very low	32.3	Very low	93 Å²	93	129 Å²	129	65%	0.65	76%	0.76	S	S	*	*			trans	-83.8	-172.7	-177	-36	0	0	0	0	113.7
1008	D	28.5	Very low	32.5	Very low	133 Å²	133	128.4 Å²	128.4	71%	0.711	75%	0.752	S	S	*	*			cis	-161.8	176.2	4.9	-147.1	-69.7	0	0	0	111.2
1009	S	30.5	Very low	32.5	Very low	88 Å²	88	130.9 Å²	130.9	62%	0.615	75%	0.754	S	S	*	*			trans	62.6	120.2	145.9	-80.7	0	0	0	0	121.1
1010	S	29.5	Very low	32.5	Very low	102 Å²	102	124.9 Å²	124.9	71%	0.713	75%	0.745	S	S	*	*				78.7	144.2	71.2	84.1	0	0	0	0	112.9
1011	V	31.6	Very low	32.4	Very low	121 Å²	121	125.1 Å²	125.1	73%	0.733	74%	0.742	S	S	*	*			cis	-145	178.6	35.9	175.7	0	0	0	0	112.3
1012	H	31.7	Very low	31.8	Very low	185 Å²	185	125.5 Å²	125.5	86%	0.856	74%	0.737	S	S	*	*			trans	-47.3	170.1	168.8	-45.7	-44.2	0	0	0	116
1013	G	29.8	Very low	31.9	Very low	69 Å²	69	127 Å²	127	71%	0.711	73%	0.734	S	S	*	*			cis	134.8	166.9	1.4	0	0	0	0	0	113
1014	A	31.3	Very low	32.4	Very low	93 Å²	93	125 Å²	125	77%	0.769	73%	0.729	S	S	*	*			trans	69.2	123.7	-174.5	0	0	0	0	0	115
1015	Y	28.9	Very low	32.4	Very low	196 Å²	196	124 Å²	124	77%	0.769	74%	0.736	S	S	*	*				79.6	97.3	60.4	-69.9	-57.7	0	0	0	115
1016	T	30.9	Very low	32.7	Very low	149 Å²	149	122.1 Å²	122.1	91%	0.914	74%	0.739	S	S	*	*				-171.7	150.1	122.9	24.5	0	0	0	0	113.2
1017	E	36.3	Very low	33	Very low	161 Å²	161	118.8 Å²	118.8	75%	0.752	74%	0.74	S	S	*	*			trans	-63.3	161.6	159.5	-77.9	-72.7	148.4	0	0	110.9
1018	P	36.1	Very low	33.4	Very low	113 Å²	113	119.4 Å²	119.4	73%	0.734	74%	0.744	S	S	*	*				-161.6	162.8	56.1	44.6	-22	0	0	0	121.8
1019	V	32.5	Very low	33.8	Very low	117 Å²	117	118.1 Å²	118.1	71%	0.709	75%	0.752	S	S	*	*				47	100.2	129.6	-172.5	0	0	0	0	121.7
1020	S	34.2	Very low	34	Very low	99 Å²	99	117.5 Å²	117.5	69%	0.692	76%	0.759	S	S	*	*				90.8	158.2	128.8	82	0	0	0	0	125.2
1021	Q	32.6	Very low	34.4	Very low	164 Å²	164	118 Å²	118	77%	0.766	76%	0.763	S	S	*	*			trans	89.5	109	157.4	-63.5	-164.8	29.9	0	0	123.7
1022	L	32	Very low	35.1	Very low	125 Å²	125	117.9 Å²	117.9	65%	0.654	76%	0.764	S	S	*	*				79.5	77.9	120.3	-63	177.4	0	0	0	125.4
1023	T	37.4	Very low	35.4	Very low	93 Å²	93	116 Å²	116	57%	0.571	77%	0.766	S	S	*	*				73.3	-175.8	116.1	64.3	0	0	0	0	120.1	P886	P886-T1023 HydrophobicContact CG-CG2 3.27Å
1024	P	43	Very low	35.8	Very low	113 Å²	113	118.2 Å²	118.2	73%	0.734	77%	0.768	S	S	*	*				-143.8	175.3	-100.3	43.1	-21.5	0	0	0	119.8
1025	G	32.3	Very low	36	Very low	85 Å²	85	123.5 Å²	123.5	88%	0.876	78%	0.776	S	S	*	*			trans	94.9	160.3	157.6	0	0	0	0	0	116.7
1026	G	35	Very low	36.1	Very low	70 Å²	70	117.9 Å²	117.9	72%	0.722	78%	0.778	S	S	*	*			cis	163.1	158.8	-9.1	0	0	0	0	0	113.2
1027	S	37.8	Very low	36.1	Very low	126 Å²	126	114.3 Å²	114.3	88%	0.881	77%	0.771	S	S	*	*			trans	69.7	155.8	169.1	-68	0	0	0	0	117.6
1028	S	40.3	Very low	35.8	Very low	105 Å²	105	113.6 Å²	113.6	73%	0.734	77%	0.773	S	S	*	*			cis	-166.1	144.7	-10.5	43.1	0	0	0	0	114.8
1029	A	35.4	Very low	35.6	Very low	106 Å²	106	116.3 Å²	116.3	88%	0.876	78%	0.775	S	S	*	*			trans	70.5	133.5	138.2	0	0	0	0	0	123.1
1030	G	36	Very low	35.4	Very low	75 Å²	75	117.6 Å²	117.6	77%	0.773	78%	0.783	S	S	*	*			trans	-179.9	126.4	165.7	0	0	0	0	0	109.9
1031	S	38.2	Very low	35.4	Very low	114 Å²	114	118.8 Å²	118.8	80%	0.797	79%	0.786	S	S	*	*			trans	-138.3	-174.1	-167.6	-53.3	0	0	0	0	111.3
1032	P	45.7	Very low	35.5	Very low	117 Å²	117	116.1 Å²	116.1	76%	0.76	78%	0.783	S	S	*	*				-133.8	159.3	-76.8	39.8	-24.6	0	0	0	114.6
1033	V	38.7	Very low	35.4	Very low	146 Å²	146	119.1 Å²	119.1	89%	0.885	79%	0.793	S	S	*	*			trans	-144.7	134.2	159.3	-173	0	0	0	0	110.2
1034	P	36.9	Very low	35.2	Very low	116 Å²	116	120.4 Å²	120.4	75%	0.753	80%	0.801	S	S	*	*			trans	-109.5	148.1	-178.8	38.4	-31.6	0	0	0	114.6
1035	Q	35.2	Very low	34.6	Very low	203 Å²	203	121.9 Å²	121.9	95%	0.949	80%	0.803	S	S	*	*			trans	-165.1	157.6	160.1	-116.3	177.5	34.2	0	0	112.8
1036	G	31.7	Very low	34.7	Very low	78 Å²	78	124.7 Å²	124.7	80%	0.804	80%	0.798	S	S	*	*			trans	73.1	88.2	160.1	0	0	0	0	0	117
1037	G	30.1	Very low	34.7	Very low	75 Å²	75	128.9 Å²	128.9	77%	0.773	80%	0.804	S	S	*	*			trans	-86.9	174.6	-177.8	0	0	0	0	0	115.9
1038	N	31.2	Very low	34.8	Very low	146 Å²	146	128.8 Å²	128.8	78%	0.781	80%	0.798	S	S	*	*			trans	-154.8	141.5	152.3	-121	-43.6	0	0	0	111.8
1039	Q	31	Very low	34.8	Very low	170 Å²	170	127.3 Å²	127.3	79%	0.794	78%	0.782	S	S	*	*			trans	35.5	96.4	158.8	-65.7	172.4	54.7	0	0	118.8	V1041	Q1039-V1041 PolarHBondContact O-N 2.74Å
1040	T	29.6	Very low	35.2	Very low	143 Å²	143	128.8 Å²	128.8	88%	0.877	78%	0.775	S	S	*	*			trans	-68.9	112	167.2	47.2	0	0	0	0	112.1
1041	V	33.6	Very low	35.8	Very low	124 Å²	124	133.7 Å²	133.7	75%	0.752	78%	0.778	S	S	*	*			trans	-81.8	127.4	159.4	-178.4	0	0	0	0	108.1	Q1039 H1043	Q1039-V1041 PolarHBondContact O-N 2.74Å; V1041-H1043 PolarHBondContact O-N 3.19Å; V1041-H1043 VanDerWaalsContact O-N 3.15Å
1042	P	33.4	Very low	37.1	Very low	108 Å²	108	130.2 Å²	130.2	70%	0.701	75%	0.752	S	S	*	*			trans	-74.4	106	178.8	29.2	-33.1	0	0	0	110.7	T1044	P1042-T1044 PolarHBondContact O-N 3.12Å
1043	H	30.3	Very low	38.7	Very low	188 Å²	188	130.5 Å²	130.5	87%	0.87	74%	0.741	S	S	*	*			trans	-62.6	125.4	159.2	-91.9	-91	0	0	0	108.8	V1041	V1041-H1043 PolarHBondContact O-N 3.19Å; V1041-H1043 VanDerWaalsContact O-N 3.15Å
1044	T	34.8	Very low	40.8	Very low	120 Å²	120	124.7 Å²	124.7	74%	0.736	71%	0.706	S	S	*	*			trans	-95.7	133.4	179.3	48	0	0	0	0	111.1	P1042 D1046	P1042-T1044 PolarHBondContact O-N 3.12Å; T1044-D1046 PolarHBondContact O-N 3.08Å
1045	D	29.6	Very low	43.2	Very low	145 Å²	145	124.4 Å²	124.4	78%	0.775	69%	0.69	S	S	*	*			trans	-64	114.7	-179.2	-69.4	-74.3	0	0	0	113.7	N1047	D1045-N1047 PolarHBondContact O-N 3.08Å
1046	D	34.7	Very low	45.4	Very low	143 Å²	143	118.2 Å²	118.2	77%	0.765	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	15.7	-179.5	-108.4	-40.4	0	0	0	114.7	T1044	T1044-D1046 PolarHBondContact O-N 3.08Å
1047	N	35.4	Very low	47.2	Very low	159 Å²	159	116.2 Å²	116.2	85%	0.85	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.4	7.6	-169.2	-116.9	-34.3	0	0	0	115.6	D1045	D1045-N1047 PolarHBondContact O-N 3.08Å
1048	V	39.3	Very low	48.2	Very low	123 Å²	123	115.6 Å²	115.6	75%	0.745	61%	0.614	S	S	*	*	S	Bend	trans	-108.7	-1.1	179.3	-169.4	0	0	0	0	112.3	D1050	V1048-D1050 PolarHBondContact O-N 3.48Å
1049	N	39.8	Very low	49.3	Very low	75 Å²	75	110.9 Å²	110.9	40%	0.401	59%	0.587	S	S	.	*	G	3₁₀ helix	trans	-90.7	2.1	-153.1	-151.7	-1.5	0	0	0	116.3	Q1051 T1052	N1049-Q1051 PolarHBondContact O-N 2.88Å; N1049-T1052 PolarHBondContact O-N 3.33Å; N1049-T1052 PolarHBondContact O-OG1 3.12Å; N1049-T1052 WeakPolarHBondContact OD1-CB 3.27Å; N1049-T1052 WeakPolarHBondContact OD1-CG2 3.33Å; N1049-T1052 PolarHBondContact OD1-OG1 2.98Å
1050	D	45	Very low	50.6	Low	137 Å²	137	105 Å²	105	73%	0.733	56%	0.562	S	S	*	*	G	3₁₀ helix	trans	-86.5	-3.9	-174.2	-120.3	18.6	0	0	0	115.3	V1048 K1053	V1048-D1050 PolarHBondContact O-N 3.48Å; D1050-K1053 IonicContact OD1-NZ 3.4Å; D1050-K1053 PolarHBondContact OD1-NZ 3.47Å
1051	Q	48.6	Very low	51.5	Low	177 Å²	177	101.9 Å²	101.9	83%	0.827	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-91.5	0.8	167.9	-63.4	-168	20.7	0	0	113.9	N1049	N1049-Q1051 PolarHBondContact O-N 2.88Å
1052	T	64.3	Low	52.7	Low	41 Å²	41	99 Å²	99	25%	0.252	52%	0.52	S	S	.	.	S	Bend	trans	-93.4	-1.2	-171.4	67.9	0	0	0	0	114.9	N1049 Y1095	N1049-T1052 PolarHBondContact O-N 3.33Å; N1049-T1052 PolarHBondContact O-OG1 3.12Å; N1049-T1052 WeakPolarHBondContact OD1-CB 3.27Å; N1049-T1052 WeakPolarHBondContact OD1-CG2 3.33Å; N1049-T1052 PolarHBondContact OD1-OG1 2.98Å; T1052-Y1095 WeakPolarHBondContact O-CE2 3.36Å; T1052-Y1095 PolarHBondContact O-OH 3.19Å; T1052-Y1095 VanDerWaalsContact O-OH 3.13Å
1053	K	78.5	Confident	54.4	Low	124 Å²	124	94.7 Å²	94.7	54%	0.539	49%	0.49	S	S	.	.	S	Bend	trans	-110.6	143.3	-175	-60	157.6	-160.7	155.3	0	110.5	D1050 Y1095	D1050-K1053 IonicContact OD1-NZ 3.4Å; D1050-K1053 PolarHBondContact OD1-NZ 3.47Å; K1053-Y1095 VanDerWaalsContact C-CE2 3.45Å
1054	P	84.6	Confident	56.4	Low	23 Å²	23	89.6 Å²	89.6	15%	0.149	47%	0.466	C	S	.	.			trans	-64.7	145.3	176.6	30	-39.2	0	0	0	111.3	S1056 P1071 Y1095 V1116 K1118	P1054-S1056 PolarHBondContact O-N 3.06Å; P1054-P1071 HydrophobicContact CB-CB 4.35Å; P1054-P1071 HydrophobicContact CB-CG 4.33Å; P1054-P1071 HydrophobicContact CG-CB 4.17Å; P1054-P1071 HydrophobicContact CG-CG 3.66Å; P1054-Y1095 VanDerWaalsContact CA-CD2 3.46Å; P1054-Y1095 HydrophobicContact CB-CD2 3.97Å; P1054-Y1095 HydrophobicContact CB-CE2 4.29Å; P1054-Y1095 HydrophobicContact CB-CG 4.1Å; P1054-V1116 WeakPolarHBondContact CB-O 3.17Å; P1054-K1118 HydrophobicContact CG-CB 4.22Å
1055	R	86.5	Confident	58.6	Low	110 Å²	110	85.4 Å²	85.4	42%	0.415	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	126.3	-179	-166.3	172.2	-62.8	138.5	1.8	109.9	L1057 E1093 E1115 C1117 K1118	R1055-L1057 PolarHBondContact O-N 3.07Å; R1055-E1093 IonicContact CZ-OE2 3.91Å; R1055-E1093 IonicContact NH2-OE1 2.68Å; R1055-E1093 IonicContact NH2-OE2 2.62Å; R1055-E1093 PolarHBondContact NH2-OE2 3.28Å; R1055-E1115 WeakPolarHBondContact CB-OE1 3.45Å; R1055-E1115 WeakPolarHBondContact CD-OE1 3.44Å; R1055-E1115 IonicContact CZ-OE1 2.86Å; R1055-E1115 VanDerWaalsContact CZ-OE1 3.28Å; R1055-E1115 IonicContact NE-OE1 2.77Å; R1055-E1115 PolarHBondContact NE-OE1 3.28Å; R1055-E1115 IonicContact NH1-OE1 2.7Å; R1055-E1115 PolarHBondContact NH1-OE1 2.88Å; R1055-E1115 IonicContact NH1-OE2 2.74Å; R1055-E1115 PolarHBondContact NH1-OE2 2.87Å; R1055-C1117 CarbonylContact O-C 3.56Å; R1055-C1117 WeakPolarHBondContact O-CA 3.32Å; R1055-C1117 WeakPolarHBondContact O-CB 3.44Å; R1055-K1118 PolarHBondContact O-N 2.89Å
