A0A077Z8E6_TRITR Loading...

t-SNARE coiled-coil homology domain-containing protein

AlphaFold DB , UniProt , Accession A0A077Z8E6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 597 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.5	Very low	29.4	Very low	82 Å²	82	52.9 Å²	52.9	40%	0.404	29%	0.293	S	S	.	.				0	103.4	0	-162.4	-178.4	171.6	0	0	106.4	I3 I39 L75 A79 F81 V85	M1-I3 HydrophobicContact CB-CD1 4.46Å; M1-I3 HydrophobicContact CB-CG1 4.16Å; M1-I3 HydrophobicContact CE-CD1 4.08Å; M1-I3 HydrophobicContact CE-CG1 3.68Å; M1-I3 HydrophobicContact CG-CD1 4.06Å; M1-I3 HydrophobicContact CG-CG1 3.49Å; M1-I3 VanDerWaalsContact CG-CG1 3.49Å; M1-I3 HydrophobicContact SD-CD1 3.77Å; M1-I3 HydrophobicContact SD-CG1 3.71Å; M1-I39 HydrophobicContact CE-CD1 4.24Å; M1-L75 HydrophobicContact SD-CD1 4.02Å; M1-A79 HydrophobicContact CE-CB 3.84Å; M1-A79 HydrophobicContact SD-CB 4.21Å; M1-F81 HydrophobicContact CE-CD1 4.46Å; M1-F81 HydrophobicContact CE-CE1 3.66Å; M1-V85 HydrophobicContact CE-CG1 4.37Å
2	L	31.4	Very low	29.2	Very low	44 Å²	44	57.6 Å²	57.6	23%	0.23	32%	0.316	C	S	.	.			trans	-82.1	120.6	161.9	-74.7	162.5	0	0	0	105.2	I88 L90 A157 I160 V183	L2-I88 HydrophobicContact CB-CG2 3.81Å; L2-I88 WeakPolarHBondContact O-CG2 3.13Å; L2-L90 HydrophobicContact CD1-CD2 3.25Å; L2-L90 HydrophobicContact CD1-CG 4.16Å; L2-A157 HydrophobicContact CD1-CB 4.38Å; L2-I160 HydrophobicContact CD2-CD1 3.88Å; L2-V183 HydrophobicContact CD1-CG1 3.88Å
3	I	32.8	Very low	28.9	Very low	26 Å²	26	66.6 Å²	66.6	13%	0.133	35%	0.354	C	S	.	.			trans	-107.1	100	-173.3	-58.2	158.9	0	0	0	105.9	M1 S5 V7 V37 I39	M1-I3 HydrophobicContact CB-CD1 4.46Å; M1-I3 HydrophobicContact CB-CG1 4.16Å; M1-I3 HydrophobicContact CE-CD1 4.08Å; M1-I3 HydrophobicContact CE-CG1 3.68Å; M1-I3 HydrophobicContact CG-CD1 4.06Å; M1-I3 HydrophobicContact CG-CG1 3.49Å; M1-I3 VanDerWaalsContact CG-CG1 3.49Å; M1-I3 HydrophobicContact SD-CD1 3.77Å; M1-I3 HydrophobicContact SD-CG1 3.71Å; I3-S5 PolarHBondContact O-N 2.81Å; I3-V7 HydrophobicContact CB-CG2 4.2Å; I3-V37 HydrophobicContact CD1-CG1 4.27Å; I3-I39 HydrophobicContact CD1-CD1 3.31Å; I3-I39 HydrophobicContact CD1-CG1 4.08Å; I3-I39 HydrophobicContact CG1-CD1 4.2Å; I3-I39 HydrophobicContact CG2-CD1 4.23Å; I3-I39 HydrophobicContact CG2-CG1 4.22Å; I3-I39 HydrophobicContact CG2-CG2 3.75Å
4	S	28.8	Very low	28.6	Very low	22 Å²	22	73.1 Å²	73.1	15%	0.154	38%	0.382	C	S	.	.			trans	-85.2	86	172.1	79.1	0	0	0	0	109.3	I88 I148	S4-I88 WeakPolarHBondContact OG-CD1 3.29Å; S4-I148 VanDerWaalsContact CB-CD1 3.48Å
5	S	28.2	Very low	28.4	Very low	57 Å²	57	75.3 Å²	75.3	40%	0.399	40%	0.402	S	S	.	.	S	Bend	trans	179.4	85.7	159.5	-74.3	0	0	0	0	104.1	I3 V7	I3-S5 PolarHBondContact O-N 2.81Å; S5-V7 PolarHBondContact O-N 3.2Å
6	S	31.9	Very low	28.3	Very low	16 Å²	16	78.6 Å²	78.6	11%	0.112	43%	0.429	C	S	.	.			trans	39.4	77.6	168.2	-49.2	0	0	0	0	116.8	I8 Y114	S6-I8 PolarHBondContact O-N 3.36Å; S6-Y114 WeakPolarHBondContact OG-CD1 3.46Å; S6-Y114 WeakPolarHBondContact OG-CE1 3.12Å
7	V	31.9	Very low	28.2	Very low	53 Å²	53	81.7 Å²	81.7	32%	0.321	45%	0.451	S	S	.	.			trans	-67.1	89.6	158.4	178.8	0	0	0	0	107.7	I3 S5 L9 V37	I3-V7 HydrophobicContact CB-CG2 4.2Å; S5-V7 PolarHBondContact O-N 3.2Å; V7-L9 HydrophobicContact CG1-CD1 4.25Å; V7-L9 PolarHBondContact O-N 3.18Å; V7-V37 HydrophobicContact CG1-CG1 4.18Å; V7-V37 HydrophobicContact CG2-CG1 4.13Å
8	I	30.4	Very low	28.1	Very low	33 Å²	33	88.4 Å²	88.4	17%	0.169	48%	0.475	C	S	.	.			trans	-76.9	101.5	164.8	-55.9	162.7	0	0	0	105.7	S6 S10 F108	S6-I8 PolarHBondContact O-N 3.36Å; I8-S10 PolarHBondContact O-N 3.39Å; I8-F108 HydrophobicContact CD1-CB 3.73Å; I8-F108 HydrophobicContact CD1-CD1 3.3Å; I8-F108 HydrophobicContact CD1-CD2 3.65Å; I8-F108 HydrophobicContact CD1-CE1 3.62Å; I8-F108 HydrophobicContact CD1-CE2 3.93Å; I8-F108 HydrophobicContact CD1-CG 3.28Å; I8-F108 HydrophobicContact CD1-CZ 3.89Å; I8-F108 HydrophobicContact CG1-CB 3.73Å; I8-F108 HydrophobicContact CG1-CD1 3.99Å; I8-F108 HydrophobicContact CG1-CG 3.87Å
9	L	28.9	Very low	28.1	Very low	62 Å²	62	91.9 Å²	91.9	33%	0.325	49%	0.488	S	S	.	.			trans	-65	82.1	157	-103.8	115.9	0	0	0	107.6	V7 H11 M20 L35	V7-L9 HydrophobicContact CG1-CD1 4.25Å; V7-L9 PolarHBondContact O-N 3.18Å; L9-H11 PolarHBondContact O-N 3.15Å; L9-M20 HydrophobicContact CD1-CE 4.48Å; L9-M20 HydrophobicContact CD2-CE 3.94Å; L9-L35 HydrophobicContact CD2-CD2 3.32Å; L9-L35 HydrophobicContact CG-CD2 4.24Å
10	S	24.9	Very low	28.2	Very low	45 Å²	45	93.1 Å²	93.1	32%	0.315	49%	0.492	S	S	.	.			trans	-79.7	71.7	176.4	58.1	0	0	0	0	110	I8 R38	I8-S10 PolarHBondContact O-N 3.39Å; S10-R38 PolarHBondContact OG-NE 2.85Å; S10-R38 PolarHBondContact OG-NH2 3.24Å
11	H	25.2	Very low	28.2	Very low	142 Å²	142	92.6 Å²	92.6	66%	0.657	49%	0.487	S	S	*	.			trans	179.3	77.3	149.9	-110.1	-16.7	0	0	0	110.9	L9	L9-H11 PolarHBondContact O-N 3.15Å
12	L	26.4	Very low	28.4	Very low	109 Å²	109	91 Å²	91	57%	0.571	48%	0.483	S	S	*	.			trans	-128.8	73.1	154.5	-87.4	166.3	0	0	0	107.3	Q14 M20	L12-Q14 PolarHBondContact O-N 3.12Å; L12-M20 HydrophobicContact CD1-SD 4.2Å
