X5M8V1_CAEEL Loading...

PDZ domain-containing protein

AlphaFold DB , UniProt , Accession X5M8V1, Species CAEEL (Caenorhabditis elegans), Gene afd-1, Length 1,049 aa.

						>X5M8V1_CAEEL|X5M8V1|afd-1
MSGSSVSSSRQEDLMMHSNNNILPPYSTKSAQEPLQLPLSIQIGDYNVWDFLAEVMSNRAATSSEMSTFRLSPAYSLYLALRSFHTHNKPYSVQFFSRIESNFKQIAQECSSKDDLIFWLANASEFNHLVERDTELKASRYGKISVEIERIFRRLVAVLQSVIRPAARALLDIHLNDHDATGDVIHLLDTTMRQARICGLNAALTIQLCGHLLHMVNAFVFNSLVSVNLPAAQLNTRLGKCLQYRIESIHRFCERMGVEMAAECHLDRSRQAANLLATQKNDVAALGSTCYKLNSLQVVHILSGFEPDDGEIPCDDDVVDRICRLAEKQADKLTLEDGQRVTLEESDELNLPFLIPQDGYFVEQFRTVPDGLWQYLQQLQHRRLCHTVSLTPAPPAAMTHSMHAMHIGASDAHYHQHQHQQQQNPIVRSVSQTTLTSIPTTQFGDSFGSAVSDTISKVTLRKNGGGIGLSIVAAQGVGDRQMGIYVKKVVEGTPAAHDGRLETGDQLLSVNGHSLIGISQEDAARLMTQSGNEVHFDVRKRAAHRNGLSNWLGSQTPTTSNFIAPSPSTVPPPSYSHVGRTPSYDGQPPPSYNHRNGGASGAGGSSGRNSAFVAPLSNSSSNASSSHMQQHYAHHNMMHNGNLSAAPGAPAGDPKHYRSSSASDLQHDPNASFSQSSMTGSARSSVFDKLPSHYRHSTRPTVIQPTRPSAQSPSALRKAAAASPVSNLYRPTSASNLFAPPRNSGGLVGYSSNAARESTQDIHRAEPAIVIRPVDLNMPKATPPASIRGAVPTAITQALQLQPNGGGAVLRQVRPASGLRERLQDADVRNLEKTNTALMSYEAVNEELDRLDAKQNTMTIDEQRRYRELLNVVAEQSRARKLLSEIRSPPTSYQEREIPIHVQKEQQQHRRETVIDDIPHSSSSVENVSPVSPPESRKVQFIDEVVQYQTPTSGANHAFFDDVPVLDSPGIVGTNEIYRDPRQRRLNELQDRNRSSENGAADGAKLGFRDKQRLFARQIGEDTAPRQRMNESSAQRLIETDIAATPQKP
					

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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	32.2	Very low	27.4	Very low	237 Å²	237	137 Å²	137	100%	1.167	82%	0.819	S	S	*	*				0	125.4	0	-54.2	-179.2	91.9	0	0	106.3
2	S	27.8	Very low	27.5	Very low	121 Å²	121	138.8 Å²	138.8	85%	0.846	81%	0.812	S	S	*	*			cis	-158	160.6	-7.6	-61.2	0	0	0	0	105.7
3	G	28.2	Very low	27.4	Very low	65 Å²	65	139.4 Å²	139.4	67%	0.67	81%	0.81	S	S	*	*			cis	161.9	-170	6.1	0	0	0	0	0	108.1
4	S	27.1	Very low	27.3	Very low	124 Å²	124	138.9 Å²	138.9	87%	0.867	80%	0.802	S	S	*	*			trans	68	101.9	162.8	-53.3	0	0	0	0	119.4
5	S	28.4	Very low	27.2	Very low	112 Å²	112	139.9 Å²	139.9	78%	0.783	80%	0.799	S	S	*	*			trans	-44.1	157.3	153.2	52	0	0	0	0	117.1
6	V	26.4	Very low	27.2	Very low	144 Å²	144	140.5 Å²	140.5	87%	0.873	80%	0.795	S	S	*	*				-164.6	158.3	120.9	137.6	0	0	0	0	110.3
7	S	25.6	Very low	27.3	Very low	108 Å²	108	141.6 Å²	141.6	76%	0.755	79%	0.792	S	S	*	*			trans	-115.2	155.7	-167.3	55.7	0	0	0	0	114.7
8	S	26.3	Very low	27.2	Very low	102 Å²	102	140.4 Å²	140.4	71%	0.713	79%	0.794	S	S	*	*				166.6	139.6	120	-176.4	0	0	0	0	114.1
9	S	26.3	Very low	27.2	Very low	101 Å²	101	141.6 Å²	141.6	71%	0.706	80%	0.798	S	S	*	*			trans	53.3	146.5	149.7	53.9	0	0	0	0	120.5
10	R	28.2	Very low	27.2	Very low	230 Å²	230	142.5 Å²	142.5	87%	0.868	80%	0.801	S	S	*	*			cis	-155.1	173.8	-5.2	-107.6	172.5	175.9	163.2	-3.3	104.5
11	Q	25.2	Very low	27.2	Very low	163 Å²	163	142.9 Å²	142.9	76%	0.762	80%	0.801	S	S	*	*			cis	-159.9	-178.2	31.1	-158.1	152.3	-43.6	0	0	109.8
12	E	28.3	Very low	27.2	Very low	158 Å²	158	139.1 Å²	139.1	74%	0.738	79%	0.785	S	S	*	*			trans	-64.2	153.5	-179.1	-57.6	98	146.7	0	0	114.1
13	D	26.1	Very low	27.1	Very low	147 Å²	147	139.8 Å²	139.8	79%	0.786	78%	0.778	S	S	*	*				-159.1	159.5	85.6	-128.7	-22.4	0	0	0	118.6
14	L	26.5	Very low	27.1	Very low	133 Å²	133	141 Å²	141	70%	0.696	77%	0.774	S	S	*	*			trans	3	134.4	172.3	-100.6	62.6	0	0	0	126.2
15	M	26	Very low	27.1	Very low	153 Å²	153	141.3 Å²	141.3	75%	0.754	77%	0.773	S	S	*	*			trans	62.3	105.3	145.2	-53.4	-156.4	-162.1	0	0	122.4
16	M	26.4	Very low	27.1	Very low	150 Å²	150	145.7 Å²	145.7	74%	0.739	77%	0.774	S	S	*	*				172.4	146.4	101.6	-95.9	-58.8	-172.3	0	0	114.5
17	H	28.9	Very low	27.1	Very low	160 Å²	160	144.1 Å²	144.1	74%	0.741	77%	0.769	S	S	*	*			trans	41.5	105.2	162	-59.3	106	0	0	0	120.9
18	S	26.2	Very low	27.2	Very low	119 Å²	119	145 Å²	145	83%	0.832	77%	0.77	S	S	*	*				167.7	116.9	118.3	-76.9	0	0	0	0	112
19	N	26.2	Very low	27.4	Very low	163 Å²	163	148.9 Å²	148.9	87%	0.872	77%	0.774	S	S	*	*			trans	-116.2	99.3	171.2	-96.5	-2.1	0	0	0	111.2
20	N	28.1	Very low	27.5	Very low	160 Å²	160	149.5 Å²	149.5	86%	0.856	78%	0.779	S	S	*	*			trans	-73.7	136.6	149	-88.2	-29.2	0	0	0	107.9
21	N	27.3	Very low	27.8	Very low	150 Å²	150	142.9 Å²	142.9	80%	0.802	77%	0.773	S	S	*	*			trans	-144.5	131.9	153.6	-123.7	-23.3	0	0	0	112.7
22	I	30.9	Very low	28.8	Very low	159 Å²	159	143 Å²	143	82%	0.815	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-64.2	134.9	-167.6	-66.4	155.4	0	0	0	111.2
23	L	27	Very low	29.7	Very low	135 Å²	135	143.4 Å²	143.4	71%	0.707	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-97.2	151.1	161.8	-81.2	167.5	0	0	0	110.1
24	P	27.8	Very low	31.2	Very low	90 Å²	90	140.6 Å²	140.6	58%	0.584	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-68.6	159.5	-174.3	29.1	-36	0	0	0	112.7	Y26	P24-Y26 PolarHBondContact O-N 2.7Å
25	P	28	Very low	33	Very low	131 Å²	131	135.7 Å²	135.7	85%	0.851	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-62.8	119.9	175.9	26.7	-34.1	0	0	0	110.3
26	Y	28.4	Very low	34.9	Very low	204 Å²	204	135.1 Å²	135.1	80%	0.8	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-66.7	151.3	178.6	-87.4	-91.3	0	0	0	112.1	P24	P24-Y26 PolarHBondContact O-N 2.7Å
27	S	25.8	Very low	37	Very low	110 Å²	110	129.8 Å²	129.8	77%	0.769	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-54.8	158.3	-165.7	-159.2	0	0	0	0	115.2
28	T	27.5	Very low	39.2	Very low	126 Å²	126	124.5 Å²	124.5	77%	0.773	69%	0.689	S	S	*	*			trans	-45.9	153.2	-179.6	46.7	0	0	0	0	115.1	S30	T28-S30 PolarHBondContact O-N 2.75Å
29	K	31.1	Very low	41.7	Very low	184 Å²	184	119.3 Å²	119.3	80%	0.8	65%	0.652	S	S	*	*			trans	-29.8	134.5	160.8	-59.1	173.6	-178.5	176.9	0	111.8	A31	K29-A31 PolarHBondContact O-N 3.44Å
30	S	28.9	Very low	44.4	Very low	115 Å²	115	113.8 Å²	113.8	80%	0.804	63%	0.626	S	S	*	*			trans	-59.2	108.8	163.1	50.8	0	0	0	0	108.7	T28 Q32	T28-S30 PolarHBondContact O-N 2.75Å; S30-Q32 PolarHBondContact O-N 2.77Å
31	A	34	Very low	47.3	Very low	91 Å²	91	106.2 Å²	106.2	75%	0.752	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-61.7	124.7	165.6	0	0	0	0	0	107.4	K29 E33	K29-A31 PolarHBondContact O-N 3.44Å; A31-E33 PolarHBondContact O-N 2.89Å
32	Q	45.7	Very low	50	Low	165 Å²	165	104 Å²	104	77%	0.771	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-63.1	127.1	164.3	-72.4	174.6	-53.1	0	0	106.7	S30	S30-Q32 PolarHBondContact O-N 2.77Å
33	E	47.4	Very low	52.6	Low	166 Å²	166	97.2 Å²	97.2	78%	0.776	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-58.6	139.8	179.2	-64.7	-179.1	129.2	0	0	109.5	A31	A31-E33 PolarHBondContact O-N 2.89Å
34	P	57.7	Low	54.9	Low	89 Å²	89	91.4 Å²	91.4	58%	0.578	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-61.4	146.4	-178.8	27	-35	0	0	0	110.3	Q36	P34-Q36 VanDerWaalsContact C-N 3.28Å; P34-Q36 PolarHBondContact O-N 3.06Å
35	L	65	Low	57	Low	30 Å²	30	93.3 Å²	93.3	16%	0.157	51%	0.514	C	S	.	.			trans	-75.9	76.1	-171	-159.7	80.9	0	0	0	113.4	Y78 L129 R132 V362	L35-Y78 PolarHBondContact O-OH 2.58Å; L35-Y78 VanDerWaalsContact O-OH 3.07Å; L35-L129 HydrophobicContact CD2-CD2 3.78Å; L35-R132 HydrophobicContact CB-CB 4.3Å; L35-R132 HydrophobicContact CD2-CB 4.14Å; L35-V362 HydrophobicContact CD1-CG1 3.31Å; L35-V362 HydrophobicContact CD2-CG1 3.68Å; L35-V362 HydrophobicContact CG-CG1 4.08Å
36	Q	64.6	Low	59.2	Low	140 Å²	140	94.7 Å²	94.7	65%	0.654	50%	0.503	S	S	*	.			trans	-98.2	96.2	178.1	-163.3	165.3	28	0	0	110.7	P34	P34-Q36 VanDerWaalsContact C-N 3.28Å; P34-Q36 PolarHBondContact O-N 3.06Å
37	L	71.6	Confident	61.7	Low	38 Å²	38	86.1 Å²	86.1	20%	0.199	47%	0.471	C	S	.	.			trans	-57.7	139.3	164.3	-64	177.4	0	0	0	108.8	L39 Y75 Y78 L79	L37-L39 PolarHBondContact O-N 3.25Å; L37-Y75 HydrophobicContact CD1-CD1 3.68Å; L37-Y75 HydrophobicContact CD1-CE1 3.92Å; L37-Y75 HydrophobicContact CD2-CE1 4.18Å; L37-Y78 HydrophobicContact CD1-CD1 3.87Å; L37-Y78 HydrophobicContact CD1-CE1 3.78Å; L37-Y78 HydrophobicContact CG-CE1 4.24Å; L37-L79 HydrophobicContact CD1-CD2 4.17Å
38	P	73.7	Confident	64.6	Low	49 Å²	49	80.9 Å²	80.9	32%	0.318	43%	0.434	S	S	.	.	S	Bend	trans	-76.9	43.2	176	33.8	-36.5	0	0	0	111.4	V368 L390 T391	P38-V368 HydrophobicContact CG-CG2 3.98Å; P38-L390 VanDerWaalsContact O-CA 3.27Å; P38-L390 WeakPolarHBondContact O-CA 3.47Å; P38-L390 WeakPolarHBondContact O-CD2 3.07Å; P38-T391 PolarHBondContact O-N 2.74Å
39	L	80.1	Confident	67.6	Low	11 Å²	11	80.2 Å²	80.2	6%	0.058	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	145.4	177.4	-75.6	175	0	0	0	110.2	L37 L79 V368 L372 W373 L376 V388 S389 L390 T391	L37-L39 PolarHBondContact O-N 3.25Å; L39-L79 HydrophobicContact CB-CD1 4.01Å; L39-L79 HydrophobicContact CB-CD2 3.91Å; L39-L79 HydrophobicContact CD1-CD1 3.88Å; L39-L79 WeakPolarHBondContact O-CD2 3.31Å; L39-V368 HydrophobicContact CD1-CG1 3.77Å; L39-V368 HydrophobicContact CD1-CG2 3.97Å; L39-V368 HydrophobicContact CD2-CG1 4.38Å; L39-V368 HydrophobicContact CD2-CG2 3.94Å; L39-V368 HydrophobicContact CG-CG1 4.3Å; L39-V368 HydrophobicContact CG-CG2 3.65Å; L39-L372 HydrophobicContact CD1-CD2 4Å; L39-W373 HydrophobicContact CD2-CE3 3.76Å; L39-W373 HydrophobicContact CD2-CZ3 3.64Å; L39-L376 HydrophobicContact CD1-CD1 3.94Å; L39-V388 HydrophobicContact CD2-CG1 4.27Å; L39-S389 CarbonylContact C-O 3.49Å; L39-S389 WeakPolarHBondContact CA-O 3.47Å; L39-L390 HydrophobicContact CD2-CD2 3.96Å; L39-T391 VanDerWaalsContact C-OG1 3.3Å; L39-T391 PolarHBondContact N-OG1 2.88Å; L39-T391 PolarHBondContact O-OG1 2.78Å
40	S	82.3	Confident	70.4	Confident	47 Å²	47	76 Å²	76	33%	0.329	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	149.8	159	73.5	0	0	0	0	110	S389	S40-S389 PolarHBondContact N-O 3.31Å; S40-S389 PolarHBondContact O-N 2.9Å; S40-S389 PolarHBondContact OG-OG 3.1Å
41	I	88.3	Confident	73.4	Confident	1 Å²	1	70.5 Å²	70.5	1%	0.005	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	140.5	174.2	71.4	-179.5	0	0	0	110.8	I43 F51 L79 A80 S83 L376 T387 V388	I41-I43 HydrophobicContact CD1-CD1 4Å; I41-I43 HydrophobicContact CD1-CG1 4.34Å; I41-I43 HydrophobicContact CG1-CD1 4.38Å; I41-I43 HydrophobicContact CG1-CG1 4.4Å; I41-F51 HydrophobicContact CD1-CE2 4.13Å; I41-F51 HydrophobicContact CD1-CZ 3.75Å; I41-L79 HydrophobicContact CD1-CB 3.86Å; I41-L79 HydrophobicContact CG1-CB 3.96Å; I41-L79 HydrophobicContact CG2-CB 4.36Å; I41-L79 HydrophobicContact CG2-CD1 4.36Å; I41-A80 HydrophobicContact CD1-CB 4.11Å; I41-S83 VanDerWaalsContact O-CB 3.27Å; I41-S83 WeakPolarHBondContact O-CB 3.44Å; I41-S83 PolarHBondContact O-OG 3.29Å; I41-L376 HydrophobicContact CG2-CD1 4.45Å; I41-L376 HydrophobicContact CG2-CD2 4.34Å; I41-T387 CarbonylContact C-O 3.59Å; I41-T387 WeakPolarHBondContact CA-O 3.21Å; I41-V388 HydrophobicContact CG2-CG1 4.22Å; I41-V388 HydrophobicContact CG2-CG2 4.15Å
42	Q	84.9	Confident	76.1	Confident	103 Å²	103	66.3 Å²	66.3	48%	0.481	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	125.8	170.9	-69	177.9	-28.9	0	0	108.9	C385 H386 T387	Q42-C385 CarbonylContact O-C 3.6Å; Q42-C385 WeakPolarHBondContact O-CA 3.33Å; Q42-C385 WeakPolarHBondContact O-CB 3.39Å; Q42-H386 PolarHBondContact O-N 3.16Å; Q42-T387 PolarHBondContact N-O 2.97Å; Q42-T387 VanDerWaalsContact OE1-CB 3.3Å; Q42-T387 PolarHBondContact OE1-OG1 2.68Å
43	I	84.8	Confident	78.3	Confident	17 Å²	17	61.3 Å²	61.3	9%	0.087	32%	0.317	C	S	.	.			trans	-119.4	122.1	177.7	-57.9	167.3	0	0	0	106	I41 V48 F51 A80 F84 C385	I41-I43 HydrophobicContact CD1-CD1 4Å; I41-I43 HydrophobicContact CD1-CG1 4.34Å; I41-I43 HydrophobicContact CG1-CD1 4.38Å; I41-I43 HydrophobicContact CG1-CG1 4.4Å; I43-V48 HydrophobicContact CG2-CB 4.27Å; I43-V48 HydrophobicContact CG2-CG2 3.75Å; I43-F51 HydrophobicContact CD1-CD1 3.71Å; I43-F51 HydrophobicContact CD1-CD2 3.99Å; I43-F51 HydrophobicContact CD1-CE1 3.66Å; I43-F51 HydrophobicContact CD1-CE2 3.92Å; I43-F51 HydrophobicContact CD1-CG 3.89Å; I43-F51 HydrophobicContact CD1-CZ 3.77Å; I43-F51 HydrophobicContact CG1-CD2 4.24Å; I43-F51 HydrophobicContact CG1-CE2 4.32Å; I43-F51 HydrophobicContact CG1-CG 4.45Å; I43-F51 HydrophobicContact CG2-CB 4.35Å; I43-A80 HydrophobicContact CD1-CB 3.53Å; I43-F84 HydrophobicContact CB-CE1 4.47Å; I43-F84 HydrophobicContact CB-CZ 4.07Å; I43-F84 HydrophobicContact CD1-CE2 4.28Å; I43-F84 HydrophobicContact CD1-CZ 3.96Å; I43-F84 HydrophobicContact CG2-CZ 4.34Å; I43-C385 HydrophobicContact CG1-CB 4.18Å
44	G	75.3	Confident	80.2	Confident	13 Å²	13	54.6 Å²	54.6	13%	0.134	29%	0.286	C	S	.	.			trans	-71.6	145.5	177	0	0	0	0	0	112.3	Y46 N47 H386	G44-Y46 PolarHBondContact O-N 3.43Å; G44-N47 PolarHBondContact O-N 3.5Å; G44-H386 WeakPolarHBondContact CA-CE1 3.45Å; G44-H386 PolarHBondContact N-CE1 3.02Å; G44-H386 PolarHBondContact N-ND1 3.45Å; G44-H386 VanDerWaalsContact N-ND1 3.13Å
45	D	73.1	Confident	81.8	Confident	130 Å²	130	50.3 Å²	50.3	70%	0.695	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-30	-166.6	-49	-68.7	0	0	0	114.4
46	Y	72.9	Confident	83	Confident	160 Å²	160	49.4 Å²	49.4	63%	0.627	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-15.4	-179.2	59.8	-85.3	0	0	0	114.3	G44 H386	G44-Y46 PolarHBondContact O-N 3.43Å; Y46-H386 AromaticContact CE1-CE1 3.81Å; Y46-H386 AromaticContact CE1-NE2 3.52Å; Y46-H386 AromaticContact CZ-CE1 3.49Å; Y46-H386 VanDerWaalsContact CZ-CE1 3.49Å; Y46-H386 AromaticContact CZ-NE2 3.16Å; Y46-H386 PolarHBondContact OH-CE1 3.28Å; Y46-H386 VanDerWaalsContact OH-CE1 3.32Å; Y46-H386 PolarHBondContact OH-NE2 3.4Å
47	N	82.1	Confident	83.9	Confident	23 Å²	23	43.9 Å²	43.9	12%	0.123	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-1.3	-176.2	-76.4	-7.2	0	0	0	114	G44 W49 D50 F51 R383 H386	G44-N47 PolarHBondContact O-N 3.5Å; N47-W49 PolarHBondContact O-N 3Å; N47-D50 PolarHBondContact O-N 3.28Å; N47-F51 WeakPolarHBondContact O-CB 3.14Å; N47-F51 PolarHBondContact O-N 2.81Å; N47-R383 PolarHBondContact ND2-O 2.88Å; N47-H386 PolarHBondContact ND2-CE1 3Å
48	V	86.9	Confident	83.6	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-61.7	-41	-171.4	-177.3	0	0	0	0	112.9	I43 L52 F84 Y91 F95	I43-V48 HydrophobicContact CG2-CB 4.27Å; I43-V48 HydrophobicContact CG2-CG2 3.75Å; V48-L52 WeakPolarHBondContact O-CB 3.48Å; V48-L52 PolarHBondContact O-N 2.93Å; V48-F84 HydrophobicContact CB-CZ 4.27Å; V48-F84 HydrophobicContact CG1-CE2 3.76Å; V48-F84 HydrophobicContact CG1-CZ 3.53Å; V48-F84 HydrophobicContact CG2-CE1 4.11Å; V48-F84 HydrophobicContact CG2-CZ 3.74Å; V48-Y91 HydrophobicContact CB-CE1 4.28Å; V48-Y91 WeakPolarHBondContact CB-OH 3.3Å; V48-Y91 HydrophobicContact CG1-CE1 3.87Å; V48-Y91 WeakPolarHBondContact CG1-OH 3.39Å; V48-Y91 HydrophobicContact CG2-CE1 3.93Å; V48-Y91 WeakPolarHBondContact CG2-OH 3.45Å; V48-F95 HydrophobicContact CG1-CD2 3.72Å; V48-F95 HydrophobicContact CG1-CE2 3.75Å
49	W	89.9	Confident	83	Confident	113 Å²	113	50.6 Å²	50.6	43%	0.428	25%	0.253	S	S	.	.	H	α-helix	trans	-75.6	-31.3	-179.2	-54.9	124.4	0	0	0	112.3	N47 L52 A53 Y91 F95 R98	N47-W49 PolarHBondContact O-N 3Å; W49-L52 HydrophobicContact CE3-CD2 3.91Å; W49-L52 HydrophobicContact CZ3-CD2 4Å; W49-L52 PolarHBondContact O-N 3.16Å; W49-A53 VanDerWaalsContact O-CB 3.23Å; W49-A53 WeakPolarHBondContact O-CB 3.32Å; W49-A53 PolarHBondContact O-N 2.85Å; W49-Y91 HydrophobicContact CH2-CE2 4.48Å; W49-Y91 AromaticContact CZ2-CE2 3.89Å; W49-Y91 HydrophobicContact CZ2-CE2 3.89Å; W49-F95 HydrophobicContact CZ3-CD2 4.28Å; W49-R98 HydrophobicContact CE3-CG 4.31Å; W49-R98 HydrophobicContact CZ3-CB 3.86Å; W49-R98 HydrophobicContact CZ3-CG 3.93Å
50	D	89.8	Confident	81.9	Confident	94 Å²	94	50.3 Å²	50.3	50%	0.503	25%	0.251	S	S	.	.	H	α-helix	trans	-70.7	-39.1	171.9	-66	-32.4	0	0	0	111.6	N47 A53 E54 L384	N47-D50 PolarHBondContact O-N 3.28Å; D50-A53 PolarHBondContact O-N 3.43Å; D50-E54 WeakPolarHBondContact O-CB 3.37Å; D50-E54 PolarHBondContact O-N 3.24Å; D50-L384 HydrophobicContact CB-CD2 3.78Å
51	F	90.6	Very high	80.6	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-58.6	-49.4	170.3	173.4	-84.2	0	0	0	110.6	I41 I43 N47 E54 V55 A80 F95 L379 L384	I41-F51 HydrophobicContact CD1-CE2 4.13Å; I41-F51 HydrophobicContact CD1-CZ 3.75Å; I43-F51 HydrophobicContact CD1-CD1 3.71Å; I43-F51 HydrophobicContact CD1-CD2 3.99Å; I43-F51 HydrophobicContact CD1-CE1 3.66Å; I43-F51 HydrophobicContact CD1-CE2 3.92Å; I43-F51 HydrophobicContact CD1-CG 3.89Å; I43-F51 HydrophobicContact CD1-CZ 3.77Å; I43-F51 HydrophobicContact CG1-CD2 4.24Å; I43-F51 HydrophobicContact CG1-CE2 4.32Å; I43-F51 HydrophobicContact CG1-CG 4.45Å; I43-F51 HydrophobicContact CG2-CB 4.35Å; N47-F51 WeakPolarHBondContact O-CB 3.14Å; N47-F51 PolarHBondContact O-N 2.81Å; F51-E54 PolarHBondContact O-N 2.95Å; F51-V55 HydrophobicContact CD1-CG2 4.27Å; F51-V55 HydrophobicContact CD2-CG2 4.44Å; F51-V55 HydrophobicContact CE1-CG2 4.01Å; F51-V55 HydrophobicContact CE2-CG2 4.21Å; F51-V55 HydrophobicContact CG-CG2 4.47Å; F51-V55 HydrophobicContact CZ-CG2 3.98Å; F51-V55 VanDerWaalsContact O-CB 3.3Å; F51-V55 WeakPolarHBondContact O-CB 3.44Å; F51-V55 WeakPolarHBondContact O-CG2 3.28Å; F51-V55 PolarHBondContact O-N 3.19Å; F51-A80 HydrophobicContact CE1-CB 3.73Å; F51-A80 HydrophobicContact CZ-CB 4.19Å; F51-F95 HydrophobicContact CE1-CZ 4.49Å; F51-L379 HydrophobicContact CD2-CD1 4.32Å; F51-L379 HydrophobicContact CE2-CD1 3.75Å; F51-L379 HydrophobicContact CZ-CD1 4.41Å; F51-L384 HydrophobicContact CB-CB 4.26Å; F51-L384 HydrophobicContact CD2-CB 4.19Å
52	L	91.9	Very high	78.9	Confident	4 Å²	4	52.9 Å²	52.9	2%	0.021	27%	0.266	C	S	.	.	H	α-helix	trans	-62.1	-44.8	178.4	-177.9	62.6	0	0	0	111.7	V48 W49 V55 M56 L77 F95 R98 I99	V48-L52 WeakPolarHBondContact O-CB 3.48Å; V48-L52 PolarHBondContact O-N 2.93Å; W49-L52 HydrophobicContact CE3-CD2 3.91Å; W49-L52 HydrophobicContact CZ3-CD2 4Å; W49-L52 PolarHBondContact O-N 3.16Å; L52-V55 PolarHBondContact O-N 3.34Å; L52-M56 HydrophobicContact CD1-CG 3.97Å; L52-M56 HydrophobicContact CD1-SD 3.72Å; L52-M56 WeakPolarHBondContact O-CB 3.35Å; L52-M56 PolarHBondContact O-N 2.97Å; L52-L77 HydrophobicContact CD1-CD2 3.58Å; L52-F95 HydrophobicContact CB-CE2 4.14Å; L52-F95 HydrophobicContact CD1-CE2 4.16Å; L52-F95 HydrophobicContact CD1-CZ 4.27Å; L52-F95 HydrophobicContact CD2-CE2 4.38Å; L52-F95 HydrophobicContact CG-CE2 4.47Å; L52-R98 HydrophobicContact CD2-CB 3.8Å; L52-R98 HydrophobicContact CD2-CG 3.49Å; L52-R98 VanDerWaalsContact CD2-CG 3.49Å; L52-I99 HydrophobicContact CD1-CG1 3.65Å
53	A	90.5	Very high	77.3	Confident	59 Å²	59	49.1 Å²	49.1	49%	0.488	25%	0.251	S	S	.	.	H	α-helix	trans	-64.6	-39.8	179.8	0	0	0	0	0	112.4	W49 D50 S57	W49-A53 VanDerWaalsContact O-CB 3.23Å; W49-A53 WeakPolarHBondContact O-CB 3.32Å; W49-A53 PolarHBondContact O-N 2.85Å; D50-A53 PolarHBondContact O-N 3.43Å; A53-S57 VanDerWaalsContact O-CB 3.3Å; A53-S57 WeakPolarHBondContact O-CB 3.48Å; A53-S57 PolarHBondContact O-N 3.19Å; A53-S57 VanDerWaalsContact O-N 3.09Å
54	E	89.2	Confident	75.7	Confident	25 Å²	25	53.3 Å²	53.3	12%	0.117	28%	0.282	C	S	.	.	H	α-helix	trans	-70.4	-46.6	176	-172	65.6	-154.8	0	0	111.6	D50 F51 M56 S57 L379 R382 L384	D50-E54 WeakPolarHBondContact O-CB 3.37Å; D50-E54 PolarHBondContact O-N 3.24Å; F51-E54 PolarHBondContact O-N 2.95Å; E54-M56 VanDerWaalsContact C-N 3.3Å; E54-M56 PolarHBondContact O-N 2.89Å; E54-S57 WeakPolarHBondContact O-CB 3.41Å; E54-S57 PolarHBondContact O-N 3.13Å; E54-S57 VanDerWaalsContact O-N 3.11Å; E54-S57 PolarHBondContact O-OG 3.44Å; E54-L379 HydrophobicContact CG-CD2 4.22Å; E54-R382 VanDerWaalsContact CD-CZ 3.47Å; E54-R382 IonicContact OE1-CZ 3.62Å; E54-R382 IonicContact OE1-NH1 3.29Å; E54-R382 PolarHBondContact OE1-NH1 3.48Å; E54-R382 IonicContact OE1-NH2 2.88Å; E54-R382 IonicContact OE2-CZ 3.03Å; E54-R382 IonicContact OE2-NH1 2.67Å; E54-R382 PolarHBondContact OE2-NH1 2.98Å; E54-R382 IonicContact OE2-NH2 2.82Å; E54-R382 PolarHBondContact OE2-NH2 3.43Å; E54-L384 HydrophobicContact CB-CD1 3.7Å; E54-L384 HydrophobicContact CG-CD1 3.84Å
55	V	90.5	Very high	74.4	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-64	-34.5	-179.5	171.4	0	0	0	0	111.9	F51 L52 P73 L77 L379	F51-V55 HydrophobicContact CD1-CG2 4.27Å; F51-V55 HydrophobicContact CD2-CG2 4.44Å; F51-V55 HydrophobicContact CE1-CG2 4.01Å; F51-V55 HydrophobicContact CE2-CG2 4.21Å; F51-V55 HydrophobicContact CG-CG2 4.47Å; F51-V55 HydrophobicContact CZ-CG2 3.98Å; F51-V55 VanDerWaalsContact O-CB 3.3Å; F51-V55 WeakPolarHBondContact O-CB 3.44Å; F51-V55 WeakPolarHBondContact O-CG2 3.28Å; F51-V55 PolarHBondContact O-N 3.19Å; L52-V55 PolarHBondContact O-N 3.34Å; V55-P73 HydrophobicContact CG1-CB 3.95Å; V55-L77 HydrophobicContact CB-CD2 4.44Å; V55-L77 HydrophobicContact CG1-CD2 3.75Å; V55-L77 HydrophobicContact CG1-CG 3.86Å; V55-L379 HydrophobicContact CG2-CD1 3.73Å; V55-L379 HydrophobicContact CG2-CD2 4.38Å
56	M	90.6	Very high	73.3	Confident	10 Å²	10	57.7 Å²	57.7	5%	0.049	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	11	175.1	-59.6	-160.6	74.5	0	0	114	L52 E54 L77 I99 N102 F103 I106	L52-M56 HydrophobicContact CD1-CG 3.97Å; L52-M56 HydrophobicContact CD1-SD 3.72Å; L52-M56 WeakPolarHBondContact O-CB 3.35Å; L52-M56 PolarHBondContact O-N 2.97Å; E54-M56 VanDerWaalsContact C-N 3.3Å; E54-M56 PolarHBondContact O-N 2.89Å; M56-L77 HydrophobicContact CE-CD1 4.44Å; M56-L77 HydrophobicContact CG-CD1 4.12Å; M56-L77 HydrophobicContact CG-CD2 4.29Å; M56-L77 HydrophobicContact SD-CD1 4.03Å; M56-I99 HydrophobicContact SD-CB 4.48Å; M56-I99 HydrophobicContact SD-CG1 4.34Å; M56-I99 HydrophobicContact SD-CG2 4.32Å; M56-N102 HydrophobicContact CE-CB 3.49Å; M56-N102 VanDerWaalsContact CE-CB 3.49Å; M56-N102 HydrophobicContact SD-CB 3.54Å; M56-N102 VanDerWaalsContact SD-CB 3.54Å; M56-F103 HydrophobicContact CE-CD1 4.06Å; M56-F103 HydrophobicContact CE-CD2 3.68Å; M56-F103 HydrophobicContact CE-CE1 3.96Å; M56-F103 HydrophobicContact CE-CE2 3.63Å; M56-F103 HydrophobicContact CE-CG 3.94Å; M56-F103 HydrophobicContact CE-CZ 3.77Å; M56-I106 HydrophobicContact CE-CD1 4.26Å
57	S	83.6	Confident	72.6	Confident	25 Å²	25	50.6 Å²	50.6	18%	0.175	27%	0.269	C	S	.	.	S	Bend	trans	-77.3	144.3	177.3	72.8	0	0	0	0	112.3	A53 E54 R59 A60	A53-S57 VanDerWaalsContact O-CB 3.3Å; A53-S57 WeakPolarHBondContact O-CB 3.48Å; A53-S57 PolarHBondContact O-N 3.19Å; A53-S57 VanDerWaalsContact O-N 3.09Å; E54-S57 WeakPolarHBondContact O-CB 3.41Å; E54-S57 PolarHBondContact O-N 3.13Å; E54-S57 VanDerWaalsContact O-N 3.11Å; E54-S57 PolarHBondContact O-OG 3.44Å; S57-R59 PolarHBondContact O-N 3.17Å; S57-A60 WeakPolarHBondContact O-CB 3.4Å; S57-A60 PolarHBondContact O-N 2.73Å
58	N	64.6	Low	72.2	Confident	78 Å²	78	54.9 Å²	54.9	42%	0.417	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-5.9	173.5	-72.9	-18	0	0	0	113.9	A60 A61 T62 W119	N58-A60 VanDerWaalsContact C-N 3.28Å; N58-A60 PolarHBondContact O-N 3.33Å; N58-A61 PolarHBondContact O-N 3.25Å; N58-T62 PolarHBondContact O-N 2.74Å; N58-T62 VanDerWaalsContact O-N 3.1Å; N58-T62 PolarHBondContact O-OG1 3.4Å; N58-W119 PolarHBondContact OD1-NE1 2.98Å
59	R	61.7	Low	72.1	Confident	150 Å²	150	55.8 Å²	55.8	57%	0.566	30%	0.3	S	S	*	.	H	α-helix	trans	-63.8	-34.4	168.6	-62.4	177.6	171.9	174.1	-3.7	111.5	S57 A61 S63 M66	S57-R59 PolarHBondContact O-N 3.17Å; R59-A61 VanDerWaalsContact C-N 3.31Å; R59-A61 PolarHBondContact O-N 3.25Å; R59-S63 VanDerWaalsContact O-CB 3.3Å; R59-S63 WeakPolarHBondContact O-CB 3.34Å; R59-S63 PolarHBondContact O-N 3.32Å; R59-S63 VanDerWaalsContact O-N 3.09Å; R59-S63 PolarHBondContact O-OG 2.91Å; R59-M66 HydrophobicContact CB-CE 4.03Å
60	A	56.5	Low	72	Confident	4 Å²	4	52.6 Å²	52.6	3%	0.033	29%	0.288	C	S	.	.	H	α-helix	trans	-68	-30.6	177.6	0	0	0	0	0	112.9	S57 N58 P73 F118	S57-A60 WeakPolarHBondContact O-CB 3.4Å; S57-A60 PolarHBondContact O-N 2.73Å; N58-A60 VanDerWaalsContact C-N 3.28Å; N58-A60 PolarHBondContact O-N 3.33Å; A60-P73 HydrophobicContact CB-CG 4.21Å; A60-F118 HydrophobicContact CB-CE1 4.26Å; A60-F118 HydrophobicContact CB-CZ 4.05Å; A60-F118 WeakPolarHBondContact O-CZ 3.49Å
61	A	55.3	Low	72.1	Confident	7 Å²	7	48.2 Å²	48.2	6%	0.058	27%	0.265	C	S	.	.	H	α-helix	trans	-78.3	-47.6	177.2	0	0	0	0	0	111.9	N58 R59 R70 D115 F118	N58-A61 PolarHBondContact O-N 3.25Å; R59-A61 VanDerWaalsContact C-N 3.31Å; R59-A61 PolarHBondContact O-N 3.25Å; A61-R70 PolarHBondContact O-NH1 3.31Å; A61-D115 HydrophobicContact CB-CB 4.36Å; A61-D115 WeakPolarHBondContact CB-OD1 3.44Å; A61-F118 HydrophobicContact CB-CB 4.19Å; A61-F118 HydrophobicContact CB-CD1 3.38Å; A61-F118 HydrophobicContact CB-CD2 4.44Å; A61-F118 HydrophobicContact CB-CE1 3.76Å; A61-F118 HydrophobicContact CB-CG 3.76Å; A61-F118 HydrophobicContact CB-CZ 4.42Å
62	T	51.5	Low	72	Confident	96 Å²	96	48.2 Å²	48.2	59%	0.589	27%	0.265	S	S	*	.	H	α-helix	trans	-81.9	-26.5	-171.1	51.4	0	0	0	0	115.1	N58	N58-T62 PolarHBondContact O-N 2.74Å; N58-T62 VanDerWaalsContact O-N 3.1Å; N58-T62 PolarHBondContact O-OG1 3.4Å
63	S	52.2	Low	72.1	Confident	23 Å²	23	48.1 Å²	48.1	16%	0.161	26%	0.264	C	S	.	.			trans	-83.9	125.4	-177.6	61.7	0	0	0	0	112.9	R59 E65 M66	R59-S63 VanDerWaalsContact O-CB 3.3Å; R59-S63 WeakPolarHBondContact O-CB 3.34Å; R59-S63 PolarHBondContact O-N 3.32Å; R59-S63 VanDerWaalsContact O-N 3.09Å; R59-S63 PolarHBondContact O-OG 2.91Å; S63-E65 PolarHBondContact O-N 2.99Å; S63-M66 WeakPolarHBondContact OG-CB 3.19Å
64	S	50.9	Low	72.2	Confident	105 Å²	105	45.3 Å²	45.3	73%	0.734	24%	0.241	S	C	*	.	S	Bend	trans	-77.7	-6.3	168.9	-169.4	0	0	0	0	113.2
65	E	48.3	Very low	72.3	Confident	183 Å²	183	44.4 Å²	44.4	86%	0.855	24%	0.237	S	C	*	.	S	Bend	trans	-100.7	-24.7	-170.3	-58.4	-179.9	147.1	0	0	113.1	S63	S63-E65 PolarHBondContact O-N 2.99Å
66	M	50.9	Low	72.4	Confident	52 Å²	52	44.4 Å²	44.4	26%	0.256	24%	0.237	S	C	.	.	S	Bend	trans	-90.5	-22.8	-166	-155.7	110	67.7	0	0	113.9	R59 S63 Y375 Q378	R59-M66 HydrophobicContact CB-CE 4.03Å; S63-M66 WeakPolarHBondContact OG-CB 3.19Å; M66-Y375 HydrophobicContact CG-CE2 4.48Å; M66-Q378 PolarHBondContact O-OE1 2.99Å
67	S	58	Low	72.5	Confident	11 Å²	11	43.9 Å²	43.9	8%	0.077	23%	0.234	C	C	.	.			trans	-152.2	133.7	168	67.4	0	0	0	0	112.8	F69	S67-F69 VanDerWaalsContact C-N 3.28Å; S67-F69 PolarHBondContact OG-O 2.82Å
68	T	72.4	Confident	72.9	Confident	113 Å²	113	43 Å²	43	69%	0.693	23%	0.227	S	C	*	.	S	Bend	trans	-76.7	-18.7	165.2	48.8	0	0	0	0	111.9	G371	T68-G371 WeakPolarHBondContact OG1-CA 3.34Å
69	F	86.3	Confident	74.2	Confident	20 Å²	20	39.6 Å²	39.6	9%	0.088	21%	0.209	C	C	.	.	S	Bend	trans	-107.9	100.4	178.1	-178.3	-115.7	0	0	0	110.8	S67 L71 S72 Y75 F361 P369 L372	S67-F69 VanDerWaalsContact C-N 3.28Å; S67-F69 PolarHBondContact OG-O 2.82Å; F69-L71 HydrophobicContact CD1-CB 4.49Å; F69-L71 HydrophobicContact CE1-CB 3.84Å; F69-L71 HydrophobicContact CE2-CB 4.3Å; F69-L71 HydrophobicContact CZ-CB 3.74Å; F69-L71 HydrophobicContact CZ-CD1 4.48Å; F69-L71 PolarHBondContact O-N 2.75Å; F69-L71 VanDerWaalsContact O-N 3.13Å; F69-S72 WeakPolarHBondContact CD1-OG 3.47Å; F69-S72 VanDerWaalsContact O-CB 3.28Å; F69-S72 WeakPolarHBondContact O-CB 3.3Å; F69-S72 PolarHBondContact O-N 3.26Å; F69-S72 PolarHBondContact O-OG 3.35Å; F69-Y75 AromaticContact CE1-CD2 3.77Å; F69-Y75 HydrophobicContact CE1-CD2 3.77Å; F69-Y75 HydrophobicContact CE1-CE2 4.09Å; F69-Y75 HydrophobicContact CE1-CG 4.21Å; F69-Y75 HydrophobicContact CZ-CD2 4.04Å; F69-Y75 AromaticContact CZ-CE2 3.87Å; F69-Y75 HydrophobicContact CZ-CE2 3.87Å; F69-F361 HydrophobicContact CD2-CE2 4.33Å; F69-F361 HydrophobicContact CD2-CZ 4.47Å; F69-F361 HydrophobicContact CE2-CD1 4Å; F69-F361 AromaticContact CE2-CD2 3.63Å; F69-F361 HydrophobicContact CE2-CD2 3.63Å; F69-F361 HydrophobicContact CE2-CE1 4.03Å; F69-F361 AromaticContact CE2-CE2 3.63Å; F69-F361 HydrophobicContact CE2-CE2 3.63Å; F69-F361 AromaticContact CE2-CG 3.8Å; F69-F361 HydrophobicContact CE2-CG 3.8Å; F69-F361 AromaticContact CE2-CZ 3.82Å; F69-F361 HydrophobicContact CE2-CZ 3.82Å; F69-F361 HydrophobicContact CZ-CD1 4.04Å; F69-F361 HydrophobicContact CZ-CD2 4.3Å; F69-F361 HydrophobicContact CZ-CE1 4.35Å; F69-F361 HydrophobicContact CZ-CG 4.01Å; F69-P369 HydrophobicContact CD2-CB 4.43Å; F69-P369 HydrophobicContact CE2-CG 4.44Å; F69-P369 HydrophobicContact CZ-CG 4.45Å; F69-L372 HydrophobicContact CD1-CB 3.76Å; F69-L372 HydrophobicContact CD1-CD1 4.36Å; F69-L372 HydrophobicContact CE1-CB 4.17Å; F69-L372 HydrophobicContact CE1-CD1 4.48Å
70	R	87.9	Confident	75.6	Confident	45 Å²	45	32.5 Å²	32.5	17%	0.17	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-16.4	-171.8	-69.1	-61.1	-163.4	147	3.1	115.6	A61 S72 F118 N122 I197	A61-R70 PolarHBondContact O-NH1 3.31Å; R70-S72 VanDerWaalsContact C-N 3.33Å; R70-F118 HydrophobicContact CB-CE2 4.36Å; R70-F118 WeakPolarHBondContact O-CE2 3.37Å; R70-N122 PolarHBondContact O-ND2 2.66Å; R70-I197 WeakPolarHBondContact CG-O 3.32Å
71	L	90.4	Very high	77.3	Confident	3 Å²	3	32.3 Å²	32.3	2%	0.016	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	7.6	175.2	-62	171.3	0	0	0	113.1	F69 P73 A74 Y75 A121 N122 E125 Y360 F361	F69-L71 HydrophobicContact CD1-CB 4.49Å; F69-L71 HydrophobicContact CE1-CB 3.84Å; F69-L71 HydrophobicContact CE2-CB 4.3Å; F69-L71 HydrophobicContact CZ-CB 3.74Å; F69-L71 HydrophobicContact CZ-CD1 4.48Å; F69-L71 PolarHBondContact O-N 2.75Å; F69-L71 VanDerWaalsContact O-N 3.13Å; L71-P73 VanDerWaalsContact C-N 3.34Å; L71-A74 PolarHBondContact O-N 3Å; L71-A74 VanDerWaalsContact O-N 3.13Å; L71-Y75 HydrophobicContact CB-CD2 4.21Å; L71-Y75 HydrophobicContact CB-CE2 4.28Å; L71-Y75 WeakPolarHBondContact O-CD2 3.42Å; L71-Y75 PolarHBondContact O-N 2.95Å; L71-A121 HydrophobicContact CD2-CB 4Å; L71-N122 WeakPolarHBondContact CA-OD1 3.32Å; L71-N122 PolarHBondContact O-OD1 3.07Å; L71-E125 HydrophobicContact CD1-CG 4.16Å; L71-E125 HydrophobicContact CD2-CB 4.15Å; L71-Y360 HydrophobicContact CD1-CD1 3.84Å; L71-Y360 HydrophobicContact CD1-CG 4.23Å; L71-F361 HydrophobicContact CD1-CB 4.24Å
72	S	89.9	Confident	79	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-49.9	-41.7	179.2	-83.1	0	0	0	0	114.8	F69 R70 S76	F69-S72 WeakPolarHBondContact CD1-OG 3.47Å; F69-S72 VanDerWaalsContact O-CB 3.28Å; F69-S72 WeakPolarHBondContact O-CB 3.3Å; F69-S72 PolarHBondContact O-N 3.26Å; F69-S72 PolarHBondContact O-OG 3.35Å; R70-S72 VanDerWaalsContact C-N 3.33Å; S72-S76 VanDerWaalsContact O-CB 3.31Å; S72-S76 WeakPolarHBondContact O-CB 3.49Å; S72-S76 PolarHBondContact O-N 3.42Å; S72-S76 PolarHBondContact O-OG 3.32Å
73	P	92.9	Very high	80.7	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.006	17%	0.165	C	C	.	.	H	α-helix	trans	-59.1	-49.2	174.2	-26.2	34.4	0	0	0	113.8	V55 A60 L71 Y75 S76 L77 F118 W119 N122	V55-P73 HydrophobicContact CG1-CB 3.95Å; A60-P73 HydrophobicContact CB-CG 4.21Å; L71-P73 VanDerWaalsContact C-N 3.34Å; P73-Y75 VanDerWaalsContact C-N 3.32Å; P73-Y75 PolarHBondContact O-N 3.16Å; P73-S76 PolarHBondContact O-N 3.21Å; P73-S76 VanDerWaalsContact O-N 3.1Å; P73-L77 WeakPolarHBondContact O-CG 3.03Å; P73-L77 PolarHBondContact O-N 3.28Å; P73-F118 HydrophobicContact CG-CE1 4.28Å; P73-F118 HydrophobicContact CG-CZ 3.87Å; P73-W119 HydrophobicContact CB-CH2 4.45Å; P73-W119 HydrophobicContact CB-CZ3 4.08Å; P73-W119 HydrophobicContact CG-CZ3 4.42Å; P73-N122 WeakPolarHBondContact CB-OD1 3.24Å; P73-N122 VanDerWaalsContact CD-OD1 3.3Å; P73-N122 WeakPolarHBondContact CD-OD1 3.49Å
74	A	92.6	Very high	82.5	Confident	1 Å²	1	30.4 Å²	30.4	1%	0.008	16%	0.161	C	C	.	.	H	α-helix	trans	-55.8	-46.2	-179.5	0	0	0	0	0	112.5	L71 Y78 N122 E125 F126	L71-A74 PolarHBondContact O-N 3Å; L71-A74 VanDerWaalsContact O-N 3.13Å; A74-Y78 WeakPolarHBondContact O-CB 3.23Å; A74-Y78 PolarHBondContact O-N 3.45Å; A74-N122 HydrophobicContact CB-CB 4.24Å; A74-N122 VanDerWaalsContact CB-O 3.3Å; A74-N122 WeakPolarHBondContact CB-O 3.48Å; A74-N122 PolarHBondContact N-OD1 3.07Å; A74-E125 HydrophobicContact CB-CB 4.12Å; A74-E125 HydrophobicContact CB-CG 4.38Å; A74-F126 HydrophobicContact CB-CB 4.12Å
75	Y	91.3	Very high	84.2	Confident	5 Å²	5	25.6 Å²	25.6	2%	0.02	13%	0.127	C	C	.	.	H	α-helix	trans	-67.6	-37.6	177.5	-81.1	-101.1	0	0	0	112.3	L37 F69 L71 P73 Y78 L79 E125 L129 V362 L372	L37-Y75 HydrophobicContact CD1-CD1 3.68Å; L37-Y75 HydrophobicContact CD1-CE1 3.92Å; L37-Y75 HydrophobicContact CD2-CE1 4.18Å; F69-Y75 AromaticContact CE1-CD2 3.77Å; F69-Y75 HydrophobicContact CE1-CD2 3.77Å; F69-Y75 HydrophobicContact CE1-CE2 4.09Å; F69-Y75 HydrophobicContact CE1-CG 4.21Å; F69-Y75 HydrophobicContact CZ-CD2 4.04Å; F69-Y75 AromaticContact CZ-CE2 3.87Å; F69-Y75 HydrophobicContact CZ-CE2 3.87Å; L71-Y75 HydrophobicContact CB-CD2 4.21Å; L71-Y75 HydrophobicContact CB-CE2 4.28Å; L71-Y75 WeakPolarHBondContact O-CD2 3.42Å; L71-Y75 PolarHBondContact O-N 2.95Å; P73-Y75 VanDerWaalsContact C-N 3.32Å; P73-Y75 PolarHBondContact O-N 3.16Å; Y75-Y78 PolarHBondContact O-N 3.47Å; Y75-L79 WeakPolarHBondContact O-CB 3.46Å; Y75-L79 VanDerWaalsContact O-CG 3.25Å; Y75-L79 WeakPolarHBondContact O-CG 3.42Å; Y75-L79 PolarHBondContact O-N 2.91Å; Y75-E125 HydrophobicContact CD2-CG 4.48Å; Y75-E125 HydrophobicContact CE2-CG 3.78Å; Y75-E125 PolarHBondContact OH-OE1 2.69Å; Y75-L129 HydrophobicContact CD1-CD1 4.36Å; Y75-L129 HydrophobicContact CD2-CD1 4.15Å; Y75-L129 HydrophobicContact CE1-CD1 4.39Å; Y75-L129 HydrophobicContact CE1-CD2 4.23Å; Y75-L129 HydrophobicContact CE2-CD1 4.19Å; Y75-L129 HydrophobicContact CG-CD1 4.23Å; Y75-V362 VanDerWaalsContact OH-CG2 3.29Å; Y75-V362 WeakPolarHBondContact OH-CG2 3.45Å; Y75-V362 PolarHBondContact OH-N 3.41Å; Y75-L372 HydrophobicContact CD1-CD2 3.83Å; Y75-L372 HydrophobicContact CG-CD2 4.01Å
76	S	91.9	Very high	86	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-68.3	-41.2	178	-57.7	0	0	0	0	112.2	S72 P73 A80 Y375 L376	S72-S76 VanDerWaalsContact O-CB 3.31Å; S72-S76 WeakPolarHBondContact O-CB 3.49Å; S72-S76 PolarHBondContact O-N 3.42Å; S72-S76 PolarHBondContact O-OG 3.32Å; P73-S76 PolarHBondContact O-N 3.21Å; P73-S76 VanDerWaalsContact O-N 3.1Å; S76-A80 WeakPolarHBondContact O-CB 3.39Å; S76-A80 PolarHBondContact O-N 2.86Å; S76-Y375 WeakPolarHBondContact OG-CE1 3.44Å; S76-L376 WeakPolarHBondContact OG-CD2 3.31Å
77	L	93.8	Very high	87.6	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-65.6	-40.6	174.2	-65.8	179.2	0	0	0	111.7	L52 V55 M56 P73 L81 F95 I99 F103 F126	L52-L77 HydrophobicContact CD1-CD2 3.58Å; V55-L77 HydrophobicContact CB-CD2 4.44Å; V55-L77 HydrophobicContact CG1-CD2 3.75Å; V55-L77 HydrophobicContact CG1-CG 3.86Å; M56-L77 HydrophobicContact CE-CD1 4.44Å; M56-L77 HydrophobicContact CG-CD1 4.12Å; M56-L77 HydrophobicContact CG-CD2 4.29Å; M56-L77 HydrophobicContact SD-CD1 4.03Å; P73-L77 WeakPolarHBondContact O-CG 3.03Å; P73-L77 PolarHBondContact O-N 3.28Å; L77-L81 VanDerWaalsContact O-CB 3.26Å; L77-L81 WeakPolarHBondContact O-CB 3.15Å; L77-L81 PolarHBondContact O-N 3.41Å; L77-F95 HydrophobicContact CD2-CZ 4.37Å; L77-I99 HydrophobicContact CB-CD1 4.17Å; L77-I99 HydrophobicContact CD1-CD1 4.46Å; L77-I99 HydrophobicContact CD1-CG1 4.39Å; L77-I99 HydrophobicContact CD1-CG2 4.15Å; L77-I99 HydrophobicContact CD2-CD1 4.07Å; L77-I99 HydrophobicContact CD2-CG1 4.14Å; L77-I99 HydrophobicContact CG-CD1 4.46Å; L77-F103 HydrophobicContact CD1-CE2 4.4Å; L77-F103 HydrophobicContact CD1-CZ 4.5Å; L77-F126 HydrophobicContact CB-CD2 3.85Å; L77-F126 HydrophobicContact CB-CE2 3.76Å
78	Y	92.6	Very high	88.8	Confident	6 Å²	6	28.1 Å²	28.1	2%	0.024	15%	0.145	C	C	.	.	H	α-helix	trans	-61.7	-49.8	174.3	169.8	-104.5	0	0	0	112.1	L35 L37 A74 Y75 A80 L81 R82 L129 D133 L136	L35-Y78 PolarHBondContact O-OH 2.58Å; L35-Y78 VanDerWaalsContact O-OH 3.07Å; L37-Y78 HydrophobicContact CD1-CD1 3.87Å; L37-Y78 HydrophobicContact CD1-CE1 3.78Å; L37-Y78 HydrophobicContact CG-CE1 4.24Å; A74-Y78 WeakPolarHBondContact O-CB 3.23Å; A74-Y78 PolarHBondContact O-N 3.45Å; Y75-Y78 PolarHBondContact O-N 3.47Å; Y78-A80 VanDerWaalsContact C-N 3.32Å; Y78-A80 PolarHBondContact O-N 3.48Å; Y78-L81 PolarHBondContact O-N 3.41Å; Y78-R82 VanDerWaalsContact O-CB 3.31Å; Y78-R82 WeakPolarHBondContact O-CB 3.31Å; Y78-R82 PolarHBondContact O-N 3.23Å; Y78-L129 HydrophobicContact CD1-CD1 4.45Å; Y78-L129 HydrophobicContact CD1-CD2 4.42Å; Y78-L129 HydrophobicContact CD2-CB 3.65Å; Y78-L129 HydrophobicContact CE2-CB 4.11Å; Y78-L129 HydrophobicContact CG-CB 3.9Å; Y78-L129 HydrophobicContact CG-CD1 4.1Å; Y78-L129 HydrophobicContact CG-CG 4.41Å; Y78-D133 HydrophobicContact CE2-CB 4Å; Y78-D133 PolarHBondContact OH-OD2 3.49Å; Y78-L136 HydrophobicContact CD2-CD1 3.99Å; Y78-L136 HydrophobicContact CE2-CD1 3.71Å
79	L	91.3	Very high	89.3	Confident	7 Å²	7	28.2 Å²	28.2	4%	0.037	14%	0.136	C	C	.	.	H	α-helix	trans	-62.8	-38.1	179.5	-70.7	169.3	0	0	0	111.9	L37 L39 I41 Y75 S83 L376	L37-L79 HydrophobicContact CD1-CD2 4.17Å; L39-L79 HydrophobicContact CB-CD1 4.01Å; L39-L79 HydrophobicContact CB-CD2 3.91Å; L39-L79 HydrophobicContact CD1-CD1 3.88Å; L39-L79 WeakPolarHBondContact O-CD2 3.31Å; I41-L79 HydrophobicContact CD1-CB 3.86Å; I41-L79 HydrophobicContact CG1-CB 3.96Å; I41-L79 HydrophobicContact CG2-CB 4.36Å; I41-L79 HydrophobicContact CG2-CD1 4.36Å; Y75-L79 WeakPolarHBondContact O-CB 3.46Å; Y75-L79 VanDerWaalsContact O-CG 3.25Å; Y75-L79 WeakPolarHBondContact O-CG 3.42Å; Y75-L79 PolarHBondContact O-N 2.91Å; L79-S83 WeakPolarHBondContact O-CB 3.16Å; L79-S83 PolarHBondContact O-N 3.02Å; L79-L376 HydrophobicContact CD1-CD1 3.99Å
80	A	91.6	Very high	89.2	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-63.1	-53.6	173.2	0	0	0	0	0	111.7	I41 I43 F51 S76 Y78 R82 S83 F84 F95	I41-A80 HydrophobicContact CD1-CB 4.11Å; I43-A80 HydrophobicContact CD1-CB 3.53Å; F51-A80 HydrophobicContact CE1-CB 3.73Å; F51-A80 HydrophobicContact CZ-CB 4.19Å; S76-A80 WeakPolarHBondContact O-CB 3.39Å; S76-A80 PolarHBondContact O-N 2.86Å; Y78-A80 VanDerWaalsContact C-N 3.32Å; Y78-A80 PolarHBondContact O-N 3.48Å; A80-R82 VanDerWaalsContact C-N 3.27Å; A80-R82 PolarHBondContact O-N 3.24Å; A80-S83 WeakPolarHBondContact O-CB 3.49Å; A80-S83 PolarHBondContact O-N 2.75Å; A80-S83 VanDerWaalsContact O-N 3.14Å; A80-F84 HydrophobicContact CB-CE2 4.13Å; A80-F84 WeakPolarHBondContact O-CD2 3.48Å; A80-F84 WeakPolarHBondContact O-CG 3.31Å; A80-F84 PolarHBondContact O-N 3.23Å; A80-F95 HydrophobicContact CB-CE1 3.59Å; A80-F95 HydrophobicContact CB-CZ 3.55Å
81	L	92.2	Very high	89.1	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-57.3	-40.7	178.8	179	67.4	0	0	0	111.8	L77 Y78 F84 H85 S92 F95 F96 F126 V130 L136 Y141	L77-L81 VanDerWaalsContact O-CB 3.26Å; L77-L81 WeakPolarHBondContact O-CB 3.15Å; L77-L81 PolarHBondContact O-N 3.41Å; Y78-L81 PolarHBondContact O-N 3.41Å; L81-F84 PolarHBondContact O-N 3.17Å; L81-H85 WeakPolarHBondContact O-CB 3.28Å; L81-H85 PolarHBondContact O-N 3.3Å; L81-S92 WeakPolarHBondContact CD1-O 3.4Å; L81-F95 HydrophobicContact CB-CD1 4.21Å; L81-F95 HydrophobicContact CB-CE1 4.28Å; L81-F95 HydrophobicContact CD1-CD1 4.23Å; L81-F96 HydrophobicContact CD1-CB 4.14Å; L81-F96 HydrophobicContact CD1-CD2 4.37Å; L81-F96 HydrophobicContact CD2-CD2 3.82Å; L81-F96 HydrophobicContact CD2-CE2 4.43Å; L81-F126 HydrophobicContact CD2-CE2 4.29Å; L81-F126 HydrophobicContact CD2-CZ 4.02Å; L81-V130 HydrophobicContact CD2-CG2 3.81Å; L81-L136 HydrophobicContact CD2-CD1 4.07Å; L81-L136 HydrophobicContact CG-CD1 4.34Å; L81-L136 HydrophobicContact CG-CD2 4.22Å; L81-Y141 HydrophobicContact CD1-CE1 4.23Å
82	R	89.8	Confident	89	Confident	52 Å²	52	31.2 Å²	31.2	20%	0.196	16%	0.159	C	C	.	.	H	α-helix	trans	-67	-42.2	177.5	-170.1	51.9	157.2	120.6	-14.4	112.1	Y78 A80 H85 T86 D133 E135	Y78-R82 VanDerWaalsContact O-CB 3.31Å; Y78-R82 WeakPolarHBondContact O-CB 3.31Å; Y78-R82 PolarHBondContact O-N 3.23Å; A80-R82 VanDerWaalsContact C-N 3.27Å; A80-R82 PolarHBondContact O-N 3.24Å; R82-H85 PolarHBondContact O-N 3.44Å; R82-T86 PolarHBondContact O-N 3.43Å; R82-T86 VanDerWaalsContact O-N 3.09Å; R82-T86 PolarHBondContact O-OG1 3.11Å; R82-D133 IonicContact CZ-OD1 3.52Å; R82-D133 IonicContact CZ-OD2 3.82Å; R82-D133 VanDerWaalsContact CZ-OD2 3.26Å; R82-D133 IonicContact NE-OD1 2.72Å; R82-D133 IonicContact NE-OD2 3.68Å; R82-D133 PolarHBondContact NE-OD2 2.85Å; R82-D133 IonicContact NH2-OD1 3.61Å; R82-D133 IonicContact NH2-OD2 3.66Å; R82-D133 PolarHBondContact NH2-OD2 3.23Å; R82-E135 IonicContact CZ-OE1 3.38Å; R82-E135 IonicContact CZ-OE2 3.61Å; R82-E135 IonicContact NH1-OE1 3.19Å; R82-E135 PolarHBondContact NH1-OE1 3.35Å; R82-E135 IonicContact NH1-OE2 2.81Å; R82-E135 PolarHBondContact NH1-OE2 3.44Å; R82-E135 IonicContact NH2-OE1 2.89Å; R82-E135 PolarHBondContact NH2-OE1 2.98Å; R82-E135 IonicContact NH2-OE2 3.73Å
83	S	87.7	Confident	89	Confident	19 Å²	19	35 Å²	35	13%	0.133	18%	0.182	C	C	.	.	H	α-helix	trans	-60.8	-45.7	174.6	-161.9	0	0	0	0	111.4	I41 L79 A80 T86 H87	I41-S83 VanDerWaalsContact O-CB 3.27Å; I41-S83 WeakPolarHBondContact O-CB 3.44Å; I41-S83 PolarHBondContact O-OG 3.29Å; L79-S83 WeakPolarHBondContact O-CB 3.16Å; L79-S83 PolarHBondContact O-N 3.02Å; A80-S83 WeakPolarHBondContact O-CB 3.49Å; A80-S83 PolarHBondContact O-N 2.75Å; A80-S83 VanDerWaalsContact O-N 3.14Å; S83-T86 PolarHBondContact O-N 3.28Å; S83-H87 PolarHBondContact O-N 3.46Å; S83-H87 PolarHBondContact O-ND1 3.03Å
84	F	88.8	Confident	88.8	Confident	15 Å²	15	40.5 Å²	40.5	7%	0.066	21%	0.207	C	C	.	.	H	α-helix	trans	-66.9	-35	174.1	-59.4	-47.4	0	0	0	112.7	I43 V48 A80 L81 T86 H87 N88 Y91 F95	I43-F84 HydrophobicContact CB-CE1 4.47Å; I43-F84 HydrophobicContact CB-CZ 4.07Å; I43-F84 HydrophobicContact CD1-CE2 4.28Å; I43-F84 HydrophobicContact CD1-CZ 3.96Å; I43-F84 HydrophobicContact CG2-CZ 4.34Å; V48-F84 HydrophobicContact CB-CZ 4.27Å; V48-F84 HydrophobicContact CG1-CE2 3.76Å; V48-F84 HydrophobicContact CG1-CZ 3.53Å; V48-F84 HydrophobicContact CG2-CE1 4.11Å; V48-F84 HydrophobicContact CG2-CZ 3.74Å; A80-F84 HydrophobicContact CB-CE2 4.13Å; A80-F84 WeakPolarHBondContact O-CD2 3.48Å; A80-F84 WeakPolarHBondContact O-CG 3.31Å; A80-F84 PolarHBondContact O-N 3.23Å; L81-F84 PolarHBondContact O-N 3.17Å; F84-T86 VanDerWaalsContact C-N 3.32Å; F84-T86 PolarHBondContact O-N 2.88Å; F84-H87 PolarHBondContact O-N 3.05Å; F84-N88 CarbonylContact O-C 3.58Å; F84-N88 WeakPolarHBondContact O-CA 3.47Å; F84-N88 PolarHBondContact O-N 2.89Å; F84-N88 VanDerWaalsContact O-O 3.05Å; F84-Y91 AromaticContact CD1-CD1 3.81Å; F84-Y91 HydrophobicContact CD1-CD1 3.81Å; F84-Y91 HydrophobicContact CD1-CE1 4.08Å; F84-Y91 HydrophobicContact CD2-CD1 4.45Å; F84-Y91 HydrophobicContact CE1-CD1 4.12Å; F84-Y91 AromaticContact CE1-CE1 3.9Å; F84-Y91 HydrophobicContact CE1-CE1 3.9Å; F84-Y91 HydrophobicContact CE2-CE1 4.38Å; F84-Y91 HydrophobicContact CG-CD1 4.02Å; F84-Y91 HydrophobicContact CG-CE1 4.43Å; F84-Y91 HydrophobicContact CZ-CE1 4.07Å; F84-F95 HydrophobicContact CD2-CB 4.25Å; F84-F95 AromaticContact CD2-CD1 3.83Å; F84-F95 HydrophobicContact CD2-CD1 3.83Å; F84-F95 HydrophobicContact CD2-CD2 4.2Å; F84-F95 HydrophobicContact CD2-CE1 4.19Å; F84-F95 AromaticContact CD2-CG 3.84Å; F84-F95 HydrophobicContact CD2-CG 3.84Å; F84-F95 HydrophobicContact CE2-CD1 4.05Å; F84-F95 AromaticContact CE2-CD2 3.78Å; F84-F95 HydrophobicContact CE2-CD2 3.78Å; F84-F95 HydrophobicContact CE2-CE1 4.08Å; F84-F95 AromaticContact CE2-CE2 3.83Å; F84-F95 HydrophobicContact CE2-CE2 3.83Å; F84-F95 AromaticContact CE2-CG 3.9Å; F84-F95 HydrophobicContact CE2-CG 3.9Å; F84-F95 AromaticContact CE2-CZ 3.98Å; F84-F95 HydrophobicContact CE2-CZ 3.98Å
85	H	87.9	Confident	88.8	Confident	5 Å²	5	40.5 Å²	40.5	2%	0.023	21%	0.207	C	C	.	.	H	α-helix	trans	-64.1	-37.8	176.7	-169.3	72.7	0	0	0	112.5	L81 R82 K89 E135 L136 S139 Y141	L81-H85 WeakPolarHBondContact O-CB 3.28Å; L81-H85 PolarHBondContact O-N 3.3Å; R82-H85 PolarHBondContact O-N 3.44Å; H85-K89 PolarHBondContact CE1-NZ 3Å; H85-K89 WeakPolarHBondContact NE2-CE 3.45Å; H85-K89 PolarHBondContact NE2-NZ 3.25Å; H85-K89 VanDerWaalsContact O-CE 3.3Å; H85-K89 WeakPolarHBondContact O-CE 3.48Å; H85-K89 WeakPolarHBondContact O-CG 3.44Å; H85-E135 IonicContact CD2-OE2 3.91Å; H85-L136 HydrophobicContact CB-CD2 3.56Å; H85-S139 PolarHBondContact CE1-OG 3.06Å; H85-Y141 PolarHBondContact ND1-OH 3.28Å
86	T	86.8	Confident	88.9	Confident	83 Å²	83	40.5 Å²	40.5	51%	0.509	21%	0.207	S	C	.	.	H	α-helix	trans	-70.2	-38.6	177.9	-58.3	0	0	0	0	112.3	R82 S83 F84	R82-T86 PolarHBondContact O-N 3.43Å; R82-T86 VanDerWaalsContact O-N 3.09Å; R82-T86 PolarHBondContact O-OG1 3.11Å; S83-T86 PolarHBondContact O-N 3.28Å; F84-T86 VanDerWaalsContact C-N 3.32Å; F84-T86 PolarHBondContact O-N 2.88Å
87	H	83.4	Confident	88.9	Confident	144 Å²	144	43.4 Å²	43.4	67%	0.667	23%	0.228	S	C	*	.	H	α-helix	trans	-104.4	-29.7	-170.4	-57.2	95.8	0	0	0	115.2	S83 F84	S83-H87 PolarHBondContact O-N 3.46Å; S83-H87 PolarHBondContact O-ND1 3.03Å; F84-H87 PolarHBondContact O-N 3.05Å
88	N	84.2	Confident	88.9	Confident	71 Å²	71	49.3 Å²	49.3	38%	0.38	25%	0.25	S	C	.	.			trans	-153.3	78.9	-173.6	-170.5	-14.4	0	0	0	111.9	F84 P90 Y91 S92	F84-N88 CarbonylContact O-C 3.58Å; F84-N88 WeakPolarHBondContact O-CA 3.47Å; F84-N88 PolarHBondContact O-N 2.89Å; F84-N88 VanDerWaalsContact O-O 3.05Å; N88-P90 WeakPolarHBondContact OD1-CD 3.2Å; N88-Y91 WeakPolarHBondContact O-CB 3.29Å; N88-Y91 PolarHBondContact O-N 3.44Å; N88-Y91 VanDerWaalsContact O-N 3.08Å; N88-Y91 WeakPolarHBondContact OD1-CB 3.12Å; N88-Y91 PolarHBondContact OD1-N 2.83Å; N88-S92 PolarHBondContact O-N 2.92Å; N88-S92 VanDerWaalsContact O-N 3.08Å
89	K	81.9	Confident	89	Confident	116 Å²	116	49 Å²	49	50%	0.504	25%	0.249	S	C	.	.	H	α-helix	trans	-55.9	-43.9	-175.3	-65	-170.3	-174.1	-143.6	0	114.8	H85 Y91 S92 V93	H85-K89 PolarHBondContact CE1-NZ 3Å; H85-K89 WeakPolarHBondContact NE2-CE 3.45Å; H85-K89 PolarHBondContact NE2-NZ 3.25Å; H85-K89 VanDerWaalsContact O-CE 3.3Å; H85-K89 WeakPolarHBondContact O-CE 3.48Å; H85-K89 WeakPolarHBondContact O-CG 3.44Å; K89-Y91 PolarHBondContact O-N 3.44Å; K89-S92 PolarHBondContact O-N 3.22Å; K89-S92 PolarHBondContact O-OG 3.31Å; K89-V93 PolarHBondContact O-N 3.42Å
90	P	84.3	Confident	89.2	Confident	96 Å²	96	51 Å²	51	62%	0.623	26%	0.258	S	S	*	.	H	α-helix	trans	-56.9	-39.2	175.2	-26.1	35.4	0	0	0	113	N88 V93 Q94	N88-P90 WeakPolarHBondContact OD1-CD 3.2Å; P90-V93 PolarHBondContact O-N 3.29Å; P90-Q94 PolarHBondContact O-N 3.36Å
91	Y	84.9	Confident	89.3	Confident	34 Å²	34	53.4 Å²	53.4	13%	0.133	27%	0.274	C	S	.	.	H	α-helix	trans	-72.2	-34.3	180	-166.2	-112.4	0	0	0	112.8	V48 W49 F84 N88 K89 V93 Q94 F95	V48-Y91 HydrophobicContact CB-CE1 4.28Å; V48-Y91 WeakPolarHBondContact CB-OH 3.3Å; V48-Y91 HydrophobicContact CG1-CE1 3.87Å; V48-Y91 WeakPolarHBondContact CG1-OH 3.39Å; V48-Y91 HydrophobicContact CG2-CE1 3.93Å; V48-Y91 WeakPolarHBondContact CG2-OH 3.45Å; W49-Y91 HydrophobicContact CH2-CE2 4.48Å; W49-Y91 AromaticContact CZ2-CE2 3.89Å; W49-Y91 HydrophobicContact CZ2-CE2 3.89Å; F84-Y91 AromaticContact CD1-CD1 3.81Å; F84-Y91 HydrophobicContact CD1-CD1 3.81Å; F84-Y91 HydrophobicContact CD1-CE1 4.08Å; F84-Y91 HydrophobicContact CD2-CD1 4.45Å; F84-Y91 HydrophobicContact CE1-CD1 4.12Å; F84-Y91 AromaticContact CE1-CE1 3.9Å; F84-Y91 HydrophobicContact CE1-CE1 3.9Å; F84-Y91 HydrophobicContact CE2-CE1 4.38Å; F84-Y91 HydrophobicContact CG-CD1 4.02Å; F84-Y91 HydrophobicContact CG-CE1 4.43Å; F84-Y91 HydrophobicContact CZ-CE1 4.07Å; N88-Y91 WeakPolarHBondContact O-CB 3.29Å; N88-Y91 PolarHBondContact O-N 3.44Å; N88-Y91 VanDerWaalsContact O-N 3.08Å; N88-Y91 WeakPolarHBondContact OD1-CB 3.12Å; N88-Y91 PolarHBondContact OD1-N 2.83Å; K89-Y91 PolarHBondContact O-N 3.44Å; Y91-V93 PolarHBondContact O-N 3.42Å; Y91-Q94 PolarHBondContact O-N 2.83Å; Y91-Q94 VanDerWaalsContact O-N 3.15Å; Y91-F95 WeakPolarHBondContact O-CB 3.39Å; Y91-F95 PolarHBondContact O-N 2.98Å
92	S	89.3	Confident	89.4	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-59.5	-32	173.8	71.9	0	0	0	0	113.3	L81 N88 K89 F96 Y141	L81-S92 WeakPolarHBondContact CD1-O 3.4Å; N88-S92 PolarHBondContact O-N 2.92Å; N88-S92 VanDerWaalsContact O-N 3.08Å; K89-S92 PolarHBondContact O-N 3.22Å; K89-S92 PolarHBondContact O-OG 3.31Å; S92-F96 WeakPolarHBondContact O-CB 3.22Å; S92-F96 PolarHBondContact O-N 2.94Å; S92-Y141 PolarHBondContact OG-OH 3.34Å
93	V	89.2	Confident	89.7	Confident	81 Å²	81	52.3 Å²	52.3	49%	0.491	27%	0.272	S	S	.	.	H	α-helix	trans	-71.2	-42.2	175.1	-179.8	0	0	0	0	111.5	K89 P90 Y91 F96 S97 Y141	K89-V93 PolarHBondContact O-N 3.42Å; P90-V93 PolarHBondContact O-N 3.29Å; Y91-V93 PolarHBondContact O-N 3.42Å; V93-F96 PolarHBondContact O-N 3.34Å; V93-S97 PolarHBondContact O-N 2.93Å; V93-Y141 HydrophobicContact CG2-CD1 4.34Å; V93-Y141 HydrophobicContact CG2-CE1 3.97Å
94	Q	89.6	Confident	90	Very high	116 Å²	116	55.7 Å²	55.7	54%	0.542	29%	0.285	S	S	.	.	H	α-helix	trans	-63.3	-43.9	175.3	-65.3	179.9	-6.3	0	0	111.4	P90 Y91 S97 R98	P90-Q94 PolarHBondContact O-N 3.36Å; Y91-Q94 PolarHBondContact O-N 2.83Å; Y91-Q94 VanDerWaalsContact O-N 3.15Å; Q94-S97 PolarHBondContact O-N 2.97Å; Q94-R98 PolarHBondContact O-N 3.38Å
95	F	92.3	Very high	90.2	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-60.1	-46.5	175.9	-171.9	-107.8	0	0	0	111.6	V48 W49 F51 L52 L77 A80 L81 F84 Y91 R98 I99	V48-F95 HydrophobicContact CG1-CD2 3.72Å; V48-F95 HydrophobicContact CG1-CE2 3.75Å; W49-F95 HydrophobicContact CZ3-CD2 4.28Å; F51-F95 HydrophobicContact CE1-CZ 4.49Å; L52-F95 HydrophobicContact CB-CE2 4.14Å; L52-F95 HydrophobicContact CD1-CE2 4.16Å; L52-F95 HydrophobicContact CD1-CZ 4.27Å; L52-F95 HydrophobicContact CD2-CE2 4.38Å; L52-F95 HydrophobicContact CG-CE2 4.47Å; L77-F95 HydrophobicContact CD2-CZ 4.37Å; A80-F95 HydrophobicContact CB-CE1 3.59Å; A80-F95 HydrophobicContact CB-CZ 3.55Å; L81-F95 HydrophobicContact CB-CD1 4.21Å; L81-F95 HydrophobicContact CB-CE1 4.28Å; L81-F95 HydrophobicContact CD1-CD1 4.23Å; F84-F95 HydrophobicContact CD2-CB 4.25Å; F84-F95 AromaticContact CD2-CD1 3.83Å; F84-F95 HydrophobicContact CD2-CD1 3.83Å; F84-F95 HydrophobicContact CD2-CD2 4.2Å; F84-F95 HydrophobicContact CD2-CE1 4.19Å; F84-F95 AromaticContact CD2-CG 3.84Å; F84-F95 HydrophobicContact CD2-CG 3.84Å; F84-F95 HydrophobicContact CE2-CD1 4.05Å; F84-F95 AromaticContact CE2-CD2 3.78Å; F84-F95 HydrophobicContact CE2-CD2 3.78Å; F84-F95 HydrophobicContact CE2-CE1 4.08Å; F84-F95 AromaticContact CE2-CE2 3.83Å; F84-F95 HydrophobicContact CE2-CE2 3.83Å; F84-F95 AromaticContact CE2-CG 3.9Å; F84-F95 HydrophobicContact CE2-CG 3.9Å; F84-F95 AromaticContact CE2-CZ 3.98Å; F84-F95 HydrophobicContact CE2-CZ 3.98Å; Y91-F95 WeakPolarHBondContact O-CB 3.39Å; Y91-F95 PolarHBondContact O-N 2.98Å; F95-R98 PolarHBondContact O-N 2.89Å; F95-I99 HydrophobicContact CD1-CD1 3.73Å; F95-I99 HydrophobicContact CE1-CD1 3.54Å; F95-I99 HydrophobicContact CE1-CG1 4.49Å; F95-I99 HydrophobicContact CZ-CD1 4.17Å; F95-I99 WeakPolarHBondContact O-CG1 3.33Å; F95-I99 PolarHBondContact O-N 3.42Å
96	F	94	Very high	90.5	Very high	6 Å²	6	59.1 Å²	59.1	3%	0.026	30%	0.301	C	S	.	.	H	α-helix	trans	-59.8	-48	175.1	-170.2	-79.4	0	0	0	112.5	L81 S92 V93 R98 I99 E100 F126 V130 Y141 G142 I144	L81-F96 HydrophobicContact CD1-CB 4.14Å; L81-F96 HydrophobicContact CD1-CD2 4.37Å; L81-F96 HydrophobicContact CD2-CD2 3.82Å; L81-F96 HydrophobicContact CD2-CE2 4.43Å; S92-F96 WeakPolarHBondContact O-CB 3.22Å; S92-F96 PolarHBondContact O-N 2.94Å; V93-F96 PolarHBondContact O-N 3.34Å; F96-R98 PolarHBondContact O-N 2.82Å; F96-I99 WeakPolarHBondContact O-CB 3.39Å; F96-I99 PolarHBondContact O-N 2.66Å; F96-E100 PolarHBondContact O-N 3.12Å; F96-F126 HydrophobicContact CD2-CE1 4.41Å; F96-F126 HydrophobicContact CD2-CZ 4.22Å; F96-F126 AromaticContact CE2-CE1 3.87Å; F96-F126 HydrophobicContact CE2-CE1 3.87Å; F96-F126 HydrophobicContact CE2-CZ 4.06Å; F96-F126 HydrophobicContact CZ-CE1 4.49Å; F96-V130 HydrophobicContact CE2-CG1 4.34Å; F96-Y141 HydrophobicContact CB-CD1 3.84Å; F96-Y141 HydrophobicContact CB-CE1 4.33Å; F96-Y141 HydrophobicContact CB-CG 4.42Å; F96-Y141 HydrophobicContact CD2-CD1 4.12Å; F96-Y141 HydrophobicContact CD2-CD2 4.36Å; F96-Y141 AromaticContact CD2-CG 3.85Å; F96-Y141 HydrophobicContact CD2-CG 3.85Å; F96-Y141 HydrophobicContact CE2-CG 4.26Å; F96-Y141 AromaticContact CG-CD1 3.9Å; F96-Y141 HydrophobicContact CG-CD1 3.9Å; F96-Y141 AromaticContact CG-CG 4Å; F96-Y141 HydrophobicContact CG-CG 4Å; F96-G142 WeakPolarHBondContact CE1-O 3.27Å; F96-G142 WeakPolarHBondContact CZ-O 3.33Å; F96-I144 HydrophobicContact CZ-CB 4.36Å
97	S	92.4	Very high	90.8	Very high	61 Å²	61	55.5 Å²	55.5	43%	0.427	28%	0.28	S	S	.	.	H	α-helix	trans	-62.6	-31.7	179.6	-174.7	0	0	0	0	112.3	V93 Q94 S101	V93-S97 PolarHBondContact O-N 2.93Å; Q94-S97 PolarHBondContact O-N 2.97Å; S97-S101 WeakPolarHBondContact O-CB 3.3Å; S97-S101 PolarHBondContact O-N 3.19Å; S97-S101 PolarHBondContact O-OG 3.33Å
98	R	93.2	Very high	91.2	Very high	123 Å²	123	54.2 Å²	54.2	46%	0.464	27%	0.274	S	S	.	.	H	α-helix	trans	-72.8	-35.7	172.9	-160.8	67.2	176.1	117.6	1.8	112.3	W49 L52 Q94 F95 F96 S101 N102	W49-R98 HydrophobicContact CE3-CG 4.31Å; W49-R98 HydrophobicContact CZ3-CB 3.86Å; W49-R98 HydrophobicContact CZ3-CG 3.93Å; L52-R98 HydrophobicContact CD2-CB 3.8Å; L52-R98 HydrophobicContact CD2-CG 3.49Å; L52-R98 VanDerWaalsContact CD2-CG 3.49Å; Q94-R98 PolarHBondContact O-N 3.38Å; F95-R98 PolarHBondContact O-N 2.89Å; F96-R98 PolarHBondContact O-N 2.82Å; R98-S101 PolarHBondContact O-N 3.17Å; R98-N102 PolarHBondContact O-N 3.36Å; R98-N102 VanDerWaalsContact O-N 3.08Å; R98-N102 PolarHBondContact O-ND2 3.26Å
99	I	95.2	Very high	91.6	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-60.9	-51	170.9	-69.8	164.1	0	0	0	110.6	L52 M56 L77 F95 F96 S101 N102 F103 F126 I144	L52-I99 HydrophobicContact CD1-CG1 3.65Å; M56-I99 HydrophobicContact SD-CB 4.48Å; M56-I99 HydrophobicContact SD-CG1 4.34Å; M56-I99 HydrophobicContact SD-CG2 4.32Å; L77-I99 HydrophobicContact CB-CD1 4.17Å; L77-I99 HydrophobicContact CD1-CD1 4.46Å; L77-I99 HydrophobicContact CD1-CG1 4.39Å; L77-I99 HydrophobicContact CD1-CG2 4.15Å; L77-I99 HydrophobicContact CD2-CD1 4.07Å; L77-I99 HydrophobicContact CD2-CG1 4.14Å; L77-I99 HydrophobicContact CG-CD1 4.46Å; F95-I99 HydrophobicContact CD1-CD1 3.73Å; F95-I99 HydrophobicContact CE1-CD1 3.54Å; F95-I99 HydrophobicContact CE1-CG1 4.49Å; F95-I99 HydrophobicContact CZ-CD1 4.17Å; F95-I99 WeakPolarHBondContact O-CG1 3.33Å; F95-I99 PolarHBondContact O-N 3.42Å; F96-I99 WeakPolarHBondContact O-CB 3.39Å; F96-I99 PolarHBondContact O-N 2.66Å; I99-S101 VanDerWaalsContact C-N 3.29Å; I99-S101 PolarHBondContact O-N 2.81Å; I99-N102 PolarHBondContact O-N 3.03Å; I99-N102 VanDerWaalsContact O-N 3.07Å; I99-F103 HydrophobicContact CG2-CD2 3.64Å; I99-F103 HydrophobicContact CG2-CE2 3.46Å; I99-F103 VanDerWaalsContact CG2-CE2 3.46Å; I99-F103 WeakPolarHBondContact O-CD2 3.22Å; I99-F103 PolarHBondContact O-N 3.27Å; I99-F126 HydrophobicContact CD1-CE2 4.36Å; I99-F126 HydrophobicContact CD1-CZ 3.94Å; I99-F126 HydrophobicContact CG2-CD1 4.44Å; I99-F126 HydrophobicContact CG2-CE1 3.88Å; I99-F126 HydrophobicContact CG2-CZ 4.15Å; I99-I144 HydrophobicContact CG2-CD1 4.06Å