1056	S	81.2	Confident	61.3	Low	73 Å²	73	80.7 Å²	80.7	51%	0.51	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	107.3	176.6	-180	0	0	0	0	109.5	P1054 P1120	P1054-S1056 PolarHBondContact O-N 3.06Å; S1056-P1120 WeakPolarHBondContact OG-CD 3.39Å; S1056-P1120 WeakPolarHBondContact OG-CG 3.42Å
1057	L	68.7	Low	63.9	Low	36 Å²	36	74 Å²	74	19%	0.188	38%	0.381	C	S	.	.			trans	-83.3	130.1	178.8	-82.3	-176.8	0	0	0	111.7	R1055 F1059 M1063 C1117 K1118 L1119 R1128	R1055-L1057 PolarHBondContact O-N 3.07Å; L1057-F1059 VanDerWaalsContact C-N 3.3Å; L1057-F1059 PolarHBondContact O-N 2.75Å; L1057-M1063 HydrophobicContact CB-CE 4.32Å; L1057-M1063 HydrophobicContact CD1-CE 3.55Å; L1057-M1063 HydrophobicContact CD1-SD 4.48Å; L1057-C1117 HydrophobicContact CB-CB 4.12Å; L1057-C1117 HydrophobicContact CD1-CB 3.58Å; L1057-C1117 WeakPolarHBondContact CD1-SG 3.41Å; L1057-C1117 HydrophobicContact CG-CB 3.65Å; L1057-K1118 PolarHBondContact N-O 3.29Å; L1057-L1119 HydrophobicContact CB-CD2 4.35Å; L1057-R1128 HydrophobicContact CD1-CB 4.21Å
1058	R	53.1	Low	66.3	Low	62 Å²	62	71.5 Å²	71.5	23%	0.234	38%	0.376	C	S	.	.	S	Bend	trans	-70.4	-26.1	-178.8	-165.3	161.3	-158	32.8	79.6	113.4	E129 F131 D132	E129-R1058 IonicContact OE2-NE 2.76Å; E129-R1058 PolarHBondContact OE2-NE 2.99Å; F131-R1058 VanDerWaalsContact C-CZ 3.44Å; F131-R1058 HydrophobicContact CD1-CG 3.81Å; F131-R1058 HydrophobicContact CE1-CG 3.77Å; F131-R1058 VanDerWaalsContact CE1-NH2 3.27Å; F131-R1058 PolarHBondContact O-NH2 2.95Å; D132-R1058 IonicContact OD1-CZ 3.82Å; D132-R1058 IonicContact OD1-NE 2.84Å; D132-R1058 PolarHBondContact OD1-NE 2.92Å; D132-R1058 VanDerWaalsContact OD1-NE 3.15Å; D132-R1058 IonicContact OD1-NH1 2.67Å; D132-R1058 PolarHBondContact OD1-NH1 2.96Å
1059	F	53.3	Low	68.7	Low	48 Å²	48	68.7 Å²	68.7	21%	0.211	36%	0.356	C	S	.	.	S	Bend	trans	-137.8	147.1	-179.3	-63.2	-80.8	0	0	0	110.4	F131 E172 L1057 W1061	F131-F1059 AromaticContact CD1-CE1 3.99Å; F131-F1059 HydrophobicContact CD1-CE1 3.99Å; F131-F1059 AromaticContact CD1-CE2 3.88Å; F131-F1059 HydrophobicContact CD1-CE2 3.88Å; F131-F1059 AromaticContact CD1-CZ 3.36Å; F131-F1059 HydrophobicContact CD1-CZ 3.36Å; F131-F1059 HydrophobicContact CE1-CD1 4.06Å; F131-F1059 AromaticContact CE1-CE1 3.29Å; F131-F1059 HydrophobicContact CE1-CE1 3.29Å; F131-F1059 AromaticContact CE1-CE2 3.81Å; F131-F1059 HydrophobicContact CE1-CE2 3.81Å; F131-F1059 AromaticContact CE1-CZ 3.15Å; F131-F1059 HydrophobicContact CE1-CZ 3.15Å; F131-F1059 AromaticContact CZ-CE1 3.9Å; F131-F1059 HydrophobicContact CZ-CE1 3.9Å; F131-F1059 HydrophobicContact CZ-CZ 4.14Å; E172-F1059 HydrophobicContact CG-CE2 3.93Å; E172-F1059 HydrophobicContact CG-CZ 4.37Å; E172-F1059 WeakPolarHBondContact OE1-CE2 3.27Å; L1057-F1059 VanDerWaalsContact C-N 3.3Å; L1057-F1059 PolarHBondContact O-N 2.75Å; F1059-W1061 HydrophobicContact CB-CB 4.21Å; F1059-W1061 HydrophobicContact CB-CG 4.33Å; F1059-W1061 PolarHBondContact O-N 3.15Å
1060	T	58	Low	71.1	Confident	45 Å²	45	68 Å²	68	28%	0.276	36%	0.356	S	S	.	.			trans	-75.1	9.7	170.8	43.9	0	0	0	0	113.6	M1063 L1119 L1122	T1060-M1063 WeakPolarHBondContact O-CB 3.24Å; T1060-M1063 PolarHBondContact O-N 3.12Å; T1060-M1063 VanDerWaalsContact O-N 3.12Å; T1060-L1119 HydrophobicContact CG2-CD1 4Å; T1060-L1119 HydrophobicContact CG2-CD2 3.73Å; T1060-L1119 HydrophobicContact CG2-CG 4.48Å; T1060-L1122 HydrophobicContact CG2-CD1 4.1Å
1061	W	49.1	Very low	73.4	Confident	79 Å²	79	62.4 Å²	62.4	30%	0.299	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	133.3	-175.4	-78.6	59.3	0	0	0	110.5	P206 P207 L248 L251 F1059 M1063	P206-W1061 HydrophobicContact CB-CH2 3.86Å; P206-W1061 HydrophobicContact CB-CZ3 4.03Å; P206-W1061 HydrophobicContact CG-CH2 4.28Å; P206-W1061 HydrophobicContact CG-CZ3 3.93Å; P207-W1061 HydrophobicContact CG-CH2 3.92Å; P207-W1061 HydrophobicContact CG-CZ2 3.45Å; P207-W1061 VanDerWaalsContact CG-CZ2 3.45Å; L248-W1061 HydrophobicContact CD2-CH2 3.67Å; L248-W1061 HydrophobicContact CD2-CZ3 3.7Å; L251-W1061 HydrophobicContact CD2-CH2 3.55Å; L251-W1061 HydrophobicContact CD2-CZ2 3.76Å; F1059-W1061 HydrophobicContact CB-CB 4.21Å; F1059-W1061 HydrophobicContact CB-CG 4.33Å; F1059-W1061 PolarHBondContact O-N 3.15Å; W1061-M1063 PolarHBondContact O-N 3.42Å
1062	S	58.4	Low	75.5	Confident	62 Å²	62	56.9 Å²	56.9	43%	0.434	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.1	10	-167	63.9	0	0	0	0	116.6	R1128 F1129	S1062-R1128 WeakPolarHBondContact O-CA 3.28Å; S1062-R1128 PolarHBondContact OG-NE 3.38Å; S1062-R1128 VanDerWaalsContact OG-NE 3.12Å; S1062-F1129 PolarHBondContact O-N 3.39Å
1063	M	68.6	Low	76.8	Confident	18 Å²	18	58 Å²	58	9%	0.089	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	134.6	164.3	-142.2	73.5	58.3	0	0	109.8	L1057 T1060 W1061 T1066 L1119 V1127 R1128	L1057-M1063 HydrophobicContact CB-CE 4.32Å; L1057-M1063 HydrophobicContact CD1-CE 3.55Å; L1057-M1063 HydrophobicContact CD1-SD 4.48Å; T1060-M1063 WeakPolarHBondContact O-CB 3.24Å; T1060-M1063 PolarHBondContact O-N 3.12Å; T1060-M1063 VanDerWaalsContact O-N 3.12Å; W1061-M1063 PolarHBondContact O-N 3.42Å; M1063-T1066 HydrophobicContact CG-CG2 4.16Å; M1063-L1119 HydrophobicContact CE-CD1 3.91Å; M1063-L1119 HydrophobicContact CE-CD2 3.71Å; M1063-L1119 HydrophobicContact CE-CG 4.06Å; M1063-L1119 HydrophobicContact CG-CD1 4.34Å; M1063-L1119 HydrophobicContact SD-CD1 4.42Å; M1063-V1127 WeakPolarHBondContact CA-O 3.33Å; M1063-V1127 VanDerWaalsContact SD-C 3.55Å; M1063-V1127 PolarHBondContact SD-N 3.07Å; M1063-R1128 HydrophobicContact SD-CB 4.05Å
1064	K	72.5	Confident	77.6	Confident	81 Å²	81	52.1 Å²	52.1	35%	0.352	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	-30.2	175.9	-81.6	-147.5	166.6	-154.3	0	114.4	V1127 F1129 A1143 S1144 A1147	K1064-V1127 PolarHBondContact N-O 3.13Å; K1064-F1129 HydrophobicContact CB-CD2 3.69Å; K1064-F1129 HydrophobicContact CB-CE2 3.67Å; K1064-F1129 HydrophobicContact CD-CD2 3.89Å; K1064-F1129 HydrophobicContact CD-CE2 4.01Å; K1064-F1129 HydrophobicContact CD-CG 4.22Å; K1064-F1129 HydrophobicContact CD-CZ 4.41Å; K1064-F1129 HydrophobicContact CG-CD2 3.66Å; K1064-F1129 HydrophobicContact CG-CE2 4.03Å; K1064-F1129 HydrophobicContact CG-CG 4.28Å; K1064-A1143 VanDerWaalsContact CD-O 3.27Å; K1064-A1143 WeakPolarHBondContact CD-O 3.42Å; K1064-A1143 WeakPolarHBondContact CE-O 3.47Å; K1064-A1143 PolarHBondContact NZ-O 2.96Å; K1064-S1144 PolarHBondContact NZ-OG 3.42Å; K1064-A1147 HydrophobicContact CB-CB 4.09Å; K1064-A1147 HydrophobicContact CD-CB 3.52Å; K1064-A1147 HydrophobicContact CG-CB 4.47Å
1065	T	80.7	Confident	78.1	Confident	32 Å²	32	51.6 Å²	51.6	20%	0.196	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	159.9	174.1	-176.2	0	0	0	0	110.3	G1126 V1127 L1150 L1152	T1065-G1126 VanDerWaalsContact O-CA 3.29Å; T1065-G1126 WeakPolarHBondContact O-CA 3.34Å; T1065-V1127 HydrophobicContact CG2-CB 4.15Å; T1065-V1127 HydrophobicContact CG2-CG2 4.04Å; T1065-V1127 PolarHBondContact O-N 2.94Å; T1065-L1150 HydrophobicContact CG2-CD1 4.21Å; T1065-L1152 HydrophobicContact CG2-CB 4.18Å; T1065-L1152 HydrophobicContact CG2-CD1 3.77Å
1066	T	86.9	Confident	78.4	Confident	47 Å²	47	52.8 Å²	52.8	29%	0.288	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	134.2	-176.9	52.9	0	0	0	0	110.2	M1063 L1119 N1125	M1063-T1066 HydrophobicContact CG-CG2 4.16Å; T1066-L1119 HydrophobicContact CG2-CD1 3.67Å; T1066-N1125 CarbonylContact C-O 3.02Å; T1066-N1125 VanDerWaalsContact CA-O 3.23Å; T1066-N1125 WeakPolarHBondContact CA-O 3.42Å
1067	S	88.5	Confident	79.1	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.014	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	152.3	-171.8	-165.9	0	0	0	0	112.6	M1069 N1125 L1152	S1067-M1069 VanDerWaalsContact OG-CB 3.32Å; S1067-M1069 WeakPolarHBondContact OG-CB 3.31Å; S1067-M1069 WeakPolarHBondContact OG-CG 3.48Å; S1067-M1069 PolarHBondContact OG-N 2.75Å; S1067-N1125 PolarHBondContact N-O 3.07Å; S1067-N1125 PolarHBondContact O-N 3.34Å; S1067-L1152 WeakPolarHBondContact CA-OXT 3.37Å; S1067-L1152 WeakPolarHBondContact CB-OXT 3.04Å; S1067-L1152 PolarHBondContact OG-OXT 3.26Å
1068	S	87	Confident	80.4	Confident	107 Å²	107	49 Å²	49	75%	0.748	26%	0.259	S	S	*	.	S	Bend	trans	-85	-9.2	164	56.7	0	0	0	0	112.9
1069	M	88.5	Confident	82.4	Confident	63 Å²	63	49 Å²	49	31%	0.31	26%	0.261	S	S	.	.	S	Bend	trans	-61.4	149.3	177	-67.6	176	63.1	0	0	111.9	S1067 N1073 M1074 N1125 L1152	S1067-M1069 VanDerWaalsContact OG-CB 3.32Å; S1067-M1069 WeakPolarHBondContact OG-CB 3.31Å; S1067-M1069 WeakPolarHBondContact OG-CG 3.48Å; S1067-M1069 PolarHBondContact OG-N 2.75Å; M1069-N1073 HydrophobicContact CE-CB 3.93Å; M1069-M1074 HydrophobicContact CB-CG 4Å; M1069-N1125 PolarHBondContact O-ND2 3.42Å; M1069-L1152 HydrophobicContact CE-CD2 4.4Å; M1069-L1152 HydrophobicContact SD-CD2 3.82Å
1070	C	91.4	Very high	84.5	Confident	61 Å²	61	52.2 Å²	52.2	41%	0.412	28%	0.275	S	S	.	.			trans	-67.6	147.5	175.9	66.9	0	0	0	0	111.5	D1072 N1073 M1074	C1070-D1072 VanDerWaalsContact C-N 3.31Å; C1070-D1072 PolarHBondContact O-N 3.42Å; C1070-N1073 PolarHBondContact O-N 2.8Å; C1070-N1073 VanDerWaalsContact SG-CG 3.54Å; C1070-N1073 PolarHBondContact SG-ND2 3.3Å; C1070-N1073 VanDerWaalsContact SG-ND2 3.42Å; C1070-M1074 PolarHBondContact O-N 2.95Å; C1070-M1074 VanDerWaalsContact O-N 3.11Å