13	E	25.1	Very low	28.3	Very low	175 Å²	175	91.3 Å²	91.3	82%	0.818	49%	0.489	S	S	*	.			trans	-92.5	63.3	167.5	-156.3	161.7	-164.2	0	0	107.5
14	Q	25.4	Very low	28.6	Very low	158 Å²	158	94.2 Å²	94.2	74%	0.738	52%	0.517	S	S	*	.	S	Bend	trans	-144	144.1	165.7	-76.9	-163.6	-7.2	0	0	109.4	L12	L12-Q14 PolarHBondContact O-N 3.12Å
15	P	25.3	Very low	28.9	Very low	105 Å²	105	102 Å²	102	68%	0.682	55%	0.548	S	S	*	.			trans	-60.5	155.2	-171.6	24	-34.2	0	0	0	113.6	T17	P15-T17 PolarHBondContact O-N 3.16Å
16	P	26.7	Very low	29.4	Very low	129 Å²	129	106.3 Å²	106.3	84%	0.838	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	82.6	-165	34.9	-33.8	0	0	0	111
17	T	26.4	Very low	29.7	Very low	131 Å²	131	115.2 Å²	115.2	80%	0.804	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-145.2	-3.8	171.6	45	0	0	0	0	115.9	P15	P15-T17 PolarHBondContact O-N 3.16Å
18	K	26.6	Very low	30	Very low	202 Å²	202	117.7 Å²	117.7	88%	0.878	61%	0.61	S	S	*	*	S	Bend	trans	-115.3	119.3	173.7	-78.3	-175.9	175	-176.5	0	110.5	M20	K18-M20 PolarHBondContact O-N 3.37Å
19	Q	28.8	Very low	30.5	Very low	156 Å²	156	118.9 Å²	118.9	73%	0.729	63%	0.631	S	S	*	*			trans	-40.2	131.7	171.1	-74.1	164.2	-48.6	0	0	110.1	H21	Q19-H21 HydrophobicContact CB-CB 3.9Å; Q19-H21 PolarHBondContact O-N 3.12Å
20	M	30.4	Very low	31.3	Very low	114 Å²	114	120.3 Å²	120.3	56%	0.562	64%	0.639	S	S	*	*			trans	-74.6	64.5	150.7	-159.5	168.7	162.5	0	0	106.3	L9 L12 K18 C22	L9-M20 HydrophobicContact CD1-CE 4.48Å; L9-M20 HydrophobicContact CD2-CE 3.94Å; L12-M20 HydrophobicContact CD1-SD 4.2Å; K18-M20 PolarHBondContact O-N 3.37Å; M20-C22 PolarHBondContact O-N 2.88Å
21	H	28.2	Very low	32.3	Very low	83 Å²	83	124.4 Å²	124.4	38%	0.384	65%	0.648	S	S	.	*			trans	-63.2	106.1	167.5	-146	34.7	0	0	0	102.4	Q19 S23 D68	Q19-H21 HydrophobicContact CB-CB 3.9Å; Q19-H21 PolarHBondContact O-N 3.12Å; H21-S23 VanDerWaalsContact CD2-CB 3.43Å; H21-S23 WeakPolarHBondContact CD2-CB 3.36Å; H21-S23 PolarHBondContact O-N 3.35Å; H21-D68 IonicContact CE1-OD1 3.91Å; H21-D68 PolarHBondContact CE1-OD1 2.81Å; H21-D68 IonicContact CE1-OD2 2.64Å; H21-D68 PolarHBondContact CE1-OD2 3.2Å; H21-D68 IonicContact CG-OD1 3.61Å; H21-D68 IonicContact ND1-OD1 2.76Å; H21-D68 PolarHBondContact ND1-OD1 2.99Å; H21-D68 IonicContact ND1-OD2 2.63Å
22	C	31.6	Very low	33.4	Very low	48 Å²	48	120.6 Å²	120.6	32%	0.324	63%	0.632	S	S	.	*			trans	-68.5	40.7	165.6	-71.3	0	0	0	0	109.6	M20 A24 P60	M20-C22 PolarHBondContact O-N 2.88Å; C22-A24 PolarHBondContact O-N 2.8Å; C22-P60 HydrophobicContact CB-CB 4.31Å; C22-P60 WeakPolarHBondContact O-CB 3.24Å
23	S	29.5	Very low	34.3	Very low	52 Å²	52	120 Å²	120	36%	0.364	63%	0.627	S	S	.	*			trans	-76.1	119.6	176.1	-154.8	0	0	0	0	106	H21 K25	H21-S23 VanDerWaalsContact CD2-CB 3.43Å; H21-S23 WeakPolarHBondContact CD2-CB 3.36Å; H21-S23 PolarHBondContact O-N 3.35Å; S23-K25 PolarHBondContact O-N 3.32Å
24	A	39.1	Very low	35.8	Very low	87 Å²	87	118.1 Å²	118.1	72%	0.719	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.1	29.3	-179.6	0	0	0	0	0	114.4	C22 P60	C22-A24 PolarHBondContact O-N 2.8Å; A24-P60 HydrophobicContact CB-CG 4.48Å
25	K	35.3	Very low	37.6	Very low	185 Å²	185	112 Å²	112	80%	0.804	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.7	-6.4	-171.4	-77.4	-170.2	174	-180	0	115.1	S23 K27	S23-K25 PolarHBondContact O-N 3.32Å; K25-K27 PolarHBondContact O-N 3.07Å
26	E	39.3	Very low	39.4	Very low	148 Å²	148	111 Å²	111	69%	0.692	57%	0.573	S	S	*	*			trans	-93.3	82.8	171.2	-149.3	162.6	-153.7	0	0	109.4	D28	E26-D28 PolarHBondContact O-N 2.92Å
27	K	37.3	Very low	41.5	Very low	202 Å²	202	105.3 Å²	105.3	88%	0.878	54%	0.536	S	S	*	.			trans	-68.1	23.6	176.9	-81.1	-174.2	175.2	180	0	113.6	K25 G29	K25-K27 PolarHBondContact O-N 3.07Å; K27-G29 PolarHBondContact O-N 3.42Å
28	D	40	Very low	43.5	Very low	105 Å²	105	102.2 Å²	102.2	56%	0.561	51%	0.51	S	S	*	.			trans	-80.8	92	173.3	-83.4	-2.1	0	0	0	108.6	E26 N30 Y31	E26-D28 PolarHBondContact O-N 2.92Å; D28-N30 PolarHBondContact O-N 3.06Å; D28-Y31 PolarHBondContact O-N 2.94Å
29	G	40.1	Very low	45.7	Very low	59 Å²	59	92.8 Å²	92.8	61%	0.608	47%	0.469	S	S	*	.	H	α-helix	trans	-53.1	-13	176.5	0	0	0	0	0	114.5	K27	K27-G29 PolarHBondContact O-N 3.42Å
30	N	45.7	Very low	47.3	Very low	91 Å²	91	85.8 Å²	85.8	49%	0.487	44%	0.438	S	S	.	.	H	α-helix	trans	-81.8	-17.3	179.2	-140.2	-11.9	0	0	0	113.9	D28	D28-N30 PolarHBondContact O-N 3.06Å
31	Y	46.7	Very low	48.8	Very low	132 Å²	132	82.2 Å²	82.2	52%	0.518	42%	0.423	S	S	.	.	H	α-helix	trans	-80.2	-36.6	-178.7	-131.9	-84.3	0	0	0	112.2	D28 E33 K34	D28-Y31 PolarHBondContact O-N 2.94Å; Y31-E33 VanDerWaalsContact C-N 3.34Å; Y31-E33 PolarHBondContact O-N 2.88Å; Y31-K34 PolarHBondContact O-N 3.12Å
32	L	48.3	Very low	50.3	Low	61 Å²	61	79.9 Å²	79.9	32%	0.319	42%	0.418	S	S	.	.	H	α-helix	trans	-67.6	-32.5	178	-66.7	179	0	0	0	112.7	K34 L35 A58	L32-K34 PolarHBondContact O-N 2.03Å; L32-L35 HydrophobicContact CD2-CD1 3.77Å; L32-L35 PolarHBondContact O-N 3.12Å; L32-A58 HydrophobicContact CD2-CB 3.87Å