100	E	94.5	Very high	92	Very high	49 Å²	49	52.1 Å²	52.1	23%	0.229	27%	0.266	C	S	.	.	H	α-helix	trans	-54.7	-44.2	175.9	-177.5	177.5	-167.5	0	0	111.6	F96 N102 F103 K104 I144 E147	F96-E100 PolarHBondContact O-N 3.12Å; E100-N102 PolarHBondContact O-N 3.21Å; E100-F103 PolarHBondContact O-N 3.33Å; E100-K104 WeakPolarHBondContact O-CB 3.46Å; E100-K104 PolarHBondContact O-N 3.16Å; E100-I144 HydrophobicContact CB-CD1 4.48Å; E100-E147 HydrophobicContact CG-CG 4.16Å
101	S	93.7	Very high	92.3	Very high	50 Å²	50	51.8 Å²	51.8	35%	0.35	27%	0.265	S	S	.	.	H	α-helix	trans	-61.4	-38.2	175.9	-60.4	0	0	0	0	113.6	S97 R98 I99 Q105	S97-S101 WeakPolarHBondContact O-CB 3.3Å; S97-S101 PolarHBondContact O-N 3.19Å; S97-S101 PolarHBondContact O-OG 3.33Å; R98-S101 PolarHBondContact O-N 3.17Å; I99-S101 VanDerWaalsContact C-N 3.29Å; I99-S101 PolarHBondContact O-N 2.81Å; S101-Q105 PolarHBondContact O-N 2.88Å
102	N	94.4	Very high	92.6	Very high	29 Å²	29	52 Å²	52	16%	0.155	27%	0.272	C	S	.	.	H	α-helix	trans	-71.7	-41.4	177.5	-80.5	-83.6	0	0	0	111.6	M56 R98 I99 E100 K104 Q105 I106	M56-N102 HydrophobicContact CE-CB 3.49Å; M56-N102 VanDerWaalsContact CE-CB 3.49Å; M56-N102 HydrophobicContact SD-CB 3.54Å; M56-N102 VanDerWaalsContact SD-CB 3.54Å; R98-N102 PolarHBondContact O-N 3.36Å; R98-N102 VanDerWaalsContact O-N 3.08Å; R98-N102 PolarHBondContact O-ND2 3.26Å; I99-N102 PolarHBondContact O-N 3.03Å; I99-N102 VanDerWaalsContact O-N 3.07Å; E100-N102 PolarHBondContact O-N 3.21Å; N102-K104 VanDerWaalsContact C-N 3.32Å; N102-K104 PolarHBondContact O-N 2.94Å; N102-Q105 WeakPolarHBondContact O-CB 3.46Å; N102-Q105 PolarHBondContact O-N 3.24Å; N102-Q105 VanDerWaalsContact O-N 3.16Å; N102-I106 WeakPolarHBondContact O-CG1 3.36Å; N102-I106 PolarHBondContact O-N 3.21Å
103	F	95.3	Very high	92.8	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-64.1	-37.2	174.7	-77.2	-64.9	0	0	0	112.4	M56 L77 I99 E100 I106 A107 W119 A123 F126 I144 E147 I151	M56-F103 HydrophobicContact CE-CD1 4.06Å; M56-F103 HydrophobicContact CE-CD2 3.68Å; M56-F103 HydrophobicContact CE-CE1 3.96Å; M56-F103 HydrophobicContact CE-CE2 3.63Å; M56-F103 HydrophobicContact CE-CG 3.94Å; M56-F103 HydrophobicContact CE-CZ 3.77Å; L77-F103 HydrophobicContact CD1-CE2 4.4Å; L77-F103 HydrophobicContact CD1-CZ 4.5Å; I99-F103 HydrophobicContact CG2-CD2 3.64Å; I99-F103 HydrophobicContact CG2-CE2 3.46Å; I99-F103 VanDerWaalsContact CG2-CE2 3.46Å; I99-F103 WeakPolarHBondContact O-CD2 3.22Å; I99-F103 PolarHBondContact O-N 3.27Å; E100-F103 PolarHBondContact O-N 3.33Å; F103-I106 HydrophobicContact CD1-CD1 4.22Å; F103-I106 PolarHBondContact O-N 2.69Å; F103-A107 PolarHBondContact O-N 3.48Å; F103-W119 AromaticContact CE1-CE3 3.96Å; F103-W119 HydrophobicContact CE1-CE3 3.96Å; F103-A123 HydrophobicContact CD1-CB 3.78Å; F103-A123 HydrophobicContact CE1-CB 3.5Å; F103-A123 HydrophobicContact CE2-CB 4.5Å; F103-A123 HydrophobicContact CG-CB 4.4Å; F103-A123 HydrophobicContact CZ-CB 3.88Å; F103-F126 HydrophobicContact CE2-CD1 4.5Å; F103-I144 HydrophobicContact CD2-CD1 3.53Å; F103-I144 HydrophobicContact CD2-CG1 4.4Å; F103-I144 HydrophobicContact CE2-CD1 3.97Å; F103-I144 HydrophobicContact CG-CD1 4.42Å; F103-E147 HydrophobicContact CB-CB 4.13Å; F103-I151 HydrophobicContact CB-CD1 4.24Å; F103-I151 HydrophobicContact CD1-CD1 3.78Å; F103-I151 HydrophobicContact CG-CD1 4.43Å
104	K	94.5	Very high	93	Very high	91 Å²	91	52.9 Å²	52.9	40%	0.396	27%	0.272	S	S	.	.	H	α-helix	trans	-59.7	-44.9	169.7	-178	-179.8	173.8	-171.8	0	112.1	E100 N102 A107 Q108 E147	E100-K104 WeakPolarHBondContact O-CB 3.46Å; E100-K104 PolarHBondContact O-N 3.16Å; N102-K104 VanDerWaalsContact C-N 3.32Å; N102-K104 PolarHBondContact O-N 2.94Å; K104-A107 PolarHBondContact O-N 2.84Å; K104-Q108 WeakPolarHBondContact O-CG 3.45Å; K104-Q108 PolarHBondContact O-N 3.03Å; K104-E147 WeakPolarHBondContact CA-OE2 3.33Å; K104-E147 HydrophobicContact CB-CG 4.32Å; K104-E147 WeakPolarHBondContact CB-OE2 3.33Å
105	Q	93.9	Very high	93.1	Very high	74 Å²	74	48.4 Å²	48.4	35%	0.346	25%	0.252	S	S	.	.	H	α-helix	trans	-62.2	-45.6	176.8	-172.8	177.5	-12.2	0	0	111.4	S101 N102 A107 Q108 E109	S101-Q105 PolarHBondContact O-N 2.88Å; N102-Q105 WeakPolarHBondContact O-CB 3.46Å; N102-Q105 PolarHBondContact O-N 3.24Å; N102-Q105 VanDerWaalsContact O-N 3.16Å; Q105-A107 VanDerWaalsContact C-N 3.3Å; Q105-A107 PolarHBondContact O-N 3.39Å; Q105-Q108 PolarHBondContact O-N 3.42Å; Q105-E109 HydrophobicContact CG-CG 4.17Å; Q105-E109 WeakPolarHBondContact CG-OE1 3.5Å; Q105-E109 WeakPolarHBondContact CG-OE2 3.39Å; Q105-E109 PolarHBondContact NE2-OE1 3.18Å; Q105-E109 PolarHBondContact NE2-OE2 3.09Å; Q105-E109 PolarHBondContact O-N 3.46Å
106	I	93.2	Very high	93.3	Very high	17 Å²	17	48.4 Å²	48.4	9%	0.087	25%	0.252	C	S	.	.	H	α-helix	trans	-55.8	-43.8	174.4	-70.2	159.3	0	0	0	111.1	M56 N102 F103 Q108 C110 W119	M56-I106 HydrophobicContact CE-CD1 4.26Å; N102-I106 WeakPolarHBondContact O-CG1 3.36Å; N102-I106 PolarHBondContact O-N 3.21Å; F103-I106 HydrophobicContact CD1-CD1 4.22Å; F103-I106 PolarHBondContact O-N 2.69Å; I106-Q108 PolarHBondContact O-N 3.06Å; I106-C110 HydrophobicContact CG2-CB 4.33Å; I106-C110 WeakPolarHBondContact O-CB 3.17Å; I106-C110 PolarHBondContact O-N 3.01Å; I106-C110 VanDerWaalsContact O-N 3.11Å; I106-W119 HydrophobicContact CD1-CD2 3.75Å; I106-W119 HydrophobicContact CD1-CE3 4.26Å; I106-W119 HydrophobicContact CD1-CG 3.86Å; I106-W119 HydrophobicContact CG1-CG 4.49Å; I106-W119 HydrophobicContact CG2-CB 3.83Å; I106-W119 HydrophobicContact CG2-CG 3.82Å
107	A	93.5	Very high	93.3	Very high	8 Å²	8	48.1 Å²	48.1	7%	0.066	25%	0.25	C	S	.	.	H	α-helix	trans	-66.2	-22	178	0	0	0	0	0	114.4	F103 K104 Q105 R150 I151 R154	F103-A107 PolarHBondContact O-N 3.48Å; K104-A107 PolarHBondContact O-N 2.84Å; Q105-A107 VanDerWaalsContact C-N 3.3Å; Q105-A107 PolarHBondContact O-N 3.39Å; A107-R150 HydrophobicContact CB-CB 3.75Å; A107-I151 HydrophobicContact CB-CG1 3.78Å; A107-R154 WeakPolarHBondContact O-CG 3.46Å
108	Q	92.8	Very high	93.4	Very high	116 Å²	116	45.2 Å²	45.2	54%	0.542	23%	0.23	S	C	.	.	H	α-helix	trans	-96.2	-45.7	-178.2	-69.6	180	-46.8	0	0	112.2	K104 Q105 I106 R154	K104-Q108 WeakPolarHBondContact O-CG 3.45Å; K104-Q108 PolarHBondContact O-N 3.03Å; Q105-Q108 PolarHBondContact O-N 3.42Å; I106-Q108 PolarHBondContact O-N 3.06Å; Q108-R154 PolarHBondContact O-NH2 2.91Å; Q108-R154 VanDerWaalsContact O-NH2 3.13Å
109	E	90.9	Very high	93.5	Very high	130 Å²	130	39.4 Å²	39.4	61%	0.607	21%	0.208	S	C	*	.	H	α-helix	trans	-93.2	-33.6	-170.4	-65.8	176.4	-174.8	0	0	113.2	Q105	Q105-E109 HydrophobicContact CG-CG 4.17Å; Q105-E109 WeakPolarHBondContact CG-OE1 3.5Å; Q105-E109 WeakPolarHBondContact CG-OE2 3.39Å; Q105-E109 PolarHBondContact NE2-OE1 3.18Å; Q105-E109 PolarHBondContact NE2-OE2 3.09Å; Q105-E109 PolarHBondContact O-N 3.46Å
110	C	90.4	Very high	93.6	Very high	14 Å²	14	39.4 Å²	39.4	10%	0.095	21%	0.208	C	C	.	.			trans	-69.4	137.9	-173.7	-165.5	0	0	0	0	112.1	I106 L116 R154	I106-C110 HydrophobicContact CG2-CB 4.33Å; I106-C110 WeakPolarHBondContact O-CB 3.17Å; I106-C110 PolarHBondContact O-N 3.01Å; I106-C110 VanDerWaalsContact O-N 3.11Å; C110-L116 HydrophobicContact CB-CD2 3.94Å; C110-L116 HydrophobicContact CB-CG 4.12Å; C110-R154 VanDerWaalsContact O-CZ 3.28Å; C110-R154 PolarHBondContact O-NE 3.05Å; C110-R154 PolarHBondContact O-NH2 3.17Å
111	S	90.6	Very high	93.6	Very high	88 Å²	88	37 Å²	37	62%	0.615	20%	0.197	S	C	*	.			trans	-121.9	-9.9	179	55.7	0	0	0	0	113.4	V158	S111-V158 WeakPolarHBondContact O-CG1 3.22Å
112	S	92.8	Very high	93.6	Very high	39 Å²	39	34.7 Å²	34.7	27%	0.273	18%	0.181	S	C	.	.			trans	-82	123.5	-179.9	166.7	0	0	0	0	110.3	D114 D115 L116	S112-D114 PolarHBondContact O-N 2.85Å; S112-D115 WeakPolarHBondContact CB-OD2 3.27Å; S112-D115 VanDerWaalsContact OG-CG 3.31Å; S112-D115 PolarHBondContact OG-N 2.65Å; S112-D115 PolarHBondContact OG-OD2 3.43Å; S112-L116 WeakPolarHBondContact O-CB 3.32Å; S112-L116 WeakPolarHBondContact O-CD1 3.3Å; S112-L116 VanDerWaalsContact O-CG 3.29Å; S112-L116 WeakPolarHBondContact O-CG 3.47Å; S112-L116 PolarHBondContact O-N 3.22Å
113	K	93.3	Very high	93.6	Very high	39 Å²	39	33.4 Å²	33.4	17%	0.17	17%	0.174	C	C	.	.	H	α-helix	trans	-60.3	-37.3	178.1	75.7	172.9	-167.5	167.1	0	111.6	L116 I117 L155 V158 L159 T190 T191	K113-L116 PolarHBondContact O-N 2.85Å; K113-I117 WeakPolarHBondContact O-CB 3.4Å; K113-I117 WeakPolarHBondContact O-CD1 3.45Å; K113-I117 WeakPolarHBondContact O-CG1 3.41Å; K113-I117 PolarHBondContact O-N 3.11Å; K113-L155 HydrophobicContact CB-CD1 4.1Å; K113-V158 HydrophobicContact CB-CG1 4.2Å; K113-L159 HydrophobicContact CB-CD2 4.1Å; K113-L159 HydrophobicContact CD-CD2 3.84Å; K113-T190 PolarHBondContact NZ-OG1 3.17Å; K113-T191 PolarHBondContact NZ-OG1 3.11Å; K113-T191 VanDerWaalsContact NZ-OG1 3.11Å
114	D	92.3	Very high	93.6	Very high	60 Å²	60	34 Å²	34	32%	0.321	18%	0.178	S	C	.	.	H	α-helix	trans	-79	-34.6	-170.5	-61.6	-45.3	0	0	0	111.3	S112 F118 Q194	S112-D114 PolarHBondContact O-N 2.85Å; D114-F118 WeakPolarHBondContact O-CB 3.44Å; D114-F118 PolarHBondContact O-N 3.31Å; D114-Q194 HydrophobicContact CB-CG 4.12Å; D114-Q194 WeakPolarHBondContact OD1-CG 3.33Å
115	D	92.4	Very high	93.5	Very high	22 Å²	22	29.9 Å²	29.9	12%	0.118	16%	0.161	C	C	.	.	H	α-helix	trans	-71.6	-39.1	171.2	-60.4	-50.8	0	0	0	111.5	A61 S112 I117 F118 W119	A61-D115 HydrophobicContact CB-CB 4.36Å; A61-D115 WeakPolarHBondContact CB-OD1 3.44Å; S112-D115 WeakPolarHBondContact CB-OD2 3.27Å; S112-D115 VanDerWaalsContact OG-CG 3.31Å; S112-D115 PolarHBondContact OG-N 2.65Å; S112-D115 PolarHBondContact OG-OD2 3.43Å; D115-I117 PolarHBondContact O-N 3.38Å; D115-F118 PolarHBondContact O-N 3.45Å; D115-W119 WeakPolarHBondContact O-CB 3.44Å; D115-W119 PolarHBondContact O-N 2.93Å
116	L	95.4	Very high	93.5	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-63.4	-39	174.1	-77.1	165.3	0	0	0	112	C110 S112 K113 L120 I151 R154 L155 V158	C110-L116 HydrophobicContact CB-CD2 3.94Å; C110-L116 HydrophobicContact CB-CG 4.12Å; S112-L116 WeakPolarHBondContact O-CB 3.32Å; S112-L116 WeakPolarHBondContact O-CD1 3.3Å; S112-L116 VanDerWaalsContact O-CG 3.29Å; S112-L116 WeakPolarHBondContact O-CG 3.47Å; S112-L116 PolarHBondContact O-N 3.22Å; K113-L116 PolarHBondContact O-N 2.85Å; L116-L120 WeakPolarHBondContact O-CB 3.47Å; L116-L120 PolarHBondContact O-N 3.34Å; L116-I151 HydrophobicContact CD2-CG2 4.08Å; L116-R154 HydrophobicContact CD1-CG 3.88Å; L116-R154 HydrophobicContact CD2-CB 4.31Å; L116-R154 HydrophobicContact CD2-CG 3.85Å; L116-L155 HydrophobicContact CB-CB 4.17Å; L116-L155 HydrophobicContact CB-CD1 3.96Å; L116-V158 HydrophobicContact CD1-CB 4.42Å; L116-V158 HydrophobicContact CD1-CG2 3.88Å
117	I	95.6	Very high	93.4	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-64.3	-45.2	172.6	-71.8	162.7	0	0	0	111.1	K113 D115 L120 A121 L155 T191 Q194 A195 C198	K113-I117 WeakPolarHBondContact O-CB 3.4Å; K113-I117 WeakPolarHBondContact O-CD1 3.45Å; K113-I117 WeakPolarHBondContact O-CG1 3.41Å; K113-I117 PolarHBondContact O-N 3.11Å; D115-I117 PolarHBondContact O-N 3.38Å; I117-L120 PolarHBondContact O-N 3.27Å; I117-A121 PolarHBondContact O-N 2.97Å; I117-L155 HydrophobicContact CD1-CD1 4.33Å; I117-L155 HydrophobicContact CG1-CD1 3.88Å; I117-L155 HydrophobicContact CG1-CD2 3.58Å; I117-L155 HydrophobicContact CG1-CG 4.4Å; I117-T191 HydrophobicContact CD1-CG2 3.92Å; I117-Q194 HydrophobicContact CB-CG 4.31Å; I117-Q194 HydrophobicContact CD1-CB 4.18Å; I117-Q194 HydrophobicContact CD1-CG 4.08Å; I117-Q194 HydrophobicContact CG2-CG 4.01Å; I117-A195 HydrophobicContact CG2-CB 4.27Å; I117-C198 HydrophobicContact CG2-CB 4.06Å
118	F	94.3	Very high	93.3	Very high	1 Å²	1	26.4 Å²	26.4	0%	0.004	14%	0.143	C	C	.	.	H	α-helix	trans	-60.6	-45	177.5	174.7	-93	0	0	0	112.4	A60 A61 R70 P73 D114 D115 A121 N122	A60-F118 HydrophobicContact CB-CE1 4.26Å; A60-F118 HydrophobicContact CB-CZ 4.05Å; A60-F118 WeakPolarHBondContact O-CZ 3.49Å; A61-F118 HydrophobicContact CB-CB 4.19Å; A61-F118 HydrophobicContact CB-CD1 3.38Å; A61-F118 HydrophobicContact CB-CD2 4.44Å; A61-F118 HydrophobicContact CB-CE1 3.76Å; A61-F118 HydrophobicContact CB-CG 3.76Å; A61-F118 HydrophobicContact CB-CZ 4.42Å; R70-F118 HydrophobicContact CB-CE2 4.36Å; R70-F118 WeakPolarHBondContact O-CE2 3.37Å; P73-F118 HydrophobicContact CG-CE1 4.28Å; P73-F118 HydrophobicContact CG-CZ 3.87Å; D114-F118 WeakPolarHBondContact O-CB 3.44Å; D114-F118 PolarHBondContact O-N 3.31Å; D115-F118 PolarHBondContact O-N 3.45Å; F118-A121 PolarHBondContact O-N 3.48Å; F118-N122 PolarHBondContact O-N 3.03Å; F118-N122 VanDerWaalsContact O-N 3.09Å; F118-N122 PolarHBondContact O-ND2 3.4Å
119	W	95.1	Very high	93.1	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-73.7	-32.3	178.3	-73	125.6	0	0	0	113.1	N58 P73 F103 I106 D115 N122 A123	N58-W119 PolarHBondContact OD1-NE1 2.98Å; P73-W119 HydrophobicContact CB-CH2 4.45Å; P73-W119 HydrophobicContact CB-CZ3 4.08Å; P73-W119 HydrophobicContact CG-CZ3 4.42Å; F103-W119 AromaticContact CE1-CE3 3.96Å; F103-W119 HydrophobicContact CE1-CE3 3.96Å; I106-W119 HydrophobicContact CD1-CD2 3.75Å; I106-W119 HydrophobicContact CD1-CE3 4.26Å; I106-W119 HydrophobicContact CD1-CG 3.86Å; I106-W119 HydrophobicContact CG1-CG 4.49Å; I106-W119 HydrophobicContact CG2-CB 3.83Å; I106-W119 HydrophobicContact CG2-CG 3.82Å; D115-W119 WeakPolarHBondContact O-CB 3.44Å; D115-W119 PolarHBondContact O-N 2.93Å; W119-N122 HydrophobicContact CE3-CB 4.16Å; W119-N122 HydrophobicContact CZ3-CB 4.44Å; W119-N122 PolarHBondContact O-N 3.19Å; W119-A123 WeakPolarHBondContact O-CB 3.3Å; W119-A123 PolarHBondContact O-N 2.95Å
120	L	95.9	Very high	93.1	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-62.3	-43.5	172	-177.5	67.1	0	0	0	111.5	L116 I117 S124 I148 I151 F152 L155 L200	L116-L120 WeakPolarHBondContact O-CB 3.47Å; L116-L120 PolarHBondContact O-N 3.34Å; I117-L120 PolarHBondContact O-N 3.27Å; L120-S124 WeakPolarHBondContact O-CB 3.36Å; L120-S124 PolarHBondContact O-N 3.47Å; L120-S124 PolarHBondContact O-OG 2.98Å; L120-I148 HydrophobicContact CD1-CG2 3.93Å; L120-I151 HydrophobicContact CB-CG2 3.86Å; L120-I151 HydrophobicContact CD1-CB 4.39Å; L120-I151 HydrophobicContact CD1-CG2 4.22Å; L120-F152 HydrophobicContact CD1-CB 4.06Å; L120-F152 HydrophobicContact CD2-CD2 3.92Å; L120-L155 HydrophobicContact CD2-CD2 4.23Å; L120-L200 HydrophobicContact CB-CD1 4.31Å; L120-L200 HydrophobicContact CD2-CD1 3.8Å; L120-L200 HydrophobicContact CD2-CD2 4.11Å; L120-L200 HydrophobicContact CG-CD1 3.78Å
121	A	94.5	Very high	92.9	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-63.2	-47.4	176.5	0	0	0	0	0	111.3	L71 I117 F118 S124 E125 C198 L200	L71-A121 HydrophobicContact CD2-CB 4Å; I117-A121 PolarHBondContact O-N 2.97Å; F118-A121 PolarHBondContact O-N 3.48Å; A121-S124 PolarHBondContact O-N 2.94Å; A121-S124 PolarHBondContact O-OG 2.62Å; A121-E125 WeakPolarHBondContact O-CB 3.35Å; A121-E125 PolarHBondContact O-N 3.33Å; A121-C198 HydrophobicContact CB-CB 4.2Å; A121-C198 WeakPolarHBondContact CB-O 3.49Å; A121-L200 HydrophobicContact CB-CB 4.25Å; A121-L200 HydrophobicContact CB-CD1 4.09Å
122	N	94.1	Very high	92.7	Very high	1 Å²	1	18 Å²	18	1%	0.005	9%	0.091	C	C	.	.	H	α-helix	trans	-67.2	-38.2	178.5	-82.8	-85.3	0	0	0	113.2	R70 L71 P73 A74 F118 W119 F126	R70-N122 PolarHBondContact O-ND2 2.66Å; L71-N122 WeakPolarHBondContact CA-OD1 3.32Å; L71-N122 PolarHBondContact O-OD1 3.07Å; P73-N122 WeakPolarHBondContact CB-OD1 3.24Å; P73-N122 VanDerWaalsContact CD-OD1 3.3Å; P73-N122 WeakPolarHBondContact CD-OD1 3.49Å; A74-N122 HydrophobicContact CB-CB 4.24Å; A74-N122 VanDerWaalsContact CB-O 3.3Å; A74-N122 WeakPolarHBondContact CB-O 3.48Å; A74-N122 PolarHBondContact N-OD1 3.07Å; F118-N122 PolarHBondContact O-N 3.03Å; F118-N122 VanDerWaalsContact O-N 3.09Å; F118-N122 PolarHBondContact O-ND2 3.4Å; W119-N122 HydrophobicContact CE3-CB 4.16Å; W119-N122 HydrophobicContact CZ3-CB 4.44Å; W119-N122 PolarHBondContact O-N 3.19Å; N122-F126 WeakPolarHBondContact O-CB 3.1Å; N122-F126 PolarHBondContact O-N 3.04Å
123	A	95.1	Very high	92.5	Very high	1 Å²	1	16.3 Å²	16.3	1%	0.008	8%	0.079	C	C	.	.	H	α-helix	trans	-66.2	-42.7	177.5	0	0	0	0	0	112.2	F103 W119 N127 I148 I151	F103-A123 HydrophobicContact CD1-CB 3.78Å; F103-A123 HydrophobicContact CE1-CB 3.5Å; F103-A123 HydrophobicContact CE2-CB 4.5Å; F103-A123 HydrophobicContact CG-CB 4.4Å; F103-A123 HydrophobicContact CZ-CB 3.88Å; W119-A123 WeakPolarHBondContact O-CB 3.3Å; W119-A123 PolarHBondContact O-N 2.95Å; A123-N127 PolarHBondContact O-N 3.4Å; A123-I148 HydrophobicContact CB-CG1 3.76Å; A123-I151 HydrophobicContact CB-CD1 4.18Å
124	S	94.9	Very high	92.1	Very high	13 Å²	13	18.8 Å²	18.8	9%	0.091	10%	0.097	C	C	.	.	H	α-helix	trans	-71.2	-40.9	179.7	49.8	0	0	0	0	112.9	L120 A121 N127 H128	L120-S124 WeakPolarHBondContact O-CB 3.36Å; L120-S124 PolarHBondContact O-N 3.47Å; L120-S124 PolarHBondContact O-OG 2.98Å; A121-S124 PolarHBondContact O-N 2.94Å; A121-S124 PolarHBondContact O-OG 2.62Å; S124-N127 PolarHBondContact O-N 2.83Å; S124-H128 PolarHBondContact O-N 3.32Å
125	E	92.8	Very high	91.7	Very high	5 Å²	5	19.9 Å²	19.9	2%	0.023	10%	0.1	C	C	.	.	H	α-helix	trans	-65.8	-39.2	173.5	-169.1	76	155.3	0	0	111.7	L71 A74 Y75 A121 H128 L129 G359 Y360 F361	L71-E125 HydrophobicContact CD1-CG 4.16Å; L71-E125 HydrophobicContact CD2-CB 4.15Å; A74-E125 HydrophobicContact CB-CB 4.12Å; A74-E125 HydrophobicContact CB-CG 4.38Å; Y75-E125 HydrophobicContact CD2-CG 4.48Å; Y75-E125 HydrophobicContact CE2-CG 3.78Å; Y75-E125 PolarHBondContact OH-OE1 2.69Å; A121-E125 WeakPolarHBondContact O-CB 3.35Å; A121-E125 PolarHBondContact O-N 3.33Å; E125-H128 PolarHBondContact O-N 3Å; E125-L129 HydrophobicContact CG-CD1 4.4Å; E125-L129 WeakPolarHBondContact O-CG 3.48Å; E125-L129 PolarHBondContact O-N 3.41Å; E125-G359 WeakPolarHBondContact OE2-CA 3.36Å; E125-Y360 PolarHBondContact OE2-N 3.49Å; E125-F361 WeakPolarHBondContact OE1-CB 3.49Å; E125-F361 PolarHBondContact OE1-N 3.41Å
126	F	93.3	Very high	91.5	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-61.8	-44.1	174.4	174.6	-104.1	0	0	0	112.2	A74 L77 L81 F96 I99 F103 N122 H128 L129 V130 I144	A74-F126 HydrophobicContact CB-CB 4.12Å; L77-F126 HydrophobicContact CB-CD2 3.85Å; L77-F126 HydrophobicContact CB-CE2 3.76Å; L81-F126 HydrophobicContact CD2-CE2 4.29Å; L81-F126 HydrophobicContact CD2-CZ 4.02Å; F96-F126 HydrophobicContact CD2-CE1 4.41Å; F96-F126 HydrophobicContact CD2-CZ 4.22Å; F96-F126 AromaticContact CE2-CE1 3.87Å; F96-F126 HydrophobicContact CE2-CE1 3.87Å; F96-F126 HydrophobicContact CE2-CZ 4.06Å; F96-F126 HydrophobicContact CZ-CE1 4.49Å; I99-F126 HydrophobicContact CD1-CE2 4.36Å; I99-F126 HydrophobicContact CD1-CZ 3.94Å; I99-F126 HydrophobicContact CG2-CD1 4.44Å; I99-F126 HydrophobicContact CG2-CE1 3.88Å; I99-F126 HydrophobicContact CG2-CZ 4.15Å; F103-F126 HydrophobicContact CE2-CD1 4.5Å; N122-F126 WeakPolarHBondContact O-CB 3.1Å; N122-F126 PolarHBondContact O-N 3.04Å; F126-H128 VanDerWaalsContact C-N 3.35Å; F126-H128 PolarHBondContact O-N 2.22Å; F126-L129 PolarHBondContact O-N 2.94Å; F126-V130 HydrophobicContact CD2-CG2 4.35Å; F126-V130 HydrophobicContact CE1-CG2 4.23Å; F126-V130 HydrophobicContact CE2-CG2 3.94Å; F126-V130 HydrophobicContact CZ-CG2 3.88Å; F126-V130 WeakPolarHBondContact O-CG2 3.4Å; F126-V130 PolarHBondContact O-N 2.77Å; F126-I144 HydrophobicContact CD1-CD1 4.1Å; F126-I144 HydrophobicContact CE1-CD1 4Å
127	N	92.3	Very high	90.9	Very high	15 Å²	15	24.5 Å²	24.5	8%	0.08	12%	0.119	C	C	.	.	H	α-helix	trans	-60.9	-43.8	174	-175.5	89.1	0	0	0	111.5	A123 S124 L129 V130 E131 I144 I148	A123-N127 PolarHBondContact O-N 3.4Å; S124-N127 PolarHBondContact O-N 2.83Å; N127-L129 PolarHBondContact O-N 3.27Å; N127-V130 PolarHBondContact O-N 2.96Å; N127-E131 PolarHBondContact ND2-OE1 2.78Å; N127-E131 WeakPolarHBondContact O-CB 3.15Å; N127-E131 WeakPolarHBondContact O-CG 3.38Å; N127-E131 PolarHBondContact O-N 3.34Å; N127-I144 HydrophobicContact CB-CG2 3.78Å; N127-I144 WeakPolarHBondContact OD1-CG2 3.47Å; N127-I148 HydrophobicContact CB-CD1 3.65Å
128	H	89.8	Confident	90.1	Very high	10 Å²	10	28.1 Å²	28.1	5%	0.046	15%	0.149	C	C	.	.	H	α-helix	trans	-60.4	-43.8	177.2	-179.3	78.8	0	0	0	112.7	S124 E125 F126 E131 R132 Q357 G359	S124-H128 PolarHBondContact O-N 3.32Å; E125-H128 PolarHBondContact O-N 3Å; F126-H128 VanDerWaalsContact C-N 3.35Å; F126-H128 PolarHBondContact O-N 2.22Å; H128-E131 PolarHBondContact O-N 3.15Å; H128-R132 WeakPolarHBondContact CE1-CD 3.47Å; H128-R132 PolarHBondContact CE1-NH1 3.37Å; H128-R132 WeakPolarHBondContact NE2-CD 3.28Å; H128-R132 PolarHBondContact NE2-NH1 2.99Å; H128-R132 VanDerWaalsContact NE2-NH1 3.14Å; H128-R132 WeakPolarHBondContact O-CG 3.37Å; H128-R132 PolarHBondContact O-N 3.03Å; H128-R132 VanDerWaalsContact O-N 3.07Å; H128-Q357 PolarHBondContact CE1-O 3.27Å; H128-Q357 PolarHBondContact ND1-O 3.46Å; H128-G359 WeakPolarHBondContact CD2-CA 3.33Å; H128-G359 PolarHBondContact CD2-N 3.39Å; H128-G359 PolarHBondContact CE1-N 2.98Å; H128-G359 PolarHBondContact ND1-N 3Å; H128-G359 WeakPolarHBondContact NE2-CA 3.31Å; H128-G359 PolarHBondContact NE2-N 3.09Å; H128-G359 VanDerWaalsContact NE2-N 3.11Å
129	L	89.8	Confident	89.3	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-60.2	-47.9	175.6	-72.5	166.8	0	0	0	111.6	L35 Y75 Y78 E125 F126 N127 E131 R132 D133 V362	L35-L129 HydrophobicContact CD2-CD2 3.78Å; Y75-L129 HydrophobicContact CD1-CD1 4.36Å; Y75-L129 HydrophobicContact CD2-CD1 4.15Å; Y75-L129 HydrophobicContact CE1-CD1 4.39Å; Y75-L129 HydrophobicContact CE1-CD2 4.23Å; Y75-L129 HydrophobicContact CE2-CD1 4.19Å; Y75-L129 HydrophobicContact CG-CD1 4.23Å; Y78-L129 HydrophobicContact CD1-CD1 4.45Å; Y78-L129 HydrophobicContact CD1-CD2 4.42Å; Y78-L129 HydrophobicContact CD2-CB 3.65Å; Y78-L129 HydrophobicContact CE2-CB 4.11Å; Y78-L129 HydrophobicContact CG-CB 3.9Å; Y78-L129 HydrophobicContact CG-CD1 4.1Å; Y78-L129 HydrophobicContact CG-CG 4.41Å; E125-L129 HydrophobicContact CG-CD1 4.4Å; E125-L129 WeakPolarHBondContact O-CG 3.48Å; E125-L129 PolarHBondContact O-N 3.41Å; F126-L129 PolarHBondContact O-N 2.94Å; N127-L129 PolarHBondContact O-N 3.27Å; L129-E131 PolarHBondContact O-N 3.48Å; L129-R132 PolarHBondContact O-N 3.1Å; L129-D133 PolarHBondContact O-N 3.45Å; L129-D133 VanDerWaalsContact O-N 3.09Å; L129-V362 HydrophobicContact CD2-CG2 3.59Å; L129-V362 HydrophobicContact CG-CG2 4.33Å
130	V	89.8	Confident	88.3	Confident	14 Å²	14	41.2 Å²	41.2	9%	0.085	21%	0.205	C	C	.	.	H	α-helix	trans	-67.3	-34	178.5	173.6	0	0	0	0	112.3	L81 F96 F126 N127 R132 L136 Y141	L81-V130 HydrophobicContact CD2-CG2 3.81Å; F96-V130 HydrophobicContact CE2-CG1 4.34Å; F126-V130 HydrophobicContact CD2-CG2 4.35Å; F126-V130 HydrophobicContact CE1-CG2 4.23Å; F126-V130 HydrophobicContact CE2-CG2 3.94Å; F126-V130 HydrophobicContact CZ-CG2 3.88Å; F126-V130 WeakPolarHBondContact O-CG2 3.4Å; F126-V130 PolarHBondContact O-N 2.77Å; N127-V130 PolarHBondContact O-N 2.96Å; V130-R132 VanDerWaalsContact C-N 3.33Å; V130-L136 HydrophobicContact CG1-CB 4.28Å; V130-L136 HydrophobicContact CG2-CD1 4.4Å; V130-Y141 HydrophobicContact CG1-CD2 4.44Å
131	E	87.8	Confident	87.4	Confident	93 Å²	93	42.5 Å²	42.5	44%	0.435	21%	0.211	S	C	.	.	H	α-helix	trans	-76.4	-14.2	175.7	-79	-158.1	-135.3	0	0	114.2	N127 H128 L129 K137	N127-E131 PolarHBondContact ND2-OE1 2.78Å; N127-E131 WeakPolarHBondContact O-CB 3.15Å; N127-E131 WeakPolarHBondContact O-CG 3.38Å; N127-E131 PolarHBondContact O-N 3.34Å; H128-E131 PolarHBondContact O-N 3.15Å; L129-E131 PolarHBondContact O-N 3.48Å; E131-K137 VanDerWaalsContact O-CD 3.31Å; E131-K137 WeakPolarHBondContact O-CD 3.43Å; E131-K137 WeakPolarHBondContact O-CE 3.45Å; E131-K137 PolarHBondContact O-NZ 3.26Å; E131-K137 IonicContact OE2-NZ 2.72Å
132	R	85.6	Confident	86.2	Confident	65 Å²	65	44.2 Å²	44.2	25%	0.245	23%	0.228	C	C	.	.	H	α-helix	trans	-99.1	-28.2	175.1	-75.1	-178.1	79.9	148.3	11.2	114.3	L35 H128 L129 V130 T134 E363	L35-R132 HydrophobicContact CB-CB 4.3Å; L35-R132 HydrophobicContact CD2-CB 4.14Å; H128-R132 WeakPolarHBondContact CE1-CD 3.47Å; H128-R132 PolarHBondContact CE1-NH1 3.37Å; H128-R132 WeakPolarHBondContact NE2-CD 3.28Å; H128-R132 PolarHBondContact NE2-NH1 2.99Å; H128-R132 VanDerWaalsContact NE2-NH1 3.14Å; H128-R132 WeakPolarHBondContact O-CG 3.37Å; H128-R132 PolarHBondContact O-N 3.03Å; H128-R132 VanDerWaalsContact O-N 3.07Å; L129-R132 PolarHBondContact O-N 3.1Å; V130-R132 VanDerWaalsContact C-N 3.33Å; R132-T134 PolarHBondContact O-N 2.86Å; R132-E363 IonicContact CZ-OE1 3.68Å; R132-E363 IonicContact NH1-OE1 2.95Å; R132-E363 PolarHBondContact NH1-OE1 3.45Å; R132-E363 IonicContact NH2-OE1 3.26Å; R132-E363 PolarHBondContact NH2-OE1 3.42Å
133	D	88	Confident	85.4	Confident	4 Å²	4	52 Å²	52	2%	0.021	26%	0.262	C	S	.	.			trans	-68.8	120.7	170.8	-174.7	-71.5	0	0	0	110.3	Y78 R82 L129 E135 L136 K137	Y78-D133 HydrophobicContact CE2-CB 4Å; Y78-D133 PolarHBondContact OH-OD2 3.49Å; R82-D133 IonicContact CZ-OD1 3.52Å; R82-D133 IonicContact CZ-OD2 3.82Å; R82-D133 VanDerWaalsContact CZ-OD2 3.26Å; R82-D133 IonicContact NE-OD1 2.72Å; R82-D133 IonicContact NE-OD2 3.68Å; R82-D133 PolarHBondContact NE-OD2 2.85Å; R82-D133 IonicContact NH2-OD1 3.61Å; R82-D133 IonicContact NH2-OD2 3.66Å; R82-D133 PolarHBondContact NH2-OD2 3.23Å; L129-D133 PolarHBondContact O-N 3.45Å; L129-D133 VanDerWaalsContact O-N 3.09Å; D133-E135 PolarHBondContact O-N 2.9Å; D133-E135 WeakPolarHBondContact OD1-CA 3.48Å; D133-E135 WeakPolarHBondContact OD1-CB 3.43Å; D133-E135 PolarHBondContact OD1-N 3.42Å; D133-L136 HydrophobicContact CB-CB 4.07Å; D133-L136 HydrophobicContact CB-CD1 4.02Å; D133-L136 HydrophobicContact CB-CG 4.03Å; D133-L136 WeakPolarHBondContact OD1-CG 3.41Å; D133-L136 PolarHBondContact OD1-N 2.97Å; D133-K137 WeakPolarHBondContact O-CB 3.49Å; D133-K137 PolarHBondContact O-N 2.9Å
134	T	84.5	Confident	85.2	Confident	91 Å²	91	52 Å²	52	56%	0.558	26%	0.261	S	S	*	.	H	α-helix	trans	-69.8	-29.3	-173.1	46.9	0	0	0	0	113.4	R132 A138	R132-T134 PolarHBondContact O-N 2.86Å; T134-A138 VanDerWaalsContact O-CB 3.25Å; T134-A138 WeakPolarHBondContact O-CB 3.49Å; T134-A138 PolarHBondContact O-N 2.95Å; T134-A138 VanDerWaalsContact O-N 3.17Å
135	E	85.4	Confident	84.9	Confident	83 Å²	83	52.8 Å²	52.8	39%	0.388	27%	0.267	S	S	.	.	H	α-helix	trans	-80	-43.3	177.5	-70.9	172.1	-120.9	0	0	111.1	R82 H85 D133 A138 S139	R82-E135 IonicContact CZ-OE1 3.38Å; R82-E135 IonicContact CZ-OE2 3.61Å; R82-E135 IonicContact NH1-OE1 3.19Å; R82-E135 PolarHBondContact NH1-OE1 3.35Å; R82-E135 IonicContact NH1-OE2 2.81Å; R82-E135 PolarHBondContact NH1-OE2 3.44Å; R82-E135 IonicContact NH2-OE1 2.89Å; R82-E135 PolarHBondContact NH2-OE1 2.98Å; R82-E135 IonicContact NH2-OE2 3.73Å; H85-E135 IonicContact CD2-OE2 3.91Å; D133-E135 PolarHBondContact O-N 2.9Å; D133-E135 WeakPolarHBondContact OD1-CA 3.48Å; D133-E135 WeakPolarHBondContact OD1-CB 3.43Å; D133-E135 PolarHBondContact OD1-N 3.42Å; E135-A138 PolarHBondContact O-N 2.81Å; E135-S139 PolarHBondContact O-N 2.9Å; E135-S139 VanDerWaalsContact O-N 3.17Å; E135-S139 PolarHBondContact O-OG 3.15Å
136	L	86.8	Confident	84.9	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-65.2	-42.6	176.3	-59.8	-177.2	0	0	0	111	Y78 L81 H85 V130 D133 A138 S139 Y141	Y78-L136 HydrophobicContact CD2-CD1 3.99Å; Y78-L136 HydrophobicContact CE2-CD1 3.71Å; L81-L136 HydrophobicContact CD2-CD1 4.07Å; L81-L136 HydrophobicContact CG-CD1 4.34Å; L81-L136 HydrophobicContact CG-CD2 4.22Å; H85-L136 HydrophobicContact CB-CD2 3.56Å; V130-L136 HydrophobicContact CG1-CB 4.28Å; V130-L136 HydrophobicContact CG2-CD1 4.4Å; D133-L136 HydrophobicContact CB-CB 4.07Å; D133-L136 HydrophobicContact CB-CD1 4.02Å; D133-L136 HydrophobicContact CB-CG 4.03Å; D133-L136 WeakPolarHBondContact OD1-CG 3.41Å; D133-L136 PolarHBondContact OD1-N 2.97Å; L136-A138 PolarHBondContact O-N 3.48Å; L136-S139 WeakPolarHBondContact O-CB 3.4Å; L136-S139 PolarHBondContact O-N 2.69Å; L136-S139 VanDerWaalsContact O-N 3.15Å; L136-Y141 HydrophobicContact CB-CD2 4.47Å; L136-Y141 HydrophobicContact CB-CE2 3.91Å; L136-Y141 HydrophobicContact CD2-CE2 3.76Å; L136-Y141 HydrophobicContact CG-CE2 4.42Å; L136-Y141 WeakPolarHBondContact O-CD2 3.22Å; L136-Y141 WeakPolarHBondContact O-CE2 3.44Å
137	K	83.6	Confident	84.9	Confident	118 Å²	118	56 Å²	56	51%	0.513	29%	0.286	S	S	.	.	H	α-helix	trans	-61.6	-41.9	174.5	-168.7	174.3	-146.2	146.7	0	112.6	E131 D133 S139 R140	E131-K137 VanDerWaalsContact O-CD 3.31Å; E131-K137 WeakPolarHBondContact O-CD 3.43Å; E131-K137 WeakPolarHBondContact O-CE 3.45Å; E131-K137 PolarHBondContact O-NZ 3.26Å; E131-K137 IonicContact OE2-NZ 2.72Å; D133-K137 WeakPolarHBondContact O-CB 3.49Å; D133-K137 PolarHBondContact O-N 2.9Å; K137-S139 PolarHBondContact O-N 2.94Å; K137-R140 PolarHBondContact O-N 3.37Å
138	A	79.3	Confident	85.1	Confident	76 Å²	76	55.4 Å²	55.4	63%	0.628	28%	0.283	S	S	*	.	H	α-helix	trans	-63.9	-24.5	176.8	0	0	0	0	0	113.2	T134 E135 L136 R140	T134-A138 VanDerWaalsContact O-CB 3.25Å; T134-A138 WeakPolarHBondContact O-CB 3.49Å; T134-A138 PolarHBondContact O-N 2.95Å; T134-A138 VanDerWaalsContact O-N 3.17Å; E135-A138 PolarHBondContact O-N 2.81Å; L136-A138 PolarHBondContact O-N 3.48Å; A138-R140 VanDerWaalsContact C-N 3.28Å; A138-R140 PolarHBondContact O-N 3.22Å
139	S	77.5	Confident	85.3	Confident	44 Å²	44	57.4 Å²	57.4	31%	0.308	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-7.6	-176.3	-58.6	0	0	0	0	114.9	H85 E135 L136 K137 Y141	H85-S139 PolarHBondContact CE1-OG 3.06Å; E135-S139 PolarHBondContact O-N 2.9Å; E135-S139 VanDerWaalsContact O-N 3.17Å; E135-S139 PolarHBondContact O-OG 3.15Å; L136-S139 WeakPolarHBondContact O-CB 3.4Å; L136-S139 PolarHBondContact O-N 2.69Å; L136-S139 VanDerWaalsContact O-N 3.15Å; K137-S139 PolarHBondContact O-N 2.94Å; S139-Y141 PolarHBondContact O-N 2.95Å
140	R	73.8	Confident	85.6	Confident	231 Å²	231	62.1 Å²	62.1	87%	0.872	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	47.3	178	-53.8	-171.7	-174.7	-149.7	3.5	114.2	K137 A138	K137-R140 PolarHBondContact O-N 3.37Å; A138-R140 VanDerWaalsContact C-N 3.28Å; A138-R140 PolarHBondContact O-N 3.22Å
141	Y	76.4	Confident	85.9	Confident	28 Å²	28	61.5 Å²	61.5	11%	0.11	31%	0.306	C	S	.	.			trans	-57.7	164.3	166.2	-58.8	-70.9	0	0	0	111.9	L81 H85 S92 V93 F96 V130 L136 S139	L81-Y141 HydrophobicContact CD1-CE1 4.23Å; H85-Y141 PolarHBondContact ND1-OH 3.28Å; S92-Y141 PolarHBondContact OG-OH 3.34Å; V93-Y141 HydrophobicContact CG2-CD1 4.34Å; V93-Y141 HydrophobicContact CG2-CE1 3.97Å; F96-Y141 HydrophobicContact CB-CD1 3.84Å; F96-Y141 HydrophobicContact CB-CE1 4.33Å; F96-Y141 HydrophobicContact CB-CG 4.42Å; F96-Y141 HydrophobicContact CD2-CD1 4.12Å; F96-Y141 HydrophobicContact CD2-CD2 4.36Å; F96-Y141 AromaticContact CD2-CG 3.85Å; F96-Y141 HydrophobicContact CD2-CG 3.85Å; F96-Y141 HydrophobicContact CE2-CG 4.26Å; F96-Y141 AromaticContact CG-CD1 3.9Å; F96-Y141 HydrophobicContact CG-CD1 3.9Å; F96-Y141 AromaticContact CG-CG 4Å; F96-Y141 HydrophobicContact CG-CG 4Å; V130-Y141 HydrophobicContact CG1-CD2 4.44Å; L136-Y141 HydrophobicContact CB-CD2 4.47Å; L136-Y141 HydrophobicContact CB-CE2 3.91Å; L136-Y141 HydrophobicContact CD2-CE2 3.76Å; L136-Y141 HydrophobicContact CG-CE2 4.42Å; L136-Y141 WeakPolarHBondContact O-CD2 3.22Å; L136-Y141 WeakPolarHBondContact O-CE2 3.44Å; S139-Y141 PolarHBondContact O-N 2.95Å
142	G	70.6	Confident	86.4	Confident	35 Å²	35	57.3 Å²	57.3	36%	0.361	29%	0.286	S	S	.	.			trans	-56.9	150.8	176.9	0	0	0	0	0	112.8	F96 I144	F96-G142 WeakPolarHBondContact CE1-O 3.27Å; F96-G142 WeakPolarHBondContact CZ-O 3.33Å; G142-I144 PolarHBondContact O-N 3.11Å
143	K	77.3	Confident	86.8	Confident	166 Å²	166	62 Å²	62	72%	0.722	30%	0.304	S	S	*	.			trans	-86.6	92.9	178.8	-75.4	-164.5	176.9	-171.3	0	110.9	S145 V146	K143-S145 PolarHBondContact O-N 3.48Å; K143-S145 PolarHBondContact O-OG 3.35Å; K143-V146 PolarHBondContact O-N 2.95Å
144	I	89.3	Confident	87.2	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-7.7	177.6	-147	165.8	0	0	0	113.5	F96 I99 E100 F103 F126 N127 G142 V146 E147 I148	F96-I144 HydrophobicContact CZ-CB 4.36Å; I99-I144 HydrophobicContact CG2-CD1 4.06Å; E100-I144 HydrophobicContact CB-CD1 4.48Å; F103-I144 HydrophobicContact CD2-CD1 3.53Å; F103-I144 HydrophobicContact CD2-CG1 4.4Å; F103-I144 HydrophobicContact CE2-CD1 3.97Å; F103-I144 HydrophobicContact CG-CD1 4.42Å; F126-I144 HydrophobicContact CD1-CD1 4.1Å; F126-I144 HydrophobicContact CE1-CD1 4Å; N127-I144 HydrophobicContact CB-CG2 3.78Å; N127-I144 WeakPolarHBondContact OD1-CG2 3.47Å; G142-I144 PolarHBondContact O-N 3.11Å; I144-V146 PolarHBondContact O-N 2.75Å; I144-V146 VanDerWaalsContact O-N 3.14Å; I144-E147 HydrophobicContact CG1-CB 4.32Å; I144-E147 HydrophobicContact CG1-CG 4.47Å; I144-E147 PolarHBondContact O-N 3.25Å; I144-I148 HydrophobicContact CG2-CD1 4.04Å; I144-I148 WeakPolarHBondContact O-CG1 3.44Å; I144-I148 PolarHBondContact O-N 2.86Å
145	S	89.9	Confident	87.7	Confident	30 Å²	30	61.5 Å²	61.5	21%	0.21	29%	0.292	C	S	.	.	H	α-helix	trans	-45.2	-38.8	168.4	59.6	0	0	0	0	114	K143 E149 I355	K143-S145 PolarHBondContact O-N 3.48Å; K143-S145 PolarHBondContact O-OG 3.35Å; S145-E149 PolarHBondContact O-N 3.27Å; S145-I355 VanDerWaalsContact CA-CD1 3.46Å
146	V	91.8	Very high	88.2	Confident	62 Å²	62	58.5 Å²	58.5	38%	0.376	28%	0.279	S	S	.	.	H	α-helix	trans	-69.1	-37.2	-179.7	-176.5	0	0	0	0	111.1	K143 I144 R150	K143-V146 PolarHBondContact O-N 2.95Å; I144-V146 PolarHBondContact O-N 2.75Å; I144-V146 VanDerWaalsContact O-N 3.14Å; V146-R150 WeakPolarHBondContact O-CG 3.5Å; V146-R150 PolarHBondContact O-N 2.87Å
147	E	94.3	Very high	88.5	Confident	11 Å²	11	61 Å²	61	5%	0.051	30%	0.299	C	S	.	.	H	α-helix	trans	-76.5	-36.1	178	-50.2	-51.5	150.7	0	0	111.4	E100 F103 K104 I144 E149 R150 I151	E100-E147 HydrophobicContact CG-CG 4.16Å; F103-E147 HydrophobicContact CB-CB 4.13Å; K104-E147 WeakPolarHBondContact CA-OE2 3.33Å; K104-E147 HydrophobicContact CB-CG 4.32Å; K104-E147 WeakPolarHBondContact CB-OE2 3.33Å; I144-E147 HydrophobicContact CG1-CB 4.32Å; I144-E147 HydrophobicContact CG1-CG 4.47Å; I144-E147 PolarHBondContact O-N 3.25Å; E147-E149 VanDerWaalsContact C-N 3.3Å; E147-E149 PolarHBondContact O-N 2.94Å; E147-R150 PolarHBondContact O-N 3.44Å; E147-R150 IonicContact OE1-CZ 2.68Å; E147-R150 IonicContact OE1-NH1 3.9Å; E147-R150 PolarHBondContact OE1-NH1 3.3Å; E147-R150 IonicContact OE1-NH2 2.85Å; E147-R150 WeakPolarHBondContact OE2-CD 3.46Å; E147-R150 IonicContact OE2-CZ 2.89Å; E147-R150 IonicContact OE2-NE 3.08Å; E147-R150 IonicContact OE2-NH1 3.97Å; E147-R150 PolarHBondContact OE2-NH1 2.93Å; E147-I151 VanDerWaalsContact O-CG1 3.31Å; E147-I151 WeakPolarHBondContact O-CG1 3.39Å; E147-I151 PolarHBondContact O-N 3.12Å
148	I	95.5	Very high	89.1	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-55.4	-47	169.7	-65.6	166.2	0	0	0	110.4	L120 A123 N127 I144 I151 F152 F353 I355	L120-I148 HydrophobicContact CD1-CG2 3.93Å; A123-I148 HydrophobicContact CB-CG1 3.76Å; N127-I148 HydrophobicContact CB-CD1 3.65Å; I144-I148 HydrophobicContact CG2-CD1 4.04Å; I144-I148 WeakPolarHBondContact O-CG1 3.44Å; I144-I148 PolarHBondContact O-N 2.86Å; I148-I151 PolarHBondContact O-N 3.05Å; I148-F152 PolarHBondContact O-N 3.31Å; I148-F353 HydrophobicContact CG2-CE1 3.95Å; I148-F353 HydrophobicContact CG2-CZ 3.9Å; I148-I355 HydrophobicContact CD1-CD1 4.47Å
149	E	95.1	Very high	89.9	Confident	52 Å²	52	53 Å²	53	24%	0.243	25%	0.253	C	S	.	.	H	α-helix	trans	-63.6	-40.4	177.2	-172.9	178.4	168.2	0	0	112.1	S145 E147 F152 R153 F353	S145-E149 PolarHBondContact O-N 3.27Å; E147-E149 VanDerWaalsContact C-N 3.3Å; E147-E149 PolarHBondContact O-N 2.94Å; E149-F152 PolarHBondContact O-N 2.88Å; E149-R153 HydrophobicContact CG-CG 4.4Å; E149-R153 WeakPolarHBondContact O-CB 3.45Å; E149-R153 WeakPolarHBondContact O-CG 3.35Å; E149-R153 PolarHBondContact O-N 3.26Å; E149-R153 IonicContact OE1-CZ 2.76Å; E149-R153 IonicContact OE1-NE 2.7Å; E149-R153 PolarHBondContact OE1-NE 3.4Å; E149-R153 IonicContact OE1-NH2 3.15Å; E149-R153 PolarHBondContact OE1-NH2 3.08Å; E149-F353 HydrophobicContact CB-CD1 3.53Å; E149-F353 HydrophobicContact CB-CE1 3.76Å; E149-F353 HydrophobicContact CB-CG 4.25Å; E149-F353 HydrophobicContact CG-CB 3.91Å; E149-F353 HydrophobicContact CG-CD1 3.56Å; E149-F353 HydrophobicContact CG-CE1 4.21Å; E149-F353 HydrophobicContact CG-CG 3.78Å
150	R	95.6	Very high	90.6	Very high	100 Å²	100	53.4 Å²	53.4	38%	0.377	25%	0.25	S	C	.	.	H	α-helix	trans	-65	-40.3	175.6	-71.3	179.6	-164.8	146.2	9.2	112.4	A107 V146 E147 F152 R153 R154	A107-R150 HydrophobicContact CB-CB 3.75Å; V146-R150 WeakPolarHBondContact O-CG 3.5Å; V146-R150 PolarHBondContact O-N 2.87Å; E147-R150 PolarHBondContact O-N 3.44Å; E147-R150 IonicContact OE1-CZ 2.68Å; E147-R150 IonicContact OE1-NH1 3.9Å; E147-R150 PolarHBondContact OE1-NH1 3.3Å; E147-R150 IonicContact OE1-NH2 2.85Å; E147-R150 WeakPolarHBondContact OE2-CD 3.46Å; E147-R150 IonicContact OE2-CZ 2.89Å; E147-R150 IonicContact OE2-NE 3.08Å; E147-R150 IonicContact OE2-NH1 3.97Å; E147-R150 PolarHBondContact OE2-NH1 2.93Å; R150-F152 VanDerWaalsContact C-N 3.33Å; R150-R153 PolarHBondContact O-N 2.84Å; R150-R154 VanDerWaalsContact O-CB 3.25Å; R150-R154 WeakPolarHBondContact O-CB 3.48Å; R150-R154 PolarHBondContact O-N 2.81Å
151	I	96.8	Very high	91.4	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-61.4	-43.8	173.9	-64.1	167.7	0	0	0	109.9	F103 A107 L116 L120 A123 E147 I148 R154 L155	F103-I151 HydrophobicContact CB-CD1 4.24Å; F103-I151 HydrophobicContact CD1-CD1 3.78Å; F103-I151 HydrophobicContact CG-CD1 4.43Å; A107-I151 HydrophobicContact CB-CG1 3.78Å; L116-I151 HydrophobicContact CD2-CG2 4.08Å; L120-I151 HydrophobicContact CB-CG2 3.86Å; L120-I151 HydrophobicContact CD1-CB 4.39Å; L120-I151 HydrophobicContact CD1-CG2 4.22Å; A123-I151 HydrophobicContact CB-CD1 4.18Å; E147-I151 VanDerWaalsContact O-CG1 3.31Å; E147-I151 WeakPolarHBondContact O-CG1 3.39Å; E147-I151 PolarHBondContact O-N 3.12Å; I148-I151 PolarHBondContact O-N 3.05Å; I151-R154 PolarHBondContact O-N 3.27Å; I151-L155 WeakPolarHBondContact O-CB 3.31Å; I151-L155 PolarHBondContact O-N 3.45Å
152	F	96.7	Very high	92.3	Very high	5 Å²	5	48.6 Å²	48.6	2%	0.022	25%	0.252	C	S	.	.	H	α-helix	trans	-62.1	-49.9	176.3	-177.4	-89.4	0	0	0	112.3	L120 I148 E149 R150 R154 L155 V156 Q207 L208 H211 F353	L120-F152 HydrophobicContact CD1-CB 4.06Å; L120-F152 HydrophobicContact CD2-CD2 3.92Å; I148-F152 PolarHBondContact O-N 3.31Å; E149-F152 PolarHBondContact O-N 2.88Å; R150-F152 VanDerWaalsContact C-N 3.33Å; F152-R154 VanDerWaalsContact C-N 3.31Å; F152-R154 PolarHBondContact O-N 3.44Å; F152-L155 WeakPolarHBondContact O-CB 3.41Å; F152-L155 PolarHBondContact O-N 3.43Å; F152-V156 HydrophobicContact CD1-CG2 4.17Å; F152-V156 HydrophobicContact CE1-CG2 3.73Å; F152-V156 HydrophobicContact CZ-CG2 4.05Å; F152-V156 WeakPolarHBondContact O-CG2 3.47Å; F152-V156 PolarHBondContact O-N 3.22Å; F152-Q207 HydrophobicContact CE2-CB 4.18Å; F152-Q207 HydrophobicContact CZ-CB 4Å; F152-L208 HydrophobicContact CE2-CB 4.03Å; F152-L208 HydrophobicContact CE2-CD1 4.37Å; F152-H211 AromaticContact CE1-CE1 3.61Å; F152-H211 AromaticContact CE1-ND1 3.87Å; F152-H211 AromaticContact CE1-NE2 3.81Å; F152-H211 AromaticContact CZ-CE1 3.82Å; F152-H211 AromaticContact CZ-ND1 3.68Å; F152-F353 HydrophobicContact CB-CD2 4.46Å; F152-F353 HydrophobicContact CB-CE2 3.74Å; F152-F353 HydrophobicContact CB-CZ 4.02Å; F152-F353 AromaticContact CD1-CD2 3.88Å; F152-F353 HydrophobicContact CD1-CD2 3.88Å; F152-F353 AromaticContact CD1-CE2 3.82Å; F152-F353 HydrophobicContact CD1-CE2 3.82Å; F152-F353 AromaticContact CD2-CE2 3.79Å; F152-F353 HydrophobicContact CD2-CE2 3.79Å; F152-F353 HydrophobicContact CE1-CD2 4.3Å; F152-F353 HydrophobicContact CE1-CE2 4.4Å; F152-F353 HydrophobicContact CE2-CE2 4.37Å; F152-F353 HydrophobicContact CG-CD2 4.06Å; F152-F353 AromaticContact CG-CE2 3.49Å; F152-F353 HydrophobicContact CG-CE2 3.49Å; F152-F353 VanDerWaalsContact CG-CE2 3.49Å; F152-F353 HydrophobicContact CG-CZ 4.25Å
153	R	94.5	Very high	93.4	Very high	164 Å²	164	47 Å²	47	62%	0.619	24%	0.235	S	C	*	.	H	α-helix	trans	-59	-40.8	176.4	-71.7	173	179	-121	10	111.7	E149 R150 V156 A157	E149-R153 HydrophobicContact CG-CG 4.4Å; E149-R153 WeakPolarHBondContact O-CB 3.45Å; E149-R153 WeakPolarHBondContact O-CG 3.35Å; E149-R153 PolarHBondContact O-N 3.26Å; E149-R153 IonicContact OE1-CZ 2.76Å; E149-R153 IonicContact OE1-NE 2.7Å; E149-R153 PolarHBondContact OE1-NE 3.4Å; E149-R153 IonicContact OE1-NH2 3.15Å; E149-R153 PolarHBondContact OE1-NH2 3.08Å; R150-R153 PolarHBondContact O-N 2.84Å; R153-V156 PolarHBondContact O-N 3.28Å; R153-A157 PolarHBondContact O-N 2.88Å
154	R	95.9	Very high	94.1	Very high	85 Å²	85	43 Å²	43	32%	0.321	22%	0.216	S	C	.	.	H	α-helix	trans	-63.7	-43	175.7	-179.7	62.2	172.5	-156.3	-12.9	112	A107 Q108 C110 L116 R150 I151 F152 A157 V158	A107-R154 WeakPolarHBondContact O-CG 3.46Å; Q108-R154 PolarHBondContact O-NH2 2.91Å; Q108-R154 VanDerWaalsContact O-NH2 3.13Å; C110-R154 VanDerWaalsContact O-CZ 3.28Å; C110-R154 PolarHBondContact O-NE 3.05Å; C110-R154 PolarHBondContact O-NH2 3.17Å; L116-R154 HydrophobicContact CD1-CG 3.88Å; L116-R154 HydrophobicContact CD2-CB 4.31Å; L116-R154 HydrophobicContact CD2-CG 3.85Å; R150-R154 VanDerWaalsContact O-CB 3.25Å; R150-R154 WeakPolarHBondContact O-CB 3.48Å; R150-R154 PolarHBondContact O-N 2.81Å; I151-R154 PolarHBondContact O-N 3.27Å; F152-R154 VanDerWaalsContact C-N 3.31Å; F152-R154 PolarHBondContact O-N 3.44Å; R154-A157 PolarHBondContact O-N 3.4Å; R154-V158 WeakPolarHBondContact O-CG2 3.44Å; R154-V158 PolarHBondContact O-N 2.83Å
155	L	96.8	Very high	94.2	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-61.1	-44.8	174.9	176.4	60.1	0	0	0	111.8	K113 L116 I117 L120 I151 F152 V158 L159 L208	K113-L155 HydrophobicContact CB-CD1 4.1Å; L116-L155 HydrophobicContact CB-CB 4.17Å; L116-L155 HydrophobicContact CB-CD1 3.96Å; I117-L155 HydrophobicContact CD1-CD1 4.33Å; I117-L155 HydrophobicContact CG1-CD1 3.88Å; I117-L155 HydrophobicContact CG1-CD2 3.58Å; I117-L155 HydrophobicContact CG1-CG 4.4Å; L120-L155 HydrophobicContact CD2-CD2 4.23Å; I151-L155 WeakPolarHBondContact O-CB 3.31Å; I151-L155 PolarHBondContact O-N 3.45Å; F152-L155 WeakPolarHBondContact O-CB 3.41Å; F152-L155 PolarHBondContact O-N 3.43Å; L155-V158 PolarHBondContact O-N 3.14Å; L155-L159 HydrophobicContact CD1-CD1 3.73Å; L155-L159 HydrophobicContact CD1-CG 4.16Å; L155-L159 HydrophobicContact CG-CD1 3.86Å; L155-L159 WeakPolarHBondContact O-CB 3.42Å; L155-L159 VanDerWaalsContact O-CG 3.3Å; L155-L159 WeakPolarHBondContact O-CG 3.41Å; L155-L159 PolarHBondContact O-N 3.03Å; L155-L208 HydrophobicContact CD2-CD1 3.87Å; L155-L208 HydrophobicContact CD2-CD2 3.87Å; L155-L208 HydrophobicContact CG-CD1 4.08Å
156	V	95	Very high	94.4	Very high	20 Å²	20	45 Å²	45	12%	0.121	23%	0.229	C	C	.	.	H	α-helix	trans	-60.3	-46.9	175.4	172.8	0	0	0	0	110.9	F152 R153 V158 L159 Q160 L208 H211 M215	F152-V156 HydrophobicContact CD1-CG2 4.17Å; F152-V156 HydrophobicContact CE1-CG2 3.73Å; F152-V156 HydrophobicContact CZ-CG2 4.05Å; F152-V156 WeakPolarHBondContact O-CG2 3.47Å; F152-V156 PolarHBondContact O-N 3.22Å; R153-V156 PolarHBondContact O-N 3.28Å; V156-V158 PolarHBondContact O-N 3.23Å; V156-L159 PolarHBondContact O-N 3.29Å; V156-Q160 WeakPolarHBondContact O-CB 3.05Å; V156-Q160 PolarHBondContact O-N 3.38Å; V156-L208 HydrophobicContact CG2-CD1 4.3Å; V156-H211 HydrophobicContact CG1-CB 4.27Å; V156-H211 HydrophobicContact CG2-CB 4.03Å; V156-M215 HydrophobicContact CG1-CE 4.02Å; V156-M215 HydrophobicContact CG1-SD 4.13Å
157	A	93.9	Very high	94.5	Very high	52 Å²	52	42.1 Å²	42.1	43%	0.43	21%	0.211	S	C	.	.	H	α-helix	trans	-63	-39.2	178.4	0	0	0	0	0	113.4	R153 R154 Q160 S161	R153-A157 PolarHBondContact O-N 2.88Å; R154-A157 PolarHBondContact O-N 3.4Å; A157-Q160 WeakPolarHBondContact O-CB 3.47Å; A157-Q160 PolarHBondContact O-N 3.26Å; A157-S161 PolarHBondContact O-N 2.67Å
158	V	95.3	Very high	94.5	Very high	26 Å²	26	48.8 Å²	48.8	16%	0.158	24%	0.236	C	C	.	.	H	α-helix	trans	-61.2	-48	172.5	166.2	0	0	0	0	110.4	S111 K113 L116 R154 L155 V156 Q160 S161	S111-V158 WeakPolarHBondContact O-CG1 3.22Å; K113-V158 HydrophobicContact CB-CG1 4.2Å; L116-V158 HydrophobicContact CD1-CB 4.42Å; L116-V158 HydrophobicContact CD1-CG2 3.88Å; R154-V158 WeakPolarHBondContact O-CG2 3.44Å; R154-V158 PolarHBondContact O-N 2.83Å; L155-V158 PolarHBondContact O-N 3.14Å; V156-V158 PolarHBondContact O-N 3.23Å; V158-Q160 PolarHBondContact O-N 2.62Å; V158-S161 PolarHBondContact O-N 3.35Å; V158-S161 PolarHBondContact O-OG 3.48Å
159	L	95.5	Very high	94.3	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-68.4	-32.4	-179.6	-68.1	165.2	0	0	0	113	K113 L155 V156 S161 V162 I163 L187 T191 L208 L212	K113-L159 HydrophobicContact CB-CD2 4.1Å; K113-L159 HydrophobicContact CD-CD2 3.84Å; L155-L159 HydrophobicContact CD1-CD1 3.73Å; L155-L159 HydrophobicContact CD1-CG 4.16Å; L155-L159 HydrophobicContact CG-CD1 3.86Å; L155-L159 WeakPolarHBondContact O-CB 3.42Å; L155-L159 VanDerWaalsContact O-CG 3.3Å; L155-L159 WeakPolarHBondContact O-CG 3.41Å; L155-L159 PolarHBondContact O-N 3.03Å; V156-L159 PolarHBondContact O-N 3.29Å; L159-S161 PolarHBondContact O-N 2.98Å; L159-V162 PolarHBondContact O-N 2.68Å; L159-I163 WeakPolarHBondContact O-CG2 3.33Å; L159-I163 PolarHBondContact O-N 2.81Å; L159-L187 HydrophobicContact CD2-CD1 4.16Å; L159-T191 HydrophobicContact CD1-CG2 3.83Å; L159-T191 HydrophobicContact CD2-CG2 4.06Å; L159-L208 HydrophobicContact CD1-CD1 3.88Å; L159-L212 HydrophobicContact CB-CD2 3.76Å; L159-L212 HydrophobicContact CD1-CD1 4.42Å; L159-L212 HydrophobicContact CD1-CD2 3.97Å; L159-L212 HydrophobicContact CG-CD2 4.33Å
160	Q	92.6	Very high	94.3	Very high	53 Å²	53	47.2 Å²	47.2	25%	0.248	23%	0.232	C	C	.	.	H	α-helix	trans	-54.9	-41	174.9	-169.1	174.7	23.4	0	0	111.6	V156 A157 V158 V162 R164 M215	V156-Q160 WeakPolarHBondContact O-CB 3.05Å; V156-Q160 PolarHBondContact O-N 3.38Å; A157-Q160 WeakPolarHBondContact O-CB 3.47Å; A157-Q160 PolarHBondContact O-N 3.26Å; V158-Q160 PolarHBondContact O-N 2.62Å; Q160-V162 PolarHBondContact O-N 2.67Å; Q160-R164 WeakPolarHBondContact O-CB 3.19Å; Q160-R164 PolarHBondContact O-N 2.78Å; Q160-M215 HydrophobicContact CB-SD 3.48Å; Q160-M215 WeakPolarHBondContact CB-SD 3.41Å; Q160-M215 HydrophobicContact CG-SD 3.54Å; Q160-M215 VanDerWaalsContact CG-SD 3.54Å
161	S	91.4	Very high	94.2	Very high	82 Å²	82	43.7 Å²	43.7	57%	0.573	22%	0.221	S	C	*	.	H	α-helix	trans	-64.8	-22.8	179.1	76.7	0	0	0	0	114.1	A157 V158 L159 P165	A157-S161 PolarHBondContact O-N 2.67Å; V158-S161 PolarHBondContact O-N 3.35Å; V158-S161 PolarHBondContact O-OG 3.48Å; L159-S161 PolarHBondContact O-N 2.98Å; S161-P165 WeakPolarHBondContact O-CD 3.45Å; S161-P165 VanDerWaalsContact O-CG 3.32Å; S161-P165 WeakPolarHBondContact O-CG 3.35Å
162	V	94.3	Very high	93.9	Very high	75 Å²	75	46.8 Å²	46.8	46%	0.455	24%	0.237	S	C	.	.	H	α-helix	trans	-101.2	-39.8	-178.3	-170.5	0	0	0	0	111.8	L159 Q160 P165 A166 L187	L159-V162 PolarHBondContact O-N 2.68Å; Q160-V162 PolarHBondContact O-N 2.67Å; V162-P165 WeakPolarHBondContact O-CD 3.49Å; V162-A166 PolarHBondContact O-N 3.45Å; V162-L187 HydrophobicContact CB-CD2 4.13Å; V162-L187 HydrophobicContact CG1-CD1 4.17Å; V162-L187 HydrophobicContact CG1-CD2 3.99Å
163	I	94.5	Very high	93.5	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-72.1	-33	-177	-158.5	160.3	0	0	0	112.7	L159 A166 A167 L187 L212 M215 V216	L159-I163 WeakPolarHBondContact O-CG2 3.33Å; L159-I163 PolarHBondContact O-N 2.81Å; I163-A166 PolarHBondContact O-N 2.9Å; I163-A167 VanDerWaalsContact O-CB 3.3Å; I163-A167 WeakPolarHBondContact O-CB 3.44Å; I163-A167 PolarHBondContact O-N 2.92Å; I163-L187 HydrophobicContact CB-CD2 3.59Å; I163-L187 HydrophobicContact CD1-CD2 4.26Å; I163-L187 HydrophobicContact CG1-CD2 3.9Å; I163-L212 HydrophobicContact CD1-CB 3.91Å; I163-L212 HydrophobicContact CD1-CD2 3.72Å; I163-L212 HydrophobicContact CD1-CG 4.44Å; I163-L212 WeakPolarHBondContact CD1-O 3.08Å; I163-M215 HydrophobicContact CG2-CB 3.95Å; I163-M215 HydrophobicContact CG2-CE 4.18Å; I163-M215 HydrophobicContact CG2-SD 4.32Å; I163-V216 HydrophobicContact CD1-CG2 3.66Å; I163-V216 HydrophobicContact CG1-CG2 3.77Å
164	R	90.8	Very high	93.3	Very high	84 Å²	84	47.8 Å²	47.8	32%	0.317	25%	0.249	S	C	.	.	H	α-helix	trans	-65.5	-45.1	178.1	175.9	176.2	-67.1	176	2.8	112.4	Q160 F219 D347	Q160-R164 WeakPolarHBondContact O-CB 3.19Å; Q160-R164 PolarHBondContact O-N 2.78Å; R164-F219 HydrophobicContact CG-CD2 3.72Å; R164-F219 HydrophobicContact CG-CE2 4.16Å; R164-F219 HydrophobicContact CG-CG 4.37Å; R164-D347 IonicContact CZ-OD1 3.62Å; R164-D347 IonicContact CZ-OD2 3.1Å; R164-D347 IonicContact NH1-OD2 3.42Å; R164-D347 IonicContact NH2-OD1 2.85Å; R164-D347 PolarHBondContact NH2-OD1 2.98Å; R164-D347 IonicContact NH2-OD2 2.69Å; R164-D347 PolarHBondContact NH2-OD2 3.48Å
165	P	91.7	Very high	93.1	Very high	62 Å²	62	47 Å²	47	40%	0.403	25%	0.251	S	S	.	.	H	α-helix	trans	-57.5	-48.6	167.1	-28.9	35.7	0	0	0	113.8	S161 V162 A167 R168	S161-P165 WeakPolarHBondContact O-CD 3.45Å; S161-P165 VanDerWaalsContact O-CG 3.32Å; S161-P165 WeakPolarHBondContact O-CG 3.35Å; V162-P165 WeakPolarHBondContact O-CD 3.49Å; P165-A167 VanDerWaalsContact C-N 3.32Å; P165-A167 PolarHBondContact O-N 3.49Å; P165-R168 VanDerWaalsContact O-CB 3.31Å; P165-R168 WeakPolarHBondContact O-CB 3.48Å; P165-R168 PolarHBondContact O-N 2.89Å; P165-R168 VanDerWaalsContact O-N 3.16Å
166	A	94	Very high	93	Very high	10 Å²	10	50.8 Å²	50.8	8%	0.083	27%	0.272	C	S	.	.	H	α-helix	trans	-59.6	-40	-178.9	0	0	0	0	0	112.8	V162 I163 R168 A169 D183 V184	V162-A166 PolarHBondContact O-N 3.45Å; I163-A166 PolarHBondContact O-N 2.9Å; A166-R168 PolarHBondContact O-N 2.93Å; A166-A169 PolarHBondContact O-N 2.95Å; A166-D183 HydrophobicContact CB-CB 3.7Å; A166-V184 HydrophobicContact CB-CG2 3.92Å
167	A	94.8	Very high	92.9	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-69.2	-12	-179.5	0	0	0	0	0	114.2	I163 P165 A169 L170 V184 F219	I163-A167 VanDerWaalsContact O-CB 3.3Å; I163-A167 WeakPolarHBondContact O-CB 3.44Å; I163-A167 PolarHBondContact O-N 2.92Å; P165-A167 VanDerWaalsContact C-N 3.32Å; P165-A167 PolarHBondContact O-N 3.49Å; A167-A169 VanDerWaalsContact C-N 3.31Å; A167-A169 PolarHBondContact O-N 3.25Å; A167-L170 HydrophobicContact CB-CD1 4.1Å; A167-L170 WeakPolarHBondContact O-CB 3.46Å; A167-L170 PolarHBondContact O-N 3.2Å; A167-V184 HydrophobicContact CB-CG2 4.36Å; A167-F219 HydrophobicContact CB-CD1 3.46Å; A167-F219 VanDerWaalsContact CB-CD1 3.46Å; A167-F219 HydrophobicContact CB-CE1 4.1Å; A167-F219 HydrophobicContact CB-CG 4.19Å; A167-F219 WeakPolarHBondContact O-CE1 3.27Å
168	R	93	Very high	92.9	Very high	151 Å²	151	56.7 Å²	56.7	57%	0.57	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-61.2	-38.9	174.4	-71.4	173.4	171.4	147.8	-2.1	112.6	P165 A166 L170 L171 F219	P165-R168 VanDerWaalsContact O-CB 3.31Å; P165-R168 WeakPolarHBondContact O-CB 3.48Å; P165-R168 PolarHBondContact O-N 2.89Å; P165-R168 VanDerWaalsContact O-N 3.16Å; A166-R168 PolarHBondContact O-N 2.93Å; R168-L170 PolarHBondContact O-N 3.19Å; R168-L170 VanDerWaalsContact O-N 3.17Å; R168-L171 PolarHBondContact O-N 3.14Å; R168-L171 VanDerWaalsContact O-N 3.11Å; R168-F219 HydrophobicContact CB-CZ 4.44Å; R168-F219 HydrophobicContact CG-CE1 4.04Å; R168-F219 HydrophobicContact CG-CE2 4.36Å; R168-F219 HydrophobicContact CG-CZ 3.57Å
169	A	92.9	Very high	92.8	Very high	20 Å²	20	59.6 Å²	59.6	17%	0.165	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-61.6	-25.3	-178.5	0	0	0	0	0	112.5	A166 A167 L171 D172 L175 A180 R245	A166-A169 PolarHBondContact O-N 2.95Å; A167-A169 VanDerWaalsContact C-N 3.31Å; A167-A169 PolarHBondContact O-N 3.25Å; A169-L171 PolarHBondContact O-N 3.22Å; A169-D172 PolarHBondContact O-N 3.04Å; A169-L175 HydrophobicContact CB-CD1 3.8Å; A169-A180 WeakPolarHBondContact O-CB 3.14Å; A169-R245 PolarHBondContact O-NH1 2.7Å
170	L	94.9	Very high	92.7	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-61.4	-28.3	176.7	-59.3	172.5	0	0	0	113.2	A167 R168 A180 T181 V184 V216 V220 L242 R245 I249	A167-L170 HydrophobicContact CB-CD1 4.1Å; A167-L170 WeakPolarHBondContact O-CB 3.46Å; A167-L170 PolarHBondContact O-N 3.2Å; R168-L170 PolarHBondContact O-N 3.19Å; R168-L170 VanDerWaalsContact O-N 3.17Å; L170-A180 VanDerWaalsContact CD2-O 3.29Å; L170-A180 WeakPolarHBondContact CD2-O 3.4Å; L170-T181 HydrophobicContact CD2-CG2 3.66Å; L170-V184 HydrophobicContact CD1-CG2 4.28Å; L170-V184 HydrophobicContact CG-CG2 4.46Å; L170-V216 HydrophobicContact CD1-CG1 3.76Å; L170-V220 HydrophobicContact CB-CG2 4.28Å; L170-V220 HydrophobicContact CD1-CG2 3.68Å; L170-L242 HydrophobicContact CB-CD2 4.38Å; L170-L242 VanDerWaalsContact O-CD2 3.31Å; L170-L242 WeakPolarHBondContact O-CD2 3.4Å; L170-R245 HydrophobicContact CD2-CB 4.11Å; L170-R245 VanDerWaalsContact O-CD 3.32Å; L170-R245 WeakPolarHBondContact O-CD 3.49Å; L170-R245 PolarHBondContact O-NH1 2.75Å; L170-I249 HydrophobicContact CD1-CD1 4.17Å; L170-I249 HydrophobicContact CD2-CD1 3.94Å
171	L	92.9	Very high	92.9	Very high	27 Å²	27	57.2 Å²	57.2	14%	0.141	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-90.6	-12.2	-178.4	-64.7	162.8	0	0	0	113.3	R168 A169 I173 F219 V220 S223 L224 L238 L242	R168-L171 PolarHBondContact O-N 3.14Å; R168-L171 VanDerWaalsContact O-N 3.11Å; A169-L171 PolarHBondContact O-N 3.22Å; L171-I173 PolarHBondContact O-N 3.32Å; L171-F219 HydrophobicContact CD1-CE1 3.83Å; L171-F219 HydrophobicContact CD1-CZ 4.2Å; L171-V220 HydrophobicContact CD2-CG1 4.3Å; L171-S223 VanDerWaalsContact CD1-CB 3.43Å; L171-L224 HydrophobicContact CD2-CD2 4.07Å; L171-L224 HydrophobicContact CD2-CG 4.33Å; L171-L238 WeakPolarHBondContact O-CD1 3.06Å; L171-L242 HydrophobicContact CD2-CD1 4.26Å; L171-L242 HydrophobicContact CD2-CD2 4.28Å
172	D	90	Very high	93.2	Very high	64 Å²	64	54.6 Å²	54.6	34%	0.342	28%	0.28	S	S	.	.			trans	-78.5	110.2	-175.3	-171	-33.3	0	0	0	111.4	A169 H174 L175 R245	A169-D172 PolarHBondContact O-N 3.04Å; D172-H174 PolarHBondContact O-N 3.08Å; D172-H174 WeakPolarHBondContact OD1-CA 3.26Å; D172-H174 VanDerWaalsContact OD1-CB 3.3Å; D172-H174 WeakPolarHBondContact OD1-CB 3.35Å; D172-H174 IonicContact OD1-CD2 3.58Å; D172-H174 IonicContact OD1-CG 3.82Å; D172-H174 PolarHBondContact OD1-N 2.9Å; D172-L175 HydrophobicContact CB-CB 4.3Å; D172-L175 HydrophobicContact CB-CD1 3.93Å; D172-L175 HydrophobicContact CB-CG 3.96Å; D172-L175 PolarHBondContact OD1-N 2.79Å; D172-R245 VanDerWaalsContact O-CZ 3.31Å; D172-R245 PolarHBondContact O-NH1 2.71Å; D172-R245 PolarHBondContact O-NH2 3.5Å