1071	P	92.3	Very high	86.3	Confident	19 Å²	19	50.4 Å²	50.4	12%	0.123	26%	0.264	C	S	.	.	H	α-helix	trans	-54.6	-41.6	-171.2	-28.9	36.8	0	0	0	114.3	P1054 N1073 M1074 I1075 Y1095 V1116	P1054-P1071 HydrophobicContact CB-CB 4.35Å; P1054-P1071 HydrophobicContact CB-CG 4.33Å; P1054-P1071 HydrophobicContact CG-CB 4.17Å; P1054-P1071 HydrophobicContact CG-CG 3.66Å; P1071-N1073 VanDerWaalsContact C-N 3.3Å; P1071-N1073 PolarHBondContact O-N 3.31Å; P1071-M1074 WeakPolarHBondContact O-CB 3.35Å; P1071-M1074 PolarHBondContact O-N 3.12Å; P1071-M1074 VanDerWaalsContact O-N 3.16Å; P1071-I1075 WeakPolarHBondContact O-CG1 3.27Å; P1071-I1075 PolarHBondContact O-N 3.15Å; P1071-Y1095 HydrophobicContact CB-CD1 3.82Å; P1071-Y1095 HydrophobicContact CB-CE1 3.33Å; P1071-V1116 HydrophobicContact CB-CG1 4Å
1072	D	92.8	Very high	88.5	Confident	61 Å²	61	46.6 Å²	46.6	33%	0.326	25%	0.25	S	C	.	.	H	α-helix	trans	-68.6	-27.5	-178.8	-50.8	-95.6	0	0	0	112.6	C1070 K1076 R1094 Y1095	C1070-D1072 VanDerWaalsContact C-N 3.31Å; C1070-D1072 PolarHBondContact O-N 3.42Å; D1072-K1076 WeakPolarHBondContact O-CG 3.21Å; D1072-K1076 PolarHBondContact O-N 2.95Å; D1072-R1094 IonicContact OD1-NH1 2.74Å; D1072-R1094 PolarHBondContact OD1-NH1 2.99Å; D1072-Y1095 PolarHBondContact OD1-OH 2.88Å; D1072-Y1095 PolarHBondContact OD2-OH 3.01Å
1073	N	93	Very high	90.3	Very high	66 Å²	66	47.8 Å²	47.8	35%	0.353	25%	0.254	S	S	.	.	H	α-helix	trans	-78.9	-31.9	171.4	-75.6	-10.7	0	0	0	112	M1069 C1070 P1071 I1075 K1076 E1077	M1069-N1073 HydrophobicContact CE-CB 3.93Å; C1070-N1073 PolarHBondContact O-N 2.8Å; C1070-N1073 VanDerWaalsContact SG-CG 3.54Å; C1070-N1073 PolarHBondContact SG-ND2 3.3Å; C1070-N1073 VanDerWaalsContact SG-ND2 3.42Å; P1071-N1073 VanDerWaalsContact C-N 3.3Å; P1071-N1073 PolarHBondContact O-N 3.31Å; N1073-I1075 VanDerWaalsContact C-N 3.33Å; N1073-K1076 PolarHBondContact O-N 2.87Å; N1073-K1076 PolarHBondContact OD1-NZ 2.76Å; N1073-E1077 PolarHBondContact O-N 3.27Å; N1073-E1077 VanDerWaalsContact O-N 3.12Å
1074	M	93.8	Very high	91.5	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-62.4	-41.4	171.2	-58.8	177.5	71.8	0	0	111.4	M1069 C1070 P1071 K1076 E1077 I1078 V1116 N1125 V1127 L1152	M1069-M1074 HydrophobicContact CB-CG 4Å; C1070-M1074 PolarHBondContact O-N 2.95Å; C1070-M1074 VanDerWaalsContact O-N 3.11Å; P1071-M1074 WeakPolarHBondContact O-CB 3.35Å; P1071-M1074 PolarHBondContact O-N 3.12Å; P1071-M1074 VanDerWaalsContact O-N 3.16Å; M1074-K1076 VanDerWaalsContact C-N 3.33Å; M1074-K1076 PolarHBondContact O-N 3.43Å; M1074-E1077 PolarHBondContact O-N 3.42Å; M1074-I1078 WeakPolarHBondContact O-CB 3.08Å; M1074-I1078 WeakPolarHBondContact O-CD1 3.29Å; M1074-I1078 VanDerWaalsContact O-CG1 3.26Å; M1074-I1078 WeakPolarHBondContact O-CG1 3.37Å; M1074-I1078 PolarHBondContact O-N 3.08Å; M1074-V1116 HydrophobicContact CB-CG1 4.25Å; M1074-V1116 HydrophobicContact CB-CG2 4.06Å; M1074-V1116 HydrophobicContact CE-CG1 4.33Å; M1074-V1116 HydrophobicContact SD-CG1 3.83Å; M1074-N1125 HydrophobicContact CE-CB 4.09Å; M1074-N1125 HydrophobicContact SD-CB 3.36Å; M1074-N1125 WeakPolarHBondContact SD-CB 3.39Å; M1074-V1127 HydrophobicContact CE-CG2 3.66Å; M1074-L1152 HydrophobicContact CB-CD2 4.17Å; M1074-L1152 HydrophobicContact CE-CD1 4Å; M1074-L1152 HydrophobicContact CE-CD2 4.45Å; M1074-L1152 HydrophobicContact CG-CD2 3.93Å
1075	I	95.2	Very high	92.6	Very high	12 Å²	12	47.3 Å²	47.3	6%	0.062	27%	0.266	C	S	.	.	H	α-helix	trans	-62.5	-37.3	175.9	-66.7	-70	0	0	0	111.9	P1071 N1073 K1079 Y1095 L1097 V1116	P1071-I1075 WeakPolarHBondContact O-CG1 3.27Å; P1071-I1075 PolarHBondContact O-N 3.15Å; N1073-I1075 VanDerWaalsContact C-N 3.33Å; I1075-K1079 WeakPolarHBondContact O-CG 3.43Å; I1075-K1079 PolarHBondContact O-N 3.15Å; I1075-Y1095 HydrophobicContact CD1-CD1 4.39Å; I1075-Y1095 HydrophobicContact CG1-CD1 3.89Å; I1075-L1097 HydrophobicContact CD1-CD1 3.62Å; I1075-V1116 HydrophobicContact CD1-CB 4.1Å; I1075-V1116 HydrophobicContact CD1-CG2 3.54Å; I1075-V1116 HydrophobicContact CG1-CB 4.48Å; I1075-V1116 HydrophobicContact CG1-CG2 4.02Å
1076	K	94	Very high	93.2	Very high	135 Å²	135	52.8 Å²	52.8	59%	0.587	29%	0.294	S	S	*	.	H	α-helix	trans	-63	-46.4	174.2	-67.7	168	-163.2	166.2	0	111.8	D1072 N1073 M1074 K1079 K1080	D1072-K1076 WeakPolarHBondContact O-CG 3.21Å; D1072-K1076 PolarHBondContact O-N 2.95Å; N1073-K1076 PolarHBondContact O-N 2.87Å; N1073-K1076 PolarHBondContact OD1-NZ 2.76Å; M1074-K1076 VanDerWaalsContact C-N 3.33Å; M1074-K1076 PolarHBondContact O-N 3.43Å; K1076-K1079 PolarHBondContact O-N 3.33Å; K1076-K1080 WeakPolarHBondContact O-CB 3.27Å; K1076-K1080 PolarHBondContact O-N 2.89Å; K1076-K1080 VanDerWaalsContact O-N 3.07Å
1077	E	94.8	Very high	93.5	Very high	27 Å²	27	50.9 Å²	50.9	13%	0.126	28%	0.283	C	S	.	.	H	α-helix	trans	-67.5	-38.6	179.7	-169	61.8	-165.4	0	0	111.8	N1073 M1074 K1080 V1081 L1150 L1152	N1073-E1077 PolarHBondContact O-N 3.27Å; N1073-E1077 VanDerWaalsContact O-N 3.12Å; M1074-E1077 PolarHBondContact O-N 3.42Å; E1077-K1080 PolarHBondContact O-N 2.78Å; E1077-K1080 IonicContact OE1-NZ 2.65Å; E1077-K1080 PolarHBondContact OE1-NZ 3.07Å; E1077-K1080 IonicContact OE2-NZ 2.68Å; E1077-K1080 PolarHBondContact OE2-NZ 3.31Å; E1077-V1081 WeakPolarHBondContact O-CG2 3.36Å; E1077-V1081 PolarHBondContact O-N 3.11Å; E1077-L1150 HydrophobicContact CG-CD2 4.31Å; E1077-L1152 HydrophobicContact CB-CD2 4.35Å; E1077-L1152 HydrophobicContact CG-CD2 4.48Å
1078	I	95.7	Very high	93.7	Very high	1 Å²	1	57.8 Å²	57.8	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-57.3	-51.1	172.8	-72.4	163.3	0	0	0	111.5	M1074 K1080 V1081 L1082 L1097 M1114 V1116 V1127 L1150	M1074-I1078 WeakPolarHBondContact O-CB 3.08Å; M1074-I1078 WeakPolarHBondContact O-CD1 3.29Å; M1074-I1078 VanDerWaalsContact O-CG1 3.26Å; M1074-I1078 WeakPolarHBondContact O-CG1 3.37Å; M1074-I1078 PolarHBondContact O-N 3.08Å; I1078-K1080 VanDerWaalsContact C-N 3.35Å; I1078-K1080 PolarHBondContact O-N 2.6Å; I1078-V1081 PolarHBondContact O-N 2.97Å; I1078-L1082 HydrophobicContact CG2-CD1 3.67Å; I1078-L1082 HydrophobicContact CG2-CG 4.41Å; I1078-L1082 WeakPolarHBondContact O-CG 3.21Å; I1078-L1082 PolarHBondContact O-N 3.14Å; I1078-L1097 HydrophobicContact CG2-CD1 4.29Å; I1078-L1097 HydrophobicContact CG2-CD2 4.21Å; I1078-M1114 HydrophobicContact CB-CE 4.45Å; I1078-M1114 HydrophobicContact CD1-CE 4.39Å; I1078-M1114 HydrophobicContact CG1-CE 4.04Å; I1078-M1114 HydrophobicContact CG2-CE 3.66Å; I1078-M1114 HydrophobicContact CG2-SD 4.28Å; I1078-V1116 HydrophobicContact CD1-CG2 3.42Å; I1078-V1116 VanDerWaalsContact CD1-CG2 3.42Å; I1078-V1127 HydrophobicContact CD1-CG1 3.93Å; I1078-V1127 HydrophobicContact CD1-CG2 3.92Å; I1078-L1150 HydrophobicContact CB-CD2 4.42Å; I1078-L1150 HydrophobicContact CG1-CD2 3.73Å
1079	K	96.4	Very high	94.1	Very high	63 Å²	63	56.7 Å²	56.7	27%	0.274	30%	0.295	S	S	.	.	H	α-helix	trans	-58.6	-46.7	177.9	-74.1	-175.1	180	-172.8	0	111.8	I1075 K1076 V1081 L1082 T1083 Y1089 L1097	I1075-K1079 WeakPolarHBondContact O-CG 3.43Å; I1075-K1079 PolarHBondContact O-N 3.15Å; K1076-K1079 PolarHBondContact O-N 3.33Å; K1079-V1081 PolarHBondContact O-N 3.42Å; K1079-L1082 PolarHBondContact O-N 3.44Å; K1079-T1083 PolarHBondContact O-N 2.89Å; K1079-T1083 PolarHBondContact O-OG1 3.28Å; K1079-Y1089 HydrophobicContact CB-CE1 4.43Å; K1079-Y1089 HydrophobicContact CB-CE2 4.37Å; K1079-Y1089 HydrophobicContact CD-CE2 3.95Å; K1079-Y1089 HydrophobicContact CG-CD2 4.46Å; K1079-Y1089 HydrophobicContact CG-CE2 3.77Å; K1079-L1097 HydrophobicContact CG-CD2 3.9Å
1080	K	96	Very high	94.4	Very high	115 Å²	115	57.1 Å²	57.1	50%	0.5	30%	0.299	S	S	.	.	H	α-helix	trans	-57.7	-43.1	177.3	164.2	164.6	157.7	-84.3	0	112.7	K1076 E1077 I1078 A1084	K1076-K1080 WeakPolarHBondContact O-CB 3.27Å; K1076-K1080 PolarHBondContact O-N 2.89Å; K1076-K1080 VanDerWaalsContact O-N 3.07Å; E1077-K1080 PolarHBondContact O-N 2.78Å; E1077-K1080 IonicContact OE1-NZ 2.65Å; E1077-K1080 PolarHBondContact OE1-NZ 3.07Å; E1077-K1080 IonicContact OE2-NZ 2.68Å; E1077-K1080 PolarHBondContact OE2-NZ 3.31Å; I1078-K1080 VanDerWaalsContact C-N 3.35Å; I1078-K1080 PolarHBondContact O-N 2.6Å; K1080-A1084 WeakPolarHBondContact O-CB 3.46Å; K1080-A1084 PolarHBondContact O-N 2.95Å; K1080-A1084 VanDerWaalsContact O-N 3.08Å
1081	V	96.3	Very high	94.5	Very high	7 Å²	7	57.4 Å²	57.4	4%	0.042	29%	0.294	C	S	.	.	H	α-helix	trans	-71.7	-37	177.8	171.4	0	0	0	0	112.3	E1077 I1078 K1079 A1084 N1085 I1146 D1149 L1150	E1077-V1081 WeakPolarHBondContact O-CG2 3.36Å; E1077-V1081 PolarHBondContact O-N 3.11Å; I1078-V1081 PolarHBondContact O-N 2.97Å; K1079-V1081 PolarHBondContact O-N 3.42Å; V1081-A1084 PolarHBondContact O-N 2.62Å; V1081-N1085 WeakPolarHBondContact O-CB 3.34Å; V1081-N1085 PolarHBondContact O-N 3.18Å; V1081-N1085 VanDerWaalsContact O-N 3.15Å; V1081-N1085 PolarHBondContact O-ND2 2.68Å; V1081-I1146 HydrophobicContact CG1-CB 4.46Å; V1081-I1146 HydrophobicContact CG1-CD1 3.98Å; V1081-I1146 HydrophobicContact CG1-CG2 4.01Å; V1081-D1149 HydrophobicContact CG1-CB 3.58Å; V1081-D1149 HydrophobicContact CG2-CB 4.27Å; V1081-L1150 HydrophobicContact CB-CD2 4.27Å; V1081-L1150 HydrophobicContact CG1-CG 4.47Å; V1081-L1150 HydrophobicContact CG2-CD2 4.1Å; V1081-L1150 HydrophobicContact CG2-CG 4.48Å