33	E	45.2	Very low	51.5	Low	97 Å²	97	83.5 Å²	83.5	45%	0.453	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-18	176.3	-66.4	-154.3	137.5	0	0	113.7	Y31	Y31-E33 VanDerWaalsContact C-N 3.34Å; Y31-E33 PolarHBondContact O-N 2.88Å
34	K	55.4	Low	52.5	Low	135 Å²	135	88.3 Å²	88.3	59%	0.587	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-5.5	178.9	-64.4	176.9	-176	173.3	0	113.4	Y31 L32 F36	Y31-K34 PolarHBondContact O-N 3.12Å; L32-K34 PolarHBondContact O-N 2.03Å; K34-F36 WeakPolarHBondContact O-CD2 2.88Å; K34-F36 VanDerWaalsContact O-CE2 3.25Å; K34-F36 WeakPolarHBondContact O-CE2 3.37Å
35	L	62.6	Low	53.1	Low	29 Å²	29	87.4 Å²	87.4	15%	0.152	43%	0.433	C	S	.	.			trans	-84.3	115.3	179	-82.1	156.4	0	0	0	110.4	L9 L32 V55	L9-L35 HydrophobicContact CD2-CD2 3.32Å; L9-L35 HydrophobicContact CG-CD2 4.24Å; L32-L35 HydrophobicContact CD2-CD1 3.77Å; L32-L35 PolarHBondContact O-N 3.12Å; L35-V55 HydrophobicContact CB-CB 4.13Å; L35-V55 HydrophobicContact CB-CG2 4.02Å; L35-V55 PolarHBondContact O-N 3.26Å
36	F	64.7	Low	53.8	Low	86 Å²	86	87.5 Å²	87.5	38%	0.377	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	136.1	176.1	-56.6	-81.5	0	0	0	110	K34 M52 T54	K34-F36 WeakPolarHBondContact O-CD2 2.88Å; K34-F36 VanDerWaalsContact O-CE2 3.25Å; K34-F36 WeakPolarHBondContact O-CE2 3.37Å; F36-M52 HydrophobicContact CB-SD 4.4Å; F36-T54 HydrophobicContact CD1-CG2 3.94Å; F36-T54 HydrophobicContact CE1-CG2 3.66Å
37	V	69.8	Low	54.3	Low	9 Å²	9	85.1 Å²	85.1	6%	0.055	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	131.6	173.4	-179.9	0	0	0	0	108	I3 V7 I39 L53 V55 L75	I3-V37 HydrophobicContact CD1-CG1 4.27Å; V7-V37 HydrophobicContact CG1-CG1 4.18Å; V7-V37 HydrophobicContact CG2-CG1 4.13Å; V37-I39 HydrophobicContact CG1-CD1 4.25Å; V37-I39 HydrophobicContact CG1-CG1 3.81Å; V37-L53 PolarHBondContact N-O 3.24Å; V37-L53 PolarHBondContact O-N 2.75Å; V37-V55 HydrophobicContact CG2-CG2 3.79Å; V37-L75 HydrophobicContact CB-CD2 4.3Å; V37-L75 HydrophobicContact CG2-CD2 4.3Å
38	R	69.3	Low	55	Low	66 Å²	66	78.2 Å²	78.2	25%	0.249	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	131.9	171.7	-57.7	-177.4	-168.1	-169.1	2	108.2	S10 Y50	S10-R38 PolarHBondContact OG-NE 2.85Å; S10-R38 PolarHBondContact OG-NH2 3.24Å; R38-Y50 HydrophobicContact CG-CD2 4.18Å; R38-Y50 HydrophobicContact CG-CE2 4.33Å
39	I	71.5	Confident	55.8	Low	4 Å²	4	79.6 Å²	79.6	2%	0.021	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	148.8	177.7	-45.1	-178.7	0	0	0	108.6	M1 I3 V37 L53 L75 A79 V85	M1-I39 HydrophobicContact CE-CD1 4.24Å; I3-I39 HydrophobicContact CD1-CD1 3.31Å; I3-I39 HydrophobicContact CD1-CG1 4.08Å; I3-I39 HydrophobicContact CG1-CD1 4.2Å; I3-I39 HydrophobicContact CG2-CD1 4.23Å; I3-I39 HydrophobicContact CG2-CG1 4.22Å; I3-I39 HydrophobicContact CG2-CG2 3.75Å; V37-I39 HydrophobicContact CG1-CD1 4.25Å; V37-I39 HydrophobicContact CG1-CG1 3.81Å; I39-L53 HydrophobicContact CD1-CD1 3.44Å; I39-L53 VanDerWaalsContact CD1-CD1 3.44Å; I39-L53 HydrophobicContact CG1-CD1 4.1Å; I39-L75 HydrophobicContact CD1-CD1 4.23Å; I39-A79 HydrophobicContact CD1-CB 4.15Å; I39-V85 HydrophobicContact CG2-CB 4.27Å; I39-V85 HydrophobicContact CG2-CG1 3.53Å; I39-V85 HydrophobicContact CG2-CG2 3.86Å
40	G	63.7	Low	56.8	Low	9 Å²	9	80 Å²	80	9%	0.093	41%	0.408	C	S	.	.			trans	85.7	28.5	170	0	0	0	0	0	115.2	V85	G40-V85 VanDerWaalsContact CA-CG2 3.49Å
41	V	62.2	Low	57.5	Low	38 Å²	38	79.7 Å²	79.7	23%	0.23	41%	0.409	C	S	.	.			trans	-90.8	121.7	179.3	-166.5	0	0	0	0	109.5	Y114	V41-Y114 HydrophobicContact CB-CE2 4.08Å; V41-Y114 WeakPolarHBondContact CB-OH 3.07Å; V41-Y114 HydrophobicContact CG1-CE2 3.58Å; V41-Y114 WeakPolarHBondContact CG1-OH 3.45Å
42	A	59.9	Low	58.5	Low	35 Å²	35	77.6 Å²	77.6	29%	0.289	41%	0.405	S	S	.	.			trans	-80	156.2	173.2	0	0	0	0	0	112.3	N44 E45	A42-N44 PolarHBondContact O-N 3.42Å; A42-E45 HydrophobicContact CB-CB 3.99Å; A42-E45 HydrophobicContact CB-CG 3.75Å; A42-E45 PolarHBondContact N-OE2 3.46Å; A42-E45 PolarHBondContact O-N 3Å; A42-E45 VanDerWaalsContact O-N 3.16Å
43	E	55.2	Low	59.4	Low	123 Å²	123	75.8 Å²	75.8	58%	0.575	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-25	-175.2	-170.5	165.9	-164.5	0	0	114.3
44	N	50.8	Low	60.6	Low	154 Å²	154	73.1 Å²	73.1	82%	0.824	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.2	14.3	-177.5	-64	-49.2	0	0	0	113.6	A42	A42-N44 PolarHBondContact O-N 3.42Å
45	E	51.9	Low	61.3	Low	68 Å²	68	66.9 Å²	66.9	32%	0.318	36%	0.359	S	S	.	.			trans	-77.6	132.8	179.3	-97.5	178.6	164.1	0	0	111.5	A42	A42-E45 HydrophobicContact CB-CB 3.99Å; A42-E45 HydrophobicContact CB-CG 3.75Å; A42-E45 PolarHBondContact N-OE2 3.46Å; A42-E45 PolarHBondContact O-N 3Å; A42-E45 VanDerWaalsContact O-N 3.16Å
46	K	49.6	Very low	61.6	Low	186 Å²	186	67.3 Å²	67.3	81%	0.809	37%	0.365	S	S	*	.			trans	-53	136.1	171.9	-70.7	-178	179.4	179.6	0	109.1	G48	K46-G48 VanDerWaalsContact C-N 3.29Å; K46-G48 PolarHBondContact O-N 3.29Å
47	P	51	Low	61.6	Low	99 Å²	99	68.5 Å²	68.5	64%	0.643	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	86.6	-179.6	25.8	-33.4	0	0	0	110.5
48	G	52.1	Low	61.2	Low	56 Å²	56	70.1 Å²	70.1	58%	0.577	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-172.5	-26	-176.8	0	0	0	0	0	115.9	K46 Y50	K46-G48 VanDerWaalsContact C-N 3.29Å; K46-G48 PolarHBondContact O-N 3.29Å; G48-Y50 PolarHBondContact O-N 3.02Å