173	I	89.7	Confident	93.3	Very high	35 Å²	35	56 Å²	56	18%	0.179	29%	0.285	C	S	.	.	S	Bend	trans	-73	-6.7	-179.3	63.8	170.9	0	0	0	114.4	L171 R237 L238	L171-I173 PolarHBondContact O-N 3.32Å; I173-R237 PolarHBondContact O-NE 3.23Å; I173-R237 PolarHBondContact O-NH2 2.89Å; I173-L238 HydrophobicContact CG2-CB 3.92Å; I173-L238 HydrophobicContact CG2-CD1 3.86Å; I173-L238 HydrophobicContact CG2-CG 4.46Å
174	H	89.6	Confident	93.4	Very high	155 Å²	155	55.9 Å²	55.9	72%	0.718	29%	0.285	S	S	*	.	S	Bend	trans	-99	-25.3	178.8	-54	-78.3	0	0	0	112.7	D172	D172-H174 PolarHBondContact O-N 3.08Å; D172-H174 WeakPolarHBondContact OD1-CA 3.26Å; D172-H174 VanDerWaalsContact OD1-CB 3.3Å; D172-H174 WeakPolarHBondContact OD1-CB 3.35Å; D172-H174 IonicContact OD1-CD2 3.58Å; D172-H174 IonicContact OD1-CG 3.82Å; D172-H174 PolarHBondContact OD1-N 2.9Å
175	L	92	Very high	93.7	Very high	68 Å²	68	53.4 Å²	53.4	36%	0.356	28%	0.277	S	S	.	.	S	Bend	trans	-67.9	151.7	167.7	-67.2	-179.4	0	0	0	111.4	A169 D172 A180 R245	A169-L175 HydrophobicContact CB-CD1 3.8Å; D172-L175 HydrophobicContact CB-CB 4.3Å; D172-L175 HydrophobicContact CB-CD1 3.93Å; D172-L175 HydrophobicContact CB-CG 3.96Å; D172-L175 PolarHBondContact OD1-N 2.79Å; L175-A180 HydrophobicContact CB-CB 4.14Å; L175-R245 PolarHBondContact O-NH2 2.97Å
176	N	93.9	Very high	94	Very high	81 Å²	81	56 Å²	56	43%	0.433	28%	0.284	S	S	.	.			trans	-79.8	158.7	166.8	69.7	70.9	0	0	0	110.5	H178 D179 A180	N176-H178 VanDerWaalsContact C-N 3.27Å; N176-H178 PolarHBondContact O-N 2.85Å; N176-H178 WeakPolarHBondContact OD1-CB 3.4Å; N176-H178 PolarHBondContact OD1-N 3.17Å; N176-D179 PolarHBondContact ND2-OD2 3.31Å; N176-D179 PolarHBondContact O-N 3.03Å; N176-D179 PolarHBondContact OD1-N 2.89Å; N176-A180 WeakPolarHBondContact O-CB 3.46Å; N176-A180 PolarHBondContact O-N 2.8Å
177	D	93.1	Very high	94.1	Very high	57 Å²	57	56.2 Å²	56.2	31%	0.305	28%	0.283	S	S	.	.	H	α-helix	trans	-69.3	-22	-170.5	-55.7	-42.8	0	0	0	114.3	T181 R245	D177-T181 WeakPolarHBondContact O-CB 3.34Å; D177-T181 WeakPolarHBondContact O-CG2 3.44Å; D177-T181 PolarHBondContact O-N 2.6Å; D177-T181 PolarHBondContact O-OG1 2.85Å; D177-R245 HydrophobicContact CB-CG 3.97Å; D177-R245 IonicContact OD1-CZ 3.07Å; D177-R245 IonicContact OD1-NE 3.6Å; D177-R245 PolarHBondContact OD1-NE 2.9Å; D177-R245 IonicContact OD1-NH2 3.32Å; D177-R245 PolarHBondContact OD1-NH2 3.41Å
178	H	93.3	Very high	94.2	Very high	138 Å²	138	56.2 Å²	56.2	64%	0.639	28%	0.284	S	S	*	.	H	α-helix	trans	-70.3	-55.1	173.8	173.4	-85.8	0	0	0	110.2	N176 A180 T181 G182	N176-H178 VanDerWaalsContact C-N 3.27Å; N176-H178 PolarHBondContact O-N 2.85Å; N176-H178 WeakPolarHBondContact OD1-CB 3.4Å; N176-H178 PolarHBondContact OD1-N 3.17Å; H178-A180 VanDerWaalsContact C-N 3.32Å; H178-A180 PolarHBondContact O-N 2.7Å; H178-T181 PolarHBondContact O-N 2.71Å; H178-T181 VanDerWaalsContact O-N 3.13Å; H178-T181 PolarHBondContact O-OG1 3.2Å; H178-G182 PolarHBondContact O-N 3.11Å
179	D	93.9	Very high	94.3	Very high	87 Å²	87	50.5 Å²	50.5	47%	0.465	26%	0.264	S	S	.	.	H	α-helix	trans	-70.1	-33.4	-176.9	-58.9	-18.7	0	0	0	111.1	N176 T181 G182	N176-D179 PolarHBondContact ND2-OD2 3.31Å; N176-D179 PolarHBondContact O-N 3.03Å; N176-D179 PolarHBondContact OD1-N 2.89Å; D179-T181 VanDerWaalsContact C-N 3.26Å; D179-T181 PolarHBondContact O-N 3.08Å; D179-G182 PolarHBondContact O-N 3.12Å
180	A	93.8	Very high	94.4	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.008	27%	0.268	C	S	.	.	H	α-helix	trans	-62.5	-26.7	172.1	0	0	0	0	0	114.1	A169 L170 L175 N176 H178 R245	A169-A180 WeakPolarHBondContact O-CB 3.14Å; L170-A180 VanDerWaalsContact CD2-O 3.29Å; L170-A180 WeakPolarHBondContact CD2-O 3.4Å; L175-A180 HydrophobicContact CB-CB 4.14Å; N176-A180 WeakPolarHBondContact O-CB 3.46Å; N176-A180 PolarHBondContact O-N 2.8Å; H178-A180 VanDerWaalsContact C-N 3.32Å; H178-A180 PolarHBondContact O-N 2.7Å; A180-R245 HydrophobicContact CB-CG 4.4Å; A180-R245 VanDerWaalsContact CB-CZ 3.48Å
181	T	96.9	Very high	94.5	Very high	3 Å²	3	51.4 Å²	51.4	2%	0.018	27%	0.268	C	S	.	.	H	α-helix	trans	-102.9	-14.2	178.2	54.6	0	0	0	0	113.9	L170 D177 H178 D179 D183 V184 I185 R245 I249	L170-T181 HydrophobicContact CD2-CG2 3.66Å; D177-T181 WeakPolarHBondContact O-CB 3.34Å; D177-T181 WeakPolarHBondContact O-CG2 3.44Å; D177-T181 PolarHBondContact O-N 2.6Å; D177-T181 PolarHBondContact O-OG1 2.85Å; H178-T181 PolarHBondContact O-N 2.71Å; H178-T181 VanDerWaalsContact O-N 3.13Å; H178-T181 PolarHBondContact O-OG1 3.2Å; D179-T181 VanDerWaalsContact C-N 3.26Å; D179-T181 PolarHBondContact O-N 3.08Å; T181-D183 PolarHBondContact O-N 3.29Å; T181-V184 PolarHBondContact O-N 3.11Å; T181-I185 WeakPolarHBondContact O-CB 3.38Å; T181-I185 WeakPolarHBondContact O-CG1 3.32Å; T181-I185 PolarHBondContact O-N 3.46Å; T181-R245 HydrophobicContact CG2-CB 3.58Å; T181-R245 HydrophobicContact CG2-CG 3.87Å; T181-R245 WeakPolarHBondContact CG2-O 3.49Å; T181-I249 HydrophobicContact CG2-CG1 4.36Å
182	G	96.6	Very high	94.5	Very high	27 Å²	27	50.3 Å²	50.3	28%	0.278	26%	0.262	S	S	.	.	H	α-helix	trans	-53.2	-54.9	-171.4	0	0	0	0	0	114	H178 D179 V184 I185 H186	H178-G182 PolarHBondContact O-N 3.11Å; D179-G182 PolarHBondContact O-N 3.12Å; G182-V184 PolarHBondContact O-N 2.98Å; G182-I185 PolarHBondContact O-N 2.56Å; G182-H186 WeakPolarHBondContact O-CB 3.43Å; G182-H186 PolarHBondContact O-N 2.88Å
183	D	96.6	Very high	94.6	Very high	104 Å²	104	53.5 Å²	53.5	56%	0.556	27%	0.269	S	S	*	.	H	α-helix	trans	-63.8	-38.9	-177.3	-76.3	-21.3	0	0	0	112.9	A166 T181 L187	A166-D183 HydrophobicContact CB-CB 3.7Å; T181-D183 PolarHBondContact O-N 3.29Å; D183-L187 VanDerWaalsContact O-CB 3.3Å; D183-L187 WeakPolarHBondContact O-CB 3.31Å; D183-L187 PolarHBondContact O-N 3.3Å
184	V	97.4	Very high	94.8	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-67.7	-46.3	178.4	178.7	0	0	0	0	110.4	A166 A167 L170 T181 G182 L187 L188 V216 I249	A166-V184 HydrophobicContact CB-CG2 3.92Å; A167-V184 HydrophobicContact CB-CG2 4.36Å; L170-V184 HydrophobicContact CD1-CG2 4.28Å; L170-V184 HydrophobicContact CG-CG2 4.46Å; T181-V184 PolarHBondContact O-N 3.11Å; G182-V184 PolarHBondContact O-N 2.98Å; V184-L187 PolarHBondContact O-N 3.48Å; V184-L188 HydrophobicContact CG1-CD1 4.14Å; V184-L188 WeakPolarHBondContact O-CB 3.3Å; V184-L188 VanDerWaalsContact O-CG 3.28Å; V184-L188 WeakPolarHBondContact O-CG 3.43Å; V184-L188 PolarHBondContact O-N 2.89Å; V184-V216 HydrophobicContact CG1-CG2 3.86Å; V184-I249 HydrophobicContact CG1-CD1 4Å; V184-I249 HydrophobicContact CG1-CG1 4.5Å
185	I	97.5	Very high	94.9	Very high	31 Å²	31	46 Å²	46	16%	0.159	23%	0.234	C	C	.	.	H	α-helix	trans	-65.4	-40.4	177.8	-70.9	175.2	0	0	0	111	T181 G182 L188 D189 I249 F252	T181-I185 WeakPolarHBondContact O-CB 3.38Å; T181-I185 WeakPolarHBondContact O-CG1 3.32Å; T181-I185 PolarHBondContact O-N 3.46Å; G182-I185 PolarHBondContact O-N 2.56Å; I185-L188 PolarHBondContact O-N 2.97Å; I185-D189 PolarHBondContact O-N 2.82Å; I185-I249 HydrophobicContact CD1-CG1 4.41Å; I185-I249 HydrophobicContact CG1-CG1 4.15Å; I185-F252 HydrophobicContact CD1-CB 4.44Å; I185-F252 HydrophobicContact CG1-CB 4.37Å; I185-F252 HydrophobicContact CG1-CG 4.48Å; I185-F252 HydrophobicContact CG2-CB 4.42Å; I185-F252 HydrophobicContact CG2-CD1 4.48Å; I185-F252 HydrophobicContact CG2-CD2 3.61Å; I185-F252 HydrophobicContact CG2-CE2 4Å; I185-F252 HydrophobicContact CG2-CG 3.88Å
186	H	96.7	Very high	94.8	Very high	118 Å²	118	48.2 Å²	48.2	55%	0.546	24%	0.237	S	C	.	.	H	α-helix	trans	-67	-39.7	176.9	177.6	-116.2	0	0	0	112.6	G182 D189 T190	G182-H186 WeakPolarHBondContact O-CB 3.43Å; G182-H186 PolarHBondContact O-N 2.88Å; H186-D189 PolarHBondContact O-N 3.4Å; H186-T190 WeakPolarHBondContact NE2-CG2 3.04Å; H186-T190 WeakPolarHBondContact O-CB 3.44Å; H186-T190 WeakPolarHBondContact O-CG2 3.39Å; H186-T190 PolarHBondContact O-N 3.19Å; H186-T190 PolarHBondContact O-OG1 2.91Å
187	L	96.8	Very high	94.5	Very high	13 Å²	13	48.6 Å²	48.6	7%	0.068	24%	0.239	C	C	.	.	H	α-helix	trans	-65.1	-40.8	173.8	-177.9	60.1	0	0	0	111.5	L159 V162 I163 D183 V184 T190 T191	L159-L187 HydrophobicContact CD2-CD1 4.16Å; V162-L187 HydrophobicContact CB-CD2 4.13Å; V162-L187 HydrophobicContact CG1-CD1 4.17Å; V162-L187 HydrophobicContact CG1-CD2 3.99Å; I163-L187 HydrophobicContact CB-CD2 3.59Å; I163-L187 HydrophobicContact CD1-CD2 4.26Å; I163-L187 HydrophobicContact CG1-CD2 3.9Å; D183-L187 VanDerWaalsContact O-CB 3.3Å; D183-L187 WeakPolarHBondContact O-CB 3.31Å; D183-L187 PolarHBondContact O-N 3.3Å; V184-L187 PolarHBondContact O-N 3.48Å; L187-T190 PolarHBondContact O-OG1 3.05Å; L187-T191 WeakPolarHBondContact O-CB 3.2Å; L187-T191 PolarHBondContact O-N 2.97Å; L187-T191 PolarHBondContact O-OG1 3.19Å
188	L	96.4	Very high	94.4	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-64.5	-48.2	174.7	-71.1	168.4	0	0	0	111.5	V184 I185 M192 L212 L213 I249 F252	V184-L188 HydrophobicContact CG1-CD1 4.14Å; V184-L188 WeakPolarHBondContact O-CB 3.3Å; V184-L188 VanDerWaalsContact O-CG 3.28Å; V184-L188 WeakPolarHBondContact O-CG 3.43Å; V184-L188 PolarHBondContact O-N 2.89Å; I185-L188 PolarHBondContact O-N 2.97Å; L188-M192 VanDerWaalsContact O-CB 3.3Å; L188-M192 WeakPolarHBondContact O-CB 3.26Å; L188-M192 WeakPolarHBondContact O-CG 3.4Å; L188-M192 PolarHBondContact O-N 3.26Å; L188-L212 HydrophobicContact CD2-CB 3.81Å; L188-L212 HydrophobicContact CD2-CD1 4.11Å; L188-L213 HydrophobicContact CD1-CD2 4.43Å; L188-I249 HydrophobicContact CD1-CG2 4.1Å; L188-F252 HydrophobicContact CB-CD1 4.24Å; L188-F252 HydrophobicContact CB-CE1 3.67Å; L188-F252 HydrophobicContact CB-CZ 4.49Å; L188-F252 HydrophobicContact CD1-CD1 4.4Å
189	D	95.5	Very high	94.2	Very high	31 Å²	31	39.7 Å²	39.7	17%	0.166	20%	0.197	C	C	.	.	H	α-helix	trans	-60.1	-55.6	178.5	-176.4	81.6	0	0	0	112	I185 H186 T191 M192 R193 F252	I185-D189 PolarHBondContact O-N 2.82Å; H186-D189 PolarHBondContact O-N 3.4Å; D189-T191 VanDerWaalsContact C-N 3.27Å; D189-T191 PolarHBondContact O-N 2.77Å; D189-M192 PolarHBondContact O-N 3.31Å; D189-R193 WeakPolarHBondContact O-CB 3.3Å; D189-R193 PolarHBondContact O-N 2.95Å; D189-R193 IonicContact OD1-CZ 2.83Å; D189-R193 IonicContact OD1-NE 2.62Å; D189-R193 IonicContact OD1-NH2 2.78Å; D189-R193 PolarHBondContact OD1-NH2 2.91Å; D189-R193 IonicContact OD2-CZ 2.71Å; D189-R193 IonicContact OD2-NE 3.44Å; D189-R193 PolarHBondContact OD2-NE 3.01Å; D189-R193 IonicContact OD2-NH2 3.93Å; D189-R193 PolarHBondContact OD2-NH2 3.25Å; D189-F252 HydrophobicContact CB-CE2 4.01Å; D189-F252 HydrophobicContact CB-CZ 3.62Å
190	T	95.9	Very high	94.1	Very high	39 Å²	39	35.7 Å²	35.7	24%	0.239	18%	0.176	C	C	.	.	H	α-helix	trans	-58.9	-40.3	-176.5	53.7	0	0	0	0	111.9	K113 H186 L187 Q194	K113-T190 PolarHBondContact NZ-OG1 3.17Å; H186-T190 WeakPolarHBondContact NE2-CG2 3.04Å; H186-T190 WeakPolarHBondContact O-CB 3.44Å; H186-T190 WeakPolarHBondContact O-CG2 3.39Å; H186-T190 PolarHBondContact O-N 3.19Å; H186-T190 PolarHBondContact O-OG1 2.91Å; L187-T190 PolarHBondContact O-OG1 3.05Å; T190-Q194 WeakPolarHBondContact O-CB 3.36Å; T190-Q194 PolarHBondContact O-N 3.38Å
191	T	95.8	Very high	93.9	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-72	-43.6	-178.9	-52.6	0	0	0	0	112	K113 I117 L159 L187 D189 A195 L208 L212	K113-T191 PolarHBondContact NZ-OG1 3.11Å; K113-T191 VanDerWaalsContact NZ-OG1 3.11Å; I117-T191 HydrophobicContact CD1-CG2 3.92Å; L159-T191 HydrophobicContact CD1-CG2 3.83Å; L159-T191 HydrophobicContact CD2-CG2 4.06Å; L187-T191 WeakPolarHBondContact O-CB 3.2Å; L187-T191 PolarHBondContact O-N 2.97Å; L187-T191 PolarHBondContact O-OG1 3.19Å; D189-T191 VanDerWaalsContact C-N 3.27Å; D189-T191 PolarHBondContact O-N 2.77Å; T191-A195 WeakPolarHBondContact O-CB 3.45Å; T191-A195 PolarHBondContact O-N 2.83Å; T191-L208 HydrophobicContact CG2-CD2 4.17Å; T191-L212 HydrophobicContact CG2-CD1 4.23Å
192	M	93.5	Very high	93.5	Very high	4 Å²	4	39.7 Å²	39.7	2%	0.02	21%	0.206	C	C	.	.	H	α-helix	trans	-71.2	-32.6	176.2	-66.4	-64.2	104.5	0	0	112.5	L188 D189 A195 R196 T205 L208 C209 L212 M256	L188-M192 VanDerWaalsContact O-CB 3.3Å; L188-M192 WeakPolarHBondContact O-CB 3.26Å; L188-M192 WeakPolarHBondContact O-CG 3.4Å; L188-M192 PolarHBondContact O-N 3.26Å; D189-M192 PolarHBondContact O-N 3.31Å; M192-A195 PolarHBondContact O-N 2.91Å; M192-R196 WeakPolarHBondContact O-CG 3.42Å; M192-R196 PolarHBondContact O-N 3.21Å; M192-R196 VanDerWaalsContact O-N 3.09Å; M192-T205 HydrophobicContact SD-CG2 3.65Å; M192-L208 HydrophobicContact CE-CB 4.22Å; M192-L208 HydrophobicContact CE-CD2 3.8Å; M192-L208 HydrophobicContact CE-CG 3.85Å; M192-C209 HydrophobicContact CE-CB 4.23Å; M192-C209 HydrophobicContact SD-CB 3.85Å; M192-L212 HydrophobicContact CE-CD1 3.99Å; M192-M256 HydrophobicContact CB-CE 3.4Å; M192-M256 VanDerWaalsContact CB-CE 3.4Å; M192-M256 HydrophobicContact CG-CE 4.1Å
193	R	92.4	Very high	93.1	Very high	131 Å²	131	40.4 Å²	40.4	49%	0.494	21%	0.21	S	C	.	.	H	α-helix	trans	-64.7	-46.9	173.4	-176.8	-178.4	-59.5	-84.3	-7.5	110.7	D189 R196 I197	D189-R193 WeakPolarHBondContact O-CB 3.3Å; D189-R193 PolarHBondContact O-N 2.95Å; D189-R193 IonicContact OD1-CZ 2.83Å; D189-R193 IonicContact OD1-NE 2.62Å; D189-R193 IonicContact OD1-NH2 2.78Å; D189-R193 PolarHBondContact OD1-NH2 2.91Å; D189-R193 IonicContact OD2-CZ 2.71Å; D189-R193 IonicContact OD2-NE 3.44Å; D189-R193 PolarHBondContact OD2-NE 3.01Å; D189-R193 IonicContact OD2-NH2 3.93Å; D189-R193 PolarHBondContact OD2-NH2 3.25Å; R193-R196 PolarHBondContact O-N 3.14Å; R193-I197 HydrophobicContact CG-CD1 3.97Å; R193-I197 VanDerWaalsContact O-CG1 3.31Å; R193-I197 WeakPolarHBondContact O-CG1 3.17Å; R193-I197 PolarHBondContact O-N 3.33Å
194	Q	92.6	Very high	92.9	Very high	33 Å²	33	35.5 Å²	35.5	15%	0.154	18%	0.183	C	C	.	.	H	α-helix	trans	-63.1	-41.8	175	-175.1	68.2	-7.4	0	0	111.8	D114 I117 T190 R196 I197 C198	D114-Q194 HydrophobicContact CB-CG 4.12Å; D114-Q194 WeakPolarHBondContact OD1-CG 3.33Å; I117-Q194 HydrophobicContact CB-CG 4.31Å; I117-Q194 HydrophobicContact CD1-CB 4.18Å; I117-Q194 HydrophobicContact CD1-CG 4.08Å; I117-Q194 HydrophobicContact CG2-CG 4.01Å; T190-Q194 WeakPolarHBondContact O-CB 3.36Å; T190-Q194 PolarHBondContact O-N 3.38Å; Q194-R196 VanDerWaalsContact C-N 3.32Å; Q194-R196 PolarHBondContact O-N 3.31Å; Q194-I197 PolarHBondContact O-N 2.95Å; Q194-C198 WeakPolarHBondContact O-CB 3.45Å; Q194-C198 PolarHBondContact O-N 3.49Å; Q194-C198 PolarHBondContact O-SG 2.73Å
195	A	92.6	Very high	92.7	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-55.6	-45.6	174.5	0	0	0	0	0	112.3	I117 T191 M192 G199 L200 T205	I117-A195 HydrophobicContact CG2-CB 4.27Å; T191-A195 WeakPolarHBondContact O-CB 3.45Å; T191-A195 PolarHBondContact O-N 2.83Å; M192-A195 PolarHBondContact O-N 2.91Å; A195-G199 PolarHBondContact O-N 2.91Å; A195-L200 HydrophobicContact CB-CB 4.15Å; A195-L200 HydrophobicContact CB-CD2 3.9Å; A195-L200 VanDerWaalsContact O-CB 3.26Å; A195-L200 WeakPolarHBondContact O-CB 3.48Å; A195-L200 PolarHBondContact O-N 3.09Å; A195-T205 HydrophobicContact CB-CG2 4.24Å
196	R	89.8	Confident	92.3	Very high	113 Å²	113	38.9 Å²	38.9	43%	0.426	20%	0.201	S	C	.	.	H	α-helix	trans	-65.9	-41.8	175.3	-67.9	171.9	-172.8	148.5	-1.6	112.6	M192 R193 Q194 G199 M256	M192-R196 WeakPolarHBondContact O-CG 3.42Å; M192-R196 PolarHBondContact O-N 3.21Å; M192-R196 VanDerWaalsContact O-N 3.09Å; R193-R196 PolarHBondContact O-N 3.14Å; Q194-R196 VanDerWaalsContact C-N 3.32Å; Q194-R196 PolarHBondContact O-N 3.31Å; R196-G199 PolarHBondContact O-N 3.09Å; R196-M256 VanDerWaalsContact NH1-CE 3.26Å; R196-M256 PolarHBondContact NH1-SD 3.02Å; R196-M256 PolarHBondContact NH2-O 2.64Å; R196-M256 PolarHBondContact NH2-SD 3.1Å; R196-M256 VanDerWaalsContact NH2-SD 3.4Å
197	I	88.4	Confident	92.1	Very high	90 Å²	90	34.4 Å²	34.4	46%	0.462	18%	0.181	S	C	.	.	H	α-helix	trans	-63.5	-40.3	178.7	-71.8	166.7	0	0	0	111.6	R70 R193 Q194 G199	R70-I197 WeakPolarHBondContact CG-O 3.32Å; R193-I197 HydrophobicContact CG-CD1 3.97Å; R193-I197 VanDerWaalsContact O-CG1 3.31Å; R193-I197 WeakPolarHBondContact O-CG1 3.17Å; R193-I197 PolarHBondContact O-N 3.33Å; Q194-I197 PolarHBondContact O-N 2.95Å; I197-G199 PolarHBondContact O-N 3.3Å
198	C	90.4	Very high	92	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-6.3	178.1	-70.5	0	0	0	0	114.2	I117 A121 Q194	I117-C198 HydrophobicContact CG2-CB 4.06Å; A121-C198 HydrophobicContact CB-CB 4.2Å; A121-C198 WeakPolarHBondContact CB-O 3.49Å; Q194-C198 WeakPolarHBondContact O-CB 3.45Å; Q194-C198 PolarHBondContact O-N 3.49Å; Q194-C198 PolarHBondContact O-SG 2.73Å
199	G	88.5	Confident	91.9	Very high	7 Å²	7	33.8 Å²	33.8	7%	0.072	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.2	34.5	-174.4	0	0	0	0	0	113.3	A195 R196 I197 Y360	A195-G199 PolarHBondContact O-N 2.91Å; R196-G199 PolarHBondContact O-N 3.09Å; I197-G199 PolarHBondContact O-N 3.3Å; G199-Y360 WeakPolarHBondContact O-CB 3.34Å; G199-Y360 WeakPolarHBondContact O-CD2 3.47Å
200	L	91.9	Very high	91.8	Very high	3 Å²	3	32.5 Å²	32.5	2%	0.016	17%	0.171	C	C	.	.			trans	-67.8	134.3	174.3	-172.3	65	0	0	0	110	L120 A121 A195 L204	L120-L200 HydrophobicContact CB-CD1 4.31Å; L120-L200 HydrophobicContact CD2-CD1 3.8Å; L120-L200 HydrophobicContact CD2-CD2 4.11Å; L120-L200 HydrophobicContact CG-CD1 3.78Å; A121-L200 HydrophobicContact CB-CB 4.25Å; A121-L200 HydrophobicContact CB-CD1 4.09Å; A195-L200 HydrophobicContact CB-CB 4.15Å; A195-L200 HydrophobicContact CB-CD2 3.9Å; A195-L200 VanDerWaalsContact O-CB 3.26Å; A195-L200 WeakPolarHBondContact O-CB 3.48Å; A195-L200 PolarHBondContact O-N 3.09Å; L200-L204 HydrophobicContact CD1-CB 3.91Å; L200-L204 HydrophobicContact CD1-CD1 3.82Å; L200-L204 HydrophobicContact CD2-CB 4.18Å; L200-L204 HydrophobicContact CG-CB 3.93Å
201	N	90.2	Very high	91.8	Very high	21 Å²	21	31.9 Å²	31.9	11%	0.112	17%	0.166	C	C	.	.			trans	-55.2	142.6	177.3	179.8	-71.5	0	0	0	111.8	A203 L204 T205 P356 D358	N201-A203 VanDerWaalsContact C-N 3.32Å; N201-A203 PolarHBondContact O-N 3.34Å; N201-A203 WeakPolarHBondContact OD1-CB 3.32Å; N201-A203 PolarHBondContact OD1-N 2.74Å; N201-L204 HydrophobicContact CB-CD1 4.45Å; N201-L204 PolarHBondContact O-N 3.35Å; N201-L204 VanDerWaalsContact O-N 3.12Å; N201-T205 PolarHBondContact O-N 2.95Å; N201-T205 PolarHBondContact O-OG1 3.34Å; N201-P356 HydrophobicContact CB-CB 4.28Å; N201-P356 HydrophobicContact CB-CG 3.81Å; N201-P356 VanDerWaalsContact CG-CB 3.46Å; N201-P356 WeakPolarHBondContact ND2-CB 3.31Å; N201-P356 WeakPolarHBondContact OD1-CB 3.35Å; N201-P356 VanDerWaalsContact OD1-CG 3.29Å; N201-P356 WeakPolarHBondContact OD1-CG 3.5Å; N201-D358 PolarHBondContact ND2-O 3.1Å
202	A	87.9	Confident	91.8	Very high	67 Å²	67	32 Å²	32	55%	0.554	17%	0.166	S	C	*	.	H	α-helix	trans	-57.6	-38.8	-177.4	0	0	0	0	0	113.4	T205 I206	A202-T205 WeakPolarHBondContact O-CB 3.06Å; A202-T205 PolarHBondContact O-N 2.96Å; A202-I206 VanDerWaalsContact O-CG1 3.28Å; A202-I206 WeakPolarHBondContact O-CG1 3.23Å; A202-I206 PolarHBondContact O-N 3.03Å
203	A	88.9	Confident	91.9	Very high	43 Å²	43	31.8 Å²	31.8	36%	0.355	17%	0.165	S	C	.	.	H	α-helix	trans	-71.4	-29.4	178.3	0	0	0	0	0	113.1	N201 Q207 P356	N201-A203 VanDerWaalsContact C-N 3.32Å; N201-A203 PolarHBondContact O-N 3.34Å; N201-A203 WeakPolarHBondContact OD1-CB 3.32Å; N201-A203 PolarHBondContact OD1-N 2.74Å; A203-Q207 WeakPolarHBondContact O-CB 3.39Å; A203-Q207 WeakPolarHBondContact O-CG 3.1Å; A203-Q207 PolarHBondContact O-N 2.96Å; A203-Q207 VanDerWaalsContact O-N 3.11Å; A203-Q207 PolarHBondContact O-NE2 2.81Å; A203-P356 HydrophobicContact CB-CG 4.28Å
204	L	92.5	Very high	92	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-73.5	-35.7	169.1	-72.9	171.7	0	0	0	111.4	L200 N201 Q207 L208 F353 P356	L200-L204 HydrophobicContact CD1-CB 3.91Å; L200-L204 HydrophobicContact CD1-CD1 3.82Å; L200-L204 HydrophobicContact CD2-CB 4.18Å; L200-L204 HydrophobicContact CG-CB 3.93Å; N201-L204 HydrophobicContact CB-CD1 4.45Å; N201-L204 PolarHBondContact O-N 3.35Å; N201-L204 VanDerWaalsContact O-N 3.12Å; L204-Q207 PolarHBondContact O-N 2.67Å; L204-L208 WeakPolarHBondContact O-CB 3.2Å; L204-L208 PolarHBondContact O-N 3.33Å; L204-F353 HydrophobicContact CD2-CE2 3.63Å; L204-F353 HydrophobicContact CD2-CZ 3.64Å; L204-P356 HydrophobicContact CD1-CG 4Å; L204-P356 HydrophobicContact CG-CG 3.7Å
205	T	92.2	Very high	92.1	Very high	14 Å²	14	24.8 Å²	24.8	9%	0.086	14%	0.138	C	C	.	.	H	α-helix	trans	-65.4	-42.2	175.5	-54.6	0	0	0	0	111.5	M192 A195 N201 A202 L208 C209	M192-T205 HydrophobicContact SD-CG2 3.65Å; A195-T205 HydrophobicContact CB-CG2 4.24Å; N201-T205 PolarHBondContact O-N 2.95Å; N201-T205 PolarHBondContact O-OG1 3.34Å; A202-T205 WeakPolarHBondContact O-CB 3.06Å; A202-T205 PolarHBondContact O-N 2.96Å; T205-L208 PolarHBondContact O-N 2.99Å; T205-C209 WeakPolarHBondContact O-CB 2.95Å; T205-C209 PolarHBondContact O-N 2.77Å
206	I	90.3	Very high	92.3	Very high	88 Å²	88	25 Å²	25	45%	0.451	14%	0.14	S	C	.	.	H	α-helix	trans	-64.3	-45.8	173.9	-69	162.1	0	0	0	110.8	A202 L208 C209 G210 V258	A202-I206 VanDerWaalsContact O-CG1 3.28Å; A202-I206 WeakPolarHBondContact O-CG1 3.23Å; A202-I206 PolarHBondContact O-N 3.03Å; I206-L208 PolarHBondContact O-N 3.21Å; I206-C209 PolarHBondContact O-N 3.44Å; I206-G210 PolarHBondContact O-N 3.32Å; I206-V258 HydrophobicContact CG1-CG1 4.31Å
207	Q	92.7	Very high	92.6	Very high	24 Å²	24	19.6 Å²	19.6	11%	0.112	12%	0.119	C	C	.	.	H	α-helix	trans	-59.1	-44.8	175.1	-79.7	171.1	95.6	0	0	111.9	F152 A203 L204 G210 H211 L354	F152-Q207 HydrophobicContact CE2-CB 4.18Å; F152-Q207 HydrophobicContact CZ-CB 4Å; A203-Q207 WeakPolarHBondContact O-CB 3.39Å; A203-Q207 WeakPolarHBondContact O-CG 3.1Å; A203-Q207 PolarHBondContact O-N 2.96Å; A203-Q207 VanDerWaalsContact O-N 3.11Å; A203-Q207 PolarHBondContact O-NE2 2.81Å; L204-Q207 PolarHBondContact O-N 2.67Å; Q207-G210 PolarHBondContact O-N 2.88Å; Q207-H211 PolarHBondContact O-N 3.49Å; Q207-H211 PolarHBondContact O-ND1 3.47Å; Q207-L354 PolarHBondContact NE2-O 3.47Å
208	L	94.1	Very high	92.8	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-61.9	-44.4	177.1	-177.1	61	0	0	0	111.6	F152 L155 V156 L159 T191 M192 L204 T205 I206 H211 L212	F152-L208 HydrophobicContact CE2-CB 4.03Å; F152-L208 HydrophobicContact CE2-CD1 4.37Å; L155-L208 HydrophobicContact CD2-CD1 3.87Å; L155-L208 HydrophobicContact CD2-CD2 3.87Å; L155-L208 HydrophobicContact CG-CD1 4.08Å; V156-L208 HydrophobicContact CG2-CD1 4.3Å; L159-L208 HydrophobicContact CD1-CD1 3.88Å; T191-L208 HydrophobicContact CG2-CD2 4.17Å; M192-L208 HydrophobicContact CE-CB 4.22Å; M192-L208 HydrophobicContact CE-CD2 3.8Å; M192-L208 HydrophobicContact CE-CG 3.85Å; L204-L208 WeakPolarHBondContact O-CB 3.2Å; L204-L208 PolarHBondContact O-N 3.33Å; T205-L208 PolarHBondContact O-N 2.99Å; I206-L208 PolarHBondContact O-N 3.21Å; L208-H211 PolarHBondContact O-N 3.39Å; L208-L212 HydrophobicContact CG-CD1 4.2Å; L208-L212 WeakPolarHBondContact O-CD1 3.43Å; L208-L212 VanDerWaalsContact O-CG 3.31Å; L208-L212 WeakPolarHBondContact O-CG 3.37Å; L208-L212 PolarHBondContact O-N 2.93Å; L208-L212 VanDerWaalsContact O-N 3.11Å
209	C	94.2	Very high	93	Very high	2 Å²	2	16.8 Å²	16.8	1%	0.014	10%	0.104	C	C	.	.	H	α-helix	trans	-61.8	-43.4	175.9	-167.3	0	0	0	0	111.9	M192 T205 I206 H211 L212 L213	M192-C209 HydrophobicContact CE-CB 4.23Å; M192-C209 HydrophobicContact SD-CB 3.85Å; T205-C209 WeakPolarHBondContact O-CB 2.95Å; T205-C209 PolarHBondContact O-N 2.77Å; I206-C209 PolarHBondContact O-N 3.44Å; C209-H211 PolarHBondContact O-N 2.79Å; C209-L212 PolarHBondContact O-N 3.03Å; C209-L213 WeakPolarHBondContact O-CB 3.29Å; C209-L213 WeakPolarHBondContact O-CD1 3.49Å; C209-L213 VanDerWaalsContact O-CG 3.32Å; C209-L213 WeakPolarHBondContact O-CG 3.48Å; C209-L213 PolarHBondContact O-N 3.04Å; C209-L213 VanDerWaalsContact SG-CD1 3.58Å
210	G	94	Very high	93.2	Very high	3 Å²	3	16.5 Å²	16.5	3%	0.031	10%	0.101	C	C	.	.	H	α-helix	trans	-60.8	-41.5	177	0	0	0	0	0	113.4	I206 Q207 L213 H214 H265	I206-G210 PolarHBondContact O-N 3.32Å; Q207-G210 PolarHBondContact O-N 2.88Å; G210-L213 PolarHBondContact O-N 3.36Å; G210-H214 VanDerWaalsContact O-CB 3.25Å; G210-H214 WeakPolarHBondContact O-CB 3.06Å; G210-H214 PolarHBondContact O-N 3.02Å; G210-H265 WeakPolarHBondContact CA-CD2 3.36Å
211	H	94.6	Very high	93.4	Very high	27 Å²	27	16.4 Å²	16.4	13%	0.125	10%	0.1	C	C	.	.	H	α-helix	trans	-63.2	-42.2	173.4	-73.9	71.8	0	0	0	111.9	F152 V156 Q207 L208 C209 H214 M215	F152-H211 AromaticContact CE1-CE1 3.61Å; F152-H211 AromaticContact CE1-ND1 3.87Å; F152-H211 AromaticContact CE1-NE2 3.81Å; F152-H211 AromaticContact CZ-CE1 3.82Å; F152-H211 AromaticContact CZ-ND1 3.68Å; V156-H211 HydrophobicContact CG1-CB 4.27Å; V156-H211 HydrophobicContact CG2-CB 4.03Å; Q207-H211 PolarHBondContact O-N 3.49Å; Q207-H211 PolarHBondContact O-ND1 3.47Å; L208-H211 PolarHBondContact O-N 3.39Å; C209-H211 PolarHBondContact O-N 2.79Å; H211-H214 PolarHBondContact O-N 2.86Å; H211-M215 WeakPolarHBondContact O-CE 3.32Å; H211-M215 WeakPolarHBondContact O-CG 3.32Å; H211-M215 PolarHBondContact O-N 3.36Å
212	L	95.4	Very high	93.5	Very high	1 Å²	1	16.4 Å²	16.4	1%	0.005	10%	0.1	C	C	.	.	H	α-helix	trans	-63.9	-45.6	178.1	-68	162.8	0	0	0	112	L159 I163 L188 T191 M192 L208 C209 M215 V216	L159-L212 HydrophobicContact CB-CD2 3.76Å; L159-L212 HydrophobicContact CD1-CD1 4.42Å; L159-L212 HydrophobicContact CD1-CD2 3.97Å; L159-L212 HydrophobicContact CG-CD2 4.33Å; I163-L212 HydrophobicContact CD1-CB 3.91Å; I163-L212 HydrophobicContact CD1-CD2 3.72Å; I163-L212 HydrophobicContact CD1-CG 4.44Å; I163-L212 WeakPolarHBondContact CD1-O 3.08Å; L188-L212 HydrophobicContact CD2-CB 3.81Å; L188-L212 HydrophobicContact CD2-CD1 4.11Å; T191-L212 HydrophobicContact CG2-CD1 4.23Å; M192-L212 HydrophobicContact CE-CD1 3.99Å; L208-L212 HydrophobicContact CG-CD1 4.2Å; L208-L212 WeakPolarHBondContact O-CD1 3.43Å; L208-L212 VanDerWaalsContact O-CG 3.31Å; L208-L212 WeakPolarHBondContact O-CG 3.37Å; L208-L212 PolarHBondContact O-N 2.93Å; L208-L212 VanDerWaalsContact O-N 3.11Å; C209-L212 PolarHBondContact O-N 3.03Å; L212-M215 HydrophobicContact CD2-CE 3.78Å; L212-M215 HydrophobicContact CG-CE 4.36Å; L212-M215 PolarHBondContact O-N 2.98Å; L212-V216 WeakPolarHBondContact O-CG2 3.45Å; L212-V216 PolarHBondContact O-N 3Å; L212-V216 VanDerWaalsContact O-N 3.09Å
213	L	95.8	Very high	93.7	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-66.6	-38.9	177.7	-68.1	162.6	0	0	0	111.8	L188 C209 G210 V216 N217 I249 A261 A262 H265 L266	L188-L213 HydrophobicContact CD1-CD2 4.43Å; C209-L213 WeakPolarHBondContact O-CB 3.29Å; C209-L213 WeakPolarHBondContact O-CD1 3.49Å; C209-L213 VanDerWaalsContact O-CG 3.32Å; C209-L213 WeakPolarHBondContact O-CG 3.48Å; C209-L213 PolarHBondContact O-N 3.04Å; C209-L213 VanDerWaalsContact SG-CD1 3.58Å; G210-L213 PolarHBondContact O-N 3.36Å; L213-V216 PolarHBondContact O-N 3.49Å; L213-N217 PolarHBondContact O-N 2.93Å; L213-I249 HydrophobicContact CD2-CG2 4Å; L213-A261 HydrophobicContact CD1-CB 3.93Å; L213-A262 HydrophobicContact CD1-CB 4.03Å; L213-A262 HydrophobicContact CD2-CB 4.34Å; L213-H265 HydrophobicContact CB-CB 3.87Å; L213-L266 HydrophobicContact CB-CD2 4.3Å; L213-L266 HydrophobicContact CD2-CD1 4Å; L213-L266 HydrophobicContact CD2-CD2 4.2Å; L213-L266 HydrophobicContact CD2-CG 4.18Å; L213-L266 WeakPolarHBondContact O-CD2 3.3Å
214	H	95.3	Very high	93.9	Very high	4 Å²	4	12.1 Å²	12.1	2%	0.019	6%	0.063	C	C	.	.	H	α-helix	trans	-62.3	-42.9	172.3	171.5	72.4	0	0	0	112.1	G210 H211 V216 N217 A218 H265 S346 L349 Y694	G210-H214 VanDerWaalsContact O-CB 3.25Å; G210-H214 WeakPolarHBondContact O-CB 3.06Å; G210-H214 PolarHBondContact O-N 3.02Å; H211-H214 PolarHBondContact O-N 2.86Å; H214-V216 VanDerWaalsContact C-N 3.31Å; H214-V216 PolarHBondContact O-N 3.39Å; H214-N217 PolarHBondContact O-N 3.13Å; H214-N217 VanDerWaalsContact O-N 3.14Å; H214-A218 WeakPolarHBondContact O-CB 3.48Å; H214-A218 PolarHBondContact O-N 2.89Å; H214-H265 HydrophobicContact CB-CB 4.43Å; H214-S346 PolarHBondContact CE1-O 2.8Å; H214-S346 VanDerWaalsContact CE1-O 3.25Å; H214-S346 PolarHBondContact NE2-O 3.45Å; H214-S346 VanDerWaalsContact NE2-O 3.13Å; H214-L349 HydrophobicContact CB-CB 4.38Å; H214-L349 HydrophobicContact CB-CD1 4.31Å; H214-L349 HydrophobicContact CB-CD2 4.02Å; H214-L349 HydrophobicContact CB-CG 4.48Å; H214-L349 PolarHBondContact NE2-N 2.96Å; H214-Y694 PolarHBondContact CE1-OH 3.46Å; H214-Y694 PolarHBondContact ND1-OH 3.37Å
215	M	95	Very high	93.7	Very high	13 Å²	13	12.2 Å²	12.2	6%	0.064	6%	0.064	C	C	.	.	H	α-helix	trans	-64.3	-33.5	176.6	-72.6	-176.8	-66.8	0	0	112.8	V156 Q160 I163 H211 L212 F219	V156-M215 HydrophobicContact CG1-CE 4.02Å; V156-M215 HydrophobicContact CG1-SD 4.13Å; Q160-M215 HydrophobicContact CB-SD 3.48Å; Q160-M215 WeakPolarHBondContact CB-SD 3.41Å; Q160-M215 HydrophobicContact CG-SD 3.54Å; Q160-M215 VanDerWaalsContact CG-SD 3.54Å; I163-M215 HydrophobicContact CG2-CB 3.95Å; I163-M215 HydrophobicContact CG2-CE 4.18Å; I163-M215 HydrophobicContact CG2-SD 4.32Å; H211-M215 WeakPolarHBondContact O-CE 3.32Å; H211-M215 WeakPolarHBondContact O-CG 3.32Å; H211-M215 PolarHBondContact O-N 3.36Å; L212-M215 HydrophobicContact CD2-CE 3.78Å; L212-M215 HydrophobicContact CG-CE 4.36Å; L212-M215 PolarHBondContact O-N 2.98Å; M215-F219 VanDerWaalsContact O-CB 3.31Å; M215-F219 WeakPolarHBondContact O-CB 3.34Å; M215-F219 PolarHBondContact O-N 2.99Å; M215-F219 VanDerWaalsContact O-N 3.08Å
216	V	96	Very high	93.4	Very high	5 Å²	5	12.5 Å²	12.5	3%	0.03	7%	0.067	C	C	.	.	H	α-helix	trans	-65.2	-47.4	169.8	174.2	0	0	0	0	110.6	I163 L170 V184 L212 L213 H214 F219 V220 L266	I163-V216 HydrophobicContact CD1-CG2 3.66Å; I163-V216 HydrophobicContact CG1-CG2 3.77Å; L170-V216 HydrophobicContact CD1-CG1 3.76Å; V184-V216 HydrophobicContact CG1-CG2 3.86Å; L212-V216 WeakPolarHBondContact O-CG2 3.45Å; L212-V216 PolarHBondContact O-N 3Å; L212-V216 VanDerWaalsContact O-N 3.09Å; L213-V216 PolarHBondContact O-N 3.49Å; H214-V216 VanDerWaalsContact C-N 3.31Å; H214-V216 PolarHBondContact O-N 3.39Å; V216-F219 PolarHBondContact O-N 2.82Å; V216-V220 HydrophobicContact CG1-CG2 4.27Å; V216-V220 WeakPolarHBondContact O-CB 3.43Å; V216-V220 WeakPolarHBondContact O-CG2 3.33Å; V216-V220 PolarHBondContact O-N 2.77Å; V216-L266 HydrophobicContact CB-CD2 4.31Å; V216-L266 HydrophobicContact CG1-CD2 4.21Å
217	N	95.2	Very high	92.2	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-62.4	-48.5	178.6	176.1	83.3	0	0	0	112.6	L213 H214 F219 V220 F221 H265 L266 S269	L213-N217 PolarHBondContact O-N 2.93Å; H214-N217 PolarHBondContact O-N 3.13Å; H214-N217 VanDerWaalsContact O-N 3.14Å; N217-F219 VanDerWaalsContact C-N 3.33Å; N217-F219 PolarHBondContact O-N 2.88Å; N217-V220 PolarHBondContact O-N 3.48Å; N217-F221 WeakPolarHBondContact O-CB 3.17Å; N217-F221 PolarHBondContact O-N 2.77Å; N217-H265 WeakPolarHBondContact CB-O 3.37Å; N217-L266 HydrophobicContact CB-CD2 4.28Å; N217-S269 WeakPolarHBondContact CA-OG 3.41Å; N217-S269 PolarHBondContact O-OG 2.89Å; N217-S269 WeakPolarHBondContact OD1-CB 3.39Å; N217-S269 PolarHBondContact OD1-N 3.06Å; N217-S269 PolarHBondContact OD1-OG 3.18Å
218	A	93.8	Very high	90.5	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-59.8	-44.5	178.4	0	0	0	0	0	110.6	H214 N222	H214-A218 WeakPolarHBondContact O-CB 3.48Å; H214-A218 PolarHBondContact O-N 2.89Å; A218-N222 WeakPolarHBondContact O-CB 3.44Å; A218-N222 PolarHBondContact O-N 3.34Å; A218-N222 PolarHBondContact O-ND2 3.28Å; A218-N222 PolarHBondContact O-OD1 3.08Å
219	F	93.6	Very high	89.1	Confident	31 Å²	31	22.4 Å²	22.4	14%	0.136	13%	0.126	C	C	.	.	H	α-helix	trans	-63.8	-51.3	176.5	176	-95.7	0	0	0	113.1	R164 A167 R168 L171 M215 V216 N217 S223	R164-F219 HydrophobicContact CG-CD2 3.72Å; R164-F219 HydrophobicContact CG-CE2 4.16Å; R164-F219 HydrophobicContact CG-CG 4.37Å; A167-F219 HydrophobicContact CB-CD1 3.46Å; A167-F219 VanDerWaalsContact CB-CD1 3.46Å; A167-F219 HydrophobicContact CB-CE1 4.1Å; A167-F219 HydrophobicContact CB-CG 4.19Å; A167-F219 WeakPolarHBondContact O-CE1 3.27Å; R168-F219 HydrophobicContact CB-CZ 4.44Å; R168-F219 HydrophobicContact CG-CE1 4.04Å; R168-F219 HydrophobicContact CG-CE2 4.36Å; R168-F219 HydrophobicContact CG-CZ 3.57Å; L171-F219 HydrophobicContact CD1-CE1 3.83Å; L171-F219 HydrophobicContact CD1-CZ 4.2Å; M215-F219 VanDerWaalsContact O-CB 3.31Å; M215-F219 WeakPolarHBondContact O-CB 3.34Å; M215-F219 PolarHBondContact O-N 2.99Å; M215-F219 VanDerWaalsContact O-N 3.08Å; V216-F219 PolarHBondContact O-N 2.82Å; N217-F219 VanDerWaalsContact C-N 3.33Å; N217-F219 PolarHBondContact O-N 2.88Å; F219-S223 WeakPolarHBondContact CZ-OG 3.5Å; F219-S223 WeakPolarHBondContact O-CB 3.37Å; F219-S223 PolarHBondContact O-N 2.86Å; F219-S223 PolarHBondContact O-OG 2.81Å
220	V	94.4	Very high	87.6	Confident	1 Å²	1	25.7 Å²	25.7	1%	0.006	15%	0.147	C	C	.	.	H	α-helix	trans	-64.2	-49.2	-177.9	170	0	0	0	0	110.3	L170 L171 V216 N217 S223 L224 L242	L170-V220 HydrophobicContact CB-CG2 4.28Å; L170-V220 HydrophobicContact CD1-CG2 3.68Å; L171-V220 HydrophobicContact CD2-CG1 4.3Å; V216-V220 HydrophobicContact CG1-CG2 4.27Å; V216-V220 WeakPolarHBondContact O-CB 3.43Å; V216-V220 WeakPolarHBondContact O-CG2 3.33Å; V216-V220 PolarHBondContact O-N 2.77Å; N217-V220 PolarHBondContact O-N 3.48Å; V220-S223 PolarHBondContact O-N 3.15Å; V220-L224 HydrophobicContact CG1-CD1 4.48Å; V220-L224 WeakPolarHBondContact O-CG 3.34Å; V220-L224 PolarHBondContact O-N 2.56Å; V220-L242 HydrophobicContact CG1-CD2 3.98Å
221	F	94.7	Very high	85.7	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-64.5	-49.4	-178.9	-169.1	-84	0	0	0	112	N217 S223 L224 V225 R268 A272 L293 Q297 I301 E345	N217-F221 WeakPolarHBondContact O-CB 3.17Å; N217-F221 PolarHBondContact O-N 2.77Å; F221-S223 PolarHBondContact O-N 3.31Å; F221-L224 WeakPolarHBondContact O-CB 3.49Å; F221-L224 PolarHBondContact O-N 2.91Å; F221-V225 HydrophobicContact CD1-CG2 4.16Å; F221-V225 HydrophobicContact CE1-CG1 3.91Å; F221-V225 HydrophobicContact CE1-CG2 3.96Å; F221-V225 HydrophobicContact CZ-CG1 4.17Å; F221-V225 PolarHBondContact O-N 3.13Å; F221-R268 HydrophobicContact CD2-CB 3.88Å; F221-R268 HydrophobicContact CE2-CB 4.09Å; F221-A272 HydrophobicContact CD2-CB 4.09Å; F221-A272 HydrophobicContact CE2-CB 3.92Å; F221-L293 HydrophobicContact CE2-CD2 3.63Å; F221-L293 HydrophobicContact CZ-CD2 4.11Å; F221-Q297 HydrophobicContact CE1-CG 3.8Å; F221-Q297 VanDerWaalsContact CE1-NE2 3.33Å; F221-Q297 HydrophobicContact CZ-CB 3.97Å; F221-Q297 VanDerWaalsContact CZ-CD 3.43Å; F221-Q297 HydrophobicContact CZ-CG 3.63Å; F221-I301 HydrophobicContact CE2-CD1 4.38Å; F221-I301 HydrophobicContact CZ-CD1 4.37Å; F221-E345 HydrophobicContact CB-CG 4.4Å; F221-E345 HydrophobicContact CD1-CG 3.71Å; F221-E345 HydrophobicContact CE1-CG 4.3Å; F221-E345 HydrophobicContact CG-CG 4.11Å
222	N	93.6	Very high	83.8	Confident	22 Å²	22	29 Å²	29	12%	0.118	18%	0.179	C	C	.	.	H	α-helix	trans	-63.7	-33.2	-179.3	-65.5	-2.5	0	0	0	110.8	A218 L224 V225 S226 E344 E345	A218-N222 WeakPolarHBondContact O-CB 3.44Å; A218-N222 PolarHBondContact O-N 3.34Å; A218-N222 PolarHBondContact O-ND2 3.28Å; A218-N222 PolarHBondContact O-OD1 3.08Å; N222-L224 PolarHBondContact O-N 2.82Å; N222-V225 CarbonylContact O-C 3.58Å; N222-V225 PolarHBondContact O-N 3.09Å; N222-S226 WeakPolarHBondContact O-CB 3.43Å; N222-S226 PolarHBondContact O-N 2.77Å; N222-E344 HydrophobicContact CB-CG 4.44Å; N222-E345 PolarHBondContact ND2-O 2.67Å; N222-E345 WeakPolarHBondContact OD1-CB 3.4Å; N222-E345 PolarHBondContact OD1-N 3.1Å
223	S	92	Very high	82.9	Confident	17 Å²	17	33.3 Å²	33.3	12%	0.119	20%	0.199	C	C	.	.	H	α-helix	trans	-61.2	-41.6	171.9	-58.4	0	0	0	0	112.5	L171 F219 V220 F221 V225 S226	L171-S223 VanDerWaalsContact CD1-CB 3.43Å; F219-S223 WeakPolarHBondContact CZ-OG 3.5Å; F219-S223 WeakPolarHBondContact O-CB 3.37Å; F219-S223 PolarHBondContact O-N 2.86Å; F219-S223 PolarHBondContact O-OG 2.81Å; V220-S223 PolarHBondContact O-N 3.15Å; F221-S223 PolarHBondContact O-N 3.31Å; S223-V225 VanDerWaalsContact C-N 3.26Å; S223-V225 PolarHBondContact O-N 2.71Å; S223-S226 PolarHBondContact O-N 3.44Å
224	L	91.6	Very high	82.6	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.01	20%	0.2	C	C	.	.	H	α-helix	trans	-67.7	-20.2	177.8	-66.7	173	0	0	0	114.3	L171 V220 F221 N222 L234 L238 L242 A272 L276	L171-L224 HydrophobicContact CD2-CD2 4.07Å; L171-L224 HydrophobicContact CD2-CG 4.33Å; V220-L224 HydrophobicContact CG1-CD1 4.48Å; V220-L224 WeakPolarHBondContact O-CG 3.34Å; V220-L224 PolarHBondContact O-N 2.56Å; F221-L224 WeakPolarHBondContact O-CB 3.49Å; F221-L224 PolarHBondContact O-N 2.91Å; N222-L224 PolarHBondContact O-N 2.82Å; L224-L234 HydrophobicContact CB-CD2 4.48Å; L224-L234 HydrophobicContact CD2-CD2 3.73Å; L224-L238 HydrophobicContact CD2-CD2 3.75Å; L224-L242 HydrophobicContact CD1-CD1 3.94Å; L224-L242 HydrophobicContact CD2-CD1 4.02Å; L224-L242 HydrophobicContact CG-CD1 4.46Å; L224-A272 HydrophobicContact CD1-CB 3.88Å; L224-L276 HydrophobicContact CD2-CD1 4.16Å
225	V	90	Very high	82.4	Confident	2 Å²	2	34.1 Å²	34.1	1%	0.012	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.8	12.2	177.4	-58.5	0	0	0	0	113.5	F221 N222 S223 H300 I301 L343 E344	F221-V225 HydrophobicContact CD1-CG2 4.16Å; F221-V225 HydrophobicContact CE1-CG1 3.91Å; F221-V225 HydrophobicContact CE1-CG2 3.96Å; F221-V225 HydrophobicContact CZ-CG1 4.17Å; F221-V225 PolarHBondContact O-N 3.13Å; N222-V225 CarbonylContact O-C 3.58Å; N222-V225 PolarHBondContact O-N 3.09Å; S223-V225 VanDerWaalsContact C-N 3.26Å; S223-V225 PolarHBondContact O-N 2.71Å; V225-H300 PolarHBondContact O-NE2 2.84Å; V225-I301 HydrophobicContact CG1-CD1 4.12Å; V225-I301 HydrophobicContact CG1-CG1 3.92Å; V225-L343 HydrophobicContact CB-CD1 3.84Å; V225-L343 HydrophobicContact CB-CD2 4.4Å; V225-L343 HydrophobicContact CB-CG 3.89Å; V225-L343 HydrophobicContact CG1-CD1 4.12Å; V225-L343 HydrophobicContact CG2-CD1 4.34Å; V225-L343 HydrophobicContact CG2-CG 3.99Å; V225-E344 HydrophobicContact CG2-CG 4.22Å
226	S	84.4	Confident	82.3	Confident	21 Å²	21	33.6 Å²	33.6	15%	0.147	20%	0.201	C	C	.	.	S	Bend	trans	-98.6	139.5	178.7	-167.3	0	0	0	0	110.8	N222 S223 N228 L229	N222-S226 WeakPolarHBondContact O-CB 3.43Å; N222-S226 PolarHBondContact O-N 2.77Å; S223-S226 PolarHBondContact O-N 3.44Å; S226-N228 PolarHBondContact O-N 3Å; S226-N228 PolarHBondContact OG-ND2 2.81Å; S226-L229 PolarHBondContact O-N 2.86Å
227	V	65.1	Low	82.1	Confident	140 Å²	140	39.1 Å²	39.1	85%	0.848	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-8.9	172.3	-158.8	0	0	0	0	112.9
228	N	58.3	Low	82	Confident	143 Å²	143	39.2 Å²	39.2	77%	0.765	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-17.7	176.6	-63.6	-73.3	0	0	0	114.2	S226	S226-N228 PolarHBondContact O-N 3Å; S226-N228 PolarHBondContact OG-ND2 2.81Å
229	L	65.2	Low	82	Confident	36 Å²	36	39.2 Å²	39.2	19%	0.188	22%	0.222	C	C	.	.	S	Bend	trans	-89.6	130.3	161.8	-103.2	73.3	0	0	0	108.6	S226 Q233	S226-L229 PolarHBondContact O-N 2.86Å; L229-Q233 HydrophobicContact CD2-CB 4.43Å
230	P	60.8	Low	82	Confident	72 Å²	72	42.7 Å²	42.7	47%	0.468	24%	0.237	S	C	.	.			trans	-60.6	141.3	166.2	-19.6	31.8	0	0	0	110.5	A232 Q233	P230-A232 PolarHBondContact O-N 2.86Å; P230-A232 VanDerWaalsContact O-N 3.16Å; P230-Q233 HydrophobicContact CB-CG 4.49Å; P230-Q233 PolarHBondContact O-N 2.84Å
231	A	55.2	Low	82.1	Confident	44 Å²	44	43.6 Å²	43.6	36%	0.364	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-51.8	-38.6	174.6	0	0	0	0	0	112	Q233 L234 E306	A231-Q233 PolarHBondContact O-N 3.43Å; A231-L234 PolarHBondContact O-N 2.8Å; A231-E306 WeakPolarHBondContact CB-OE1 3.22Å
232	A	55.3	Low	82.2	Confident	55 Å²	55	43.6 Å²	43.6	46%	0.455	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-56.8	4.7	171.3	0	0	0	0	0	117.1	P230 E306	P230-A232 PolarHBondContact O-N 2.86Å; P230-A232 VanDerWaalsContact O-N 3.16Å; A232-E306 WeakPolarHBondContact CA-OE1 3.48Å; A232-E306 WeakPolarHBondContact CA-OE2 3.45Å; A232-E306 VanDerWaalsContact CB-OE2 3.32Å; A232-E306 WeakPolarHBondContact CB-OE2 3.27Å; A232-E306 VanDerWaalsContact N-CD 3.34Å; A232-E306 PolarHBondContact N-OE1 3.2Å
233	Q	75	Confident	82.3	Confident	91 Å²	91	45.5 Å²	45.5	43%	0.425	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-109.7	-14.7	169.5	-61.2	-172.2	-8.2	0	0	113.2	L229 P230 A231 N235 L238	L229-Q233 HydrophobicContact CD2-CB 4.43Å; P230-Q233 HydrophobicContact CB-CG 4.49Å; P230-Q233 PolarHBondContact O-N 2.84Å; A231-Q233 PolarHBondContact O-N 3.43Å; Q233-N235 PolarHBondContact O-N 2.8Å; Q233-L238 WeakPolarHBondContact O-CD2 3.39Å
234	L	89.9	Confident	82.5	Confident	7 Å²	7	51.9 Å²	51.9	4%	0.037	27%	0.274	C	S	.	.			trans	-82	65.3	177.5	-62.4	-176.9	0	0	0	111.3	L224 A231 L238 L276 F305 E306	L224-L234 HydrophobicContact CB-CD2 4.48Å; L224-L234 HydrophobicContact CD2-CD2 3.73Å; A231-L234 PolarHBondContact O-N 2.8Å; L234-L238 HydrophobicContact CD2-CD2 4.3Å; L234-L276 HydrophobicContact CB-CD2 4.12Å; L234-L276 HydrophobicContact CD2-CD1 4.46Å; L234-F305 WeakPolarHBondContact O-CA 3.3Å; L234-F305 WeakPolarHBondContact O-CD2 3.36Å; L234-E306 PolarHBondContact O-N 2.71Å
235	N	91.3	Very high	82.8	Confident	14 Å²	14	51.9 Å²	51.9	8%	0.075	27%	0.273	C	S	.	.	S	Bend	trans	-109.1	169.8	178.3	58.8	33	0	0	0	112.6	Q233 R237 L238 G239 E306	Q233-N235 PolarHBondContact O-N 2.8Å; N235-R237 PolarHBondContact O-N 3.41Å; N235-R237 WeakPolarHBondContact OD1-CB 3.22Å; N235-R237 PolarHBondContact OD1-N 3.17Å; N235-L238 PolarHBondContact O-N 2.99Å; N235-L238 PolarHBondContact OD1-N 3.39Å; N235-G239 PolarHBondContact O-N 3.47Å; N235-G239 VanDerWaalsContact O-N 3.16Å; N235-E306 WeakPolarHBondContact CA-O 3.47Å; N235-E306 VanDerWaalsContact CB-O 3.28Å; N235-E306 WeakPolarHBondContact CB-O 3.23Å
236	T	92.5	Very high	83.1	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.018	28%	0.275	C	S	.	.	H	α-helix	trans	-65.6	-27	179.8	-77.3	0	0	0	0	112	G239 K240 L276 K280 F305 E311	T236-G239 PolarHBondContact O-N 2.85Å; T236-K240 HydrophobicContact CG2-CD 3.91Å; T236-K240 HydrophobicContact CG2-CG 4.46Å; T236-K240 WeakPolarHBondContact O-CG 3.26Å; T236-K240 PolarHBondContact O-N 2.75Å; T236-L276 PolarHBondContact OG1-O 3.34Å; T236-K280 PolarHBondContact OG1-NZ 2.69Å; T236-F305 WeakPolarHBondContact OG1-CZ 3.29Å; T236-E311 VanDerWaalsContact CB-OE1 3.23Å; T236-E311 WeakPolarHBondContact CB-OE1 3.4Å; T236-E311 WeakPolarHBondContact CB-OE2 3.4Å; T236-E311 WeakPolarHBondContact CG2-OE1 3.5Å; T236-E311 PolarHBondContact OG1-OE1 3.36Å; T236-E311 PolarHBondContact OG1-OE2 2.88Å
237	R	91.8	Very high	83.6	Confident	121 Å²	121	53.9 Å²	53.9	46%	0.457	28%	0.28	S	S	.	.	H	α-helix	trans	-60.9	-49.5	170.5	176.2	178.2	175	159.1	-1.5	111.9	I173 N235 G239 K240 C241 D308	I173-R237 PolarHBondContact O-NE 3.23Å; I173-R237 PolarHBondContact O-NH2 2.89Å; N235-R237 PolarHBondContact O-N 3.41Å; N235-R237 WeakPolarHBondContact OD1-CB 3.22Å; N235-R237 PolarHBondContact OD1-N 3.17Å; R237-G239 VanDerWaalsContact C-N 3.33Å; R237-G239 PolarHBondContact O-N 3.21Å; R237-K240 PolarHBondContact O-N 2.91Å; R237-C241 PolarHBondContact O-N 2.97Å; R237-C241 PolarHBondContact O-SG 2.69Å; R237-C241 VanDerWaalsContact O-SG 3.35Å; R237-D308 PolarHBondContact N-OD2 3.11Å
238	L	93.3	Very high	85.2	Confident	2 Å²	2	49 Å²	49	1%	0.01	25%	0.253	C	S	.	.	H	α-helix	trans	-59.1	-44.8	175.7	176.3	59.9	0	0	0	111.2	L171 I173 L224 Q233 L234 N235 K240 C241 L242	L171-L238 WeakPolarHBondContact O-CD1 3.06Å; I173-L238 HydrophobicContact CG2-CB 3.92Å; I173-L238 HydrophobicContact CG2-CD1 3.86Å; I173-L238 HydrophobicContact CG2-CG 4.46Å; L224-L238 HydrophobicContact CD2-CD2 3.75Å; Q233-L238 WeakPolarHBondContact O-CD2 3.39Å; L234-L238 HydrophobicContact CD2-CD2 4.3Å; N235-L238 PolarHBondContact O-N 2.99Å; N235-L238 PolarHBondContact OD1-N 3.39Å; L238-K240 PolarHBondContact O-N 3.46Å; L238-C241 PolarHBondContact O-N 3.01Å; L238-L242 HydrophobicContact CD1-CD1 3.9Å; L238-L242 HydrophobicContact CD1-CG 4.01Å; L238-L242 HydrophobicContact CG-CD1 3.97Å; L238-L242 HydrophobicContact CG-CG 4.49Å; L238-L242 WeakPolarHBondContact O-CB 3.4Å; L238-L242 WeakPolarHBondContact O-CG 3.36Å; L238-L242 PolarHBondContact O-N 2.89Å
239	G	94.4	Very high	87	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-54.2	-50	175.2	0	0	0	0	0	112.8	N235 T236 R237 L242 Q243	N235-G239 PolarHBondContact O-N 3.47Å; N235-G239 VanDerWaalsContact O-N 3.16Å; T236-G239 PolarHBondContact O-N 2.85Å; R237-G239 VanDerWaalsContact C-N 3.33Å; R237-G239 PolarHBondContact O-N 3.21Å; G239-L242 PolarHBondContact O-N 2.95Å; G239-Q243 WeakPolarHBondContact O-CG 3.48Å; G239-Q243 PolarHBondContact O-N 3.29Å
240	K	94.1	Very high	88.5	Confident	104 Å²	104	41.7 Å²	41.7	45%	0.452	21%	0.213	S	C	.	.	H	α-helix	trans	-64.4	-42.4	178.4	-72.7	165.9	-178.9	164	0	112.7	T236 R237 L238 Q243 Y244 A277	T236-K240 HydrophobicContact CG2-CD 3.91Å; T236-K240 HydrophobicContact CG2-CG 4.46Å; T236-K240 WeakPolarHBondContact O-CG 3.26Å; T236-K240 PolarHBondContact O-N 2.75Å; R237-K240 PolarHBondContact O-N 2.91Å; L238-K240 PolarHBondContact O-N 3.46Å; K240-Q243 WeakPolarHBondContact O-CB 3.45Å; K240-Q243 PolarHBondContact O-N 2.92Å; K240-Y244 WeakPolarHBondContact O-CD2 3.48Å; K240-Y244 PolarHBondContact O-N 3.17Å; K240-A277 HydrophobicContact CG-CB 3.99Å
241	C	95.4	Very high	90.1	Very high	19 Å²	19	42.3 Å²	42.3	13%	0.128	21%	0.206	C	C	.	.	H	α-helix	trans	-58.3	-49.1	174	-71.9	0	0	0	0	110.9	R237 L238 Q243 Y244 R245	R237-C241 PolarHBondContact O-N 2.97Å; R237-C241 PolarHBondContact O-SG 2.69Å; R237-C241 VanDerWaalsContact O-SG 3.35Å; L238-C241 PolarHBondContact O-N 3.01Å; C241-Q243 PolarHBondContact O-N 3.37Å; C241-Y244 PolarHBondContact O-N 3.12Å; C241-R245 WeakPolarHBondContact O-CB 3.29Å; C241-R245 VanDerWaalsContact O-CD 3.3Å; C241-R245 WeakPolarHBondContact O-CD 3.47Å; C241-R245 WeakPolarHBondContact O-CG 3.29Å; C241-R245 PolarHBondContact O-N 2.96Å
242	L	96.6	Very high	92	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-63.2	-37.3	178.4	-74	171.8	0	0	0	112.9	L170 L171 V220 L224 L238 G239 R245 I246 A273	L170-L242 HydrophobicContact CB-CD2 4.38Å; L170-L242 VanDerWaalsContact O-CD2 3.31Å; L170-L242 WeakPolarHBondContact O-CD2 3.4Å; L171-L242 HydrophobicContact CD2-CD1 4.26Å; L171-L242 HydrophobicContact CD2-CD2 4.28Å; V220-L242 HydrophobicContact CG1-CD2 3.98Å; L224-L242 HydrophobicContact CD1-CD1 3.94Å; L224-L242 HydrophobicContact CD2-CD1 4.02Å; L224-L242 HydrophobicContact CG-CD1 4.46Å; L238-L242 HydrophobicContact CD1-CD1 3.9Å; L238-L242 HydrophobicContact CD1-CG 4.01Å; L238-L242 HydrophobicContact CG-CD1 3.97Å; L238-L242 HydrophobicContact CG-CG 4.49Å; L238-L242 WeakPolarHBondContact O-CB 3.4Å; L238-L242 WeakPolarHBondContact O-CG 3.36Å; L238-L242 PolarHBondContact O-N 2.89Å; G239-L242 PolarHBondContact O-N 2.95Å; L242-R245 PolarHBondContact O-N 2.76Å; L242-I246 HydrophobicContact CB-CD1 4.34Å; L242-I246 VanDerWaalsContact O-CB 3.27Å; L242-I246 WeakPolarHBondContact O-CB 3.3Å; L242-I246 VanDerWaalsContact O-CG1 3.22Å; L242-I246 WeakPolarHBondContact O-CG1 3.44Å; L242-I246 PolarHBondContact O-N 2.88Å; L242-A273 HydrophobicContact CB-CB 3.59Å
243	Q	95.6	Very high	93.9	Very high	63 Å²	63	38.6 Å²	38.6	29%	0.294	17%	0.171	S	C	.	.	H	α-helix	trans	-55.2	-54.4	172.9	-75.9	177.5	-42.7	0	0	111.5	G239 K240 C241 R245 E247 A273 N274 A277	G239-Q243 WeakPolarHBondContact O-CG 3.48Å; G239-Q243 PolarHBondContact O-N 3.29Å; K240-Q243 WeakPolarHBondContact O-CB 3.45Å; K240-Q243 PolarHBondContact O-N 2.92Å; C241-Q243 PolarHBondContact O-N 3.37Å; Q243-R245 PolarHBondContact O-N 2.93Å; Q243-E247 WeakPolarHBondContact O-CB 3.42Å; Q243-E247 PolarHBondContact O-N 2.96Å; Q243-E247 VanDerWaalsContact O-N 3.1Å; Q243-A273 HydrophobicContact CG-CB 4.04Å; Q243-N274 PolarHBondContact NE2-OD1 3.41Å; Q243-A277 HydrophobicContact CG-CB 4.44Å; Q243-A277 VanDerWaalsContact OE1-CB 3.26Å
244	Y	96.1	Very high	94.7	Very high	151 Å²	151	38.6 Å²	38.6	59%	0.592	17%	0.171	S	C	*	.	H	α-helix	trans	-65	-37.4	-179.9	-69.4	-63	0	0	0	112.9	K240 C241 S248	K240-Y244 WeakPolarHBondContact O-CD2 3.48Å; K240-Y244 PolarHBondContact O-N 3.17Å; C241-Y244 PolarHBondContact O-N 3.12Å; Y244-S248 WeakPolarHBondContact O-CB 3.4Å; Y244-S248 PolarHBondContact O-N 3.48Å
245	R	97.5	Very high	94.8	Very high	1 Å²	1	47.1 Å²	47.1	0%	0.004	20%	0.203	C	C	.	.	H	α-helix	trans	-71.6	-45.3	-178.1	-67.6	165.1	-169.5	-160.8	-6.3	112.7	A169 L170 D172 L175 D177 A180 T181 C241 L242 Q243 E247 S248 I249	A169-R245 PolarHBondContact O-NH1 2.7Å; L170-R245 HydrophobicContact CD2-CB 4.11Å; L170-R245 VanDerWaalsContact O-CD 3.32Å; L170-R245 WeakPolarHBondContact O-CD 3.49Å; L170-R245 PolarHBondContact O-NH1 2.75Å; D172-R245 VanDerWaalsContact O-CZ 3.31Å; D172-R245 PolarHBondContact O-NH1 2.71Å; D172-R245 PolarHBondContact O-NH2 3.5Å; L175-R245 PolarHBondContact O-NH2 2.97Å; D177-R245 HydrophobicContact CB-CG 3.97Å; D177-R245 IonicContact OD1-CZ 3.07Å; D177-R245 IonicContact OD1-NE 3.6Å; D177-R245 PolarHBondContact OD1-NE 2.9Å; D177-R245 IonicContact OD1-NH2 3.32Å; D177-R245 PolarHBondContact OD1-NH2 3.41Å; A180-R245 HydrophobicContact CB-CG 4.4Å; A180-R245 VanDerWaalsContact CB-CZ 3.48Å; T181-R245 HydrophobicContact CG2-CB 3.58Å; T181-R245 HydrophobicContact CG2-CG 3.87Å; T181-R245 WeakPolarHBondContact CG2-O 3.49Å; C241-R245 WeakPolarHBondContact O-CB 3.29Å; C241-R245 VanDerWaalsContact O-CD 3.3Å; C241-R245 WeakPolarHBondContact O-CD 3.47Å; C241-R245 WeakPolarHBondContact O-CG 3.29Å; C241-R245 PolarHBondContact O-N 2.96Å; L242-R245 PolarHBondContact O-N 2.76Å; Q243-R245 PolarHBondContact O-N 2.93Å; R245-E247 VanDerWaalsContact C-N 3.31Å; R245-E247 PolarHBondContact O-N 3.29Å; R245-S248 WeakPolarHBondContact O-CB 3.27Å; R245-S248 PolarHBondContact O-N 3.44Å; R245-I249 WeakPolarHBondContact O-CG1 3.24Å; R245-I249 PolarHBondContact O-N 3.35Å; R245-I249 VanDerWaalsContact O-N 3.15Å
246	I	97.2	Very high	94.6	Very high	8 Å²	8	47.7 Å²	47.7	4%	0.041	21%	0.206	C	C	.	.	H	α-helix	trans	-64.2	-39.3	175.8	-68.1	168.7	0	0	0	110.4	L242 I249 H250 L266 R270 A273	L242-I246 HydrophobicContact CB-CD1 4.34Å; L242-I246 VanDerWaalsContact O-CB 3.27Å; L242-I246 WeakPolarHBondContact O-CB 3.3Å; L242-I246 VanDerWaalsContact O-CG1 3.22Å; L242-I246 WeakPolarHBondContact O-CG1 3.44Å; L242-I246 PolarHBondContact O-N 2.88Å; I246-I249 PolarHBondContact O-N 3.43Å; I246-H250 PolarHBondContact O-N 3.32Å; I246-L266 HydrophobicContact CG2-CB 4.14Å; I246-L266 HydrophobicContact CG2-CD1 4.19Å; I246-R270 HydrophobicContact CG2-CB 4.28Å; I246-A273 HydrophobicContact CD1-CB 4.39Å
247	E	95.9	Very high	94.3	Very high	57 Å²	57	50 Å²	50	27%	0.266	23%	0.23	S	C	.	.	H	α-helix	trans	-67.8	-34.6	175.6	176.9	63.8	-178.8	0	0	112.9	Q243 R245 H250 R251	Q243-E247 WeakPolarHBondContact O-CB 3.42Å; Q243-E247 PolarHBondContact O-N 2.96Å; Q243-E247 VanDerWaalsContact O-N 3.1Å; R245-E247 VanDerWaalsContact C-N 3.31Å; R245-E247 PolarHBondContact O-N 3.29Å; E247-H250 WeakPolarHBondContact O-CB 3.44Å; E247-H250 PolarHBondContact O-N 3.31Å; E247-R251 VanDerWaalsContact CG-CZ 3.41Å; E247-R251 WeakPolarHBondContact O-CG 3.35Å; E247-R251 PolarHBondContact O-N 3.09Å; E247-R251 IonicContact OE1-CZ 3.21Å; E247-R251 IonicContact OE1-NE 3.54Å; E247-R251 PolarHBondContact OE1-NE 2.91Å; E247-R251 IonicContact OE1-NH2 2.65Å; E247-R251 PolarHBondContact OE1-NH2 3.29Å
248	S	97.1	Very high	94	Very high	39 Å²	39	45 Å²	45	27%	0.273	21%	0.213	S	C	.	.	H	α-helix	trans	-61	-43.6	171.3	-173.4	0	0	0	0	111.6	Y244 R245 R251 F252	Y244-S248 WeakPolarHBondContact O-CB 3.4Å; Y244-S248 PolarHBondContact O-N 3.48Å; R245-S248 WeakPolarHBondContact O-CB 3.27Å; R245-S248 PolarHBondContact O-N 3.44Å; S248-R251 PolarHBondContact O-N 3.38Å; S248-F252 PolarHBondContact O-N 2.91Å
249	I	97.4	Very high	93.9	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-64.9	-40.9	174.3	-62.6	165.6	0	0	0	110.6	L170 T181 V184 I185 L188 L213 R245 I246 F252 C253 L266	L170-I249 HydrophobicContact CD1-CD1 4.17Å; L170-I249 HydrophobicContact CD2-CD1 3.94Å; T181-I249 HydrophobicContact CG2-CG1 4.36Å; V184-I249 HydrophobicContact CG1-CD1 4Å; V184-I249 HydrophobicContact CG1-CG1 4.5Å; I185-I249 HydrophobicContact CD1-CG1 4.41Å; I185-I249 HydrophobicContact CG1-CG1 4.15Å; L188-I249 HydrophobicContact CD1-CG2 4.1Å; L213-I249 HydrophobicContact CD2-CG2 4Å; R245-I249 WeakPolarHBondContact O-CG1 3.24Å; R245-I249 PolarHBondContact O-N 3.35Å; R245-I249 VanDerWaalsContact O-N 3.15Å; I246-I249 PolarHBondContact O-N 3.43Å; I249-F252 WeakPolarHBondContact O-CB 3.42Å; I249-F252 PolarHBondContact O-N 2.72Å; I249-C253 PolarHBondContact O-N 3.29Å; I249-L266 HydrophobicContact CB-CD1 4.39Å; I249-L266 HydrophobicContact CG2-CD1 3.91Å
250	H	95.6	Very high	93.5	Very high	23 Å²	23	53.1 Å²	53.1	11%	0.106	25%	0.252	C	S	.	.	H	α-helix	trans	-58.7	-50.1	175.5	-168.3	-96.1	0	0	0	112	I246 E247 F252 C253 E254	I246-H250 PolarHBondContact O-N 3.32Å; E247-H250 WeakPolarHBondContact O-CB 3.44Å; E247-H250 PolarHBondContact O-N 3.31Å; H250-F252 PolarHBondContact O-N 3.43Å; H250-C253 CarbonylContact O-C 3.46Å; H250-C253 WeakPolarHBondContact O-CA 3.4Å; H250-C253 WeakPolarHBondContact O-CB 3.45Å; H250-C253 PolarHBondContact O-N 2.89Å; H250-E254 IonicContact CE1-OE1 3.56Å; H250-E254 PolarHBondContact CE1-OE1 3.14Å; H250-E254 IonicContact ND1-OE1 2.7Å; H250-E254 PolarHBondContact ND1-OE1 2.92Å; H250-E254 PolarHBondContact O-N 3.45Å
251	R	95.3	Very high	93.2	Very high	85 Å²	85	48.6 Å²	48.6	32%	0.321	23%	0.234	S	C	.	.	H	α-helix	trans	-66.3	-19.9	176.8	-66.4	173.8	-168.5	161.3	8.3	113.7	E247 S248 E254 R255 H667	E247-R251 VanDerWaalsContact CG-CZ 3.41Å; E247-R251 WeakPolarHBondContact O-CG 3.35Å; E247-R251 PolarHBondContact O-N 3.09Å; E247-R251 IonicContact OE1-CZ 3.21Å; E247-R251 IonicContact OE1-NE 3.54Å; E247-R251 PolarHBondContact OE1-NE 2.91Å; E247-R251 IonicContact OE1-NH2 2.65Å; E247-R251 PolarHBondContact OE1-NH2 3.29Å; S248-R251 PolarHBondContact O-N 3.38Å; R251-E254 WeakPolarHBondContact CA-OE2 3.13Å; R251-R255 WeakPolarHBondContact O-CG 3.36Å; R251-R255 PolarHBondContact O-NE 3.08Å; R251-H667 VanDerWaalsContact CZ-NE2 3.28Å; R251-H667 PolarHBondContact NH2-NE2 3.02Å