1082	L	96.4	Very high	94.2	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-64	-47.4	175	-72.3	163.9	0	0	0	111.7	I1078 K1079 A1084 N1085 N1086 C1087 Y1089 L1097 C1099 W1112 M1114 I1146	I1078-L1082 HydrophobicContact CG2-CD1 3.67Å; I1078-L1082 HydrophobicContact CG2-CG 4.41Å; I1078-L1082 WeakPolarHBondContact O-CG 3.21Å; I1078-L1082 PolarHBondContact O-N 3.14Å; K1079-L1082 PolarHBondContact O-N 3.44Å; L1082-A1084 VanDerWaalsContact C-N 3.33Å; L1082-A1084 PolarHBondContact O-N 3.45Å; L1082-N1085 CarbonylContact O-C 3.48Å; L1082-N1085 PolarHBondContact O-N 2.93Å; L1082-N1085 VanDerWaalsContact O-N 3.12Å; L1082-N1086 PolarHBondContact O-N 2.7Å; L1082-C1087 HydrophobicContact CB-CB 4.14Å; L1082-C1087 HydrophobicContact CD2-CB 3.65Å; L1082-C1087 PolarHBondContact O-N 3.07Å; L1082-Y1089 HydrophobicContact CB-CD1 3.58Å; L1082-Y1089 HydrophobicContact CB-CE1 3.9Å; L1082-Y1089 HydrophobicContact CD1-CD1 3.85Å; L1082-Y1089 HydrophobicContact CD1-CG 4.06Å; L1082-Y1089 HydrophobicContact CG-CD1 4.33Å; L1082-L1097 HydrophobicContact CD1-CD2 3.99Å; L1082-C1099 VanDerWaalsContact CD1-SG 3.6Å; L1082-C1099 HydrophobicContact CD2-CB 4.17Å; L1082-W1112 HydrophobicContact CD2-CZ2 3.96Å; L1082-M1114 HydrophobicContact CD1-SD 4.27Å; L1082-M1114 HydrophobicContact CD2-SD 4.02Å; L1082-M1114 HydrophobicContact CG-SD 4.43Å; L1082-I1146 HydrophobicContact CD2-CD1 4.05Å; L1082-I1146 HydrophobicContact CD2-CG1 4.48Å
1083	T	95.3	Very high	94.1	Very high	86 Å²	86	66.3 Å²	66.3	53%	0.528	32%	0.324	S	S	.	.	H	α-helix	trans	-60.1	-41.7	174.7	-57.3	0	0	0	0	112	K1079 N1085 N1086	K1079-T1083 PolarHBondContact O-N 2.89Å; K1079-T1083 PolarHBondContact O-OG1 3.28Å; T1083-N1085 PolarHBondContact O-N 3.46Å; T1083-N1086 PolarHBondContact O-N 2.88Å
1084	A	94.9	Very high	94	Very high	74 Å²	74	69.4 Å²	69.4	61%	0.612	33%	0.331	S	S	*	.	H	α-helix	trans	-67	-18.2	177.7	0	0	0	0	0	114	K1080 V1081 L1082	K1080-A1084 WeakPolarHBondContact O-CB 3.46Å; K1080-A1084 PolarHBondContact O-N 2.95Å; K1080-A1084 VanDerWaalsContact O-N 3.08Å; V1081-A1084 PolarHBondContact O-N 2.62Å; L1082-A1084 VanDerWaalsContact C-N 3.33Å; L1082-A1084 PolarHBondContact O-N 3.45Å
1085	N	93.9	Very high	94.1	Very high	16 Å²	16	70.2 Å²	70.2	9%	0.086	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	22.3	178.9	-79.3	-82.1	0	0	0	112.8	V1081 L1082 T1083 C1087 Q1145 I1146 D1149	V1081-N1085 WeakPolarHBondContact O-CB 3.34Å; V1081-N1085 PolarHBondContact O-N 3.18Å; V1081-N1085 VanDerWaalsContact O-N 3.15Å; V1081-N1085 PolarHBondContact O-ND2 2.68Å; L1082-N1085 CarbonylContact O-C 3.48Å; L1082-N1085 PolarHBondContact O-N 2.93Å; L1082-N1085 VanDerWaalsContact O-N 3.12Å; T1083-N1085 PolarHBondContact O-N 3.46Å; N1085-C1087 PolarHBondContact O-N 3.15Å; N1085-C1087 PolarHBondContact O-SG 3.06Å; N1085-Q1145 WeakPolarHBondContact OD1-CG 3.38Å; N1085-Q1145 PolarHBondContact OD1-NE2 3.39Å; N1085-I1146 HydrophobicContact CB-CD1 3.51Å; N1085-D1149 PolarHBondContact ND2-OD2 3.39Å; N1085-D1149 PolarHBondContact OD1-OD2 2.89Å
1086	N	93.3	Very high	94	Very high	146 Å²	146	70.5 Å²	70.5	78%	0.781	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	30.4	178.3	-66.6	91.4	0	0	0	114.2	L1082 T1083	L1082-N1086 PolarHBondContact O-N 2.7Å; T1083-N1086 PolarHBondContact O-N 2.88Å
1087	C	94.1	Very high	94.1	Very high	7 Å²	7	64.1 Å²	64.1	5%	0.047	31%	0.308	C	S	.	.			trans	-90.1	125.9	175.5	-59.3	0	0	0	0	109.4	L1082 N1085 E1100 W1112	L1082-C1087 HydrophobicContact CB-CB 4.14Å; L1082-C1087 HydrophobicContact CD2-CB 3.65Å; L1082-C1087 PolarHBondContact O-N 3.07Å; N1085-C1087 PolarHBondContact O-N 3.15Å; N1085-C1087 PolarHBondContact O-SG 3.06Å; C1087-E1100 CarbonylContact C-O 3.59Å; C1087-E1100 WeakPolarHBondContact CA-O 3.27Å; C1087-W1112 HydrophobicContact CB-CH2 4.26Å
1088	E	93.5	Very high	94.2	Very high	148 Å²	148	64.9 Å²	64.9	69%	0.692	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.1	147.9	167	-63.9	-167.9	175.8	0	0	109.3	C1099 E1100	E1088-C1099 CarbonylContact O-C 3.49Å; E1088-C1099 VanDerWaalsContact O-CA 3.31Å; E1088-C1099 WeakPolarHBondContact O-CA 3.17Å; E1088-E1100 HydrophobicContact CB-CB 4.47Å; E1088-E1100 PolarHBondContact N-O 2.9Å; E1088-E1100 PolarHBondContact O-N 3.11Å
1089	Y	95.4	Very high	94.2	Very high	84 Å²	84	64.9 Å²	64.9	33%	0.329	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	152.5	176.8	63.8	-100.4	0	0	0	113.3	K1079 L1082 L1097 I1098	K1079-Y1089 HydrophobicContact CB-CE1 4.43Å; K1079-Y1089 HydrophobicContact CB-CE2 4.37Å; K1079-Y1089 HydrophobicContact CD-CE2 3.95Å; K1079-Y1089 HydrophobicContact CG-CD2 4.46Å; K1079-Y1089 HydrophobicContact CG-CE2 3.77Å; L1082-Y1089 HydrophobicContact CB-CD1 3.58Å; L1082-Y1089 HydrophobicContact CB-CE1 3.9Å; L1082-Y1089 HydrophobicContact CD1-CD1 3.85Å; L1082-Y1089 HydrophobicContact CD1-CG 4.06Å; L1082-Y1089 HydrophobicContact CG-CD1 4.33Å; Y1089-L1097 HydrophobicContact CD2-CD2 3.86Å; Y1089-L1097 HydrophobicContact CE2-CD2 4.47Å; Y1089-L1097 HydrophobicContact CG-CD2 4.19Å; Y1089-I1098 CarbonylContact C-O 3.56Å; Y1089-I1098 WeakPolarHBondContact CA-O 3.15Å; Y1089-I1098 VanDerWaalsContact CB-O 3.32Å; Y1089-I1098 WeakPolarHBondContact CB-O 3.25Å
1090	D	94.3	Very high	94.1	Very high	72 Å²	72	64 Å²	64	39%	0.385	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	134.3	178.2	175.7	20.2	0	0	0	109.6	R1092 L1097 I1098	D1090-R1092 IonicContact OD2-CZ 2.67Å; D1090-R1092 IonicContact OD2-NE 2.61Å; D1090-R1092 PolarHBondContact OD2-NE 3.11Å; D1090-R1092 IonicContact OD2-NH2 2.63Å; D1090-R1092 PolarHBondContact OD2-NH2 3.37Å; D1090-L1097 CarbonylContact O-C 3.39Å; D1090-L1097 WeakPolarHBondContact O-CA 3.36Å; D1090-I1098 PolarHBondContact N-O 2.82Å; D1090-I1098 PolarHBondContact O-N 2.83Å
1091	Q	92.5	Very high	94	Very high	66 Å²	66	61.8 Å²	61.8	31%	0.308	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	101.7	-173.6	-175.2	172.7	-1.2	0	0	111.3	E1093 R1094 L1097	Q1091-E1093 WeakPolarHBondContact CG-O 3.25Å; Q1091-E1093 PolarHBondContact NE2-O 2.93Å; Q1091-R1094 VanDerWaalsContact NE2-C 3.28Å; Q1091-R1094 PolarHBondContact NE2-O 3.35Å; Q1091-L1097 HydrophobicContact CB-CG 4.44Å; Q1091-L1097 HydrophobicContact CG-CG 4.43Å
1092	R	86.8	Confident	93.6	Very high	176 Å²	176	63.2 Å²	63.2	66%	0.664	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.1	-28.8	-175.6	-66.7	-71.8	166.1	132.7	-2.3	114.6	D1090 L1096 I1098	D1090-R1092 IonicContact OD2-CZ 2.67Å; D1090-R1092 IonicContact OD2-NE 2.61Å; D1090-R1092 PolarHBondContact OD2-NE 3.11Å; D1090-R1092 IonicContact OD2-NH2 2.63Å; D1090-R1092 PolarHBondContact OD2-NH2 3.37Å; R1092-L1096 PolarHBondContact N-O 2.77Å; R1092-I1098 HydrophobicContact CG-CD1 4.43Å; R1092-I1098 HydrophobicContact CG-CG1 3.68Å
1093	E	89.9	Confident	92.9	Very high	91 Å²	91	67.5 Å²	67.5	43%	0.425	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	164.1	173.1	-50.3	176.3	157.6	0	0	109.2	R1055 Q1091 Y1095 L1096	R1055-E1093 IonicContact CZ-OE2 3.91Å; R1055-E1093 IonicContact NH2-OE1 2.68Å; R1055-E1093 IonicContact NH2-OE2 2.62Å; R1055-E1093 PolarHBondContact NH2-OE2 3.28Å; Q1091-E1093 WeakPolarHBondContact CG-O 3.25Å; Q1091-E1093 PolarHBondContact NE2-O 2.93Å; E1093-Y1095 PolarHBondContact O-N 3.1Å; E1093-L1096 HydrophobicContact CB-CB 3.78Å; E1093-L1096 HydrophobicContact CG-CB 4.09Å; E1093-L1096 HydrophobicContact CG-CD2 4.04Å; E1093-L1096 PolarHBondContact N-O 3.34Å; E1093-L1096 PolarHBondContact O-N 3.09Å
1094	R	91.7	Very high	92.2	Very high	131 Å²	131	68 Å²	68	49%	0.494	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51	-28.6	-179.9	-177.8	-178.9	-83	-112	5.3	113.5	D1072 Q1091	D1072-R1094 IonicContact OD1-NH1 2.74Å; D1072-R1094 PolarHBondContact OD1-NH1 2.99Å; Q1091-R1094 VanDerWaalsContact NE2-C 3.28Å; Q1091-R1094 PolarHBondContact NE2-O 3.35Å
1095	Y	94.7	Very high	91.2	Very high	18 Å²	18	69.2 Å²	69.2	7%	0.071	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.9	16.8	-180	-56.5	-64.7	0	0	0	114.4	T1052 K1053 P1054 P1071 D1072 I1075 E1093 E1115 V1116	T1052-Y1095 WeakPolarHBondContact O-CE2 3.36Å; T1052-Y1095 PolarHBondContact O-OH 3.19Å; T1052-Y1095 VanDerWaalsContact O-OH 3.13Å; K1053-Y1095 VanDerWaalsContact C-CE2 3.45Å; P1054-Y1095 VanDerWaalsContact CA-CD2 3.46Å; P1054-Y1095 HydrophobicContact CB-CD2 3.97Å; P1054-Y1095 HydrophobicContact CB-CE2 4.29Å; P1054-Y1095 HydrophobicContact CB-CG 4.1Å; P1071-Y1095 HydrophobicContact CB-CD1 3.82Å; P1071-Y1095 HydrophobicContact CB-CE1 3.33Å; D1072-Y1095 PolarHBondContact OD1-OH 2.88Å; D1072-Y1095 PolarHBondContact OD2-OH 3.01Å; I1075-Y1095 HydrophobicContact CD1-CD1 4.39Å; I1075-Y1095 HydrophobicContact CG1-CD1 3.89Å; E1093-Y1095 PolarHBondContact O-N 3.1Å; Y1095-E1115 CarbonylContact O-C 3.45Å; Y1095-E1115 WeakPolarHBondContact O-CA 3.39Å; Y1095-V1116 HydrophobicContact CD1-CB 4.4Å; Y1095-V1116 PolarHBondContact O-N 2.91Å
1096	L	94	Very high	90.4	Very high	18 Å²	18	71.2 Å²	71.2	9%	0.094	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	123.7	-179.3	-177.9	66.7	0	0	0	111.5	R1092 E1093 E1113 E1115	R1092-L1096 PolarHBondContact N-O 2.77Å; E1093-L1096 HydrophobicContact CB-CB 3.78Å; E1093-L1096 HydrophobicContact CG-CB 4.09Å; E1093-L1096 HydrophobicContact CG-CD2 4.04Å; E1093-L1096 PolarHBondContact N-O 3.34Å; E1093-L1096 PolarHBondContact O-N 3.09Å; L1096-E1113 HydrophobicContact CD1-CB 4.17Å; L1096-E1115 HydrophobicContact CD1-CB 3.89Å; L1096-E1115 HydrophobicContact CD1-CG 4.04Å
1097	L	96.1	Very high	89.4	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	142.4	171.2	-63.2	84.7	0	0	0	110.1	I1075 I1078 K1079 L1082 Y1089 D1090 Q1091 E1113 M1114	I1075-L1097 HydrophobicContact CD1-CD1 3.62Å; I1078-L1097 HydrophobicContact CG2-CD1 4.29Å; I1078-L1097 HydrophobicContact CG2-CD2 4.21Å; K1079-L1097 HydrophobicContact CG-CD2 3.9Å; L1082-L1097 HydrophobicContact CD1-CD2 3.99Å; Y1089-L1097 HydrophobicContact CD2-CD2 3.86Å; Y1089-L1097 HydrophobicContact CE2-CD2 4.47Å; Y1089-L1097 HydrophobicContact CG-CD2 4.19Å; D1090-L1097 CarbonylContact O-C 3.39Å; D1090-L1097 WeakPolarHBondContact O-CA 3.36Å; Q1091-L1097 HydrophobicContact CB-CG 4.44Å; Q1091-L1097 HydrophobicContact CG-CG 4.43Å; L1097-E1113 CarbonylContact O-C 3.45Å; L1097-E1113 WeakPolarHBondContact O-CA 3.25Å; L1097-M1114 PolarHBondContact N-O 3.07Å; L1097-M1114 PolarHBondContact O-N 3.4Å