49	N	56	Low	60.9	Low	135 Å²	135	69.4 Å²	69.4	72%	0.722	39%	0.386	S	S	*	.	S	Bend	trans	-89.5	10	-176.8	-93.8	2.4	0	0	0	115.6
50	Y	61	Low	60.4	Low	68 Å²	68	70.7 Å²	70.7	27%	0.267	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-90.8	145	-174.5	60.3	-85.8	0	0	0	112.7	R38 G48 M52	R38-Y50 HydrophobicContact CG-CD2 4.18Å; R38-Y50 HydrophobicContact CG-CE2 4.33Å; G48-Y50 PolarHBondContact O-N 3.02Å; Y50-M52 HydrophobicContact CD2-CG 3.92Å; Y50-M52 HydrophobicContact CE2-CE 4.23Å; Y50-M52 HydrophobicContact CE2-CG 3.56Å; Y50-M52 HydrophobicContact CE2-SD 4.32Å
51	T	61.8	Low	60.1	Low	84 Å²	84	70.8 Å²	70.8	52%	0.515	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	117.9	169.3	51.1	0	0	0	0	109.8
52	M	66.1	Low	59.7	Low	87 Å²	87	73.4 Å²	73.4	43%	0.429	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	122.5	166.6	-75.7	-148.5	-111.1	0	0	109.9	F36 Y50	F36-M52 HydrophobicContact CB-SD 4.4Å; Y50-M52 HydrophobicContact CD2-CG 3.92Å; Y50-M52 HydrophobicContact CE2-CE 4.23Å; Y50-M52 HydrophobicContact CE2-CG 3.56Å; Y50-M52 HydrophobicContact CE2-SD 4.32Å
53	L	68.4	Low	59.3	Low	23 Å²	23	71.7 Å²	71.7	12%	0.12	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	133.2	177.5	-57.9	178	0	0	0	109.7	V37 I39 L75 A79	V37-L53 PolarHBondContact N-O 3.24Å; V37-L53 PolarHBondContact O-N 2.75Å; I39-L53 HydrophobicContact CD1-CD1 3.44Å; I39-L53 VanDerWaalsContact CD1-CD1 3.44Å; I39-L53 HydrophobicContact CG1-CD1 4.1Å; L53-L75 HydrophobicContact CB-CD2 4Å; L53-L75 HydrophobicContact CD1-CD1 3.74Å; L53-A79 HydrophobicContact CD1-CB 3.69Å
54	T	70.5	Confident	59.1	Low	42 Å²	42	71.2 Å²	71.2	26%	0.258	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	139.9	177.2	17.8	0	0	0	0	110.3	F36 R76	F36-T54 HydrophobicContact CD1-CG2 3.94Å; F36-T54 HydrophobicContact CE1-CG2 3.66Å; T54-R76 WeakPolarHBondContact O-CB 3.5Å; T54-R76 PolarHBondContact O-N 2.04Å
55	V	69.6	Low	58.9	Low	4 Å²	4	67.6 Å²	67.6	2%	0.024	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	133	172.8	179.7	0	0	0	0	109.1	L35 V37 F73	L35-V55 HydrophobicContact CB-CB 4.13Å; L35-V55 HydrophobicContact CB-CG2 4.02Å; L35-V55 PolarHBondContact O-N 3.26Å; V37-V55 HydrophobicContact CG2-CG2 3.79Å; V55-F73 HydrophobicContact CG1-CB 4.15Å; V55-F73 HydrophobicContact CG1-CD1 3.86Å; V55-F73 HydrophobicContact CG1-CG 4.45Å; V55-F73 HydrophobicContact CG2-CB 4.36Å; V55-F73 HydrophobicContact CG2-CD1 4.36Å
56	S	68.3	Low	58.8	Low	38 Å²	38	69.7 Å²	69.7	27%	0.266	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	-50.2	174	175.9	0	0	0	0	111	K74	S56-K74 WeakPolarHBondContact CB-O 3.07Å; S56-K74 PolarHBondContact N-O 2.93Å
57	H	64.5	Low	58.7	Low	110 Å²	110	64.7 Å²	64.7	51%	0.509	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	144.8	-179.1	-66.1	75	0	0	0	109.5	K74	H57-K74 HydrophobicContact CB-CB 4.37Å; H57-K74 PolarHBondContact N-O 3.33Å; H57-K74 PolarHBondContact O-N 3.44Å
58	A	62.4	Low	58.7	Low	43 Å²	43	63 Å²	63	36%	0.355	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	130.1	169.3	0	0	0	0	0	108.2	L32 I72 F73	L32-A58 HydrophobicContact CD2-CB 3.87Å; A58-I72 WeakPolarHBondContact CA-O 3.29Å; A58-F73 HydrophobicContact CB-CD1 3.63Å; A58-F73 HydrophobicContact CB-CE1 3.66Å
59	L	62.9	Low	58.9	Low	51 Å²	51	61.8 Å²	61.8	27%	0.267	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	125.4	-179.7	-78.6	159.2	0	0	0	107.8	F61 G71 I72 Y192 N196	L59-F61 PolarHBondContact O-N 3.5Å; L59-G71 CarbonylContact O-C 3.39Å; L59-G71 WeakPolarHBondContact O-CA 3.19Å; L59-I72 PolarHBondContact N-O 3.26Å; L59-I72 PolarHBondContact O-N 2.95Å; L59-Y192 HydrophobicContact CB-CE1 4.12Å; L59-Y192 HydrophobicContact CD2-CE1 4.24Å; L59-N196 HydrophobicContact CD2-CB 4.09Å
60	P	60.6	Low	59.4	Low	32 Å²	32	55.7 Å²	55.7	21%	0.208	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	134.8	168.8	22.8	-28	0	0	0	109.1	C22 A24 Y192	C22-P60 HydrophobicContact CB-CB 4.31Å; C22-P60 WeakPolarHBondContact O-CB 3.24Å; A24-P60 HydrophobicContact CB-CG 4.48Å; P60-Y192 WeakPolarHBondContact O-CE1 3.18Å; P60-Y192 PolarHBondContact O-OH 2.81Å
61	F	58.4	Low	59.7	Low	10 Å²	10	53.5 Å²	53.5	4%	0.044	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	121.8	175.6	-170.9	-125	0	0	0	108.7	L59 T63 V70 I72 V183 A184 L189 Y192	L59-F61 PolarHBondContact O-N 3.5Å; F61-T63 HydrophobicContact CD1-CG2 3.71Å; F61-T63 HydrophobicContact CE1-CG2 4.01Å; F61-T63 PolarHBondContact O-N 3.33Å; F61-V70 HydrophobicContact CB-CB 4.45Å; F61-V70 HydrophobicContact CB-CG1 4.13Å; F61-V70 HydrophobicContact CD1-CG1 4.13Å; F61-V70 PolarHBondContact N-O 2.83Å; F61-V70 VanDerWaalsContact O-O 3.06Å; F61-I72 HydrophobicContact CB-CD1 3.53Å; F61-I72 HydrophobicContact CB-CG1 3.82Å; F61-I72 HydrophobicContact CD1-CD1 4.41Å; F61-I72 HydrophobicContact CD2-CD1 3.4Å; F61-I72 HydrophobicContact CD2-CG1 4.44Å; F61-I72 HydrophobicContact CE2-CD1 4.22Å; F61-I72 HydrophobicContact CG-CD1 3.52Å; F61-I72 HydrophobicContact CG-CG1 4.09Å; F61-V183 HydrophobicContact CE1-CG1 4.4Å; F61-A184 HydrophobicContact CE1-CB 3.91Å; F61-A184 HydrophobicContact CZ-CB 3.95Å; F61-L189 HydrophobicContact CD2-CD1 3.98Å; F61-L189 HydrophobicContact CE2-CB 4.03Å; F61-L189 HydrophobicContact CE2-CD1 3.67Å; F61-L189 HydrophobicContact CE2-CG 4.5Å; F61-L189 HydrophobicContact CZ-CB 3.89Å; F61-L189 HydrophobicContact CZ-CD1 4.03Å; F61-Y192 HydrophobicContact CD2-CD1 4.41Å; F61-Y192 HydrophobicContact CD2-CG 4.36Å