252	F	95.4	Very high	92.9	Very high	20 Å²	20	47.7 Å²	47.7	9%	0.088	23%	0.228	C	C	.	.	H	α-helix	trans	-72.7	-46.6	166.1	176.3	-95.7	0	0	0	111.2	I185 L188 D189 S248 I249 H250 E254 R255 M256	I185-F252 HydrophobicContact CD1-CB 4.44Å; I185-F252 HydrophobicContact CG1-CB 4.37Å; I185-F252 HydrophobicContact CG1-CG 4.48Å; I185-F252 HydrophobicContact CG2-CB 4.42Å; I185-F252 HydrophobicContact CG2-CD1 4.48Å; I185-F252 HydrophobicContact CG2-CD2 3.61Å; I185-F252 HydrophobicContact CG2-CE2 4Å; I185-F252 HydrophobicContact CG2-CG 3.88Å; L188-F252 HydrophobicContact CB-CD1 4.24Å; L188-F252 HydrophobicContact CB-CE1 3.67Å; L188-F252 HydrophobicContact CB-CZ 4.49Å; L188-F252 HydrophobicContact CD1-CD1 4.4Å; D189-F252 HydrophobicContact CB-CE2 4.01Å; D189-F252 HydrophobicContact CB-CZ 3.62Å; S248-F252 PolarHBondContact O-N 2.91Å; I249-F252 WeakPolarHBondContact O-CB 3.42Å; I249-F252 PolarHBondContact O-N 2.72Å; H250-F252 PolarHBondContact O-N 3.43Å; F252-E254 PolarHBondContact O-N 3.3Å; F252-R255 PolarHBondContact O-N 2.82Å; F252-M256 HydrophobicContact CD1-CG 4.38Å; F252-M256 HydrophobicContact CE1-CE 4.27Å; F252-M256 HydrophobicContact CE1-CG 3.83Å; F252-M256 HydrophobicContact CE2-CG 4.17Å; F252-M256 HydrophobicContact CZ-CE 3.82Å; F252-M256 HydrophobicContact CZ-CG 3.71Å; F252-M256 HydrophobicContact CZ-SD 4.06Å; F252-M256 VanDerWaalsContact O-CG 3.26Å; F252-M256 WeakPolarHBondContact O-CG 3.37Å; F252-M256 PolarHBondContact O-N 2.95Å
253	C	94.6	Very high	92.5	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.007	24%	0.242	C	C	.	.	H	α-helix	trans	-63	-37.9	177.1	-72.9	0	0	0	0	113.8	I249 H250 M256 G257 V258 A262	I249-C253 PolarHBondContact O-N 3.29Å; H250-C253 CarbonylContact O-C 3.46Å; H250-C253 WeakPolarHBondContact O-CA 3.4Å; H250-C253 WeakPolarHBondContact O-CB 3.45Å; H250-C253 PolarHBondContact O-N 2.89Å; C253-M256 CarbonylContact O-C 3.56Å; C253-M256 WeakPolarHBondContact O-CA 3.45Å; C253-M256 WeakPolarHBondContact O-CB 3.25Å; C253-M256 PolarHBondContact O-N 2.92Å; C253-G257 PolarHBondContact O-N 3.07Å; C253-G257 VanDerWaalsContact O-N 3.13Å; C253-V258 HydrophobicContact CB-CG2 3.86Å; C253-V258 WeakPolarHBondContact O-CG2 3.29Å; C253-V258 PolarHBondContact O-N 3.15Å; C253-A262 HydrophobicContact CB-CB 3.54Å
254	E	92.1	Very high	92.2	Very high	91 Å²	91	48.1 Å²	48.1	43%	0.425	23%	0.231	S	C	.	.	H	α-helix	trans	-56.6	-49.7	171.1	-71.6	170.5	169.6	0	0	112.3	H250 R251 F252 M256 G257 E259	H250-E254 IonicContact CE1-OE1 3.56Å; H250-E254 PolarHBondContact CE1-OE1 3.14Å; H250-E254 IonicContact ND1-OE1 2.7Å; H250-E254 PolarHBondContact ND1-OE1 2.92Å; H250-E254 PolarHBondContact O-N 3.45Å; R251-E254 WeakPolarHBondContact CA-OE2 3.13Å; F252-E254 PolarHBondContact O-N 3.3Å; E254-M256 PolarHBondContact O-N 2.78Å; E254-G257 PolarHBondContact O-N 3.34Å; E254-G257 VanDerWaalsContact O-N 3.11Å; E254-E259 HydrophobicContact CB-CB 4.4Å; E254-E259 HydrophobicContact CG-CB 3.73Å
255	R	92	Very high	92.1	Very high	187 Å²	187	41.7 Å²	41.7	71%	0.706	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-11.9	176.7	-71.4	179.1	-69.6	165	0.4	113.4	R251 F252	R251-R255 WeakPolarHBondContact O-CG 3.36Å; R251-R255 PolarHBondContact O-NE 3.08Å; F252-R255 PolarHBondContact O-N 2.82Å
256	M	85.7	Confident	91.9	Very high	25 Å²	25	41.8 Å²	41.8	12%	0.123	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105	-4.7	179.8	-67.1	-73.3	-88.5	0	0	113.5	M192 R196 F252 C253 E254 V258	M192-M256 HydrophobicContact CB-CE 3.4Å; M192-M256 VanDerWaalsContact CB-CE 3.4Å; M192-M256 HydrophobicContact CG-CE 4.1Å; R196-M256 VanDerWaalsContact NH1-CE 3.26Å; R196-M256 PolarHBondContact NH1-SD 3.02Å; R196-M256 PolarHBondContact NH2-O 2.64Å; R196-M256 PolarHBondContact NH2-SD 3.1Å; R196-M256 VanDerWaalsContact NH2-SD 3.4Å; F252-M256 HydrophobicContact CD1-CG 4.38Å; F252-M256 HydrophobicContact CE1-CE 4.27Å; F252-M256 HydrophobicContact CE1-CG 3.83Å; F252-M256 HydrophobicContact CE2-CG 4.17Å; F252-M256 HydrophobicContact CZ-CE 3.82Å; F252-M256 HydrophobicContact CZ-CG 3.71Å; F252-M256 HydrophobicContact CZ-SD 4.06Å; F252-M256 VanDerWaalsContact O-CG 3.26Å; F252-M256 WeakPolarHBondContact O-CG 3.37Å; F252-M256 PolarHBondContact O-N 2.95Å; C253-M256 CarbonylContact O-C 3.56Å; C253-M256 WeakPolarHBondContact O-CA 3.45Å; C253-M256 WeakPolarHBondContact O-CB 3.25Å; C253-M256 PolarHBondContact O-N 2.92Å; E254-M256 PolarHBondContact O-N 2.78Å; M256-V258 HydrophobicContact CB-CG2 3.97Å
257	G	86.9	Confident	91.6	Very high	51 Å²	51	41.7 Å²	41.7	53%	0.526	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.3	33.1	-178	0	0	0	0	0	113.9	C253 E254 E259	C253-G257 PolarHBondContact O-N 3.07Å; C253-G257 VanDerWaalsContact O-N 3.13Å; E254-G257 PolarHBondContact O-N 3.34Å; E254-G257 VanDerWaalsContact O-N 3.11Å; G257-E259 VanDerWaalsContact C-OE2 3.24Å; G257-E259 WeakPolarHBondContact CA-OE2 3.39Å
258	V	85.8	Confident	91.4	Very high	17 Å²	17	39.7 Å²	39.7	10%	0.103	20%	0.196	C	C	.	.			trans	-133.5	24.1	-179.4	-64.4	0	0	0	0	112.2	I206 C253 M256 M260 A261 A262	I206-V258 HydrophobicContact CG1-CG1 4.31Å; C253-V258 HydrophobicContact CB-CG2 3.86Å; C253-V258 WeakPolarHBondContact O-CG2 3.29Å; C253-V258 PolarHBondContact O-N 3.15Å; M256-V258 HydrophobicContact CB-CG2 3.97Å; V258-M260 VanDerWaalsContact C-N 3.33Å; V258-M260 PolarHBondContact O-N 3.49Å; V258-A261 WeakPolarHBondContact O-CB 3.2Å; V258-A261 PolarHBondContact O-N 2.9Å; V258-A262 PolarHBondContact O-N 3.39Å
259	E	90.2	Very high	91.3	Very high	72 Å²	72	38 Å²	38	34%	0.336	18%	0.184	S	C	.	.	H	α-helix	trans	-51.6	-45.3	179.5	58.5	-73.1	173.7	0	0	113.1	E254 G257 A261 A262 E263	E254-E259 HydrophobicContact CB-CB 4.4Å; E254-E259 HydrophobicContact CG-CB 3.73Å; G257-E259 VanDerWaalsContact C-OE2 3.24Å; G257-E259 WeakPolarHBondContact CA-OE2 3.39Å; E259-A261 PolarHBondContact O-N 2.86Å; E259-A261 VanDerWaalsContact O-N 3.14Å; E259-A262 CarbonylContact O-C 3.56Å; E259-A262 WeakPolarHBondContact O-CA 3.4Å; E259-A262 PolarHBondContact O-N 3.21Å; E259-E263 PolarHBondContact O-N 3.06Å
260	M	86.9	Confident	91.1	Very high	101 Å²	101	39.9 Å²	39.9	50%	0.498	19%	0.191	S	C	.	.	H	α-helix	trans	-61.1	-26.8	179.8	-60.4	-75.7	88.4	0	0	113.2	V258 E263 C264	V258-M260 VanDerWaalsContact C-N 3.33Å; V258-M260 PolarHBondContact O-N 3.49Å; M260-E263 WeakPolarHBondContact CE-OE2 3.48Å; M260-C264 WeakPolarHBondContact O-CB 3.39Å; M260-C264 PolarHBondContact O-N 3.03Å
261	A	87	Confident	91.1	Very high	9 Å²	9	38.9 Å²	38.9	7%	0.074	19%	0.187	C	C	.	.	H	α-helix	trans	-75.8	-36.3	172.9	0	0	0	0	0	111.5	L213 V258 E259 H265	L213-A261 HydrophobicContact CD1-CB 3.93Å; V258-A261 WeakPolarHBondContact O-CB 3.2Å; V258-A261 PolarHBondContact O-N 2.9Å; E259-A261 PolarHBondContact O-N 2.86Å; E259-A261 VanDerWaalsContact O-N 3.14Å; A261-H265 VanDerWaalsContact O-CB 3.3Å; A261-H265 WeakPolarHBondContact O-CB 3.31Å; A261-H265 PolarHBondContact O-CD2 3.11Å; A261-H265 PolarHBondContact O-N 2.79Å
262	A	90.4	Very high	91.1	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-77.4	-34.4	178.1	0	0	0	0	0	113	L213 C253 V258 E259 L266 R270	L213-A262 HydrophobicContact CD1-CB 4.03Å; L213-A262 HydrophobicContact CD2-CB 4.34Å; C253-A262 HydrophobicContact CB-CB 3.54Å; V258-A262 PolarHBondContact O-N 3.39Å; E259-A262 CarbonylContact O-C 3.56Å; E259-A262 WeakPolarHBondContact O-CA 3.4Å; E259-A262 PolarHBondContact O-N 3.21Å; A262-L266 HydrophobicContact CB-CD1 4.35Å; A262-L266 WeakPolarHBondContact O-CB 3.43Å; A262-L266 PolarHBondContact O-N 2.86Å; A262-R270 PolarHBondContact O-NH2 3.5Å
263	E	88.8	Confident	91.1	Very high	65 Å²	65	33.9 Å²	33.9	30%	0.304	17%	0.167	S	C	.	.	H	α-helix	trans	-58.9	-53.9	169.1	-165.4	-160.2	129.1	0	0	109.3	E259 M260 D267 R270 S697	E259-E263 PolarHBondContact O-N 3.06Å; M260-E263 WeakPolarHBondContact CE-OE2 3.48Å; E263-D267 WeakPolarHBondContact O-CB 3.37Å; E263-R270 PolarHBondContact O-NH1 3.49Å; E263-S697 WeakPolarHBondContact OE1-CB 3.32Å; E263-S697 PolarHBondContact OE1-OG 3.33Å
264	C	88.9	Confident	91.1	Very high	7 Å²	7	36 Å²	36	5%	0.047	18%	0.178	C	C	.	.	H	α-helix	trans	-66	-55.1	-176.1	-173.2	0	0	0	0	113.4	M260 F687 Y694	M260-C264 WeakPolarHBondContact O-CB 3.39Å; M260-C264 PolarHBondContact O-N 3.03Å; C264-F687 HydrophobicContact CB-CE1 4.44Å; C264-Y694 WeakPolarHBondContact O-CD1 3.46Å
265	H	92.4	Very high	91.3	Very high	15 Å²	15	31.6 Å²	31.6	7%	0.069	16%	0.158	C	C	.	.	H	α-helix	trans	-81	-24.1	-168.3	-68	-61.8	0	0	0	115	G210 L213 H214 N217 A261 Y694	G210-H265 WeakPolarHBondContact CA-CD2 3.36Å; L213-H265 HydrophobicContact CB-CB 3.87Å; H214-H265 HydrophobicContact CB-CB 4.43Å; N217-H265 WeakPolarHBondContact CB-O 3.37Å; A261-H265 VanDerWaalsContact O-CB 3.3Å; A261-H265 WeakPolarHBondContact O-CB 3.31Å; A261-H265 PolarHBondContact O-CD2 3.11Å; A261-H265 PolarHBondContact O-N 2.79Å; H265-Y694 AromaticContact ND1-CE1 3.72Å
266	L	94.1	Very high	91.3	Very high	3 Å²	3	22.8 Å²	22.8	2%	0.016	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	0.1	178.3	-56.6	178.1	0	0	0	113.6	L213 V216 N217 I246 I249 A262 R268 S269 R270	L213-L266 HydrophobicContact CB-CD2 4.3Å; L213-L266 HydrophobicContact CD2-CD1 4Å; L213-L266 HydrophobicContact CD2-CD2 4.2Å; L213-L266 HydrophobicContact CD2-CG 4.18Å; L213-L266 WeakPolarHBondContact O-CD2 3.3Å; V216-L266 HydrophobicContact CB-CD2 4.31Å; V216-L266 HydrophobicContact CG1-CD2 4.21Å; N217-L266 HydrophobicContact CB-CD2 4.28Å; I246-L266 HydrophobicContact CG2-CB 4.14Å; I246-L266 HydrophobicContact CG2-CD1 4.19Å; I249-L266 HydrophobicContact CB-CD1 4.39Å; I249-L266 HydrophobicContact CG2-CD1 3.91Å; A262-L266 HydrophobicContact CB-CD1 4.35Å; A262-L266 WeakPolarHBondContact O-CB 3.43Å; A262-L266 PolarHBondContact O-N 2.86Å; L266-R268 PolarHBondContact O-N 3.04Å; L266-S269 PolarHBondContact O-N 3.31Å; L266-R270 WeakPolarHBondContact O-CB 3.5Å; L266-R270 PolarHBondContact O-N 2.95Å
267	D	90.8	Very high	91.7	Very high	7 Å²	7	22.3 Å²	22.3	4%	0.037	13%	0.125	C	C	.	.	H	α-helix	trans	-67.3	-33.2	-164.5	-155.3	34.9	0	0	0	114.4	E263 R270 Q271 Y291 K292	E263-D267 WeakPolarHBondContact O-CB 3.37Å; D267-R270 VanDerWaalsContact CA-NH1 3.34Å; D267-R270 WeakPolarHBondContact O-CB 3.48Å; D267-R270 PolarHBondContact O-N 3.37Å; D267-R270 IonicContact OD1-CZ 3.84Å; D267-R270 IonicContact OD1-NH1 2.68Å; D267-R270 PolarHBondContact OD1-NH1 3.01Å; D267-Q271 WeakPolarHBondContact O-CB 3.48Å; D267-Q271 VanDerWaalsContact O-CG 3.23Å; D267-Q271 WeakPolarHBondContact O-CG 3.47Å; D267-Q271 PolarHBondContact O-N 3.38Å; D267-Q271 PolarHBondContact OD2-NE2 2.92Å; D267-Y291 PolarHBondContact OD2-OH 2.89Å; D267-K292 HydrophobicContact CB-CD 4.34Å; D267-K292 VanDerWaalsContact OD2-CD 3.27Å; D267-K292 WeakPolarHBondContact OD2-CD 3.44Å; D267-K292 VanDerWaalsContact OD2-CE 3.28Å; D267-K292 WeakPolarHBondContact OD2-CE 3.21Å; D267-K292 IonicContact OD2-NZ 3.11Å; D267-K292 PolarHBondContact OD2-NZ 3.25Å
268	R	91.3	Very high	92	Very high	14 Å²	14	21.1 Å²	21.1	5%	0.053	11%	0.108	C	C	.	.	H	α-helix	trans	-68.7	-42.1	176.9	-63.2	-147.2	-146.5	-150.2	35.1	112.2	F221 L266 R270 Q271 A272 K292 L293 E345	F221-R268 HydrophobicContact CD2-CB 3.88Å; F221-R268 HydrophobicContact CE2-CB 4.09Å; L266-R268 PolarHBondContact O-N 3.04Å; R268-R270 VanDerWaalsContact C-N 3.32Å; R268-R270 PolarHBondContact O-N 3.3Å; R268-Q271 PolarHBondContact O-N 3.38Å; R268-A272 WeakPolarHBondContact O-CB 3.48Å; R268-A272 PolarHBondContact O-N 2.9Å; R268-K292 PolarHBondContact NH1-O 2.9Å; R268-L293 HydrophobicContact CB-CD2 4.13Å; R268-L293 HydrophobicContact CG-CD2 4.44Å; R268-E345 VanDerWaalsContact CD-CD 3.46Å; R268-E345 VanDerWaalsContact CD-OE1 3.32Å; R268-E345 WeakPolarHBondContact CD-OE1 3.46Å; R268-E345 VanDerWaalsContact CZ-CD 3.4Å; R268-E345 IonicContact CZ-OE1 3.74Å; R268-E345 IonicContact CZ-OE2 2.98Å; R268-E345 IonicContact NE-OE1 2.67Å; R268-E345 PolarHBondContact NE-OE1 3.04Å; R268-E345 IonicContact NE-OE2 3.58Å; R268-E345 PolarHBondContact NE-OE2 3.13Å; R268-E345 IonicContact NH1-OE1 3.25Å; R268-E345 IonicContact NH2-OE1 3.87Å; R268-E345 PolarHBondContact NH2-OE1 3.34Å; R268-E345 IonicContact NH2-OE2 3.46Å; R268-E345 PolarHBondContact NH2-OE2 2.93Å
269	S	94.7	Very high	92.2	Very high	3 Å²	3	26.5 Å²	26.5	2%	0.021	13%	0.131	C	C	.	.	H	α-helix	trans	-62.3	-39.8	172.8	-60.7	0	0	0	0	111.7	N217 L266 A272 A273	N217-S269 WeakPolarHBondContact CA-OG 3.41Å; N217-S269 PolarHBondContact O-OG 2.89Å; N217-S269 WeakPolarHBondContact OD1-CB 3.39Å; N217-S269 PolarHBondContact OD1-N 3.06Å; N217-S269 PolarHBondContact OD1-OG 3.18Å; L266-S269 PolarHBondContact O-N 3.31Å; S269-A272 PolarHBondContact O-N 3.46Å; S269-A273 WeakPolarHBondContact O-CB 3.48Å; S269-A273 PolarHBondContact O-N 2.8Å
270	R	95.2	Very high	92.4	Very high	42 Å²	42	23.1 Å²	23.1	16%	0.158	12%	0.116	C	C	.	.	H	α-helix	trans	-60.7	-45.5	173.7	-172.1	-171.8	-64.7	117.1	4	111.5	I246 A262 E263 L266 D267 R268 A273 N274	I246-R270 HydrophobicContact CG2-CB 4.28Å; A262-R270 PolarHBondContact O-NH2 3.5Å; E263-R270 PolarHBondContact O-NH1 3.49Å; L266-R270 WeakPolarHBondContact O-CB 3.5Å; L266-R270 PolarHBondContact O-N 2.95Å; D267-R270 VanDerWaalsContact CA-NH1 3.34Å; D267-R270 WeakPolarHBondContact O-CB 3.48Å; D267-R270 PolarHBondContact O-N 3.37Å; D267-R270 IonicContact OD1-CZ 3.84Å; D267-R270 IonicContact OD1-NH1 2.68Å; D267-R270 PolarHBondContact OD1-NH1 3.01Å; R268-R270 VanDerWaalsContact C-N 3.32Å; R268-R270 PolarHBondContact O-N 3.3Å; R270-A273 PolarHBondContact O-N 3.09Å; R270-N274 WeakPolarHBondContact O-CB 3.11Å; R270-N274 PolarHBondContact O-N 3.14Å; R270-N274 PolarHBondContact O-ND2 2.59Å
271	Q	95	Very high	92.4	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-68.8	-38.5	178.2	-71.3	-171.7	32.3	0	0	112.7	D267 R268 N274 L275 T289 Y291 L293	D267-Q271 WeakPolarHBondContact O-CB 3.48Å; D267-Q271 VanDerWaalsContact O-CG 3.23Å; D267-Q271 WeakPolarHBondContact O-CG 3.47Å; D267-Q271 PolarHBondContact O-N 3.38Å; D267-Q271 PolarHBondContact OD2-NE2 2.92Å; R268-Q271 PolarHBondContact O-N 3.38Å; Q271-N274 PolarHBondContact O-N 3.25Å; Q271-L275 WeakPolarHBondContact O-CB 3.18Å; Q271-L275 PolarHBondContact O-N 3.43Å; Q271-T289 WeakPolarHBondContact CB-O 3.18Å; Q271-T289 WeakPolarHBondContact CG-O 3.21Å; Q271-T289 PolarHBondContact OE1-O 2.74Å; Q271-Y291 VanDerWaalsContact NE2-CE2 3.27Å; Q271-Y291 PolarHBondContact NE2-OH 3.47Å; Q271-L293 HydrophobicContact CB-CD1 4.2Å; Q271-L293 HydrophobicContact CB-CD2 4.12Å; Q271-L293 HydrophobicContact CB-CG 4.02Å
272	A	95	Very high	92.6	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-63.3	-45.2	173.1	0	0	0	0	0	111.8	F221 L224 R268 S269 N274 L275 L276 L293 I301	F221-A272 HydrophobicContact CD2-CB 4.09Å; F221-A272 HydrophobicContact CE2-CB 3.92Å; L224-A272 HydrophobicContact CD1-CB 3.88Å; R268-A272 WeakPolarHBondContact O-CB 3.48Å; R268-A272 PolarHBondContact O-N 2.9Å; S269-A272 PolarHBondContact O-N 3.46Å; A272-N274 VanDerWaalsContact C-N 3.33Å; A272-N274 PolarHBondContact O-N 2.8Å; A272-L275 PolarHBondContact O-N 3.05Å; A272-L276 WeakPolarHBondContact O-CG 3.3Å; A272-L276 PolarHBondContact O-N 3.34Å; A272-L293 HydrophobicContact CB-CD1 4.48Å; A272-I301 HydrophobicContact CB-CD1 3.91Å
273	A	95.5	Very high	92.5	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-60.8	-41.1	174.7	0	0	0	0	0	112.1	L242 Q243 I246 S269 R270 A277	L242-A273 HydrophobicContact CB-CB 3.59Å; Q243-A273 HydrophobicContact CG-CB 4.04Å; I246-A273 HydrophobicContact CD1-CB 4.39Å; S269-A273 WeakPolarHBondContact O-CB 3.48Å; S269-A273 PolarHBondContact O-N 2.8Å; R270-A273 PolarHBondContact O-N 3.09Å; A273-A277 WeakPolarHBondContact O-CB 3.36Å; A273-A277 PolarHBondContact O-N 3.48Å
274	N	95.3	Very high	92.5	Very high	45 Å²	45	26.3 Å²	26.3	24%	0.241	14%	0.143	C	C	.	.	H	α-helix	trans	-64.4	-42.2	174	-70.3	-23.4	0	0	0	112.6	Q243 R270 Q271 A272 A277 T278 T289	Q243-N274 PolarHBondContact NE2-OD1 3.41Å; R270-N274 WeakPolarHBondContact O-CB 3.11Å; R270-N274 PolarHBondContact O-N 3.14Å; R270-N274 PolarHBondContact O-ND2 2.59Å; Q271-N274 PolarHBondContact O-N 3.25Å; A272-N274 VanDerWaalsContact C-N 3.33Å; A272-N274 PolarHBondContact O-N 2.8Å; N274-A277 PolarHBondContact O-N 3.1Å; N274-T278 WeakPolarHBondContact O-CB 3.43Å; N274-T278 PolarHBondContact O-N 3.37Å; N274-T278 PolarHBondContact O-OG1 3.29Å; N274-T289 HydrophobicContact CB-CG2 3.85Å
275	L	94.8	Very high	92.6	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-64.6	-42.9	178.8	-174.2	65.5	0	0	0	111.2	Q271 A272 L286 C290 L293 I301 L302	Q271-L275 WeakPolarHBondContact O-CB 3.18Å; Q271-L275 PolarHBondContact O-N 3.43Å; A272-L275 PolarHBondContact O-N 3.05Å; L275-L286 HydrophobicContact CD1-CB 4.36Å; L275-L286 HydrophobicContact CD1-CD2 3.76Å; L275-C290 HydrophobicContact CD1-CB 4.28Å; L275-C290 HydrophobicContact CD2-CB 4.38Å; L275-L293 HydrophobicContact CD2-CD1 3.99Å; L275-I301 HydrophobicContact CD2-CB 4.33Å; L275-I301 HydrophobicContact CD2-CG2 4.02Å; L275-I301 HydrophobicContact CG-CG2 4.47Å; L275-L302 HydrophobicContact CD1-CD1 4.43Å; L275-L302 HydrophobicContact CD1-CD2 4.03Å; L275-L302 HydrophobicContact CD1-CG 4.47Å; L275-L302 HydrophobicContact CD2-CD2 4.24Å; L275-L302 HydrophobicContact CD2-CG 4.16Å; L275-L302 HydrophobicContact CG-CD2 3.9Å; L275-L302 HydrophobicContact CG-CG 4.36Å
276	L	93.7	Very high	92.5	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-63.3	-43.4	172.3	-73.8	172.7	0	0	0	112.2	L224 L234 T236 A272 T278 K280 I301 F305	L224-L276 HydrophobicContact CD2-CD1 4.16Å; L234-L276 HydrophobicContact CB-CD2 4.12Å; L234-L276 HydrophobicContact CD2-CD1 4.46Å; T236-L276 PolarHBondContact OG1-O 3.34Å; A272-L276 WeakPolarHBondContact O-CG 3.3Å; A272-L276 PolarHBondContact O-N 3.34Å; L276-T278 PolarHBondContact O-N 3.2Å; L276-K280 PolarHBondContact O-NZ 2.63Å; L276-I301 HydrophobicContact CD2-CG2 3.77Å; L276-I301 HydrophobicContact CG-CG2 3.94Å; L276-F305 HydrophobicContact CD2-CD2 3.95Å
277	A	93.4	Very high	92.2	Very high	16 Å²	16	26.7 Å²	26.7	13%	0.132	15%	0.15	C	C	.	.	H	α-helix	trans	-77.8	-14.4	-175.8	0	0	0	0	0	115.2	K240 Q243 A273 N274	K240-A277 HydrophobicContact CG-CB 3.99Å; Q243-A277 HydrophobicContact CG-CB 4.44Å; Q243-A277 VanDerWaalsContact OE1-CB 3.26Å; A273-A277 WeakPolarHBondContact O-CB 3.36Å; A273-A277 PolarHBondContact O-N 3.48Å; N274-A277 PolarHBondContact O-N 3.1Å
278	T	93.4	Very high	92.1	Very high	26 Å²	26	27.1 Å²	27.1	16%	0.16	15%	0.153	C	C	.	.	S	Bend	trans	-83	146.8	-177.1	-63.4	0	0	0	0	111.6	N274 L276 K280 A285 L286	N274-T278 WeakPolarHBondContact O-CB 3.43Å; N274-T278 PolarHBondContact O-N 3.37Å; N274-T278 PolarHBondContact O-OG1 3.29Å; L276-T278 PolarHBondContact O-N 3.2Å; T278-K280 PolarHBondContact O-N 2.88Å; T278-K280 PolarHBondContact O-NZ 3.05Å; T278-A285 HydrophobicContact CG2-CB 3.75Å; T278-L286 HydrophobicContact CG2-CD2 3.71Å; T278-L286 HydrophobicContact CG2-CG 3.93Å
279	Q	90.5	Very high	91.8	Very high	129 Å²	129	27.2 Å²	27.2	60%	0.603	16%	0.156	S	C	*	.			trans	-64.1	128.3	178.1	-63.3	-175.6	-3.9	0	0	110.8	N281 D282	Q279-N281 WeakPolarHBondContact CB-OD1 3.2Å; Q279-N281 PolarHBondContact O-N 3.45Å; Q279-N281 VanDerWaalsContact O-N 3.12Å; Q279-D282 PolarHBondContact O-N 3.32Å
280	K	92.6	Very high	91.4	Very high	2 Å²	2	27.2 Å²	27.2	1%	0.009	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-6.4	-168.3	-54.1	-55.5	177.7	-61.3	0	114.9	T236 L276 T278 L286 L302 F305 C314 V318	T236-K280 PolarHBondContact OG1-NZ 2.69Å; L276-K280 PolarHBondContact O-NZ 2.63Å; T278-K280 PolarHBondContact O-N 2.88Å; T278-K280 PolarHBondContact O-NZ 3.05Å; K280-L286 HydrophobicContact CD-CD2 4.4Å; K280-L302 HydrophobicContact CD-CD2 4.32Å; K280-F305 HydrophobicContact CD-CD1 4.25Å; K280-F305 HydrophobicContact CD-CE1 4.2Å; K280-F305 HydrophobicContact CD-CZ 4.4Å; K280-F305 VanDerWaalsContact CE-CD2 3.42Å; K280-F305 VanDerWaalsContact CE-CZ 3.46Å; K280-F305 HydrophobicContact CG-CD1 3.97Å; K280-F305 HydrophobicContact CG-CE1 3.65Å; K280-F305 HydrophobicContact CG-CZ 4.14Å; K280-C314 HydrophobicContact CB-CB 4.06Å; K280-C314 HydrophobicContact CD-CB 4.44Å; K280-C314 HydrophobicContact CG-CB 4.12Å; K280-V318 WeakPolarHBondContact O-CG1 3.32Å; K280-V318 WeakPolarHBondContact O-CG2 3.39Å
281	N	88.6	Confident	90.9	Very high	82 Å²	82	27.1 Å²	27.1	44%	0.439	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-19.7	173.8	61	-17	0	0	0	114.2	Q279 V283 I312	Q279-N281 WeakPolarHBondContact CB-OD1 3.2Å; Q279-N281 PolarHBondContact O-N 3.45Å; Q279-N281 VanDerWaalsContact O-N 3.12Å; N281-V283 PolarHBondContact O-N 3.18Å; N281-V283 VanDerWaalsContact O-N 3.17Å; N281-I312 HydrophobicContact CB-CD1 4.44Å; N281-I312 HydrophobicContact CB-CG2 4.46Å; N281-I312 WeakPolarHBondContact ND2-CD1 3.33Å
282	D	89.6	Confident	90.5	Very high	74 Å²	74	27.4 Å²	27.4	40%	0.396	16%	0.157	S	C	.	.			trans	-88.4	84.8	-179.5	-170	-13.9	0	0	0	111.7	Q279 A284 A285 L286	Q279-D282 PolarHBondContact O-N 3.32Å; D282-A284 PolarHBondContact O-N 3.3Å; D282-A284 VanDerWaalsContact O-N 3.15Å; D282-A284 WeakPolarHBondContact OD1-CA 3.3Å; D282-A284 WeakPolarHBondContact OD1-CB 3.46Å; D282-A284 PolarHBondContact OD1-N 3.4Å; D282-A285 HydrophobicContact CB-CB 3.87Å; D282-A285 VanDerWaalsContact CG-CB 3.41Å; D282-A285 PolarHBondContact O-N 3.11Å; D282-A285 PolarHBondContact OD1-N 2.78Å; D282-A285 WeakPolarHBondContact OD2-CB 3.39Å; D282-L286 WeakPolarHBondContact O-CB 3.5Å; D282-L286 WeakPolarHBondContact O-CG 3.34Å; D282-L286 PolarHBondContact O-N 2.71Å
283	V	89.7	Confident	90.4	Very high	45 Å²	45	27.4 Å²	27.4	27%	0.273	16%	0.157	S	C	.	.	H	α-helix	trans	-54.3	-30.7	176.2	-174.6	0	0	0	0	112.5	N281 G287 V318 R321 I322	N281-V283 PolarHBondContact O-N 3.18Å; N281-V283 VanDerWaalsContact O-N 3.17Å; V283-G287 PolarHBondContact O-N 2.93Å; V283-V318 HydrophobicContact CG2-CG1 4.44Å; V283-V318 HydrophobicContact CG2-CG2 4.33Å; V283-R321 HydrophobicContact CG1-CB 4.1Å; V283-I322 HydrophobicContact CB-CD1 4.47Å; V283-I322 HydrophobicContact CG1-CD1 3.75Å; V283-I322 WeakPolarHBondContact O-CD1 3.25Å
284	A	88.7	Confident	90.3	Very high	41 Å²	41	27.5 Å²	27.5	34%	0.339	16%	0.157	S	C	.	.	H	α-helix	trans	-80.5	-40.4	-179	0	0	0	0	0	111.9	D282 S288	D282-A284 PolarHBondContact O-N 3.3Å; D282-A284 VanDerWaalsContact O-N 3.15Å; D282-A284 WeakPolarHBondContact OD1-CA 3.3Å; D282-A284 WeakPolarHBondContact OD1-CB 3.46Å; D282-A284 PolarHBondContact OD1-N 3.4Å; A284-S288 WeakPolarHBondContact O-CB 2.94Å; A284-S288 PolarHBondContact O-N 3.5Å
285	A	89.9	Confident	90.3	Very high	28 Å²	28	26 Å²	26	23%	0.231	15%	0.15	C	C	.	.	H	α-helix	trans	-62.9	-54.3	171.2	0	0	0	0	0	110.7	T278 D282 G287 S288 T289	T278-A285 HydrophobicContact CG2-CB 3.75Å; D282-A285 HydrophobicContact CB-CB 3.87Å; D282-A285 VanDerWaalsContact CG-CB 3.41Å; D282-A285 PolarHBondContact O-N 3.11Å; D282-A285 PolarHBondContact OD1-N 2.78Å; D282-A285 WeakPolarHBondContact OD2-CB 3.39Å; A285-G287 PolarHBondContact O-N 3.06Å; A285-S288 WeakPolarHBondContact O-CA 3.28Å; A285-S288 WeakPolarHBondContact O-CB 3.27Å; A285-S288 PolarHBondContact O-N 3.19Å; A285-S288 PolarHBondContact O-OG 2.88Å; A285-T289 WeakPolarHBondContact O-CG2 3.36Å; A285-T289 PolarHBondContact O-N 2.89Å
286	L	90.9	Very high	90.3	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-51	-53.4	178.2	-68.9	166.3	0	0	0	111	L275 T278 K280 D282 S288 T289 V318 I322	L275-L286 HydrophobicContact CD1-CB 4.36Å; L275-L286 HydrophobicContact CD1-CD2 3.76Å; T278-L286 HydrophobicContact CG2-CD2 3.71Å; T278-L286 HydrophobicContact CG2-CG 3.93Å; K280-L286 HydrophobicContact CD-CD2 4.4Å; D282-L286 WeakPolarHBondContact O-CB 3.5Å; D282-L286 WeakPolarHBondContact O-CG 3.34Å; D282-L286 PolarHBondContact O-N 2.71Å; L286-S288 PolarHBondContact O-N 2.99Å; L286-S288 VanDerWaalsContact O-N 3.14Å; L286-T289 PolarHBondContact O-N 2.94Å; L286-T289 PolarHBondContact O-OG1 3Å; L286-V318 HydrophobicContact CD1-CG1 3.63Å; L286-I322 HydrophobicContact CB-CD1 3.75Å; L286-I322 HydrophobicContact CB-CG1 4.13Å; L286-I322 HydrophobicContact CD1-CD1 4.48Å; L286-I322 HydrophobicContact CD1-CG1 4.41Å
287	G	87.9	Confident	90.3	Very high	4 Å²	4	30 Å²	30	4%	0.041	17%	0.171	C	C	.	.	H	α-helix	trans	-62.7	-20.5	178.9	0	0	0	0	0	114.7	V283 A285 L325	V283-G287 PolarHBondContact O-N 2.93Å; A285-G287 PolarHBondContact O-N 3.06Å; G287-L325 VanDerWaalsContact CA-CD2 3.47Å
288	S	87.9	Confident	90.3	Very high	16 Å²	16	29.3 Å²	29.3	11%	0.112	17%	0.165	C	C	.	.	H	α-helix	trans	-84.7	-12.2	173	89.1	0	0	0	0	114.1	A284 A285 L286 R699	A284-S288 WeakPolarHBondContact O-CB 2.94Å; A284-S288 PolarHBondContact O-N 3.5Å; A285-S288 WeakPolarHBondContact O-CA 3.28Å; A285-S288 WeakPolarHBondContact O-CB 3.27Å; A285-S288 PolarHBondContact O-N 3.19Å; A285-S288 PolarHBondContact O-OG 2.88Å; L286-S288 PolarHBondContact O-N 2.99Å; L286-S288 VanDerWaalsContact O-N 3.14Å; S288-R699 PolarHBondContact OG-NH2 2.61Å
289	T	86.6	Confident	90.3	Very high	17 Å²	17	30.5 Å²	30.5	10%	0.104	17%	0.172	C	C	.	.	H	α-helix	trans	-94.1	-22.8	-178.6	63.2	0	0	0	0	114.5	Q271 N274 A285 L286	Q271-T289 WeakPolarHBondContact CB-O 3.18Å; Q271-T289 WeakPolarHBondContact CG-O 3.21Å; Q271-T289 PolarHBondContact OE1-O 2.74Å; N274-T289 HydrophobicContact CB-CG2 3.85Å; A285-T289 WeakPolarHBondContact O-CG2 3.36Å; A285-T289 PolarHBondContact O-N 2.89Å; L286-T289 PolarHBondContact O-N 2.94Å; L286-T289 PolarHBondContact O-OG1 3Å
290	C	85	Confident	90.4	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.014	16%	0.158	C	C	.	.			trans	-115.8	24.9	-165	67.5	0	0	0	0	114.9	L275 K292 L293 V298 I322	L275-C290 HydrophobicContact CD1-CB 4.28Å; L275-C290 HydrophobicContact CD2-CB 4.38Å; C290-K292 PolarHBondContact O-N 2.86Å; C290-K292 VanDerWaalsContact O-N 3.1Å; C290-L293 HydrophobicContact CB-CB 4.15Å; C290-L293 HydrophobicContact CB-CD1 3.97Å; C290-L293 HydrophobicContact CB-CG 4.16Å; C290-L293 PolarHBondContact O-N 3.5Å; C290-V298 HydrophobicContact CB-CG2 4.2Å; C290-I322 WeakPolarHBondContact SG-CG2 3.41Å
291	Y	84.6	Confident	90.4	Very high	40 Å²	40	27.3 Å²	27.3	16%	0.157	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-11.1	-171.2	60.6	-91.6	0	0	0	116.1	D267 Q271 R699 P700	D267-Y291 PolarHBondContact OD2-OH 2.89Å; Q271-Y291 VanDerWaalsContact NE2-CE2 3.27Å; Q271-Y291 PolarHBondContact NE2-OH 3.47Å; Y291-R699 HydrophobicContact CE1-CG 4.42Å; Y291-P700 HydrophobicContact CG-CG 4.13Å
292	K	86.3	Confident	90.6	Very high	8 Å²	8	23.6 Å²	23.6	4%	0.035	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.8	-3.1	169.2	-69.4	177.8	178.8	165.1	0	113.7	D267 R268 C290 H693 H696	D267-K292 HydrophobicContact CB-CD 4.34Å; D267-K292 VanDerWaalsContact OD2-CD 3.27Å; D267-K292 WeakPolarHBondContact OD2-CD 3.44Å; D267-K292 VanDerWaalsContact OD2-CE 3.28Å; D267-K292 WeakPolarHBondContact OD2-CE 3.21Å; D267-K292 IonicContact OD2-NZ 3.11Å; D267-K292 PolarHBondContact OD2-NZ 3.25Å; R268-K292 PolarHBondContact NH1-O 2.9Å; C290-K292 PolarHBondContact O-N 2.86Å; C290-K292 VanDerWaalsContact O-N 3.1Å; K292-H693 WeakPolarHBondContact CD-O 3.3Å; K292-H693 WeakPolarHBondContact CE-O 3.47Å; K292-H696 WeakPolarHBondContact CE-O 3.42Å
293	L	93.1	Very high	90.7	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.143	C	C	.	.	S	Bend	trans	-85.1	128	175.7	-54.8	-171.4	0	0	0	108.3	F221 R268 Q271 A272 L275 C290 Q297 V298 I301 A326 A330	F221-L293 HydrophobicContact CE2-CD2 3.63Å; F221-L293 HydrophobicContact CZ-CD2 4.11Å; R268-L293 HydrophobicContact CB-CD2 4.13Å; R268-L293 HydrophobicContact CG-CD2 4.44Å; Q271-L293 HydrophobicContact CB-CD1 4.2Å; Q271-L293 HydrophobicContact CB-CD2 4.12Å; Q271-L293 HydrophobicContact CB-CG 4.02Å; A272-L293 HydrophobicContact CB-CD1 4.48Å; L275-L293 HydrophobicContact CD2-CD1 3.99Å; C290-L293 HydrophobicContact CB-CB 4.15Å; C290-L293 HydrophobicContact CB-CD1 3.97Å; C290-L293 HydrophobicContact CB-CG 4.16Å; C290-L293 PolarHBondContact O-N 3.5Å; L293-Q297 HydrophobicContact CB-CB 4.36Å; L293-V298 HydrophobicContact CB-CG2 3.78Å; L293-I301 HydrophobicContact CD1-CD1 4.4Å; L293-A326 WeakPolarHBondContact O-CB 3.44Å; L293-A330 WeakPolarHBondContact O-CB 3.45Å
294	N	94.1	Very high	90.6	Very high	2 Å²	2	22.2 Å²	22.2	1%	0.011	14%	0.138	C	C	.	.			trans	-77.5	168.9	179	69.6	49.6	0	0	0	112.1	L296 Q297 V298 A330 D331 V341 T342	N294-L296 VanDerWaalsContact C-N 3.32Å; N294-L296 PolarHBondContact O-N 3.02Å; N294-L296 WeakPolarHBondContact OD1-CB 3.21Å; N294-L296 PolarHBondContact OD1-N 2.89Å; N294-L296 VanDerWaalsContact OD1-N 3.15Å; N294-Q297 VanDerWaalsContact N-OE1 3.13Å; N294-Q297 PolarHBondContact ND2-NE2 3.15Å; N294-Q297 PolarHBondContact ND2-OE1 3.13Å; N294-Q297 WeakPolarHBondContact O-CB 3.25Å; N294-Q297 PolarHBondContact O-N 3.03Å; N294-Q297 VanDerWaalsContact O-N 3.14Å; N294-Q297 WeakPolarHBondContact OD1-CG 3.4Å; N294-Q297 PolarHBondContact OD1-N 3.19Å; N294-V298 WeakPolarHBondContact O-CG2 3.08Å; N294-V298 PolarHBondContact O-N 3.11Å; N294-A330 HydrophobicContact CB-CB 4.47Å; N294-D331 VanDerWaalsContact CA-OD1 3.23Å; N294-D331 WeakPolarHBondContact CA-OD1 3.44Å; N294-D331 VanDerWaalsContact CB-OD1 3.3Å; N294-D331 WeakPolarHBondContact CB-OD1 3.48Å; N294-V341 HydrophobicContact CB-CG1 3.76Å; N294-T342 PolarHBondContact ND2-O 3.13Å
295	S	94.6	Very high	90.7	Very high	14 Å²	14	21 Å²	21	10%	0.098	13%	0.125	C	C	.	.	H	α-helix	trans	-51.8	-46.9	-178.2	59.5	0	0	0	0	112.8	Q297 V298 V299 D331	S295-Q297 PolarHBondContact O-N 3.12Å; S295-V298 PolarHBondContact O-N 3.31Å; S295-V299 WeakPolarHBondContact O-CB 3.32Å; S295-V299 VanDerWaalsContact O-CG2 3.27Å; S295-V299 WeakPolarHBondContact O-CG2 3.47Å; S295-V299 PolarHBondContact O-N 2.92Å; S295-D331 VanDerWaalsContact CB-OD2 3.27Å; S295-D331 WeakPolarHBondContact CB-OD2 3.2Å; S295-D331 PolarHBondContact N-OD1 2.94Å; S295-D331 PolarHBondContact OG-OD2 3.22Å
296	L	94.2	Very high	90.7	Very high	85 Å²	85	24 Å²	24	45%	0.445	13%	0.134	S	C	.	.	H	α-helix	trans	-62.9	-44	179.2	-53.5	-178.6	0	0	0	111.6	N294 H300 V341 L343	N294-L296 VanDerWaalsContact C-N 3.32Å; N294-L296 PolarHBondContact O-N 3.02Å; N294-L296 WeakPolarHBondContact OD1-CB 3.21Å; N294-L296 PolarHBondContact OD1-N 2.89Å; N294-L296 VanDerWaalsContact OD1-N 3.15Å; L296-H300 WeakPolarHBondContact O-CB 3.25Å; L296-H300 PolarHBondContact O-N 3.39Å; L296-V341 HydrophobicContact CD1-CG1 3.94Å; L296-V341 HydrophobicContact CG-CG1 3.99Å; L296-L343 HydrophobicContact CB-CD1 4.39Å
297	Q	94.2	Very high	90.6	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-63.5	-45.8	177.6	-73	172.5	-14.8	0	0	111.8	F221 L293 N294 S295 I301 L343 E345	F221-Q297 HydrophobicContact CE1-CG 3.8Å; F221-Q297 VanDerWaalsContact CE1-NE2 3.33Å; F221-Q297 HydrophobicContact CZ-CB 3.97Å; F221-Q297 VanDerWaalsContact CZ-CD 3.43Å; F221-Q297 HydrophobicContact CZ-CG 3.63Å; L293-Q297 HydrophobicContact CB-CB 4.36Å; N294-Q297 VanDerWaalsContact N-OE1 3.13Å; N294-Q297 PolarHBondContact ND2-NE2 3.15Å; N294-Q297 PolarHBondContact ND2-OE1 3.13Å; N294-Q297 WeakPolarHBondContact O-CB 3.25Å; N294-Q297 PolarHBondContact O-N 3.03Å; N294-Q297 VanDerWaalsContact O-N 3.14Å; N294-Q297 WeakPolarHBondContact OD1-CG 3.4Å; N294-Q297 PolarHBondContact OD1-N 3.19Å; S295-Q297 PolarHBondContact O-N 3.12Å; Q297-I301 WeakPolarHBondContact O-CB 3.37Å; Q297-I301 WeakPolarHBondContact O-CD1 3.38Å; Q297-I301 VanDerWaalsContact O-CG1 3.27Å; Q297-I301 WeakPolarHBondContact O-CG1 3.42Å; Q297-I301 PolarHBondContact O-N 3.39Å; Q297-I301 VanDerWaalsContact O-N 3.09Å; Q297-L343 HydrophobicContact CG-CD1 4.43Å; Q297-L343 WeakPolarHBondContact CG-O 3.38Å; Q297-L343 PolarHBondContact NE2-O 3.04Å; Q297-E345 PolarHBondContact NE2-OE1 3.4Å
298	V	94.4	Very high	90.5	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62.5	-48.3	176.9	165.1	0	0	0	0	111.4	C290 L293 N294 S295 L302 I322 A326	C290-V298 HydrophobicContact CB-CG2 4.2Å; L293-V298 HydrophobicContact CB-CG2 3.78Å; N294-V298 WeakPolarHBondContact O-CG2 3.08Å; N294-V298 PolarHBondContact O-N 3.11Å; S295-V298 PolarHBondContact O-N 3.31Å; V298-L302 HydrophobicContact CG1-CD1 3.89Å; V298-L302 WeakPolarHBondContact O-CB 3.32Å; V298-L302 WeakPolarHBondContact O-CG 3.47Å; V298-L302 PolarHBondContact O-N 3.38Å; V298-I322 HydrophobicContact CG1-CB 3.96Å; V298-I322 HydrophobicContact CG1-CG2 3.62Å; V298-A326 HydrophobicContact CG2-CB 4.04Å
299	V	93.4	Very high	90.1	Very high	52 Å²	52	37.4 Å²	37.4	32%	0.315	21%	0.207	S	C	.	.	H	α-helix	trans	-62.6	-46.2	179.7	170.3	0	0	0	0	110.6	S295 I301 L302 S303 V319 C323	S295-V299 WeakPolarHBondContact O-CB 3.32Å; S295-V299 VanDerWaalsContact O-CG2 3.27Å; S295-V299 WeakPolarHBondContact O-CG2 3.47Å; S295-V299 PolarHBondContact O-N 2.92Å; V299-I301 PolarHBondContact O-N 2.96Å; V299-L302 PolarHBondContact O-N 2.87Å; V299-S303 VanDerWaalsContact O-CB 3.24Å; V299-S303 WeakPolarHBondContact O-CB 3.33Å; V299-S303 PolarHBondContact O-N 3.06Å; V299-S303 PolarHBondContact O-OG 3.2Å; V299-V319 HydrophobicContact CB-CG1 4.44Å; V299-V319 HydrophobicContact CG1-CG1 4.49Å; V299-V319 HydrophobicContact CG2-CG1 4.12Å; V299-C323 HydrophobicContact CG2-CB 3.81Å
300	H	92.6	Very high	89.9	Confident	63 Å²	63	40.7 Å²	40.7	29%	0.292	24%	0.244	S	C	.	.	H	α-helix	trans	-62.1	-45.2	-179.5	-165.5	105.3	0	0	0	112.4	V225 L296 G304 L343	V225-H300 PolarHBondContact O-NE2 2.84Å; L296-H300 WeakPolarHBondContact O-CB 3.25Å; L296-H300 PolarHBondContact O-N 3.39Å; H300-G304 PolarHBondContact O-N 3.07Å; H300-L343 HydrophobicContact CB-CD1 3.65Å
301	I	92.7	Very high	90	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-68.7	-36.8	-178.8	-66.8	167.5	0	0	0	111.8	F221 V225 A272 L275 L276 L293 Q297 V299 F305	F221-I301 HydrophobicContact CE2-CD1 4.38Å; F221-I301 HydrophobicContact CZ-CD1 4.37Å; V225-I301 HydrophobicContact CG1-CD1 4.12Å; V225-I301 HydrophobicContact CG1-CG1 3.92Å; A272-I301 HydrophobicContact CB-CD1 3.91Å; L275-I301 HydrophobicContact CD2-CB 4.33Å; L275-I301 HydrophobicContact CD2-CG2 4.02Å; L275-I301 HydrophobicContact CG-CG2 4.47Å; L276-I301 HydrophobicContact CD2-CG2 3.77Å; L276-I301 HydrophobicContact CG-CG2 3.94Å; L293-I301 HydrophobicContact CD1-CD1 4.4Å; Q297-I301 WeakPolarHBondContact O-CB 3.37Å; Q297-I301 WeakPolarHBondContact O-CD1 3.38Å; Q297-I301 VanDerWaalsContact O-CG1 3.27Å; Q297-I301 WeakPolarHBondContact O-CG1 3.42Å; Q297-I301 PolarHBondContact O-N 3.39Å; Q297-I301 VanDerWaalsContact O-N 3.09Å; V299-I301 PolarHBondContact O-N 2.96Å; I301-F305 PolarHBondContact O-N 3.09Å
302	L	92.1	Very high	90.1	Very high	3 Å²	3	44.5 Å²	44.5	2%	0.016	27%	0.265	C	S	.	.	H	α-helix	trans	-85.1	-38.7	-178.1	-66.9	178.4	0	0	0	113.7	L275 K280 V298 V299 G304 F305 V319 I322	L275-L302 HydrophobicContact CD1-CD1 4.43Å; L275-L302 HydrophobicContact CD1-CD2 4.03Å; L275-L302 HydrophobicContact CD1-CG 4.47Å; L275-L302 HydrophobicContact CD2-CD2 4.24Å; L275-L302 HydrophobicContact CD2-CG 4.16Å; L275-L302 HydrophobicContact CG-CD2 3.9Å; L275-L302 HydrophobicContact CG-CG 4.36Å; K280-L302 HydrophobicContact CD-CD2 4.32Å; V298-L302 HydrophobicContact CG1-CD1 3.89Å; V298-L302 WeakPolarHBondContact O-CB 3.32Å; V298-L302 WeakPolarHBondContact O-CG 3.47Å; V298-L302 PolarHBondContact O-N 3.38Å; V299-L302 PolarHBondContact O-N 2.87Å; L302-G304 VanDerWaalsContact C-N 3.29Å; L302-F305 VanDerWaalsContact O-CB 3.31Å; L302-F305 WeakPolarHBondContact O-CB 3.41Å; L302-F305 PolarHBondContact O-N 3.08Å; L302-V319 HydrophobicContact CB-CG1 4.15Å; L302-V319 HydrophobicContact CB-CG2 3.87Å; L302-I322 HydrophobicContact CD1-CB 4.16Å; L302-I322 HydrophobicContact CD1-CG1 4.29Å; L302-I322 HydrophobicContact CD1-CG2 4.45Å
303	S	90.8	Very high	90.1	Very high	75 Å²	75	47.6 Å²	47.6	52%	0.524	29%	0.286	S	S	.	.	H	α-helix	trans	-75.2	-19.6	174.6	-63.6	0	0	0	0	112.9	V299	V299-S303 VanDerWaalsContact O-CB 3.24Å; V299-S303 WeakPolarHBondContact O-CB 3.33Å; V299-S303 PolarHBondContact O-N 3.06Å; V299-S303 PolarHBondContact O-OG 3.2Å
304	G	88.7	Confident	89.9	Confident	15 Å²	15	48.7 Å²	48.7	16%	0.155	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	0.1	169.3	0	0	0	0	0	114.5	H300 L302 E306	H300-G304 PolarHBondContact O-N 3.07Å; L302-G304 VanDerWaalsContact C-N 3.29Å; G304-E306 PolarHBondContact O-N 3.49Å
305	F	91.6	Very high	89.8	Confident	15 Å²	15	53.2 Å²	53.2	7%	0.066	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-75.9	118	-175.5	177.2	-97.4	0	0	0	112.2	L234 T236 L276 K280 I301 L302 P307 C314	L234-F305 WeakPolarHBondContact O-CA 3.3Å; L234-F305 WeakPolarHBondContact O-CD2 3.36Å; T236-F305 WeakPolarHBondContact OG1-CZ 3.29Å; L276-F305 HydrophobicContact CD2-CD2 3.95Å; K280-F305 HydrophobicContact CD-CD1 4.25Å; K280-F305 HydrophobicContact CD-CE1 4.2Å; K280-F305 HydrophobicContact CD-CZ 4.4Å; K280-F305 VanDerWaalsContact CE-CD2 3.42Å; K280-F305 VanDerWaalsContact CE-CZ 3.46Å; K280-F305 HydrophobicContact CG-CD1 3.97Å; K280-F305 HydrophobicContact CG-CE1 3.65Å; K280-F305 HydrophobicContact CG-CZ 4.14Å; I301-F305 PolarHBondContact O-N 3.09Å; L302-F305 VanDerWaalsContact O-CB 3.31Å; L302-F305 WeakPolarHBondContact O-CB 3.41Å; L302-F305 PolarHBondContact O-N 3.08Å; F305-P307 HydrophobicContact CE1-CB 3.92Å; F305-P307 HydrophobicContact CZ-CB 4.5Å; F305-C314 HydrophobicContact CD1-CB 4.27Å
306	E	89.4	Confident	89.6	Confident	91 Å²	91	58.8 Å²	58.8	43%	0.425	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-102.2	119.6	171.4	-70.6	-171.8	-145.9	0	0	110.1	A231 A232 L234 N235 G304	A231-E306 WeakPolarHBondContact CB-OE1 3.22Å; A232-E306 WeakPolarHBondContact CA-OE1 3.48Å; A232-E306 WeakPolarHBondContact CA-OE2 3.45Å; A232-E306 VanDerWaalsContact CB-OE2 3.32Å; A232-E306 WeakPolarHBondContact CB-OE2 3.27Å; A232-E306 VanDerWaalsContact N-CD 3.34Å; A232-E306 PolarHBondContact N-OE1 3.2Å; L234-E306 PolarHBondContact O-N 2.71Å; N235-E306 WeakPolarHBondContact CA-O 3.47Å; N235-E306 VanDerWaalsContact CB-O 3.28Å; N235-E306 WeakPolarHBondContact CB-O 3.23Å; G304-E306 PolarHBondContact O-N 3.49Å
307	P	88.6	Confident	89.5	Confident	54 Å²	54	59.4 Å²	59.4	35%	0.351	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-72.7	142.1	-179	28.3	-33.6	0	0	0	112.3	F305 E311 P313	F305-P307 HydrophobicContact CE1-CB 3.92Å; F305-P307 HydrophobicContact CZ-CB 4.5Å; P307-E311 HydrophobicContact CB-CB 3.94Å; P307-E311 HydrophobicContact CB-CG 4.21Å; P307-P313 HydrophobicContact CG-CB 4.29Å; P307-P313 HydrophobicContact CG-CG 4.19Å
308	D	85.4	Confident	89.5	Confident	66 Å²	66	59.5 Å²	59.5	35%	0.353	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-68.2	162.5	168.3	-71.6	-51.6	0	0	0	111	R237 G310 E311	R237-D308 PolarHBondContact N-OD2 3.11Å; D308-G310 PolarHBondContact O-N 2.87Å; D308-E311 VanDerWaalsContact O-CB 3.31Å; D308-E311 WeakPolarHBondContact O-CB 3.33Å; D308-E311 PolarHBondContact O-N 3.44Å
309	D	80.5	Confident	89.4	Confident	182 Å²	182	59.9 Å²	59.9	97%	0.973	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	113.6	-178.9	-90.1	-37.3	0	0	0	113
310	G	80.6	Confident	89.5	Confident	87 Å²	87	61.4 Å²	61.4	90%	0.897	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.7	4.1	-179.5	0	0	0	0	0	115.4	D308	D308-G310 PolarHBondContact O-N 2.87Å
311	E	88.3	Confident	89.6	Confident	48 Å²	48	62.6 Å²	62.6	22%	0.224	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-79.1	157.1	169.2	-176.3	161.8	-144.2	0	0	112.3	T236 P307 D308 P313	T236-E311 VanDerWaalsContact CB-OE1 3.23Å; T236-E311 WeakPolarHBondContact CB-OE1 3.4Å; T236-E311 WeakPolarHBondContact CB-OE2 3.4Å; T236-E311 WeakPolarHBondContact CG2-OE1 3.5Å; T236-E311 PolarHBondContact OG1-OE1 3.36Å; T236-E311 PolarHBondContact OG1-OE2 2.88Å; P307-E311 HydrophobicContact CB-CB 3.94Å; P307-E311 HydrophobicContact CB-CG 4.21Å; D308-E311 VanDerWaalsContact O-CB 3.31Å; D308-E311 WeakPolarHBondContact O-CB 3.33Å; D308-E311 PolarHBondContact O-N 3.44Å; E311-P313 WeakPolarHBondContact O-CD 3.41Å
312	I	86.6	Confident	89.7	Confident	74 Å²	74	62.6 Å²	62.6	38%	0.379	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-78.3	121.3	177.4	-52.9	176.7	0	0	0	109	N281	N281-I312 HydrophobicContact CB-CD1 4.44Å; N281-I312 HydrophobicContact CB-CG2 4.46Å; N281-I312 WeakPolarHBondContact ND2-CD1 3.33Å
313	P	87.1	Confident	89.8	Confident	72 Å²	72	63.3 Å²	63.3	47%	0.468	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-59.1	161.4	172.8	-21.5	32.7	0	0	0	112.6	P307 E311	P307-P313 HydrophobicContact CG-CB 4.29Å; P307-P313 HydrophobicContact CG-CG 4.19Å; E311-P313 WeakPolarHBondContact O-CD 3.41Å
314	C	88.4	Confident	90	Very high	24 Å²	24	65 Å²	65	16%	0.162	36%	0.361	C	S	.	.			trans	-87.7	109.2	170.7	-161.9	0	0	0	0	110.1	K280 F305	K280-C314 HydrophobicContact CB-CB 4.06Å; K280-C314 HydrophobicContact CD-CB 4.44Å; K280-C314 HydrophobicContact CG-CB 4.12Å; F305-C314 HydrophobicContact CD1-CB 4.27Å
315	D	90.8	Very high	90.2	Very high	96 Å²	96	66.9 Å²	66.9	51%	0.513	37%	0.367	S	S	.	.			trans	-64.4	139.9	172.5	-59.6	-49.7	0	0	0	110.4	D317 V318 V319	D315-D317 HydrophobicContact CB-CB 4.32Å; D315-D317 PolarHBondContact O-N 3.29Å; D315-D317 VanDerWaalsContact O-N 3.11Å; D315-V318 HydrophobicContact CB-CG2 4.24Å; D315-V318 WeakPolarHBondContact O-CA 3.45Å; D315-V318 WeakPolarHBondContact O-CB 3.28Å; D315-V318 PolarHBondContact O-N 3.04Å; D315-V319 PolarHBondContact O-N 3.34Å
316	D	91.8	Very high	90.3	Very high	132 Å²	132	66.2 Å²	66.2	71%	0.706	37%	0.365	S	S	*	.	H	α-helix	trans	-49.5	-39.8	170.7	-67.4	-43.4	0	0	0	111.4	V318 V319 D320	D316-V318 PolarHBondContact O-N 3.21Å; D316-V319 WeakPolarHBondContact O-CB 3.29Å; D316-V319 PolarHBondContact O-N 3.15Å; D316-D320 VanDerWaalsContact O-CB 3.3Å; D316-D320 WeakPolarHBondContact O-CB 3.31Å; D316-D320 PolarHBondContact O-N 2.81Å
317	D	92.6	Very high	90.6	Very high	97 Å²	97	66.4 Å²	66.4	52%	0.519	37%	0.365	S	S	.	.	H	α-helix	trans	-60.3	-27.2	178.8	-162.1	51.5	0	0	0	112.6	D315 R321	D315-D317 HydrophobicContact CB-CB 4.32Å; D315-D317 PolarHBondContact O-N 3.29Å; D315-D317 VanDerWaalsContact O-N 3.11Å; D317-R321 VanDerWaalsContact C-CZ 3.5Å; D317-R321 WeakPolarHBondContact O-CG 3.48Å; D317-R321 PolarHBondContact O-NE 2.93Å; D317-R321 VanDerWaalsContact O-NE 3.12Å; D317-R321 PolarHBondContact O-NH1 2.86Å; D317-R321 VanDerWaalsContact O-NH1 3.11Å; D317-R321 PolarHBondContact O-NH2 3.03Å; D317-R321 IonicContact OD1-NH1 3.37Å; D317-R321 IonicContact OD2-CZ 3.43Å; D317-R321 IonicContact OD2-NH1 2.74Å; D317-R321 PolarHBondContact OD2-NH1 3.5Å; D317-R321 IonicContact OD2-NH2 3.25Å; D317-R321 PolarHBondContact OD2-NH2 2.87Å
318	V	92.6	Very high	90.7	Very high	2 Å²	2	70.4 Å²	70.4	1%	0.012	38%	0.377	C	S	.	.	H	α-helix	trans	-78.9	-48.6	168.9	174.4	0	0	0	0	111.1	K280 V283 L286 D315 D316 D320 R321 I322	K280-V318 WeakPolarHBondContact O-CG1 3.32Å; K280-V318 WeakPolarHBondContact O-CG2 3.39Å; V283-V318 HydrophobicContact CG2-CG1 4.44Å; V283-V318 HydrophobicContact CG2-CG2 4.33Å; L286-V318 HydrophobicContact CD1-CG1 3.63Å; D315-V318 HydrophobicContact CB-CG2 4.24Å; D315-V318 WeakPolarHBondContact O-CA 3.45Å; D315-V318 WeakPolarHBondContact O-CB 3.28Å; D315-V318 PolarHBondContact O-N 3.04Å; D316-V318 PolarHBondContact O-N 3.21Å; V318-D320 PolarHBondContact O-N 3.05Å; V318-R321 WeakPolarHBondContact O-CB 3.3Å; V318-R321 PolarHBondContact O-N 3.45Å; V318-I322 HydrophobicContact CG1-CG1 4.17Å; V318-I322 PolarHBondContact O-N 2.85Å
319	V	94	Very high	90.9	Very high	8 Å²	8	69.8 Å²	69.8	5%	0.048	37%	0.372	C	S	.	.	H	α-helix	trans	-52	-47.3	178.8	-172.9	0	0	0	0	110.2	V299 L302 D315 D316 R321 I322 C323	V299-V319 HydrophobicContact CB-CG1 4.44Å; V299-V319 HydrophobicContact CG1-CG1 4.49Å; V299-V319 HydrophobicContact CG2-CG1 4.12Å; L302-V319 HydrophobicContact CB-CG1 4.15Å; L302-V319 HydrophobicContact CB-CG2 3.87Å; D315-V319 PolarHBondContact O-N 3.34Å; D316-V319 WeakPolarHBondContact O-CB 3.29Å; D316-V319 PolarHBondContact O-N 3.15Å; V319-R321 VanDerWaalsContact C-N 3.27Å; V319-R321 PolarHBondContact O-N 2.68Å; V319-I322 PolarHBondContact O-N 2.86Å; V319-C323 VanDerWaalsContact O-CB 3.22Å; V319-C323 WeakPolarHBondContact O-CB 3.36Å; V319-C323 PolarHBondContact O-N 3.44Å
320	D	94.7	Very high	91.4	Very high	84 Å²	84	61.3 Å²	61.3	45%	0.449	33%	0.328	S	S	.	.	H	α-helix	trans	-65.5	-26.8	-178.4	-156.2	63.4	0	0	0	112.8	D316 V318 R324	D316-D320 VanDerWaalsContact O-CB 3.3Å; D316-D320 WeakPolarHBondContact O-CB 3.31Å; D316-D320 PolarHBondContact O-N 2.81Å; V318-D320 PolarHBondContact O-N 3.05Å; D320-R324 WeakPolarHBondContact O-CB 3.38Å; D320-R324 WeakPolarHBondContact O-CG 3.38Å; D320-R324 PolarHBondContact O-N 2.85Å; D320-R324 PolarHBondContact O-NE 2.88Å; D320-R324 IonicContact OD2-CZ 3.61Å; D320-R324 IonicContact OD2-NE 2.77Å; D320-R324 PolarHBondContact OD2-NE 3.34Å; D320-R324 IonicContact OD2-NH2 2.62Å; D320-R324 PolarHBondContact OD2-NH2 3.26Å
321	R	94	Very high	92	Very high	89 Å²	89	58 Å²	58	34%	0.336	29%	0.289	S	S	.	.	H	α-helix	trans	-78.3	-41.7	172.6	-77.4	-176.4	-72.9	-95.8	5.3	113.1	V283 D317 V318 V319 L325	V283-R321 HydrophobicContact CG1-CB 4.1Å; D317-R321 VanDerWaalsContact C-CZ 3.5Å; D317-R321 WeakPolarHBondContact O-CG 3.48Å; D317-R321 PolarHBondContact O-NE 2.93Å; D317-R321 VanDerWaalsContact O-NE 3.12Å; D317-R321 PolarHBondContact O-NH1 2.86Å; D317-R321 VanDerWaalsContact O-NH1 3.11Å; D317-R321 PolarHBondContact O-NH2 3.03Å; D317-R321 IonicContact OD1-NH1 3.37Å; D317-R321 IonicContact OD2-CZ 3.43Å; D317-R321 IonicContact OD2-NH1 2.74Å; D317-R321 PolarHBondContact OD2-NH1 3.5Å; D317-R321 IonicContact OD2-NH2 3.25Å; D317-R321 PolarHBondContact OD2-NH2 2.87Å; V318-R321 WeakPolarHBondContact O-CB 3.3Å; V318-R321 PolarHBondContact O-N 3.45Å; V319-R321 VanDerWaalsContact C-N 3.27Å; V319-R321 PolarHBondContact O-N 2.68Å; R321-L325 PolarHBondContact O-N 3.28Å
322	I	94.8	Very high	92.2	Very high	1 Å²	1	60.4 Å²	60.4	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-74.6	-36.9	179.8	-51	-56.4	0	0	0	110.5	V283 L286 C290 V298 L302 V318 V319 R324 L325 A326	V283-I322 HydrophobicContact CB-CD1 4.47Å; V283-I322 HydrophobicContact CG1-CD1 3.75Å; V283-I322 WeakPolarHBondContact O-CD1 3.25Å; L286-I322 HydrophobicContact CB-CD1 3.75Å; L286-I322 HydrophobicContact CB-CG1 4.13Å; L286-I322 HydrophobicContact CD1-CD1 4.48Å; L286-I322 HydrophobicContact CD1-CG1 4.41Å; C290-I322 WeakPolarHBondContact SG-CG2 3.41Å; V298-I322 HydrophobicContact CG1-CB 3.96Å; V298-I322 HydrophobicContact CG1-CG2 3.62Å; L302-I322 HydrophobicContact CD1-CB 4.16Å; L302-I322 HydrophobicContact CD1-CG1 4.29Å; L302-I322 HydrophobicContact CD1-CG2 4.45Å; V318-I322 HydrophobicContact CG1-CG1 4.17Å; V318-I322 PolarHBondContact O-N 2.85Å; V319-I322 PolarHBondContact O-N 2.86Å; I322-R324 PolarHBondContact O-N 3.08Å; I322-L325 WeakPolarHBondContact O-CA 3.38Å; I322-L325 WeakPolarHBondContact O-CB 3.28Å; I322-L325 PolarHBondContact O-N 2.96Å; I322-A326 PolarHBondContact O-N 3.33Å
323	C	94.9	Very high	92.2	Very high	18 Å²	18	59.6 Å²	59.6	12%	0.122	30%	0.295	C	S	.	.	H	α-helix	trans	-54.5	-53.1	170.3	-177.6	0	0	0	0	111.2	V299 V319 L325 A326 E327	V299-C323 HydrophobicContact CG2-CB 3.81Å; V319-C323 VanDerWaalsContact O-CB 3.22Å; V319-C323 WeakPolarHBondContact O-CB 3.36Å; V319-C323 PolarHBondContact O-N 3.44Å; C323-L325 PolarHBondContact O-N 3.41Å; C323-A326 PolarHBondContact O-N 2.79Å; C323-E327 WeakPolarHBondContact O-CG 3.22Å; C323-E327 PolarHBondContact O-N 2.92Å
324	R	94.4	Very high	92.3	Very high	109 Å²	109	56.5 Å²	56.5	41%	0.411	28%	0.275	S	S	.	.	H	α-helix	trans	-65.6	-2.4	175.9	-74.1	-178.5	-75.9	164.3	-8.2	115.4	D320 I322 E327 K328	D320-R324 WeakPolarHBondContact O-CB 3.38Å; D320-R324 WeakPolarHBondContact O-CG 3.38Å; D320-R324 PolarHBondContact O-N 2.85Å; D320-R324 PolarHBondContact O-NE 2.88Å; D320-R324 IonicContact OD2-CZ 3.61Å; D320-R324 IonicContact OD2-NE 2.77Å; D320-R324 PolarHBondContact OD2-NE 3.34Å; D320-R324 IonicContact OD2-NH2 2.62Å; D320-R324 PolarHBondContact OD2-NH2 3.26Å; I322-R324 PolarHBondContact O-N 3.08Å; R324-E327 WeakPolarHBondContact CA-OE2 3.11Å; R324-K328 WeakPolarHBondContact O-CD 3.39Å; R324-K328 WeakPolarHBondContact O-CE 3.46Å; R324-K328 PolarHBondContact O-NZ 3.15Å
325	L	93.4	Very high	92.3	Very high	55 Å²	55	60.6 Å²	60.6	29%	0.288	30%	0.295	S	S	.	.	H	α-helix	trans	-96.5	-45.4	167.6	-173.9	67.2	0	0	0	110.8	G287 R321 I322 C323 K328 Q329	G287-L325 VanDerWaalsContact CA-CD2 3.47Å; R321-L325 PolarHBondContact O-N 3.28Å; I322-L325 WeakPolarHBondContact O-CA 3.38Å; I322-L325 WeakPolarHBondContact O-CB 3.28Å; I322-L325 PolarHBondContact O-N 2.96Å; C323-L325 PolarHBondContact O-N 3.41Å; L325-K328 PolarHBondContact O-N 3.17Å; L325-K328 VanDerWaalsContact O-N 3.15Å; L325-Q329 PolarHBondContact O-N 2.79Å
326	A	94.5	Very high	92.3	Very high	2 Å²	2	61.8 Å²	61.8	2%	0.017	30%	0.297	C	S	.	.	H	α-helix	trans	-58.8	-45.5	175	0	0	0	0	0	112.3	L293 V298 I322 C323 K328 Q329 A330 D331	L293-A326 WeakPolarHBondContact O-CB 3.44Å; V298-A326 HydrophobicContact CG2-CB 4.04Å; I322-A326 PolarHBondContact O-N 3.33Å; C323-A326 PolarHBondContact O-N 2.79Å; A326-K328 PolarHBondContact O-N 2.86Å; A326-K328 VanDerWaalsContact O-N 3.12Å; A326-Q329 CarbonylContact O-C 3.43Å; A326-Q329 PolarHBondContact O-N 2.86Å; A326-A330 PolarHBondContact O-N 3.13Å; A326-D331 PolarHBondContact O-N 3.03Å; A326-D331 VanDerWaalsContact O-N 3.13Å
327	E	94.7	Very high	91.8	Very high	94 Å²	94	58.1 Å²	58.1	44%	0.439	28%	0.278	S	S	.	.	I	π-helix	trans	-49.1	-39.6	172.9	-73.7	-179.5	148.1	0	0	112.9	C323 R324 K332	C323-E327 WeakPolarHBondContact O-CG 3.22Å; C323-E327 PolarHBondContact O-N 2.92Å; R324-E327 WeakPolarHBondContact CA-OE2 3.11Å; E327-K332 PolarHBondContact O-N 3.02Å
328	K	91.6	Very high	91.5	Very high	139 Å²	139	56.7 Å²	56.7	60%	0.604	29%	0.286	S	S	*	.	I	π-helix	trans	-86.8	-14.9	-175.4	-65.8	176.3	-171.4	130.3	0	113.5	R324 L325 A326	R324-K328 WeakPolarHBondContact O-CD 3.39Å; R324-K328 WeakPolarHBondContact O-CE 3.46Å; R324-K328 PolarHBondContact O-NZ 3.15Å; L325-K328 PolarHBondContact O-N 3.17Å; L325-K328 VanDerWaalsContact O-N 3.15Å; A326-K328 PolarHBondContact O-N 2.86Å; A326-K328 VanDerWaalsContact O-N 3.12Å
329	Q	89.2	Confident	91.2	Very high	52 Å²	52	59.8 Å²	59.8	24%	0.243	30%	0.3	C	S	.	.	I	π-helix	trans	-117.1	-78.9	-175.5	-64.3	-174.3	3.2	0	0	110.5	L325 A326 L333	L325-Q329 PolarHBondContact O-N 2.79Å; A326-Q329 CarbonylContact O-C 3.43Å; A326-Q329 PolarHBondContact O-N 2.86Å; Q329-L333 WeakPolarHBondContact O-CB 3.26Å; Q329-L333 VanDerWaalsContact O-CG 3.25Å; Q329-L333 WeakPolarHBondContact O-CG 3.46Å; Q329-L333 PolarHBondContact O-N 3.47Å
330	A	90.5	Very high	90.9	Very high	5 Å²	5	69.6 Å²	69.6	4%	0.041	34%	0.336	C	S	.	.	I	π-helix	trans	-66.6	-47.4	-173.6	0	0	0	0	0	113	L293 N294 A326 L333 T334	L293-A330 WeakPolarHBondContact O-CB 3.45Å; N294-A330 HydrophobicContact CB-CB 4.47Å; A326-A330 PolarHBondContact O-N 3.13Å; A330-L333 PolarHBondContact O-N 3.41Å; A330-T334 WeakPolarHBondContact O-CB 3.41Å; A330-T334 PolarHBondContact O-N 2.77Å; A330-T334 PolarHBondContact O-OG1 2.67Å
331	D	94	Very high	90.8	Very high	17 Å²	17	67.3 Å²	67.3	9%	0.091	33%	0.326	C	S	.	.	I	π-helix	trans	-64.6	-45.9	-179.2	-64.9	39.7	0	0	0	110.7	N294 S295 A326 L333 T334 L335 V341	N294-D331 VanDerWaalsContact CA-OD1 3.23Å; N294-D331 WeakPolarHBondContact CA-OD1 3.44Å; N294-D331 VanDerWaalsContact CB-OD1 3.3Å; N294-D331 WeakPolarHBondContact CB-OD1 3.48Å; S295-D331 VanDerWaalsContact CB-OD2 3.27Å; S295-D331 WeakPolarHBondContact CB-OD2 3.2Å; S295-D331 PolarHBondContact N-OD1 2.94Å; S295-D331 PolarHBondContact OG-OD2 3.22Å; A326-D331 PolarHBondContact O-N 3.03Å; A326-D331 VanDerWaalsContact O-N 3.13Å; D331-L333 PolarHBondContact O-N 3.01Å; D331-T334 WeakPolarHBondContact O-CB 3.17Å; D331-T334 PolarHBondContact O-N 3.19Å; D331-T334 VanDerWaalsContact O-N 3.11Å; D331-L335 WeakPolarHBondContact O-CB 3.28Å; D331-L335 WeakPolarHBondContact O-CG 3.17Å; D331-L335 PolarHBondContact O-N 3.22Å; D331-V341 HydrophobicContact CB-CG2 4.02Å
332	K	90.8	Very high	90.7	Very high	99 Å²	99	66.3 Å²	66.3	43%	0.43	33%	0.329	S	S	.	.	H	α-helix	trans	-55.6	-49.3	175.3	-175.5	-178.4	173.1	-69.3	0	111.5	E327 T334 L335 E336	E327-K332 PolarHBondContact O-N 3.02Å; K332-T334 VanDerWaalsContact C-N 3.3Å; K332-T334 PolarHBondContact O-N 2.91Å; K332-L335 PolarHBondContact O-N 2.67Å; K332-E336 WeakPolarHBondContact CE-OE1 3.48Å; K332-E336 IonicContact NZ-OE1 2.71Å; K332-E336 PolarHBondContact NZ-OE1 3.17Å; K332-E336 IonicContact NZ-OE2 3.37Å; K332-E336 PolarHBondContact NZ-OE2 3.28Å; K332-E336 WeakPolarHBondContact O-CB 3.33Å; K332-E336 WeakPolarHBondContact O-CG 3.47Å; K332-E336 PolarHBondContact O-N 2.96Å
333	L	88.3	Confident	90.6	Very high	56 Å²	56	68.8 Å²	68.8	29%	0.293	34%	0.342	S	S	.	.	H	α-helix	trans	-67.3	-27.7	177.1	-71.4	172.4	0	0	0	113.3	Q329 A330 D331 D337 S692	Q329-L333 WeakPolarHBondContact O-CB 3.26Å; Q329-L333 VanDerWaalsContact O-CG 3.25Å; Q329-L333 WeakPolarHBondContact O-CG 3.46Å; Q329-L333 PolarHBondContact O-N 3.47Å; A330-L333 PolarHBondContact O-N 3.41Å; D331-L333 PolarHBondContact O-N 3.01Å; L333-D337 PolarHBondContact O-N 3.26Å; L333-S692 WeakPolarHBondContact O-CB 3.44Å; L333-S692 PolarHBondContact O-OG 2.81Å
334	T	87.5	Confident	90.4	Very high	7 Å²	7	72.6 Å²	72.6	4%	0.043	36%	0.358	C	S	.	.	H	α-helix	trans	-71.4	-45.2	175.2	-57.6	0	0	0	0	110.5	A330 D331 K332 D337 G338 Q339 V341	A330-T334 WeakPolarHBondContact O-CB 3.41Å; A330-T334 PolarHBondContact O-N 2.77Å; A330-T334 PolarHBondContact O-OG1 2.67Å; D331-T334 WeakPolarHBondContact O-CB 3.17Å; D331-T334 PolarHBondContact O-N 3.19Å; D331-T334 VanDerWaalsContact O-N 3.11Å; K332-T334 VanDerWaalsContact C-N 3.3Å; K332-T334 PolarHBondContact O-N 2.91Å; T334-D337 PolarHBondContact O-N 3.41Å; T334-G338 PolarHBondContact O-N 3.02Å; T334-Q339 HydrophobicContact CG2-CB 3.74Å; T334-Q339 WeakPolarHBondContact O-CB 3.5Å; T334-Q339 PolarHBondContact O-N 3.1Å; T334-V341 HydrophobicContact CG2-CG2 4.33Å
335	L	90.1	Very high	90.2	Very high	111 Å²	111	67.9 Å²	67.9	58%	0.581	34%	0.341	S	S	*	.	H	α-helix	trans	-70	-35.7	178.1	-68	168.5	0	0	0	112.7	D331 K332 D337 G338 V341	D331-L335 WeakPolarHBondContact O-CB 3.28Å; D331-L335 WeakPolarHBondContact O-CG 3.17Å; D331-L335 PolarHBondContact O-N 3.22Å; K332-L335 PolarHBondContact O-N 2.67Å; L335-D337 VanDerWaalsContact C-N 3.3Å; L335-D337 PolarHBondContact O-N 3.23Å; L335-G338 PolarHBondContact O-N 2.82Å; L335-V341 HydrophobicContact CG-CG2 4.37Å
336	E	90.1	Very high	90	Very high	121 Å²	121	68.6 Å²	68.6	57%	0.565	35%	0.35	S	S	*	.	H	α-helix	trans	-66.4	-29.4	175.2	-77.9	175.6	144.8	0	0	112.9	K332 G338	K332-E336 WeakPolarHBondContact CE-OE1 3.48Å; K332-E336 IonicContact NZ-OE1 2.71Å; K332-E336 PolarHBondContact NZ-OE1 3.17Å; K332-E336 IonicContact NZ-OE2 3.37Å; K332-E336 PolarHBondContact NZ-OE2 3.28Å; K332-E336 WeakPolarHBondContact O-CB 3.33Å; K332-E336 WeakPolarHBondContact O-CG 3.47Å; K332-E336 PolarHBondContact O-N 2.96Å; E336-G338 PolarHBondContact O-N 3.02Å
337	D	82.1	Confident	89.6	Confident	54 Å²	54	71.7 Å²	71.7	29%	0.289	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	7.9	170.9	-111.5	50.7	0	0	0	112.8	L333 T334 L335 Q339 P691 S692 R695	L333-D337 PolarHBondContact O-N 3.26Å; T334-D337 PolarHBondContact O-N 3.41Å; L335-D337 VanDerWaalsContact C-N 3.3Å; L335-D337 PolarHBondContact O-N 3.23Å; D337-Q339 PolarHBondContact O-N 3.31Å; D337-P691 WeakPolarHBondContact OD2-CA 3.44Å; D337-S692 VanDerWaalsContact CG-CB 3.49Å; D337-S692 PolarHBondContact OD2-N 3.33Å; D337-R695 IonicContact OD1-CZ 3.66Å; D337-R695 IonicContact OD1-NH1 3.59Å; D337-R695 PolarHBondContact OD1-NH1 3.03Å; D337-R695 IonicContact OD1-NH2 3.55Å; D337-R695 IonicContact OD2-CZ 2.67Å; D337-R695 IonicContact OD2-NH1 2.69Å; D337-R695 PolarHBondContact OD2-NH1 3.38Å; D337-R695 IonicContact OD2-NH2 3.42Å; D337-R695 PolarHBondContact OD2-NH2 2.85Å