1098	I	95.9	Very high	88.7	Confident	44 Å²	44	74.6 Å²	74.6	23%	0.226	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	137.7	158.4	-50.1	-56.2	0	0	0	106.6	Y1089 D1090 R1092 E1113 I1132	Y1089-I1098 CarbonylContact C-O 3.56Å; Y1089-I1098 WeakPolarHBondContact CA-O 3.15Å; Y1089-I1098 VanDerWaalsContact CB-O 3.32Å; Y1089-I1098 WeakPolarHBondContact CB-O 3.25Å; D1090-I1098 PolarHBondContact N-O 2.82Å; D1090-I1098 PolarHBondContact O-N 2.83Å; R1092-I1098 HydrophobicContact CG-CD1 4.43Å; R1092-I1098 HydrophobicContact CG-CG1 3.68Å; I1098-E1113 HydrophobicContact CD1-CG 3.81Å; I1098-I1132 HydrophobicContact CD1-CD1 4.25Å; I1098-I1132 HydrophobicContact CG2-CD1 3.84Å
1099	C	95.8	Very high	88.5	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.007	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	145.4	-176.4	-55	0	0	0	0	110	L1082 E1088 Q1111 W1112	L1082-C1099 VanDerWaalsContact CD1-SG 3.6Å; L1082-C1099 HydrophobicContact CD2-CB 4.17Å; E1088-C1099 CarbonylContact O-C 3.49Å; E1088-C1099 VanDerWaalsContact O-CA 3.31Å; E1088-C1099 WeakPolarHBondContact O-CA 3.17Å; C1099-Q1111 CarbonylContact O-C 3.54Å; C1099-Q1111 VanDerWaalsContact O-CA 3.22Å; C1099-Q1111 WeakPolarHBondContact O-CA 3.2Å; C1099-W1112 HydrophobicContact CB-CD2 3.8Å; C1099-W1112 VanDerWaalsContact CB-CE2 3.42Å; C1099-W1112 HydrophobicContact CB-CE3 4.25Å; C1099-W1112 HydrophobicContact CB-CG 4.27Å; C1099-W1112 HydrophobicContact CB-CH2 4.06Å; C1099-W1112 HydrophobicContact CB-CZ2 3.59Å; C1099-W1112 HydrophobicContact CB-CZ3 4.36Å; C1099-W1112 PolarHBondContact N-O 3.19Å; C1099-W1112 PolarHBondContact O-N 3.21Å
1100	E	94.5	Very high	88.4	Confident	43 Å²	43	64.6 Å²	64.6	20%	0.201	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	142.2	-179	-171.9	151.6	-169.1	0	0	110.6	C1087 E1088 N1109 V1110 Q1111	C1087-E1100 CarbonylContact C-O 3.59Å; C1087-E1100 WeakPolarHBondContact CA-O 3.27Å; E1088-E1100 HydrophobicContact CB-CB 4.47Å; E1088-E1100 PolarHBondContact N-O 2.9Å; E1088-E1100 PolarHBondContact O-N 3.11Å; E1100-N1109 WeakPolarHBondContact CG-OD1 3.5Å; E1100-N1109 PolarHBondContact OE1-ND2 2.82Å; E1100-N1109 PolarHBondContact OE1-OD1 3.49Å; E1100-V1110 WeakPolarHBondContact CA-O 3.49Å; E1100-Q1111 HydrophobicContact CB-CG 4.05Å; E1100-Q1111 HydrophobicContact CG-CG 3.69Å; E1100-Q1111 PolarHBondContact OE1-NE2 3.13Å; E1100-Q1111 WeakPolarHBondContact OE2-CG 3.29Å; E1100-Q1111 PolarHBondContact OE2-NE2 2.96Å
1101	H	94.2	Very high	88.4	Confident	69 Å²	69	63.9 Å²	63.9	32%	0.319	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	128.5	179	170.1	-71.1	0	0	0	111.2	V1110 W1112 I1142	H1101-V1110 PolarHBondContact N-O 2.7Å; H1101-V1110 PolarHBondContact O-N 2.89Å; H1101-W1112 HydrophobicContact CB-CH2 3.77Å; H1101-W1112 HydrophobicContact CB-CZ3 3.73Å; H1101-I1142 HydrophobicContact CB-CG1 4.13Å
1102	G	89.3	Confident	88.5	Confident	37 Å²	37	60.8 Å²	60.8	38%	0.381	33%	0.325	S	S	.	.	S	Bend	trans	115	170	-174.7	0	0	0	0	0	110.8	P1104	G1102-P1104 WeakPolarHBondContact O-CD 3.46Å
1103	D	81	Confident	88.9	Confident	91 Å²	91	54.2 Å²	54.2	49%	0.487	30%	0.302	S	S	.	.			trans	-80.9	122.2	175.4	-177.7	-33.5	0	0	0	109.2	S1105 T1106	D1103-S1105 PolarHBondContact O-N 3.25Å; D1103-S1105 VanDerWaalsContact OD1-CB 3.29Å; D1103-S1105 WeakPolarHBondContact OD1-CB 3.09Å; D1103-S1105 PolarHBondContact OD1-N 3.29Å; D1103-S1105 PolarHBondContact OD1-OG 2.88Å; D1103-S1105 PolarHBondContact OD2-OG 3.49Å; D1103-T1106 HydrophobicContact CB-CG2 3.93Å; D1103-T1106 PolarHBondContact O-N 2.88Å; D1103-T1106 PolarHBondContact O-OG1 2.96Å
1104	P	80.9	Confident	89.1	Confident	96 Å²	96	49.9 Å²	49.9	62%	0.623	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-16.6	179.7	-26.6	36.2	0	0	0	115.6	G1102 T1106	G1102-P1104 WeakPolarHBondContact O-CD 3.46Å; P1104-T1106 VanDerWaalsContact C-N 3.26Å; P1104-T1106 PolarHBondContact O-N 3.39Å
1105	S	73.4	Confident	89.2	Confident	99 Å²	99	43.9 Å²	43.9	69%	0.692	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-0.2	173	71.2	0	0	0	0	114.2	D1103	D1103-S1105 PolarHBondContact O-N 3.25Å; D1103-S1105 VanDerWaalsContact OD1-CB 3.29Å; D1103-S1105 WeakPolarHBondContact OD1-CB 3.09Å; D1103-S1105 PolarHBondContact OD1-N 3.29Å; D1103-S1105 PolarHBondContact OD1-OG 2.88Å; D1103-S1105 PolarHBondContact OD2-OG 3.49Å
1106	T	76.2	Confident	89.1	Confident	59 Å²	59	43 Å²	43	36%	0.362	26%	0.256	S	S	.	.	S	Bend	trans	-126	150.2	-172	71.2	0	0	0	0	113.9	D1103 P1104 A1108 N1109	D1103-T1106 HydrophobicContact CB-CG2 3.93Å; D1103-T1106 PolarHBondContact O-N 2.88Å; D1103-T1106 PolarHBondContact O-OG1 2.96Å; P1104-T1106 VanDerWaalsContact C-N 3.26Å; P1104-T1106 PolarHBondContact O-N 3.39Å; T1106-A1108 PolarHBondContact O-N 2.84Å; T1106-A1108 PolarHBondContact OG1-N 3.32Å; T1106-N1109 PolarHBondContact O-N 3.46Å; T1106-N1109 VanDerWaalsContact O-N 3.08Å
1107	D	73.8	Confident	89	Confident	158 Å²	158	42.1 Å²	42.1	85%	0.845	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-6.4	170.3	-74.9	-39.8	0	0	0	114
1108	A	78.4	Confident	88.7	Confident	65 Å²	65	47.3 Å²	47.3	54%	0.537	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-12.4	175	0	0	0	0	0	113.4	T1106	T1106-A1108 PolarHBondContact O-N 2.84Å; T1106-A1108 PolarHBondContact OG1-N 3.32Å
1109	N	90.3	Very high	88.2	Confident	22 Å²	22	45.5 Å²	45.5	12%	0.118	26%	0.264	C	S	.	.			trans	-62.5	141.5	178.3	-170	12.7	0	0	0	112.2	E1100 T1106 G1134	E1100-N1109 WeakPolarHBondContact CG-OD1 3.5Å; E1100-N1109 PolarHBondContact OE1-ND2 2.82Å; E1100-N1109 PolarHBondContact OE1-OD1 3.49Å; T1106-N1109 PolarHBondContact O-N 3.46Å; T1106-N1109 VanDerWaalsContact O-N 3.08Å; N1109-G1134 WeakPolarHBondContact O-CA 3.49Å
1110	V	92.9	Very high	87.1	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.006	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	123.3	176.6	-175.4	0	0	0	0	110	E1100 H1101 W1112 F1139	E1100-V1110 WeakPolarHBondContact CA-O 3.49Å; H1101-V1110 PolarHBondContact N-O 2.7Å; H1101-V1110 PolarHBondContact O-N 2.89Å; V1110-W1112 HydrophobicContact CG1-CE3 3.97Å; V1110-W1112 HydrophobicContact CG1-CZ3 4.41Å; V1110-W1112 WeakPolarHBondContact O-CZ3 3.33Å; V1110-F1139 HydrophobicContact CG1-CB 3.68Å; V1110-F1139 HydrophobicContact CG1-CD2 3.97Å; V1110-F1139 HydrophobicContact CG1-CG 4.31Å
1111	Q	94.3	Very high	86	Confident	57 Å²	57	54.4 Å²	54.4	27%	0.266	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	144	167.2	-62	160.6	-23.6	0	0	111.6	C1099 E1100 I1132 S1133	C1099-Q1111 CarbonylContact O-C 3.54Å; C1099-Q1111 VanDerWaalsContact O-CA 3.22Å; C1099-Q1111 WeakPolarHBondContact O-CA 3.2Å; E1100-Q1111 HydrophobicContact CB-CG 4.05Å; E1100-Q1111 HydrophobicContact CG-CG 3.69Å; E1100-Q1111 PolarHBondContact OE1-NE2 3.13Å; E1100-Q1111 WeakPolarHBondContact OE2-CG 3.29Å; E1100-Q1111 PolarHBondContact OE2-NE2 2.96Å; Q1111-I1132 HydrophobicContact CB-CB 4.03Å; Q1111-I1132 HydrophobicContact CB-CD1 4.28Å; Q1111-I1132 HydrophobicContact CB-CG2 4.49Å; Q1111-I1132 PolarHBondContact O-N 3.48Å; Q1111-S1133 VanDerWaalsContact CB-OG 3.27Å; Q1111-S1133 WeakPolarHBondContact CB-OG 3.17Å; Q1111-S1133 WeakPolarHBondContact CG-OG 3.45Å; Q1111-S1133 PolarHBondContact N-OG 3.31Å; Q1111-S1133 VanDerWaalsContact N-OG 3.13Å; Q1111-S1133 PolarHBondContact O-N 3.12Å; Q1111-S1133 VanDerWaalsContact O-N 3.15Å; Q1111-S1133 PolarHBondContact OE1-OG 3.02Å; Q1111-S1133 VanDerWaalsContact OE1-OG 3.07Å
1112	W	94.5	Very high	85.1	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	156.9	175.6	69.3	97.1	0	0	0	114	L1082 C1087 C1099 H1101 V1110 M1114 F1129 K1130 F1139 I1142 I1146	L1082-W1112 HydrophobicContact CD2-CZ2 3.96Å; C1087-W1112 HydrophobicContact CB-CH2 4.26Å; C1099-W1112 HydrophobicContact CB-CD2 3.8Å; C1099-W1112 VanDerWaalsContact CB-CE2 3.42Å; C1099-W1112 HydrophobicContact CB-CE3 4.25Å; C1099-W1112 HydrophobicContact CB-CG 4.27Å; C1099-W1112 HydrophobicContact CB-CH2 4.06Å; C1099-W1112 HydrophobicContact CB-CZ2 3.59Å; C1099-W1112 HydrophobicContact CB-CZ3 4.36Å; C1099-W1112 PolarHBondContact N-O 3.19Å; C1099-W1112 PolarHBondContact O-N 3.21Å; H1101-W1112 HydrophobicContact CB-CH2 3.77Å; H1101-W1112 HydrophobicContact CB-CZ3 3.73Å; V1110-W1112 HydrophobicContact CG1-CE3 3.97Å; V1110-W1112 HydrophobicContact CG1-CZ3 4.41Å; V1110-W1112 WeakPolarHBondContact O-CZ3 3.33Å; W1112-M1114 VanDerWaalsContact NE1-CG 3.34Å; W1112-M1114 PolarHBondContact NE1-SD 2.87Å; W1112-M1114 VanDerWaalsContact NE1-SD 3.44Å; W1112-F1129 AromaticContact CD1-CD1 3.86Å; W1112-F1129 AromaticContact NE1-CD1 3.82Å; W1112-K1130 CarbonylContact C-O 3.5Å; W1112-K1130 WeakPolarHBondContact CA-O 3.38Å; W1112-K1130 WeakPolarHBondContact CB-O 3.49Å; W1112-F1139 HydrophobicContact CB-CD2 4Å; W1112-F1139 HydrophobicContact CB-CE2 3.55Å; W1112-F1139 HydrophobicContact CD2-CE2 4.47Å; W1112-F1139 HydrophobicContact CG-CD2 4.31Å; W1112-F1139 AromaticContact CG-CE2 3.83Å; W1112-F1139 HydrophobicContact CG-CE2 3.83Å; W1112-I1142 HydrophobicContact CE3-CG2 4.37Å; W1112-I1142 HydrophobicContact CH2-CG1 3.7Å; W1112-I1142 HydrophobicContact CH2-CG2 3.95Å; W1112-I1142 HydrophobicContact CZ2-CG1 4.25Å; W1112-I1142 HydrophobicContact CZ3-CG1 4.37Å; W1112-I1142 HydrophobicContact CZ3-CG2 3.86Å; W1112-I1146 HydrophobicContact CZ2-CG1 4.48Å