62	L	52	Low	60.1	Low	93 Å²	93	51 Å²	51	49%	0.487	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	112	177.3	-69.7	166	0	0	0	108.5	Y192	L62-Y192 HydrophobicContact CD1-CE2 4.42Å
63	T	52.2	Low	60.5	Low	0 Å²	0	49.4 Å²	49.4	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	123.4	169.8	45.3	0	0	0	0	108.9	F61 G65 Q66 V70 S181 F182	F61-T63 HydrophobicContact CD1-CG2 3.71Å; F61-T63 HydrophobicContact CE1-CG2 4.01Å; F61-T63 PolarHBondContact O-N 3.33Å; T63-G65 VanDerWaalsContact C-N 3.31Å; T63-G65 PolarHBondContact O-N 3.38Å; T63-Q66 PolarHBondContact O-N 3.47Å; T63-Q66 VanDerWaalsContact O-N 3.17Å; T63-V70 HydrophobicContact CG2-CB 3.83Å; T63-V70 HydrophobicContact CG2-CG1 4.27Å; T63-V70 HydrophobicContact CG2-CG2 3.71Å; T63-V70 WeakPolarHBondContact OG1-CG2 3.47Å; T63-S181 WeakPolarHBondContact CB-OG 3.47Å; T63-S181 PolarHBondContact OG1-OG 3.47Å; T63-F182 WeakPolarHBondContact CB-O 3.23Å; T63-F182 VanDerWaalsContact CG2-O 3.3Å; T63-F182 WeakPolarHBondContact CG2-O 3.2Å
64	N	51.2	Low	60.6	Low	112 Å²	112	54.9 Å²	54.9	60%	0.599	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	39	177	-69.4	-4	0	0	0	116	Q66	N64-Q66 PolarHBondContact O-N 3.26Å
65	G	46.5	Very low	60.9	Low	79 Å²	79	54 Å²	54	81%	0.814	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.1	3.9	177	0	0	0	0	0	114.8	T63	T63-G65 VanDerWaalsContact C-N 3.31Å; T63-G65 PolarHBondContact O-N 3.38Å
66	Q	50.6	Low	61.1	Low	111 Å²	111	60.1 Å²	60.1	52%	0.519	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	126.2	167.3	-79.4	-178.3	-20.6	0	0	109	T63 N64 D68	T63-Q66 PolarHBondContact O-N 3.47Å; T63-Q66 VanDerWaalsContact O-N 3.17Å; N64-Q66 PolarHBondContact O-N 3.26Å; Q66-D68 PolarHBondContact O-N 2.94Å; Q66-D68 VanDerWaalsContact O-N 3.14Å
67	S	45.9	Very low	61.4	Low	82 Å²	82	63.2 Å²	63.2	57%	0.573	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.3	-7.6	175.2	46.5	0	0	0	0	113.7
68	D	52.9	Low	61.9	Low	62 Å²	62	63.5 Å²	63.5	33%	0.332	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	109.8	-164	-70.5	-58.2	0	0	0	111.2	H21 Q66	H21-D68 IonicContact CE1-OD1 3.91Å; H21-D68 PolarHBondContact CE1-OD1 2.81Å; H21-D68 IonicContact CE1-OD2 2.64Å; H21-D68 PolarHBondContact CE1-OD2 3.2Å; H21-D68 IonicContact CG-OD1 3.61Å; H21-D68 IonicContact ND1-OD1 2.76Å; H21-D68 PolarHBondContact ND1-OD1 2.99Å; H21-D68 IonicContact ND1-OD2 2.63Å; Q66-D68 PolarHBondContact O-N 2.94Å; Q66-D68 VanDerWaalsContact O-N 3.14Å
69	G	56.3	Low	62.4	Low	31 Å²	31	62.2 Å²	62.2	32%	0.32	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	162.9	-33.3	163.5	0	0	0	0	0	115.5
70	V	64.6	Low	63	Low	8 Å²	8	67.2 Å²	67.2	5%	0.048	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	137.4	-175.3	-177.5	0	0	0	0	110.7	F61 T63 I160	F61-V70 HydrophobicContact CB-CB 4.45Å; F61-V70 HydrophobicContact CB-CG1 4.13Å; F61-V70 HydrophobicContact CD1-CG1 4.13Å; F61-V70 PolarHBondContact N-O 2.83Å; F61-V70 VanDerWaalsContact O-O 3.06Å; T63-V70 HydrophobicContact CG2-CB 3.83Å; T63-V70 HydrophobicContact CG2-CG1 4.27Å; T63-V70 HydrophobicContact CG2-CG2 3.71Å; T63-V70 WeakPolarHBondContact OG1-CG2 3.47Å; V70-I160 HydrophobicContact CB-CD1 4.25Å; V70-I160 HydrophobicContact CG1-CD1 3.47Å; V70-I160 VanDerWaalsContact CG1-CD1 3.47Å; V70-I160 HydrophobicContact CG2-CB 4.19Å; V70-I160 HydrophobicContact CG2-CD1 3.76Å; V70-I160 HydrophobicContact CG2-CG1 4.49Å
71	G	67.8	Low	63.8	Low	22 Å²	22	71.6 Å²	71.6	23%	0.227	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	148.5	174.3	0	0	0	0	0	110.6	L59	L59-G71 CarbonylContact O-C 3.39Å; L59-G71 WeakPolarHBondContact O-CA 3.19Å
72	I	70.9	Confident	64.4	Low	31 Å²	31	72.9 Å²	72.9	16%	0.159	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	129.6	173.7	-61.2	147.8	0	0	0	108.5	A58 L59 F61 L189	A58-I72 WeakPolarHBondContact CA-O 3.29Å; L59-I72 PolarHBondContact N-O 3.26Å; L59-I72 PolarHBondContact O-N 2.95Å; F61-I72 HydrophobicContact CB-CD1 3.53Å; F61-I72 HydrophobicContact CB-CG1 3.82Å; F61-I72 HydrophobicContact CD1-CD1 4.41Å; F61-I72 HydrophobicContact CD2-CD1 3.4Å; F61-I72 HydrophobicContact CD2-CG1 4.44Å; F61-I72 HydrophobicContact CE2-CD1 4.22Å; F61-I72 HydrophobicContact CG-CD1 3.52Å; F61-I72 HydrophobicContact CG-CG1 4.09Å; I72-L189 HydrophobicContact CD1-CD1 3.13Å; I72-L189 HydrophobicContact CG1-CD1 4.01Å
73	F	74.2	Confident	65.5	Low	54 Å²	54	77 Å²	77	24%	0.237	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	125.9	171.5	-57.6	-74.2	0	0	0	109.9	V55 A58	V55-F73 HydrophobicContact CG1-CB 4.15Å; V55-F73 HydrophobicContact CG1-CD1 3.86Å; V55-F73 HydrophobicContact CG1-CG 4.45Å; V55-F73 HydrophobicContact CG2-CB 4.36Å; V55-F73 HydrophobicContact CG2-CD1 4.36Å; A58-F73 HydrophobicContact CB-CD1 3.63Å; A58-F73 HydrophobicContact CB-CE1 3.66Å