338	G	85.2	Confident	89.2	Confident	68 Å²	68	73.9 Å²	73.9	70%	0.701	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.1	9	178.7	0	0	0	0	0	115	T334 L335 E336	T334-G338 PolarHBondContact O-N 3.02Å; L335-G338 PolarHBondContact O-N 2.82Å; E336-G338 PolarHBondContact O-N 3.02Å
339	Q	85.7	Confident	89	Confident	66 Å²	66	68.2 Å²	68.2	31%	0.308	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-85.9	155.3	178.5	-62.7	-167.7	-30.6	0	0	111.3	T334 D337 H693	T334-Q339 HydrophobicContact CG2-CB 3.74Å; T334-Q339 WeakPolarHBondContact O-CB 3.5Å; T334-Q339 PolarHBondContact O-N 3.1Å; D337-Q339 PolarHBondContact O-N 3.31Å; Q339-H693 PolarHBondContact OE1-CE1 3.37Å; Q339-H693 PolarHBondContact OE1-ND1 2.59Å; Q339-H693 VanDerWaalsContact OE1-ND1 3.08Å
340	R	88.9	Confident	88.5	Confident	214 Å²	214	71.2 Å²	71.2	81%	0.808	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-85.1	143	171.7	-66.9	-177.4	179.8	-85	-1.8	109.4	T342	R340-T342 PolarHBondContact O-N 3.3Å
341	V	91.4	Very high	87.9	Confident	37 Å²	37	73 Å²	73	22%	0.224	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-69.3	118.5	167.3	-177	0	0	0	0	108	N294 L296 D331 T334 L335	N294-V341 HydrophobicContact CB-CG1 3.76Å; L296-V341 HydrophobicContact CD1-CG1 3.94Å; L296-V341 HydrophobicContact CG-CG1 3.99Å; D331-V341 HydrophobicContact CB-CG2 4.02Å; T334-V341 HydrophobicContact CG2-CG2 4.33Å; L335-V341 HydrophobicContact CG-CG2 4.37Å
342	T	92.7	Very high	87.4	Confident	67 Å²	67	75.6 Å²	75.6	41%	0.411	40%	0.398	S	S	.	.			trans	-124.3	151.3	179.8	54.7	0	0	0	0	110.3	N294 R340 E344	N294-T342 PolarHBondContact ND2-O 3.13Å; R340-T342 PolarHBondContact O-N 3.3Å; T342-E344 WeakPolarHBondContact CB-O 3.23Å; T342-E344 PolarHBondContact OG1-O 2.98Å
343	L	91.8	Very high	87.2	Confident	53 Å²	53	72.7 Å²	72.7	28%	0.277	39%	0.385	S	S	.	.	S	Bend	trans	-68.8	-55.2	173.6	-178.8	61.1	0	0	0	110.4	V225 L296 Q297 H300	V225-L343 HydrophobicContact CB-CD1 3.84Å; V225-L343 HydrophobicContact CB-CD2 4.4Å; V225-L343 HydrophobicContact CB-CG 3.89Å; V225-L343 HydrophobicContact CG1-CD1 4.12Å; V225-L343 HydrophobicContact CG2-CD1 4.34Å; V225-L343 HydrophobicContact CG2-CG 3.99Å; L296-L343 HydrophobicContact CB-CD1 4.39Å; Q297-L343 HydrophobicContact CG-CD1 4.43Å; Q297-L343 WeakPolarHBondContact CG-O 3.38Å; Q297-L343 PolarHBondContact NE2-O 3.04Å; H300-L343 HydrophobicContact CB-CD1 3.65Å
344	E	91.9	Very high	87.2	Confident	98 Å²	98	72.8 Å²	72.8	46%	0.458	39%	0.385	S	S	.	.	S	Bend	trans	-80.2	150	177.9	-64.7	178	161.4	0	0	112.1	N222 V225 T342	N222-E344 HydrophobicContact CB-CG 4.44Å; V225-E344 HydrophobicContact CG2-CG 4.22Å; T342-E344 WeakPolarHBondContact CB-O 3.23Å; T342-E344 PolarHBondContact OG1-O 2.98Å
345	E	90.2	Very high	87.1	Confident	11 Å²	11	74.8 Å²	74.8	5%	0.051	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-76.2	153.6	164.6	-65.6	-58.9	112.5	0	0	111.1	F221 N222 R268 Q297	F221-E345 HydrophobicContact CB-CG 4.4Å; F221-E345 HydrophobicContact CD1-CG 3.71Å; F221-E345 HydrophobicContact CE1-CG 4.3Å; F221-E345 HydrophobicContact CG-CG 4.11Å; N222-E345 PolarHBondContact ND2-O 2.67Å; N222-E345 WeakPolarHBondContact OD1-CB 3.4Å; N222-E345 PolarHBondContact OD1-N 3.1Å; R268-E345 VanDerWaalsContact CD-CD 3.46Å; R268-E345 VanDerWaalsContact CD-OE1 3.32Å; R268-E345 WeakPolarHBondContact CD-OE1 3.46Å; R268-E345 VanDerWaalsContact CZ-CD 3.4Å; R268-E345 IonicContact CZ-OE1 3.74Å; R268-E345 IonicContact CZ-OE2 2.98Å; R268-E345 IonicContact NE-OE1 2.67Å; R268-E345 PolarHBondContact NE-OE1 3.04Å; R268-E345 IonicContact NE-OE2 3.58Å; R268-E345 PolarHBondContact NE-OE2 3.13Å; R268-E345 IonicContact NH1-OE1 3.25Å; R268-E345 IonicContact NH2-OE1 3.87Å; R268-E345 PolarHBondContact NH2-OE1 3.34Å; R268-E345 IonicContact NH2-OE2 3.46Å; R268-E345 PolarHBondContact NH2-OE2 2.93Å; Q297-E345 PolarHBondContact NE2-OE1 3.4Å
346	S	89.8	Confident	86.7	Confident	69 Å²	69	70.5 Å²	70.5	48%	0.483	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-63	138.4	172	-58	0	0	0	0	111.5	H214 E348	H214-S346 PolarHBondContact CE1-O 2.8Å; H214-S346 VanDerWaalsContact CE1-O 3.25Å; H214-S346 PolarHBondContact NE2-O 3.45Å; H214-S346 VanDerWaalsContact NE2-O 3.13Å; S346-E348 VanDerWaalsContact C-N 3.26Å
347	D	86.3	Confident	86.1	Confident	67 Å²	67	73 Å²	73	36%	0.358	39%	0.386	S	S	.	.	S	Bend	trans	-76.5	-15.9	174.4	-129.9	8.2	0	0	0	112.4	R164	R164-D347 IonicContact CZ-OD1 3.62Å; R164-D347 IonicContact CZ-OD2 3.1Å; R164-D347 IonicContact NH1-OD2 3.42Å; R164-D347 IonicContact NH2-OD1 2.85Å; R164-D347 PolarHBondContact NH2-OD1 2.98Å; R164-D347 IonicContact NH2-OD2 2.69Å; R164-D347 PolarHBondContact NH2-OD2 3.48Å
348	E	84.4	Confident	85.8	Confident	141 Å²	141	75.6 Å²	75.6	66%	0.659	40%	0.4	S	S	*	.	S	Bend	trans	-114.4	128.6	178	-65	-170.2	167.8	0	0	111.7	S346 N350	S346-E348 VanDerWaalsContact C-N 3.26Å; E348-N350 PolarHBondContact O-N 3.3Å; E348-N350 PolarHBondContact O-ND2 3.12Å; E348-N350 VanDerWaalsContact O-ND2 3.07Å
349	L	88	Confident	85.1	Confident	19 Å²	19	73.2 Å²	73.2	10%	0.099	38%	0.375	C	S	.	.			trans	-75.5	97	174.5	-173.2	54.2	0	0	0	109.9	H214 L351 Y694	H214-L349 HydrophobicContact CB-CB 4.38Å; H214-L349 HydrophobicContact CB-CD1 4.31Å; H214-L349 HydrophobicContact CB-CD2 4.02Å; H214-L349 HydrophobicContact CB-CG 4.48Å; H214-L349 PolarHBondContact NE2-N 2.96Å; L349-L351 HydrophobicContact CD1-CD1 4.4Å; L349-L351 HydrophobicContact CD1-CG 4.4Å; L349-L351 HydrophobicContact CD2-CD1 3.89Å; L349-L351 HydrophobicContact CG-CB 4.37Å; L349-L351 HydrophobicContact CG-CD1 4.03Å; L349-L351 HydrophobicContact CG-CG 4.16Å; L349-L351 PolarHBondContact O-N 2.93Å; L349-Y694 HydrophobicContact CD1-CE2 4.16Å
350	N	79.4	Confident	84.3	Confident	115 Å²	115	74 Å²	74	62%	0.615	38%	0.376	S	S	*	.			trans	-73.9	61.9	-179.2	-79.3	-81.6	0	0	0	112.8	E348	E348-N350 PolarHBondContact O-N 3.3Å; E348-N350 PolarHBondContact O-ND2 3.12Å; E348-N350 VanDerWaalsContact O-ND2 3.07Å
351	L	78.2	Confident	83.3	Confident	43 Å²	43	65.3 Å²	65.3	23%	0.225	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-101.9	137.9	171.9	-90.9	177	0	0	0	111	L349 F353 L690	L349-L351 HydrophobicContact CD1-CD1 4.4Å; L349-L351 HydrophobicContact CD1-CG 4.4Å; L349-L351 HydrophobicContact CD2-CD1 3.89Å; L349-L351 HydrophobicContact CG-CB 4.37Å; L349-L351 HydrophobicContact CG-CD1 4.03Å; L349-L351 HydrophobicContact CG-CG 4.16Å; L349-L351 PolarHBondContact O-N 2.93Å; L351-F353 PolarHBondContact O-N 2.85Å; L351-L690 HydrophobicContact CD1-CD2 4.02Å; L351-L690 HydrophobicContact CD2-CD2 3.62Å; L351-L690 HydrophobicContact CD2-CG 4.13Å; L351-L690 HydrophobicContact CG-CD2 4.01Å
352	P	82.3	Confident	81.6	Confident	72 Å²	72	64.5 Å²	64.5	47%	0.468	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-61	124.7	166.2	-20.1	32.4	0	0	0	110.2	L354	P352-L354 PolarHBondContact O-N 3.23Å
353	F	87.3	Confident	79.7	Confident	38 Å²	38	67.4 Å²	67.4	17%	0.167	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-63.6	129	176.8	179.6	-114.2	0	0	0	110.9	I148 E149 F152 L204 L351 I355	I148-F353 HydrophobicContact CG2-CE1 3.95Å; I148-F353 HydrophobicContact CG2-CZ 3.9Å; E149-F353 HydrophobicContact CB-CD1 3.53Å; E149-F353 HydrophobicContact CB-CE1 3.76Å; E149-F353 HydrophobicContact CB-CG 4.25Å; E149-F353 HydrophobicContact CG-CB 3.91Å; E149-F353 HydrophobicContact CG-CD1 3.56Å; E149-F353 HydrophobicContact CG-CE1 4.21Å; E149-F353 HydrophobicContact CG-CG 3.78Å; F152-F353 HydrophobicContact CB-CD2 4.46Å; F152-F353 HydrophobicContact CB-CE2 3.74Å; F152-F353 HydrophobicContact CB-CZ 4.02Å; F152-F353 AromaticContact CD1-CD2 3.88Å; F152-F353 HydrophobicContact CD1-CD2 3.88Å; F152-F353 AromaticContact CD1-CE2 3.82Å; F152-F353 HydrophobicContact CD1-CE2 3.82Å; F152-F353 AromaticContact CD2-CE2 3.79Å; F152-F353 HydrophobicContact CD2-CE2 3.79Å; F152-F353 HydrophobicContact CE1-CD2 4.3Å; F152-F353 HydrophobicContact CE1-CE2 4.4Å; F152-F353 HydrophobicContact CE2-CE2 4.37Å; F152-F353 HydrophobicContact CG-CD2 4.06Å; F152-F353 AromaticContact CG-CE2 3.49Å; F152-F353 HydrophobicContact CG-CE2 3.49Å; F152-F353 VanDerWaalsContact CG-CE2 3.49Å; F152-F353 HydrophobicContact CG-CZ 4.25Å; L204-F353 HydrophobicContact CD2-CE2 3.63Å; L204-F353 HydrophobicContact CD2-CZ 3.64Å; L351-F353 PolarHBondContact O-N 2.85Å; F353-I355 HydrophobicContact CD1-CG1 4.04Å; F353-I355 HydrophobicContact CE1-CD1 4.19Å; F353-I355 HydrophobicContact CE1-CG1 3.5Å; F353-I355 VanDerWaalsContact CE1-CG1 3.5Å; F353-I355 HydrophobicContact CZ-CG1 4.3Å
354	L	87.5	Confident	77.9	Confident	58 Å²	58	71.3 Å²	71.3	30%	0.304	37%	0.365	S	S	.	.			trans	-113	111.4	-178.3	-61.3	-177.1	0	0	0	110.9	Q207 P352 V686	Q207-L354 PolarHBondContact NE2-O 3.47Å; P352-L354 PolarHBondContact O-N 3.23Å; L354-V686 HydrophobicContact CD1-CB 4.25Å; L354-V686 HydrophobicContact CD1-CG1 3.74Å; L354-V686 HydrophobicContact CD1-CG2 3.58Å
355	I	85.4	Confident	76.2	Confident	48 Å²	48	71.7 Å²	71.7	25%	0.246	37%	0.365	C	S	.	.			trans	-74.4	128.3	169.3	-64.3	175.6	0	0	0	108.5	S145 I148 F353 Q357	S145-I355 VanDerWaalsContact CA-CD1 3.46Å; I148-I355 HydrophobicContact CD1-CD1 4.47Å; F353-I355 HydrophobicContact CD1-CG1 4.04Å; F353-I355 HydrophobicContact CE1-CD1 4.19Å; F353-I355 HydrophobicContact CE1-CG1 3.5Å; F353-I355 VanDerWaalsContact CE1-CG1 3.5Å; F353-I355 HydrophobicContact CZ-CG1 4.3Å; I355-Q357 PolarHBondContact O-N 3.31Å
356	P	82.5	Confident	74.5	Confident	22 Å²	22	82.2 Å²	82.2	14%	0.143	40%	0.404	C	S	.	.			trans	-61.4	135.3	173.9	-18.6	30.3	0	0	0	110.9	N201 A203 L204 D358	N201-P356 HydrophobicContact CB-CB 4.28Å; N201-P356 HydrophobicContact CB-CG 3.81Å; N201-P356 VanDerWaalsContact CG-CB 3.46Å; N201-P356 WeakPolarHBondContact ND2-CB 3.31Å; N201-P356 WeakPolarHBondContact OD1-CB 3.35Å; N201-P356 VanDerWaalsContact OD1-CG 3.29Å; N201-P356 WeakPolarHBondContact OD1-CG 3.5Å; A203-P356 HydrophobicContact CB-CG 4.28Å; L204-P356 HydrophobicContact CD1-CG 4Å; L204-P356 HydrophobicContact CG-CG 3.7Å; P356-D358 VanDerWaalsContact C-N 3.27Å
357	Q	76.5	Confident	73.4	Confident	174 Å²	174	83.5 Å²	83.5	81%	0.813	41%	0.409	S	S	*	.	S	Bend	trans	-78.1	-18.9	170.6	-63.4	-175	13.5	0	0	111.6	H128 I355	H128-Q357 PolarHBondContact CE1-O 3.27Å; H128-Q357 PolarHBondContact ND1-O 3.46Å; I355-Q357 PolarHBondContact O-N 3.31Å
358	D	77.4	Confident	72.9	Confident	107 Å²	107	81.7 Å²	81.7	57%	0.572	40%	0.401	S	S	*	.	S	Bend	trans	-97.7	137.2	-179.6	-46.8	-53.3	0	0	0	111.5	N201 P356	N201-D358 PolarHBondContact ND2-O 3.1Å; P356-D358 VanDerWaalsContact C-N 3.27Å
359	G	69.1	Low	72.8	Confident	18 Å²	18	76.1 Å²	76.1	19%	0.186	38%	0.377	C	S	.	.			trans	-80	163.5	175.1	0	0	0	0	0	111.2	E125 H128	E125-G359 WeakPolarHBondContact OE2-CA 3.36Å; H128-G359 WeakPolarHBondContact CD2-CA 3.33Å; H128-G359 PolarHBondContact CD2-N 3.39Å; H128-G359 PolarHBondContact CE1-N 2.98Å; H128-G359 PolarHBondContact ND1-N 3Å; H128-G359 WeakPolarHBondContact NE2-CA 3.31Å; H128-G359 PolarHBondContact NE2-N 3.09Å; H128-G359 VanDerWaalsContact NE2-N 3.11Å
360	Y	68.8	Low	72.4	Confident	84 Å²	84	81.1 Å²	81.1	33%	0.329	40%	0.404	S	S	.	.	S	Bend	trans	-72.1	-42.8	176.2	-171.4	-96.3	0	0	0	111.5	L71 E125 G199 Q364	L71-Y360 HydrophobicContact CD1-CD1 3.84Å; L71-Y360 HydrophobicContact CD1-CG 4.23Å; E125-Y360 PolarHBondContact OE2-N 3.49Å; G199-Y360 WeakPolarHBondContact O-CB 3.34Å; G199-Y360 WeakPolarHBondContact O-CD2 3.47Å; Y360-Q364 PolarHBondContact O-NE2 3.11Å; Y360-Q364 VanDerWaalsContact O-NE2 3.09Å
361	F	68.6	Low	72.6	Confident	30 Å²	30	75.9 Å²	75.9	13%	0.132	38%	0.377	C	S	.	.	S	Bend	trans	-122.2	-28.4	-160.9	-155.3	-86.8	0	0	0	114.8	F69 L71 E125 E363 Q364 F365 P369	F69-F361 HydrophobicContact CD2-CE2 4.33Å; F69-F361 HydrophobicContact CD2-CZ 4.47Å; F69-F361 HydrophobicContact CE2-CD1 4Å; F69-F361 AromaticContact CE2-CD2 3.63Å; F69-F361 HydrophobicContact CE2-CD2 3.63Å; F69-F361 HydrophobicContact CE2-CE1 4.03Å; F69-F361 AromaticContact CE2-CE2 3.63Å; F69-F361 HydrophobicContact CE2-CE2 3.63Å; F69-F361 AromaticContact CE2-CG 3.8Å; F69-F361 HydrophobicContact CE2-CG 3.8Å; F69-F361 AromaticContact CE2-CZ 3.82Å; F69-F361 HydrophobicContact CE2-CZ 3.82Å; F69-F361 HydrophobicContact CZ-CD1 4.04Å; F69-F361 HydrophobicContact CZ-CD2 4.3Å; F69-F361 HydrophobicContact CZ-CE1 4.35Å; F69-F361 HydrophobicContact CZ-CG 4.01Å; L71-F361 HydrophobicContact CD1-CB 4.24Å; E125-F361 WeakPolarHBondContact OE1-CB 3.49Å; E125-F361 PolarHBondContact OE1-N 3.41Å; F361-E363 VanDerWaalsContact C-N 3.29Å; F361-E363 PolarHBondContact O-N 3.05Å; F361-E363 VanDerWaalsContact O-N 3.1Å; F361-Q364 PolarHBondContact O-N 2.88Å; F361-Q364 VanDerWaalsContact O-N 3.1Å; F361-F365 AromaticContact CD1-CD2 3.88Å; F361-F365 HydrophobicContact CD1-CD2 3.88Å; F361-F365 HydrophobicContact CD1-CE2 4.48Å; F361-F365 HydrophobicContact CD2-CE2 4.37Å; F361-F365 HydrophobicContact CE1-CB 4.11Å; F361-F365 AromaticContact CE1-CD2 3.15Å; F361-F365 HydrophobicContact CE1-CD2 3.15Å; F361-F365 AromaticContact CE1-CE2 3.67Å; F361-F365 HydrophobicContact CE1-CE2 3.67Å; F361-F365 AromaticContact CE1-CG 3.71Å; F361-F365 HydrophobicContact CE1-CG 3.71Å; F361-F365 AromaticContact CE2-CD2 3.96Å; F361-F365 HydrophobicContact CE2-CD2 3.96Å; F361-F365 AromaticContact CE2-CE2 3.58Å; F361-F365 HydrophobicContact CE2-CE2 3.58Å; F361-F365 HydrophobicContact CE2-CZ 4.35Å; F361-F365 AromaticContact CZ-CD2 3.22Å; F361-F365 HydrophobicContact CZ-CD2 3.22Å; F361-F365 HydrophobicContact CZ-CE1 4.47Å; F361-F365 AromaticContact CZ-CE2 3.18Å; F361-F365 HydrophobicContact CZ-CE2 3.18Å; F361-F365 AromaticContact CZ-CG 3.95Å; F361-F365 HydrophobicContact CZ-CG 3.95Å; F361-F365 AromaticContact CZ-CZ 3.85Å; F361-F365 HydrophobicContact CZ-CZ 3.85Å; F361-P369 HydrophobicContact CD1-CG 4.28Å; F361-P369 HydrophobicContact CE1-CB 4.4Å; F361-P369 HydrophobicContact CE1-CG 3.39Å; F361-P369 HydrophobicContact CZ-CB 4.4Å; F361-P369 HydrophobicContact CZ-CG 3.85Å
362	V	55.9	Low	72.9	Confident	20 Å²	20	74 Å²	74	12%	0.121	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50	-38.5	-171.7	176.1	0	0	0	0	115.2	L35 Y75 L129	L35-V362 HydrophobicContact CD1-CG1 3.31Å; L35-V362 HydrophobicContact CD2-CG1 3.68Å; L35-V362 HydrophobicContact CG-CG1 4.08Å; Y75-V362 VanDerWaalsContact OH-CG2 3.29Å; Y75-V362 WeakPolarHBondContact OH-CG2 3.45Å; Y75-V362 PolarHBondContact OH-N 3.41Å; L129-V362 HydrophobicContact CD2-CG2 3.59Å; L129-V362 HydrophobicContact CG-CG2 4.33Å
363	E	53.3	Low	73	Confident	129 Å²	129	73.7 Å²	73.7	60%	0.603	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-9.4	-174.4	-54.4	-155.7	148.8	0	0	114.3	R132 F361	R132-E363 IonicContact CZ-OE1 3.68Å; R132-E363 IonicContact NH1-OE1 2.95Å; R132-E363 PolarHBondContact NH1-OE1 3.45Å; R132-E363 IonicContact NH2-OE1 3.26Å; R132-E363 PolarHBondContact NH2-OE1 3.42Å; F361-E363 VanDerWaalsContact C-N 3.29Å; F361-E363 PolarHBondContact O-N 3.05Å; F361-E363 VanDerWaalsContact O-N 3.1Å
364	Q	54.2	Low	73	Confident	135 Å²	135	76.2 Å²	76.2	63%	0.631	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-19.5	-168.7	-60.9	-174.6	24.1	0	0	113.8	Y360 F361	Y360-Q364 PolarHBondContact O-NE2 3.11Å; Y360-Q364 VanDerWaalsContact O-NE2 3.09Å; F361-Q364 PolarHBondContact O-N 2.88Å; F361-Q364 VanDerWaalsContact O-N 3.1Å
365	F	54.8	Low	73	Confident	105 Å²	105	73.9 Å²	73.9	46%	0.461	36%	0.356	S	S	.	.			trans	-131.9	125.8	-173.3	-67.6	-95.1	0	0	0	112.5	F361 T367	F361-F365 AromaticContact CD1-CD2 3.88Å; F361-F365 HydrophobicContact CD1-CD2 3.88Å; F361-F365 HydrophobicContact CD1-CE2 4.48Å; F361-F365 HydrophobicContact CD2-CE2 4.37Å; F361-F365 HydrophobicContact CE1-CB 4.11Å; F361-F365 AromaticContact CE1-CD2 3.15Å; F361-F365 HydrophobicContact CE1-CD2 3.15Å; F361-F365 AromaticContact CE1-CE2 3.67Å; F361-F365 HydrophobicContact CE1-CE2 3.67Å; F361-F365 AromaticContact CE1-CG 3.71Å; F361-F365 HydrophobicContact CE1-CG 3.71Å; F361-F365 AromaticContact CE2-CD2 3.96Å; F361-F365 HydrophobicContact CE2-CD2 3.96Å; F361-F365 AromaticContact CE2-CE2 3.58Å; F361-F365 HydrophobicContact CE2-CE2 3.58Å; F361-F365 HydrophobicContact CE2-CZ 4.35Å; F361-F365 AromaticContact CZ-CD2 3.22Å; F361-F365 HydrophobicContact CZ-CD2 3.22Å; F361-F365 HydrophobicContact CZ-CE1 4.47Å; F361-F365 AromaticContact CZ-CE2 3.18Å; F361-F365 HydrophobicContact CZ-CE2 3.18Å; F361-F365 AromaticContact CZ-CG 3.95Å; F361-F365 HydrophobicContact CZ-CG 3.95Å; F361-F365 AromaticContact CZ-CZ 3.85Å; F361-F365 HydrophobicContact CZ-CZ 3.85Å; F365-T367 PolarHBondContact O-N 3.11Å
366	R	55.8	Low	73.1	Confident	232 Å²	232	71.6 Å²	71.6	88%	0.875	34%	0.344	S	S	*	.	S	Bend	trans	-83.6	5.4	170.5	-68.1	-173.7	178.5	-93.9	1.4	113.4
367	T	66.1	Low	73.3	Confident	96 Å²	96	74 Å²	74	59%	0.589	35%	0.354	S	S	*	.	S	Bend	trans	-138.1	158.4	-173.1	54.1	0	0	0	0	110.5	F365	F365-T367 PolarHBondContact O-N 3.11Å
368	V	76.1	Confident	73.7	Confident	29 Å²	29	69 Å²	69	18%	0.176	33%	0.331	C	S	.	.			trans	-63.8	135.4	174.7	-176.5	0	0	0	0	110.4	P38 L39 W373 L390	P38-V368 HydrophobicContact CG-CG2 3.98Å; L39-V368 HydrophobicContact CD1-CG1 3.77Å; L39-V368 HydrophobicContact CD1-CG2 3.97Å; L39-V368 HydrophobicContact CD2-CG1 4.38Å; L39-V368 HydrophobicContact CD2-CG2 3.94Å; L39-V368 HydrophobicContact CG-CG1 4.3Å; L39-V368 HydrophobicContact CG-CG2 3.65Å; V368-W373 HydrophobicContact CG1-CB 4.09Å; V368-L390 HydrophobicContact CG2-CD2 3.78Å
369	P	81.3	Confident	74.2	Confident	25 Å²	25	64.1 Å²	64.1	16%	0.162	31%	0.305	C	S	.	.			trans	-70.2	132.6	169.5	-22	36.2	0	0	0	111.5	F69 F361 G371 L372 W373	F69-P369 HydrophobicContact CD2-CB 4.43Å; F69-P369 HydrophobicContact CE2-CG 4.44Å; F69-P369 HydrophobicContact CZ-CG 4.45Å; F361-P369 HydrophobicContact CD1-CG 4.28Å; F361-P369 HydrophobicContact CE1-CB 4.4Å; F361-P369 HydrophobicContact CE1-CG 3.39Å; F361-P369 HydrophobicContact CZ-CB 4.4Å; F361-P369 HydrophobicContact CZ-CG 3.85Å; P369-G371 PolarHBondContact O-N 3.13Å; P369-G371 VanDerWaalsContact O-N 3.16Å; P369-L372 HydrophobicContact CB-CB 4.19Å; P369-L372 HydrophobicContact CG-CB 4.46Å; P369-L372 WeakPolarHBondContact O-CB 3.33Å; P369-L372 PolarHBondContact O-N 3.39Å; P369-W373 PolarHBondContact O-N 3.37Å
370	D	79.8	Confident	75.1	Confident	123 Å²	123	66.9 Å²	66.9	66%	0.658	31%	0.313	S	S	*	.	H	α-helix	trans	-55.3	-37	179.2	-62.1	-50	0	0	0	112.5	L372 W373 Q374	D370-L372 PolarHBondContact O-N 2.69Å; D370-W373 PolarHBondContact O-N 2.71Å; D370-Q374 WeakPolarHBondContact O-CB 3.49Å; D370-Q374 WeakPolarHBondContact O-CG 3.45Å; D370-Q374 PolarHBondContact O-N 3.11Å
371	G	83.3	Confident	75.9	Confident	6 Å²	6	70.4 Å²	70.4	6%	0.062	33%	0.332	C	S	.	.	H	α-helix	trans	-67.9	-30.4	176.6	0	0	0	0	0	114.8	T68 P369 Y375	T68-G371 WeakPolarHBondContact OG1-CA 3.34Å; P369-G371 PolarHBondContact O-N 3.13Å; P369-G371 VanDerWaalsContact O-N 3.16Å; G371-Y375 WeakPolarHBondContact O-CB 3.35Å; G371-Y375 PolarHBondContact O-N 3.09Å
372	L	85.8	Confident	76.8	Confident	2 Å²	2	74.7 Å²	74.7	1%	0.01	35%	0.347	C	S	.	.	H	α-helix	trans	-72.5	-44.2	171.2	177	61.1	0	0	0	110	L39 F69 Y75 P369 D370 Y375 L376	L39-L372 HydrophobicContact CD1-CD2 4Å; F69-L372 HydrophobicContact CD1-CB 3.76Å; F69-L372 HydrophobicContact CD1-CD1 4.36Å; F69-L372 HydrophobicContact CE1-CB 4.17Å; F69-L372 HydrophobicContact CE1-CD1 4.48Å; Y75-L372 HydrophobicContact CD1-CD2 3.83Å; Y75-L372 HydrophobicContact CG-CD2 4.01Å; P369-L372 HydrophobicContact CB-CB 4.19Å; P369-L372 HydrophobicContact CG-CB 4.46Å; P369-L372 WeakPolarHBondContact O-CB 3.33Å; P369-L372 PolarHBondContact O-N 3.39Å; D370-L372 PolarHBondContact O-N 2.69Å; L372-Y375 PolarHBondContact O-N 3.39Å; L372-L376 HydrophobicContact CD1-CD1 4.12Å; L372-L376 HydrophobicContact CD1-CG 4.18Å; L372-L376 HydrophobicContact CG-CD1 4.05Å; L372-L376 HydrophobicContact CG-CG 4.49Å; L372-L376 WeakPolarHBondContact O-CG 3.39Å; L372-L376 PolarHBondContact O-N 2.94Å
373	W	84.7	Confident	78.2	Confident	66 Å²	66	83.2 Å²	83.2	25%	0.25	38%	0.377	C	S	.	.	H	α-helix	trans	-60.3	-47.6	177.6	-178.5	-99.7	0	0	0	111.8	L39 V368 P369 D370 Y375 L376 Q377 V388 L390	L39-W373 HydrophobicContact CD2-CE3 3.76Å; L39-W373 HydrophobicContact CD2-CZ3 3.64Å; V368-W373 HydrophobicContact CG1-CB 4.09Å; P369-W373 PolarHBondContact O-N 3.37Å; D370-W373 PolarHBondContact O-N 2.71Å; W373-Y375 PolarHBondContact O-N 2.9Å; W373-L376 PolarHBondContact O-N 2.82Å; W373-Q377 VanDerWaalsContact NE1-NE2 3.14Å; W373-Q377 WeakPolarHBondContact O-CB 3.33Å; W373-Q377 WeakPolarHBondContact O-CG 3.43Å; W373-Q377 PolarHBondContact O-N 2.86Å; W373-V388 HydrophobicContact CE3-CG1 4.08Å; W373-V388 HydrophobicContact CH2-CG1 4.13Å; W373-V388 HydrophobicContact CZ3-CB 4.49Å; W373-V388 HydrophobicContact CZ3-CG1 3.59Å; W373-L390 HydrophobicContact CH2-CG 4.36Å; W373-L390 HydrophobicContact CZ3-CD2 4.16Å; W373-L390 HydrophobicContact CZ3-CG 4.1Å
374	Q	85.9	Confident	79.7	Confident	92 Å²	92	77.9 Å²	77.9	43%	0.43	35%	0.352	S	S	.	.	H	α-helix	trans	-58.7	-44.3	175.6	-73.2	165.1	9.4	0	0	112.1	D370 Q377 Q378	D370-Q374 WeakPolarHBondContact O-CB 3.49Å; D370-Q374 WeakPolarHBondContact O-CG 3.45Å; D370-Q374 PolarHBondContact O-N 3.11Å; Q374-Q377 PolarHBondContact O-N 3.19Å; Q374-Q378 WeakPolarHBondContact O-CG 3.34Å; Q374-Q378 PolarHBondContact O-N 2.72Å
375	Y	87.5	Confident	81.1	Confident	8 Å²	8	71.5 Å²	71.5	3%	0.031	32%	0.323	C	S	.	.	H	α-helix	trans	-62.7	-46.4	176.7	179.8	-100.5	0	0	0	112.1	M66 S76 G371 L372 W373 Q377 Q378 L379	M66-Y375 HydrophobicContact CG-CE2 4.48Å; S76-Y375 WeakPolarHBondContact OG-CE1 3.44Å; G371-Y375 WeakPolarHBondContact O-CB 3.35Å; G371-Y375 PolarHBondContact O-N 3.09Å; L372-Y375 PolarHBondContact O-N 3.39Å; W373-Y375 PolarHBondContact O-N 2.9Å; Y375-Q377 VanDerWaalsContact C-N 3.32Å; Y375-Q377 PolarHBondContact O-N 3.14Å; Y375-Q378 WeakPolarHBondContact O-CB 3.38Å; Y375-Q378 PolarHBondContact O-N 2.91Å; Y375-Q378 VanDerWaalsContact O-N 3.13Å; Y375-L379 HydrophobicContact CD1-CD1 4.12Å; Y375-L379 HydrophobicContact CE1-CD1 3.65Å; Y375-L379 HydrophobicContact CE1-CG 4.29Å; Y375-L379 PolarHBondContact O-N 3.49Å; Y375-L379 VanDerWaalsContact O-N 3.09Å
376	L	88.1	Confident	82.2	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-63.1	-37.3	176.3	-68.7	174.7	0	0	0	111.9	L39 I41 S76 L79 L372 W373 L379 Q380 V388	L39-L376 HydrophobicContact CD1-CD1 3.94Å; I41-L376 HydrophobicContact CG2-CD1 4.45Å; I41-L376 HydrophobicContact CG2-CD2 4.34Å; S76-L376 WeakPolarHBondContact OG-CD2 3.31Å; L79-L376 HydrophobicContact CD1-CD1 3.99Å; L372-L376 HydrophobicContact CD1-CD1 4.12Å; L372-L376 HydrophobicContact CD1-CG 4.18Å; L372-L376 HydrophobicContact CG-CD1 4.05Å; L372-L376 HydrophobicContact CG-CG 4.49Å; L372-L376 WeakPolarHBondContact O-CG 3.39Å; L372-L376 PolarHBondContact O-N 2.94Å; W373-L376 PolarHBondContact O-N 2.82Å; L376-L379 HydrophobicContact CD2-CD1 4.46Å; L376-L379 PolarHBondContact O-N 3.3Å; L376-Q380 PolarHBondContact O-N 2.88Å; L376-V388 HydrophobicContact CB-CG1 4.01Å; L376-V388 HydrophobicContact CB-CG2 3.98Å; L376-V388 HydrophobicContact CD1-CG1 4.09Å
377	Q	86.1	Confident	83.1	Confident	72 Å²	72	62.4 Å²	62.4	34%	0.336	30%	0.295	S	S	.	.	H	α-helix	trans	-63	-39.8	171.7	-75.1	-175.4	-46.4	0	0	112.3	W373 Q374 Y375 Q380 H381	W373-Q377 VanDerWaalsContact NE1-NE2 3.14Å; W373-Q377 WeakPolarHBondContact O-CB 3.33Å; W373-Q377 WeakPolarHBondContact O-CG 3.43Å; W373-Q377 PolarHBondContact O-N 2.86Å; Q374-Q377 PolarHBondContact O-N 3.19Å; Y375-Q377 VanDerWaalsContact C-N 3.32Å; Y375-Q377 PolarHBondContact O-N 3.14Å; Q377-Q380 WeakPolarHBondContact O-CB 3.41Å; Q377-Q380 PolarHBondContact O-N 2.84Å; Q377-H381 PolarHBondContact O-CD2 3.06Å; Q377-H381 PolarHBondContact O-N 2.79Å
378	Q	85.5	Confident	83.7	Confident	70 Å²	70	58.4 Å²	58.4	33%	0.327	27%	0.271	S	S	.	.	H	α-helix	trans	-63	-41.1	175.6	-70.7	175.4	16.8	0	0	112	M66 Q374 Y375 Q380 H381 R382	M66-Q378 PolarHBondContact O-OE1 2.99Å; Q374-Q378 WeakPolarHBondContact O-CG 3.34Å; Q374-Q378 PolarHBondContact O-N 2.72Å; Y375-Q378 WeakPolarHBondContact O-CB 3.38Å; Y375-Q378 PolarHBondContact O-N 2.91Å; Y375-Q378 VanDerWaalsContact O-N 3.13Å; Q378-Q380 VanDerWaalsContact C-N 3.31Å; Q378-Q380 PolarHBondContact O-N 3.44Å; Q378-H381 PolarHBondContact O-N 2.86Å; Q378-R382 WeakPolarHBondContact O-CG 3.32Å; Q378-R382 PolarHBondContact O-N 3.3Å
379	L	87.8	Confident	83.6	Confident	5 Å²	5	59.1 Å²	59.1	3%	0.026	28%	0.277	C	S	.	.	H	α-helix	trans	-62.4	-38.4	172.7	-63	178.6	0	0	0	111.7	F51 E54 V55 Y375 L376 R382 R383 L384	F51-L379 HydrophobicContact CD2-CD1 4.32Å; F51-L379 HydrophobicContact CE2-CD1 3.75Å; F51-L379 HydrophobicContact CZ-CD1 4.41Å; E54-L379 HydrophobicContact CG-CD2 4.22Å; V55-L379 HydrophobicContact CG2-CD1 3.73Å; V55-L379 HydrophobicContact CG2-CD2 4.38Å; Y375-L379 HydrophobicContact CD1-CD1 4.12Å; Y375-L379 HydrophobicContact CE1-CD1 3.65Å; Y375-L379 HydrophobicContact CE1-CG 4.29Å; Y375-L379 PolarHBondContact O-N 3.49Å; Y375-L379 VanDerWaalsContact O-N 3.09Å; L376-L379 HydrophobicContact CD2-CD1 4.46Å; L376-L379 PolarHBondContact O-N 3.3Å; L379-R382 CarbonylContact O-C 3.56Å; L379-R382 PolarHBondContact O-N 2.79Å; L379-R383 PolarHBondContact O-N 3.38Å; L379-L384 HydrophobicContact CB-CB 4.48Å; L379-L384 HydrophobicContact CD2-CD1 3.92Å; L379-L384 PolarHBondContact O-N 3.35Å
380	Q	88.3	Confident	83.2	Confident	76 Å²	76	63 Å²	63	36%	0.355	30%	0.296	S	S	.	.	H	α-helix	trans	-67.5	-41.7	175.6	-161.5	-174.3	-65.6	0	0	112.2	L376 Q377 Q378 R382 R383 C385 V388	L376-Q380 PolarHBondContact O-N 2.88Å; Q377-Q380 WeakPolarHBondContact O-CB 3.41Å; Q377-Q380 PolarHBondContact O-N 2.84Å; Q378-Q380 VanDerWaalsContact C-N 3.31Å; Q378-Q380 PolarHBondContact O-N 3.44Å; Q380-R382 VanDerWaalsContact C-N 3.27Å; Q380-R382 PolarHBondContact O-N 3.17Å; Q380-R383 WeakPolarHBondContact O-CA 3.21Å; Q380-R383 PolarHBondContact O-N 2.9Å; Q380-C385 VanDerWaalsContact CA-SG 3.59Å; Q380-C385 PolarHBondContact N-SG 3.41Å; Q380-C385 VanDerWaalsContact N-SG 3.42Å; Q380-V388 HydrophobicContact CB-CG2 4.42Å
381	H	86.1	Confident	82.4	Confident	158 Å²	158	59.1 Å²	59.1	73%	0.731	28%	0.277	S	S	*	.	H	α-helix	trans	-62.1	-35	173.9	-77.2	-62.7	0	0	0	112.3	Q377 Q378 R383	Q377-H381 PolarHBondContact O-CD2 3.06Å; Q377-H381 PolarHBondContact O-N 2.79Å; Q378-H381 PolarHBondContact O-N 2.86Å; H381-R383 PolarHBondContact O-N 3.38Å
382	R	85.8	Confident	80.7	Confident	119 Å²	119	64.2 Å²	64.2	45%	0.449	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	4	171.6	-68.2	-178.5	61.4	-174.4	-10.5	113.9	E54 Q378 L379 Q380 L384	E54-R382 VanDerWaalsContact CD-CZ 3.47Å; E54-R382 IonicContact OE1-CZ 3.62Å; E54-R382 IonicContact OE1-NH1 3.29Å; E54-R382 PolarHBondContact OE1-NH1 3.48Å; E54-R382 IonicContact OE1-NH2 2.88Å; E54-R382 IonicContact OE2-CZ 3.03Å; E54-R382 IonicContact OE2-NH1 2.67Å; E54-R382 PolarHBondContact OE2-NH1 2.98Å; E54-R382 IonicContact OE2-NH2 2.82Å; E54-R382 PolarHBondContact OE2-NH2 3.43Å; Q378-R382 WeakPolarHBondContact O-CG 3.32Å; Q378-R382 PolarHBondContact O-N 3.3Å; L379-R382 CarbonylContact O-C 3.56Å; L379-R382 PolarHBondContact O-N 2.79Å; Q380-R382 VanDerWaalsContact C-N 3.27Å; Q380-R382 PolarHBondContact O-N 3.17Å; R382-L384 HydrophobicContact CB-CD1 4.29Å; R382-L384 HydrophobicContact CB-CG 4.2Å; R382-L384 PolarHBondContact O-N 3.41Å
383	R	86.3	Confident	78.5	Confident	200 Å²	200	68.3 Å²	68.3	76%	0.755	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.4	13.9	-179.7	-52.3	-178.4	178.7	-172.2	-1.7	114.9	N47 L379 Q380 H381 C385	N47-R383 PolarHBondContact ND2-O 2.88Å; L379-R383 PolarHBondContact O-N 3.38Å; Q380-R383 WeakPolarHBondContact O-CA 3.21Å; Q380-R383 PolarHBondContact O-N 2.9Å; H381-R383 PolarHBondContact O-N 3.38Å; R383-C385 VanDerWaalsContact C-N 3.29Å
384	L	84.2	Confident	76.1	Confident	16 Å²	16	70 Å²	70	8%	0.084	36%	0.362	C	S	.	.	S	Bend	trans	-73.2	-25.6	179.3	-62.3	175.9	0	0	0	111.8	D50 F51 E54 L379 R382	D50-L384 HydrophobicContact CB-CD2 3.78Å; F51-L384 HydrophobicContact CB-CB 4.26Å; F51-L384 HydrophobicContact CD2-CB 4.19Å; E54-L384 HydrophobicContact CB-CD1 3.7Å; E54-L384 HydrophobicContact CG-CD1 3.84Å; L379-L384 HydrophobicContact CB-CB 4.48Å; L379-L384 HydrophobicContact CD2-CD1 3.92Å; L379-L384 PolarHBondContact O-N 3.35Å; R382-L384 HydrophobicContact CB-CD1 4.29Å; R382-L384 HydrophobicContact CB-CG 4.2Å; R382-L384 PolarHBondContact O-N 3.41Å
385	C	84.9	Confident	73.6	Confident	1 Å²	1	71.6 Å²	71.6	1%	0.007	38%	0.381	C	S	.	.			trans	-125.8	156.5	160.9	57.3	0	0	0	0	110.1	Q42 I43 Q380 R383	Q42-C385 CarbonylContact O-C 3.6Å; Q42-C385 WeakPolarHBondContact O-CA 3.33Å; Q42-C385 WeakPolarHBondContact O-CB 3.39Å; I43-C385 HydrophobicContact CG1-CB 4.18Å; Q380-C385 VanDerWaalsContact CA-SG 3.59Å; Q380-C385 PolarHBondContact N-SG 3.41Å; Q380-C385 VanDerWaalsContact N-SG 3.42Å; R383-C385 VanDerWaalsContact C-N 3.29Å
386	H	77.1	Confident	71.1	Confident	92 Å²	92	75.8 Å²	75.8	43%	0.426	42%	0.417	S	S	.	.	S	Bend	trans	-95.2	-42.6	-175.2	-68.5	63.4	0	0	0	111.9	Q42 G44 Y46 N47	Q42-H386 PolarHBondContact O-N 3.16Å; G44-H386 WeakPolarHBondContact CA-CE1 3.45Å; G44-H386 PolarHBondContact N-CE1 3.02Å; G44-H386 PolarHBondContact N-ND1 3.45Å; G44-H386 VanDerWaalsContact N-ND1 3.13Å; Y46-H386 AromaticContact CE1-CE1 3.81Å; Y46-H386 AromaticContact CE1-NE2 3.52Å; Y46-H386 AromaticContact CZ-CE1 3.49Å; Y46-H386 VanDerWaalsContact CZ-CE1 3.49Å; Y46-H386 AromaticContact CZ-NE2 3.16Å; Y46-H386 PolarHBondContact OH-CE1 3.28Å; Y46-H386 VanDerWaalsContact OH-CE1 3.32Å; Y46-H386 PolarHBondContact OH-NE2 3.4Å; N47-H386 PolarHBondContact ND2-CE1 3Å
387	T	75.1	Confident	68.4	Low	54 Å²	54	80.4 Å²	80.4	33%	0.331	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	126.1	-177	-44.6	0	0	0	0	109.2	I41 Q42	I41-T387 CarbonylContact C-O 3.59Å; I41-T387 WeakPolarHBondContact CA-O 3.21Å; Q42-T387 PolarHBondContact N-O 2.97Å; Q42-T387 VanDerWaalsContact OE1-CB 3.3Å; Q42-T387 PolarHBondContact OE1-OG1 2.68Å
388	V	77.5	Confident	65.9	Low	13 Å²	13	85.3 Å²	85.3	8%	0.079	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	112.1	160.7	-175.5	0	0	0	0	106.7	L39 I41 W373 L376 Q380	L39-V388 HydrophobicContact CD2-CG1 4.27Å; I41-V388 HydrophobicContact CG2-CG1 4.22Å; I41-V388 HydrophobicContact CG2-CG2 4.15Å; W373-V388 HydrophobicContact CE3-CG1 4.08Å; W373-V388 HydrophobicContact CH2-CG1 4.13Å; W373-V388 HydrophobicContact CZ3-CB 4.49Å; W373-V388 HydrophobicContact CZ3-CG1 3.59Å; L376-V388 HydrophobicContact CB-CG1 4.01Å; L376-V388 HydrophobicContact CB-CG2 3.98Å; L376-V388 HydrophobicContact CD1-CG1 4.09Å; Q380-V388 HydrophobicContact CB-CG2 4.42Å
389	S	75.3	Confident	63.2	Low	44 Å²	44	88.5 Å²	88.5	31%	0.308	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	140.8	-177.1	57.8	0	0	0	0	111.6	L39 S40 T391	L39-S389 CarbonylContact C-O 3.49Å; L39-S389 WeakPolarHBondContact CA-O 3.47Å; S40-S389 PolarHBondContact N-O 3.31Å; S40-S389 PolarHBondContact O-N 2.9Å; S40-S389 PolarHBondContact OG-OG 3.1Å; S389-T391 PolarHBondContact O-N 3.03Å
390	L	72.4	Confident	60.5	Low	106 Å²	106	96.6 Å²	96.6	56%	0.555	54%	0.542	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	120.5	167.3	-68.2	167.7	0	0	0	108.3	P38 L39 V368 W373 P392	P38-L390 VanDerWaalsContact O-CA 3.27Å; P38-L390 WeakPolarHBondContact O-CA 3.47Å; P38-L390 WeakPolarHBondContact O-CD2 3.07Å; L39-L390 HydrophobicContact CD2-CD2 3.96Å; V368-L390 HydrophobicContact CG2-CD2 3.78Å; W373-L390 HydrophobicContact CH2-CG 4.36Å; W373-L390 HydrophobicContact CZ3-CD2 4.16Å; W373-L390 HydrophobicContact CZ3-CG 4.1Å; L390-P392 WeakPolarHBondContact O-CD 3.31Å
391	T	62.4	Low	57.7	Low	42 Å²	42	98.7 Å²	98.7	26%	0.258	57%	0.565	S	S	.	*	P	Polyproline II helix	trans	-69.2	119	176	-44.1	0	0	0	0	108.1	P38 L39 S389 A393	P38-T391 PolarHBondContact O-N 2.74Å; L39-T391 VanDerWaalsContact C-OG1 3.3Å; L39-T391 PolarHBondContact N-OG1 2.88Å; L39-T391 PolarHBondContact O-OG1 2.78Å; S389-T391 PolarHBondContact O-N 3.03Å; T391-A393 PolarHBondContact O-N 2.94Å
392	P	48.3	Very low	54.9	Low	113 Å²	113	98.8 Å²	98.8	73%	0.734	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-62.8	135.3	175.7	26.9	-33.4	0	0	0	109.1	L390	L390-P392 WeakPolarHBondContact O-CD 3.31Å
393	A	39.7	Very low	52.1	Low	88 Å²	88	102.1 Å²	102.1	73%	0.727	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-57.1	139.6	175.2	0	0	0	0	0	109.8	T391	T391-A393 PolarHBondContact O-N 2.94Å
394	P	34.5	Very low	49.4	Very low	102 Å²	102	97.5 Å²	97.5	66%	0.662	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-58.9	134.2	179	24.8	-33.7	0	0	0	109.5	A396	P394-A396 PolarHBondContact O-N 2.87Å
395	P	33.7	Very low	46.8	Very low	125 Å²	125	105.1 Å²	105.1	81%	0.812	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-62.3	123.4	179.2	25.5	-33.2	0	0	0	109.2	A397	P395-A397 PolarHBondContact O-N 3.48Å
396	A	33.3	Very low	44.1	Very low	95 Å²	95	113.2 Å²	113.2	79%	0.785	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-55.8	134	174.2	0	0	0	0	0	109.6	P394 M398	P394-A396 PolarHBondContact O-N 2.87Å; A396-M398 PolarHBondContact O-N 2.83Å
397	A	32.8	Very low	41.8	Very low	98 Å²	98	116.2 Å²	116.2	81%	0.81	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-56.5	133.3	-176.2	0	0	0	0	0	110.9	P395 T399	P395-A397 PolarHBondContact O-N 3.48Å; A397-T399 PolarHBondContact O-N 3.23Å
398	M	32.1	Very low	39.5	Very low	174 Å²	174	117.1 Å²	117.1	86%	0.857	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-60.6	118.1	-169.3	-58.9	179.5	-168.4	0	0	112.1	A396	A396-M398 PolarHBondContact O-N 2.83Å
399	T	30.5	Very low	37	Very low	138 Å²	138	120.8 Å²	120.8	85%	0.847	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-84.8	121.2	152.3	41.2	0	0	0	0	108.4	A397	A397-T399 PolarHBondContact O-N 3.23Å
400	H	30	Very low	34.7	Very low	174 Å²	174	123.5 Å²	123.5	81%	0.806	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-66	139.8	-176.6	-71.8	-115.2	0	0	0	111.6
401	S	29	Very low	32.5	Very low	121 Å²	121	125.6 Å²	125.6	85%	0.846	77%	0.767	S	S	*	*			trans	-141.1	115.4	150.4	-170.9	0	0	0	0	109.6
402	M	27.6	Very low	30.9	Very low	159 Å²	159	127.9 Å²	127.9	78%	0.783	79%	0.79	S	S	*	*			trans	-89	131.3	169.4	-67.2	-129.5	-60.1	0	0	109.1
403	H	27.9	Very low	29.9	Very low	190 Å²	190	129.9 Å²	129.9	88%	0.88	79%	0.79	S	S	*	*				179.9	107.9	129	-102.5	83	0	0	0	111.9
404	A	29.8	Very low	29.2	Very low	103 Å²	103	134.7 Å²	134.7	85%	0.851	79%	0.79	S	S	*	*			trans	-164.7	114	149.8	0	0	0	0	0	108.5
405	M	28.4	Very low	28.9	Very low	175 Å²	175	136.8 Å²	136.8	86%	0.862	79%	0.791	S	S	*	*			trans	-91.7	132.9	168.5	-69.8	-169.3	-68.1	0	0	109.4
406	H	29.9	Very low	28.5	Very low	172 Å²	172	137.3 Å²	137.3	80%	0.796	78%	0.783	S	S	*	*			trans	-159.7	106	133.5	-119.7	-76.3	0	0	0	114
407	I	27.6	Very low	28.3	Very low	154 Å²	154	139.7 Å²	139.7	79%	0.79	78%	0.777	S	S	*	*			trans	19.5	123.2	140.8	-51.5	177	0	0	0	118.8
408	G	26	Very low	27.9	Very low	74 Å²	74	141.5 Å²	141.5	76%	0.763	77%	0.769	S	S	*	*			trans	114.1	130.5	146	0	0	0	0	0	115.9
409	A	25.8	Very low	27.8	Very low	90 Å²	90	140.1 Å²	140.1	74%	0.744	76%	0.76	S	S	*	*			cis	172.7	159.2	-21.5	0	0	0	0	0	106.1
410	S	27.1	Very low	27.6	Very low	100 Å²	100	139.9 Å²	139.9	70%	0.699	75%	0.75	S	S	*	*			trans	60.2	102.1	164.3	45	0	0	0	0	120.4
411	D	26.9	Very low	27.4	Very low	150 Å²	150	138.6 Å²	138.6	80%	0.802	74%	0.744	S	S	*	*				85	131.4	116.6	-54.1	-30	0	0	0	124.8
412	A	27.7	Very low	27.3	Very low	90 Å²	90	139.4 Å²	139.4	74%	0.744	73%	0.734	S	S	*	*			trans	66.7	155	140	0	0	0	0	0	121
413	H	27.1	Very low	27.3	Very low	156 Å²	156	140 Å²	140	72%	0.722	74%	0.735	S	S	*	*			cis	-172.1	160.5	-39.9	-125.9	107.9	0	0	0	107.3
414	Y	26.7	Very low	27.2	Very low	188 Å²	188	138.4 Å²	138.4	74%	0.737	73%	0.733	S	S	*	*			trans	63.1	107.5	160.5	-75.5	-64.4	0	0	0	123
415	H	27.5	Very low	27.9	Very low	147 Å²	147	138.3 Å²	138.3	68%	0.681	72%	0.724	S	S	*	*				46.7	115.6	118.9	-76.5	-29.6	0	0	0	124.3
416	Q	24.8	Very low	27.8	Very low	136 Å²	136	137 Å²	137	64%	0.636	72%	0.719	S	S	*	*				84.6	153.5	101.5	-156	170	-78.8	0	0	121.3
417	H	29.5	Very low	27.6	Very low	144 Å²	144	134.3 Å²	134.3	67%	0.667	71%	0.714	S	S	*	*			trans	74.1	159.1	175	-59.7	-72.4	0	0	0	116.7
418	Q	24.9	Very low	27.6	Very low	136 Å²	136	138.5 Å²	138.5	64%	0.636	72%	0.72	S	S	*	*			cis	179.2	156.1	-47.6	-125.9	174.9	-27.8	0	0	106.4
419	H	29.7	Very low	27.5	Very low	145 Å²	145	139.9 Å²	139.9	67%	0.671	72%	0.718	S	S	*	*			trans	66.2	152.2	163	-68.4	-33.3	0	0	0	116.5
420	Q	25.1	Very low	27.6	Very low	134 Å²	134	140.8 Å²	140.8	63%	0.626	71%	0.714	S	S	*	*			cis	-166.8	161.3	-25.1	-133.6	-178.7	29.1	0	0	108.5
421	Q	26.4	Very low	27.6	Very low	146 Å²	146	141.4 Å²	141.4	68%	0.682	72%	0.718	S	S	*	*			trans	65.9	160.5	160.3	-60.4	176.3	54.6	0	0	115.4
422	Q	26.5	Very low	27.5	Very low	138 Å²	138	141.3 Å²	141.3	65%	0.645	71%	0.713	S	S	*	*			cis	-158.3	172.1	-21.5	-117.4	-173	42.5	0	0	109.9
423	Q	27	Very low	27.5	Very low	171 Å²	171	143.1 Å²	143.1	80%	0.799	72%	0.715	S	S	*	*			trans	75.1	142.2	156.3	-71.9	163	44.7	0	0	120.8
424	N	27.4	Very low	27.4	Very low	157 Å²	157	142.8 Å²	142.8	84%	0.84	72%	0.724	S	S	*	*			trans	-133.9	179.3	174.3	-117.7	-17.9	0	0	0	104.4
425	P	43.3	Very low	27.3	Very low	102 Å²	102	141.7 Å²	141.7	66%	0.662	73%	0.73	S	S	*	*			cis	-140.7	-157.9	-1.1	24.2	4.3	0	0	0	113.9
426	I	27.2	Very low	27.3	Very low	146 Å²	146	141.2 Å²	141.2	75%	0.749	74%	0.738	S	S	*	*			trans	113.1	96.2	145.4	-59.9	-178.2	0	0	0	120.4
427	V	26.1	Very low	27.3	Very low	116 Å²	116	140.2 Å²	140.2	70%	0.703	75%	0.746	S	S	*	*				61.5	125.4	128	-179.1	0	0	0	0	122.9
428	R	26.6	Very low	27.1	Very low	243 Å²	243	140.9 Å²	140.9	92%	0.917	75%	0.753	S	S	*	*				-163.1	166.6	120.3	-105.5	179.1	-173.8	99	-1.4	112.1
429	S	24.6	Very low	27.3	Very low	102 Å²	102	140 Å²	140	71%	0.713	76%	0.759	S	S	*	*			trans	-156.1	158.1	-160.7	57.1	0	0	0	0	116.9
430	V	27.4	Very low	27	Very low	110 Å²	110	138.8 Å²	138.8	67%	0.667	76%	0.762	S	S	*	*			trans	53.9	127.9	159.9	-121.2	0	0	0	0	124.1	Q432	V430-Q432 HydrophobicContact CG1-CG 4.22Å
431	S	27	Very low	27	Very low	113 Å²	113	138.1 Å²	138.1	79%	0.79	77%	0.767	S	S	*	*			trans	-170.6	146.6	134.7	-72.6	0	0	0	0	108.9
432	Q	25.3	Very low	27.2	Very low	148 Å²	148	139.6 Å²	139.6	69%	0.692	77%	0.774	S	S	*	*			cis	93.8	128.8	7.3	-60.9	171.3	-80.6	0	0	117.1	V430	V430-Q432 HydrophobicContact CG1-CG 4.22Å
433	T	26.8	Very low	27.2	Very low	127 Å²	127	143.7 Å²	143.7	78%	0.779	79%	0.79	S	S	*	*			cis	-171.6	139.4	-27.8	5	0	0	0	0	111.1
434	T	26	Very low	27	Very low	150 Å²	150	138.7 Å²	138.7	92%	0.92	78%	0.784	S	S	*	*			trans	-153	162	169	29.9	0	0	0	0	113.8
435	L	24.7	Very low	27	Very low	164 Å²	164	138.8 Å²	138.8	86%	0.859	79%	0.785	S	S	*	*			trans	-147.2	175.9	-163.7	-106.5	172.8	0	0	0	115.1
436	T	26.3	Very low	26.3	Very low	137 Å²	137	139.8 Å²	139.8	84%	0.84	79%	0.794	S	S	*	*			trans	78.4	146.9	176.6	74.6	0	0	0	0	115.9
437	S	25	Very low	26.4	Very low	116 Å²	116	142.9 Å²	142.9	81%	0.811	80%	0.803	S	S	*	*			cis	-138.5	170	13.7	55.3	0	0	0	0	114.2
438	I	26.6	Very low	26.9	Very low	157 Å²	157	141.4 Å²	141.4	81%	0.805	81%	0.811	S	S	*	*			trans	-116.5	159.1	-179.2	-23.3	178.6	0	0	0	110.4
439	P	27.9	Very low	27.1	Very low	117 Å²	117	135.2 Å²	135.2	76%	0.76	81%	0.805	S	S	*	*				-145.2	136.8	98.3	35.8	-19.5	0	0	0	117.1
440	T	23	Very low	27.6	Very low	120 Å²	120	134.2 Å²	134.2	74%	0.736	80%	0.803	S	S	*	*			trans	48	99.9	136.4	-40.5	0	0	0	0	120.9
441	T	26	Very low	28.1	Very low	120 Å²	120	135.1 Å²	135.1	74%	0.736	81%	0.808	S	S	*	*				-172	127.5	100.1	33.1	0	0	0	0	113.2
442	Q	30.5	Very low	28.7	Very low	177 Å²	177	133.8 Å²	133.8	83%	0.827	80%	0.799	S	S	*	*			trans	38.8	92.5	148.1	-56.5	-175.9	34.9	0	0	119.8
443	F	25.8	Very low	30	Very low	224 Å²	224	129.8 Å²	129.8	98%	0.982	78%	0.782	S	S	*	*				-157.6	129	129.2	-104.4	-70	0	0	0	108.9
444	G	24.4	Very low	31.8	Very low	66 Å²	66	128.5 Å²	128.5	68%	0.68	77%	0.774	S	S	*	*			trans	-171	168.2	-176.1	0	0	0	0	0	112.5
445	D	25.4	Very low	34.5	Very low	159 Å²	159	125.3 Å²	125.3	85%	0.85	75%	0.751	S	S	*	*			trans	62.4	100	172.3	-56.1	-14.1	0	0	0	118.2
446	S	30.3	Very low	37.5	Very low	123 Å²	123	119.6 Å²	119.6	86%	0.86	73%	0.725	S	S	*	*			trans	-155.2	47.6	158.5	-79.2	0	0	0	0	112.5
447	F	29.4	Very low	40.6	Very low	212 Å²	212	120.2 Å²	120.2	93%	0.93	72%	0.716	S	S	*	*	S	Bend	trans	-137.1	133.9	162.1	-100.9	-87.9	0	0	0	108.9
448	G	36.2	Very low	43.8	Very low	84 Å²	84	114.8 Å²	114.8	87%	0.866	68%	0.677	S	S	*	*			trans	72.2	32.7	164.3	0	0	0	0	0	117.8	A450	G448-A450 PolarHBondContact O-N 3.21Å
449	S	29.3	Very low	46.8	Very low	114 Å²	114	109.4 Å²	109.4	80%	0.797	65%	0.652	S	S	*	*			trans	-73.7	122.1	169.2	-172.8	0	0	0	0	111	V451	S449-V451 PolarHBondContact O-N 3.01Å
450	A	36.7	Very low	49.7	Very low	81 Å²	81	104.1 Å²	104.1	67%	0.669	62%	0.617	S	S	*	*			trans	-65.1	121.7	164.2	0	0	0	0	0	108.6	G448 S452	G448-A450 PolarHBondContact O-N 3.21Å; A450-S452 VanDerWaalsContact C-N 3.31Å; A450-S452 PolarHBondContact O-N 3.13Å
451	V	38.1	Very low	52.6	Low	128 Å²	128	106 Å²	106	78%	0.776	61%	0.611	S	S	*	*			trans	-66.1	95.8	175.6	-176.2	0	0	0	0	108.1	S449	S449-V451 PolarHBondContact O-N 3.01Å
452	S	38.7	Very low	55.2	Low	85 Å²	85	101.8 Å²	101.8	59%	0.594	58%	0.582	S	S	*	*			trans	-57.2	151.5	178.2	-69.7	0	0	0	0	110.3	A450 T454	A450-S452 VanDerWaalsContact C-N 3.31Å; A450-S452 PolarHBondContact O-N 3.13Å; S452-T454 PolarHBondContact O-N 2.87Å; S452-T454 PolarHBondContact O-OG1 2.73Å
453	D	52.6	Low	57.1	Low	64 Å²	64	98.6 Å²	98.6	34%	0.342	57%	0.571	S	S	.	*			trans	-73.3	72.4	-177.5	-127.3	49.2	0	0	0	110.5	I455 R539 R545	D453-I455 PolarHBondContact O-N 3.4Å; D453-R539 IonicContact OD1-NE 2.71Å; D453-R539 IonicContact OD2-CZ 3.23Å; D453-R539 IonicContact OD2-NE 2.7Å; D453-R539 PolarHBondContact OD2-NE 2.8Å; D453-R539 IonicContact OD2-NH2 3.14Å; D453-R539 PolarHBondContact OD2-NH2 3.49Å; D453-R545 IonicContact OD1-CZ 3.77Å; D453-R545 IonicContact OD1-NH1 2.61Å; D453-R545 PolarHBondContact OD1-NH1 3.48Å; D453-R545 IonicContact OD1-NH2 3.64Å; D453-R545 PolarHBondContact OD1-NH2 3.34Å
454	T	64.4	Low	58.8	Low	100 Å²	100	92.7 Å²	92.7	61%	0.613	57%	0.573	S	S	*	*			trans	-73.3	88.6	-173.4	41.9	0	0	0	0	111.1	S452 S456	S452-T454 PolarHBondContact O-N 2.87Å; S452-T454 PolarHBondContact O-OG1 2.73Å; T454-S456 PolarHBondContact O-N 2.89Å
455	I	83.9	Confident	60.8	Low	84 Å²	84	93.5 Å²	93.5	43%	0.431	58%	0.581	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-64.8	112.1	168.6	-59.3	177.7	0	0	0	108.4	D453 L508 D537 V538	D453-I455 PolarHBondContact O-N 3.4Å; I455-L508 HydrophobicContact CD1-CD1 3.62Å; I455-L508 HydrophobicContact CG1-CD1 3.7Å; I455-L508 HydrophobicContact CG2-CD1 4.2Å; I455-D537 HydrophobicContact CG2-CB 3.67Å; I455-V538 WeakPolarHBondContact CA-O 3.45Å
456	S	87.9	Confident	63.4	Low	44 Å²	44	87.3 Å²	87.3	31%	0.308	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.4	139.2	175.3	-173.3	0	0	0	0	110.3	T454 V538	T454-S456 PolarHBondContact O-N 2.89Å; S456-V538 PolarHBondContact N-O 2.87Å; S456-V538 PolarHBondContact O-N 2.85Å
457	K	90.5	Very high	66	Low	150 Å²	150	82.2 Å²	82.2	65%	0.652	52%	0.518	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.8	117.4	175.7	-61.3	-157.5	178.3	-145.9	0	110.5	F536 D537	K457-F536 WeakPolarHBondContact CA-O 3.47Å; K457-D537 WeakPolarHBondContact CE-OD1 3.44Å; K457-D537 IonicContact NZ-OD1 3.22Å; K457-D537 PolarHBondContact NZ-OD1 3.38Å
458	V	92.2	Very high	68.8	Low	1 Å²	1	72.8 Å²	72.8	1%	0.006	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	112.6	-178.3	-174.5	0	0	0	0	109.5	L460 R500 L501 F536 V538	V458-L460 HydrophobicContact CG1-CD2 4.02Å; V458-L460 HydrophobicContact CG1-CG 4.08Å; V458-R500 HydrophobicContact CG1-CB 4.22Å; V458-R500 HydrophobicContact CG2-CB 4.11Å; V458-L501 HydrophobicContact CB-CD2 4.21Å; V458-L501 HydrophobicContact CG1-CD2 4.24Å; V458-L501 HydrophobicContact CG1-CG 4.13Å; V458-L501 HydrophobicContact CG2-CD2 3.95Å; V458-F536 PolarHBondContact N-O 2.9Å; V458-F536 PolarHBondContact O-N 3.05Å; V458-V538 HydrophobicContact CB-CG2 4.35Å; V458-V538 HydrophobicContact CG2-CG2 4.03Å
459	T	89.6	Confident	71.3	Confident	45 Å²	45	70.4 Å²	70.4	28%	0.276	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	122.5	172.4	-51.6	0	0	0	0	109.6	R500 E533 V534 H535	T459-R500 PolarHBondContact O-NH2 3.07Å; T459-E533 HydrophobicContact CG2-CG 3.42Å; T459-E533 VanDerWaalsContact CG2-CG 3.42Å; T459-E533 WeakPolarHBondContact CG2-OE1 3.49Å; T459-V534 CarbonylContact C-O 3.49Å; T459-V534 WeakPolarHBondContact CA-O 3.39Å; T459-H535 PolarHBondContact OG1-CD2 3.02Å
460	L	88.8	Confident	74.2	Confident	5 Å²	5	67.3 Å²	67.3	3%	0.026	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	139.7	176.4	-62.2	-178.3	0	0	0	110.6	V458 I467 A495 D498 L501 E533 V534 F536	V458-L460 HydrophobicContact CG1-CD2 4.02Å; V458-L460 HydrophobicContact CG1-CG 4.08Å; L460-I467 HydrophobicContact CB-CG2 4.33Å; L460-I467 HydrophobicContact CD1-CG2 3.57Å; L460-A495 HydrophobicContact CD1-CB 3.85Å; L460-D498 HydrophobicContact CD2-CB 3.38Å; L460-L501 HydrophobicContact CD1-CD1 3.76Å; L460-E533 WeakPolarHBondContact O-CA 3.37Å; L460-V534 PolarHBondContact N-O 2.85Å; L460-V534 PolarHBondContact O-N 2.87Å; L460-F536 HydrophobicContact CD1-CE2 4.25Å
461	R	84.2	Confident	76.8	Confident	159 Å²	159	64.2 Å²	64.2	60%	0.6	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.9	138.2	172.2	-66.2	-179.7	63.4	-179.7	0.4	110.2	P494 N532 E533	R461-P494 VanDerWaalsContact O-CB 3.22Å; R461-P494 WeakPolarHBondContact O-CB 3.43Å; R461-P494 WeakPolarHBondContact O-CG 3.38Å; R461-N532 CarbonylContact C-O 3.53Å; R461-N532 WeakPolarHBondContact CA-O 3.44Å; R461-E533 HydrophobicContact CG-CB 4.38Å; R461-E533 HydrophobicContact CG-CG 4.13Å
462	K	79.8	Confident	79.4	Confident	33 Å²	33	58.8 Å²	58.8	14%	0.143	37%	0.365	C	S	.	.			trans	-77.3	142.7	177.2	-66.2	-174.6	-177.4	177.9	0	110.1	I467 M527 T528 S530 G531 N532 V534	K462-I467 HydrophobicContact CG-CG1 4Å; K462-M527 VanDerWaalsContact CE-O 3.3Å; K462-M527 WeakPolarHBondContact CE-O 3.41Å; K462-M527 PolarHBondContact NZ-O 3.22Å; K462-T528 PolarHBondContact NZ-O 3.29Å; K462-S530 PolarHBondContact NZ-O 3.26Å; K462-G531 VanDerWaalsContact CD-O 3.29Å; K462-G531 WeakPolarHBondContact CD-O 3.46Å; K462-G531 WeakPolarHBondContact CE-O 3.49Å; K462-N532 PolarHBondContact N-O 2.75Å; K462-N532 PolarHBondContact O-OD1 3.23Å; K462-V534 HydrophobicContact CD-CG2 4.35Å; K462-V534 VanDerWaalsContact CE-CG2 3.47Å; K462-V534 HydrophobicContact CG-CG2 4.09Å
463	N	70.3	Confident	81.9	Confident	110 Å²	110	55.7 Å²	55.7	59%	0.588	35%	0.345	S	S	*	.	B	Isolated β-bridge	trans	-106.9	175.1	159.2	-71.1	-8	0	0	0	108.7	G465 G466 P494	N463-G465 PolarHBondContact O-N 2.87Å; N463-G466 PolarHBondContact N-O 3.21Å; N463-G466 PolarHBondContact O-N 3.32Å; N463-P494 HydrophobicContact CB-CG 4.11Å
464	G	62.4	Low	83.5	Confident	99 Å²	99	53.1 Å²	53.1	100%	1.021	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-12.5	-177.8	0	0	0	0	0	116.2
465	G	65.6	Low	84.6	Confident	83 Å²	83	53.4 Å²	53.4	86%	0.856	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	6.5	172	0	0	0	0	0	115.4	N463	N463-G465 PolarHBondContact O-N 2.87Å
466	G	79.9	Confident	84.3	Confident	29 Å²	29	49.8 Å²	49.8	30%	0.299	31%	0.31	S	S	.	.	B	Isolated β-bridge	trans	93.6	-157.2	-178.5	0	0	0	0	0	114.6	N463	N463-G466 PolarHBondContact N-O 3.21Å; N463-G466 PolarHBondContact O-N 3.32Å
467	I	85.8	Confident	83.1	Confident	17 Å²	17	54.2 Å²	54.2	9%	0.087	34%	0.335	C	S	.	.			trans	-86.8	-35.7	-175	-53.3	173.6	0	0	0	111.8	L460 K462 L469 A495 M527 V534 F536	L460-I467 HydrophobicContact CB-CG2 4.33Å; L460-I467 HydrophobicContact CD1-CG2 3.57Å; K462-I467 HydrophobicContact CG-CG1 4Å; I467-L469 HydrophobicContact CG2-CD1 4.03Å; I467-L469 HydrophobicContact CG2-CG 4.15Å; I467-A495 WeakPolarHBondContact O-CB 3.36Å; I467-A495 PolarHBondContact O-N 3.37Å; I467-A495 VanDerWaalsContact O-N 3.13Å; I467-M527 HydrophobicContact CD1-CB 4.2Å; I467-V534 HydrophobicContact CD1-CB 4.27Å; I467-V534 HydrophobicContact CD1-CG1 4.13Å; I467-V534 HydrophobicContact CD1-CG2 3.92Å; I467-V534 HydrophobicContact CG1-CG2 4.43Å; I467-F536 HydrophobicContact CD1-CE2 4.45Å; I467-F536 HydrophobicContact CD1-CZ 4.01Å; I467-F536 HydrophobicContact CG2-CE2 4.46Å
468	G	87.3	Confident	81.5	Confident	14 Å²	14	50.8 Å²	50.8	14%	0.144	34%	0.342	C	S	.	.			trans	93.6	21.7	-179.6	0	0	0	0	0	116.5	V490 T493	G468-V490 WeakPolarHBondContact O-CB 3.46Å; G468-V490 WeakPolarHBondContact O-CG2 3.43Å; G468-V490 PolarHBondContact O-N 2.79Å; G468-T493 WeakPolarHBondContact CA-OG1 3.43Å
469	L	89.4	Confident	80.5	Confident	33 Å²	33	52.9 Å²	52.9	17%	0.173	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	128.6	176	-63.6	171.9	0	0	0	111.2	I467 I471 V486 V489 A495 L501 L507 F536	I467-L469 HydrophobicContact CG2-CD1 4.03Å; I467-L469 HydrophobicContact CG2-CG 4.15Å; L469-I471 HydrophobicContact CB-CG2 4.24Å; L469-V486 HydrophobicContact CD2-CG1 4.12Å; L469-V489 HydrophobicContact CD2-CG1 4.45Å; L469-V489 HydrophobicContact CD2-CG2 4.03Å; L469-A495 HydrophobicContact CD2-CB 3.71Å; L469-A495 HydrophobicContact CG-CB 3.98Å; L469-L501 HydrophobicContact CD1-CD1 3.61Å; L469-L501 HydrophobicContact CD2-CB 4.39Å; L469-L501 HydrophobicContact CD2-CD1 3.76Å; L469-L501 HydrophobicContact CG-CD1 4.24Å; L469-L507 HydrophobicContact CD1-CD1 4.49Å; L469-F536 HydrophobicContact CD1-CE2 4.36Å; L469-F536 HydrophobicContact CD1-CZ 4.24Å
470	S	89.6	Confident	79.6	Confident	50 Å²	50	62.4 Å²	62.4	35%	0.35	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	114.9	158	-178.6	0	0	0	0	108	K487 K488	S470-K487 PolarHBondContact O-N 2.79Å; S470-K488 WeakPolarHBondContact CB-O 3.29Å; S470-K488 PolarHBondContact N-O 3.32Å; S470-K488 PolarHBondContact O-N 2.82Å
471	I	92.7	Very high	79	Confident	16 Å²	16	68 Å²	68	8%	0.082	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	157.9	177.3	62.4	166.3	0	0	0	111.3	L469 I484 Y485 L507 Q520 A523 A524 M527	L469-I471 HydrophobicContact CB-CG2 4.24Å; I471-I484 HydrophobicContact CB-CG2 3.94Å; I471-I484 HydrophobicContact CD1-CG2 3.95Å; I471-I484 HydrophobicContact CG2-CG2 4.23Å; I471-Y485 CarbonylContact C-O 3.5Å; I471-Y485 VanDerWaalsContact CA-O 3.31Å; I471-Y485 WeakPolarHBondContact CA-O 3.48Å; I471-L507 HydrophobicContact CG2-CD1 3.95Å; I471-Q520 HydrophobicContact CD1-CG 4.44Å; I471-Q520 HydrophobicContact CG1-CG 4.36Å; I471-Q520 PolarHBondContact O-NE2 3.24Å; I471-A523 HydrophobicContact CD1-CB 3.99Å; I471-A524 HydrophobicContact CD1-CB 4.43Å; I471-M527 HydrophobicContact CD1-CE 3.88Å; I471-M527 HydrophobicContact CD1-SD 3.99Å; I471-M527 HydrophobicContact CG2-CE 4.41Å; I471-M527 HydrophobicContact CG2-SD 4.37Å
472	V	91	Very high	79	Confident	13 Å²	13	63.7 Å²	63.7	8%	0.079	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	144.5	171.4	-73.7	0	0	0	0	111.1	I484 Y485 K487 W551 L552	V472-I484 WeakPolarHBondContact O-CA 3.47Å; V472-Y485 PolarHBondContact N-O 2.86Å; V472-Y485 PolarHBondContact O-N 2.89Å; V472-K487 HydrophobicContact CG1-CB 4.13Å; V472-K487 HydrophobicContact CG1-CD 3.67Å; V472-K487 HydrophobicContact CG2-CB 4.06Å; V472-W551 HydrophobicContact CB-CH2 3.88Å; V472-W551 HydrophobicContact CB-CZ3 4.03Å; V472-W551 HydrophobicContact CG1-CH2 4.19Å; V472-W551 HydrophobicContact CG2-CH2 3.92Å; V472-W551 HydrophobicContact CG2-CZ3 3.53Å; V472-L552 HydrophobicContact CG2-CD2 3.67Å
473	A	91.1	Very high	79.6	Confident	21 Å²	21	62.1 Å²	62.1	17%	0.174	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	130.2	166.9	0	0	0	0	0	109.9	M482 G483 I484 Q520	A473-M482 HydrophobicContact CB-CE 3.73Å; A473-G483 WeakPolarHBondContact CA-O 3.44Å; A473-I484 HydrophobicContact CB-CD1 3.85Å; A473-Q520 HydrophobicContact CB-CB 3.85Å
474	A	87.1	Confident	80.7	Confident	10 Å²	10	56.9 Å²	56.9	8%	0.083	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	158.2	176.8	0	0	0	0	0	111.1	G483 Y485 L548 W551	A474-G483 PolarHBondContact N-O 2.89Å; A474-G483 PolarHBondContact O-N 3.17Å; A474-Y485 HydrophobicContact CB-CD2 4.04Å; A474-Y485 HydrophobicContact CB-CE2 4.15Å; A474-L548 HydrophobicContact CB-CD1 3.78Å; A474-L548 HydrophobicContact CB-CD2 4.15Å; A474-W551 HydrophobicContact CB-CE3 4.47Å; A474-W551 HydrophobicContact CB-CH2 4.32Å; A474-W551 HydrophobicContact CB-CZ3 3.84Å
475	Q	88.6	Confident	82.3	Confident	106 Å²	106	52.2 Å²	52.2	50%	0.495	32%	0.315	S	S	.	.			trans	-110.6	127.4	171.8	-171.9	169.8	1.4	0	0	108.6	D479 M482	Q475-D479 HydrophobicContact CG-CB 4.03Å; Q475-D479 PolarHBondContact NE2-O 3.01Å; Q475-M482 HydrophobicContact CB-SD 3.76Å
476	G	75.7	Confident	83.6	Confident	7 Å²	7	48.2 Å²	48.2	7%	0.072	27%	0.274	C	S	.	.			trans	-74.3	161.4	175.4	0	0	0	0	0	113.2	G478 D479 N546	G476-G478 PolarHBondContact O-N 2.92Å; G476-D479 WeakPolarHBondContact CA-OD2 3.29Å; G476-D479 PolarHBondContact N-OD2 3.36Å; G476-D479 PolarHBondContact O-N 3.26Å; G476-N546 VanDerWaalsContact CA-O 3.22Å; G476-N546 WeakPolarHBondContact CA-O 3.3Å
477	V	63.2	Low	84.2	Confident	137 Å²	137	51 Å²	51	83%	0.83	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	107.8	171.4	-177.5	0	0	0	0	108.7	N546	V477-N546 PolarHBondContact N-O 2.98Å
478	G	57.9	Low	84.4	Confident	78 Å²	78	54.3 Å²	54.3	80%	0.804	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.6	-9.3	-175.8	0	0	0	0	0	115.5	G476	G476-G478 PolarHBondContact O-N 2.92Å
479	D	71.4	Confident	84.5	Confident	46 Å²	46	54.8 Å²	54.8	25%	0.246	29%	0.292	C	S	.	.			trans	-68.1	135.5	172.4	-79.1	-33.5	0	0	0	110.3	Q475 G476 Y485 N546	Q475-D479 HydrophobicContact CG-CB 4.03Å; Q475-D479 PolarHBondContact NE2-O 3.01Å; G476-D479 WeakPolarHBondContact CA-OD2 3.29Å; G476-D479 PolarHBondContact N-OD2 3.36Å; G476-D479 PolarHBondContact O-N 3.26Å; D479-Y485 PolarHBondContact OD2-OH 3.07Å; D479-N546 VanDerWaalsContact CG-ND2 3.29Å; D479-N546 PolarHBondContact OD1-ND2 3.45Å; D479-N546 VanDerWaalsContact OD1-ND2 3.14Å; D479-N546 PolarHBondContact OD2-ND2 3.03Å
480	R	69.2	Low	84.5	Confident	245 Å²	245	56.3 Å²	56.3	93%	0.925	30%	0.302	S	S	*	.	S	Bend	trans	-83.3	-9.9	173.7	-75.8	-175.3	170.2	-173.8	-3.4	114.3
481	Q	77.5	Confident	84.2	Confident	121 Å²	121	61 Å²	61	57%	0.565	32%	0.319	S	S	*	.	S	Bend	trans	-144.9	155.1	-173.9	-69.7	-179.4	-28.6	0	0	110.7	I516	Q481-I516 HydrophobicContact CB-CG2 4.2Å
482	M	83.6	Confident	83.6	Confident	69 Å²	69	63.2 Å²	63.2	34%	0.34	35%	0.346	S	S	.	.			trans	-62.9	144.9	172.4	-65.8	-68.7	-70.9	0	0	111.1	A473 Q475 G517	A473-M482 HydrophobicContact CB-CE 3.73Å; Q475-M482 HydrophobicContact CB-SD 3.76Å; M482-G517 WeakPolarHBondContact O-CA 3.41Å; M482-G517 PolarHBondContact O-N 3.35Å