1113	E	94.6	Very high	84.8	Confident	38 Å²	38	59.1 Å²	59.1	18%	0.178	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	137.8	168.6	-63.9	168.9	-158.3	0	0	110.1	L1096 L1097 I1098 F1129 K1130 I1132	L1096-E1113 HydrophobicContact CD1-CB 4.17Å; L1097-E1113 CarbonylContact O-C 3.45Å; L1097-E1113 WeakPolarHBondContact O-CA 3.25Å; I1098-E1113 HydrophobicContact CD1-CG 3.81Å; E1113-F1129 WeakPolarHBondContact O-CA 3.41Å; E1113-K1130 HydrophobicContact CB-CB 4.31Å; E1113-K1130 HydrophobicContact CB-CD 4.37Å; E1113-K1130 HydrophobicContact CG-CD 4.22Å; E1113-K1130 PolarHBondContact N-O 3.05Å; E1113-K1130 PolarHBondContact O-N 2.8Å; E1113-K1130 IonicContact OE1-NZ 2.77Å; E1113-K1130 PolarHBondContact OE1-NZ 2.99Å; E1113-K1130 WeakPolarHBondContact OE2-CD 3.43Å; E1113-K1130 IonicContact OE2-NZ 2.61Å; E1113-K1130 PolarHBondContact OE2-NZ 3.39Å; E1113-I1132 HydrophobicContact CG-CD1 3.98Å; E1113-I1132 HydrophobicContact CG-CG1 4.09Å
1114	M	94.4	Very high	85.1	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.005	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	124	164.9	-70.8	-173	61.1	0	0	110.3	I1078 L1082 L1097 W1112 V1127 R1128 F1129 I1146 L1150	I1078-M1114 HydrophobicContact CB-CE 4.45Å; I1078-M1114 HydrophobicContact CD1-CE 4.39Å; I1078-M1114 HydrophobicContact CG1-CE 4.04Å; I1078-M1114 HydrophobicContact CG2-CE 3.66Å; I1078-M1114 HydrophobicContact CG2-SD 4.28Å; L1082-M1114 HydrophobicContact CD1-SD 4.27Å; L1082-M1114 HydrophobicContact CD2-SD 4.02Å; L1082-M1114 HydrophobicContact CG-SD 4.43Å; L1097-M1114 PolarHBondContact N-O 3.07Å; L1097-M1114 PolarHBondContact O-N 3.4Å; W1112-M1114 VanDerWaalsContact NE1-CG 3.34Å; W1112-M1114 PolarHBondContact NE1-SD 2.87Å; W1112-M1114 VanDerWaalsContact NE1-SD 3.44Å; M1114-V1127 HydrophobicContact CE-CG1 3.77Å; M1114-R1128 WeakPolarHBondContact CA-O 3.46Å; M1114-F1129 HydrophobicContact CE-CE1 3.76Å; M1114-F1129 HydrophobicContact CE-CE2 3.96Å; M1114-F1129 HydrophobicContact CE-CZ 3.43Å; M1114-F1129 VanDerWaalsContact CE-CZ 3.43Å; M1114-F1129 HydrophobicContact CG-CD1 3.98Å; M1114-F1129 HydrophobicContact CG-CE1 4.02Å; M1114-F1129 HydrophobicContact CG-CG 4.44Å; M1114-F1129 HydrophobicContact CG-CZ 4.49Å; M1114-F1129 HydrophobicContact SD-CD1 4.21Å; M1114-F1129 HydrophobicContact SD-CE1 3.64Å; M1114-F1129 HydrophobicContact SD-CZ 3.99Å; M1114-I1146 HydrophobicContact CE-CG2 4.01Å; M1114-I1146 HydrophobicContact SD-CG2 4.13Å; M1114-L1150 HydrophobicContact CE-CD1 4.3Å
1115	E	93.7	Very high	85.6	Confident	4 Å²	4	53.8 Å²	53.8	2%	0.019	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	129.3	-172.5	-164.9	-170	163.6	0	0	111	R1055 Y1095 L1096 C1117 V1127 R1128	R1055-E1115 WeakPolarHBondContact CB-OE1 3.45Å; R1055-E1115 WeakPolarHBondContact CD-OE1 3.44Å; R1055-E1115 IonicContact CZ-OE1 2.86Å; R1055-E1115 VanDerWaalsContact CZ-OE1 3.28Å; R1055-E1115 IonicContact NE-OE1 2.77Å; R1055-E1115 PolarHBondContact NE-OE1 3.28Å; R1055-E1115 IonicContact NH1-OE1 2.7Å; R1055-E1115 PolarHBondContact NH1-OE1 2.88Å; R1055-E1115 IonicContact NH1-OE2 2.74Å; R1055-E1115 PolarHBondContact NH1-OE2 2.87Å; Y1095-E1115 CarbonylContact O-C 3.45Å; Y1095-E1115 WeakPolarHBondContact O-CA 3.39Å; L1096-E1115 HydrophobicContact CD1-CB 3.89Å; L1096-E1115 HydrophobicContact CD1-CG 4.04Å; E1115-C1117 VanDerWaalsContact CG-SG 3.51Å; E1115-C1117 PolarHBondContact OE1-SG 3.36Å; E1115-V1127 WeakPolarHBondContact O-CA 3.34Å; E1115-R1128 HydrophobicContact CB-CB 4.37Å; E1115-R1128 PolarHBondContact N-O 3.41Å; E1115-R1128 PolarHBondContact O-N 2.93Å; E1115-R1128 IonicContact OE2-NH1 3.46Å; E1115-R1128 PolarHBondContact OE2-NH1 2.91Å
1116	V	93.8	Very high	86.4	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	118.2	171.8	174.3	0	0	0	0	109.4	P1054 P1071 M1074 I1075 I1078 Y1095 V1127	P1054-V1116 WeakPolarHBondContact CB-O 3.17Å; P1071-V1116 HydrophobicContact CB-CG1 4Å; M1074-V1116 HydrophobicContact CB-CG1 4.25Å; M1074-V1116 HydrophobicContact CB-CG2 4.06Å; M1074-V1116 HydrophobicContact CE-CG1 4.33Å; M1074-V1116 HydrophobicContact SD-CG1 3.83Å; I1075-V1116 HydrophobicContact CD1-CB 4.1Å; I1075-V1116 HydrophobicContact CD1-CG2 3.54Å; I1075-V1116 HydrophobicContact CG1-CB 4.48Å; I1075-V1116 HydrophobicContact CG1-CG2 4.02Å; I1078-V1116 HydrophobicContact CD1-CG2 3.42Å; I1078-V1116 VanDerWaalsContact CD1-CG2 3.42Å; Y1095-V1116 HydrophobicContact CD1-CB 4.4Å; Y1095-V1116 PolarHBondContact O-N 2.91Å; V1116-V1127 HydrophobicContact CG2-CG2 4.5Å
1117	C	91.5	Very high	87.2	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	148.7	-169.6	-55.9	0	0	0	0	111.5	R1055 L1057 E1115 N1125 G1126	R1055-C1117 CarbonylContact O-C 3.56Å; R1055-C1117 WeakPolarHBondContact O-CA 3.32Å; R1055-C1117 WeakPolarHBondContact O-CB 3.44Å; L1057-C1117 HydrophobicContact CB-CB 4.12Å; L1057-C1117 HydrophobicContact CD1-CB 3.58Å; L1057-C1117 WeakPolarHBondContact CD1-SG 3.41Å; L1057-C1117 HydrophobicContact CG-CB 3.65Å; E1115-C1117 VanDerWaalsContact CG-SG 3.51Å; E1115-C1117 PolarHBondContact OE1-SG 3.36Å; C1117-N1125 CarbonylContact O-C 3.49Å; C1117-N1125 VanDerWaalsContact O-CA 3.25Å; C1117-N1125 WeakPolarHBondContact O-CA 3.26Å; C1117-G1126 PolarHBondContact N-O 3.43Å; C1117-G1126 PolarHBondContact O-N 3.28Å
1118	K	89.2	Confident	88	Confident	108 Å²	108	41.2 Å²	41.2	47%	0.47	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	142.7	170.2	-172.7	172.4	-176.8	177	0	110.2	P1054 R1055 L1057 P1120	P1054-K1118 HydrophobicContact CG-CB 4.22Å; R1055-K1118 PolarHBondContact O-N 2.89Å; L1057-K1118 PolarHBondContact N-O 3.29Å; K1118-P1120 WeakPolarHBondContact O-CD 3.48Å
1119	L	85.4	Confident	88.7	Confident	7 Å²	7	38.6 Å²	38.6	4%	0.037	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	84	177	-73.1	168.8	0	0	0	110.7	L1057 T1060 M1063 T1066 R1121 L1122 S1123 L1124	L1057-L1119 HydrophobicContact CB-CD2 4.35Å; T1060-L1119 HydrophobicContact CG2-CD1 4Å; T1060-L1119 HydrophobicContact CG2-CD2 3.73Å; T1060-L1119 HydrophobicContact CG2-CG 4.48Å; M1063-L1119 HydrophobicContact CE-CD1 3.91Å; M1063-L1119 HydrophobicContact CE-CD2 3.71Å; M1063-L1119 HydrophobicContact CE-CG 4.06Å; M1063-L1119 HydrophobicContact CG-CD1 4.34Å; M1063-L1119 HydrophobicContact SD-CD1 4.42Å; T1066-L1119 HydrophobicContact CG2-CD1 3.67Å; L1119-R1121 PolarHBondContact O-N 3.49Å; L1119-R1121 VanDerWaalsContact O-N 3.12Å; L1119-L1122 HydrophobicContact CB-CB 4.47Å; L1119-L1122 HydrophobicContact CD1-CD1 4.38Å; L1119-L1122 PolarHBondContact O-N 2.99Å; L1119-S1123 PolarHBondContact O-N 3.45Å; L1119-S1123 VanDerWaalsContact O-N 3.16Å; L1119-L1124 WeakPolarHBondContact CA-O 3.26Å; L1119-L1124 WeakPolarHBondContact CB-O 3.47Å; L1119-L1124 PolarHBondContact N-O 3.21Å
1120	P	73.9	Confident	88.7	Confident	70 Å²	70	40.3 Å²	40.3	46%	0.455	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-32.2	-173.4	-25.6	33.9	0	0	0	114.7	S1056 K1118 L1122	S1056-P1120 WeakPolarHBondContact OG-CD 3.39Å; S1056-P1120 WeakPolarHBondContact OG-CG 3.42Å; K1118-P1120 WeakPolarHBondContact O-CD 3.48Å; P1120-L1122 PolarHBondContact O-N 3.1Å
1121	R	70.4	Confident	88.7	Confident	160 Å²	160	45 Å²	45	60%	0.604	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-15	179.7	-56	-168	79.6	164.8	10.8	114.2	G239 L1119	G239-R1121 PolarHBondContact O-NH2 3.02Å; L1119-R1121 PolarHBondContact O-N 3.49Å; L1119-R1121 VanDerWaalsContact O-N 3.12Å
1122	L	76.1	Confident	88.5	Confident	93 Å²	93	46.2 Å²	46.2	49%	0.487	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.7	-8	-179.3	-61.3	179.6	0	0	0	113	T1060 L1119 P1120 L1124	T1060-L1122 HydrophobicContact CG2-CD1 4.1Å; L1119-L1122 HydrophobicContact CB-CB 4.47Å; L1119-L1122 HydrophobicContact CD1-CD1 4.38Å; L1119-L1122 PolarHBondContact O-N 2.99Å; P1120-L1122 PolarHBondContact O-N 3.1Å; L1122-L1124 HydrophobicContact CB-CB 4.27Å; L1122-L1124 HydrophobicContact CB-CD1 4.35Å; L1122-L1124 HydrophobicContact CB-CG 4.24Å; L1122-L1124 PolarHBondContact O-N 3.44Å
1123	S	82.6	Confident	88.3	Confident	113 Å²	113	48 Å²	48	79%	0.79	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.4	26.1	-168.3	-60.7	0	0	0	0	114.3	L1119	L1119-S1123 PolarHBondContact O-N 3.45Å; L1119-S1123 VanDerWaalsContact O-N 3.16Å
1124	L	87.8	Confident	88	Confident	52 Å²	52	47.6 Å²	47.6	27%	0.272	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	169.9	179	-64	178.7	0	0	0	111.4	L1119 L1122	L1119-L1124 WeakPolarHBondContact CA-O 3.26Å; L1119-L1124 WeakPolarHBondContact CB-O 3.47Å; L1119-L1124 PolarHBondContact N-O 3.21Å; L1122-L1124 HydrophobicContact CB-CB 4.27Å; L1122-L1124 HydrophobicContact CB-CD1 4.35Å; L1122-L1124 HydrophobicContact CB-CG 4.24Å; L1122-L1124 PolarHBondContact O-N 3.44Å
1125	N	90	Very high	87.6	Confident	22 Å²	22	50.9 Å²	50.9	12%	0.118	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	166.7	160	-60.9	-50.5	0	0	0	109.5	T1066 S1067 M1069 M1074 C1117	T1066-N1125 CarbonylContact C-O 3.02Å; T1066-N1125 VanDerWaalsContact CA-O 3.23Å; T1066-N1125 WeakPolarHBondContact CA-O 3.42Å; S1067-N1125 PolarHBondContact N-O 3.07Å; S1067-N1125 PolarHBondContact O-N 3.34Å; M1069-N1125 PolarHBondContact O-ND2 3.42Å; M1074-N1125 HydrophobicContact CE-CB 4.09Å; M1074-N1125 HydrophobicContact SD-CB 3.36Å; M1074-N1125 WeakPolarHBondContact SD-CB 3.39Å; C1117-N1125 CarbonylContact O-C 3.49Å; C1117-N1125 VanDerWaalsContact O-CA 3.25Å; C1117-N1125 WeakPolarHBondContact O-CA 3.26Å
1126	G	90.5	Very high	87.2	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	159.4	176.9	0	0	0	0	0	113.4	T1065 C1117	T1065-G1126 VanDerWaalsContact O-CA 3.29Å; T1065-G1126 WeakPolarHBondContact O-CA 3.34Å; C1117-G1126 PolarHBondContact N-O 3.43Å; C1117-G1126 PolarHBondContact O-N 3.28Å