74	K	71.5	Confident	66.3	Low	137 Å²	137	81.2 Å²	81.2	60%	0.596	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.7	120.1	165.4	-175.8	177.2	-179.9	179.3	0	107.9	S56 H57	S56-K74 WeakPolarHBondContact CB-O 3.07Å; S56-K74 PolarHBondContact N-O 2.93Å; H57-K74 HydrophobicContact CB-CB 4.37Å; H57-K74 PolarHBondContact N-O 3.33Å; H57-K74 PolarHBondContact O-N 3.44Å
75	L	75.1	Confident	67.4	Low	23 Å²	23	76.7 Å²	76.7	12%	0.12	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	145.7	175.2	-59.4	173.2	0	0	0	110.2	M1 V37 I39 L53 N77 A79	M1-L75 HydrophobicContact SD-CD1 4.02Å; V37-L75 HydrophobicContact CB-CD2 4.3Å; V37-L75 HydrophobicContact CG2-CD2 4.3Å; I39-L75 HydrophobicContact CD1-CD1 4.23Å; L53-L75 HydrophobicContact CB-CD2 4Å; L53-L75 HydrophobicContact CD1-CD1 3.74Å; L75-N77 VanDerWaalsContact CB-O 3.27Å; L75-N77 WeakPolarHBondContact CB-O 3.39Å; L75-A79 HydrophobicContact CD1-CB 4.25Å
76	R	75	Confident	68.9	Low	134 Å²	134	79.6 Å²	79.6	51%	0.506	42%	0.419	S	S	.	.	S	Bend	trans	-64.1	-45	175.8	-177.3	179	-73.5	-157.9	-0.7	111.3	T54	T54-R76 WeakPolarHBondContact O-CB 3.5Å; T54-R76 PolarHBondContact O-N 2.04Å
77	N	74	Confident	70.4	Confident	103 Å²	103	77.8 Å²	77.8	55%	0.551	42%	0.417	S	S	*	.	S	Bend	trans	-114.7	138.6	171.8	-64.3	-9.7	0	0	0	108.5	L75	L75-N77 VanDerWaalsContact CB-O 3.27Å; L75-N77 WeakPolarHBondContact CB-O 3.39Å
78	P	75.2	Confident	72	Confident	116 Å²	116	74.9 Å²	74.9	75%	0.753	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-60.2	141.2	174.5	26.6	-33.2	0	0	0	110
79	A	73.5	Confident	73.3	Confident	15 Å²	15	75 Å²	75	12%	0.124	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-70.3	138.8	172.8	0	0	0	0	0	109.7	M1 I39 L53 L75	M1-A79 HydrophobicContact CE-CB 3.84Å; M1-A79 HydrophobicContact SD-CB 4.21Å; I39-A79 HydrophobicContact CD1-CB 4.15Å; L53-A79 HydrophobicContact CD1-CB 3.69Å; L75-A79 HydrophobicContact CD1-CB 4.25Å
80	I	74.4	Confident	74.4	Confident	157 Å²	157	75.2 Å²	75.2	81%	0.805	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-80.3	120.6	173.2	-58.1	173.3	0	0	0	107.3
81	F	77.9	Confident	74.7	Confident	124 Å²	124	75.4 Å²	75.4	54%	0.544	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-74.9	138.2	176.1	-56.9	-51.4	0	0	0	110.4	M1 V85 P87	M1-F81 HydrophobicContact CE-CD1 4.46Å; M1-F81 HydrophobicContact CE-CE1 3.66Å; F81-V85 WeakPolarHBondContact CA-O 3.08Å; F81-V85 HydrophobicContact CD1-CG1 4.32Å; F81-P87 HydrophobicContact CE1-CB 4.43Å; F81-P87 HydrophobicContact CE1-CG 4.23Å; F81-P87 HydrophobicContact CZ-CG 4.35Å
82	G	71.6	Confident	74.7	Confident	36 Å²	36	79.2 Å²	79.2	37%	0.371	41%	0.41	S	S	.	.	B	Isolated β-bridge	trans	-154.1	-168.1	-179.3	0	0	0	0	0	110.8	N84 V85	G82-N84 PolarHBondContact O-N 2.9Å; G82-V85 PolarHBondContact N-O 2.91Å; G82-V85 CarbonylContact O-C 3.59Å; G82-V85 PolarHBondContact O-N 2.98Å; G82-V85 VanDerWaalsContact O-O 3.09Å
83	H	74.3	Confident	74.2	Confident	179 Å²	179	81.6 Å²	81.6	83%	0.829	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-36.1	177.8	-68.5	-81.2	0	0	0	112.4
84	N	68.3	Low	73.3	Confident	90 Å²	90	85.7 Å²	85.7	48%	0.481	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-9.4	-177.7	-60	-4.2	0	0	0	113.8	G82	G82-N84 PolarHBondContact O-N 2.9Å
85	V	75.7	Confident	72.7	Confident	17 Å²	17	81.7 Å²	81.7	10%	0.103	44%	0.44	C	S	.	.	B	Isolated β-bridge	trans	-132.5	103.8	-174.8	-176.2	0	0	0	0	109.5	M1 I39 G40 F81 G82	M1-V85 HydrophobicContact CE-CG1 4.37Å; I39-V85 HydrophobicContact CG2-CB 4.27Å; I39-V85 HydrophobicContact CG2-CG1 3.53Å; I39-V85 HydrophobicContact CG2-CG2 3.86Å; G40-V85 VanDerWaalsContact CA-CG2 3.49Å; F81-V85 WeakPolarHBondContact CA-O 3.08Å; F81-V85 HydrophobicContact CD1-CG1 4.32Å; G82-V85 PolarHBondContact N-O 2.91Å; G82-V85 CarbonylContact O-C 3.59Å; G82-V85 PolarHBondContact O-N 2.98Å; G82-V85 VanDerWaalsContact O-O 3.09Å
86	K	77.2	Confident	71.9	Confident	140 Å²	140	89.8 Å²	89.8	61%	0.609	47%	0.474	S	S	*	.			trans	-130.4	143.9	175.4	-65.1	-177.8	-178.1	177.9	0	110.1
87	P	81.6	Confident	71.3	Confident	73 Å²	73	88.1 Å²	88.1	47%	0.474	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-70.3	153.3	170.5	31.8	-33.5	0	0	0	110.1	F81	F81-P87 HydrophobicContact CE1-CB 4.43Å; F81-P87 HydrophobicContact CE1-CG 4.23Å; F81-P87 HydrophobicContact CZ-CG 4.35Å
88	I	80.3	Confident	70.7	Confident	20 Å²	20	84.7 Å²	84.7	10%	0.103	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-97	147	169.6	-165.6	164.2	0	0	0	110.4	L2 S4 I148 L155 A157	L2-I88 HydrophobicContact CB-CG2 3.81Å; L2-I88 WeakPolarHBondContact O-CG2 3.13Å; S4-I88 WeakPolarHBondContact OG-CD1 3.29Å; I88-I148 HydrophobicContact CD1-CB 4.06Å; I88-I148 HydrophobicContact CD1-CD1 4.2Å; I88-I148 HydrophobicContact CD1-CG1 3.62Å; I88-I148 HydrophobicContact CD1-CG2 3.65Å; I88-L155 WeakPolarHBondContact CG1-O 3.41Å; I88-A157 HydrophobicContact CD1-CB 3.84Å; I88-A157 HydrophobicContact CG1-CB 4.11Å; I88-A157 HydrophobicContact CG2-CB 3.67Å