483	G	91.5	Very high	83.4	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.01	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	153.9	171.9	0	0	0	0	0	112.1	A473 A474 Y485	A473-G483 WeakPolarHBondContact CA-O 3.44Å; A474-G483 PolarHBondContact N-O 2.89Å; A474-G483 PolarHBondContact O-N 3.17Å; G483-Y485 VanDerWaalsContact O-CD2 3.29Å; G483-Y485 WeakPolarHBondContact O-CD2 3.45Å; G483-Y485 WeakPolarHBondContact O-CE2 3.46Å
484	I	95.1	Very high	83.2	Confident	0 Å²	0	64 Å²	64	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	122	175.7	-56.5	-59.7	0	0	0	109.5	I471 V472 A473 Q506 L507 L515 A523 M527	I471-I484 HydrophobicContact CB-CG2 3.94Å; I471-I484 HydrophobicContact CD1-CG2 3.95Å; I471-I484 HydrophobicContact CG2-CG2 4.23Å; V472-I484 WeakPolarHBondContact O-CA 3.47Å; A473-I484 HydrophobicContact CB-CD1 3.85Å; I484-Q506 CarbonylContact O-C 3.59Å; I484-Q506 WeakPolarHBondContact O-CA 3.41Å; I484-L507 HydrophobicContact CG2-CB 4.46Å; I484-L507 HydrophobicContact CG2-CD1 4.32Å; I484-L507 PolarHBondContact O-N 2.95Å; I484-L515 HydrophobicContact CB-CB 4.39Å; I484-L515 HydrophobicContact CG1-CB 4.05Å; I484-A523 HydrophobicContact CD1-CB 3.64Å; I484-A523 HydrophobicContact CG1-CB 3.73Å; I484-A523 HydrophobicContact CG2-CB 4.39Å; I484-M527 HydrophobicContact CG2-CE 4.23Å
485	Y	94.6	Very high	83.3	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	146.8	-177.4	-62.3	-94.9	0	0	0	111.8	I471 V472 A474 D479 G483 K487 D505 Q506 A542 A543 N546 L548	I471-Y485 CarbonylContact C-O 3.5Å; I471-Y485 VanDerWaalsContact CA-O 3.31Å; I471-Y485 WeakPolarHBondContact CA-O 3.48Å; V472-Y485 PolarHBondContact N-O 2.86Å; V472-Y485 PolarHBondContact O-N 2.89Å; A474-Y485 HydrophobicContact CB-CD2 4.04Å; A474-Y485 HydrophobicContact CB-CE2 4.15Å; D479-Y485 PolarHBondContact OD2-OH 3.07Å; G483-Y485 VanDerWaalsContact O-CD2 3.29Å; G483-Y485 WeakPolarHBondContact O-CD2 3.45Å; G483-Y485 WeakPolarHBondContact O-CE2 3.46Å; Y485-K487 PolarHBondContact O-N 3.29Å; Y485-D505 CarbonylContact C-O 3.5Å; Y485-D505 WeakPolarHBondContact CA-O 3.17Å; Y485-Q506 HydrophobicContact CD1-CB 3.81Å; Y485-Q506 HydrophobicContact CD1-CG 4.33Å; Y485-Q506 HydrophobicContact CE1-CB 3.74Å; Y485-Q506 HydrophobicContact CE1-CG 4.06Å; Y485-Q506 PolarHBondContact OH-NE2 3.3Å; Y485-A542 HydrophobicContact CE1-CB 3.98Å; Y485-A543 HydrophobicContact CD1-CB 4.11Å; Y485-A543 HydrophobicContact CE1-CB 4.42Å; Y485-N546 PolarHBondContact OH-ND2 3.14Å; Y485-L548 HydrophobicContact CD2-CD1 4.1Å; Y485-L548 HydrophobicContact CE1-CD1 4.05Å; Y485-L548 HydrophobicContact CE2-CD1 3.59Å
486	V	94.2	Very high	83.2	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	115.3	173.1	-179.5	0	0	0	0	109.4	L469 V489 E502 T503 G504 D505 L507	L469-V486 HydrophobicContact CD2-CG1 4.12Å; V486-V489 HydrophobicContact CG1-CG2 3.94Å; V486-E502 WeakPolarHBondContact CB-O 3.32Å; V486-T503 WeakPolarHBondContact O-CA 3.47Å; V486-G504 PolarHBondContact O-N 3.14Å; V486-D505 HydrophobicContact CG2-CB 4.3Å; V486-D505 PolarHBondContact N-O 2.87Å; V486-L507 HydrophobicContact CG2-CD1 4.29Å; V486-L507 HydrophobicContact CG2-CD2 4.03Å; V486-L507 HydrophobicContact CG2-CG 4.1Å
487	K	90.9	Very high	83.7	Confident	87 Å²	87	67 Å²	67	38%	0.378	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	-44.1	176.9	178.9	163.5	-179.8	163.7	0	113	S470 V472 Y485 T503 L552	S470-K487 PolarHBondContact O-N 2.79Å; V472-K487 HydrophobicContact CG1-CB 4.13Å; V472-K487 HydrophobicContact CG1-CD 3.67Å; V472-K487 HydrophobicContact CG2-CB 4.06Å; Y485-K487 PolarHBondContact O-N 3.29Å; K487-T503 WeakPolarHBondContact O-CG2 3.22Å; K487-T503 PolarHBondContact O-OG1 3.42Å; K487-L552 HydrophobicContact CB-CD2 3.83Å; K487-L552 HydrophobicContact CG-CD2 4.13Å
488	K	90.3	Very high	84.9	Confident	87 Å²	87	63 Å²	63	38%	0.378	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	137.6	172.5	176.3	163.3	-178	170.7	0	110	S470 E491	S470-K488 WeakPolarHBondContact CB-O 3.29Å; S470-K488 PolarHBondContact N-O 3.32Å; S470-K488 PolarHBondContact O-N 2.82Å; K488-E491 IonicContact NZ-OE1 3.17Å; K488-E491 PolarHBondContact NZ-OE1 3.29Å
489	V	90.8	Very high	86.3	Confident	24 Å²	24	61.7 Å²	61.7	15%	0.145	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	129.5	160.9	-170.9	0	0	0	0	107.9	L469 V486 A495 A496 L501	L469-V489 HydrophobicContact CD2-CG1 4.45Å; L469-V489 HydrophobicContact CD2-CG2 4.03Å; V486-V489 HydrophobicContact CG1-CG2 3.94Å; V489-A495 HydrophobicContact CG1-CB 3.75Å; V489-A496 HydrophobicContact CG1-CB 3.96Å; V489-L501 HydrophobicContact CG2-CB 4.41Å
490	V	88.5	Confident	87.1	Confident	65 Å²	65	64.6 Å²	64.6	39%	0.394	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-87.4	123.1	-175.2	-178.4	0	0	0	0	109.7	G468 T493 A496	G468-V490 WeakPolarHBondContact O-CB 3.46Å; G468-V490 WeakPolarHBondContact O-CG2 3.43Å; G468-V490 PolarHBondContact O-N 2.79Å; V490-T493 HydrophobicContact CB-CG2 3.76Å; V490-T493 HydrophobicContact CG1-CG2 3.78Å; V490-T493 WeakPolarHBondContact O-CB 3.28Å; V490-T493 WeakPolarHBondContact O-CG2 3.18Å; V490-T493 PolarHBondContact O-N 3.22Å; V490-T493 PolarHBondContact O-OG1 3.31Å; V490-A496 WeakPolarHBondContact O-CB 3.37Å
491	E	83.8	Confident	88.1	Confident	148 Å²	148	53.2 Å²	53.2	69%	0.692	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	144.7	179.3	-67.2	144.8	-114	0	0	111.8	K488 T493	K488-E491 IonicContact NZ-OE1 3.17Å; K488-E491 PolarHBondContact NZ-OE1 3.29Å; E491-T493 VanDerWaalsContact C-N 3.28Å; E491-T493 PolarHBondContact O-N 3.03Å
492	G	79.7	Confident	88.7	Confident	63 Å²	63	51.6 Å²	51.6	65%	0.649	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.2	10.6	-177.5	0	0	0	0	0	115.8
493	T	87.8	Confident	89.1	Confident	27 Å²	27	51.8 Å²	51.8	17%	0.166	29%	0.288	C	S	.	.	S	Bend	trans	-107.6	165	177.5	70.3	0	0	0	0	112.3	G468 V490 E491 A495 A496 H497	G468-T493 WeakPolarHBondContact CA-OG1 3.43Å; V490-T493 HydrophobicContact CB-CG2 3.76Å; V490-T493 HydrophobicContact CG1-CG2 3.78Å; V490-T493 WeakPolarHBondContact O-CB 3.28Å; V490-T493 WeakPolarHBondContact O-CG2 3.18Å; V490-T493 PolarHBondContact O-N 3.22Å; V490-T493 PolarHBondContact O-OG1 3.31Å; E491-T493 VanDerWaalsContact C-N 3.28Å; E491-T493 PolarHBondContact O-N 3.03Å; T493-A495 VanDerWaalsContact C-N 3.26Å; T493-A495 PolarHBondContact O-N 3.2Å; T493-A496 PolarHBondContact O-N 2.99Å; T493-H497 PolarHBondContact O-CD2 2.71Å; T493-H497 PolarHBondContact O-N 3.24Å
494	P	85.9	Confident	89	Confident	22 Å²	22	52.1 Å²	52.1	14%	0.143	29%	0.291	C	S	.	.	H	α-helix	trans	-53.1	-39.6	178.3	-28.7	36.8	0	0	0	114.1	R461 N463 A496 H497 D498	R461-P494 VanDerWaalsContact O-CB 3.22Å; R461-P494 WeakPolarHBondContact O-CB 3.43Å; R461-P494 WeakPolarHBondContact O-CG 3.38Å; N463-P494 HydrophobicContact CB-CG 4.11Å; P494-A496 PolarHBondContact O-N 2.85Å; P494-H497 PolarHBondContact O-N 3.16Å; P494-D498 VanDerWaalsContact O-CB 3.32Å; P494-D498 WeakPolarHBondContact O-CB 3.48Å; P494-D498 PolarHBondContact O-N 2.83Å
495	A	89.1	Confident	88.9	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-65.3	-35.1	176.2	0	0	0	0	0	113.5	L460 I467 L469 V489 T493 G499	L460-A495 HydrophobicContact CD1-CB 3.85Å; I467-A495 WeakPolarHBondContact O-CB 3.36Å; I467-A495 PolarHBondContact O-N 3.37Å; I467-A495 VanDerWaalsContact O-N 3.13Å; L469-A495 HydrophobicContact CD2-CB 3.71Å; L469-A495 HydrophobicContact CG-CB 3.98Å; V489-A495 HydrophobicContact CG1-CB 3.75Å; T493-A495 VanDerWaalsContact C-N 3.26Å; T493-A495 PolarHBondContact O-N 3.2Å; A495-G499 PolarHBondContact O-N 3.01Å
496	A	87.4	Confident	88.9	Confident	37 Å²	37	52.5 Å²	52.5	31%	0.306	29%	0.293	S	S	.	.	H	α-helix	trans	-75.6	-35.2	175.6	0	0	0	0	0	112.8	V489 V490 T493 P494	V489-A496 HydrophobicContact CG1-CB 3.96Å; V490-A496 WeakPolarHBondContact O-CB 3.37Å; T493-A496 PolarHBondContact O-N 2.99Å; P494-A496 PolarHBondContact O-N 2.85Å
497	H	85.9	Confident	88.9	Confident	151 Å²	151	52.6 Å²	52.6	70%	0.699	29%	0.293	S	S	*	.	H	α-helix	trans	-72.4	-30.7	176.5	-72.3	-61.7	0	0	0	113.1	T493 P494	T493-H497 PolarHBondContact O-CD2 2.71Å; T493-H497 PolarHBondContact O-N 3.24Å; P494-H497 PolarHBondContact O-N 3.16Å
498	D	87.8	Confident	89	Confident	53 Å²	53	49.2 Å²	49.2	28%	0.283	28%	0.279	S	S	.	.	H	α-helix	trans	-74.3	-37	173.2	-178.2	-89.6	0	0	0	112.6	L460 P494 R500	L460-D498 HydrophobicContact CD2-CB 3.38Å; P494-D498 VanDerWaalsContact O-CB 3.32Å; P494-D498 WeakPolarHBondContact O-CB 3.48Å; P494-D498 PolarHBondContact O-N 2.83Å; D498-R500 VanDerWaalsContact CG-NE 3.34Å; D498-R500 PolarHBondContact O-N 3.5Å; D498-R500 WeakPolarHBondContact OD1-CB 3.5Å; D498-R500 WeakPolarHBondContact OD1-CG 3.4Å; D498-R500 IonicContact OD1-CZ 3.77Å; D498-R500 PolarHBondContact OD1-N 2.96Å; D498-R500 IonicContact OD1-NE 2.75Å; D498-R500 PolarHBondContact OD1-NE 3.16Å; D498-R500 IonicContact OD1-NH2 3.88Å; D498-R500 IonicContact OD2-CZ 3.19Å; D498-R500 VanDerWaalsContact OD2-CZ 3.3Å; D498-R500 IonicContact OD2-NE 3.98Å; D498-R500 PolarHBondContact OD2-NE 3.3Å; D498-R500 VanDerWaalsContact OD2-NE 3.1Å; D498-R500 IonicContact OD2-NH2 2.82Å; D498-R500 PolarHBondContact OD2-NH2 3.13Å
499	G	86.4	Confident	89.2	Confident	49 Å²	49	45.5 Å²	45.5	51%	0.505	27%	0.265	S	S	.	.			trans	70.1	-6.9	172.6	0	0	0	0	0	116.2	A495 L501	A495-G499 PolarHBondContact O-N 3.01Å; G499-L501 VanDerWaalsContact C-N 3.29Å; G499-L501 PolarHBondContact O-N 2.96Å
500	R	88.4	Confident	89.3	Confident	107 Å²	107	44.4 Å²	44.4	40%	0.404	26%	0.258	S	S	.	.			trans	-78.6	-7.7	-178	-59.9	177.4	-70.5	167.1	-6.8	114.2	V458 T459 D498 K540	V458-R500 HydrophobicContact CG1-CB 4.22Å; V458-R500 HydrophobicContact CG2-CB 4.11Å; T459-R500 PolarHBondContact O-NH2 3.07Å; D498-R500 VanDerWaalsContact CG-NE 3.34Å; D498-R500 PolarHBondContact O-N 3.5Å; D498-R500 WeakPolarHBondContact OD1-CB 3.5Å; D498-R500 WeakPolarHBondContact OD1-CG 3.4Å; D498-R500 IonicContact OD1-CZ 3.77Å; D498-R500 PolarHBondContact OD1-N 2.96Å; D498-R500 IonicContact OD1-NE 2.75Å; D498-R500 PolarHBondContact OD1-NE 3.16Å; D498-R500 IonicContact OD1-NH2 3.88Å; D498-R500 IonicContact OD2-CZ 3.19Å; D498-R500 VanDerWaalsContact OD2-CZ 3.3Å; D498-R500 IonicContact OD2-NE 3.98Å; D498-R500 PolarHBondContact OD2-NE 3.3Å; D498-R500 VanDerWaalsContact OD2-NE 3.1Å; D498-R500 IonicContact OD2-NH2 2.82Å; D498-R500 PolarHBondContact OD2-NH2 3.13Å; R500-K540 WeakPolarHBondContact O-CE 3.44Å; R500-K540 PolarHBondContact O-NZ 2.64Å
501	L	90.9	Very high	89.4	Confident	7 Å²	7	43.9 Å²	43.9	4%	0.037	25%	0.253	C	S	.	.			trans	-105.7	137.9	173.3	-62.1	179.4	0	0	0	110.8	V458 L460 L469 V489 G499 L507 V538	V458-L501 HydrophobicContact CB-CD2 4.21Å; V458-L501 HydrophobicContact CG1-CD2 4.24Å; V458-L501 HydrophobicContact CG1-CG 4.13Å; V458-L501 HydrophobicContact CG2-CD2 3.95Å; L460-L501 HydrophobicContact CD1-CD1 3.76Å; L469-L501 HydrophobicContact CD1-CD1 3.61Å; L469-L501 HydrophobicContact CD2-CB 4.39Å; L469-L501 HydrophobicContact CD2-CD1 3.76Å; L469-L501 HydrophobicContact CG-CD1 4.24Å; V489-L501 HydrophobicContact CG2-CB 4.41Å; G499-L501 VanDerWaalsContact C-N 3.29Å; G499-L501 PolarHBondContact O-N 2.96Å; L501-L507 HydrophobicContact CD2-CD2 4.41Å; L501-V538 HydrophobicContact CD2-CG1 4.04Å; L501-V538 HydrophobicContact CD2-CG2 3.8Å
502	E	91.2	Very high	89.4	Confident	86 Å²	86	40 Å²	40	40%	0.402	25%	0.253	S	S	.	.			trans	-128.2	155.9	-179.1	-65.8	169.2	131.8	0	0	110.6	V486 G504 D505 K540	V486-E502 WeakPolarHBondContact CB-O 3.32Å; E502-G504 PolarHBondContact O-N 3.18Å; E502-D505 PolarHBondContact N-OD2 2.83Å; E502-D505 WeakPolarHBondContact O-CB 3.48Å; E502-D505 PolarHBondContact O-N 3.33Å; E502-K540 IonicContact OE2-NZ 2.71Å; E502-K540 PolarHBondContact OE2-NZ 2.85Å
503	T	90.5	Very high	89.8	Confident	74 Å²	74	42.3 Å²	42.3	45%	0.454	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	128.7	169.8	-73.2	0	0	0	0	110	V486 K487 L552	V486-T503 WeakPolarHBondContact O-CA 3.47Å; K487-T503 WeakPolarHBondContact O-CG2 3.22Å; K487-T503 PolarHBondContact O-OG1 3.42Å; T503-L552 HydrophobicContact CG2-CB 4.17Å
504	G	88.9	Confident	90	Very high	8 Å²	8	44.2 Å²	44.2	8%	0.082	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	96.8	-2	-176.5	0	0	0	0	0	115.5	V486 E502 R541 A542 A543	V486-G504 PolarHBondContact O-N 3.14Å; E502-G504 PolarHBondContact O-N 3.18Å; G504-R541 CarbonylContact O-C 3.59Å; G504-A542 PolarHBondContact O-N 3.46Å; G504-A542 VanDerWaalsContact O-N 3.17Å; G504-A543 VanDerWaalsContact O-CB 3.29Å; G504-A543 WeakPolarHBondContact O-CB 3.42Å; G504-A543 PolarHBondContact O-N 3.36Å
505	D	94.1	Very high	90.2	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-71.3	146	166.7	-71	-23.1	0	0	0	111.6	Y485 V486 E502 V538 K540 R541	Y485-D505 CarbonylContact C-O 3.5Å; Y485-D505 WeakPolarHBondContact CA-O 3.17Å; V486-D505 HydrophobicContact CG2-CB 4.3Å; V486-D505 PolarHBondContact N-O 2.87Å; E502-D505 PolarHBondContact N-OD2 2.83Å; E502-D505 WeakPolarHBondContact O-CB 3.48Å; E502-D505 PolarHBondContact O-N 3.33Å; D505-V538 HydrophobicContact CB-CG1 3.85Å; D505-K540 VanDerWaalsContact CG-CD 3.47Å; D505-K540 WeakPolarHBondContact OD1-CA 3.47Å; D505-K540 WeakPolarHBondContact OD1-CD 3.47Å; D505-K540 IonicContact OD1-NZ 3.2Å; D505-K540 VanDerWaalsContact OD2-CD 3.31Å; D505-K540 WeakPolarHBondContact OD2-CD 3.32Å; D505-K540 WeakPolarHBondContact OD2-CE 3.3Å; D505-K540 IonicContact OD2-NZ 3.88Å; D505-K540 PolarHBondContact OD2-NZ 3.26Å; D505-R541 PolarHBondContact OD1-N 3.35Å
506	Q	94.1	Very high	90.3	Very high	8 Å²	8	46.6 Å²	46.6	4%	0.037	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	129	172.7	178.5	-176.1	41	0	0	109.9	I484 Y485 L508 V538 R539 A542	I484-Q506 CarbonylContact O-C 3.59Å; I484-Q506 WeakPolarHBondContact O-CA 3.41Å; Y485-Q506 HydrophobicContact CD1-CB 3.81Å; Y485-Q506 HydrophobicContact CD1-CG 4.33Å; Y485-Q506 HydrophobicContact CE1-CB 3.74Å; Y485-Q506 HydrophobicContact CE1-CG 4.06Å; Y485-Q506 PolarHBondContact OH-NE2 3.3Å; Q506-L508 HydrophobicContact CG-CD2 3.93Å; Q506-V538 CarbonylContact O-C 3.57Å; Q506-V538 WeakPolarHBondContact O-CA 3.17Å; Q506-R539 HydrophobicContact CB-CB 4.35Å; Q506-R539 PolarHBondContact N-O 2.81Å; Q506-R539 PolarHBondContact O-N 3.42Å; Q506-A542 HydrophobicContact CB-CB 3.36Å; Q506-A542 HydrophobicContact CG-CB 4.48Å
507	L	94.5	Very high	90.2	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.005	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	116.4	173.3	-52.6	178.6	0	0	0	107.8	L469 I471 I484 V486 L501 L515 M527 F536 V538	L469-L507 HydrophobicContact CD1-CD1 4.49Å; I471-L507 HydrophobicContact CG2-CD1 3.95Å; I484-L507 HydrophobicContact CG2-CB 4.46Å; I484-L507 HydrophobicContact CG2-CD1 4.32Å; I484-L507 PolarHBondContact O-N 2.95Å; V486-L507 HydrophobicContact CG2-CD1 4.29Å; V486-L507 HydrophobicContact CG2-CD2 4.03Å; V486-L507 HydrophobicContact CG2-CG 4.1Å; L501-L507 HydrophobicContact CD2-CD2 4.41Å; L507-L515 HydrophobicContact CB-CD1 3.51Å; L507-L515 WeakPolarHBondContact O-CB 3.35Å; L507-M527 HydrophobicContact CD1-CE 3.69Å; L507-M527 HydrophobicContact CD1-SD 4.48Å; L507-F536 HydrophobicContact CD1-CD1 4.19Å; L507-F536 HydrophobicContact CD1-CE1 4.08Å; L507-F536 HydrophobicContact CD2-CB 4.44Å; L507-F536 HydrophobicContact CD2-CD1 4.18Å; L507-F536 HydrophobicContact CD2-CG 4.39Å; L507-V538 HydrophobicContact CD2-CG1 4.36Å; L507-V538 HydrophobicContact CD2-CG2 3.99Å
508	L	93.3	Very high	90.3	Very high	16 Å²	16	41.8 Å²	41.8	8%	0.084	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	-34	-178.2	-57.7	-179.6	0	0	0	112.2	I455 Q506 L515 I516 D537 R539	I455-L508 HydrophobicContact CD1-CD1 3.62Å; I455-L508 HydrophobicContact CG1-CD1 3.7Å; I455-L508 HydrophobicContact CG2-CD1 4.2Å; Q506-L508 HydrophobicContact CG-CD2 3.93Å; L508-L515 PolarHBondContact O-N 3.18Å; L508-I516 HydrophobicContact CD2-CD1 4.36Å; L508-D537 HydrophobicContact CB-CB 4.3Å; L508-D537 WeakPolarHBondContact CB-O 3.34Å; L508-D537 PolarHBondContact N-O 3.4Å; L508-R539 HydrophobicContact CD1-CB 4.13Å; L508-R539 HydrophobicContact CD2-CB 4.26Å; L508-R539 HydrophobicContact CG-CB 4.25Å
509	S	93.4	Very high	90.3	Very high	10 Å²	10	41.5 Å²	41.5	7%	0.07	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	161	176.6	90.8	0	0	0	0	111.8	H513 F536 D537	S509-H513 CarbonylContact C-O 3.51Å; S509-H513 WeakPolarHBondContact CA-O 3.47Å; S509-H513 WeakPolarHBondContact CB-O 3.36Å; S509-F536 WeakPolarHBondContact O-CA 3.35Å; S509-F536 WeakPolarHBondContact O-CD1 3.37Å; S509-D537 WeakPolarHBondContact CB-OD2 3.33Å; S509-D537 PolarHBondContact N-O 3.33Å; S509-D537 WeakPolarHBondContact OG-CB 3.49Å; S509-D537 VanDerWaalsContact OG-CG 3.3Å; S509-D537 PolarHBondContact OG-N 3.09Å; S509-D537 PolarHBondContact OG-OD2 2.73Å
510	V	94	Very high	90.6	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	121.8	163.1	64.5	0	0	0	0	110.1	G512 H513 L515 L526 M527 V534 H535 F536	V510-G512 PolarHBondContact O-N 2.81Å; V510-G512 VanDerWaalsContact O-N 3.08Å; V510-H513 PolarHBondContact N-O 3.37Å; V510-H513 WeakPolarHBondContact O-CB 3.29Å; V510-H513 PolarHBondContact O-N 2.83Å; V510-L515 HydrophobicContact CB-CD1 4.19Å; V510-L515 HydrophobicContact CB-CD2 4.41Å; V510-L515 HydrophobicContact CB-CG 4.45Å; V510-L515 HydrophobicContact CG1-CD1 4.4Å; V510-L515 HydrophobicContact CG1-CD2 3.73Å; V510-L515 HydrophobicContact CG1-CG 4.21Å; V510-L526 HydrophobicContact CG1-CB 3.73Å; V510-L526 HydrophobicContact CG1-CD1 4.4Å; V510-M527 HydrophobicContact CB-CG 4.45Å; V510-M527 HydrophobicContact CG1-CG 4.49Å; V510-M527 HydrophobicContact CG2-CG 4.04Å; V510-V534 HydrophobicContact CG2-CG1 3.4Å; V510-H535 CarbonylContact C-O 3.58Å; V510-H535 WeakPolarHBondContact CA-O 3.2Å; V510-F536 HydrophobicContact CB-CD1 4.12Å; V510-F536 HydrophobicContact CB-CE1 4Å; V510-F536 HydrophobicContact CG2-CD1 4.11Å; V510-F536 HydrophobicContact CG2-CE1 3.68Å; V510-F536 HydrophobicContact CG2-CZ 4.24Å
511	N	89.6	Confident	90.6	Very high	55 Å²	55	45.9 Å²	45.9	29%	0.294	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.5	35.8	-175.9	-74.3	-34.5	0	0	0	113.5	S530 H535	N511-S530 VanDerWaalsContact ND2-CB 3.26Å; N511-S530 WeakPolarHBondContact ND2-CB 3.43Å; N511-S530 PolarHBondContact ND2-OG 3.33Å; N511-H535 PolarHBondContact N-O 3.45Å; N511-H535 PolarHBondContact OD1-N 3.2Å; N511-H535 PolarHBondContact OD1-ND1 2.98Å
512	G	84.8	Confident	90.4	Very high	67 Å²	67	48 Å²	48	69%	0.691	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.2	-11.3	-178.3	0	0	0	0	0	115.6	V510	V510-G512 PolarHBondContact O-N 2.81Å; V510-G512 VanDerWaalsContact O-N 3.08Å
513	H	88.4	Confident	90.4	Very high	110 Å²	110	43.9 Å²	43.9	51%	0.509	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	127.6	172	-63.1	-76	0	0	0	110.7	S509 V510 L526	S509-H513 CarbonylContact C-O 3.51Å; S509-H513 WeakPolarHBondContact CA-O 3.47Å; S509-H513 WeakPolarHBondContact CB-O 3.36Å; V510-H513 PolarHBondContact N-O 3.37Å; V510-H513 WeakPolarHBondContact O-CB 3.29Å; V510-H513 PolarHBondContact O-N 2.83Å; H513-L526 HydrophobicContact CB-CD1 4.32Å
514	S	90.9	Very high	90.3	Very high	67 Å²	67	42.2 Å²	42.2	47%	0.469	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	137.8	175.5	-177.4	0	0	0	0	111.7	I516	S514-I516 PolarHBondContact OG-N 2.91Å
515	L	91.2	Very high	90.2	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.273	C	S	.	.			trans	-102.9	2.5	171.5	-64.7	175.8	0	0	0	112.2	I484 L507 L508 V510 I518 A523 L526 M527	I484-L515 HydrophobicContact CB-CB 4.39Å; I484-L515 HydrophobicContact CG1-CB 4.05Å; L507-L515 HydrophobicContact CB-CD1 3.51Å; L507-L515 WeakPolarHBondContact O-CB 3.35Å; L508-L515 PolarHBondContact O-N 3.18Å; V510-L515 HydrophobicContact CB-CD1 4.19Å; V510-L515 HydrophobicContact CB-CD2 4.41Å; V510-L515 HydrophobicContact CB-CG 4.45Å; V510-L515 HydrophobicContact CG1-CD1 4.4Å; V510-L515 HydrophobicContact CG1-CD2 3.73Å; V510-L515 HydrophobicContact CG1-CG 4.21Å; L515-I518 HydrophobicContact CD2-CD1 3.69Å; L515-A523 HydrophobicContact CD2-CB 3.96Å; L515-L526 HydrophobicContact CD2-CD1 4.33Å; L515-M527 HydrophobicContact CD1-CE 3.75Å; L515-M527 HydrophobicContact CD2-CE 4.24Å
516	I	90.4	Very high	89.9	Confident	72 Å²	72	49.4 Å²	49.4	37%	0.369	28%	0.283	S	S	.	.	S	Bend	trans	-80.9	128.7	177.9	-50.6	178.4	0	0	0	109.1	Q481 L508 S514 I518	Q481-I516 HydrophobicContact CB-CG2 4.2Å; L508-I516 HydrophobicContact CD2-CD1 4.36Å; S514-I516 PolarHBondContact OG-N 2.91Å; I516-I518 VanDerWaalsContact C-N 3.35Å; I516-I518 PolarHBondContact O-N 3.38Å
517	G	84.9	Confident	89.5	Confident	42 Å²	42	49.7 Å²	49.7	43%	0.433	28%	0.284	S	S	.	.	S	Bend	trans	83.2	-4.9	176.2	0	0	0	0	0	116.2	M482	M482-G517 WeakPolarHBondContact O-CA 3.41Å; M482-G517 PolarHBondContact O-N 3.35Å
518	I	87.9	Confident	89	Confident	45 Å²	45	54.7 Å²	54.7	23%	0.231	32%	0.315	C	S	.	.			trans	-93	163.8	-177.9	73.2	171.5	0	0	0	112.8	L515 I516 D522 A523 L526	L515-I518 HydrophobicContact CD2-CD1 3.69Å; I516-I518 VanDerWaalsContact C-N 3.35Å; I516-I518 PolarHBondContact O-N 3.38Å; I518-D522 HydrophobicContact CB-CB 4.29Å; I518-D522 HydrophobicContact CD1-CB 4.14Å; I518-A523 HydrophobicContact CD1-CB 3.95Å; I518-A523 HydrophobicContact CG1-CB 4.32Å; I518-L526 HydrophobicContact CD1-CD1 3.79Å
519	S	88.6	Confident	88.4	Confident	48 Å²	48	60.5 Å²	60.5	34%	0.336	34%	0.342	S	S	.	.			trans	-73.2	160.8	176.6	82.4	0	0	0	0	112.5	E521 D522 A523	S519-E521 PolarHBondContact O-N 3Å; S519-E521 PolarHBondContact OG-N 3.35Å; S519-D522 VanDerWaalsContact CB-OD2 3.31Å; S519-D522 WeakPolarHBondContact CB-OD2 3.3Å; S519-D522 PolarHBondContact O-N 3.47Å; S519-D522 VanDerWaalsContact OG-CG 3.23Å; S519-D522 PolarHBondContact OG-N 3.42Å; S519-D522 PolarHBondContact OG-OD2 3.37Å; S519-A523 WeakPolarHBondContact O-CB 3.45Å; S519-A523 PolarHBondContact O-N 2.7Å
520	Q	92.1	Very high	87.7	Confident	87 Å²	87	61 Å²	61	41%	0.407	35%	0.345	S	S	.	.	H	α-helix	trans	-59.8	-32.6	172	-175.5	176.6	-35.5	0	0	112.2	I471 A473 A524	I471-Q520 HydrophobicContact CD1-CG 4.44Å; I471-Q520 HydrophobicContact CG1-CG 4.36Å; I471-Q520 PolarHBondContact O-NE2 3.24Å; A473-Q520 HydrophobicContact CB-CB 3.85Å; Q520-A524 VanDerWaalsContact O-CB 3.27Å; Q520-A524 WeakPolarHBondContact O-CB 3.31Å; Q520-A524 PolarHBondContact O-N 2.97Å
521	E	89.6	Confident	87	Confident	160 Å²	160	63.2 Å²	63.2	75%	0.748	37%	0.368	S	S	*	.	H	α-helix	trans	-75.3	-39.7	-178.8	-60.6	-175.9	176.1	0	0	111.4	S519 A524 R525	S519-E521 PolarHBondContact O-N 3Å; S519-E521 PolarHBondContact OG-N 3.35Å; E521-A524 PolarHBondContact O-N 2.97Å; E521-R525 VanDerWaalsContact O-CB 3.29Å; E521-R525 WeakPolarHBondContact O-CB 3.46Å; E521-R525 PolarHBondContact O-N 3.41Å
522	D	87	Confident	86.6	Confident	51 Å²	51	65.6 Å²	65.6	27%	0.273	38%	0.381	S	S	.	.	H	α-helix	trans	-64.4	-43.9	171.7	-62.4	-60.3	0	0	0	111.3	I518 S519 R525 L526	I518-D522 HydrophobicContact CB-CB 4.29Å; I518-D522 HydrophobicContact CD1-CB 4.14Å; S519-D522 VanDerWaalsContact CB-OD2 3.31Å; S519-D522 WeakPolarHBondContact CB-OD2 3.3Å; S519-D522 PolarHBondContact O-N 3.47Å; S519-D522 VanDerWaalsContact OG-CG 3.23Å; S519-D522 PolarHBondContact OG-N 3.42Å; S519-D522 PolarHBondContact OG-OD2 3.37Å; D522-R525 WeakPolarHBondContact O-CB 3.3Å; D522-R525 PolarHBondContact O-N 3.13Å; D522-R525 IonicContact OD1-CZ 2.81Å; D522-R525 IonicContact OD1-NH1 2.64Å; D522-R525 PolarHBondContact OD1-NH1 3.01Å; D522-R525 IonicContact OD1-NH2 2.69Å; D522-R525 PolarHBondContact OD1-NH2 2.93Å; D522-L526 WeakPolarHBondContact O-CG 3.46Å; D522-L526 PolarHBondContact O-N 3.04Å
523	A	89.9	Confident	86.6	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-60.4	-46.5	175.4	0	0	0	0	0	111.8	I471 I484 L515 I518 S519 R525 L526 M527	I471-A523 HydrophobicContact CD1-CB 3.99Å; I484-A523 HydrophobicContact CD1-CB 3.64Å; I484-A523 HydrophobicContact CG1-CB 3.73Å; I484-A523 HydrophobicContact CG2-CB 4.39Å; L515-A523 HydrophobicContact CD2-CB 3.96Å; I518-A523 HydrophobicContact CD1-CB 3.95Å; I518-A523 HydrophobicContact CG1-CB 4.32Å; S519-A523 WeakPolarHBondContact O-CB 3.45Å; S519-A523 PolarHBondContact O-N 2.7Å; A523-R525 VanDerWaalsContact C-N 3.33Å; A523-R525 PolarHBondContact O-N 3.31Å; A523-L526 PolarHBondContact O-N 3.44Å; A523-M527 HydrophobicContact CB-CE 4.28Å; A523-M527 VanDerWaalsContact O-CG 3.29Å; A523-M527 WeakPolarHBondContact O-CG 3.21Å; A523-M527 PolarHBondContact O-N 3.5Å
524	A	88.3	Confident	86.7	Confident	39 Å²	39	61.7 Å²	61.7	32%	0.322	35%	0.345	S	S	.	.	H	α-helix	trans	-63.3	-37.6	174.9	0	0	0	0	0	112	I471 Q520 E521 T528	I471-A524 HydrophobicContact CD1-CB 4.43Å; Q520-A524 VanDerWaalsContact O-CB 3.27Å; Q520-A524 WeakPolarHBondContact O-CB 3.31Å; Q520-A524 PolarHBondContact O-N 2.97Å; E521-A524 PolarHBondContact O-N 2.97Å; A524-T528 VanDerWaalsContact O-CB 3.26Å; A524-T528 WeakPolarHBondContact O-CB 3.3Å; A524-T528 PolarHBondContact O-N 2.72Å; A524-T528 PolarHBondContact O-OG1 3.26Å
525	R	86.6	Confident	86.7	Confident	120 Å²	120	62.6 Å²	62.6	45%	0.453	34%	0.341	S	S	.	.	H	α-helix	trans	-63.9	-47.3	175.4	-172.6	176.2	68.7	-111.3	-4.2	111.5	E521 D522 A523 T528 Q529	E521-R525 VanDerWaalsContact O-CB 3.29Å; E521-R525 WeakPolarHBondContact O-CB 3.46Å; E521-R525 PolarHBondContact O-N 3.41Å; D522-R525 WeakPolarHBondContact O-CB 3.3Å; D522-R525 PolarHBondContact O-N 3.13Å; D522-R525 IonicContact OD1-CZ 2.81Å; D522-R525 IonicContact OD1-NH1 2.64Å; D522-R525 PolarHBondContact OD1-NH1 3.01Å; D522-R525 IonicContact OD1-NH2 2.69Å; D522-R525 PolarHBondContact OD1-NH2 2.93Å; A523-R525 VanDerWaalsContact C-N 3.33Å; A523-R525 PolarHBondContact O-N 3.31Å; R525-T528 PolarHBondContact O-N 2.96Å; R525-Q529 HydrophobicContact CG-CG 4.24Å; R525-Q529 WeakPolarHBondContact O-CB 3.4Å; R525-Q529 WeakPolarHBondContact O-CG 3.34Å; R525-Q529 PolarHBondContact O-N 3.49Å
526	L	87.6	Confident	86.9	Confident	39 Å²	39	62.7 Å²	62.7	20%	0.204	34%	0.342	C	S	.	.	H	α-helix	trans	-61.5	-44.5	176.4	-69.5	169	0	0	0	112.2	V510 H513 L515 I518 D522 A523 T528 S530	V510-L526 HydrophobicContact CG1-CB 3.73Å; V510-L526 HydrophobicContact CG1-CD1 4.4Å; H513-L526 HydrophobicContact CB-CD1 4.32Å; L515-L526 HydrophobicContact CD2-CD1 4.33Å; I518-L526 HydrophobicContact CD1-CD1 3.79Å; D522-L526 WeakPolarHBondContact O-CG 3.46Å; D522-L526 PolarHBondContact O-N 3.04Å; A523-L526 PolarHBondContact O-N 3.44Å; L526-T528 VanDerWaalsContact C-N 3.29Å; L526-T528 PolarHBondContact O-N 2.85Å; L526-S530 WeakPolarHBondContact O-CB 3.21Å; L526-S530 PolarHBondContact O-N 3.1Å; L526-S530 PolarHBondContact O-OG 3.26Å
527	M	87.3	Confident	87	Confident	14 Å²	14	61 Å²	61	7%	0.069	33%	0.333	C	S	.	.	H	α-helix	trans	-64.1	-34	174.9	-68.5	175.7	-154	0	0	112.1	K462 I467 I471 I484 L507 V510 L515 A523 F536	K462-M527 VanDerWaalsContact CE-O 3.3Å; K462-M527 WeakPolarHBondContact CE-O 3.41Å; K462-M527 PolarHBondContact NZ-O 3.22Å; I467-M527 HydrophobicContact CD1-CB 4.2Å; I471-M527 HydrophobicContact CD1-CE 3.88Å; I471-M527 HydrophobicContact CD1-SD 3.99Å; I471-M527 HydrophobicContact CG2-CE 4.41Å; I471-M527 HydrophobicContact CG2-SD 4.37Å; I484-M527 HydrophobicContact CG2-CE 4.23Å; L507-M527 HydrophobicContact CD1-CE 3.69Å; L507-M527 HydrophobicContact CD1-SD 4.48Å; V510-M527 HydrophobicContact CB-CG 4.45Å; V510-M527 HydrophobicContact CG1-CG 4.49Å; V510-M527 HydrophobicContact CG2-CG 4.04Å; L515-M527 HydrophobicContact CD1-CE 3.75Å; L515-M527 HydrophobicContact CD2-CE 4.24Å; A523-M527 HydrophobicContact CB-CE 4.28Å; A523-M527 VanDerWaalsContact O-CG 3.29Å; A523-M527 WeakPolarHBondContact O-CG 3.21Å; A523-M527 PolarHBondContact O-N 3.5Å; M527-F536 HydrophobicContact CE-CE1 4.02Å; M527-F536 HydrophobicContact CG-CE1 3.99Å; M527-F536 HydrophobicContact CG-CZ 4.24Å; M527-F536 HydrophobicContact SD-CE1 4Å; M527-F536 HydrophobicContact SD-CZ 4.27Å
528	T	83.4	Confident	87.4	Confident	106 Å²	106	59 Å²	59	65%	0.65	31%	0.313	S	S	*	.	H	α-helix	trans	-74.7	-46.4	178	-58.2	0	0	0	0	112	K462 A524 R525 L526 S530	K462-T528 PolarHBondContact NZ-O 3.29Å; A524-T528 VanDerWaalsContact O-CB 3.26Å; A524-T528 WeakPolarHBondContact O-CB 3.3Å; A524-T528 PolarHBondContact O-N 2.72Å; A524-T528 PolarHBondContact O-OG1 3.26Å; R525-T528 PolarHBondContact O-N 2.96Å; L526-T528 VanDerWaalsContact C-N 3.29Å; L526-T528 PolarHBondContact O-N 2.85Å; T528-S530 VanDerWaalsContact C-N 3.31Å; T528-S530 PolarHBondContact O-N 3.08Å
529	Q	80.4	Confident	87.7	Confident	138 Å²	138	59.5 Å²	59.5	65%	0.645	31%	0.312	S	S	*	.	H	α-helix	trans	-71	-21	179.7	-72.2	176.8	-29.4	0	0	113.9	R525	R525-Q529 HydrophobicContact CG-CG 4.24Å; R525-Q529 WeakPolarHBondContact O-CB 3.4Å; R525-Q529 WeakPolarHBondContact O-CG 3.34Å; R525-Q529 PolarHBondContact O-N 3.49Å
530	S	79.3	Confident	87.8	Confident	21 Å²	21	60.1 Å²	60.1	15%	0.147	31%	0.309	C	S	.	.	S	Bend	trans	-52.9	154	170.8	-71.9	0	0	0	0	112.4	K462 N511 L526 T528	K462-S530 PolarHBondContact NZ-O 3.26Å; N511-S530 VanDerWaalsContact ND2-CB 3.26Å; N511-S530 WeakPolarHBondContact ND2-CB 3.43Å; N511-S530 PolarHBondContact ND2-OG 3.33Å; L526-S530 WeakPolarHBondContact O-CB 3.21Å; L526-S530 PolarHBondContact O-N 3.1Å; L526-S530 PolarHBondContact O-OG 3.26Å; T528-S530 VanDerWaalsContact C-N 3.31Å; T528-S530 PolarHBondContact O-N 3.08Å
531	G	78.1	Confident	87.3	Confident	47 Å²	47	64.3 Å²	64.3	49%	0.485	32%	0.321	S	S	.	.			trans	-66.6	-165	179.9	0	0	0	0	0	114.8	K462 E533	K462-G531 VanDerWaalsContact CD-O 3.29Å; K462-G531 WeakPolarHBondContact CD-O 3.46Å; K462-G531 WeakPolarHBondContact CE-O 3.49Å; G531-E533 PolarHBondContact O-N 3.43Å; G531-E533 VanDerWaalsContact O-N 3.09Å
532	N	82	Confident	87	Confident	105 Å²	105	56.7 Å²	56.7	56%	0.561	29%	0.285	S	S	*	.	S	Bend	trans	-67.7	-5.5	177.7	-158.9	34.5	0	0	0	113.6	R461 K462	R461-N532 CarbonylContact C-O 3.53Å; R461-N532 WeakPolarHBondContact CA-O 3.44Å; K462-N532 PolarHBondContact N-O 2.75Å; K462-N532 PolarHBondContact O-OD1 3.23Å
533	E	85.7	Confident	86.9	Confident	94 Å²	94	54.3 Å²	54.3	44%	0.439	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	140	178.4	-171.9	158.4	-136.3	0	0	109.1	T459 L460 R461 G531	T459-E533 HydrophobicContact CG2-CG 3.42Å; T459-E533 VanDerWaalsContact CG2-CG 3.42Å; T459-E533 WeakPolarHBondContact CG2-OE1 3.49Å; L460-E533 WeakPolarHBondContact O-CA 3.37Å; R461-E533 HydrophobicContact CG-CB 4.38Å; R461-E533 HydrophobicContact CG-CG 4.13Å; G531-E533 PolarHBondContact O-N 3.43Å; G531-E533 VanDerWaalsContact O-N 3.09Å
534	V	89.9	Confident	86.4	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	118	-168.6	-169.2	0	0	0	0	109.5	T459 L460 K462 I467 V510 F536	T459-V534 CarbonylContact C-O 3.49Å; T459-V534 WeakPolarHBondContact CA-O 3.39Å; L460-V534 PolarHBondContact N-O 2.85Å; L460-V534 PolarHBondContact O-N 2.87Å; K462-V534 HydrophobicContact CD-CG2 4.35Å; K462-V534 VanDerWaalsContact CE-CG2 3.47Å; K462-V534 HydrophobicContact CG-CG2 4.09Å; I467-V534 HydrophobicContact CD1-CB 4.27Å; I467-V534 HydrophobicContact CD1-CG1 4.13Å; I467-V534 HydrophobicContact CD1-CG2 3.92Å; I467-V534 HydrophobicContact CG1-CG2 4.43Å; V510-V534 HydrophobicContact CG2-CG1 3.4Å; V534-F536 HydrophobicContact CB-CE2 4.16Å; V534-F536 HydrophobicContact CB-CZ 4.47Å; V534-F536 HydrophobicContact CG1-CD2 4.31Å; V534-F536 HydrophobicContact CG1-CE1 4.14Å; V534-F536 HydrophobicContact CG1-CE2 3.61Å; V534-F536 HydrophobicContact CG1-CZ 3.53Å
535	H	91.1	Very high	85.7	Confident	86 Å²	86	66.4 Å²	66.4	40%	0.398	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	129.8	-179.8	-56.3	75.7	0	0	0	109.4	T459 V510 N511	T459-H535 PolarHBondContact OG1-CD2 3.02Å; V510-H535 CarbonylContact C-O 3.58Å; V510-H535 WeakPolarHBondContact CA-O 3.2Å; N511-H535 PolarHBondContact N-O 3.45Å; N511-H535 PolarHBondContact OD1-N 3.2Å; N511-H535 PolarHBondContact OD1-ND1 2.98Å
536	F	94.1	Very high	85.4	Confident	2 Å²	2	61.7 Å²	61.7	1%	0.009	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	132.9	174.5	-62.6	-81.1	0	0	0	110.7	K457 V458 L460 I467 L469 L507 S509 V510 M527 V534 V538	K457-F536 WeakPolarHBondContact CA-O 3.47Å; V458-F536 PolarHBondContact N-O 2.9Å; V458-F536 PolarHBondContact O-N 3.05Å; L460-F536 HydrophobicContact CD1-CE2 4.25Å; I467-F536 HydrophobicContact CD1-CE2 4.45Å; I467-F536 HydrophobicContact CD1-CZ 4.01Å; I467-F536 HydrophobicContact CG2-CE2 4.46Å; L469-F536 HydrophobicContact CD1-CE2 4.36Å; L469-F536 HydrophobicContact CD1-CZ 4.24Å; L507-F536 HydrophobicContact CD1-CD1 4.19Å; L507-F536 HydrophobicContact CD1-CE1 4.08Å; L507-F536 HydrophobicContact CD2-CB 4.44Å; L507-F536 HydrophobicContact CD2-CD1 4.18Å; L507-F536 HydrophobicContact CD2-CG 4.39Å; S509-F536 WeakPolarHBondContact O-CA 3.35Å; S509-F536 WeakPolarHBondContact O-CD1 3.37Å; V510-F536 HydrophobicContact CB-CD1 4.12Å; V510-F536 HydrophobicContact CB-CE1 4Å; V510-F536 HydrophobicContact CG2-CD1 4.11Å; V510-F536 HydrophobicContact CG2-CE1 3.68Å; V510-F536 HydrophobicContact CG2-CZ 4.24Å; M527-F536 HydrophobicContact CE-CE1 4.02Å; M527-F536 HydrophobicContact CG-CE1 3.99Å; M527-F536 HydrophobicContact CG-CZ 4.24Å; M527-F536 HydrophobicContact SD-CE1 4Å; M527-F536 HydrophobicContact SD-CZ 4.27Å; V534-F536 HydrophobicContact CB-CE2 4.16Å; V534-F536 HydrophobicContact CB-CZ 4.47Å; V534-F536 HydrophobicContact CG1-CD2 4.31Å; V534-F536 HydrophobicContact CG1-CE1 4.14Å; V534-F536 HydrophobicContact CG1-CE2 3.61Å; V534-F536 HydrophobicContact CG1-CZ 3.53Å; F536-V538 HydrophobicContact CB-CG2 3.67Å
537	D	93.8	Very high	84.9	Confident	36 Å²	36	62.4 Å²	62.4	19%	0.193	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	124.6	158.1	-66.8	-57.4	0	0	0	108	I455 K457 L508 S509	I455-D537 HydrophobicContact CG2-CB 3.67Å; K457-D537 WeakPolarHBondContact CE-OD1 3.44Å; K457-D537 IonicContact NZ-OD1 3.22Å; K457-D537 PolarHBondContact NZ-OD1 3.38Å; L508-D537 HydrophobicContact CB-CB 4.3Å; L508-D537 WeakPolarHBondContact CB-O 3.34Å; L508-D537 PolarHBondContact N-O 3.4Å; S509-D537 WeakPolarHBondContact CB-OD2 3.33Å; S509-D537 PolarHBondContact N-O 3.33Å; S509-D537 WeakPolarHBondContact OG-CB 3.49Å; S509-D537 VanDerWaalsContact OG-CG 3.3Å; S509-D537 PolarHBondContact OG-N 3.09Å; S509-D537 PolarHBondContact OG-OD2 2.73Å
538	V	93.6	Very high	84.5	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	123.6	-166.1	-173	0	0	0	0	111.6	I455 S456 V458 L501 D505 Q506 L507 F536	I455-V538 WeakPolarHBondContact CA-O 3.45Å; S456-V538 PolarHBondContact N-O 2.87Å; S456-V538 PolarHBondContact O-N 2.85Å; V458-V538 HydrophobicContact CB-CG2 4.35Å; V458-V538 HydrophobicContact CG2-CG2 4.03Å; L501-V538 HydrophobicContact CD2-CG1 4.04Å; L501-V538 HydrophobicContact CD2-CG2 3.8Å; D505-V538 HydrophobicContact CB-CG1 3.85Å; Q506-V538 CarbonylContact O-C 3.57Å; Q506-V538 WeakPolarHBondContact O-CA 3.17Å; L507-V538 HydrophobicContact CD2-CG1 4.36Å; L507-V538 HydrophobicContact CD2-CG2 3.99Å; F536-V538 HydrophobicContact CB-CG2 3.67Å
539	R	92.5	Very high	84.1	Confident	56 Å²	56	59.8 Å²	59.8	21%	0.211	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	111.6	168.2	-178	-176	-78.5	128.4	-6.7	109.3	D453 Q506 L508 A542	D453-R539 IonicContact OD1-NE 2.71Å; D453-R539 IonicContact OD2-CZ 3.23Å; D453-R539 IonicContact OD2-NE 2.7Å; D453-R539 PolarHBondContact OD2-NE 2.8Å; D453-R539 IonicContact OD2-NH2 3.14Å; D453-R539 PolarHBondContact OD2-NH2 3.49Å; Q506-R539 HydrophobicContact CB-CB 4.35Å; Q506-R539 PolarHBondContact N-O 2.81Å; Q506-R539 PolarHBondContact O-N 3.42Å; L508-R539 HydrophobicContact CD1-CB 4.13Å; L508-R539 HydrophobicContact CD2-CB 4.26Å; L508-R539 HydrophobicContact CG-CB 4.25Å; R539-A542 HydrophobicContact CB-CB 4.28Å; R539-A542 HydrophobicContact CG-CB 3.97Å
540	K	90.9	Very high	83.5	Confident	62 Å²	62	60.1 Å²	60.1	27%	0.27	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	137.1	-177.8	-83.6	-57.3	-157	166.5	0	113	R500 E502 D505 A542	R500-K540 WeakPolarHBondContact O-CE 3.44Å; R500-K540 PolarHBondContact O-NZ 2.64Å; E502-K540 IonicContact OE2-NZ 2.71Å; E502-K540 PolarHBondContact OE2-NZ 2.85Å; D505-K540 VanDerWaalsContact CG-CD 3.47Å; D505-K540 WeakPolarHBondContact OD1-CA 3.47Å; D505-K540 WeakPolarHBondContact OD1-CD 3.47Å; D505-K540 IonicContact OD1-NZ 3.2Å; D505-K540 VanDerWaalsContact OD2-CD 3.31Å; D505-K540 WeakPolarHBondContact OD2-CD 3.32Å; D505-K540 WeakPolarHBondContact OD2-CE 3.3Å; D505-K540 IonicContact OD2-NZ 3.88Å; D505-K540 PolarHBondContact OD2-NZ 3.26Å; K540-A542 PolarHBondContact O-N 2.69Å
541	R	83.3	Confident	83	Confident	175 Å²	175	65.4 Å²	65.4	66%	0.66	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	22.4	176	-57.4	179.1	-179.3	165.8	0	115.1	G504 D505 A543 H544	G504-R541 CarbonylContact O-C 3.59Å; D505-R541 PolarHBondContact OD1-N 3.35Å; R541-A543 PolarHBondContact O-N 3.44Å; R541-H544 PolarHBondContact O-N 2.86Å
542	A	83.1	Confident	82.6	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-54.4	-37.5	-175.2	0	0	0	0	0	113.3	Y485 G504 Q506 R539 K540 H544 R545 N546	Y485-A542 HydrophobicContact CE1-CB 3.98Å; G504-A542 PolarHBondContact O-N 3.46Å; G504-A542 VanDerWaalsContact O-N 3.17Å; Q506-A542 HydrophobicContact CB-CB 3.36Å; Q506-A542 HydrophobicContact CG-CB 4.48Å; R539-A542 HydrophobicContact CB-CB 4.28Å; R539-A542 HydrophobicContact CG-CB 3.97Å; K540-A542 PolarHBondContact O-N 2.69Å; A542-H544 PolarHBondContact O-N 2.95Å; A542-R545 PolarHBondContact O-N 3.03Å; A542-N546 WeakPolarHBondContact O-CB 3.48Å; A542-N546 PolarHBondContact O-N 2.99Å; A542-N546 PolarHBondContact O-OD1 3.05Å
543	A	83.3	Confident	81.2	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.008	30%	0.304	C	S	.	.	H	α-helix	trans	-59.1	-32.4	178.1	0	0	0	0	0	113.9	Y485 G504 R541 G547 L548 S549 L552	Y485-A543 HydrophobicContact CD1-CB 4.11Å; Y485-A543 HydrophobicContact CE1-CB 4.42Å; G504-A543 VanDerWaalsContact O-CB 3.29Å; G504-A543 WeakPolarHBondContact O-CB 3.42Å; G504-A543 PolarHBondContact O-N 3.36Å; R541-A543 PolarHBondContact O-N 3.44Å; A543-G547 PolarHBondContact O-N 3.07Å; A543-L548 HydrophobicContact CB-CB 4.04Å; A543-L548 WeakPolarHBondContact O-CA 3.5Å; A543-L548 PolarHBondContact O-N 3.46Å; A543-S549 PolarHBondContact O-N 3.42Å; A543-S549 VanDerWaalsContact O-N 3.14Å; A543-L552 HydrophobicContact CB-CD1 3.3Å
544	H	79.2	Confident	78.6	Confident	146 Å²	146	61.8 Å²	61.8	68%	0.676	32%	0.318	S	S	*	.	H	α-helix	trans	-72	-34.7	175.7	-170.6	-50.6	0	0	0	111.6	R541 A542 N546	R541-H544 PolarHBondContact O-N 2.86Å; A542-H544 PolarHBondContact O-N 2.95Å; H544-N546 VanDerWaalsContact C-N 3.35Å
545	R	74.2	Confident	75.8	Confident	146 Å²	146	71.2 Å²	71.2	55%	0.551	36%	0.362	S	S	*	.	H	α-helix	trans	-71.6	-33	176.2	-68.8	171	59.3	-178.2	-5.1	111.9	D453 A542	D453-R545 IonicContact OD1-CZ 3.77Å; D453-R545 IonicContact OD1-NH1 2.61Å; D453-R545 PolarHBondContact OD1-NH1 3.48Å; D453-R545 IonicContact OD1-NH2 3.64Å; D453-R545 PolarHBondContact OD1-NH2 3.34Å; A542-R545 PolarHBondContact O-N 3.03Å
546	N	79.9	Confident	72.7	Confident	22 Å²	22	72.5 Å²	72.5	12%	0.118	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98	9.1	-171	-68.6	38.9	0	0	0	113.2	G476 V477 D479 Y485 A542 H544 L548	G476-N546 VanDerWaalsContact CA-O 3.22Å; G476-N546 WeakPolarHBondContact CA-O 3.3Å; V477-N546 PolarHBondContact N-O 2.98Å; D479-N546 VanDerWaalsContact CG-ND2 3.29Å; D479-N546 PolarHBondContact OD1-ND2 3.45Å; D479-N546 VanDerWaalsContact OD1-ND2 3.14Å; D479-N546 PolarHBondContact OD2-ND2 3.03Å; Y485-N546 PolarHBondContact OH-ND2 3.14Å; A542-N546 WeakPolarHBondContact O-CB 3.48Å; A542-N546 PolarHBondContact O-N 2.99Å; A542-N546 PolarHBondContact O-OD1 3.05Å; H544-N546 VanDerWaalsContact C-N 3.35Å; N546-L548 HydrophobicContact CB-CD1 4.45Å
547	G	77.6	Confident	69.5	Low	53 Å²	53	78.5 Å²	78.5	55%	0.546	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.8	9.4	175.9	0	0	0	0	0	115.9	A543	A543-G547 PolarHBondContact O-N 3.07Å
548	L	80.1	Confident	66.3	Low	22 Å²	22	83.2 Å²	83.2	12%	0.115	45%	0.445	C	S	.	.			trans	-100	-5.9	-170.7	-62.9	170.7	0	0	0	114.4	A474 Y485 A543 N546 N550 W551 L552	A474-L548 HydrophobicContact CB-CD1 3.78Å; A474-L548 HydrophobicContact CB-CD2 4.15Å; Y485-L548 HydrophobicContact CD2-CD1 4.1Å; Y485-L548 HydrophobicContact CE1-CD1 4.05Å; Y485-L548 HydrophobicContact CE2-CD1 3.59Å; A543-L548 HydrophobicContact CB-CB 4.04Å; A543-L548 WeakPolarHBondContact O-CA 3.5Å; A543-L548 PolarHBondContact O-N 3.46Å; N546-L548 HydrophobicContact CB-CD1 4.45Å; L548-N550 PolarHBondContact O-N 3.46Å; L548-W551 WeakPolarHBondContact O-CB 3.18Å; L548-W551 PolarHBondContact O-N 2.77Å; L548-L552 HydrophobicContact CB-CD1 4.19Å; L548-L552 PolarHBondContact O-N 3.08Å
549	S	75	Confident	63.2	Low	44 Å²	44	89.5 Å²	89.5	31%	0.308	48%	0.484	S	S	.	.	H	α-helix	trans	-50.9	-49.8	-176.6	45.6	0	0	0	0	113.4	A543 W551 L552 G553	A543-S549 PolarHBondContact O-N 3.42Å; A543-S549 VanDerWaalsContact O-N 3.14Å; S549-W551 VanDerWaalsContact C-N 3.27Å; S549-W551 PolarHBondContact O-N 3.42Å; S549-L552 PolarHBondContact O-N 2.98Å; S549-G553 PolarHBondContact O-N 2.93Å; S549-G553 VanDerWaalsContact O-N 3.07Å
550	N	66.4	Low	60.1	Low	144 Å²	144	91.4 Å²	91.4	77%	0.77	51%	0.506	S	S	*	.	H	α-helix	trans	-68.7	-23.1	-179.4	-66.9	-10.2	0	0	0	113.4	L548	L548-N550 PolarHBondContact O-N 3.46Å
551	W	68.4	Low	57.1	Low	133 Å²	133	95.8 Å²	95.8	50%	0.504	53%	0.532	S	S	.	.	H	α-helix	trans	-80.2	-24	176.7	-178.5	76.5	0	0	0	112.7	V472 A474 L548 S549	V472-W551 HydrophobicContact CB-CH2 3.88Å; V472-W551 HydrophobicContact CB-CZ3 4.03Å; V472-W551 HydrophobicContact CG1-CH2 4.19Å; V472-W551 HydrophobicContact CG2-CH2 3.92Å; V472-W551 HydrophobicContact CG2-CZ3 3.53Å; A474-W551 HydrophobicContact CB-CE3 4.47Å; A474-W551 HydrophobicContact CB-CH2 4.32Å; A474-W551 HydrophobicContact CB-CZ3 3.84Å; L548-W551 WeakPolarHBondContact O-CB 3.18Å; L548-W551 PolarHBondContact O-N 2.77Å; S549-W551 VanDerWaalsContact C-N 3.27Å; S549-W551 PolarHBondContact O-N 3.42Å
552	L	70.4	Confident	54.3	Low	13 Å²	13	96.9 Å²	96.9	7%	0.068	54%	0.542	C	S	.	.	H	α-helix	trans	-89.1	-30.8	176.4	-69.2	149.9	0	0	0	112	V472 K487 T503 A543 L548 S549	V472-L552 HydrophobicContact CG2-CD2 3.67Å; K487-L552 HydrophobicContact CB-CD2 3.83Å; K487-L552 HydrophobicContact CG-CD2 4.13Å; T503-L552 HydrophobicContact CG2-CB 4.17Å; A543-L552 HydrophobicContact CB-CD1 3.3Å; L548-L552 HydrophobicContact CB-CD1 4.19Å; L548-L552 PolarHBondContact O-N 3.08Å; S549-L552 PolarHBondContact O-N 2.98Å
553	G	53.2	Low	51.7	Low	53 Å²	53	104.5 Å²	104.5	55%	0.546	58%	0.581	S	S	.	*			trans	-88.2	98.7	177.2	0	0	0	0	0	113.2	S549	S549-G553 PolarHBondContact O-N 2.93Å; S549-G553 VanDerWaalsContact O-N 3.07Å
554	S	31.6	Very low	48.9	Very low	104 Å²	104	108.9 Å²	108.9	73%	0.727	62%	0.617	S	S	*	*			trans	-147.7	84.8	174.5	-75.7	0	0	0	0	113.4
555	Q	29.3	Very low	46.6	Very low	197 Å²	197	107.9 Å²	107.9	92%	0.921	62%	0.624	S	S	*	*			trans	58.5	130.9	163.6	-56.8	-159.5	12.9	0	0	120.5
556	T	26.4	Very low	44.3	Very low	113 Å²	113	106.5 Å²	106.5	69%	0.693	64%	0.636	S	S	*	*			trans	-123.1	130.4	159.1	48	0	0	0	0	108.7
557	P	28	Very low	42.2	Very low	128 Å²	128	111 Å²	111	83%	0.831	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-77.6	124.5	177.1	30.9	-32.9	0	0	0	111
558	T	26.8	Very low	39.7	Very low	135 Å²	135	113.6 Å²	113.6	83%	0.828	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-82	119.4	170.5	45.4	0	0	0	0	110.7
559	T	26.8	Very low	37.2	Very low	133 Å²	133	118.7 Å²	118.7	82%	0.816	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-76.7	117.5	172.6	29.3	0	0	0	0	111.5
560	S	27.4	Very low	35.1	Very low	96 Å²	96	123.1 Å²	123.1	67%	0.671	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-88.6	121.3	166.7	45.2	0	0	0	0	110.4	F562	S560-F562 PolarHBondContact O-N 2.7Å
561	N	28.1	Very low	33.6	Very low	154 Å²	154	121.4 Å²	121.4	82%	0.824	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-71.9	124.3	177	-71.7	-23.4	0	0	0	110.7
562	F	25.8	Very low	32	Very low	198 Å²	198	120.3 Å²	120.3	87%	0.868	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-88.1	128.7	167.1	-87.4	-92.3	0	0	0	110.5	S560	S560-F562 PolarHBondContact O-N 2.7Å
563	I	28	Very low	31	Very low	160 Å²	160	125.6 Å²	125.6	82%	0.821	78%	0.776	S	S	*	*			trans	-104.2	138.3	166.1	-63.6	176.8	0	0	0	107.6
564	A	25.4	Very low	29.6	Very low	92 Å²	92	128.9 Å²	128.9	76%	0.76	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-79.5	141.1	-172.5	0	0	0	0	0	113.2
565	P	29.3	Very low	29.3	Very low	125 Å²	125	134 Å²	134	81%	0.812	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-90.8	149.3	171.1	35.1	-32.9	0	0	0	112.8
566	S	25.6	Very low	29.1	Very low	117 Å²	117	130.3 Å²	130.3	82%	0.818	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-94.3	164.9	168.9	-55.9	0	0	0	0	111.3
567	P	36.5	Very low	29.2	Very low	117 Å²	117	133 Å²	133	76%	0.76	80%	0.796	S	S	*	*			trans	-94.4	176	-162.2	37.4	-37.4	0	0	0	115.9
568	S	25.5	Very low	29.2	Very low	107 Å²	107	133.7 Å²	133.7	75%	0.748	80%	0.797	S	S	*	*			trans	82.3	113.1	160	-54.5	0	0	0	0	118.8
569	T	27.2	Very low	29.1	Very low	130 Å²	130	130.1 Å²	130.1	80%	0.798	79%	0.787	S	S	*	*				-177.1	141.9	96	-68.6	0	0	0	0	111.1
570	V	31.1	Very low	29.1	Very low	137 Å²	137	135.8 Å²	135.8	83%	0.83	79%	0.794	S	S	*	*			trans	-127.9	128.7	173.7	167.5	0	0	0	0	107.4
571	P	34.6	Very low	29.2	Very low	108 Å²	108	136.7 Å²	136.7	70%	0.701	80%	0.796	S	S	*	*				-153.6	-165	112.9	39.5	-18.9	0	0	0	113
572	P	35.4	Very low	29.9	Very low	110 Å²	110	135.7 Å²	135.7	71%	0.714	80%	0.797	S	S	*	*				-126.7	176.9	-70.5	39.9	-24.6	0	0	0	112.7
573	P	48.3	Very low	30	Very low	123 Å²	123	130.6 Å²	130.6	80%	0.799	79%	0.786	S	S	*	*			trans	-88	170.4	179.9	36.3	-37	0	0	0	114.4
574	S	23.9	Very low	30.2	Very low	122 Å²	122	133.3 Å²	133.3	85%	0.853	79%	0.788	S	S	*	*			trans	-142.2	150.2	173	-78.2	0	0	0	0	113.5
575	Y	25.3	Very low	30.3	Very low	212 Å²	212	136.1 Å²	136.1	83%	0.831	79%	0.79	S	S	*	*			trans	-86.7	157.9	-173.9	-72.3	-117.9	0	0	0	113.1
576	S	26.9	Very low	30.3	Very low	120 Å²	120	132.8 Å²	132.8	84%	0.839	78%	0.778	S	S	*	*				166.1	158	100.5	53.6	0	0	0	0	116.5
577	H	27.9	Very low	30.4	Very low	170 Å²	170	136.1 Å²	136.1	79%	0.787	78%	0.781	S	S	*	*			trans	-74.6	-178.8	-164.7	-71.2	-87.1	0	0	0	119.1
578	V	27.4	Very low	30.9	Very low	141 Å²	141	135.9 Å²	135.9	86%	0.855	78%	0.78	S	S	*	*			trans	82.7	128.9	157	-161.6	0	0	0	0	115.7
579	G	25.5	Very low	32.6	Very low	61 Å²	61	136 Å²	136	63%	0.629	78%	0.777	S	S	*	*			cis	126	132.5	-10.3	0	0	0	0	0	115
580	R	27.3	Very low	33.6	Very low	251 Å²	251	135.8 Å²	135.8	95%	0.947	78%	0.779	S	S	*	*			trans	-172.2	141	159.8	-111.1	170	-163.3	-126.6	2.2	113.4
581	T	28.3	Very low	33.6	Very low	116 Å²	116	134.2 Å²	134.2	71%	0.712	77%	0.774	S	S	*	*			trans	-106.7	175.1	152.1	54	0	0	0	0	109
582	P	42.2	Very low	33.5	Very low	132 Å²	132	140.1 Å²	140.1	86%	0.857	78%	0.784	S	S	*	*				-137.4	-170.9	98.7	38.1	-24.7	0	0	0	113.9
583	S	28.3	Very low	33.4	Very low	91 Å²	91	140.3 Å²	140.3	64%	0.636	78%	0.778	S	S	*	*			trans	-139	-171.5	-159.3	-46.2	0	0	0	0	114.1
584	Y	33.3	Very low	32.7	Very low	217 Å²	217	141.6 Å²	141.6	85%	0.851	77%	0.773	S	S	*	*			trans	82.2	136	175.5	-63.3	-86	0	0	0	115.7
585	D	27.3	Very low	32.9	Very low	152 Å²	152	145 Å²	145	81%	0.813	77%	0.768	S	S	*	*			cis	-148.3	-165.6	-3.7	-147.4	41.2	0	0	0	109.9
586	G	29.2	Very low	33.3	Very low	55 Å²	55	142.1 Å²	142.1	57%	0.567	77%	0.767	S	S	*	*			cis	-176.2	-148.4	11.3	0	0	0	0	0	114.3
587	Q	26.8	Very low	33.3	Very low	186 Å²	186	140.3 Å²	140.3	87%	0.869	77%	0.767	S	S	*	*			trans	-154.2	171.7	-165.4	-94.9	-160.3	-3.7	0	0	114.3
588	P	47.9	Very low	33.4	Very low	113 Å²	113	136 Å²	136	73%	0.734	77%	0.768	S	S	*	*			cis	-135.2	-119	-29.9	43.9	-22.5	0	0	0	113.2
589	P	61.8	Low	33.5	Very low	108 Å²	108	133.9 Å²	133.9	70%	0.701	77%	0.766	S	S	*	*			trans	-120.6	-172.6	-166.1	43.7	-23.2	0	0	0	116.4
590	P	47.3	Very low	33.8	Very low	127 Å²	127	137.2 Å²	137.2	83%	0.825	78%	0.779	S	S	*	*				-150.2	-174.3	104.7	41.5	-24.2	0	0	0	116.9
591	S	31.1	Very low	34	Very low	104 Å²	104	129.3 Å²	129.3	73%	0.727	78%	0.776	S	S	*	*			trans	-114.9	173.6	-172	-35.7	0	0	0	0	114.1
592	Y	31.6	Very low	34.1	Very low	232 Å²	232	129.3 Å²	129.3	91%	0.91	79%	0.788	S	S	*	*			trans	169.5	163.6	143	-83.3	-63.5	0	0	0	110.2
593	N	34.3	Very low	33.4	Very low	113 Å²	113	126.8 Å²	126.8	60%	0.604	79%	0.786	S	S	*	*			cis	-171.2	165.5	-48.8	-167.6	8.2	0	0	0	111.4
594	H	33.3	Very low	33.5	Very low	150 Å²	150	126.4 Å²	126.4	69%	0.694	80%	0.796	S	S	*	*			trans	70.3	159.4	158.9	-73.3	-20.9	0	0	0	120.7
595	R	28.5	Very low	33.5	Very low	195 Å²	195	121 Å²	121	74%	0.736	79%	0.79	S	S	*	*			cis	-176.3	150.1	-21.4	177.4	178	-173.4	-170.6	3.7	111.6
596	N	32.5	Very low	33.7	Very low	151 Å²	151	119.6 Å²	119.6	81%	0.807	79%	0.792	S	S	*	*			trans	33.8	140.8	161.7	-65.5	21.6	0	0	0	123.5
597	G	28.6	Very low	33.8	Very low	82 Å²	82	120.5 Å²	120.5	85%	0.845	80%	0.801	S	S	*	*			trans	169.3	157.4	156.5	0	0	0	0	0	112.9
598	G	28.3	Very low	34.2	Very low	78 Å²	78	122.6 Å²	122.6	80%	0.804	80%	0.801	S	S	*	*			trans	178.7	-170	175.8	0	0	0	0	0	116.7
599	A	31.1	Very low	33.4	Very low	98 Å²	98	123.9 Å²	123.9	81%	0.81	80%	0.802	S	S	*	*			trans	84.5	142.9	173.8	0	0	0	0	0	119.9
600	S	31.5	Very low	31.9	Very low	130 Å²	130	123.7 Å²	123.7	91%	0.909	80%	0.803	S	S	*	*			trans	72	137.6	151.8	-57.2	0	0	0	0	121.5
601	G	30.4	Very low	31.2	Very low	86 Å²	86	122.1 Å²	122.1	89%	0.887	80%	0.801	S	S	*	*			trans	149.6	116.6	161.1	0	0	0	0	0	114.3
602	A	31.1	Very low	31.1	Very low	115 Å²	115	126.7 Å²	126.7	95%	0.95	81%	0.808	S	S	*	*			trans	-123.5	159.4	176.6	0	0	0	0	0	111.6
603	G	28	Very low	31	Very low	80 Å²	80	122.1 Å²	122.1	83%	0.825	80%	0.804	S	S	*	*			trans	172.3	132	170.9	0	0	0	0	0	114.6
604	G	29.8	Very low	30.7	Very low	82 Å²	82	120.9 Å²	120.9	85%	0.845	81%	0.81	S	S	*	*			trans	-102.2	-148.5	166.7	0	0	0	0	0	111.3
605	S	32.9	Very low	31.2	Very low	105 Å²	105	118.7 Å²	118.7	73%	0.734	81%	0.809	S	S	*	*			cis	-170.5	177.7	-0.3	67	0	0	0	0	110.2
606	S	31.9	Very low	31.1	Very low	121 Å²	121	117.2 Å²	117.2	85%	0.846	81%	0.814	S	S	*	*			trans	72.8	142.6	163.5	-51.1	0	0	0	0	116.8
607	G	31.8	Very low	30.8	Very low	74 Å²	74	114.4 Å²	114.4	76%	0.763	81%	0.807	S	S	*	*			cis	-175.8	-163.1	-1	0	0	0	0	0	109.2
608	R	33.7	Very low	30.7	Very low	230 Å²	230	117.6 Å²	117.6	87%	0.868	80%	0.804	S	S	*	*			cis	-170.6	172.4	-5.8	-145.6	-175.9	-169.8	-175.9	3	109.3
609	N	31.1	Very low	30.5	Very low	141 Å²	141	119 Å²	119	75%	0.754	80%	0.802	S	S	*	*			trans	73.7	145.3	164.1	-55.5	-6.6	0	0	0	117.8
610	S	31	Very low	30.3	Very low	103 Å²	103	119 Å²	119	72%	0.72	80%	0.796	S	S	*	*			cis	-172.8	142.1	-14.7	49.6	0	0	0	0	113.8
611	A	32.3	Very low	30.1	Very low	94 Å²	94	117.4 Å²	117.4	78%	0.777	79%	0.785	S	S	*	*			trans	55.2	151.6	139.4	0	0	0	0	0	122.8
612	F	29.7	Very low	29.8	Very low	200 Å²	200	121 Å²	121	88%	0.877	78%	0.784	S	S	*	*			cis	-173.9	173.8	-27.5	-141.3	-86.1	0	0	0	109.4
613	V	29.6	Very low	29.5	Very low	137 Å²	137	119.9 Å²	119.9	83%	0.83	77%	0.774	S	S	*	*			trans	88.5	149.6	164.1	-162.6	0	0	0	0	118.4
614	A	26.9	Very low	29.3	Very low	87 Å²	87	121.6 Å²	121.6	72%	0.719	77%	0.773	S	S	*	*			trans	-136.7	-142.4	-176.2	0	0	0	0	0	109
615	P	45.5	Very low	29.1	Very low	104 Å²	104	123 Å²	123	68%	0.675	77%	0.771	S	S	*	*			cis	-144.1	-169.5	-7.6	45.1	-25.2	0	0	0	116.8
616	L	25.8	Very low	28.7	Very low	163 Å²	163	123.5 Å²	123.5	85%	0.853	77%	0.774	S	S	*	*			trans	70.8	154.1	157.7	-63.7	173.9	0	0	0	119.2
617	S	26.5	Very low	28.6	Very low	93 Å²	93	125.4 Å²	125.4	65%	0.65	77%	0.769	S	S	*	*			cis	-169.3	158.9	-15.6	50.5	0	0	0	0	115.4
618	N	25.1	Very low	28.2	Very low	148 Å²	148	128.2 Å²	128.2	79%	0.791	76%	0.764	S	S	*	*			trans	69.5	141.6	145.5	-87.1	12.1	0	0	0	126
619	S	25.7	Very low	27.7	Very low	107 Å²	107	123.3 Å²	123.3	75%	0.748	75%	0.751	S	S	*	*			trans	70.2	157.2	144.1	-64.5	0	0	0	0	121.1
620	S	25.7	Very low	27.5	Very low	98 Å²	98	123.6 Å²	123.6	69%	0.685	75%	0.748	S	S	*	*			cis	-170.9	170.2	-27	59	0	0	0	0	112.2
621	S	28.1	Very low	27.3	Very low	97 Å²	97	125.7 Å²	125.7	68%	0.678	75%	0.746	S	S	*	*			trans	62.4	113.5	145.2	56.4	0	0	0	0	123.8
622	N	24.2	Very low	26.9	Very low	163 Å²	163	130.9 Å²	130.9	87%	0.872	75%	0.747	S	S	*	*				38.1	145	123.5	-63.3	0.1	0	0	0	124.2
623	A	24.6	Very low	26.8	Very low	90 Å²	90	125 Å²	125	74%	0.744	74%	0.736	S	S	*	*				122.7	112.4	126.4	0	0	0	0	0	120.3
624	S	24.1	Very low	26.7	Very low	116 Å²	116	126.4 Å²	126.4	81%	0.811	73%	0.733	S	S	*	*				76.8	112.3	122.1	-59.5	0	0	0	0	124.8
625	S	23.9	Very low	26.9	Very low	112 Å²	112	128.8 Å²	128.8	78%	0.783	73%	0.729	S	S	*	*				87.5	161.6	118.9	-154.4	0	0	0	0	122.4
626	S	26.4	Very low	26.2	Very low	116 Å²	116	129 Å²	129	81%	0.811	72%	0.724	S	S	*	*			trans	75.6	159.8	171.4	74.3	0	0	0	0	119.5
627	H	28.2	Very low	26.3	Very low	160 Å²	160	130 Å²	130	74%	0.741	73%	0.726	S	S	*	*				177.8	135.8	-64.3	169.9	70.2	0	0	0	110.6
628	M	23.4	Very low	26.4	Very low	133 Å²	133	132.9 Å²	132.9	66%	0.655	73%	0.732	S	S	*	*			trans	62.6	165.9	-177.1	-58.2	-164	-66.9	0	0	115.2
629	Q	24.5	Very low	26.5	Very low	127 Å²	127	134.9 Å²	134.9	59%	0.593	74%	0.736	S	S	*	*			cis	-155.4	150.7	13.2	-163.4	109.6	18.7	0	0	112.3
630	Q	27.1	Very low	26.7	Very low	147 Å²	147	136.3 Å²	136.3	69%	0.687	74%	0.735	S	S	*	*			trans	56.7	123.8	147.2	-83.3	157.5	9.2	0	0	122.2
631	H	25.9	Very low	26.6	Very low	147 Å²	147	134.5 Å²	134.5	68%	0.681	73%	0.732	S	S	*	*				68.1	138.8	89.9	-84.8	-105.6	0	0	0	115.3
632	Y	23.9	Very low	26.6	Very low	203 Å²	203	136.4 Å²	136.4	80%	0.796	74%	0.735	S	S	*	*			cis	-129	172.9	0	-82.7	-86.2	0	0	0	108.5
633	A	26.7	Very low	26.9	Very low	78 Å²	78	135.5 Å²	135.5	65%	0.645	73%	0.729	S	S	*	*			cis	61.6	147.6	48.6	0	0	0	0	0	114.4
634	H	28.7	Very low	27	Very low	165 Å²	165	136.2 Å²	136.2	76%	0.764	73%	0.729	S	S	*	*			cis	-160.9	-172.2	2.8	-142.5	177.2	0	0	0	108.4
635	H	31.4	Very low	27.2	Very low	137 Å²	137	135.4 Å²	135.4	63%	0.634	73%	0.729	S	S	*	*			cis	-156.4	-150.8	7.1	-163.9	39.8	0	0	0	111.8
636	N	30.5	Very low	27.4	Very low	109 Å²	109	134.5 Å²	134.5	58%	0.583	73%	0.728	S	S	*	*			trans	-101.2	170.9	-174.6	-59	-51.2	0	0	0	115.4
637	M	27.6	Very low	28.2	Very low	183 Å²	183	135.6 Å²	135.6	90%	0.901	73%	0.732	S	S	*	*				-146.6	141.8	120.1	-81.3	-146.5	174.2	0	0	109.6
638	M	29.4	Very low	28.1	Very low	155 Å²	155	131.9 Å²	131.9	76%	0.764	74%	0.737	S	S	*	*			cis	85.6	122.9	35.2	-75.4	-73	-174.3	0	0	115.6
639	H	27.5	Very low	28.2	Very low	189 Å²	189	130.1 Å²	130.1	88%	0.875	74%	0.744	S	S	*	*			trans	-145.5	142.1	150.4	-142.9	-57.8	0	0	0	109.2
640	N	28.1	Very low	29.1	Very low	137 Å²	137	130.1 Å²	130.1	73%	0.733	76%	0.755	S	S	*	*			trans	-140.4	167	-175.4	-162.5	6.9	0	0	0	110.6
641	G	24.8	Very low	29	Very low	60 Å²	60	127.9 Å²	127.9	62%	0.619	76%	0.762	S	S	*	*			trans	-158.7	150.2	-176.7	0	0	0	0	0	114.6