1127	V	92.9	Very high	86.7	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	117.2	178.9	-170.7	0	0	0	0	110	M1063 K1064 T1065 M1074 I1078 M1114 E1115 V1116 F1129 L1152	M1063-V1127 WeakPolarHBondContact CA-O 3.33Å; M1063-V1127 VanDerWaalsContact SD-C 3.55Å; M1063-V1127 PolarHBondContact SD-N 3.07Å; K1064-V1127 PolarHBondContact N-O 3.13Å; T1065-V1127 HydrophobicContact CG2-CB 4.15Å; T1065-V1127 HydrophobicContact CG2-CG2 4.04Å; T1065-V1127 PolarHBondContact O-N 2.94Å; M1074-V1127 HydrophobicContact CE-CG2 3.66Å; I1078-V1127 HydrophobicContact CD1-CG1 3.93Å; I1078-V1127 HydrophobicContact CD1-CG2 3.92Å; M1114-V1127 HydrophobicContact CE-CG1 3.77Å; E1115-V1127 WeakPolarHBondContact O-CA 3.34Å; V1116-V1127 HydrophobicContact CG2-CG2 4.5Å; V1127-F1129 HydrophobicContact CB-CE2 4.44Å; V1127-F1129 HydrophobicContact CG1-CD2 4.24Å; V1127-F1129 HydrophobicContact CG1-CE2 3.78Å; V1127-L1152 HydrophobicContact CG2-CD1 3.47Å; V1127-L1152 VanDerWaalsContact CG2-CD1 3.47Å
1128	R	90.7	Very high	86.5	Confident	52 Å²	52	62.4 Å²	62.4	20%	0.196	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	139.5	176.5	172.6	173.3	173.1	-94.5	-6.4	110.8	L1057 S1062 M1063 M1114 E1115	L1057-R1128 HydrophobicContact CD1-CB 4.21Å; S1062-R1128 WeakPolarHBondContact O-CA 3.28Å; S1062-R1128 PolarHBondContact OG-NE 3.38Å; S1062-R1128 VanDerWaalsContact OG-NE 3.12Å; M1063-R1128 HydrophobicContact SD-CB 4.05Å; M1114-R1128 WeakPolarHBondContact CA-O 3.46Å; E1115-R1128 HydrophobicContact CB-CB 4.37Å; E1115-R1128 PolarHBondContact N-O 3.41Å; E1115-R1128 PolarHBondContact O-N 2.93Å; E1115-R1128 IonicContact OE2-NH1 3.46Å; E1115-R1128 PolarHBondContact OE2-NH1 2.91Å
1129	F	92.5	Very high	86.7	Confident	10 Å²	10	59 Å²	59	4%	0.044	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	132.9	175.7	-71.5	-114.2	0	0	0	110.3	S1062 K1064 W1112 E1113 M1114 V1127 F1139 A1143 I1146 A1147 L1150	S1062-F1129 PolarHBondContact O-N 3.39Å; K1064-F1129 HydrophobicContact CB-CD2 3.69Å; K1064-F1129 HydrophobicContact CB-CE2 3.67Å; K1064-F1129 HydrophobicContact CD-CD2 3.89Å; K1064-F1129 HydrophobicContact CD-CE2 4.01Å; K1064-F1129 HydrophobicContact CD-CG 4.22Å; K1064-F1129 HydrophobicContact CD-CZ 4.41Å; K1064-F1129 HydrophobicContact CG-CD2 3.66Å; K1064-F1129 HydrophobicContact CG-CE2 4.03Å; K1064-F1129 HydrophobicContact CG-CG 4.28Å; W1112-F1129 AromaticContact CD1-CD1 3.86Å; W1112-F1129 AromaticContact NE1-CD1 3.82Å; E1113-F1129 WeakPolarHBondContact O-CA 3.41Å; M1114-F1129 HydrophobicContact CE-CE1 3.76Å; M1114-F1129 HydrophobicContact CE-CE2 3.96Å; M1114-F1129 HydrophobicContact CE-CZ 3.43Å; M1114-F1129 VanDerWaalsContact CE-CZ 3.43Å; M1114-F1129 HydrophobicContact CG-CD1 3.98Å; M1114-F1129 HydrophobicContact CG-CE1 4.02Å; M1114-F1129 HydrophobicContact CG-CG 4.44Å; M1114-F1129 HydrophobicContact CG-CZ 4.49Å; M1114-F1129 HydrophobicContact SD-CD1 4.21Å; M1114-F1129 HydrophobicContact SD-CE1 3.64Å; M1114-F1129 HydrophobicContact SD-CZ 3.99Å; V1127-F1129 HydrophobicContact CB-CE2 4.44Å; V1127-F1129 HydrophobicContact CG1-CD2 4.24Å; V1127-F1129 HydrophobicContact CG1-CE2 3.78Å; F1129-F1139 HydrophobicContact CB-CZ 4.26Å; F1129-A1143 HydrophobicContact CD1-CB 3.7Å; F1129-A1143 HydrophobicContact CE1-CB 4.03Å; F1129-I1146 HydrophobicContact CE1-CB 4.25Å; F1129-I1146 HydrophobicContact CE1-CG2 3.94Å; F1129-I1146 HydrophobicContact CZ-CB 4.4Å; F1129-I1146 HydrophobicContact CZ-CG2 3.85Å; F1129-A1147 HydrophobicContact CZ-CB 4.34Å; F1129-L1150 HydrophobicContact CZ-CD1 4.31Å
1130	K	90.6	Very high	86.9	Confident	59 Å²	59	66 Å²	66	26%	0.257	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	112.7	177.1	174.9	-134.8	-175.9	-177.6	0	110.9	W1112 E1113	W1112-K1130 CarbonylContact C-O 3.5Å; W1112-K1130 WeakPolarHBondContact CA-O 3.38Å; W1112-K1130 WeakPolarHBondContact CB-O 3.49Å; E1113-K1130 HydrophobicContact CB-CB 4.31Å; E1113-K1130 HydrophobicContact CB-CD 4.37Å; E1113-K1130 HydrophobicContact CG-CD 4.22Å; E1113-K1130 PolarHBondContact N-O 3.05Å; E1113-K1130 PolarHBondContact O-N 2.8Å; E1113-K1130 IonicContact OE1-NZ 2.77Å; E1113-K1130 PolarHBondContact OE1-NZ 2.99Å; E1113-K1130 WeakPolarHBondContact OE2-CD 3.43Å; E1113-K1130 IonicContact OE2-NZ 2.61Å; E1113-K1130 PolarHBondContact OE2-NZ 3.39Å
1131	R	92.6	Very high	87.7	Confident	100 Å²	100	66.3 Å²	66.3	38%	0.377	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	135.7	176.4	-172.2	-176.9	62.6	176.1	-12.8	111.8	S1133 G1134 S1136 F1139	R1131-S1133 VanDerWaalsContact CD-O 3.22Å; R1131-S1133 WeakPolarHBondContact CD-O 3.47Å; R1131-S1133 WeakPolarHBondContact CG-O 3.43Å; R1131-G1134 WeakPolarHBondContact CD-O 3.23Å; R1131-G1134 PolarHBondContact NH1-O 3.12Å; R1131-S1136 VanDerWaalsContact NH1-CA 3.32Å; R1131-S1136 VanDerWaalsContact NH1-N 3.16Å; R1131-S1136 PolarHBondContact NH1-OG 2.89Å; R1131-F1139 HydrophobicContact CB-CD1 3.84Å; R1131-F1139 HydrophobicContact CB-CD2 3.83Å; R1131-F1139 HydrophobicContact CB-CE2 3.93Å; R1131-F1139 HydrophobicContact CB-CE1 3.92Å; R1131-F1139 HydrophobicContact CG-CG 3.88Å; R1131-F1139 HydrophobicContact CG-CD2 4.03Å; R1131-F1139 HydrophobicContact CG-CD1 4.32Å; R1131-F1139 HydrophobicContact CB-CZ 3.97Å; R1131-F1139 HydrophobicContact CB-CG 3.79Å; R1131-F1139 HydrophobicContact CG-CB 4.13Å
1132	I	90.6	Very high	88.7	Confident	81 Å²	81	59 Å²	59	42%	0.415	33%	0.327	S	S	.	.			trans	-96.2	-54.3	169.4	-58.9	163.9	0	0	0	109.1	I1098 Q1111 E1113	I1098-I1132 HydrophobicContact CD1-CD1 4.25Å; I1098-I1132 HydrophobicContact CG2-CD1 3.84Å; Q1111-I1132 HydrophobicContact CB-CB 4.03Å; Q1111-I1132 HydrophobicContact CB-CD1 4.28Å; Q1111-I1132 HydrophobicContact CB-CG2 4.49Å; Q1111-I1132 PolarHBondContact O-N 3.48Å; E1113-I1132 HydrophobicContact CG-CD1 3.98Å; E1113-I1132 HydrophobicContact CG-CG1 4.09Å
1133	S	91.3	Very high	89.5	Confident	37 Å²	37	54.5 Å²	54.5	26%	0.259	30%	0.304	S	S	.	.	S	Bend	trans	-138.3	179.7	-174.7	70.5	0	0	0	0	112.4	Q1111 R1131	Q1111-S1133 VanDerWaalsContact CB-OG 3.27Å; Q1111-S1133 WeakPolarHBondContact CB-OG 3.17Å; Q1111-S1133 WeakPolarHBondContact CG-OG 3.45Å; Q1111-S1133 PolarHBondContact N-OG 3.31Å; Q1111-S1133 VanDerWaalsContact N-OG 3.13Å; Q1111-S1133 PolarHBondContact O-N 3.12Å; Q1111-S1133 VanDerWaalsContact O-N 3.15Å; Q1111-S1133 PolarHBondContact OE1-OG 3.02Å; Q1111-S1133 VanDerWaalsContact OE1-OG 3.07Å; R1131-S1133 VanDerWaalsContact CD-O 3.22Å; R1131-S1133 WeakPolarHBondContact CD-O 3.47Å; R1131-S1133 WeakPolarHBondContact CG-O 3.43Å
1134	G	86.7	Confident	89.8	Confident	31 Å²	31	50.9 Å²	50.9	32%	0.32	28%	0.279	S	S	.	.	S	Bend	trans	82.9	167.6	174.5	0	0	0	0	0	116.3	N1109 R1131	N1109-G1134 WeakPolarHBondContact O-CA 3.49Å; R1131-G1134 WeakPolarHBondContact CD-O 3.23Å; R1131-G1134 PolarHBondContact NH1-O 3.12Å
1135	T	86.5	Confident	90	Very high	69 Å²	69	53 Å²	53	42%	0.423	29%	0.287	S	S	.	.			trans	-65.7	149	-173.8	72.6	0	0	0	0	112.6	I1137 G1138 F1139	T1135-I1137 PolarHBondContact O-N 2.88Å; T1135-G1138 PolarHBondContact O-N 3.16Å; T1135-G1138 PolarHBondContact OG1-N 3.25Å; T1135-F1139 PolarHBondContact O-N 2.85Å
1136	S	84.8	Confident	90.2	Very high	79 Å²	79	51.9 Å²	51.9	55%	0.552	28%	0.282	S	S	*	.	H	α-helix	trans	-65.7	-21	179.5	-53.3	0	0	0	0	113	R1131 K1140	R1131-S1136 VanDerWaalsContact NH1-CA 3.32Å; R1131-S1136 VanDerWaalsContact NH1-N 3.16Å; R1131-S1136 PolarHBondContact NH1-OG 2.89Å; S1136-K1140 VanDerWaalsContact O-CB 3.29Å; S1136-K1140 WeakPolarHBondContact O-CB 3.36Å; S1136-K1140 PolarHBondContact O-N 2.85Å
1137	I	84.8	Confident	90.2	Very high	145 Å²	145	52.8 Å²	52.8	74%	0.744	29%	0.289	S	S	*	.	H	α-helix	trans	-83.3	-48.6	176.9	-60.1	174.9	0	0	0	109.8	T1135 K1140 S1141	T1135-I1137 PolarHBondContact O-N 2.88Å; I1137-K1140 PolarHBondContact O-N 3.16Å; I1137-S1141 PolarHBondContact O-N 3.4Å
1138	G	87.8	Confident	90.1	Very high	22 Å²	22	59.3 Å²	59.3	23%	0.227	32%	0.324	C	S	.	.	H	α-helix	trans	-56.1	-52.7	176.5	0	0	0	0	0	112	T1135 K1140 S1141 I1142	T1135-G1138 PolarHBondContact O-N 3.16Å; T1135-G1138 PolarHBondContact OG1-N 3.25Å; G1138-K1140 VanDerWaalsContact C-N 3.31Å; G1138-K1140 PolarHBondContact O-N 3.03Å; G1138-S1141 PolarHBondContact O-N 3.11Å; G1138-S1141 WeakPolarHBondContact O-CB 3.09Å; G1138-I1142 PolarHBondContact O-N 3.01Å
1139	F	92.7	Very high	90.1	Very high	38 Å²	38	60 Å²	60	17%	0.167	33%	0.331	C	S	.	.	H	α-helix	trans	-57	-42.8	175.6	174.4	-109.7	0	0	0	112.7	V1110 W1112 F1129 R1131 T1135 S1141 A1143	V1110-F1139 HydrophobicContact CG1-CB 3.68Å; V1110-F1139 HydrophobicContact CG1-CD2 3.97Å; V1110-F1139 HydrophobicContact CG1-CG 4.31Å; W1112-F1139 HydrophobicContact CB-CD2 4Å; W1112-F1139 HydrophobicContact CB-CE2 3.55Å; W1112-F1139 HydrophobicContact CD2-CE2 4.47Å; W1112-F1139 HydrophobicContact CG-CD2 4.31Å; W1112-F1139 AromaticContact CG-CE2 3.83Å; W1112-F1139 HydrophobicContact CG-CE2 3.83Å; F1129-F1139 HydrophobicContact CB-CZ 4.26Å; R1131-F1139 HydrophobicContact CB-CD1 3.84Å; R1131-F1139 HydrophobicContact CB-CD2 3.83Å; R1131-F1139 HydrophobicContact CB-CE2 3.93Å; R1131-F1139 HydrophobicContact CB-CE1 3.92Å; R1131-F1139 HydrophobicContact CG-CG 3.88Å; R1131-F1139 HydrophobicContact CG-CD2 4.03Å; R1131-F1139 HydrophobicContact CG-CD1 4.32Å; R1131-F1139 HydrophobicContact CB-CZ 3.97Å; R1131-F1139 HydrophobicContact CB-CG 3.79Å; R1131-F1139 HydrophobicContact CG-CB 4.13Å; T1135-F1139 PolarHBondContact O-N 2.85Å; F1139-S1141 VanDerWaalsContact C-N 3.27Å; F1139-S1141 PolarHBondContact O-N 3.19Å; F1139-A1143 HydrophobicContact CD2-CB 4.13Å; F1139-A1143 HydrophobicContact CE2-CB 3.76Å; F1139-A1143 HydrophobicContact CZ-CB 4.03Å; F1139-A1143 WeakPolarHBondContact O-CB 3.47Å; F1139-A1143 PolarHBondContact O-N 3.39Å