89	C	81.1	Confident	70.3	Confident	65 Å²	65	85.9 Å²	85.9	44%	0.439	45%	0.454	S	S	.	.	B	Isolated β-bridge	trans	-74.9	149.3	176	-64.2	0	0	0	0	111.1	L155 Y156 A157	C89-L155 WeakPolarHBondContact CB-O 3.21Å; C89-L155 PolarHBondContact N-O 2.94Å; C89-Y156 HydrophobicContact CB-CD1 3.67Å; C89-Y156 HydrophobicContact CB-CE1 3.9Å; C89-Y156 CarbonylContact O-C 3.57Å; C89-Y156 WeakPolarHBondContact O-CA 3.22Å; C89-A157 PolarHBondContact O-N 3.12Å
90	L	78	Confident	70.1	Confident	35 Å²	35	85.9 Å²	85.9	18%	0.183	45%	0.452	C	S	.	.	P	Polyproline II helix	trans	-89.2	149.8	169	-79.1	174.1	0	0	0	110	L2 V183 L186 L189	L2-L90 HydrophobicContact CD1-CD2 3.25Å; L2-L90 HydrophobicContact CD1-CG 4.16Å; L90-V183 HydrophobicContact CD2-CB 4.2Å; L90-V183 HydrophobicContact CD2-CG1 3.34Å; L90-L186 HydrophobicContact CD1-CB 4.23Å; L90-L186 HydrophobicContact CD1-CD1 3.89Å; L90-L189 HydrophobicContact CD1-CD2 3.9Å
91	P	71.7	Confident	69.9	Low	12 Å²	12	81.4 Å²	81.4	8%	0.078	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-62.4	148.1	171.4	26.9	-34	0	0	0	111	S95 A157	P91-S95 WeakPolarHBondContact CB-OG 3.42Å; P91-A157 VanDerWaalsContact CD-O 3.28Å; P91-A157 WeakPolarHBondContact CD-O 3.27Å
92	D	68.1	Low	69.9	Low	102 Å²	102	79.5 Å²	79.5	55%	0.545	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-79.8	155.4	174.5	-165.2	-4	0	0	0	110.4	N94 S95	D92-N94 PolarHBondContact O-N 2.81Å; D92-S95 PolarHBondContact O-N 2.92Å; D92-S95 PolarHBondContact O-OG 2.85Å; D92-S95 VanDerWaalsContact O-OG 3.08Å
93	V	59.7	Low	70.6	Confident	82 Å²	82	77.8 Å²	77.8	50%	0.497	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51	-30.8	-176.1	-173.4	0	0	0	0	112.8	P185 E187	V93-P185 HydrophobicContact CB-CB 4.33Å; V93-P185 HydrophobicContact CB-CG 4.18Å; V93-P185 HydrophobicContact CG1-CG 4.47Å; V93-P185 HydrophobicContact CG2-CB 3.62Å; V93-P185 HydrophobicContact CG2-CG 3.95Å; V93-E187 HydrophobicContact CG2-CG 4.24Å; V93-E187 WeakPolarHBondContact CG2-OE2 3.26Å
94	N	55.2	Low	71.2	Confident	140 Å²	140	72.8 Å²	72.8	75%	0.749	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.6	5.9	-174.2	-63.8	-31.3	0	0	0	114.2	D92 K96	D92-N94 PolarHBondContact O-N 2.81Å; N94-K96 PolarHBondContact O-N 3.04Å
95	S	58.5	Low	72	Confident	53 Å²	53	68.6 Å²	68.6	37%	0.371	37%	0.366	S	S	.	.			trans	-72.1	106.7	176.2	66.8	0	0	0	0	109.4	P91 D92	P91-S95 WeakPolarHBondContact CB-OG 3.42Å; D92-S95 PolarHBondContact O-N 2.92Å; D92-S95 PolarHBondContact O-OG 2.85Å; D92-S95 VanDerWaalsContact O-OG 3.08Å
96	K	59.5	Low	72.2	Confident	192 Å²	192	69 Å²	69	84%	0.835	37%	0.369	S	S	*	.			trans	-51.7	147.4	161.6	-78.8	-176.3	179.8	178.2	0	108.6	N94 P98	N94-K96 PolarHBondContact O-N 3.04Å; K96-P98 WeakPolarHBondContact O-CD 3.46Å
97	F	60.9	Low	72	Confident	99 Å²	99	62.4 Å²	62.4	43%	0.434	34%	0.341	S	S	.	.			trans	-41.3	114.7	174.4	-153	-100.5	0	0	0	109.6	D99 L100 F182	F97-D99 PolarHBondContact O-N 3.27Å; F97-L100 HydrophobicContact CD1-CD1 3.7Å; F97-L100 HydrophobicContact CE1-CD1 3.17Å; F97-L100 HydrophobicContact CE1-CD2 4.3Å; F97-L100 HydrophobicContact CE1-CG 4.37Å; F97-L100 HydrophobicContact CZ-CD1 4.04Å; F97-F182 HydrophobicContact CD2-CD1 4.31Å; F97-F182 HydrophobicContact CD2-CE1 4.08Å; F97-F182 HydrophobicContact CD2-CZ 4.38Å; F97-F182 AromaticContact CE2-CD1 3.54Å; F97-F182 HydrophobicContact CE2-CD1 3.54Å; F97-F182 HydrophobicContact CE2-CD2 4.32Å; F97-F182 AromaticContact CE2-CE1 2.96Å; F97-F182 HydrophobicContact CE2-CE1 2.96Å; F97-F182 AromaticContact CE2-CE2 3.78Å; F97-F182 HydrophobicContact CE2-CE2 3.78Å; F97-F182 HydrophobicContact CE2-CG 4.23Å; F97-F182 AromaticContact CE2-CZ 3.11Å; F97-F182 HydrophobicContact CE2-CZ 3.11Å; F97-F182 HydrophobicContact CZ-CD1 4.27Å; F97-F182 AromaticContact CZ-CE1 3.29Å; F97-F182 HydrophobicContact CZ-CE1 3.29Å; F97-F182 HydrophobicContact CZ-CE2 4.35Å; F97-F182 AromaticContact CZ-CZ 3.35Å; F97-F182 HydrophobicContact CZ-CZ 3.35Å
98	P	61.5	Low	71.3	Confident	32 Å²	32	61.8 Å²	61.8	21%	0.208	33%	0.331	C	S	.	.			trans	-61.2	140.3	178.8	23.1	-29.8	0	0	0	107.7	K96 L100 C149 T158	K96-P98 WeakPolarHBondContact O-CD 3.46Å; P98-L100 WeakPolarHBondContact O-CD1 3.11Å; P98-L100 PolarHBondContact O-N 3Å; P98-C149 HydrophobicContact CB-CB 4.46Å; P98-C149 HydrophobicContact CG-CB 4.18Å; P98-T158 HydrophobicContact CG-CG2 3.81Å
99	D	66.6	Low	70.6	Confident	141 Å²	141	61.2 Å²	61.2	75%	0.754	33%	0.328	S	S	*	.			trans	-52	121.7	165.2	-77.8	-35.4	0	0	0	107.2	F97 S101	F97-D99 PolarHBondContact O-N 3.27Å; D99-S101 PolarHBondContact O-N 2.66Å
100	L	70.8	Confident	69.7	Low	15 Å²	15	63.5 Å²	63.5	8%	0.079	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-67	5.2	-176.3	-98.6	57.6	0	0	0	112.9	F97 P98 D102 C103 V119 T121 I130	F97-L100 HydrophobicContact CD1-CD1 3.7Å; F97-L100 HydrophobicContact CE1-CD1 3.17Å; F97-L100 HydrophobicContact CE1-CD2 4.3Å; F97-L100 HydrophobicContact CE1-CG 4.37Å; F97-L100 HydrophobicContact CZ-CD1 4.04Å; P98-L100 WeakPolarHBondContact O-CD1 3.11Å; P98-L100 PolarHBondContact O-N 3Å; L100-D102 PolarHBondContact O-N 2.64Å; L100-C103 HydrophobicContact CG-CB 4.3Å; L100-C103 PolarHBondContact O-N 3.5Å; L100-V119 HydrophobicContact CD2-CG1 3.9Å; L100-V119 HydrophobicContact CG-CG1 4.49Å; L100-T121 HydrophobicContact CB-CG2 4.19Å; L100-T121 HydrophobicContact CD2-CG2 4.05Å; L100-I130 HydrophobicContact CD2-CG2 3.82Å