642	N	28.3	Very low	29	Very low	138 Å²	138	124.9 Å²	124.9	74%	0.738	77%	0.77	S	S	*	*			trans	-160.3	171.3	-165.3	-97.5	-51.8	0	0	0	110.1
643	L	29.8	Very low	29.2	Very low	143 Å²	143	122.3 Å²	122.3	75%	0.749	77%	0.77	S	S	*	*			cis	-159.4	-176.4	7.2	-132.4	177.1	0	0	0	109.6
644	S	27.4	Very low	29.8	Very low	106 Å²	106	123.4 Å²	123.4	74%	0.741	77%	0.771	S	S	*	*			trans	74.5	152.6	153.2	-66.8	0	0	0	0	119
645	A	27.7	Very low	29.6	Very low	98 Å²	98	124.8 Å²	124.8	81%	0.81	78%	0.775	S	S	*	*			cis	-161.2	174.9	-14.2	0	0	0	0	0	110.9
646	A	28.9	Very low	29.3	Very low	94 Å²	94	126.8 Å²	126.8	78%	0.777	78%	0.784	S	S	*	*			trans	-114	169.5	178.1	0	0	0	0	0	112.3
647	P	42.6	Very low	29	Very low	138 Å²	138	130.3 Å²	130.3	90%	0.896	79%	0.79	S	S	*	*				-154	171.1	86.9	40.7	-22.4	0	0	0	117.1
648	G	26.4	Very low	28.8	Very low	82 Å²	82	130.5 Å²	130.5	85%	0.845	78%	0.781	S	S	*	*			trans	156.4	119.6	162.1	0	0	0	0	0	116.9
649	A	25.9	Very low	28.5	Very low	97 Å²	97	127.7 Å²	127.7	80%	0.802	78%	0.777	S	S	*	*			trans	-153.6	173.6	175.2	0	0	0	0	0	108.2
650	P	41.6	Very low	28.4	Very low	127 Å²	127	123.7 Å²	123.7	83%	0.825	77%	0.77	S	S	*	*			cis	-129.7	-156.9	14.9	44.7	-25.4	0	0	0	112.2
651	A	26.7	Very low	28.1	Very low	100 Å²	100	122.7 Å²	122.7	83%	0.826	77%	0.774	S	S	*	*			cis	-153.4	163.2	3.7	0	0	0	0	0	110.4
652	G	25.8	Very low	28.3	Very low	83 Å²	83	124.2 Å²	124.2	86%	0.856	78%	0.78	S	S	*	*			trans	169.7	13.3	172.5	0	0	0	0	0	121.9
653	D	27.2	Very low	28.2	Very low	149 Å²	149	122.8 Å²	122.8	80%	0.797	78%	0.781	S	S	*	*			trans	-81.4	170.4	173.4	-108.6	-41.7	0	0	0	111.8
654	P	38.5	Very low	28	Very low	102 Å²	102	122.2 Å²	122.2	66%	0.662	78%	0.779	S	S	*	*			cis	-141.9	165.2	22.1	37.8	-17.1	0	0	0	118.9
655	K	25.5	Very low	28	Very low	193 Å²	193	125.6 Å²	125.6	84%	0.839	79%	0.788	S	S	*	*				172.3	135.9	113	-93	164.4	-174.7	177.4	0	114.8
656	H	25.2	Very low	28.1	Very low	179 Å²	179	128.2 Å²	128.2	83%	0.829	78%	0.783	S	S	*	*			trans	-97.6	160.7	168.1	-49.3	-82.1	0	0	0	111.6
657	Y	24.7	Very low	28.1	Very low	183 Å²	183	131.6 Å²	131.6	72%	0.718	78%	0.783	S	S	*	*				-179.2	148.9	100.4	-138.5	-134.2	0	0	0	114.6
658	R	22.1	Very low	27.2	Very low	188 Å²	188	132.2 Å²	132.2	71%	0.709	78%	0.778	S	S	*	*			trans	39.1	116.1	152.2	-82.8	-170.6	-168.7	175.2	6	123.6
659	S	24.6	Very low	27.5	Very low	96 Å²	96	133.2 Å²	133.2	67%	0.671	77%	0.77	S	S	*	*				43.7	147.9	115.8	70.2	0	0	0	0	123.8
660	S	23.7	Very low	27.5	Very low	105 Å²	105	136.1 Å²	136.1	73%	0.734	77%	0.772	S	S	*	*			trans	122.5	131.6	138.9	-61.5	0	0	0	0	116.6
661	S	22.6	Very low	26.9	Very low	115 Å²	115	134.7 Å²	134.7	80%	0.804	77%	0.771	S	S	*	*			trans	61.1	142	161.1	-53.9	0	0	0	0	118
662	A	29.9	Very low	26.7	Very low	92 Å²	92	134.9 Å²	134.9	76%	0.76	77%	0.766	S	S	*	*			cis	76.6	148.5	34	0	0	0	0	0	114.1
663	S	25.8	Very low	26.7	Very low	108 Å²	108	140.1 Å²	140.1	76%	0.755	77%	0.766	S	S	*	*			trans	71	139.4	-164.9	-77.7	0	0	0	0	115.4
664	D	26.1	Very low	26.5	Very low	132 Å²	132	138.4 Å²	138.4	71%	0.706	77%	0.765	S	S	*	*			cis	-146.5	155.7	-7.8	-83.5	-34.4	0	0	0	110.6
665	L	27.2	Very low	26.1	Very low	177 Å²	177	141.9 Å²	141.9	93%	0.927	77%	0.773	S	S	*	*			trans	-139.1	108.5	163	-108.5	170.3	0	0	0	109.2
666	Q	29.3	Very low	25.9	Very low	152 Å²	152	138.2 Å²	138.2	71%	0.71	77%	0.772	S	S	*	*			trans	-88.4	131.9	-179.8	-69.9	-179.1	-16.1	0	0	111
667	H	28	Very low	25.9	Very low	166 Å²	166	134.6 Å²	134.6	77%	0.769	77%	0.767	S	S	*	*			trans	-72.6	152.3	166.6	-91.7	-2.4	0	0	0	111.3	R251	R251-H667 VanDerWaalsContact CZ-NE2 3.28Å; R251-H667 PolarHBondContact NH2-NE2 3.02Å
668	D	24.6	Very low	25.9	Very low	150 Å²	150	134.9 Å²	134.9	80%	0.802	78%	0.777	S	S	*	*			trans	-136.6	116.1	162.7	-139.1	-23.6	0	0	0	108.2
669	P	32.2	Very low	26.2	Very low	103 Å²	103	132.9 Å²	132.9	67%	0.669	79%	0.785	S	S	*	*			trans	-101.4	113.1	-167.8	35	-31.1	0	0	0	113.6
670	N	27	Very low	26.2	Very low	159 Å²	159	132.1 Å²	132.1	85%	0.85	79%	0.793	S	S	*	*			trans	-173.4	124	147	-100.4	-43.3	0	0	0	111.7
671	A	27.6	Very low	26.2	Very low	97 Å²	97	132.4 Å²	132.4	80%	0.802	80%	0.795	S	S	*	*			trans	-153	75.7	172.2	0	0	0	0	0	110.7	F673	A671-F673 PolarHBondContact O-N 2.63Å
672	S	23.9	Very low	26.8	Very low	103 Å²	103	131.1 Å²	131.1	72%	0.72	79%	0.791	S	S	*	*			trans	-74.2	114.8	173	-66.6	0	0	0	0	110.3
673	F	24.6	Very low	26.7	Very low	193 Å²	193	136.4 Å²	136.4	85%	0.846	79%	0.791	S	S	*	*			trans	-101.6	105.6	176.3	-132.4	-77	0	0	0	111.1	A671	A671-F673 PolarHBondContact O-N 2.63Å
674	S	23.9	Very low	27.1	Very low	113 Å²	113	136.5 Å²	136.5	79%	0.79	79%	0.792	S	S	*	*			trans	-74.2	124.9	179.5	-57.8	0	0	0	0	111.7
675	Q	28.5	Very low	27.7	Very low	175 Å²	175	132.5 Å²	132.5	82%	0.818	77%	0.774	S	S	*	*			trans	-134.2	124.4	159.8	-72.3	-163	24.3	0	0	111.4
676	S	22.6	Very low	28.3	Very low	117 Å²	117	127.6 Å²	127.6	82%	0.818	75%	0.752	S	S	*	*			trans	-136.6	148.5	168.4	-71.2	0	0	0	0	108
677	S	25.2	Very low	28.6	Very low	103 Å²	103	125 Å²	125	72%	0.72	74%	0.738	S	S	*	*			trans	79.2	74.2	175.5	-46.9	0	0	0	0	117.4
678	M	24.5	Very low	29	Very low	189 Å²	189	121.4 Å²	121.4	93%	0.931	73%	0.725	S	S	*	*			trans	-134.2	74.2	150.1	-88	-69.9	104.6	0	0	110.5
679	T	27.6	Very low	29.7	Very low	145 Å²	145	120 Å²	120	89%	0.89	71%	0.711	S	S	*	*			trans	-90	120.4	169.1	49.5	0	0	0	0	110.3
680	G	25.5	Very low	30.3	Very low	80 Å²	80	115.5 Å²	115.5	83%	0.825	68%	0.681	S	S	*	*			trans	103.1	72.6	162.9	0	0	0	0	0	117.2
681	S	24.1	Very low	31.2	Very low	112 Å²	112	108.7 Å²	108.7	78%	0.783	65%	0.646	S	S	*	*				-161.1	148.7	119.6	-162.2	0	0	0	0	109.7	R683	S681-R683 PolarHBondContact O-N 3.38Å; S681-R683 VanDerWaalsContact O-N 3.16Å
682	A	33.5	Very low	32.1	Very low	87 Å²	87	104.2 Å²	104.2	72%	0.719	61%	0.609	S	S	*	*			trans	-75.5	104.1	-171.8	0	0	0	0	0	111.9
683	R	29.7	Very low	33.2	Very low	204 Å²	204	100.5 Å²	100.5	77%	0.77	58%	0.58	S	S	*	*			trans	-105	100.6	165.8	-59.5	-178.9	77.2	-166.5	2.8	107.7	S681 S685	S681-R683 PolarHBondContact O-N 3.38Å; S681-R683 VanDerWaalsContact O-N 3.16Å; R683-S685 PolarHBondContact O-N 3.34Å
684	S	34.1	Very low	34.4	Very low	109 Å²	109	91.8 Å²	91.8	76%	0.762	54%	0.542	S	S	*	.			trans	-72.1	96.9	174.2	-172.2	0	0	0	0	108.8
685	S	38.3	Very low	35.5	Very low	49 Å²	49	91.3 Å²	91.3	34%	0.343	52%	0.522	S	S	.	.			trans	-86.5	160.7	177.7	77.4	0	0	0	0	110.5	R683 F687 D688	R683-S685 PolarHBondContact O-N 3.34Å; S685-F687 PolarHBondContact O-N 2.97Å; S685-F687 PolarHBondContact OG-N 3.18Å; S685-D688 WeakPolarHBondContact CA-OD2 3.49Å; S685-D688 VanDerWaalsContact CB-OD2 3.31Å; S685-D688 WeakPolarHBondContact CB-OD2 3.5Å; S685-D688 PolarHBondContact N-OD2 3.39Å; S685-D688 PolarHBondContact O-N 2.99Å; S685-D688 PolarHBondContact OG-N 2.59Å; S685-D688 PolarHBondContact OG-OD2 3.29Å
686	V	38.8	Very low	36.4	Very low	74 Å²	74	86.2 Å²	86.2	45%	0.448	50%	0.499	S	S	.	.	G	3₁₀ helix	trans	-61.6	-26.6	170.7	-177.6	0	0	0	0	110.9	L354 D688 K689	L354-V686 HydrophobicContact CD1-CB 4.25Å; L354-V686 HydrophobicContact CD1-CG1 3.74Å; L354-V686 HydrophobicContact CD1-CG2 3.58Å; V686-D688 PolarHBondContact O-N 3.37Å; V686-K689 PolarHBondContact O-N 3.43Å
687	F	36.9	Very low	37.3	Very low	98 Å²	98	82.9 Å²	82.9	43%	0.43	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-70.1	-28.5	179.3	-72	-102.2	0	0	0	113.2	C264 S685 K689 L690	C264-F687 HydrophobicContact CB-CE1 4.44Å; S685-F687 PolarHBondContact O-N 2.97Å; S685-F687 PolarHBondContact OG-N 3.18Å; F687-K689 PolarHBondContact O-N 3.18Å; F687-K689 VanDerWaalsContact O-N 3.08Å; F687-L690 HydrophobicContact CB-CD1 4.09Å; F687-L690 HydrophobicContact CD1-CD1 3.39Å; F687-L690 HydrophobicContact CE1-CD1 3.99Å; F687-L690 HydrophobicContact CG-CD1 3.89Å; F687-L690 WeakPolarHBondContact O-CB 3.35Å; F687-L690 PolarHBondContact O-N 2.95Å; F687-L690 VanDerWaalsContact O-N 3.1Å
688	D	36.3	Very low	38	Very low	90 Å²	90	83.3 Å²	83.3	48%	0.481	47%	0.474	S	S	.	.	G	3₁₀ helix	trans	-66.2	-12	177.1	-59.3	-68.5	0	0	0	113	S685 V686 R695	S685-D688 WeakPolarHBondContact CA-OD2 3.49Å; S685-D688 VanDerWaalsContact CB-OD2 3.31Å; S685-D688 WeakPolarHBondContact CB-OD2 3.5Å; S685-D688 PolarHBondContact N-OD2 3.39Å; S685-D688 PolarHBondContact O-N 2.99Å; S685-D688 PolarHBondContact OG-N 2.59Å; S685-D688 PolarHBondContact OG-OD2 3.29Å; V686-D688 PolarHBondContact O-N 3.37Å; D688-R695 PolarHBondContact O-NE 3.36Å
689	K	39.8	Very low	38.6	Very low	120 Å²	120	82.3 Å²	82.3	52%	0.522	46%	0.46	S	S	.	.	G	3₁₀ helix	trans	-104.8	-5.3	176.1	-64.1	-176.8	-179.5	178.1	0	114.3	V686 F687	V686-K689 PolarHBondContact O-N 3.43Å; F687-K689 PolarHBondContact O-N 3.18Å; F687-K689 VanDerWaalsContact O-N 3.08Å
690	L	43.9	Very low	38.8	Very low	8 Å²	8	77.6 Å²	77.6	4%	0.042	43%	0.431	C	S	.	.	S	Bend	trans	-68	152.3	169.2	-76.4	163.2	0	0	0	110.2	L351 F687 Y694 R695	L351-L690 HydrophobicContact CD1-CD2 4.02Å; L351-L690 HydrophobicContact CD2-CD2 3.62Å; L351-L690 HydrophobicContact CD2-CG 4.13Å; L351-L690 HydrophobicContact CG-CD2 4.01Å; F687-L690 HydrophobicContact CB-CD1 4.09Å; F687-L690 HydrophobicContact CD1-CD1 3.39Å; F687-L690 HydrophobicContact CE1-CD1 3.99Å; F687-L690 HydrophobicContact CG-CD1 3.89Å; F687-L690 WeakPolarHBondContact O-CB 3.35Å; F687-L690 PolarHBondContact O-N 2.95Å; F687-L690 VanDerWaalsContact O-N 3.1Å; L690-Y694 HydrophobicContact CD2-CD2 4.15Å; L690-Y694 HydrophobicContact CD2-CG 4.2Å; L690-R695 HydrophobicContact CB-CG 4.33Å; L690-R695 WeakPolarHBondContact O-CG 3.47Å; L690-R695 PolarHBondContact O-NE 2.99Å; L690-R695 PolarHBondContact O-NH2 3.13Å
691	P	46	Very low	39.2	Very low	17 Å²	17	80.1 Å²	80.1	11%	0.11	43%	0.431	C	S	.	.			trans	-55.4	153.9	163.4	-28.5	35.5	0	0	0	114.2	D337 H693 Y694 R695	D337-P691 WeakPolarHBondContact OD2-CA 3.44Å; P691-H693 WeakPolarHBondContact CB-CE1 3.44Å; P691-H693 PolarHBondContact O-N 2.86Å; P691-H693 VanDerWaalsContact O-N 3.14Å; P691-Y694 HydrophobicContact CB-CD2 4.45Å; P691-Y694 HydrophobicContact CG-CD2 4.4Å; P691-Y694 WeakPolarHBondContact O-CA 3.29Å; P691-Y694 PolarHBondContact O-N 3.01Å; P691-R695 PolarHBondContact O-N 2.78Å; P691-R695 VanDerWaalsContact O-N 3.11Å
692	S	46.1	Very low	39.5	Very low	3 Å²	3	78.1 Å²	78.1	2%	0.021	41%	0.414	C	S	.	.	H	α-helix	trans	-51.5	-37	-179.9	60.7	0	0	0	0	114.4	L333 D337 Y694 R695 H696	L333-S692 WeakPolarHBondContact O-CB 3.44Å; L333-S692 PolarHBondContact O-OG 2.81Å; D337-S692 VanDerWaalsContact CG-CB 3.49Å; D337-S692 PolarHBondContact OD2-N 3.33Å; S692-Y694 PolarHBondContact O-N 3.21Å; S692-R695 PolarHBondContact O-N 3.37Å; S692-R695 VanDerWaalsContact O-N 3.13Å; S692-H696 PolarHBondContact O-N 3.3Å; S692-H696 PolarHBondContact O-ND1 3.07Å
693	H	48.5	Very low	39.3	Very low	24 Å²	24	81.6 Å²	81.6	11%	0.111	42%	0.419	C	S	.	.	H	α-helix	trans	-63.1	-20.3	176.6	55.9	-105.4	0	0	0	113.6	K292 Q339 P691	K292-H693 WeakPolarHBondContact CD-O 3.3Å; K292-H693 WeakPolarHBondContact CE-O 3.47Å; Q339-H693 PolarHBondContact OE1-CE1 3.37Å; Q339-H693 PolarHBondContact OE1-ND1 2.59Å; Q339-H693 VanDerWaalsContact OE1-ND1 3.08Å; P691-H693 WeakPolarHBondContact CB-CE1 3.44Å; P691-H693 PolarHBondContact O-N 2.86Å; P691-H693 VanDerWaalsContact O-N 3.14Å
694	Y	49.5	Very low	39.1	Very low	11 Å²	11	79.1 Å²	79.1	4%	0.043	42%	0.416	C	S	.	.	H	α-helix	trans	-100.7	-20.9	171.5	-69	-59.3	0	0	0	113.9	H214 C264 H265 L349 L690 P691 S692	H214-Y694 PolarHBondContact CE1-OH 3.46Å; H214-Y694 PolarHBondContact ND1-OH 3.37Å; C264-Y694 WeakPolarHBondContact O-CD1 3.46Å; H265-Y694 AromaticContact ND1-CE1 3.72Å; L349-Y694 HydrophobicContact CD1-CE2 4.16Å; L690-Y694 HydrophobicContact CD2-CD2 4.15Å; L690-Y694 HydrophobicContact CD2-CG 4.2Å; P691-Y694 HydrophobicContact CB-CD2 4.45Å; P691-Y694 HydrophobicContact CG-CD2 4.4Å; P691-Y694 WeakPolarHBondContact O-CA 3.29Å; P691-Y694 PolarHBondContact O-N 3.01Å; S692-Y694 PolarHBondContact O-N 3.21Å
695	R	46.4	Very low	39	Very low	102 Å²	102	79.5 Å²	79.5	39%	0.385	42%	0.416	S	S	.	.	H	α-helix	trans	-70.7	-32.5	177.5	-62.5	-165.9	-160.2	115.9	23.7	113.9	D337 D688 L690 P691 S692 S697	D337-R695 IonicContact OD1-CZ 3.66Å; D337-R695 IonicContact OD1-NH1 3.59Å; D337-R695 PolarHBondContact OD1-NH1 3.03Å; D337-R695 IonicContact OD1-NH2 3.55Å; D337-R695 IonicContact OD2-CZ 2.67Å; D337-R695 IonicContact OD2-NH1 2.69Å; D337-R695 PolarHBondContact OD2-NH1 3.38Å; D337-R695 IonicContact OD2-NH2 3.42Å; D337-R695 PolarHBondContact OD2-NH2 2.85Å; D688-R695 PolarHBondContact O-NE 3.36Å; L690-R695 HydrophobicContact CB-CG 4.33Å; L690-R695 WeakPolarHBondContact O-CG 3.47Å; L690-R695 PolarHBondContact O-NE 2.99Å; L690-R695 PolarHBondContact O-NH2 3.13Å; P691-R695 PolarHBondContact O-N 2.78Å; P691-R695 VanDerWaalsContact O-N 3.11Å; S692-R695 PolarHBondContact O-N 3.37Å; S692-R695 VanDerWaalsContact O-N 3.13Å; R695-S697 PolarHBondContact O-N 3.24Å
696	H	47.9	Very low	38.5	Very low	69 Å²	69	83.8 Å²	83.8	32%	0.319	44%	0.44	S	S	.	.			trans	-98.7	74.9	-166.8	-60.4	95.8	0	0	0	114	K292 S692 T698	K292-H696 WeakPolarHBondContact CE-O 3.42Å; S692-H696 PolarHBondContact O-N 3.3Å; S692-H696 PolarHBondContact O-ND1 3.07Å; H696-T698 VanDerWaalsContact C-N 3.26Å
697	S	41.7	Very low	37.8	Very low	47 Å²	47	91.4 Å²	91.4	33%	0.329	46%	0.461	S	S	.	.			trans	-81.1	1.5	168.3	-106.2	0	0	0	0	114.4	E263 R695 R699	E263-S697 WeakPolarHBondContact OE1-CB 3.32Å; E263-S697 PolarHBondContact OE1-OG 3.33Å; R695-S697 PolarHBondContact O-N 3.24Å; S697-R699 PolarHBondContact O-N 3.34Å
698	T	38.8	Very low	37.5	Very low	112 Å²	112	92.3 Å²	92.3	69%	0.687	48%	0.476	S	S	*	.	S	Bend	trans	-81	104.2	175.3	51.9	0	0	0	0	111	H696	H696-T698 VanDerWaalsContact C-N 3.26Å
699	R	37.3	Very low	37.1	Very low	167 Å²	167	93.4 Å²	93.4	63%	0.63	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-52.8	123.6	174.7	-172.1	-177.2	-171	-165.9	2.3	110.9	S288 Y291 S697	S288-R699 PolarHBondContact OG-NH2 2.61Å; Y291-R699 HydrophobicContact CE1-CG 4.42Å; S697-R699 PolarHBondContact O-N 3.34Å
700	P	32.6	Very low	36.6	Very low	46 Å²	46	92.2 Å²	92.2	30%	0.299	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-72.6	143.8	-179.3	28.9	-34.3	0	0	0	112.1	Y291 V702	Y291-P700 HydrophobicContact CG-CG 4.13Å; P700-V702 PolarHBondContact O-N 2.89Å
701	T	32.2	Very low	35.9	Very low	133 Å²	133	100.9 Å²	100.9	82%	0.816	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-67.7	120.6	174.7	-48.6	0	0	0	0	110.5	I703	T701-I703 PolarHBondContact O-N 3.1Å
702	V	31.1	Very low	34.9	Very low	70 Å²	70	105.6 Å²	105.6	42%	0.424	58%	0.578	S	S	.	*			trans	-68.4	113.3	-179.5	-179.9	0	0	0	0	110.5	P700	P700-V702 PolarHBondContact O-N 2.89Å
703	I	30.4	Very low	34.4	Very low	160 Å²	160	111.4 Å²	111.4	82%	0.821	62%	0.615	S	S	*	*			trans	-86.1	110.1	169.3	-58.1	176.7	0	0	0	107.8	T701	T701-I703 PolarHBondContact O-N 3.1Å
704	Q	25.6	Very low	33.4	Very low	153 Å²	153	116.1 Å²	116.1	72%	0.715	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-67.9	138.4	175.3	-68.3	-173	-0.6	0	0	111.2
705	P	30.5	Very low	32.3	Very low	117 Å²	117	120.1 Å²	120.1	76%	0.76	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-68.7	135.3	168.5	29.2	-33.3	0	0	0	110.4	R707	P705-R707 PolarHBondContact O-N 2.76Å
706	T	27.7	Very low	31.5	Very low	139 Å²	139	123 Å²	123	85%	0.853	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-66.1	121.9	-179	49.8	0	0	0	0	112.2
707	R	25.7	Very low	30.6	Very low	234 Å²	234	131.8 Å²	131.8	88%	0.883	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-67.5	129.1	178.5	-168.3	-178.5	-170.1	177	5.4	111.7	P705	P705-R707 PolarHBondContact O-N 2.76Å
708	P	29.3	Very low	30	Very low	116 Å²	116	139 Å²	139	75%	0.753	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-60.8	136.7	168.8	-22.8	34.1	0	0	0	111.6	A710	P708-A710 PolarHBondContact O-N 3.1Å
709	S	28.3	Very low	29.4	Very low	113 Å²	113	138.6 Å²	138.6	79%	0.79	77%	0.772	S	S	*	*			trans	-76	109.4	-176.8	55.7	0	0	0	0	112.1
710	A	28.9	Very low	29	Very low	96 Å²	96	135.9 Å²	135.9	79%	0.793	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-67.4	134	168.9	0	0	0	0	0	110.9	P708	P708-A710 PolarHBondContact O-N 3.1Å
711	Q	30.1	Very low	28.7	Very low	190 Å²	190	138.5 Å²	138.5	89%	0.888	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-76.7	135.9	-178.8	-65.6	175.5	-9.7	0	0	111
712	S	25.4	Very low	28.5	Very low	116 Å²	116	137 Å²	137	81%	0.811	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-93	126.5	176.3	-66.3	0	0	0	0	111.3	S714	S712-S714 PolarHBondContact O-N 3.23Å
713	P	34	Very low	28.2	Very low	124 Å²	124	139 Å²	139	81%	0.805	83%	0.83	S	S	*	*			trans	-86.8	106.5	-179.2	32.4	-32.4	0	0	0	111.7
714	S	27.2	Very low	29.1	Very low	123 Å²	123	137 Å²	137	86%	0.86	83%	0.826	S	S	*	*			trans	-160	86.8	170.4	-83.9	0	0	0	0	113.3	S712	S712-S714 PolarHBondContact O-N 3.23Å
715	A	26.3	Very low	29.2	Very low	96 Å²	96	135.7 Å²	135.7	79%	0.793	83%	0.829	S	S	*	*			trans	-157.4	67.6	171.6	0	0	0	0	0	113.2
716	L	29.5	Very low	29.1	Very low	163 Å²	163	134.1 Å²	134.1	85%	0.853	82%	0.821	S	S	*	*			trans	-169.3	78.5	162.1	-113.4	166.9	0	0	0	116
717	R	30.4	Very low	29.1	Very low	252 Å²	252	134.2 Å²	134.2	95%	0.951	82%	0.816	S	S	*	*				-167.9	164.3	128.1	-115.8	168.4	-90.1	-149.8	-2.7	113.1
718	K	28.4	Very low	29.1	Very low	200 Å²	200	129.6 Å²	129.6	87%	0.87	81%	0.808	S	S	*	*			trans	-143.3	137.3	-164.5	-177.4	179.7	-178.8	-179.6	0	109.6
719	A	26.3	Very low	28.9	Very low	102 Å²	102	134.5 Å²	134.5	84%	0.843	81%	0.813	S	S	*	*			trans	59.6	112.7	167.3	0	0	0	0	0	119.3
720	A	28.1	Very low	28.7	Very low	110 Å²	110	139.8 Å²	139.8	91%	0.909	82%	0.816	S	S	*	*			trans	-152.5	166.9	140.5	0	0	0	0	0	107.5
721	A	27.3	Very low	29.5	Very low	101 Å²	101	139.7 Å²	139.7	84%	0.835	81%	0.807	S	S	*	*			trans	-130.5	174.9	-163	0	0	0	0	0	114.9
722	A	28.7	Very low	29.3	Very low	103 Å²	103	136.2 Å²	136.2	85%	0.851	80%	0.799	S	S	*	*			trans	80.8	129.9	166.4	0	0	0	0	0	119.2
723	S	24.4	Very low	29.4	Very low	112 Å²	112	136.3 Å²	136.3	78%	0.783	80%	0.8	S	S	*	*			trans	-94.8	-170.1	164.1	-25.4	0	0	0	0	109.3
724	P	48	Very low	29.2	Very low	116 Å²	116	135.1 Å²	135.1	75%	0.753	80%	0.8	S	S	*	*			cis	-130.9	-165.2	-16.8	34.5	-14	0	0	0	112.1
725	V	28.7	Very low	29.4	Very low	127 Å²	127	134.3 Å²	134.3	77%	0.77	79%	0.794	S	S	*	*			trans	153	110	131.8	167.9	0	0	0	0	112.4
726	S	28.2	Very low	29.5	Very low	84 Å²	84	137.2 Å²	137.2	59%	0.587	80%	0.797	S	S	*	*			trans	-16.3	158.3	162	63.7	0	0	0	0	124.1
727	N	27.1	Very low	29.4	Very low	140 Å²	140	137.9 Å²	137.9	75%	0.749	80%	0.8	S	S	*	*			trans	75.5	149.5	141.5	-69.3	-6.6	0	0	0	119
728	L	25.5	Very low	29.3	Very low	138 Å²	138	135.5 Å²	135.5	72%	0.723	80%	0.797	S	S	*	*			cis	-168.3	174	-19.9	-119.4	171.9	0	0	0	109.8
729	Y	25.3	Very low	29.3	Very low	218 Å²	218	130.2 Å²	130.2	86%	0.855	79%	0.79	S	S	*	*			trans	78	160.7	160.1	-98.9	-93.2	0	0	0	122.2
730	R	24.9	Very low	30.6	Very low	224 Å²	224	131.4 Å²	131.4	85%	0.845	79%	0.79	S	S	*	*			trans	-127.1	-175.4	-176.4	-136.5	-173.5	176.5	-175	0.6	106.4
731	P	46.1	Very low	31.6	Very low	95 Å²	95	131.8 Å²	131.8	62%	0.617	78%	0.783	S	S	*	*			cis	-141.2	-153.7	-7.9	38.9	-14.9	0	0	0	114.8
732	T	25.1	Very low	31.7	Very low	117 Å²	117	138.2 Å²	138.2	72%	0.718	79%	0.785	S	S	*	*			trans	80.5	106.4	147.7	39.6	0	0	0	0	124.6
733	S	28.7	Very low	31.8	Very low	118 Å²	118	140.2 Å²	140.2	83%	0.825	78%	0.782	S	S	*	*				51.8	120.1	113.3	-47.4	0	0	0	0	124.7
734	A	28.7	Very low	32.1	Very low	98 Å²	98	139.9 Å²	139.9	81%	0.81	78%	0.779	S	S	*	*			trans	176.2	175.7	138.3	0	0	0	0	0	111
735	S	30.7	Very low	31.1	Very low	106 Å²	106	138.5 Å²	138.5	74%	0.741	79%	0.787	S	S	*	*				-167.6	141.9	-60.2	-85	0	0	0	0	111.2
736	N	29.4	Very low	31.1	Very low	157 Å²	157	135.5 Å²	135.5	84%	0.84	78%	0.782	S	S	*	*			trans	59.6	139.4	158.5	-60.8	-13.7	0	0	0	122.7
737	L	27.5	Very low	31.2	Very low	177 Å²	177	139.8 Å²	139.8	93%	0.927	80%	0.797	S	S	*	*				-167.2	162	128.7	-104.6	167.7	0	0	0	111
738	F	27.2	Very low	31.4	Very low	203 Å²	203	139.2 Å²	139.2	89%	0.89	80%	0.798	S	S	*	*			trans	-150.5	158.3	-161.4	-135.4	-88.5	0	0	0	114.5
739	A	30.1	Very low	31.5	Very low	88 Å²	88	135.3 Å²	135.3	73%	0.727	79%	0.791	S	S	*	*			trans	80.7	128.1	159	0	0	0	0	0	122.5
740	P	53.6	Low	31.7	Very low	127 Å²	127	135.5 Å²	135.5	83%	0.825	79%	0.792	S	S	*	*			trans	-134.6	154.3	167.9	40.8	-27	0	0	0	116.9
741	P	47.8	Very low	31.8	Very low	119 Å²	119	129.8 Å²	129.8	77%	0.773	79%	0.786	S	S	*	*			trans	-138.6	109.8	177.5	38.1	-19.1	0	0	0	119.9
742	R	30.2	Very low	31.2	Very low	235 Å²	235	129.2 Å²	129.2	89%	0.887	78%	0.784	S	S	*	*			trans	71.2	156.7	130	-71	-176.9	163.4	-171.4	-6.2	125.9
743	N	31	Very low	31.3	Very low	146 Å²	146	131.2 Å²	131.2	78%	0.781	79%	0.791	S	S	*	*			trans	80.3	150.1	154.2	-82.1	18.8	0	0	0	120.2
744	S	29.8	Very low	31.4	Very low	104 Å²	104	129.6 Å²	129.6	73%	0.727	79%	0.785	S	S	*	*			cis	-171.3	145.4	-7.2	45.1	0	0	0	0	115.2
745	G	27.4	Very low	31.5	Very low	88 Å²	88	129.5 Å²	129.5	91%	0.907	78%	0.784	S	S	*	*			trans	73.4	161.6	155.6	0	0	0	0	0	118.8
746	G	29.3	Very low	31.4	Very low	64 Å²	64	133.9 Å²	133.9	66%	0.66	78%	0.784	S	S	*	*			cis	159.6	140.3	-12.2	0	0	0	0	0	114.4
747	L	30.7	Very low	31.4	Very low	174 Å²	174	133.2 Å²	133.2	91%	0.911	78%	0.776	S	S	*	*			trans	66.4	159.6	176.3	-71	78.9	0	0	0	115.3
748	V	30.8	Very low	31.4	Very low	127 Å²	127	129.3 Å²	129.3	77%	0.77	76%	0.763	S	S	*	*			cis	-165.1	158.8	-15.3	129	0	0	0	0	106.3
749	G	28	Very low	31.6	Very low	56 Å²	56	126 Å²	126	58%	0.577	76%	0.76	S	S	*	*			cis	165.2	-168.4	0.1	0	0	0	0	0	110.8
750	Y	29.2	Very low	31.7	Very low	223 Å²	223	130.1 Å²	130.1	88%	0.875	76%	0.764	S	S	*	*			trans	69.7	127.5	-174.5	-55.4	-80.8	0	0	0	115.3
751	S	27.8	Very low	30.5	Very low	103 Å²	103	131.1 Å²	131.1	72%	0.72	76%	0.763	S	S	*	*			cis	86.9	130.5	40.7	-157.5	0	0	0	0	112.2
752	S	31.5	Very low	29.7	Very low	83 Å²	83	131.9 Å²	131.9	58%	0.58	76%	0.759	S	S	*	*			cis	-179.2	152.3	-7.2	43.5	0	0	0	0	111.6
753	N	28.8	Very low	29.8	Very low	159 Å²	159	129.2 Å²	129.2	85%	0.85	76%	0.756	S	S	*	*			trans	65.7	161.7	155	-63.2	-9.8	0	0	0	118.7
754	A	30.1	Very low	29.6	Very low	85 Å²	85	132.7 Å²	132.7	70%	0.702	76%	0.758	S	S	*	*			cis	-173.2	164.2	-30.5	0	0	0	0	0	110.1
755	A	30.5	Very low	29.7	Very low	95 Å²	95	132.3 Å²	132.3	79%	0.785	76%	0.761	S	S	*	*			trans	66.4	166.7	159.8	0	0	0	0	0	117
756	R	29.4	Very low	29.8	Very low	198 Å²	198	135.6 Å²	135.6	75%	0.747	75%	0.753	S	S	*	*			cis	-164.4	156.5	-25.7	-108.4	170.8	90.8	132.8	3.8	107.3
757	E	28.2	Very low	30.5	Very low	144 Å²	144	138.5 Å²	138.5	67%	0.673	76%	0.76	S	S	*	*			trans	62.7	162.2	155.4	-77.7	144.4	-163.6	0	0	117.1
758	S	28.5	Very low	30.5	Very low	95 Å²	95	134.6 Å²	134.6	66%	0.664	75%	0.753	S	S	*	*			cis	-166.4	-172.8	-22.9	55.5	0	0	0	0	110.1
759	T	31.2	Very low	30.3	Very low	133 Å²	133	136.2 Å²	136.2	82%	0.816	76%	0.756	S	S	*	*			trans	77.1	162.6	162.4	20.7	0	0	0	0	119.5
760	Q	32.8	Very low	30.4	Very low	175 Å²	175	139.7 Å²	139.7	82%	0.818	77%	0.766	S	S	*	*			trans	-113	161.5	-163	-55.2	156.5	-77.4	0	0	110.8
761	D	28.7	Very low	30.4	Very low	148 Å²	148	136.3 Å²	136.3	79%	0.791	76%	0.761	S	S	*	*			trans	-166	140.5	135.1	-111.5	-19.5	0	0	0	117.1
762	I	31.1	Very low	30.6	Very low	134 Å²	134	142 Å²	142	69%	0.687	77%	0.767	S	S	*	*			trans	49.1	123.4	140.9	-67.4	163.2	0	0	0	123.2
763	H	31	Very low	31	Very low	179 Å²	179	143.2 Å²	143.2	83%	0.829	77%	0.773	S	S	*	*			trans	3.9	131.9	152	-60.1	-82.6	0	0	0	122.3
764	R	27.3	Very low	31.1	Very low	220 Å²	220	142.4 Å²	142.4	83%	0.83	77%	0.773	S	S	*	*				-153.9	151.6	121.1	-145.2	178.4	179.9	102.8	-3.3	112.1	E766	R764-E766 IonicContact NE-OE1 3.44Å; R764-E766 PolarHBondContact NE-OE1 2.68Å; R764-E766 IonicContact NH2-OE1 3.68Å
765	A	30.8	Very low	31	Very low	96 Å²	96	145.6 Å²	145.6	79%	0.793	78%	0.778	S	S	*	*			trans	-145.3	143.7	170	0	0	0	0	0	109.2
766	E	29.5	Very low	31	Very low	157 Å²	157	149.3 Å²	149.3	73%	0.734	78%	0.784	S	S	*	*			trans	-139.7	157.7	171.8	-74.2	-168.5	-166.8	0	0	111.5	R764	R764-E766 IonicContact NE-OE1 3.44Å; R764-E766 PolarHBondContact NE-OE1 2.68Å; R764-E766 IonicContact NH2-OE1 3.68Å
767	P	45.1	Very low	30.9	Very low	124 Å²	124	147.5 Å²	147.5	81%	0.805	79%	0.789	S	S	*	*			trans	-119.3	-175.4	-158.4	39.8	-24.6	0	0	0	115.1
768	A	29.4	Very low	31	Very low	93 Å²	93	147.4 Å²	147.4	77%	0.769	79%	0.79	S	S	*	*			trans	-77.9	166.1	-176.1	0	0	0	0	0	115.4
769	I	28.1	Very low	31.3	Very low	161 Å²	161	148.7 Å²	148.7	83%	0.826	80%	0.796	S	S	*	*			trans	-125.9	145.9	173.1	-67	179.2	0	0	0	110
770	V	29.6	Very low	31.2	Very low	129 Å²	129	151.3 Å²	151.3	78%	0.782	80%	0.797	S	S	*	*			trans	-133.8	125.9	-169.7	175.4	0	0	0	0	112.8
771	I	28.7	Very low	30.8	Very low	151 Å²	151	147.7 Å²	147.7	77%	0.774	80%	0.797	S	S	*	*			trans	-154.5	138.8	174.3	-57.4	-177.2	0	0	0	108.3
772	R	31.7	Very low	30.8	Very low	224 Å²	224	147.1 Å²	147.1	85%	0.845	80%	0.799	S	S	*	*			cis	-163.2	164.8	-31.8	-113.1	170.8	-176.2	-93.2	-1.8	108.1
773	P	40.7	Very low	31.3	Very low	108 Å²	108	146.2 Å²	146.2	70%	0.701	80%	0.801	S	S	*	*			trans	-99	170.7	-166.8	39.1	-36.9	0	0	0	115.7
774	V	30.4	Very low	31.2	Very low	142 Å²	142	143.9 Å²	143.9	86%	0.861	80%	0.802	S	S	*	*			trans	-141.4	129.6	162.8	178.8	0	0	0	0	109.4
775	D	29.3	Very low	31.1	Very low	152 Å²	152	137.7 Å²	137.7	81%	0.813	80%	0.798	S	S	*	*			trans	-94.4	154.1	173.6	-72	-65.6	0	0	0	112.5
776	L	29.2	Very low	30.9	Very low	173 Å²	173	138.4 Å²	138.4	91%	0.906	80%	0.797	S	S	*	*			trans	-158.1	160.3	152.9	-111.3	170.5	0	0	0	111.9
777	N	28.4	Very low	30.7	Very low	159 Å²	159	138.9 Å²	138.9	85%	0.85	80%	0.803	S	S	*	*			trans	-91.3	161.4	-155.5	-96.5	-53.3	0	0	0	117.7
778	M	30.1	Very low	29.7	Very low	142 Å²	142	144.3 Å²	144.3	70%	0.7	81%	0.808	S	S	*	*			trans	-52.5	162.9	167	-110.4	-174.5	70.7	0	0	114.4	K780	M778-K780 HydrophobicContact CE-CG 4Å
779	P	34.4	Very low	29.4	Very low	122 Å²	122	143.1 Å²	143.1	79%	0.792	80%	0.804	S	S	*	*				-149.4	-173.6	59.1	41.3	-19.8	0	0	0	118.5
780	K	29.8	Very low	29.1	Very low	189 Å²	189	140 Å²	140	82%	0.822	80%	0.802	S	S	*	*			trans	-73.5	152	-177.5	-57.9	173	179.2	176.2	0	114.1	M778	M778-K780 HydrophobicContact CE-CG 4Å
781	A	24.2	Very low	28.9	Very low	99 Å²	99	140.3 Å²	140.3	82%	0.818	80%	0.804	S	S	*	*			trans	-153.8	140.8	152.4	0	0	0	0	0	113.3
782	T	27.4	Very low	29.4	Very low	136 Å²	136	138.2 Å²	138.2	83%	0.834	80%	0.8	S	S	*	*			trans	-158.3	154.5	170.4	49.9	0	0	0	0	108.7
783	P	42.6	Very low	29.2	Very low	114 Å²	114	134 Å²	134	74%	0.74	80%	0.8	S	S	*	*			cis	-109.5	-155	-33.6	39.6	-26	0	0	0	109.3
784	P	28.5	Very low	28.7	Very low	131 Å²	131	132.4 Å²	132.4	85%	0.851	80%	0.796	S	S	*	*				-131.9	169.2	118.4	38.3	-32.3	0	0	0	113.1
785	A	25.6	Very low	28.5	Very low	90 Å²	90	133.7 Å²	133.7	74%	0.744	80%	0.796	S	S	*	*			trans	-126.3	156.1	-176.2	0	0	0	0	0	112.8
786	S	26.2	Very low	28.3	Very low	111 Å²	111	132 Å²	132	78%	0.776	79%	0.791	S	S	*	*			trans	53.6	116.8	151	-166.6	0	0	0	0	119.4
787	I	25.2	Very low	28.1	Very low	167 Å²	167	132.6 Å²	132.6	86%	0.856	79%	0.789	S	S	*	*			trans	-135.8	138.4	135.9	-102.7	158.7	0	0	0	109.8
788	R	23.6	Very low	28	Very low	238 Å²	238	129.1 Å²	129.1	90%	0.898	78%	0.783	S	S	*	*			trans	-42.7	154.1	168.9	-58.1	158.9	173.6	177.3	-4.7	112
789	G	22.9	Very low	27.8	Very low	68 Å²	68	129.3 Å²	129.3	70%	0.701	79%	0.786	S	S	*	*			cis	125.4	158.1	22.5	0	0	0	0	0	109.7
790	A	22.9	Very low	27.6	Very low	95 Å²	95	132.4 Å²	132.4	79%	0.785	79%	0.79	S	S	*	*			trans	72.6	127.9	-174.8	0	0	0	0	0	115.3
791	V	25.4	Very low	27.5	Very low	136 Å²	136	131 Å²	131	82%	0.824	79%	0.791	S	S	*	*			cis	74.3	141.8	16.3	-169.8	0	0	0	0	112.7
792	P	39.6	Very low	27.7	Very low	106 Å²	106	135.1 Å²	135.1	69%	0.688	79%	0.793	S	S	*	*			cis	-129.7	164.7	4.6	27.4	-5.8	0	0	0	117.9
793	T	27.4	Very low	28.1	Very low	137 Å²	137	134.3 Å²	134.3	84%	0.84	79%	0.79	S	S	*	*				-152.7	98.7	124.3	-33.6	0	0	0	0	106.2
794	A	29.6	Very low	27.4	Very low	74 Å²	74	137 Å²	137	61%	0.612	80%	0.798	S	S	*	*				57.3	128.8	83.8	0	0	0	0	0	112.7
795	I	25.7	Very low	27.4	Very low	169 Å²	169	134.6 Å²	134.6	87%	0.867	80%	0.797	S	S	*	*			cis	-112.9	134	19.6	-65.5	173.6	0	0	0	112.7
796	T	25.8	Very low	27.5	Very low	115 Å²	115	134.1 Å²	134.1	71%	0.706	80%	0.801	S	S	*	*			trans	-109.9	178.4	172.7	-49.3	0	0	0	0	109
797	Q	25.1	Very low	27.5	Very low	186 Å²	186	132.9 Å²	132.9	87%	0.869	81%	0.805	S	S	*	*			trans	88.9	139.4	169.1	-50.4	175.3	6.9	0	0	114
798	A	25.4	Very low	27.8	Very low	87 Å²	87	129.6 Å²	129.6	72%	0.719	80%	0.803	S	S	*	*			cis	-155.4	163.8	-0.2	0	0	0	0	0	108.7
799	L	26.5	Very low	28.1	Very low	146 Å²	146	125 Å²	125	76%	0.764	80%	0.801	S	S	*	*			cis	-160.2	151.1	-8.8	-126.5	168	0	0	0	106.7
800	Q	29.7	Very low	28.3	Very low	186 Å²	186	129.9 Å²	129.9	87%	0.869	81%	0.81	S	S	*	*			trans	-82.3	130.7	158.5	-81.2	175.6	-43.8	0	0	108.7
801	L	27.4	Very low	28.4	Very low	161 Å²	161	137 Å²	137	84%	0.843	82%	0.817	S	S	*	*			trans	-123	132.2	165	-77.2	174.3	0	0	0	109.5
802	Q	29.5	Very low	28.5	Very low	185 Å²	185	139.2 Å²	139.2	86%	0.864	82%	0.818	S	S	*	*			trans	-76.5	164	171.3	-94	-172.9	2.1	0	0	110.9
803	P	36.1	Very low	27.8	Very low	118 Å²	118	141.1 Å²	141.1	77%	0.766	83%	0.827	S	S	*	*			trans	-73.9	134.6	-163	28.4	-36.2	0	0	0	113.8
804	N	26.6	Very low	27.8	Very low	172 Å²	172	145.4 Å²	145.4	92%	0.92	83%	0.828	S	S	*	*			trans	-162.9	134.2	149.1	-111.4	-31	0	0	0	111.5
805	G	28.9	Very low	28	Very low	79 Å²	79	148 Å²	148	81%	0.814	84%	0.839	S	S	*	*			trans	76.9	67	151	0	0	0	0	0	121
806	G	27.3	Very low	28.3	Very low	81 Å²	81	145 Å²	145	84%	0.835	84%	0.84	S	S	*	*			trans	80.6	167.7	141.8	0	0	0	0	0	120.2
807	G	26.9	Very low	29	Very low	84 Å²	84	145.5 Å²	145.5	87%	0.866	85%	0.848	S	S	*	*			trans	86.9	122.4	170	0	0	0	0	0	115.8
808	A	32.2	Very low	29.6	Very low	98 Å²	98	140.4 Å²	140.4	81%	0.81	85%	0.845	S	S	*	*			trans	-89.1	156.1	174.7	0	0	0	0	0	112.5
809	V	28.8	Very low	30.1	Very low	143 Å²	143	144.8 Å²	144.8	87%	0.867	86%	0.855	S	S	*	*				178.3	141.1	126.4	147	0	0	0	0	110.6
810	L	28	Very low	30.7	Very low	169 Å²	169	147.6 Å²	147.6	89%	0.885	86%	0.856	S	S	*	*			trans	-88.9	144.4	176	-84.3	159.7	0	0	0	112.5
811	R	25.4	Very low	31.3	Very low	245 Å²	245	147.9 Å²	147.9	93%	0.925	86%	0.857	S	S	*	*			trans	-147	143.4	157.8	-114.3	178.8	179.9	179.7	-0.1	111.8
812	Q	27.4	Very low	32.3	Very low	182 Å²	182	151.8 Å²	151.8	85%	0.85	86%	0.861	S	S	*	*			trans	-91.6	155.5	-175.9	-65.5	176.3	-20.8	0	0	112.5
813	V	24.3	Very low	33.1	Very low	146 Å²	146	148.2 Å²	148.2	89%	0.885	85%	0.847	S	S	*	*			trans	-133.8	143.5	163.6	-178	0	0	0	0	108.6
814	R	27.5	Very low	34.3	Very low	227 Å²	227	149.3 Å²	149.3	86%	0.857	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-103.2	148.8	178.1	-71.3	178.7	174.7	167.6	-3.1	111.3
815	P	33	Very low	35.7	Very low	129 Å²	129	146.5 Å²	146.5	84%	0.838	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-79.2	161.6	172.5	34	-35.3	0	0	0	112.5
816	A	32.5	Very low	36.9	Very low	107 Å²	107	145 Å²	145	88%	0.884	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-102.4	161	179.5	0	0	0	0	0	113
817	S	39.5	Very low	38.5	Very low	125 Å²	125	145 Å²	145	87%	0.874	79%	0.788	S	S	*	*			trans	-112.2	137.3	-174.2	54.2	0	0	0	0	112.7
818	G	39.3	Very low	40.1	Very low	79 Å²	79	142.2 Å²	142.2	81%	0.814	75%	0.754	S	S	*	*			trans	-178.9	66.9	176.4	0	0	0	0	0	115.7
819	L	34.8	Very low	41.5	Very low	178 Å²	178	143.4 Å²	143.4	93%	0.932	74%	0.737	S	S	*	*			trans	-150.6	18.5	176.4	-123.2	172.1	0	0	0	115.2
820	R	39.9	Very low	43.3	Very low	205 Å²	205	141 Å²	141	77%	0.774	72%	0.72	S	S	*	*			trans	-108.8	8.2	-173.4	-148.9	-174.4	-175.2	-169.5	1.3	115	E832	R820-E832 IonicContact NH2-OE1 3.1Å
821	E	42.4	Very low	44.9	Very low	192 Å²	192	137.7 Å²	137.7	90%	0.897	70%	0.702	S	S	*	*	S	Bend	trans	-110.8	21.7	-156.4	-151.2	169.5	-131.1	0	0	115.1
822	R	47.7	Very low	46.8	Very low	243 Å²	243	130.1 Å²	130.1	92%	0.917	68%	0.677	S	S	*	*	S	Bend	trans	-140.1	22.1	-177.6	-70.5	-165.4	177.9	-168.3	0.5	116
823	L	47.1	Very low	48.7	Very low	111 Å²	111	127.2 Å²	127.2	58%	0.581	66%	0.662	S	S	*	*	S	Bend	trans	-124.3	145.7	170.2	-68.2	171.9	0	0	0	108.7	V828	L823-V828 HydrophobicContact CB-CG2 3.43Å; L823-V828 VanDerWaalsContact CB-CG2 3.43Å; L823-V828 HydrophobicContact CD1-CG2 4.12Å; L823-V828 HydrophobicContact CG-CG2 4.43Å
824	Q	61.1	Low	50.7	Low	140 Å²	140	123.9 Å²	123.9	65%	0.654	64%	0.642	S	S	*	*			trans	-76.2	144.1	174.4	-51.3	-173	22	0	0	109.3	A826 D827 V828	Q824-A826 PolarHBondContact O-N 3.1Å; Q824-D827 WeakPolarHBondContact CB-OD2 3.32Å; Q824-D827 PolarHBondContact O-N 3.09Å; Q824-V828 PolarHBondContact O-N 3.46Å
825	D	56.4	Low	52.6	Low	113 Å²	113	117.6 Å²	117.6	60%	0.604	63%	0.625	S	S	*	*	H	α-helix	trans	-57.1	-26	-178	-72.5	-19.3	0	0	0	113.5	R829	D825-R829 VanDerWaalsContact CB-NH2 3.3Å; D825-R829 WeakPolarHBondContact O-CB 3.2Å; D825-R829 VanDerWaalsContact O-CG 3.29Å; D825-R829 WeakPolarHBondContact O-CG 3.36Å; D825-R829 PolarHBondContact O-N 3.03Å; D825-R829 VanDerWaalsContact O-N 3.13Å; D825-R829 PolarHBondContact O-NE 2.78Å; D825-R829 PolarHBondContact O-NH2 3.11Å
826	A	53.8	Low	54.4	Low	48 Å²	48	112 Å²	112	40%	0.397	59%	0.589	S	S	.	*	H	α-helix	trans	-65.4	-47.7	172.3	0	0	0	0	0	111.6	Q824 R829 N830	Q824-A826 PolarHBondContact O-N 3.1Å; A826-R829 PolarHBondContact O-N 3.1Å; A826-N830 WeakPolarHBondContact O-CB 3.25Å; A826-N830 PolarHBondContact O-N 2.95Å; A826-N830 PolarHBondContact O-ND2 2.95Å
827	D	60.2	Low	56.2	Low	80 Å²	80	110.1 Å²	110.1	43%	0.428	57%	0.574	S	S	.	*	H	α-helix	trans	-67.4	-42.8	179.3	-56.1	-40	0	0	0	111.2	Q824 R829 N830 L831	Q824-D827 WeakPolarHBondContact CB-OD2 3.32Å; Q824-D827 PolarHBondContact O-N 3.09Å; D827-R829 PolarHBondContact O-N 3.24Å; D827-N830 PolarHBondContact O-N 3.21Å; D827-L831 WeakPolarHBondContact O-CB 3.42Å; D827-L831 PolarHBondContact O-N 3.45Å
828	V	60.1	Low	57.6	Low	26 Å²	26	110.6 Å²	110.6	16%	0.158	57%	0.566	C	S	.	*	H	α-helix	trans	-56.6	-51.3	174.9	178.4	0	0	0	0	110.3	L823 Q824 N830 L831 E832	L823-V828 HydrophobicContact CB-CG2 3.43Å; L823-V828 VanDerWaalsContact CB-CG2 3.43Å; L823-V828 HydrophobicContact CD1-CG2 4.12Å; L823-V828 HydrophobicContact CG-CG2 4.43Å; Q824-V828 PolarHBondContact O-N 3.46Å; V828-N830 VanDerWaalsContact C-N 3.35Å; V828-N830 PolarHBondContact O-N 3.45Å; V828-L831 PolarHBondContact O-N 3.32Å; V828-E832 HydrophobicContact CG1-CG 4.29Å; V828-E832 WeakPolarHBondContact O-CB 3.32Å; V828-E832 VanDerWaalsContact O-CG 3.3Å; V828-E832 WeakPolarHBondContact O-CG 3.31Å; V828-E832 PolarHBondContact O-N 2.92Å
829	R	61.1	Low	59.4	Low	123 Å²	123	108.5 Å²	108.5	46%	0.464	54%	0.535	S	S	.	.	H	α-helix	trans	-69	-30.4	-178.8	-71.3	174.5	-65.3	-152.8	0.8	113.2	D825 A826 D827 K833	D825-R829 VanDerWaalsContact CB-NH2 3.3Å; D825-R829 WeakPolarHBondContact O-CB 3.2Å; D825-R829 VanDerWaalsContact O-CG 3.29Å; D825-R829 WeakPolarHBondContact O-CG 3.36Å; D825-R829 PolarHBondContact O-N 3.03Å; D825-R829 VanDerWaalsContact O-N 3.13Å; D825-R829 PolarHBondContact O-NE 2.78Å; D825-R829 PolarHBondContact O-NH2 3.11Å; A826-R829 PolarHBondContact O-N 3.1Å; D827-R829 PolarHBondContact O-N 3.24Å; R829-K833 WeakPolarHBondContact O-CB 3.41Å; R829-K833 VanDerWaalsContact O-CG 3.25Å; R829-K833 WeakPolarHBondContact O-CG 3.16Å; R829-K833 PolarHBondContact O-N 3.25Å
830	N	66.8	Low	61.5	Low	94 Å²	94	103.2 Å²	103.2	50%	0.503	51%	0.513	S	S	.	.	H	α-helix	trans	-70.2	-39	172.4	-73.7	-21.4	0	0	0	111.5	A826 D827 V828 T834	A826-N830 WeakPolarHBondContact O-CB 3.25Å; A826-N830 PolarHBondContact O-N 2.95Å; A826-N830 PolarHBondContact O-ND2 2.95Å; D827-N830 PolarHBondContact O-N 3.21Å; V828-N830 VanDerWaalsContact C-N 3.35Å; V828-N830 PolarHBondContact O-N 3.45Å; N830-T834 WeakPolarHBondContact O-CB 3.45Å; N830-T834 PolarHBondContact O-N 2.59Å; N830-T834 PolarHBondContact O-OG1 3.1Å
831	L	61.5	Low	63.2	Low	98 Å²	98	97.2 Å²	97.2	51%	0.513	49%	0.491	S	S	.	.	H	α-helix	trans	-70.2	-41.1	176.6	-158.4	73.5	0	0	0	111.5	D827 V828 T834 N835	D827-L831 WeakPolarHBondContact O-CB 3.42Å; D827-L831 PolarHBondContact O-N 3.45Å; V828-L831 PolarHBondContact O-N 3.32Å; L831-T834 PolarHBondContact O-N 2.8Å; L831-N835 WeakPolarHBondContact O-CB 3.45Å; L831-N835 VanDerWaalsContact O-CG 3.27Å; L831-N835 PolarHBondContact O-N 2.98Å; L831-N835 PolarHBondContact O-ND2 3.01Å
832	E	65.3	Low	64.9	Low	86 Å²	86	95 Å²	95	40%	0.402	48%	0.48	S	S	.	.	H	α-helix	trans	-59.8	-45.4	172.4	-74.9	170.4	164	0	0	111.2	R820 V828 T836	R820-E832 IonicContact NH2-OE1 3.1Å; V828-E832 HydrophobicContact CG1-CG 4.29Å; V828-E832 WeakPolarHBondContact O-CB 3.32Å; V828-E832 VanDerWaalsContact O-CG 3.3Å; V828-E832 WeakPolarHBondContact O-CG 3.31Å; V828-E832 PolarHBondContact O-N 2.92Å; E832-T836 WeakPolarHBondContact O-CB 3.34Å; E832-T836 PolarHBondContact O-N 2.21Å; E832-T836 PolarHBondContact O-OG1 3.13Å
833	K	67.4	Low	66.4	Low	121 Å²	121	84.9 Å²	84.9	53%	0.526	45%	0.449	S	S	.	.	H	α-helix	trans	-63.7	-43.1	174	-76.9	175.3	178.6	-174.1	0	112.9	R829 T836 A837	R829-K833 WeakPolarHBondContact O-CB 3.41Å; R829-K833 VanDerWaalsContact O-CG 3.25Å; R829-K833 WeakPolarHBondContact O-CG 3.16Å; R829-K833 PolarHBondContact O-N 3.25Å; K833-T836 PolarHBondContact O-N 3.49Å; K833-A837 WeakPolarHBondContact O-CB 3.26Å; K833-A837 PolarHBondContact O-N 2.82Å
834	T	67.9	Low	68.1	Low	77 Å²	77	79.6 Å²	79.6	47%	0.472	42%	0.421	S	S	.	.	H	α-helix	trans	-64.1	-45.1	178.9	-54.5	0	0	0	0	110.8	N830 L831 T836 A837 L838	N830-T834 WeakPolarHBondContact O-CB 3.45Å; N830-T834 PolarHBondContact O-N 2.59Å; N830-T834 PolarHBondContact O-OG1 3.1Å; L831-T834 PolarHBondContact O-N 2.8Å; T834-T836 PolarHBondContact O-N 3.38Å; T834-A837 PolarHBondContact O-N 2.92Å; T834-L838 HydrophobicContact CG2-CD1 4.14Å; T834-L838 VanDerWaalsContact O-CG 3.3Å; T834-L838 WeakPolarHBondContact O-CG 3.4Å; T834-L838 PolarHBondContact O-N 3.39Å; T834-L838 VanDerWaalsContact O-N 3.15Å
835	N	65.9	Low	69.1	Low	94 Å²	94	75.1 Å²	75.1	50%	0.503	40%	0.402	S	S	.	.	H	α-helix	trans	-60.7	-44.5	173.7	-73	-21.4	0	0	0	111.4	L831 A837 L838 M839	L831-N835 WeakPolarHBondContact O-CB 3.45Å; L831-N835 VanDerWaalsContact O-CG 3.27Å; L831-N835 PolarHBondContact O-N 2.98Å; L831-N835 PolarHBondContact O-ND2 3.01Å; N835-A837 VanDerWaalsContact C-N 3.35Å; N835-A837 PolarHBondContact O-N 3.01Å; N835-L838 CarbonylContact O-C 3.59Å; N835-L838 PolarHBondContact O-N 3.04Å; N835-M839 WeakPolarHBondContact O-CG 3.39Å; N835-M839 PolarHBondContact O-N 3.49Å; N835-M839 VanDerWaalsContact O-N 3.1Å
836	T	72.1	Confident	70.4	Confident	12 Å²	12	76.8 Å²	76.8	7%	0.074	41%	0.406	C	S	.	.	H	α-helix	trans	-64.1	-37.4	-180	-54.2	0	0	0	0	112.1	E832 K833 T834 L838 M839 L869 V872	E832-T836 WeakPolarHBondContact O-CB 3.34Å; E832-T836 PolarHBondContact O-N 2.21Å; E832-T836 PolarHBondContact O-OG1 3.13Å; K833-T836 PolarHBondContact O-N 3.49Å; T834-T836 PolarHBondContact O-N 3.38Å; T836-L838 VanDerWaalsContact C-N 3.27Å; T836-L838 PolarHBondContact O-N 3.32Å; T836-M839 HydrophobicContact CG2-SD 4.39Å; T836-M839 PolarHBondContact O-N 3.18Å; T836-L869 HydrophobicContact CG2-CD2 3.76Å; T836-L869 HydrophobicContact CG2-CG 4.4Å; T836-V872 HydrophobicContact CG2-CG2 4.3Å
837	A	68.7	Low	71.8	Confident	68 Å²	68	76.8 Å²	76.8	56%	0.562	40%	0.398	S	S	*	.	H	α-helix	trans	-69.5	-22.5	173.7	0	0	0	0	0	113.6	K833 T834 N835	K833-A837 WeakPolarHBondContact O-CB 3.26Å; K833-A837 PolarHBondContact O-N 2.82Å; T834-A837 PolarHBondContact O-N 2.92Å; N835-A837 VanDerWaalsContact C-N 3.35Å; N835-A837 PolarHBondContact O-N 3.01Å
838	L	69.6	Low	73.1	Confident	135 Å²	135	73.6 Å²	73.6	71%	0.707	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-2.9	176.3	-68	170.7	0	0	0	113.6	T834 N835 T836	T834-L838 HydrophobicContact CG2-CD1 4.14Å; T834-L838 VanDerWaalsContact O-CG 3.3Å; T834-L838 WeakPolarHBondContact O-CG 3.4Å; T834-L838 PolarHBondContact O-N 3.39Å; T834-L838 VanDerWaalsContact O-N 3.15Å; N835-L838 CarbonylContact O-C 3.59Å; N835-L838 PolarHBondContact O-N 3.04Å; T836-L838 VanDerWaalsContact C-N 3.27Å; T836-L838 PolarHBondContact O-N 3.32Å
839	M	76.5	Confident	74.2	Confident	35 Å²	35	77.8 Å²	77.8	17%	0.172	40%	0.402	C	S	.	.	S	Bend	trans	-67.7	135.2	176.5	-71.3	176.4	73.3	0	0	111	N835 T836 A843 V844 E847 L869 Q876	N835-M839 WeakPolarHBondContact O-CG 3.39Å; N835-M839 PolarHBondContact O-N 3.49Å; N835-M839 VanDerWaalsContact O-N 3.1Å; T836-M839 HydrophobicContact CG2-SD 4.39Å; T836-M839 PolarHBondContact O-N 3.18Å; M839-A843 HydrophobicContact CE-CB 4.06Å; M839-A843 WeakPolarHBondContact CE-O 3.4Å; M839-V844 HydrophobicContact CB-CG2 3.47Å; M839-V844 VanDerWaalsContact CB-CG2 3.47Å; M839-E847 HydrophobicContact CE-CB 4.24Å; M839-L869 HydrophobicContact CE-CD2 4.27Å; M839-L869 HydrophobicContact SD-CD2 3.97Å; M839-Q876 PolarHBondContact O-NE2 2.82Å; M839-Q876 VanDerWaalsContact O-NE2 3.09Å
840	S	80.3	Confident	75.5	Confident	66 Å²	66	80.3 Å²	80.3	46%	0.462	41%	0.412	S	S	.	.			trans	-63.7	152	172.6	69.5	0	0	0	0	110.7	E842 A843 V844	S840-E842 PolarHBondContact O-N 2.91Å; S840-E842 VanDerWaalsContact O-N 3.08Å; S840-A843 PolarHBondContact O-N 2.99Å; S840-A843 WeakPolarHBondContact OG-CB 3.18Å; S840-A843 PolarHBondContact OG-N 3.22Å; S840-V844 WeakPolarHBondContact O-CG2 3.32Å; S840-V844 PolarHBondContact O-N 2.81Å
841	Y	75.9	Confident	76.4	Confident	80 Å²	80	76.3 Å²	76.3	31%	0.314	39%	0.39	S	S	.	.	H	α-helix	trans	-52.2	-34.2	177.9	-174.3	-92.2	0	0	0	112.6	N845 V873 Q876	Y841-N845 WeakPolarHBondContact CD1-ND2 3.43Å; Y841-N845 WeakPolarHBondContact CE1-ND2 3.4Å; Y841-N845 PolarHBondContact O-N 3.28Å; Y841-N845 PolarHBondContact O-ND2 3.29Å; Y841-V873 HydrophobicContact CE2-CG1 4.15Å; Y841-Q876 VanDerWaalsContact CA-OE1 3.29Å; Y841-Q876 HydrophobicContact CD2-CB 4.19Å
842	E	76.9	Confident	77.4	Confident	144 Å²	144	75.2 Å²	75.2	67%	0.673	39%	0.385	S	S	*	.	H	α-helix	trans	-69.8	-48.7	176	-68.6	167.1	-179.3	0	0	111.8	S840 V844 N845 E846	S840-E842 PolarHBondContact O-N 2.91Å; S840-E842 VanDerWaalsContact O-N 3.08Å; E842-V844 VanDerWaalsContact C-N 3.33Å; E842-V844 PolarHBondContact O-N 3Å; E842-N845 PolarHBondContact O-N 3.01Å; E842-E846 PolarHBondContact O-N 3Å
843	A	80.6	Confident	78.3	Confident	32 Å²	32	75.1 Å²	75.1	26%	0.264	40%	0.399	S	S	.	.	H	α-helix	trans	-65	-34.4	178.4	0	0	0	0	0	113	M839 S840 E847	M839-A843 HydrophobicContact CE-CB 4.06Å; M839-A843 WeakPolarHBondContact CE-O 3.4Å; S840-A843 PolarHBondContact O-N 2.99Å; S840-A843 WeakPolarHBondContact OG-CB 3.18Å; S840-A843 PolarHBondContact OG-N 3.22Å; A843-E847 PolarHBondContact O-N 3.42Å; A843-E847 VanDerWaalsContact O-N 3.1Å
844	V	82.2	Confident	78.9	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-63.1	-42.6	173.8	175.8	0	0	0	0	110.7	M839 S840 E842 L848 L869 V872 V873	M839-V844 HydrophobicContact CB-CG2 3.47Å; M839-V844 VanDerWaalsContact CB-CG2 3.47Å; S840-V844 WeakPolarHBondContact O-CG2 3.32Å; S840-V844 PolarHBondContact O-N 2.81Å; E842-V844 VanDerWaalsContact C-N 3.33Å; E842-V844 PolarHBondContact O-N 3Å; V844-L848 HydrophobicContact CG1-CD1 4.16Å; V844-L848 WeakPolarHBondContact O-CB 3.48Å; V844-L848 VanDerWaalsContact O-CG 3.29Å; V844-L848 WeakPolarHBondContact O-CG 3.5Å; V844-L848 PolarHBondContact O-N 3Å; V844-L869 HydrophobicContact CB-CD2 4.4Å; V844-L869 HydrophobicContact CG1-CB 4.19Å; V844-L869 HydrophobicContact CG1-CD2 3.89Å; V844-L869 HydrophobicContact CG2-CD2 4.32Å; V844-V872 HydrophobicContact CG2-CG1 4.12Å; V844-V873 HydrophobicContact CB-CG2 4.46Å; V844-V873 HydrophobicContact CG1-CG2 3.38Å
845	N	81.9	Confident	79.4	Confident	46 Å²	46	76.3 Å²	76.3	25%	0.246	40%	0.4	C	S	.	.	H	α-helix	trans	-71.8	-42.1	178.4	-70.2	-45.8	0	0	0	112.3	Y841 E842 E847 L848 D849	Y841-N845 WeakPolarHBondContact CD1-ND2 3.43Å; Y841-N845 WeakPolarHBondContact CE1-ND2 3.4Å; Y841-N845 PolarHBondContact O-N 3.28Å; Y841-N845 PolarHBondContact O-ND2 3.29Å; E842-N845 PolarHBondContact O-N 3.01Å; N845-E847 VanDerWaalsContact C-N 3.3Å; N845-E847 PolarHBondContact O-N 3.37Å; N845-L848 WeakPolarHBondContact O-CB 3.47Å; N845-L848 PolarHBondContact O-N 3.06Å; N845-L848 VanDerWaalsContact O-N 3.16Å; N845-D849 PolarHBondContact O-N 3Å
846	E	84.4	Confident	79.8	Confident	148 Å²	148	79.7 Å²	79.7	69%	0.692	42%	0.418	S	S	*	.	H	α-helix	trans	-61.2	-39.1	177.4	-173.3	179.2	-170.1	0	0	111.8	E842 R850	E842-E846 PolarHBondContact O-N 3Å; E846-R850 VanDerWaalsContact O-CB 3.28Å; E846-R850 WeakPolarHBondContact O-CB 3.18Å; E846-R850 PolarHBondContact O-N 2.75Å
847	E	82.4	Confident	80.5	Confident	48 Å²	48	84.4 Å²	84.4	22%	0.224	45%	0.447	C	S	.	.	H	α-helix	trans	-78.2	-24.8	176.3	-165.5	148.9	-148.8	0	0	113.5	M839 A843 N845 L851 R865 L869	M839-E847 HydrophobicContact CE-CB 4.24Å; A843-E847 PolarHBondContact O-N 3.42Å; A843-E847 VanDerWaalsContact O-N 3.1Å; N845-E847 VanDerWaalsContact C-N 3.3Å; N845-E847 PolarHBondContact O-N 3.37Å; E847-L851 HydrophobicContact CG-CD1 4.46Å; E847-L851 WeakPolarHBondContact O-CB 3.4Å; E847-L851 WeakPolarHBondContact O-CD1 3.33Å; E847-L851 VanDerWaalsContact O-CG 3.22Å; E847-L851 WeakPolarHBondContact O-CG 3.28Å; E847-L851 PolarHBondContact O-N 2.98Å; E847-R865 IonicContact OE1-CZ 2.68Å; E847-R865 IonicContact OE1-NH1 3.62Å; E847-R865 PolarHBondContact OE1-NH1 2.89Å; E847-R865 IonicContact OE1-NH2 2.79Å; E847-R865 IonicContact OE2-CZ 2.93Å; E847-R865 VanDerWaalsContact OE2-CZ 3.32Å; E847-R865 IonicContact OE2-NH1 3.56Å; E847-R865 PolarHBondContact OE2-NH1 3.3Å; E847-R865 IonicContact OE2-NH2 2.73Å; E847-R865 PolarHBondContact OE2-NH2 2.67Å; E847-L869 HydrophobicContact CB-CD1 4.34Å; E847-L869 HydrophobicContact CG-CD1 4.22Å
848	L	87.3	Confident	81.3	Confident	12 Å²	12	82.2 Å²	82.2	6%	0.063	43%	0.425	C	S	.	.	H	α-helix	trans	-64.9	-50.5	165.4	-80.4	168.8	0	0	0	111.4	V844 N845 R850 L851 D852 Y866 L869 L870 V873	V844-L848 HydrophobicContact CG1-CD1 4.16Å; V844-L848 WeakPolarHBondContact O-CB 3.48Å; V844-L848 VanDerWaalsContact O-CG 3.29Å; V844-L848 WeakPolarHBondContact O-CG 3.5Å; V844-L848 PolarHBondContact O-N 3Å; N845-L848 WeakPolarHBondContact O-CB 3.47Å; N845-L848 PolarHBondContact O-N 3.06Å; N845-L848 VanDerWaalsContact O-N 3.16Å; L848-R850 VanDerWaalsContact C-N 3.31Å; L848-R850 PolarHBondContact O-N 3.41Å; L848-L851 CarbonylContact O-C 3.59Å; L848-L851 PolarHBondContact O-N 3Å; L848-D852 WeakPolarHBondContact O-CB 3.36Å; L848-D852 PolarHBondContact O-N 3.14Å; L848-Y866 HydrophobicContact CD2-CD2 3.55Å; L848-Y866 HydrophobicContact CD2-CE2 3.86Å; L848-Y866 HydrophobicContact CD2-CG 4.02Å; L848-L869 HydrophobicContact CD1-CB 4.22Å; L848-L869 HydrophobicContact CD2-CB 3.63Å; L848-L869 HydrophobicContact CD2-CD1 4.39Å; L848-L869 HydrophobicContact CG-CB 3.77Å; L848-L869 HydrophobicContact CG-CD1 4.38Å; L848-L870 HydrophobicContact CD1-CD2 4.05Å; L848-L870 HydrophobicContact CD2-CD2 4.07Å; L848-L870 HydrophobicContact CD2-CG 3.89Å; L848-V873 HydrophobicContact CD1-CG2 3.6Å
849	D	83.3	Confident	82.2	Confident	114 Å²	114	79.6 Å²	79.6	61%	0.61	42%	0.415	S	S	*	.	H	α-helix	trans	-59.5	-41.5	178.5	-74.9	-19.3	0	0	0	111.5	N845 L851 D852 A853	N845-D849 PolarHBondContact O-N 3Å; D849-L851 PolarHBondContact O-N 3.33Å; D849-D852 PolarHBondContact O-N 3.4Å; D849-A853 VanDerWaalsContact O-CB 3.3Å; D849-A853 WeakPolarHBondContact O-CB 3.39Å; D849-A853 PolarHBondContact O-N 3.48Å
850	R	88.5	Confident	82.3	Confident	177 Å²	177	84 Å²	84	67%	0.668	44%	0.438	S	S	*	.	H	α-helix	trans	-60.1	-32.5	174.5	-178.3	-173.9	176.3	95.2	0.7	113.1	E846 L848	E846-R850 VanDerWaalsContact O-CB 3.28Å; E846-R850 WeakPolarHBondContact O-CB 3.18Å; E846-R850 PolarHBondContact O-N 2.75Å; L848-R850 VanDerWaalsContact C-N 3.31Å; L848-R850 PolarHBondContact O-N 3.41Å
851	L	86.1	Confident	82.1	Confident	9 Å²	9	85.7 Å²	85.7	5%	0.047	44%	0.442	C	S	.	.	H	α-helix	trans	-84.7	-41.3	177.4	-73.4	172.6	0	0	0	111.4	E847 L848 D849 A853 K854 M858 E862 Y866 L869	E847-L851 HydrophobicContact CG-CD1 4.46Å; E847-L851 WeakPolarHBondContact O-CB 3.4Å; E847-L851 WeakPolarHBondContact O-CD1 3.33Å; E847-L851 VanDerWaalsContact O-CG 3.22Å; E847-L851 WeakPolarHBondContact O-CG 3.28Å; E847-L851 PolarHBondContact O-N 2.98Å; L848-L851 CarbonylContact O-C 3.59Å; L848-L851 PolarHBondContact O-N 3Å; D849-L851 PolarHBondContact O-N 3.33Å; L851-A853 VanDerWaalsContact C-N 3.28Å; L851-A853 PolarHBondContact O-N 3.21Å; L851-K854 VanDerWaalsContact O-CB 3.32Å; L851-K854 WeakPolarHBondContact O-CB 3.49Å; L851-K854 PolarHBondContact O-N 3.39Å; L851-M858 HydrophobicContact CB-CE 4.08Å; L851-M858 HydrophobicContact CD2-CE 4.48Å; L851-M858 VanDerWaalsContact O-SD 3.37Å; L851-E862 HydrophobicContact CD2-CB 3.94Å; L851-E862 HydrophobicContact CD2-CG 3.95Å; L851-Y866 HydrophobicContact CB-CD2 3.78Å; L851-L869 HydrophobicContact CD1-CD1 4Å
852	D	82.6	Confident	82.4	Confident	76 Å²	76	84 Å²	84	41%	0.406	44%	0.437	S	S	.	.	H	α-helix	trans	-60.3	-38.3	176.9	-152.8	71.9	0	0	0	111.7	L848 D849 K854 Q855 Y866	L848-D852 WeakPolarHBondContact O-CB 3.36Å; L848-D852 PolarHBondContact O-N 3.14Å; D849-D852 PolarHBondContact O-N 3.4Å; D852-K854 PolarHBondContact O-N 3.44Å; D852-Q855 WeakPolarHBondContact O-CG 3.42Å; D852-Q855 PolarHBondContact O-N 3.11Å; D852-Y866 HydrophobicContact CB-CE2 4.01Å; D852-Y866 PolarHBondContact OD1-OH 3.01Å
853	A	83.2	Confident	82.7	Confident	84 Å²	84	81 Å²	81	69%	0.694	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-15.7	173.4	0	0	0	0	0	114.5	D849 L851	D849-A853 VanDerWaalsContact O-CB 3.3Å; D849-A853 WeakPolarHBondContact O-CB 3.39Å; D849-A853 PolarHBondContact O-N 3.48Å; L851-A853 VanDerWaalsContact C-N 3.28Å; L851-A853 PolarHBondContact O-N 3.21Å
854	K	81.4	Confident	82.8	Confident	80 Å²	80	85 Å²	85	35%	0.348	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-19.2	173.1	-62.7	-173.1	174.4	-165.5	0	113.6	L851 D852 N856 T857 M858 E862	L851-K854 VanDerWaalsContact O-CB 3.32Å; L851-K854 WeakPolarHBondContact O-CB 3.49Å; L851-K854 PolarHBondContact O-N 3.39Å; D852-K854 PolarHBondContact O-N 3.44Å; K854-N856 PolarHBondContact O-N 3.03Å; K854-T857 WeakPolarHBondContact O-CB 3.26Å; K854-T857 PolarHBondContact O-N 3Å; K854-T857 PolarHBondContact O-OG1 2.93Å; K854-M858 HydrophobicContact CB-CG 3.62Å; K854-M858 HydrophobicContact CD-CG 4.46Å; K854-E862 IonicContact NZ-OE1 3.42Å; K854-E862 PolarHBondContact NZ-OE1 3.03Å; K854-E862 IonicContact NZ-OE2 2.73Å
855	Q	77.6	Confident	82.8	Confident	143 Å²	143	89.1 Å²	89.1	67%	0.668	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	43.8	-126	-179.4	-57.7	-174.7	-16.9	0	0	111.9	D852 T857 M858	D852-Q855 WeakPolarHBondContact O-CG 3.42Å; D852-Q855 PolarHBondContact O-N 3.11Å; Q855-T857 PolarHBondContact O-N 2.9Å; Q855-M858 WeakPolarHBondContact O-CG 3.5Å; Q855-M858 PolarHBondContact O-N 3.35Å
856	N	75.1	Confident	83	Confident	164 Å²	164	89.6 Å²	89.6	88%	0.877	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-67.2	-1.2	-177.3	-63.8	15.8	0	0	0	114.8	K854	K854-N856 PolarHBondContact O-N 3.03Å
857	T	85.1	Confident	83.1	Confident	112 Å²	112	89.6 Å²	89.6	69%	0.687	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-95.9	-0.8	178.4	70.6	0	0	0	0	114.3	K854 Q855	K854-T857 WeakPolarHBondContact O-CB 3.26Å; K854-T857 PolarHBondContact O-N 3Å; K854-T857 PolarHBondContact O-OG1 2.93Å; Q855-T857 PolarHBondContact O-N 2.9Å
858	M	85.6	Confident	83.1	Confident	21 Å²	21	90.6 Å²	90.6	10%	0.103	44%	0.444	C	S	.	.			trans	-63.4	132.1	176.7	-66.3	169.9	66.5	0	0	112.4	L851 K854 Q855 E862 Q863 Y866	L851-M858 HydrophobicContact CB-CE 4.08Å; L851-M858 HydrophobicContact CD2-CE 4.48Å; L851-M858 VanDerWaalsContact O-SD 3.37Å; K854-M858 HydrophobicContact CB-CG 3.62Å; K854-M858 HydrophobicContact CD-CG 4.46Å; Q855-M858 WeakPolarHBondContact O-CG 3.5Å; Q855-M858 PolarHBondContact O-N 3.35Å; M858-E862 HydrophobicContact CB-CB 4.23Å; M858-E862 HydrophobicContact CE-CB 4.29Å; M858-E862 WeakPolarHBondContact CE-O 3.47Å; M858-Q863 HydrophobicContact CB-CG 3.72Å; M858-Q863 HydrophobicContact CE-CG 4.21Å; M858-Q863 PolarHBondContact O-NE2 2.93Å; M858-Y866 HydrophobicContact CE-CD2 4.13Å; M858-Y866 HydrophobicContact CE-CG 3.88Å
859	T	88.9	Confident	83.1	Confident	80 Å²	80	90 Å²	90	49%	0.491	44%	0.441	S	S	.	.			trans	-67.8	164.3	171.7	61.1	0	0	0	0	112.2	D861 E862 Q863	T859-D861 VanDerWaalsContact C-N 3.3Å; T859-D861 PolarHBondContact O-N 2.85Å; T859-E862 WeakPolarHBondContact CB-OE2 3.22Å; T859-E862 WeakPolarHBondContact CG2-OE2 3.19Å; T859-E862 PolarHBondContact N-OE2 3.34Å; T859-E862 WeakPolarHBondContact O-CB 3.46Å; T859-E862 PolarHBondContact O-N 2.91Å; T859-E862 VanDerWaalsContact O-N 3.13Å; T859-E862 WeakPolarHBondContact OG1-CB 3.25Å; T859-E862 VanDerWaalsContact OG1-CD 3.24Å; T859-E862 VanDerWaalsContact OG1-CG 3.25Å; T859-E862 WeakPolarHBondContact OG1-CG 3.35Å; T859-E862 PolarHBondContact OG1-OE2 3.13Å; T859-Q863 WeakPolarHBondContact O-CG 3.42Å; T859-Q863 PolarHBondContact O-N 3.43Å
860	I	78.9	Confident	83.2	Confident	127 Å²	127	88.3 Å²	88.3	65%	0.651	43%	0.431	S	S	*	.	H	α-helix	trans	-59.7	-38.9	-176.4	-63.2	174.2	0	0	0	112.2	Q863 R864	I860-Q863 PolarHBondContact O-N 2.87Å; I860-R864 PolarHBondContact O-N 3.46Å
861	D	76.5	Confident	83	Confident	102 Å²	102	85 Å²	85	55%	0.545	43%	0.427	S	S	.	.	H	α-helix	trans	-73.8	-33	177.4	-66.4	-52.2	0	0	0	112.3	T859 R864 R865	T859-D861 VanDerWaalsContact C-N 3.3Å; T859-D861 PolarHBondContact O-N 2.85Å; D861-R864 WeakPolarHBondContact O-CB 3.37Å; D861-R864 PolarHBondContact O-N 3.24Å; D861-R864 IonicContact OD1-CZ 2.71Å; D861-R864 IonicContact OD1-NH1 3.17Å; D861-R864 PolarHBondContact OD1-NH1 3.35Å; D861-R864 IonicContact OD1-NH2 3.21Å; D861-R865 WeakPolarHBondContact O-CB 3.36Å; D861-R865 PolarHBondContact O-N 2.98Å
862	E	82.9	Confident	82.9	Confident	46 Å²	46	85.6 Å²	85.6	22%	0.215	43%	0.43	C	S	.	.	H	α-helix	trans	-66.3	-40.5	170.7	-73.3	171.2	134.7	0	0	111.8	L851 K854 M858 T859 R864 R865 Y866	L851-E862 HydrophobicContact CD2-CB 3.94Å; L851-E862 HydrophobicContact CD2-CG 3.95Å; K854-E862 IonicContact NZ-OE1 3.42Å; K854-E862 PolarHBondContact NZ-OE1 3.03Å; K854-E862 IonicContact NZ-OE2 2.73Å; M858-E862 HydrophobicContact CB-CB 4.23Å; M858-E862 HydrophobicContact CE-CB 4.29Å; M858-E862 WeakPolarHBondContact CE-O 3.47Å; T859-E862 WeakPolarHBondContact CB-OE2 3.22Å; T859-E862 WeakPolarHBondContact CG2-OE2 3.19Å; T859-E862 PolarHBondContact N-OE2 3.34Å; T859-E862 WeakPolarHBondContact O-CB 3.46Å; T859-E862 PolarHBondContact O-N 2.91Å; T859-E862 VanDerWaalsContact O-N 3.13Å; T859-E862 WeakPolarHBondContact OG1-CB 3.25Å; T859-E862 VanDerWaalsContact OG1-CD 3.24Å; T859-E862 VanDerWaalsContact OG1-CG 3.25Å; T859-E862 WeakPolarHBondContact OG1-CG 3.35Å; T859-E862 PolarHBondContact OG1-OE2 3.13Å; E862-R864 PolarHBondContact O-N 3.29Å; E862-R865 PolarHBondContact O-N 3.33Å; E862-Y866 VanDerWaalsContact O-CB 3.3Å; E862-Y866 WeakPolarHBondContact O-CB 3.47Å; E862-Y866 PolarHBondContact O-N 2.95Å