1140	K	89.4	Confident	90	Very high	153 Å²	153	60.1 Å²	60.1	67%	0.665	33%	0.332	S	S	*	.	H	α-helix	trans	-64.3	-33.8	177.8	-175	-178	175.3	-169.2	0	111.8	S1136 I1137 G1138 S1144	S1136-K1140 VanDerWaalsContact O-CB 3.29Å; S1136-K1140 WeakPolarHBondContact O-CB 3.36Å; S1136-K1140 PolarHBondContact O-N 2.85Å; I1137-K1140 PolarHBondContact O-N 3.16Å; G1138-K1140 VanDerWaalsContact C-N 3.31Å; G1138-K1140 PolarHBondContact O-N 3.03Å; K1140-S1144 VanDerWaalsContact O-CB 3.23Å; K1140-S1144 WeakPolarHBondContact O-CB 3.47Å; K1140-S1144 PolarHBondContact O-N 3.09Å; K1140-S1144 PolarHBondContact O-OG 3.12Å
1141	S	89.6	Confident	89.7	Confident	77 Å²	77	64.9 Å²	64.9	54%	0.538	35%	0.353	S	S	.	.	H	α-helix	trans	-66.3	-66	176.2	-158.5	0	0	0	0	110.6	I1137 G1138 F1139 A1143 S1144 Q1145	I1137-S1141 PolarHBondContact O-N 3.4Å; G1138-S1141 PolarHBondContact O-N 3.11Å; G1138-S1141 WeakPolarHBondContact O-CB 3.09Å; F1139-S1141 VanDerWaalsContact C-N 3.27Å; F1139-S1141 PolarHBondContact O-N 3.19Å; S1141-A1143 PolarHBondContact O-N 2.81Å; S1141-S1144 PolarHBondContact O-N 3.22Å; S1141-Q1145 PolarHBondContact O-N 2.65Å
1142	I	93.4	Very high	89.3	Confident	5 Å²	5	62.6 Å²	62.6	3%	0.026	35%	0.348	C	S	.	.	H	α-helix	trans	-62.7	-45.1	-173	-169.6	58.3	0	0	0	112.1	H1101 W1112 G1138 S1144 Q1145 I1146	H1101-I1142 HydrophobicContact CB-CG1 4.13Å; W1112-I1142 HydrophobicContact CE3-CG2 4.37Å; W1112-I1142 HydrophobicContact CH2-CG1 3.7Å; W1112-I1142 HydrophobicContact CH2-CG2 3.95Å; W1112-I1142 HydrophobicContact CZ2-CG1 4.25Å; W1112-I1142 HydrophobicContact CZ3-CG1 4.37Å; W1112-I1142 HydrophobicContact CZ3-CG2 3.86Å; G1138-I1142 PolarHBondContact O-N 3.01Å; I1142-S1144 PolarHBondContact O-N 2.68Å; I1142-Q1145 PolarHBondContact O-N 3.3Å; I1142-Q1145 VanDerWaalsContact O-N 3.15Å; I1142-I1146 HydrophobicContact CD1-CD1 4.48Å; I1142-I1146 HydrophobicContact CD1-CG1 4.25Å; I1142-I1146 HydrophobicContact CG1-CG1 4.26Å; I1142-I1146 WeakPolarHBondContact O-CG1 3.33Å; I1142-I1146 PolarHBondContact O-N 3.27Å
1143	A	92	Very high	89.2	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-67.2	-12.7	178.5	0	0	0	0	0	113.3	K1064 F1129 F1139 S1141 A1147	K1064-A1143 VanDerWaalsContact CD-O 3.27Å; K1064-A1143 WeakPolarHBondContact CD-O 3.42Å; K1064-A1143 WeakPolarHBondContact CE-O 3.47Å; K1064-A1143 PolarHBondContact NZ-O 2.96Å; F1129-A1143 HydrophobicContact CD1-CB 3.7Å; F1129-A1143 HydrophobicContact CE1-CB 4.03Å; F1139-A1143 HydrophobicContact CD2-CB 4.13Å; F1139-A1143 HydrophobicContact CE2-CB 3.76Å; F1139-A1143 HydrophobicContact CZ-CB 4.03Å; F1139-A1143 WeakPolarHBondContact O-CB 3.47Å; F1139-A1143 PolarHBondContact O-N 3.39Å; S1141-A1143 PolarHBondContact O-N 2.81Å; A1143-A1147 VanDerWaalsContact O-CB 3.28Å; A1143-A1147 WeakPolarHBondContact O-CB 3.32Å
1144	S	89.6	Confident	89.1	Confident	37 Å²	37	62.9 Å²	62.9	26%	0.259	35%	0.349	S	S	.	.	H	α-helix	trans	-93.4	-33	172.9	-54.6	0	0	0	0	112.4	K1064 K1140 S1141 I1142 A1147 N1148	K1064-S1144 PolarHBondContact NZ-OG 3.42Å; K1140-S1144 VanDerWaalsContact O-CB 3.23Å; K1140-S1144 WeakPolarHBondContact O-CB 3.47Å; K1140-S1144 PolarHBondContact O-N 3.09Å; K1140-S1144 PolarHBondContact O-OG 3.12Å; S1141-S1144 PolarHBondContact O-N 3.22Å; I1142-S1144 PolarHBondContact O-N 2.68Å; S1144-A1147 PolarHBondContact O-N 3.23Å; S1144-N1148 PolarHBondContact O-N 3.15Å; S1144-N1148 VanDerWaalsContact O-N 3.12Å; S1144-N1148 PolarHBondContact O-ND2 3.02Å; S1144-N1148 PolarHBondContact O-OD1 2.54Å
1145	Q	91.2	Very high	89.3	Confident	95 Å²	95	64.7 Å²	64.7	44%	0.444	35%	0.351	S	S	.	.	H	α-helix	trans	-61.7	-56.2	169.7	-175.1	168.6	-24.1	0	0	110.6	N1085 S1141 I1142 A1147 N1148 D1149	N1085-Q1145 WeakPolarHBondContact OD1-CG 3.38Å; N1085-Q1145 PolarHBondContact OD1-NE2 3.39Å; S1141-Q1145 PolarHBondContact O-N 2.65Å; I1142-Q1145 PolarHBondContact O-N 3.3Å; I1142-Q1145 VanDerWaalsContact O-N 3.15Å; Q1145-A1147 PolarHBondContact O-N 3.17Å; Q1145-A1147 VanDerWaalsContact O-N 3.13Å; Q1145-N1148 PolarHBondContact O-N 3.36Å; Q1145-D1149 VanDerWaalsContact O-N 3.1Å; Q1145-D1149 PolarHBondContact O-N 3.29Å
1146	I	94.1	Very high	89.4	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-52.2	-40.3	174.4	-60.8	-65.2	0	0	0	111.8	V1081 L1082 N1085 W1112 M1114 F1129 I1142 N1148 D1149 L1150	V1081-I1146 HydrophobicContact CG1-CB 4.46Å; V1081-I1146 HydrophobicContact CG1-CD1 3.98Å; V1081-I1146 HydrophobicContact CG1-CG2 4.01Å; L1082-I1146 HydrophobicContact CD2-CD1 4.05Å; L1082-I1146 HydrophobicContact CD2-CG1 4.48Å; N1085-I1146 HydrophobicContact CB-CD1 3.51Å; W1112-I1146 HydrophobicContact CZ2-CG1 4.48Å; M1114-I1146 HydrophobicContact CE-CG2 4.01Å; M1114-I1146 HydrophobicContact SD-CG2 4.13Å; F1129-I1146 HydrophobicContact CE1-CB 4.25Å; F1129-I1146 HydrophobicContact CE1-CG2 3.94Å; F1129-I1146 HydrophobicContact CZ-CB 4.4Å; F1129-I1146 HydrophobicContact CZ-CG2 3.85Å; I1142-I1146 HydrophobicContact CD1-CD1 4.48Å; I1142-I1146 HydrophobicContact CD1-CG1 4.25Å; I1142-I1146 HydrophobicContact CG1-CG1 4.26Å; I1142-I1146 WeakPolarHBondContact O-CG1 3.33Å; I1142-I1146 PolarHBondContact O-N 3.27Å; I1146-N1148 PolarHBondContact O-N 3.13Å; I1146-D1149 PolarHBondContact O-N 3.33Å; I1146-L1150 HydrophobicContact CG2-CD1 4.35Å; I1146-L1150 VanDerWaalsContact O-CG 3.26Å; I1146-L1150 WeakPolarHBondContact O-CG 3.27Å; I1146-L1150 PolarHBondContact O-N 3.14Å
1147	A	90.7	Very high	89.7	Confident	19 Å²	19	63.6 Å²	63.6	16%	0.157	33%	0.334	C	S	.	.	H	α-helix	trans	-73.8	-22.3	-178.5	0	0	0	0	0	114.7	K1064 F1129 A1143 S1144 Q1145	K1064-A1147 HydrophobicContact CB-CB 4.09Å; K1064-A1147 HydrophobicContact CD-CB 3.52Å; K1064-A1147 HydrophobicContact CG-CB 4.47Å; F1129-A1147 HydrophobicContact CZ-CB 4.34Å; A1143-A1147 VanDerWaalsContact O-CB 3.28Å; A1143-A1147 WeakPolarHBondContact O-CB 3.32Å; S1144-A1147 PolarHBondContact O-N 3.23Å; Q1145-A1147 PolarHBondContact O-N 3.17Å; Q1145-A1147 VanDerWaalsContact O-N 3.13Å
1148	N	89.6	Confident	90	Very high	136 Å²	136	58.1 Å²	58.1	73%	0.727	31%	0.306	S	S	*	.	H	α-helix	trans	-83.6	-31.6	173.8	-66.7	-15.4	0	0	0	111.6	S1144 Q1145 I1146	S1144-N1148 PolarHBondContact O-N 3.15Å; S1144-N1148 VanDerWaalsContact O-N 3.12Å; S1144-N1148 PolarHBondContact O-ND2 3.02Å; S1144-N1148 PolarHBondContact O-OD1 2.54Å; Q1145-N1148 PolarHBondContact O-N 3.36Å; I1146-N1148 PolarHBondContact O-N 3.13Å
1149	D	91.6	Very high	90.2	Very high	67 Å²	67	60.7 Å²	60.7	36%	0.358	31%	0.312	S	S	.	.	H	α-helix	trans	-79.9	-20.7	-178.5	-66.9	-13.2	0	0	0	113.1	V1081 N1085 Q1145 I1146 K1151	V1081-D1149 HydrophobicContact CG1-CB 3.58Å; V1081-D1149 HydrophobicContact CG2-CB 4.27Å; N1085-D1149 PolarHBondContact ND2-OD2 3.39Å; N1085-D1149 PolarHBondContact OD1-OD2 2.89Å; Q1145-D1149 VanDerWaalsContact O-N 3.1Å; Q1145-D1149 PolarHBondContact O-N 3.29Å; I1146-D1149 PolarHBondContact O-N 3.33Å; D1149-K1151 PolarHBondContact O-N 3.16Å
1150	L	91.1	Very high	90	Very high	12 Å²	12	62.5 Å²	62.5	6%	0.063	32%	0.323	C	S	.	.			trans	-65.7	109.9	176.5	-83	171.5	0	0	0	112.2	T1065 E1077 I1078 V1081 M1114 F1129 I1146 L1152	T1065-L1150 HydrophobicContact CG2-CD1 4.21Å; E1077-L1150 HydrophobicContact CG-CD2 4.31Å; I1078-L1150 HydrophobicContact CB-CD2 4.42Å; I1078-L1150 HydrophobicContact CG1-CD2 3.73Å; V1081-L1150 HydrophobicContact CB-CD2 4.27Å; V1081-L1150 HydrophobicContact CG1-CG 4.47Å; V1081-L1150 HydrophobicContact CG2-CD2 4.1Å; V1081-L1150 HydrophobicContact CG2-CG 4.48Å; M1114-L1150 HydrophobicContact CE-CD1 4.3Å; F1129-L1150 HydrophobicContact CZ-CD1 4.31Å; I1146-L1150 HydrophobicContact CG2-CD1 4.35Å; I1146-L1150 VanDerWaalsContact O-CG 3.26Å; I1146-L1150 WeakPolarHBondContact O-CG 3.27Å; I1146-L1150 PolarHBondContact O-N 3.14Å; L1150-L1152 HydrophobicContact CB-CD1 4.13Å; L1150-L1152 HydrophobicContact CB-CG 4.19Å; L1150-L1152 HydrophobicContact CD1-CD1 4.16Å; L1150-L1152 HydrophobicContact CD2-CD1 3.9Å; L1150-L1152 HydrophobicContact CD2-CG 4.27Å; L1150-L1152 HydrophobicContact CG-CD1 4.29Å; L1150-L1152 PolarHBondContact O-N 3.15Å; L1150-L1152 VanDerWaalsContact O-N 3.09Å
1151	K	84.2	Confident	90.1	Very high	160 Å²	160	54.9 Å²	54.9	70%	0.696	30%	0.295	S	S	*	.			trans	-84.1	77.2	174.8	-60.2	-177.1	-178.1	-174.6	0	110.3	D1149	D1149-K1151 PolarHBondContact O-N 3.16Å
1152	L	83.6	Confident	90.1	Very high	51 Å²	51	52.9 Å²	52.9	27%	0.267	27%	0.272	S	S	.	.			trans	-127.3	0	-171.5	-72.6	-174.4	0	0	0	112.5	T1065 S1067 M1069 M1074 E1077 V1127 L1150	T1065-L1152 HydrophobicContact CG2-CB 4.18Å; T1065-L1152 HydrophobicContact CG2-CD1 3.77Å; S1067-L1152 WeakPolarHBondContact CA-OXT 3.37Å; S1067-L1152 WeakPolarHBondContact CB-OXT 3.04Å; S1067-L1152 PolarHBondContact OG-OXT 3.26Å; M1069-L1152 HydrophobicContact CE-CD2 4.4Å; M1069-L1152 HydrophobicContact SD-CD2 3.82Å; M1074-L1152 HydrophobicContact CB-CD2 4.17Å; M1074-L1152 HydrophobicContact CE-CD1 4Å; M1074-L1152 HydrophobicContact CE-CD2 4.45Å; M1074-L1152 HydrophobicContact CG-CD2 3.93Å; E1077-L1152 HydrophobicContact CB-CD2 4.35Å; E1077-L1152 HydrophobicContact CG-CD2 4.48Å; V1127-L1152 HydrophobicContact CG2-CD1 3.47Å; V1127-L1152 VanDerWaalsContact CG2-CD1 3.47Å; L1150-L1152 HydrophobicContact CB-CD1 4.13Å; L1150-L1152 HydrophobicContact CB-CG 4.19Å; L1150-L1152 HydrophobicContact CD1-CD1 4.16Å; L1150-L1152 HydrophobicContact CD2-CD1 3.9Å; L1150-L1152 HydrophobicContact CD2-CG 4.27Å; L1150-L1152 HydrophobicContact CG-CD1 4.29Å; L1150-L1152 PolarHBondContact O-N 3.15Å; L1150-L1152 VanDerWaalsContact O-N 3.09Å

Retrieved 1,152 of 1,152 residues in 276 ms (Link to these results)

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