863	Q	82.8	Confident	83	Confident	79 Å²	79	83.1 Å²	83.1	37%	0.369	42%	0.418	S	S	.	.	H	α-helix	trans	-66.5	-23.6	172.5	-67.2	179.2	23.9	0	0	112.9	M858 T859 I860 R867	M858-Q863 HydrophobicContact CB-CG 3.72Å; M858-Q863 HydrophobicContact CE-CG 4.21Å; M858-Q863 PolarHBondContact O-NE2 2.93Å; T859-Q863 WeakPolarHBondContact O-CG 3.42Å; T859-Q863 PolarHBondContact O-N 3.43Å; I860-Q863 PolarHBondContact O-N 2.87Å; Q863-R867 PolarHBondContact O-NE 2.91Å; Q863-R867 PolarHBondContact O-NH2 2.78Å
864	R	82.4	Confident	82.9	Confident	117 Å²	117	81.1 Å²	81.1	44%	0.442	40%	0.401	S	S	.	.	H	α-helix	trans	-75.2	-52.2	169.2	-174.7	-174.2	-63.1	139.3	7.3	110	I860 D861 E862 Y866 R867 E868	I860-R864 PolarHBondContact O-N 3.46Å; D861-R864 WeakPolarHBondContact O-CB 3.37Å; D861-R864 PolarHBondContact O-N 3.24Å; D861-R864 IonicContact OD1-CZ 2.71Å; D861-R864 IonicContact OD1-NH1 3.17Å; D861-R864 PolarHBondContact OD1-NH1 3.35Å; D861-R864 IonicContact OD1-NH2 3.21Å; E862-R864 PolarHBondContact O-N 3.29Å; R864-Y866 VanDerWaalsContact C-N 3.33Å; R864-Y866 PolarHBondContact O-N 2.96Å; R864-R867 WeakPolarHBondContact O-CA 3.43Å; R864-R867 WeakPolarHBondContact O-CB 3.44Å; R864-R867 PolarHBondContact O-N 2.69Å; R864-E868 HydrophobicContact CG-CG 4.47Å; R864-E868 PolarHBondContact O-N 3.27Å
865	R	82.1	Confident	82.7	Confident	87 Å²	87	83.2 Å²	83.2	33%	0.328	41%	0.412	S	S	.	.	H	α-helix	trans	-62.3	-37.7	-176.1	-167.8	162.7	179.3	-113.1	-12.3	112.7	E847 D861 E862 E868 L869	E847-R865 IonicContact OE1-CZ 2.68Å; E847-R865 IonicContact OE1-NH1 3.62Å; E847-R865 PolarHBondContact OE1-NH1 2.89Å; E847-R865 IonicContact OE1-NH2 2.79Å; E847-R865 IonicContact OE2-CZ 2.93Å; E847-R865 VanDerWaalsContact OE2-CZ 3.32Å; E847-R865 IonicContact OE2-NH1 3.56Å; E847-R865 PolarHBondContact OE2-NH1 3.3Å; E847-R865 IonicContact OE2-NH2 2.73Å; E847-R865 PolarHBondContact OE2-NH2 2.67Å; D861-R865 WeakPolarHBondContact O-CB 3.36Å; D861-R865 PolarHBondContact O-N 2.98Å; E862-R865 PolarHBondContact O-N 3.33Å; R865-E868 PolarHBondContact O-N 2.9Å; R865-L869 HydrophobicContact CG-CD1 4.26Å; R865-L869 WeakPolarHBondContact O-CB 3.48Å; R865-L869 VanDerWaalsContact O-CG 3.28Å; R865-L869 WeakPolarHBondContact O-CG 3.46Å; R865-L869 PolarHBondContact O-N 3.35Å
866	Y	87.1	Confident	82.7	Confident	56 Å²	56	78.7 Å²	78.7	22%	0.22	39%	0.391	C	S	.	.	H	α-helix	trans	-59.5	-43.3	170.6	-179.9	-91.5	0	0	0	112.4	L848 L851 D852 M858 E862 R864 L869 L870	L848-Y866 HydrophobicContact CD2-CD2 3.55Å; L848-Y866 HydrophobicContact CD2-CE2 3.86Å; L848-Y866 HydrophobicContact CD2-CG 4.02Å; L851-Y866 HydrophobicContact CB-CD2 3.78Å; D852-Y866 HydrophobicContact CB-CE2 4.01Å; D852-Y866 PolarHBondContact OD1-OH 3.01Å; M858-Y866 HydrophobicContact CE-CD2 4.13Å; M858-Y866 HydrophobicContact CE-CG 3.88Å; E862-Y866 VanDerWaalsContact O-CB 3.3Å; E862-Y866 WeakPolarHBondContact O-CB 3.47Å; E862-Y866 PolarHBondContact O-N 2.95Å; R864-Y866 VanDerWaalsContact C-N 3.33Å; R864-Y866 PolarHBondContact O-N 2.96Å; Y866-L869 PolarHBondContact O-N 2.96Å; Y866-L870 HydrophobicContact CD1-CD1 3.84Å; Y866-L870 HydrophobicContact CD1-CG 4.42Å; Y866-L870 HydrophobicContact CE1-CD1 3.49Å; Y866-L870 VanDerWaalsContact CE1-CD1 3.49Å; Y866-L870 HydrophobicContact CE1-CG 4.26Å; Y866-L870 WeakPolarHBondContact O-CG 3.27Å; Y866-L870 PolarHBondContact O-N 3.36Å
867	R	85	Confident	82.7	Confident	148 Å²	148	73.3 Å²	73.3	56%	0.558	37%	0.367	S	S	*	.	H	α-helix	trans	-67.8	-34.6	174.8	-82.8	178.3	-82.2	-174.5	-12.4	113	Q863 R864 N871	Q863-R867 PolarHBondContact O-NE 2.91Å; Q863-R867 PolarHBondContact O-NH2 2.78Å; R864-R867 WeakPolarHBondContact O-CA 3.43Å; R864-R867 WeakPolarHBondContact O-CB 3.44Å; R864-R867 PolarHBondContact O-N 2.69Å; R867-N871 PolarHBondContact O-N 2.81Å
868	E	83.8	Confident	82.3	Confident	69 Å²	69	76 Å²	76	32%	0.322	36%	0.364	S	S	.	.	H	α-helix	trans	-68.7	-43.7	174.5	-70.4	176.1	147.7	0	0	111.3	R864 R865 N871 V872	R864-E868 HydrophobicContact CG-CG 4.47Å; R864-E868 PolarHBondContact O-N 3.27Å; R865-E868 PolarHBondContact O-N 2.9Å; E868-N871 PolarHBondContact O-N 2.89Å; E868-V872 PolarHBondContact O-N 3.02Å; E868-V872 VanDerWaalsContact O-N 3.15Å
869	L	86.8	Confident	81.5	Confident	0 Å²	0	77.2 Å²	77.2	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-61.9	-42.9	174.4	-71.2	164.2	0	0	0	112.3	T836 M839 V844 E847 L848 L851 R865 Y866 N871 V872 V873	T836-L869 HydrophobicContact CG2-CD2 3.76Å; T836-L869 HydrophobicContact CG2-CG 4.4Å; M839-L869 HydrophobicContact CE-CD2 4.27Å; M839-L869 HydrophobicContact SD-CD2 3.97Å; V844-L869 HydrophobicContact CB-CD2 4.4Å; V844-L869 HydrophobicContact CG1-CB 4.19Å; V844-L869 HydrophobicContact CG1-CD2 3.89Å; V844-L869 HydrophobicContact CG2-CD2 4.32Å; E847-L869 HydrophobicContact CB-CD1 4.34Å; E847-L869 HydrophobicContact CG-CD1 4.22Å; L848-L869 HydrophobicContact CD1-CB 4.22Å; L848-L869 HydrophobicContact CD2-CB 3.63Å; L848-L869 HydrophobicContact CD2-CD1 4.39Å; L848-L869 HydrophobicContact CG-CB 3.77Å; L848-L869 HydrophobicContact CG-CD1 4.38Å; L851-L869 HydrophobicContact CD1-CD1 4Å; R865-L869 HydrophobicContact CG-CD1 4.26Å; R865-L869 WeakPolarHBondContact O-CB 3.48Å; R865-L869 VanDerWaalsContact O-CG 3.28Å; R865-L869 WeakPolarHBondContact O-CG 3.46Å; R865-L869 PolarHBondContact O-N 3.35Å; Y866-L869 PolarHBondContact O-N 2.96Å; L869-N871 VanDerWaalsContact C-N 3.29Å; L869-N871 PolarHBondContact O-N 3.29Å; L869-V872 PolarHBondContact O-N 2.86Å; L869-V872 VanDerWaalsContact O-N 3.08Å; L869-V873 PolarHBondContact O-N 2.75Å
870	L	86.1	Confident	80.6	Confident	77 Å²	77	80.8 Å²	80.8	40%	0.403	38%	0.382	S	S	.	.	H	α-helix	trans	-58.9	-37.7	175.1	-77.8	176.8	0	0	0	112.9	L848 Y866 V873 A874	L848-L870 HydrophobicContact CD1-CD2 4.05Å; L848-L870 HydrophobicContact CD2-CD2 4.07Å; L848-L870 HydrophobicContact CD2-CG 3.89Å; Y866-L870 HydrophobicContact CD1-CD1 3.84Å; Y866-L870 HydrophobicContact CD1-CG 4.42Å; Y866-L870 HydrophobicContact CE1-CD1 3.49Å; Y866-L870 VanDerWaalsContact CE1-CD1 3.49Å; Y866-L870 HydrophobicContact CE1-CG 4.26Å; Y866-L870 WeakPolarHBondContact O-CG 3.27Å; Y866-L870 PolarHBondContact O-N 3.36Å; L870-V873 PolarHBondContact O-N 3.17Å; L870-A874 PolarHBondContact O-N 3.48Å; L870-A874 VanDerWaalsContact O-N 3.12Å
871	N	84.3	Confident	80	Confident	109 Å²	109	80.7 Å²	80.7	58%	0.583	38%	0.377	S	S	*	.	H	α-helix	trans	-66.2	-40.4	174.1	-75.9	-24.5	0	0	0	111.6	R867 E868 L869 A874 E875	R867-N871 PolarHBondContact O-N 2.81Å; E868-N871 PolarHBondContact O-N 2.89Å; L869-N871 VanDerWaalsContact C-N 3.29Å; L869-N871 PolarHBondContact O-N 3.29Å; N871-A874 WeakPolarHBondContact O-CB 3.34Å; N871-A874 PolarHBondContact O-N 3.09Å; N871-A874 VanDerWaalsContact O-N 3.17Å; N871-E875 PolarHBondContact O-N 3.01Å
872	V	83.4	Confident	79.3	Confident	21 Å²	21	80.7 Å²	80.7	13%	0.127	38%	0.376	C	S	.	.	H	α-helix	trans	-63.3	-41.1	175.8	174.7	0	0	0	0	111.6	T836 V844 E868 L869 A874 E875 Q876	T836-V872 HydrophobicContact CG2-CG2 4.3Å; V844-V872 HydrophobicContact CG2-CG1 4.12Å; E868-V872 PolarHBondContact O-N 3.02Å; E868-V872 VanDerWaalsContact O-N 3.15Å; L869-V872 PolarHBondContact O-N 2.86Å; L869-V872 VanDerWaalsContact O-N 3.08Å; V872-A874 VanDerWaalsContact C-N 3.31Å; V872-A874 PolarHBondContact O-N 3.05Å; V872-E875 PolarHBondContact O-N 2.92Å; V872-Q876 HydrophobicContact CG1-CG 4.16Å; V872-Q876 WeakPolarHBondContact O-CB 3.4Å; V872-Q876 WeakPolarHBondContact O-CG 3.5Å; V872-Q876 PolarHBondContact O-N 3.47Å
873	V	83.4	Confident	77.8	Confident	24 Å²	24	84.1 Å²	84.1	15%	0.145	40%	0.395	C	S	.	.	H	α-helix	trans	-58.7	-43.5	172.3	177.9	0	0	0	0	111.1	Y841 V844 L848 L869 L870 S877	Y841-V873 HydrophobicContact CE2-CG1 4.15Å; V844-V873 HydrophobicContact CB-CG2 4.46Å; V844-V873 HydrophobicContact CG1-CG2 3.38Å; L848-V873 HydrophobicContact CD1-CG2 3.6Å; L869-V873 PolarHBondContact O-N 2.75Å; L870-V873 PolarHBondContact O-N 3.17Å; V873-S877 VanDerWaalsContact O-CB 3.24Å; V873-S877 WeakPolarHBondContact O-CB 3.07Å; V873-S877 PolarHBondContact O-N 3.35Å; V873-S877 PolarHBondContact O-OG 2.75Å
874	A	81.4	Confident	76.2	Confident	41 Å²	41	84 Å²	84	34%	0.339	40%	0.403	S	S	.	.	H	α-helix	trans	-65.4	-38.2	179	0	0	0	0	0	112.7	L870 N871 V872 R878	L870-A874 PolarHBondContact O-N 3.48Å; L870-A874 VanDerWaalsContact O-N 3.12Å; N871-A874 WeakPolarHBondContact O-CB 3.34Å; N871-A874 PolarHBondContact O-N 3.09Å; N871-A874 VanDerWaalsContact O-N 3.17Å; V872-A874 VanDerWaalsContact C-N 3.31Å; V872-A874 PolarHBondContact O-N 3.05Å; A874-R878 WeakPolarHBondContact O-CG 3.28Å; A874-R878 PolarHBondContact O-N 2.72Å; A874-R878 VanDerWaalsContact O-N 3.08Å
875	E	78.3	Confident	74.7	Confident	125 Å²	125	82.7 Å²	82.7	58%	0.584	40%	0.402	S	S	*	.	H	α-helix	trans	-72.5	-45.4	176.4	-70.5	-170.3	154	0	0	112.6	N871 V872 S877 R878 A879	N871-E875 PolarHBondContact O-N 3.01Å; V872-E875 PolarHBondContact O-N 2.92Å; E875-S877 PolarHBondContact O-N 3.45Å; E875-R878 PolarHBondContact O-N 3.14Å; E875-R878 VanDerWaalsContact O-N 3.12Å; E875-A879 PolarHBondContact O-N 3.44Å
876	Q	76.9	Confident	73.2	Confident	47 Å²	47	84.9 Å²	84.9	22%	0.22	42%	0.419	C	S	.	.	H	α-helix	trans	-60.7	-35	174.6	-69.2	-175.6	3.8	0	0	111.6	M839 Y841 V872 R880	M839-Q876 PolarHBondContact O-NE2 2.82Å; M839-Q876 VanDerWaalsContact O-NE2 3.09Å; Y841-Q876 VanDerWaalsContact CA-OE1 3.29Å; Y841-Q876 HydrophobicContact CD2-CB 4.19Å; V872-Q876 HydrophobicContact CG1-CG 4.16Å; V872-Q876 WeakPolarHBondContact O-CB 3.4Å; V872-Q876 WeakPolarHBondContact O-CG 3.5Å; V872-Q876 PolarHBondContact O-N 3.47Å; Q876-R880 PolarHBondContact O-N 2.8Å
877	S	75.7	Confident	70.9	Confident	52 Å²	52	91.5 Å²	91.5	36%	0.364	44%	0.444	S	S	.	.	H	α-helix	trans	-66.9	-41.8	173.4	-60.8	0	0	0	0	112.8	V873 E875 K881	V873-S877 VanDerWaalsContact O-CB 3.24Å; V873-S877 WeakPolarHBondContact O-CB 3.07Å; V873-S877 PolarHBondContact O-N 3.35Å; V873-S877 PolarHBondContact O-OG 2.75Å; E875-S877 PolarHBondContact O-N 3.45Å; S877-K881 PolarHBondContact O-N 3.09Å; S877-K881 VanDerWaalsContact O-N 3.11Å
878	R	75.6	Confident	68.6	Low	168 Å²	168	88.2 Å²	88.2	63%	0.634	44%	0.443	S	S	*	.	H	α-helix	trans	-64.4	-43.5	174.3	-74.4	168.4	179.9	155.6	0.3	111.7	A874 E875 K881 L882	A874-R878 WeakPolarHBondContact O-CG 3.28Å; A874-R878 PolarHBondContact O-N 2.72Å; A874-R878 VanDerWaalsContact O-N 3.08Å; E875-R878 PolarHBondContact O-N 3.14Å; E875-R878 VanDerWaalsContact O-N 3.12Å; R878-K881 PolarHBondContact O-N 3.49Å; R878-L882 PolarHBondContact O-N 3.37Å
879	A	69.9	Low	66.3	Low	47 Å²	47	90.2 Å²	90.2	39%	0.388	46%	0.463	S	S	.	.	H	α-helix	trans	-61.2	-45.4	177.9	0	0	0	0	0	111.8	E875 K881 L882 L883	E875-A879 PolarHBondContact O-N 3.44Å; A879-K881 VanDerWaalsContact C-N 3.32Å; A879-K881 PolarHBondContact O-N 3.16Å; A879-L882 PolarHBondContact O-N 3.47Å; A879-L883 WeakPolarHBondContact O-CG 3.5Å; A879-L883 PolarHBondContact O-N 2.98Å
880	R	68.8	Low	63.7	Low	154 Å²	154	96.5 Å²	96.5	58%	0.581	50%	0.503	S	S	*	.	H	α-helix	trans	-59.8	-38.8	173.5	-82.1	179.2	161.1	171.6	-7.1	112.7	Q876 L883 S884	Q876-R880 PolarHBondContact O-N 2.8Å; R880-L883 PolarHBondContact O-N 2.9Å; R880-S884 PolarHBondContact O-N 2.83Å
881	K	66.3	Low	60.9	Low	126 Å²	126	99.3 Å²	99.3	55%	0.548	52%	0.524	S	S	.	.	H	α-helix	trans	-65.1	-46.9	175.9	-168.9	171.9	-173.2	-82.7	0	112.1	S877 R878 A879 L883 S884 E885	S877-K881 PolarHBondContact O-N 3.09Å; S877-K881 VanDerWaalsContact O-N 3.11Å; R878-K881 PolarHBondContact O-N 3.49Å; A879-K881 VanDerWaalsContact C-N 3.32Å; A879-K881 PolarHBondContact O-N 3.16Å; K881-L883 VanDerWaalsContact C-N 3.33Å; K881-L883 PolarHBondContact O-N 3.26Å; K881-S884 PolarHBondContact O-N 3.07Å; K881-S884 PolarHBondContact O-OG 2.74Å; K881-E885 IonicContact NZ-OE1 3.24Å; K881-E885 PolarHBondContact NZ-OE1 2.92Å; K881-E885 WeakPolarHBondContact O-CG 3.27Å; K881-E885 PolarHBondContact O-N 3.3Å
882	L	62.7	Low	58.4	Low	102 Å²	102	99.1 Å²	99.1	53%	0.534	53%	0.531	S	S	.	.	H	α-helix	trans	-60.1	-41.2	176.2	-72	167.1	0	0	0	112.2	R878 A879 S884 E885 I886	R878-L882 PolarHBondContact O-N 3.37Å; A879-L882 PolarHBondContact O-N 3.47Å; L882-S884 VanDerWaalsContact C-N 3.29Å; L882-S884 PolarHBondContact O-N 3.38Å; L882-E885 PolarHBondContact O-N 2.85Å; L882-I886 WeakPolarHBondContact O-CD1 3.35Å; L882-I886 VanDerWaalsContact O-CG1 3.28Å; L882-I886 WeakPolarHBondContact O-CG1 3.45Å; L882-I886 PolarHBondContact O-N 3.41Å
883	L	50.5	Low	55.8	Low	117 Å²	117	109.8 Å²	109.8	61%	0.613	57%	0.571	S	S	*	*	H	α-helix	trans	-63.3	-32.5	174.4	-72.6	166.7	0	0	0	112.9	A879 R880 K881	A879-L883 WeakPolarHBondContact O-CG 3.5Å; A879-L883 PolarHBondContact O-N 2.98Å; R880-L883 PolarHBondContact O-N 2.9Å; K881-L883 VanDerWaalsContact C-N 3.33Å; K881-L883 PolarHBondContact O-N 3.26Å
884	S	51	Low	53.5	Low	77 Å²	77	117.4 Å²	117.4	54%	0.538	61%	0.605	S	S	.	*	H	α-helix	trans	-72.5	-32.3	173.7	73.4	0	0	0	0	113.3	R880 K881 L882	R880-S884 PolarHBondContact O-N 2.83Å; K881-S884 PolarHBondContact O-N 3.07Å; K881-S884 PolarHBondContact O-OG 2.74Å; L882-S884 VanDerWaalsContact C-N 3.29Å; L882-S884 PolarHBondContact O-N 3.38Å
885	E	49	Very low	50.9	Low	89 Å²	89	123.8 Å²	123.8	42%	0.416	63%	0.628	S	S	.	*	H	α-helix	trans	-74.3	-40	178.3	-70.9	166.9	176.8	0	0	111.3	K881 L882 R887 S888	K881-E885 IonicContact NZ-OE1 3.24Å; K881-E885 PolarHBondContact NZ-OE1 2.92Å; K881-E885 WeakPolarHBondContact O-CG 3.27Å; K881-E885 PolarHBondContact O-N 3.3Å; L882-E885 PolarHBondContact O-N 2.85Å; E885-R887 PolarHBondContact O-N 3.31Å; E885-S888 PolarHBondContact O-N 3.14Å; E885-S888 PolarHBondContact O-OG 2.84Å
886	I	50.9	Low	48.5	Very low	134 Å²	134	129.1 Å²	129.1	69%	0.687	64%	0.642	S	S	*	*	H	α-helix	trans	-62.4	-25.3	175.8	-68.9	163.9	0	0	0	112.9	L882 S888	L882-I886 WeakPolarHBondContact O-CD1 3.35Å; L882-I886 VanDerWaalsContact O-CG1 3.28Å; L882-I886 WeakPolarHBondContact O-CG1 3.45Å; L882-I886 PolarHBondContact O-N 3.41Å; I886-S888 PolarHBondContact O-N 3.01Å
887	R	40.2	Very low	45.9	Very low	195 Å²	195	134.9 Å²	134.9	74%	0.736	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	20.5	-177.4	-151.3	175.3	-178.8	-177.6	-1.1	113.6	E885	E885-R887 PolarHBondContact O-N 3.31Å
888	S	36.9	Very low	43.5	Very low	78 Å²	78	139 Å²	139	55%	0.545	69%	0.686	S	S	.	*	S	Bend	trans	-125.2	129.8	-179.7	64.1	0	0	0	0	112.4	E885 I886	E885-S888 PolarHBondContact O-N 3.14Å; E885-S888 PolarHBondContact O-OG 2.84Å; I886-S888 PolarHBondContact O-N 3.01Å
889	P	34.4	Very low	41.3	Very low	112 Å²	112	136.1 Å²	136.1	73%	0.727	69%	0.689	S	S	*	*			trans	-79.6	146.5	-179.4	31.9	-34.2	0	0	0	111.9
890	P	31.4	Very low	39.1	Very low	132 Å²	132	141.4 Å²	141.4	86%	0.857	71%	0.709	S	S	*	*			trans	-76.8	133.8	-177.8	30.8	-34.8	0	0	0	112.5
891	T	28.1	Very low	37	Very low	135 Å²	135	141.8 Å²	141.8	83%	0.828	72%	0.717	S	S	*	*			trans	-114.8	94.8	176.1	37.7	0	0	0	0	112.3
892	S	32.6	Very low	35	Very low	106 Å²	106	141 Å²	141	74%	0.741	72%	0.722	S	S	*	*			trans	165.2	125.1	134.8	44.1	0	0	0	0	112.1
893	Y	28.1	Very low	33.1	Very low	245 Å²	245	145.1 Å²	145.1	96%	0.961	74%	0.739	S	S	*	*			trans	-142.5	147.7	149.2	-92.9	-78.2	0	0	0	108
894	Q	34.7	Very low	32	Very low	184 Å²	184	147.4 Å²	147.4	86%	0.86	74%	0.744	S	S	*	*			trans	-104.8	139.2	-175.5	-58	169.1	-41.4	0	0	110
895	E	28	Very low	30.7	Very low	175 Å²	175	151.5 Å²	151.5	82%	0.818	76%	0.755	S	S	*	*			trans	-165.1	121.1	146.5	-106.6	160	-178.1	0	0	108
896	R	25.9	Very low	29.6	Very low	237 Å²	237	154 Å²	154	89%	0.894	77%	0.766	S	S	*	*				79.2	158.7	83.4	-69.6	-170.1	-171.8	-156.9	3.6	113.7
897	E	23.1	Very low	28.4	Very low	168 Å²	168	156.2 Å²	156.2	79%	0.785	77%	0.774	S	S	*	*			trans	-125.4	159.3	-148.2	-113.1	-177.3	165.5	0	0	113.8
898	I	24.8	Very low	27.7	Very low	138 Å²	138	154.6 Å²	154.6	71%	0.708	77%	0.774	S	S	*	*			trans	72.1	147.8	147.9	-72.5	165.4	0	0	0	117.5
899	P	31.1	Very low	27.2	Very low	108 Å²	108	158.1 Å²	158.1	70%	0.701	78%	0.782	S	S	*	*			cis	-121.7	-168.2	-27.9	27.9	-4.4	0	0	0	112.5
900	I	23.7	Very low	26.9	Very low	157 Å²	157	161.1 Å²	161.1	81%	0.805	78%	0.779	S	S	*	*				-173.9	158.8	75.2	-80.2	-178	0	0	0	112.3
901	H	23.6	Very low	26.8	Very low	162 Å²	162	165.2 Å²	165.2	75%	0.75	78%	0.777	S	S	*	*			trans	-23.4	144.6	171.1	-90.6	19.5	0	0	0	121.3
902	V	23.7	Very low	26.8	Very low	109 Å²	109	164.8 Å²	164.8	66%	0.661	77%	0.766	S	S	*	*				72.4	128.6	65.9	173.8	0	0	0	0	111.5
903	Q	23.6	Very low	26.7	Very low	189 Å²	189	165.6 Å²	165.6	88%	0.883	77%	0.766	S	S	*	*				-157.8	-161	60.6	-146.6	152.1	33.6	0	0	115.1
904	K	28.1	Very low	26.7	Very low	166 Å²	166	159.4 Å²	159.4	72%	0.722	75%	0.754	S	S	*	*			trans	-126.7	152.3	-169	-66.1	179.8	169.8	-173.2	0	116	Q906	K904-Q906 VanDerWaalsContact CD-OE1 3.31Å
905	E	23.3	Very low	26.4	Very low	163 Å²	163	157.1 Å²	157.1	76%	0.762	75%	0.746	S	S	*	*			trans	-148.7	154.5	140.6	-76.1	-153	81.1	0	0	109
906	Q	24.9	Very low	26.4	Very low	141 Å²	141	155.7 Å²	155.7	66%	0.659	74%	0.744	S	S	*	*			cis	94.9	56.9	-10.8	-54.2	-173.7	-164.4	0	0	122.5	K904	K904-Q906 VanDerWaalsContact CD-OE1 3.31Å
907	Q	25.4	Very low	26.4	Very low	181 Å²	181	151.5 Å²	151.5	85%	0.846	74%	0.739	S	S	*	*			trans	-151	-179.9	154.1	-114.9	170.1	90.6	0	0	115.4
908	Q	26	Very low	26.6	Very low	160 Å²	160	150.6 Å²	150.6	75%	0.748	74%	0.738	S	S	*	*				-149.4	169.8	-115.6	-144	-176.9	27.9	0	0	117.1
909	H	27.9	Very low	27.3	Very low	152 Å²	152	148.7 Å²	148.7	70%	0.704	74%	0.735	S	S	*	*			trans	69.6	169.3	164.6	-74.3	89.1	0	0	0	120.1
910	R	27.1	Very low	27	Very low	176 Å²	176	153 Å²	153	66%	0.664	75%	0.745	S	S	*	*				178.9	140.1	-53.5	177.5	179.8	172.4	-175.8	-2.2	111.7	E912	R910-E912 IonicContact CZ-OE1 3.15Å; R910-E912 IonicContact NE-OE1 2.75Å; R910-E912 PolarHBondContact NE-OE1 3.34Å; R910-E912 IonicContact NH2-OE1 2.7Å; R910-E912 PolarHBondContact NH2-OE1 2.84Å; R910-E912 IonicContact NH2-OE2 3.61Å
911	R	28.8	Very low	27.1	Very low	218 Å²	218	150.6 Å²	150.6	82%	0.823	74%	0.743	S	S	*	*			trans	145.2	137.6	150.6	-83.4	170.4	171.9	166.3	-1.1	111
912	E	29.3	Very low	27.2	Very low	125 Å²	125	147.6 Å²	147.6	58%	0.584	74%	0.74	S	S	*	*			cis	78.5	133	46.3	-66.6	159.4	-147.1	0	0	112.7	R910	R910-E912 IonicContact CZ-OE1 3.15Å; R910-E912 IonicContact NE-OE1 2.75Å; R910-E912 PolarHBondContact NE-OE1 3.34Å; R910-E912 IonicContact NH2-OE1 2.7Å; R910-E912 PolarHBondContact NH2-OE1 2.84Å; R910-E912 IonicContact NH2-OE2 3.61Å
913	T	30.5	Very low	27.3	Very low	123 Å²	123	147.6 Å²	147.6	76%	0.755	75%	0.745	S	S	*	*			cis	-138.1	178.4	17.7	43.5	0	0	0	0	110.9
914	V	26.5	Very low	27.6	Very low	116 Å²	116	143.2 Å²	143.2	70%	0.703	74%	0.735	S	S	*	*				-178	118.7	72.8	166.6	0	0	0	0	105.8
915	I	29.8	Very low	27.6	Very low	135 Å²	135	141.2 Å²	141.2	69%	0.692	74%	0.737	S	S	*	*				58.9	127.7	97.9	-77.6	167.1	0	0	0	115
916	D	26.8	Very low	27.8	Very low	145 Å²	145	140.9 Å²	140.9	78%	0.775	74%	0.735	S	S	*	*			cis	-139.9	-130.8	-16.5	-87.7	-35.1	0	0	0	109.5
917	D	25.9	Very low	27.9	Very low	149 Å²	149	140.2 Å²	140.2	80%	0.797	74%	0.736	S	S	*	*			cis	-160.6	-173.2	4.8	-164.2	1.3	0	0	0	110.9
918	I	28.2	Very low	27.9	Very low	149 Å²	149	137.6 Å²	137.6	76%	0.764	73%	0.732	S	S	*	*			trans	-146.2	-160.6	-159.6	-4.9	175.9	0	0	0	111.6
919	P	39.5	Very low	27.8	Very low	99 Å²	99	135 Å²	135	64%	0.643	73%	0.731	S	S	*	*			cis	-132.4	-175	-37	37.2	-18.8	0	0	0	115.1
920	H	24.9	Very low	29	Very low	198 Å²	198	133.3 Å²	133.3	92%	0.917	73%	0.734	S	S	*	*			trans	-135.7	151.1	160.1	-84.2	-16	0	0	0	111.7
921	S	26.4	Very low	28.9	Very low	107 Å²	107	131.6 Å²	131.6	75%	0.748	74%	0.743	S	S	*	*			trans	-154.6	138.7	-168.3	58.1	0	0	0	0	118.2
922	S	25.5	Very low	28.8	Very low	98 Å²	98	126.5 Å²	126.5	69%	0.685	74%	0.741	S	S	*	*			trans	66.4	124.2	135.6	63.5	0	0	0	0	125.4
923	S	25.9	Very low	29.7	Very low	110 Å²	110	126.2 Å²	126.2	77%	0.769	75%	0.749	S	S	*	*			trans	77.6	160.6	135.2	83.6	0	0	0	0	119.2
924	S	28.5	Very low	30	Very low	97 Å²	97	125.5 Å²	125.5	68%	0.678	75%	0.747	S	S	*	*			cis	-148.9	161.5	3.6	-44.9	0	0	0	0	112
925	V	27.8	Very low	30	Very low	124 Å²	124	128.3 Å²	128.3	75%	0.752	75%	0.752	S	S	*	*				55.5	134.9	111.5	170.1	0	0	0	0	116.6
926	E	27.7	Very low	30	Very low	156 Å²	156	126.8 Å²	126.8	73%	0.729	75%	0.754	S	S	*	*			cis	-173.4	179.6	-4.8	-104.7	-164.6	71.8	0	0	107.9
927	N	26.7	Very low	30	Very low	126 Å²	126	131.1 Å²	131.1	67%	0.674	76%	0.759	S	S	*	*			cis	-177.1	-173.6	-20.1	-174.3	4.7	0	0	0	108.7
928	V	26	Very low	29.9	Very low	126 Å²	126	133.9 Å²	133.9	76%	0.764	76%	0.764	S	S	*	*			trans	87.4	147.3	164.7	-174.7	0	0	0	0	119
929	S	23.8	Very low	30	Very low	106 Å²	106	132.7 Å²	132.7	74%	0.741	76%	0.764	S	S	*	*			trans	-132	-157.5	-175	-40.6	0	0	0	0	109.8
930	P	53.4	Low	29.2	Very low	117 Å²	117	137.2 Å²	137.2	76%	0.76	78%	0.776	S	S	*	*			cis	-132.4	-166.4	-20.4	40.9	-22.8	0	0	0	113
931	V	25.8	Very low	29.3	Very low	140 Å²	140	136.8 Å²	136.8	85%	0.848	77%	0.772	S	S	*	*			trans	161.6	164.6	143.3	156.8	0	0	0	0	111.1
932	S	26.6	Very low	29.3	Very low	111 Å²	111	140 Å²	140	78%	0.776	78%	0.779	S	S	*	*			trans	-119.9	-160.7	-157.6	-33.9	0	0	0	0	115.1
933	P	47.9	Very low	29.2	Very low	118 Å²	118	142.1 Å²	142.1	77%	0.766	78%	0.783	S	S	*	*			trans	-102.7	-172.7	-141.3	47.4	-40.8	0	0	0	115.6
934	P	36.8	Very low	29.1	Very low	109 Å²	109	145.3 Å²	145.3	71%	0.708	79%	0.786	S	S	*	*				-159.2	175	89.2	43.1	-22.4	0	0	0	119.8
935	E	26	Very low	28.9	Very low	174 Å²	174	146.7 Å²	146.7	81%	0.813	79%	0.789	S	S	*	*			trans	66	104.7	140	-78.3	172.4	-155.9	0	0	127.4
936	S	30	Very low	28.8	Very low	103 Å²	103	146.4 Å²	146.4	72%	0.72	79%	0.788	S	S	*	*				26.7	136.6	124	67.6	0	0	0	0	125.8
937	R	25.9	Very low	28.6	Very low	236 Å²	236	145.9 Å²	145.9	89%	0.891	79%	0.785	S	S	*	*			trans	-169.6	122.6	132.1	-101.2	161.7	-168.4	-163.9	3.7	109.6
938	K	24.4	Very low	28.4	Very low	207 Å²	207	148 Å²	148	90%	0.9	79%	0.785	S	S	*	*				82	143.8	88.7	-90.4	-165	173.5	-172.9	0	116.1
939	V	29.5	Very low	28.3	Very low	124 Å²	124	150 Å²	150	75%	0.752	79%	0.786	S	S	*	*			trans	-105.3	152.1	-164.3	175.2	0	0	0	0	112.3	F941	V939-F941 HydrophobicContact CG1-CD2 4.42Å
940	Q	24	Very low	28.7	Very low	194 Å²	194	150.5 Å²	150.5	91%	0.907	79%	0.785	S	S	*	*			trans	-152.4	147.6	153.7	-118.3	164.3	-11.9	0	0	112.6
941	F	27.2	Very low	27.3	Very low	189 Å²	189	151.3 Å²	151.3	83%	0.829	79%	0.79	S	S	*	*			trans	-108.9	149.7	173.4	-85.9	-101.5	0	0	0	109.6	V939	V939-F941 HydrophobicContact CG1-CD2 4.42Å
942	I	24.9	Very low	27.4	Very low	175 Å²	175	150.3 Å²	150.3	90%	0.897	79%	0.785	S	S	*	*			trans	-139.1	155.1	156.4	-62.4	-173.4	0	0	0	108.1
943	D	24.5	Very low	27.3	Very low	143 Å²	143	151.4 Å²	151.4	77%	0.765	79%	0.792	S	S	*	*			trans	-109.6	-163.2	-167.3	-137.4	-44.9	0	0	0	112.4
944	E	24.1	Very low	26.2	Very low	177 Å²	177	149.2 Å²	149.2	83%	0.827	79%	0.791	S	S	*	*			trans	84.7	132.1	170	-51.3	-169.6	151	0	0	116.8
945	V	24.7	Very low	25.7	Very low	125 Å²	125	148.3 Å²	148.3	76%	0.758	79%	0.792	S	S	*	*			cis	107.6	157.4	18.2	176.5	0	0	0	0	113.1
946	V	25.5	Very low	25.8	Very low	119 Å²	119	146.1 Å²	146.1	72%	0.721	79%	0.786	S	S	*	*			trans	79.9	117.1	-176	-161.8	0	0	0	0	112.1
947	Q	22.3	Very low	25.6	Very low	145 Å²	145	148.7 Å²	148.7	68%	0.678	79%	0.787	S	S	*	*				66.5	149.1	62	-70.7	178.9	-11.4	0	0	113.3
948	Y	23.8	Very low	25.6	Very low	170 Å²	170	140.9 Å²	140.9	67%	0.667	77%	0.773	S	S	*	*			cis	-156.6	161.9	1.8	-120.1	-39.7	0	0	0	110.9
949	Q	22.8	Very low	25.6	Very low	167 Å²	167	138.7 Å²	138.7	78%	0.78	76%	0.764	S	S	*	*			trans	69.7	134.7	143.4	-72.9	162.2	0.4	0	0	123.4
950	T	33.3	Very low	25.5	Very low	118 Å²	118	140.8 Å²	140.8	72%	0.724	76%	0.763	S	S	*	*			trans	-84.6	156.6	163.4	49.8	0	0	0	0	112.8
951	P	22.9	Very low	25.5	Very low	134 Å²	134	137 Å²	137	87%	0.87	75%	0.749	S	S	*	*			trans	-94.6	131.7	153.5	34	-27.8	0	0	0	111.9
952	T	27.7	Very low	25.3	Very low	119 Å²	119	135 Å²	135	73%	0.73	75%	0.747	S	S	*	*			trans	-113.8	141.4	175.3	50.3	0	0	0	0	111.8
953	S	26.1	Very low	25.3	Very low	134 Å²	134	133 Å²	133	94%	0.937	74%	0.742	S	S	*	*			trans	-175.6	141.9	148.7	-82.5	0	0	0	0	110.4
954	G	24.3	Very low	25.5	Very low	71 Å²	71	130.8 Å²	130.8	73%	0.732	74%	0.736	S	S	*	*			cis	166.1	176	-6.3	0	0	0	0	0	112.8
955	A	26.4	Very low	26	Very low	90 Å²	90	129.4 Å²	129.4	74%	0.744	74%	0.739	S	S	*	*			trans	75.3	135.8	173	0	0	0	0	0	118.1
956	N	27.5	Very low	26.1	Very low	128 Å²	128	130.5 Å²	130.5	68%	0.684	74%	0.74	S	S	*	*			cis	-164.6	152	-12.9	-117.3	-10.9	0	0	0	114.4
957	H	25.3	Very low	26	Very low	158 Å²	158	132 Å²	132	73%	0.731	74%	0.744	S	S	*	*			trans	64.8	151.2	151.7	-70.9	-48.8	0	0	0	119.8
958	A	26	Very low	26.1	Very low	72 Å²	72	130.6 Å²	130.6	60%	0.595	75%	0.75	S	S	*	*			cis	-168.4	137.5	-6.1	0	0	0	0	0	113.7
959	F	25.9	Very low	26.3	Very low	161 Å²	161	128.7 Å²	128.7	71%	0.706	76%	0.758	S	S	*	*			trans	54.8	161.6	142.5	-68.3	-72.3	0	0	0	121.2
960	F	26.2	Very low	26.3	Very low	168 Å²	168	123.9 Å²	123.9	74%	0.737	75%	0.754	S	S	*	*			cis	-146.6	156.5	8.7	-124.8	-62.3	0	0	0	112.3
961	D	24.3	Very low	26.1	Very low	114 Å²	114	126.1 Å²	126.1	61%	0.61	76%	0.759	S	S	*	*			trans	-30.4	164.2	-178	-49.6	-14.1	0	0	0	125.4
962	D	23.5	Very low	26.1	Very low	147 Å²	147	126.7 Å²	126.7	79%	0.786	76%	0.76	S	S	*	*			trans	38.2	143.7	145.2	-55.1	-15.5	0	0	0	121.8
963	V	25	Very low	26	Very low	133 Å²	133	124.6 Å²	124.6	81%	0.806	76%	0.762	S	S	*	*				-179.9	164.5	62.6	168.8	0	0	0	0	106.4
964	P	28.5	Very low	26.4	Very low	97 Å²	97	123.5 Å²	123.5	63%	0.63	75%	0.75	S	S	*	*			cis	-122.1	178.3	-17	36.6	-20.4	0	0	0	114.6
965	V	35	Very low	26.8	Very low	148 Å²	148	126.9 Å²	126.9	90%	0.897	75%	0.751	S	S	*	*			trans	-79.4	141	151.8	175	0	0	0	0	109.6
966	L	25.2	Very low	26.9	Very low	148 Å²	148	130.2 Å²	130.2	78%	0.775	75%	0.751	S	S	*	*			trans	-132.6	136.9	179.2	-140.3	151.4	0	0	0	111
967	D	23.7	Very low	27.2	Very low	151 Å²	151	130 Å²	130	81%	0.807	75%	0.749	S	S	*	*			trans	-61.9	148.2	-171.4	-79.8	-59.6	0	0	0	114.5	P969	D967-P969 WeakPolarHBondContact O-CD 3.12Å
968	S	25.3	Very low	27.4	Very low	114 Å²	114	132.1 Å²	132.1	80%	0.797	75%	0.752	S	S	*	*			trans	-78.7	115.6	170.9	-64.7	0	0	0	0	110.8	G970	S968-G970 PolarHBondContact O-N 3.46Å
969	P	26.7	Very low	27.9	Very low	130 Å²	130	138.1 Å²	138.1	84%	0.844	76%	0.76	S	S	*	*			trans	-70.4	128.8	175.7	29.1	-33.9	0	0	0	110.5	D967	D967-P969 WeakPolarHBondContact O-CD 3.12Å
970	G	24.3	Very low	28.6	Very low	66 Å²	66	132.2 Å²	132.2	68%	0.68	74%	0.735	S	S	*	*			trans	-93.8	137.8	-175.4	0	0	0	0	0	114.6	S968	S968-G970 PolarHBondContact O-N 3.46Å
971	I	27.5	Very low	29.2	Very low	165 Å²	165	128 Å²	128	85%	0.846	72%	0.724	S	S	*	*			trans	67.4	118.2	149.7	-43.4	172.6	0	0	0	117.3
972	V	24.6	Very low	30.2	Very low	147 Å²	147	131 Å²	131	89%	0.891	73%	0.727	S	S	*	*				175.8	125.6	118.8	153.5	0	0	0	0	107.7
973	G	24.7	Very low	31.3	Very low	75 Å²	75	129.7 Å²	129.7	77%	0.773	72%	0.716	S	S	*	*			trans	160.4	54.4	-175.8	0	0	0	0	0	113.9
974	T	34.6	Very low	32.4	Very low	111 Å²	111	131.5 Å²	131.5	68%	0.681	71%	0.709	S	S	*	*			trans	-95	143.9	-179.5	49.8	0	0	0	0	112.4
975	N	31.7	Very low	33.3	Very low	142 Å²	142	134.6 Å²	134.6	76%	0.759	71%	0.708	S	S	*	*			trans	90.7	77.5	171.2	-50.1	-17.9	0	0	0	116.8
976	E	30.4	Very low	34.2	Very low	159 Å²	159	131.9 Å²	131.9	74%	0.743	69%	0.688	S	S	*	*			trans	-103.9	98.9	146.6	-70.1	-154.3	-178.4	0	0	109.8	Y978	E976-Y978 PolarHBondContact O-N 2.9Å
977	I	32.3	Very low	35.5	Very low	125 Å²	125	128.6 Å²	128.6	64%	0.641	67%	0.671	S	S	*	*			trans	-82.1	112.2	171.2	-61.3	173.1	0	0	0	107.4	R979	I977-R979 HydrophobicContact CG2-CG 4.24Å; I977-R979 PolarHBondContact O-N 3.15Å; I977-R979 VanDerWaalsContact O-N 3.09Å
978	Y	31.2	Very low	37	Very low	201 Å²	201	125.8 Å²	125.8	79%	0.788	65%	0.653	S	S	*	*			trans	-59.3	114.3	169.2	-176.3	-87.4	0	0	0	109.5	E976	E976-Y978 PolarHBondContact O-N 2.9Å
979	R	34.4	Very low	38.5	Very low	199 Å²	199	124.2 Å²	124.2	75%	0.751	64%	0.635	S	S	*	*			trans	-109	115.9	176.5	-72.6	-177.9	174.3	-176.5	-1.7	109.1	I977 P981	I977-R979 HydrophobicContact CG2-CG 4.24Å; I977-R979 PolarHBondContact O-N 3.15Å; I977-R979 VanDerWaalsContact O-N 3.09Å; R979-P981 WeakPolarHBondContact O-CD 3.47Å
980	D	42.6	Very low	39.6	Very low	37 Å²	37	122.8 Å²	122.8	20%	0.198	62%	0.617	C	S	.	*			trans	-57.5	126.3	176.1	-174.3	-29	0	0	0	110.3	R982 Q983 R984	D980-R982 PolarHBondContact O-N 3.4Å; D980-R982 VanDerWaalsContact O-N 3.1Å; D980-R982 WeakPolarHBondContact OD1-CA 3.44Å; D980-R982 WeakPolarHBondContact OD1-CB 3.34Å; D980-R982 WeakPolarHBondContact OD1-CG 3.31Å; D980-R982 IonicContact OD1-CZ 2.68Å; D980-R982 PolarHBondContact OD1-N 3.47Å; D980-R982 IonicContact OD1-NE 3.1Å; D980-R982 PolarHBondContact OD1-NE 3.45Å; D980-R982 VanDerWaalsContact OD1-NE 3.1Å; D980-R982 IonicContact OD1-NH2 2.75Å; D980-R982 IonicContact OD2-CZ 2.9Å; D980-R982 IonicContact OD2-NE 3.3Å; D980-R982 PolarHBondContact OD2-NE 3.22Å; D980-R982 IonicContact OD2-NH2 2.83Å; D980-R982 PolarHBondContact OD2-NH2 3.08Å; D980-Q983 HydrophobicContact CB-CB 4.03Å; D980-Q983 WeakPolarHBondContact O-CA 3.45Å; D980-Q983 WeakPolarHBondContact O-CB 3.42Å; D980-Q983 PolarHBondContact O-N 3.48Å; D980-R984 PolarHBondContact O-N 3.39Å
981	P	37.6	Very low	40.6	Very low	78 Å²	78	124 Å²	124	51%	0.506	61%	0.609	S	S	.	*	H	α-helix	trans	-56.4	-23.6	175.4	-26.9	35.9	0	0	0	114.6	R979 R985	R979-P981 WeakPolarHBondContact O-CD 3.47Å; P981-R985 PolarHBondContact O-N 3.26Å
982	R	44.9	Very low	41.8	Very low	178 Å²	178	124.4 Å²	124.4	67%	0.672	60%	0.599	S	S	*	*	H	α-helix	trans	-71.9	-38.3	171.1	-60.3	172.7	-71.1	-165.6	-0.6	111.4	D980 R985 L986	D980-R982 PolarHBondContact O-N 3.4Å; D980-R982 VanDerWaalsContact O-N 3.1Å; D980-R982 WeakPolarHBondContact OD1-CA 3.44Å; D980-R982 WeakPolarHBondContact OD1-CB 3.34Å; D980-R982 WeakPolarHBondContact OD1-CG 3.31Å; D980-R982 IonicContact OD1-CZ 2.68Å; D980-R982 PolarHBondContact OD1-N 3.47Å; D980-R982 IonicContact OD1-NE 3.1Å; D980-R982 PolarHBondContact OD1-NE 3.45Å; D980-R982 VanDerWaalsContact OD1-NE 3.1Å; D980-R982 IonicContact OD1-NH2 2.75Å; D980-R982 IonicContact OD2-CZ 2.9Å; D980-R982 IonicContact OD2-NE 3.3Å; D980-R982 PolarHBondContact OD2-NE 3.22Å; D980-R982 IonicContact OD2-NH2 2.83Å; D980-R982 PolarHBondContact OD2-NH2 3.08Å; R982-R985 CarbonylContact O-C 3.59Å; R982-R985 PolarHBondContact O-N 3.01Å; R982-L986 WeakPolarHBondContact O-CB 3.43Å; R982-L986 PolarHBondContact O-N 3.28Å
983	Q	46.4	Very low	42.8	Very low	119 Å²	119	122.5 Å²	122.5	56%	0.556	58%	0.584	S	S	*	*	H	α-helix	trans	-73.5	-31.1	178.1	-161	168.9	18.4	0	0	111.7	D980 L986 N987	D980-Q983 HydrophobicContact CB-CB 4.03Å; D980-Q983 WeakPolarHBondContact O-CA 3.45Å; D980-Q983 WeakPolarHBondContact O-CB 3.42Å; D980-Q983 PolarHBondContact O-N 3.48Å; Q983-L986 PolarHBondContact O-N 2.85Å; Q983-N987 WeakPolarHBondContact O-CB 3.45Å; Q983-N987 PolarHBondContact O-N 2.88Å; Q983-N987 PolarHBondContact O-OD1 3.21Å
984	R	49.5	Very low	43.7	Very low	172 Å²	172	127 Å²	127	65%	0.649	58%	0.578	S	S	*	*	H	α-helix	trans	-58.9	-52	164.6	178.9	175.5	173	168	1	111.4	D980 L986 N987 E988	D980-R984 PolarHBondContact O-N 3.39Å; R984-L986 VanDerWaalsContact C-N 3.27Å; R984-L986 PolarHBondContact O-N 3.49Å; R984-N987 PolarHBondContact O-N 3.33Å; R984-E988 HydrophobicContact CG-CG 4.48Å; R984-E988 WeakPolarHBondContact CG-OE1 3.38Å; R984-E988 IonicContact CZ-OE1 3.2Å; R984-E988 IonicContact NE-OE1 2.75Å; R984-E988 PolarHBondContact NE-OE1 3.47Å; R984-E988 IonicContact NH2-OE1 2.72Å; R984-E988 PolarHBondContact NH2-OE1 2.67Å; R984-E988 VanDerWaalsContact NH2-OE1 3.17Å; R984-E988 WeakPolarHBondContact O-CB 3.35Å; R984-E988 WeakPolarHBondContact O-CG 3.14Å; R984-E988 PolarHBondContact O-N 3.02Å
985	R	46.6	Very low	44.1	Very low	162 Å²	162	125.5 Å²	125.5	61%	0.611	57%	0.572	S	S	*	*	H	α-helix	trans	-60.4	-34.7	175.7	-98.6	-177.3	-76.8	-179.6	-8	113	P981 R982 L989	P981-R985 PolarHBondContact O-N 3.26Å; R982-R985 CarbonylContact O-C 3.59Å; R982-R985 PolarHBondContact O-N 3.01Å; R985-L989 WeakPolarHBondContact O-CB 3.27Å; R985-L989 WeakPolarHBondContact O-CD1 3.16Å; R985-L989 VanDerWaalsContact O-CG 3.26Å; R985-L989 WeakPolarHBondContact O-CG 3.13Å; R985-L989 PolarHBondContact O-N 3.46Å
986	L	53.3	Low	44.8	Very low	90 Å²	90	123.5 Å²	123.5	47%	0.471	57%	0.569	S	S	.	*	H	α-helix	trans	-70.4	-40.9	177.7	-170	65.1	0	0	0	111.6	R982 Q983 R984 L989 Q990	R982-L986 WeakPolarHBondContact O-CB 3.43Å; R982-L986 PolarHBondContact O-N 3.28Å; Q983-L986 PolarHBondContact O-N 2.85Å; R984-L986 VanDerWaalsContact C-N 3.27Å; R984-L986 PolarHBondContact O-N 3.49Å; L986-L989 WeakPolarHBondContact O-CB 3.4Å; L986-L989 PolarHBondContact O-N 2.91Å; L986-Q990 WeakPolarHBondContact O-CB 3.43Å; L986-Q990 WeakPolarHBondContact O-CG 3.48Å; L986-Q990 PolarHBondContact O-N 2.84Å
987	N	53.3	Low	45.2	Very low	80 Å²	80	123.5 Å²	123.5	43%	0.428	57%	0.569	S	S	.	*	H	α-helix	trans	-66.7	-43.5	172.7	-73.4	22.5	0	0	0	111.2	Q983 R984 L989 Q990 D991	Q983-N987 WeakPolarHBondContact O-CB 3.45Å; Q983-N987 PolarHBondContact O-N 2.88Å; Q983-N987 PolarHBondContact O-OD1 3.21Å; R984-N987 PolarHBondContact O-N 3.33Å; N987-L989 PolarHBondContact O-N 2.8Å; N987-Q990 PolarHBondContact O-N 3.21Å; N987-D991 WeakPolarHBondContact O-CB 3.5Å; N987-D991 PolarHBondContact O-N 3.4Å
988	E	54.6	Low	45.5	Very low	92 Å²	92	124.1 Å²	124.1	43%	0.43	57%	0.573	S	S	.	*	H	α-helix	trans	-60.3	-29.4	173.9	-72.6	167.9	174	0	0	112.1	R984 R992	R984-E988 HydrophobicContact CG-CG 4.48Å; R984-E988 WeakPolarHBondContact CG-OE1 3.38Å; R984-E988 IonicContact CZ-OE1 3.2Å; R984-E988 IonicContact NE-OE1 2.75Å; R984-E988 PolarHBondContact NE-OE1 3.47Å; R984-E988 IonicContact NH2-OE1 2.72Å; R984-E988 PolarHBondContact NH2-OE1 2.67Å; R984-E988 VanDerWaalsContact NH2-OE1 3.17Å; R984-E988 WeakPolarHBondContact O-CB 3.35Å; R984-E988 WeakPolarHBondContact O-CG 3.14Å; R984-E988 PolarHBondContact O-N 3.02Å; E988-R992 VanDerWaalsContact O-CB 3.22Å; E988-R992 WeakPolarHBondContact O-CB 3.43Å; E988-R992 PolarHBondContact O-N 2.99Å
989	L	56.5	Low	46.1	Very low	80 Å²	80	118.7 Å²	118.7	42%	0.419	58%	0.578	S	S	.	*	H	α-helix	trans	-77.1	-39.4	169.9	-76.1	164.7	0	0	0	113.1	R985 L986 N987 R992 N993	R985-L989 WeakPolarHBondContact O-CB 3.27Å; R985-L989 WeakPolarHBondContact O-CD1 3.16Å; R985-L989 VanDerWaalsContact O-CG 3.26Å; R985-L989 WeakPolarHBondContact O-CG 3.13Å; R985-L989 PolarHBondContact O-N 3.46Å; L986-L989 WeakPolarHBondContact O-CB 3.4Å; L986-L989 PolarHBondContact O-N 2.91Å; N987-L989 PolarHBondContact O-N 2.8Å; L989-R992 PolarHBondContact O-N 3.05Å; L989-N993 PolarHBondContact O-N 3.47Å; L989-N993 PolarHBondContact O-OD1 2.95Å
990	Q	50.2	Low	46.7	Very low	100 Å²	100	113.7 Å²	113.7	47%	0.467	58%	0.58	S	S	.	*	H	α-helix	trans	-70	-40.7	178.7	-76.5	-178.9	-0.2	0	0	112.6	L986 N987 R992 N993 R994	L986-Q990 WeakPolarHBondContact O-CB 3.43Å; L986-Q990 WeakPolarHBondContact O-CG 3.48Å; L986-Q990 PolarHBondContact O-N 2.84Å; N987-Q990 PolarHBondContact O-N 3.21Å; Q990-R992 VanDerWaalsContact C-N 3.32Å; Q990-N993 PolarHBondContact O-N 2.86Å; Q990-R994 WeakPolarHBondContact O-CG 3.37Å; Q990-R994 PolarHBondContact O-N 2.72Å
991	D	46.9	Very low	46.6	Very low	93 Å²	93	115.9 Å²	115.9	50%	0.497	60%	0.603	S	S	.	*	H	α-helix	trans	-68.7	-33.2	175	-71.7	-30.9	0	0	0	111.3	N987 N993 R994 S995	N987-D991 WeakPolarHBondContact O-CB 3.5Å; N987-D991 PolarHBondContact O-N 3.4Å; D991-N993 VanDerWaalsContact C-N 3.33Å; D991-R994 PolarHBondContact O-N 3.07Å; D991-S995 WeakPolarHBondContact O-CB 3.49Å; D991-S995 PolarHBondContact O-N 2.8Å; D991-S995 PolarHBondContact O-OG 3.22Å
992	R	50.7	Low	47.1	Very low	173 Å²	173	117.4 Å²	117.4	65%	0.653	61%	0.607	S	S	*	*	H	α-helix	trans	-71.5	-24.1	172	-163.6	170.5	72.9	-169.5	4.8	113.5	E988 L989 Q990 S995	E988-R992 VanDerWaalsContact O-CB 3.22Å; E988-R992 WeakPolarHBondContact O-CB 3.43Å; E988-R992 PolarHBondContact O-N 2.99Å; L989-R992 PolarHBondContact O-N 3.05Å; Q990-R992 VanDerWaalsContact C-N 3.32Å; R992-S995 WeakPolarHBondContact CA-OG 3.49Å; R992-S995 PolarHBondContact O-OG 3.39Å
993	N	47.4	Very low	47.3	Very low	107 Å²	107	110.7 Å²	110.7	57%	0.572	59%	0.593	S	S	*	*	H	α-helix	trans	-79.7	-45.1	168.8	-75.3	6.7	0	0	0	111.8	L989 Q990 D991 S995 S996 E997	L989-N993 PolarHBondContact O-N 3.47Å; L989-N993 PolarHBondContact O-OD1 2.95Å; Q990-N993 PolarHBondContact O-N 2.86Å; D991-N993 VanDerWaalsContact C-N 3.33Å; N993-S995 VanDerWaalsContact C-N 3.29Å; N993-S995 PolarHBondContact O-N 2.78Å; N993-S996 WeakPolarHBondContact O-CA 3.41Å; N993-S996 VanDerWaalsContact O-CB 3.27Å; N993-S996 WeakPolarHBondContact O-CB 3.49Å; N993-S996 PolarHBondContact O-N 3.35Å; N993-E997 PolarHBondContact O-N 3.21Å
994	R	42.5	Very low	47.6	Very low	170 Å²	170	108.2 Å²	108.2	64%	0.642	59%	0.593	S	S	*	*	H	α-helix	trans	-59.8	-37.3	177.2	-79.6	177.2	158.2	-177.8	-6.7	113	Q990 D991 S996 E997 N998	Q990-R994 WeakPolarHBondContact O-CG 3.37Å; Q990-R994 PolarHBondContact O-N 2.72Å; D991-R994 PolarHBondContact O-N 3.07Å; R994-S996 PolarHBondContact O-N 3.3Å; R994-E997 PolarHBondContact O-N 3.09Å; R994-N998 PolarHBondContact O-N 2.91Å
995	S	43.7	Very low	47.5	Very low	79 Å²	79	109 Å²	109	55%	0.552	60%	0.601	S	S	*	*	H	α-helix	trans	-73.9	-2.5	173.1	50.4	0	0	0	0	114.3	D991 R992 N993	D991-S995 WeakPolarHBondContact O-CB 3.49Å; D991-S995 PolarHBondContact O-N 2.8Å; D991-S995 PolarHBondContact O-OG 3.22Å; R992-S995 WeakPolarHBondContact CA-OG 3.49Å; R992-S995 PolarHBondContact O-OG 3.39Å; N993-S995 VanDerWaalsContact C-N 3.29Å; N993-S995 PolarHBondContact O-N 2.78Å
996	S	45.3	Very low	47.7	Very low	99 Å²	99	104 Å²	104	69%	0.692	59%	0.586	S	S	*	*	H	α-helix	trans	-97.9	-11.8	168.9	-169.7	0	0	0	0	113.7	N993 R994	N993-S996 WeakPolarHBondContact O-CA 3.41Å; N993-S996 VanDerWaalsContact O-CB 3.27Å; N993-S996 WeakPolarHBondContact O-CB 3.49Å; N993-S996 PolarHBondContact O-N 3.35Å; R994-S996 PolarHBondContact O-N 3.3Å
997	E	40.2	Very low	48	Very low	160 Å²	160	101.6 Å²	101.6	75%	0.748	58%	0.583	S	S	*	*	H	α-helix	trans	-96.5	-34.9	-179.5	-67.5	179.6	142	0	0	112.2	N993 R994 G999	N993-E997 PolarHBondContact O-N 3.21Å; R994-E997 PolarHBondContact O-N 3.09Å; E997-G999 PolarHBondContact O-N 3.24Å; E997-G999 VanDerWaalsContact O-N 3.15Å
998	N	37.6	Very low	47.6	Very low	138 Å²	138	105.5 Å²	105.5	74%	0.738	60%	0.597	S	S	*	*	S	Bend	trans	-80	94	170.5	-77.2	-23.4	0	0	0	110.3	R994 A1000	R994-N998 PolarHBondContact O-N 2.91Å; N998-A1000 VanDerWaalsContact C-N 3.26Å; N998-A1000 PolarHBondContact O-N 2.85Å
999	G	44.3	Very low	47.5	Very low	86 Å²	86	109.4 Å²	109.4	89%	0.887	61%	0.608	S	S	*	*	S	Bend	trans	-67.9	56.3	-170.3	0	0	0	0	0	117.7	E997	E997-G999 PolarHBondContact O-N 3.24Å; E997-G999 VanDerWaalsContact O-N 3.15Å
1000	A	47.1	Very low	47.6	Very low	95 Å²	95	109.3 Å²	109.3	79%	0.785	61%	0.608	S	S	*	*			trans	-137.7	66.3	172.3	0	0	0	0	0	110.5	N998 D1002	N998-A1000 VanDerWaalsContact C-N 3.26Å; N998-A1000 PolarHBondContact O-N 2.85Å; A1000-D1002 PolarHBondContact O-N 2.92Å
1001	A	40.8	Very low	48.3	Very low	83 Å²	83	108.3 Å²	108.3	69%	0.686	60%	0.601	S	S	*	*			trans	-82	111.1	-174	0	0	0	0	0	112.8	G1003	A1001-G1003 PolarHBondContact O-N 3.44Å
1002	D	47.2	Very low	48.8	Very low	109 Å²	109	109.3 Å²	109.3	58%	0.583	60%	0.603	S	S	*	*			trans	-63.1	114.8	166.6	170.4	14.4	0	0	0	110.6	A1000 A1004 K1005	A1000-D1002 PolarHBondContact O-N 2.92Å; D1002-A1004 PolarHBondContact O-N 2.76Å; D1002-A1004 VanDerWaalsContact O-N 3.09Å; D1002-A1004 WeakPolarHBondContact OD1-CB 3.48Å; D1002-A1004 PolarHBondContact OD1-N 2.67Å; D1002-A1004 VanDerWaalsContact OD1-N 3.11Å; D1002-K1005 PolarHBondContact O-N 3.03Å
1003	G	48.8	Very low	49.2	Very low	37 Å²	37	108 Å²	108	38%	0.381	60%	0.598	S	S	.	*	G	3₁₀ helix	trans	-63.3	-14.9	-173.8	0	0	0	0	0	115.1	A1001 K1005 K1011	A1001-G1003 PolarHBondContact O-N 3.44Å; G1003-K1005 VanDerWaalsContact C-N 3.27Å; G1003-K1005 PolarHBondContact O-N 2.73Å; G1003-K1011 WeakPolarHBondContact O-CE 3.47Å
1004	A	52.5	Low	49.8	Very low	68 Å²	68	107.5 Å²	107.5	56%	0.562	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-54.4	-43.1	177.7	0	0	0	0	0	112.2	D1002 K1011	D1002-A1004 PolarHBondContact O-N 2.76Å; D1002-A1004 VanDerWaalsContact O-N 3.09Å; D1002-A1004 WeakPolarHBondContact OD1-CB 3.48Å; D1002-A1004 PolarHBondContact OD1-N 2.67Å; D1002-A1004 VanDerWaalsContact OD1-N 3.11Å; A1004-K1011 PolarHBondContact O-NZ 3.48Å
1005	K	48.4	Very low	50.3	Low	188 Å²	188	106 Å²	106	82%	0.817	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-89.3	-0.2	-168.6	-66.6	177.7	-178.1	170.6	0	115.8	D1002 G1003	D1002-K1005 PolarHBondContact O-N 3.03Å; G1003-K1005 VanDerWaalsContact C-N 3.27Å; G1003-K1005 PolarHBondContact O-N 2.73Å
1006	L	49.6	Very low	50.9	Low	57 Å²	57	103.5 Å²	103.5	30%	0.298	58%	0.577	S	S	.	*			trans	-72.3	140.5	178.9	-68.5	174.6	0	0	0	112.4	K1011 L1014	L1006-K1011 HydrophobicContact CB-CD 4.36Å; L1006-K1011 HydrophobicContact CB-CG 3.73Å; L1006-K1011 WeakPolarHBondContact O-CD 3.37Å; L1006-K1011 WeakPolarHBondContact O-CE 3.43Å; L1006-K1011 PolarHBondContact O-NZ 3.43Å; L1006-L1014 HydrophobicContact CD1-CD2 4.38Å
1007	G	59.4	Low	51.5	Low	40 Å²	40	108.4 Å²	108.4	41%	0.412	58%	0.581	S	S	.	*			trans	-73.8	161.4	175	0	0	0	0	0	113	R1009 D1010 K1011	G1007-R1009 PolarHBondContact O-N 3.27Å; G1007-D1010 PolarHBondContact O-N 3.45Å; G1007-K1011 PolarHBondContact O-N 3.15Å
1008	F	45.8	Very low	52	Low	162 Å²	162	108 Å²	108	71%	0.711	58%	0.579	S	S	*	*	H	α-helix	trans	-53.4	-47.8	-171.9	-176.5	-93.4	0	0	0	113.9	D1010 K1011 Q1012	F1008-D1010 VanDerWaalsContact C-N 3.28Å; F1008-D1010 PolarHBondContact O-N 3.4Å; F1008-K1011 PolarHBondContact O-N 2.96Å; F1008-Q1012 WeakPolarHBondContact O-CB 3.34Å; F1008-Q1012 PolarHBondContact O-N 3.42Å
1009	R	52.3	Low	53.1	Low	174 Å²	174	107.1 Å²	107.1	66%	0.657	57%	0.573	S	S	*	*	H	α-helix	trans	-63.8	-30.4	178.7	-90.1	175.5	59.2	-179.6	-3.7	113.8	G1007 R1013	G1007-R1009 PolarHBondContact O-N 3.27Å; R1009-R1013 WeakPolarHBondContact O-CG 3.33Å; R1009-R1013 PolarHBondContact O-N 3.3Å; R1009-R1013 VanDerWaalsContact O-N 3.13Å
1010	D	58.9	Low	53	Low	78 Å²	78	106 Å²	106	42%	0.417	56%	0.561	S	S	.	*	H	α-helix	trans	-86.7	-34.4	-178.2	-56.8	-52.4	0	0	0	110.9	G1007 F1008 R1013 L1014	G1007-D1010 PolarHBondContact O-N 3.45Å; F1008-D1010 VanDerWaalsContact C-N 3.28Å; F1008-D1010 PolarHBondContact O-N 3.4Å; D1010-R1013 PolarHBondContact O-N 3.08Å; D1010-R1013 IonicContact OD1-NH1 3.87Å; D1010-L1014 WeakPolarHBondContact O-CB 3.18Å; D1010-L1014 PolarHBondContact O-N 3.47Å
1011	K	64.7	Low	53.2	Low	78 Å²	78	107.2 Å²	107.2	34%	0.339	55%	0.551	S	S	.	*	H	α-helix	trans	-57.3	-47.3	162.9	-76.8	174.8	168.3	142.5	0	111.2	G1003 A1004 L1006 G1007 F1008 R1013 L1014 F1015	G1003-K1011 WeakPolarHBondContact O-CE 3.47Å; A1004-K1011 PolarHBondContact O-NZ 3.48Å; L1006-K1011 HydrophobicContact CB-CD 4.36Å; L1006-K1011 HydrophobicContact CB-CG 3.73Å; L1006-K1011 WeakPolarHBondContact O-CD 3.37Å; L1006-K1011 WeakPolarHBondContact O-CE 3.43Å; L1006-K1011 PolarHBondContact O-NZ 3.43Å; G1007-K1011 PolarHBondContact O-N 3.15Å; F1008-K1011 PolarHBondContact O-N 2.96Å; K1011-R1013 VanDerWaalsContact C-N 3.31Å; K1011-R1013 PolarHBondContact O-N 3.38Å; K1011-L1014 WeakPolarHBondContact O-CB 3.41Å; K1011-L1014 PolarHBondContact O-N 3.15Å; K1011-L1014 VanDerWaalsContact O-N 3.11Å; K1011-F1015 WeakPolarHBondContact O-CD2 3.31Å; K1011-F1015 PolarHBondContact O-N 3.24Å
1012	Q	57	Low	53.5	Low	115 Å²	115	110.5 Å²	110.5	54%	0.537	56%	0.557	S	S	.	*	H	α-helix	trans	-62	-35.9	178.9	-164.9	175.3	25.1	0	0	112.6	F1008 A1016	F1008-Q1012 WeakPolarHBondContact O-CB 3.34Å; F1008-Q1012 PolarHBondContact O-N 3.42Å; Q1012-A1016 WeakPolarHBondContact O-CB 3.4Å; Q1012-A1016 PolarHBondContact O-N 2.78Å
1013	R	59.5	Low	53.3	Low	146 Å²	146	110.9 Å²	110.9	55%	0.551	56%	0.563	S	S	*	*	H	α-helix	trans	-70.6	-36.7	171.9	-77.9	167.5	157.5	-172.6	-12.7	113.5	R1009 D1010 K1011 A1016 R1017	R1009-R1013 WeakPolarHBondContact O-CG 3.33Å; R1009-R1013 PolarHBondContact O-N 3.3Å; R1009-R1013 VanDerWaalsContact O-N 3.13Å; D1010-R1013 PolarHBondContact O-N 3.08Å; D1010-R1013 IonicContact OD1-NH1 3.87Å; K1011-R1013 VanDerWaalsContact C-N 3.31Å; K1011-R1013 PolarHBondContact O-N 3.38Å; R1013-A1016 PolarHBondContact O-N 3.42Å; R1013-R1017 PolarHBondContact O-N 3.31Å; R1013-R1017 VanDerWaalsContact O-N 3.14Å
1014	L	60.5	Low	53	Low	96 Å²	96	112.9 Å²	112.9	50%	0.503	58%	0.576	S	S	.	*	H	α-helix	trans	-62.4	-47.6	174.8	-146.7	84.2	0	0	0	110.1	L1006 D1010 K1011 R1017 Q1018	L1006-L1014 HydrophobicContact CD1-CD2 4.38Å; D1010-L1014 WeakPolarHBondContact O-CB 3.18Å; D1010-L1014 PolarHBondContact O-N 3.47Å; K1011-L1014 WeakPolarHBondContact O-CB 3.41Å; K1011-L1014 PolarHBondContact O-N 3.15Å; K1011-L1014 VanDerWaalsContact O-N 3.11Å; L1014-R1017 PolarHBondContact O-N 2.97Å; L1014-Q1018 WeakPolarHBondContact O-CB 3.42Å; L1014-Q1018 PolarHBondContact O-N 3.09Å
1015	F	52.4	Low	52.4	Low	139 Å²	139	115.8 Å²	115.8	61%	0.61	59%	0.589	S	S	*	*	H	α-helix	trans	-60.3	-46.2	175.1	-90.2	-80.5	0	0	0	112.6	K1011 R1017 Q1018 I1019	K1011-F1015 WeakPolarHBondContact O-CD2 3.31Å; K1011-F1015 PolarHBondContact O-N 3.24Å; F1015-R1017 VanDerWaalsContact C-N 3.35Å; F1015-R1017 PolarHBondContact O-N 3.11Å; F1015-Q1018 CarbonylContact O-C 3.04Å; F1015-Q1018 WeakPolarHBondContact O-CA 3.49Å; F1015-Q1018 PolarHBondContact O-N 3.42Å; F1015-I1019 WeakPolarHBondContact O-CG1 3.25Å; F1015-I1019 PolarHBondContact O-N 3.34Å
1016	A	56.6	Low	52.1	Low	25 Å²	25	118.5 Å²	118.5	21%	0.207	59%	0.594	C	S	.	*	H	α-helix	trans	-57.1	-44.9	177.8	0	0	0	0	0	112.6	Q1012 R1013 Q1018 I1019 G1020 E1021	Q1012-A1016 WeakPolarHBondContact O-CB 3.4Å; Q1012-A1016 PolarHBondContact O-N 2.78Å; R1013-A1016 PolarHBondContact O-N 3.42Å; A1016-Q1018 VanDerWaalsContact C-N 3.32Å; A1016-Q1018 PolarHBondContact O-N 3.25Å; A1016-I1019 VanDerWaalsContact O-CG1 3.28Å; A1016-I1019 WeakPolarHBondContact O-CG1 3.3Å; A1016-I1019 PolarHBondContact O-N 3.29Å; A1016-G1020 PolarHBondContact O-N 2.81Å; A1016-E1021 PolarHBondContact O-N 3.17Å
1017	R	58.7	Low	51.6	Low	203 Å²	203	124.9 Å²	124.9	77%	0.766	62%	0.622	S	S	*	*	H	α-helix	trans	-63.5	-35.7	172.5	-86.5	-175.9	164	178.8	-5.2	113.3	R1013 L1014 F1015 I1019 G1020	R1013-R1017 PolarHBondContact O-N 3.31Å; R1013-R1017 VanDerWaalsContact O-N 3.14Å; L1014-R1017 PolarHBondContact O-N 2.97Å; F1015-R1017 VanDerWaalsContact C-N 3.35Å; F1015-R1017 PolarHBondContact O-N 3.11Å; R1017-I1019 VanDerWaalsContact C-N 3.3Å; R1017-I1019 PolarHBondContact O-N 2.72Å; R1017-G1020 PolarHBondContact O-N 3.19Å
1018	Q	50.9	Low	50.6	Low	152 Å²	152	133.4 Å²	133.4	71%	0.71	64%	0.642	S	S	*	*	H	α-helix	trans	-76.9	-15.8	-177.6	-162.6	164.9	6.8	0	0	113.5	L1014 F1015 A1016	L1014-Q1018 WeakPolarHBondContact O-CB 3.42Å; L1014-Q1018 PolarHBondContact O-N 3.09Å; F1015-Q1018 CarbonylContact O-C 3.04Å; F1015-Q1018 WeakPolarHBondContact O-CA 3.49Å; F1015-Q1018 PolarHBondContact O-N 3.42Å; A1016-Q1018 VanDerWaalsContact C-N 3.32Å; A1016-Q1018 PolarHBondContact O-N 3.25Å
1019	I	60.1	Low	50.3	Low	118 Å²	118	133.7 Å²	133.7	61%	0.605	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	-1.5	170.2	66.7	179.5	0	0	0	113.8	F1015 A1016 R1017 E1021	F1015-I1019 WeakPolarHBondContact O-CG1 3.25Å; F1015-I1019 PolarHBondContact O-N 3.34Å; A1016-I1019 VanDerWaalsContact O-CG1 3.28Å; A1016-I1019 WeakPolarHBondContact O-CG1 3.3Å; A1016-I1019 PolarHBondContact O-N 3.29Å; R1017-I1019 VanDerWaalsContact C-N 3.3Å; R1017-I1019 PolarHBondContact O-N 2.72Å; I1019-E1021 HydrophobicContact CD1-CG 4.32Å; I1019-E1021 HydrophobicContact CG1-CB 4.4Å; I1019-E1021 HydrophobicContact CG1-CG 4.28Å
1020	G	41.2	Very low	49.8	Very low	62 Å²	62	133.6 Å²	133.6	64%	0.639	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	83.5	18.3	177.2	0	0	0	0	0	116	A1016 R1017	A1016-G1020 PolarHBondContact O-N 2.81Å; R1017-G1020 PolarHBondContact O-N 3.19Å
1021	E	52.3	Low	48.9	Very low	122 Å²	122	134.3 Å²	134.3	57%	0.57	66%	0.661	S	S	*	*			trans	-97.3	107.3	175.2	-71.1	-166.5	134.6	0	0	111.8	A1016 I1019 T1023	A1016-E1021 PolarHBondContact O-N 3.17Å; I1019-E1021 HydrophobicContact CD1-CG 4.32Å; I1019-E1021 HydrophobicContact CG1-CB 4.4Å; I1019-E1021 HydrophobicContact CG1-CG 4.28Å; E1021-T1023 VanDerWaalsContact C-N 3.32Å; E1021-T1023 PolarHBondContact O-N 2.87Å
1022	D	46.5	Very low	47.8	Very low	152 Å²	152	134.2 Å²	134.2	81%	0.813	67%	0.67	S	S	*	*			trans	-78.2	-3.1	-175.8	-88.9	-43.5	0	0	0	115.5
1023	T	42.4	Very low	47	Very low	117 Å²	117	133.3 Å²	133.3	72%	0.718	68%	0.677	S	S	*	*			trans	-131.6	119.4	-177.8	57	0	0	0	0	114	E1021	E1021-T1023 VanDerWaalsContact C-N 3.32Å; E1021-T1023 PolarHBondContact O-N 2.87Å
1024	A	42.5	Very low	46.2	Very low	79 Å²	79	129.6 Å²	129.6	65%	0.653	68%	0.677	S	S	*	*			trans	-72	134.9	172.6	0	0	0	0	0	111.8	R1026	A1024-R1026 PolarHBondContact O-N 2.73Å
1025	P	40.8	Very low	45.6	Very low	129 Å²	129	130.5 Å²	130.5	84%	0.838	68%	0.679	S	S	*	*			trans	-74.1	125.8	-170.7	28.5	-35.3	0	0	0	112.6
1026	R	42.3	Very low	45.5	Very low	245 Å²	245	129.8 Å²	129.8	93%	0.925	67%	0.672	S	S	*	*			trans	-144.6	14.7	175.3	-141.4	179.8	-175.9	-161.2	-3	115.7	A1024	A1024-R1026 PolarHBondContact O-N 2.73Å
1027	Q	38.7	Very low	44.8	Very low	191 Å²	191	134 Å²	134	89%	0.893	69%	0.691	S	S	*	*	S	Bend	trans	-146.5	27.6	-165.3	-127.6	171.6	3.6	0	0	116.7
1028	R	39.4	Very low	44.4	Very low	218 Å²	218	129.8 Å²	129.8	82%	0.823	68%	0.682	S	S	*	*			trans	-134.5	65.9	171.4	-70.4	-163.2	-175.5	-166.5	3.8	113
1029	M	38.9	Very low	44.2	Very low	168 Å²	168	128.6 Å²	128.6	83%	0.828	68%	0.677	S	S	*	*			trans	-152.5	34.9	172.4	-140.4	-176.6	82.1	0	0	115.2
1030	N	40.9	Very low	43.5	Very low	173 Å²	173	127.1 Å²	127.1	93%	0.925	67%	0.673	S	S	*	*			trans	-124.4	51.5	169.9	-85.7	-3.4	0	0	0	110.3
1031	E	40.2	Very low	43.6	Very low	92 Å²	92	130.7 Å²	130.7	43%	0.43	68%	0.678	S	S	.	*			trans	-115.1	127.2	176	-71.8	157.9	-154.6	0	0	108.5	R1036	E1031-R1036 IonicContact OE2-CZ 2.63Å; E1031-R1036 VanDerWaalsContact OE2-CZ 3.29Å; E1031-R1036 IonicContact OE2-NE 3.8Å; E1031-R1036 PolarHBondContact OE2-NE 2.84Å; E1031-R1036 VanDerWaalsContact OE2-NE 3.08Å; E1031-R1036 IonicContact OE2-NH2 3.16Å; E1031-R1036 PolarHBondContact OE2-NH2 3.48Å
1032	S	41.3	Very low	43.1	Very low	76 Å²	76	130.9 Å²	130.9	53%	0.531	68%	0.681	S	S	.	*			trans	-75.1	139.4	-177.8	-56.3	0	0	0	0	111.3	A1034 Q1035	S1032-A1034 PolarHBondContact O-N 3.5Å; S1032-Q1035 PolarHBondContact O-N 3.36Å
1033	S	41.2	Very low	42.7	Very low	96 Å²	96	127.7 Å²	127.7	67%	0.671	68%	0.676	S	S	*	*	H	α-helix	trans	-61.4	-13.5	-176.5	-162.9	0	0	0	0	114.8
1034	A	43.3	Very low	42.7	Very low	68 Å²	68	126.1 Å²	126.1	56%	0.562	68%	0.675	S	S	*	*	H	α-helix	trans	-76	-34.3	172.9	0	0	0	0	0	113.5	S1032 L1037 I1038	S1032-A1034 PolarHBondContact O-N 3.5Å; A1034-L1037 PolarHBondContact O-N 3.17Å; A1034-I1038 PolarHBondContact O-N 3.35Å
1035	Q	47.8	Very low	42.4	Very low	116 Å²	116	128 Å²	128	54%	0.542	68%	0.678	S	S	.	*	H	α-helix	trans	-70.4	-40.4	178	-75.7	173.8	-66.7	0	0	111.1	S1032 L1037 I1038 E1039	S1032-Q1035 PolarHBondContact O-N 3.36Å; Q1035-L1037 PolarHBondContact O-N 3.18Å; Q1035-I1038 PolarHBondContact O-N 3.44Å; Q1035-E1039 PolarHBondContact O-N 3.44Å
1036	R	49.8	Very low	42.7	Very low	124 Å²	124	127.9 Å²	127.9	47%	0.468	68%	0.678	S	S	.	*	H	α-helix	trans	-61.6	-25.7	176.9	-68.2	-175.5	176.8	-178.2	-2.4	114	E1031 T1040	E1031-R1036 IonicContact OE2-CZ 2.63Å; E1031-R1036 VanDerWaalsContact OE2-CZ 3.29Å; E1031-R1036 IonicContact OE2-NE 3.8Å; E1031-R1036 PolarHBondContact OE2-NE 2.84Å; E1031-R1036 VanDerWaalsContact OE2-NE 3.08Å; E1031-R1036 IonicContact OE2-NH2 3.16Å; E1031-R1036 PolarHBondContact OE2-NH2 3.48Å; R1036-T1040 WeakPolarHBondContact O-CG2 3.39Å; R1036-T1040 PolarHBondContact O-N 3.37Å; R1036-T1040 PolarHBondContact O-OG1 3.37Å
1037	L	41.8	Very low	42.3	Very low	114 Å²	114	125.5 Å²	125.5	60%	0.597	68%	0.677	S	S	*	*	H	α-helix	trans	-77.8	-30.5	174.1	-81.9	163.9	0	0	0	112.9	A1034 Q1035 T1040	A1034-L1037 PolarHBondContact O-N 3.17Å; Q1035-L1037 PolarHBondContact O-N 3.18Å; L1037-T1040 WeakPolarHBondContact CA-OG1 3.13Å; L1037-T1040 PolarHBondContact O-OG1 2.99Å
1038	I	50.1	Low	42.2	Very low	113 Å²	113	126 Å²	126	58%	0.579	68%	0.676	S	S	*	*	H	α-helix	trans	-75	-37.5	175.6	-63.3	168.6	0	0	0	110.2	A1034 Q1035 I1042	A1034-I1038 PolarHBondContact O-N 3.35Å; Q1035-I1038 PolarHBondContact O-N 3.44Å; I1038-I1042 HydrophobicContact CG2-CD1 4.22Å; I1038-I1042 WeakPolarHBondContact O-CG1 3.34Å
1039	E	45.8	Very low	42.3	Very low	128 Å²	128	124.9 Å²	124.9	60%	0.598	70%	0.697	S	S	*	*	H	α-helix	trans	-70	-31.5	178.1	-68.8	176.8	153.2	0	0	113	Q1035	Q1035-E1039 PolarHBondContact O-N 3.44Å
1040	T	46.8	Very low	42.5	Very low	87 Å²	87	122.8 Å²	122.8	53%	0.534	69%	0.691	S	S	.	*	H	α-helix	trans	-67.9	-35.3	177.2	42.1	0	0	0	0	113.8	R1036 L1037 I1042	R1036-T1040 WeakPolarHBondContact O-CG2 3.39Å; R1036-T1040 PolarHBondContact O-N 3.37Å; R1036-T1040 PolarHBondContact O-OG1 3.37Å; L1037-T1040 WeakPolarHBondContact CA-OG1 3.13Å; L1037-T1040 PolarHBondContact O-OG1 2.99Å; T1040-I1042 VanDerWaalsContact C-N 3.35Å
1041	D	42	Very low	42.6	Very low	137 Å²	137	120.1 Å²	120.1	73%	0.733	68%	0.678	S	S	*	*	H	α-helix	trans	-78.3	-20.1	-176.7	-75.2	-0.7	0	0	0	112.8
1042	I	42.8	Very low	42.7	Very low	126 Å²	126	121.7 Å²	121.7	65%	0.646	69%	0.692	S	S	*	*	H	α-helix	trans	-84.7	-27.3	179.8	-65.4	171.8	0	0	0	111.9	I1038 T1040 A1044	I1038-I1042 HydrophobicContact CG2-CD1 4.22Å; I1038-I1042 WeakPolarHBondContact O-CG1 3.34Å; T1040-I1042 VanDerWaalsContact C-N 3.35Å; I1042-A1044 PolarHBondContact O-N 3.18Å
1043	A	38.8	Very low	42.8	Very low	84 Å²	84	124.4 Å²	124.4	69%	0.694	70%	0.702	S	S	*	*	S	Bend	trans	-74.7	-4.2	-174.8	0	0	0	0	0	115.1	T1045	A1043-T1045 PolarHBondContact O-N 3.19Å
1044	A	42.6	Very low	42.9	Very low	85 Å²	85	126.1 Å²	126.1	70%	0.702	70%	0.704	S	S	*	*			trans	-92.4	43.5	-171.6	0	0	0	0	0	114.8	I1042	I1042-A1044 PolarHBondContact O-N 3.18Å
1045	T	35.9	Very low	42.9	Very low	117 Å²	117	130 Å²	130	72%	0.718	71%	0.713	S	S	*	*			trans	-131.7	126.9	169.7	42.2	0	0	0	0	112.6	A1043	A1043-T1045 PolarHBondContact O-N 3.19Å
1046	P	45.7	Very low	42.5	Very low	128 Å²	128	131 Å²	131	83%	0.831	73%	0.725	S	S	*	*			trans	-88	132.6	-179.4	33.3	-32.6	0	0	0	111.9
1047	Q	33.7	Very low	41.9	Very low	195 Å²	195	131.5 Å²	131.5	91%	0.911	75%	0.745	S	S	*	*			trans	-109.6	129.6	162	-68.6	-165.6	-4.6	0	0	110.6
1048	K	38.3	Very low	42	Very low	200 Å²	200	133 Å²	133	87%	0.87	76%	0.757	S	S	*	*			trans	-97.1	166.9	164.1	-76.5	-177.1	175.9	-178	0	108.9
1049	P	41.1	Very low	41.2	Very low	196 Å²	196	134.8 Å²	134.8	100%	1.273	77%	0.774	S	S	*	*			cis	-104.7	0	-6.8	38	-30.1	0	0	0	114

Retrieved 1,049 of 1,049 residues in 315.3 ms (Link to these results)

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