101	S	68.8	Low	68.8	Low	62 Å²	62	66.7 Å²	66.7	43%	0.434	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-54.9	-34.2	179.5	52.6	0	0	0	0	112.6	D99 K118	D99-S101 PolarHBondContact O-N 2.66Å; S101-K118 WeakPolarHBondContact O-CE 3.39Å; S101-K118 PolarHBondContact O-NZ 3.3Å
102	D	79.2	Confident	68.3	Low	84 Å²	84	71.8 Å²	71.8	45%	0.449	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-122.2	38.7	-176	-60	-43.8	0	0	0	112.4	L100 C149 S150	L100-D102 PolarHBondContact O-N 2.64Å; D102-C149 WeakPolarHBondContact O-CA 3.33Å; D102-S150 PolarHBondContact O-N 3.32Å; D102-S150 VanDerWaalsContact O-N 3.12Å
103	C	85.9	Confident	68.1	Low	0 Å²	0	74 Å²	74	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	138	176.3	-58.6	0	0	0	0	112.1	L100 V119 I147 I148 C149	L100-C103 HydrophobicContact CG-CB 4.3Å; L100-C103 PolarHBondContact O-N 3.5Å; C103-V119 HydrophobicContact CB-CB 4.34Å; C103-V119 PolarHBondContact O-N 2.75Å; C103-I147 HydrophobicContact CB-CG2 3.95Å; C103-I148 CarbonylContact C-O 3.59Å; C103-I148 VanDerWaalsContact CA-O 3.27Å; C103-I148 WeakPolarHBondContact CA-O 3.34Å; C103-C149 HydrophobicContact CB-CB 4.17Å; C103-C149 WeakPolarHBondContact CB-SG 3.39Å; C103-C149 WeakPolarHBondContact SG-CB 3.28Å; C103-C149 CovalentContact SG-SG 2.04Å; C103-C149 PolarHBondContact SG-SG 3.08Å
104	F	86.9	Confident	68.5	Low	75 Å²	75	71.7 Å²	71.7	33%	0.329	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	156.9	-177	-50.3	-91.3	0	0	0	110.1	I116 N117 K118 I148	F104-I116 HydrophobicContact CB-CG2 3.91Å; F104-I116 HydrophobicContact CD1-CG2 4.22Å; F104-I116 HydrophobicContact CG-CG2 4.36Å; F104-N117 WeakPolarHBondContact CA-O 3.07Å; F104-K118 HydrophobicContact CD1-CB 4.02Å; F104-K118 HydrophobicContact CD1-CG 4.25Å; F104-K118 HydrophobicContact CE1-CB 4.03Å; F104-K118 HydrophobicContact CE1-CD 4.2Å; F104-K118 HydrophobicContact CE1-CG 3.96Å; F104-I148 PolarHBondContact N-O 3.25Å; F104-I148 PolarHBondContact O-N 3.35Å
105	F	85.6	Confident	69.1	Low	1 Å²	1	67.1 Å²	67.1	0%	0.004	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	142.9	164.3	73.4	-79.4	0	0	0	110	L107 N117 V119 Y132 V142 I161	F105-L107 HydrophobicContact CD2-CB 4.44Å; F105-L107 HydrophobicContact CE2-CB 4.16Å; F105-L107 HydrophobicContact CE2-CD2 3.73Å; F105-L107 HydrophobicContact CE2-CG 4.4Å; F105-L107 HydrophobicContact CZ-CD2 4.23Å; F105-N117 HydrophobicContact CD1-CB 4.1Å; F105-N117 HydrophobicContact CE1-CB 3.5Å; F105-N117 VanDerWaalsContact CE1-CB 3.5Å; F105-N117 HydrophobicContact CE2-CB 4.49Å; F105-N117 HydrophobicContact CZ-CB 3.73Å; F105-N117 PolarHBondContact N-O 3.1Å; F105-N117 PolarHBondContact O-N 2.86Å; F105-V119 HydrophobicContact CD1-CG2 3.57Å; F105-V119 HydrophobicContact CE1-CG2 4.18Å; F105-Y132 AromaticContact CE1-CD1 3.99Å; F105-Y132 HydrophobicContact CE1-CD1 3.99Å; F105-Y132 HydrophobicContact CE1-CD2 4.05Å; F105-Y132 AromaticContact CE1-CG 3.66Å; F105-Y132 HydrophobicContact CE1-CG 3.66Å; F105-Y132 HydrophobicContact CZ-CD1 4.03Å; F105-Y132 AromaticContact CZ-CD2 3.71Å; F105-Y132 HydrophobicContact CZ-CD2 3.71Å; F105-Y132 HydrophobicContact CZ-CE1 4.27Å; F105-Y132 AromaticContact CZ-CE2 3.96Å; F105-Y132 HydrophobicContact CZ-CE2 3.96Å; F105-Y132 AromaticContact CZ-CG 3.75Å; F105-Y132 HydrophobicContact CZ-CG 3.75Å; F105-V142 HydrophobicContact CE2-CB 4.37Å; F105-V142 HydrophobicContact CE2-CG1 3.77Å; F105-V142 HydrophobicContact CZ-CG1 4.25Å; F105-I161 HydrophobicContact CD1-CD1 4.24Å; F105-I161 HydrophobicContact CD2-CD1 3.74Å; F105-I161 HydrophobicContact CE1-CD1 4.35Å; F105-I161 HydrophobicContact CE2-CD1 3.86Å; F105-I161 HydrophobicContact CG-CD1 3.93Å; F105-I161 HydrophobicContact CZ-CD1 4.17Å
106	S	79.1	Confident	70.1	Confident	26 Å²	26	69.8 Å²	69.8	18%	0.182	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	135.4	172.6	62.2	0	0	0	0	109.7	M115	S106-M115 CarbonylContact C-O 3.6Å; S106-M115 WeakPolarHBondContact CA-O 3.27Å
107	L	72.6	Confident	71.1	Confident	2 Å²	2	61.3 Å²	61.3	1%	0.01	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	161.8	168.3	67.5	78.8	0	0	0	110.8	F105 D109 Y114 M115 N117 P140 V142	F105-L107 HydrophobicContact CD2-CB 4.44Å; F105-L107 HydrophobicContact CE2-CB 4.16Å; F105-L107 HydrophobicContact CE2-CD2 3.73Å; F105-L107 HydrophobicContact CE2-CG 4.4Å; F105-L107 HydrophobicContact CZ-CD2 4.23Å; L107-D109 HydrophobicContact CD1-CB 4.16Å; L107-Y114 WeakPolarHBondContact O-CA 3.47Å; L107-M115 HydrophobicContact CD1-CB 3.77Å; L107-M115 HydrophobicContact CD1-CE 4.43Å; L107-M115 HydrophobicContact CD1-CG 4.09Å; L107-M115 HydrophobicContact CG-CB 4.07Å; L107-M115 PolarHBondContact N-O 3.37Å; L107-M115 PolarHBondContact O-N 2.94Å; L107-N117 WeakPolarHBondContact CD2-ND2 3.45Å; L107-P140 HydrophobicContact CD1-CB 3.83Å; L107-P140 HydrophobicContact CD1-CG 4.37Å; L107-P140 HydrophobicContact CD2-CB 3.78Å; L107-P140 HydrophobicContact CD2-CG 3.55Å; L107-P140 HydrophobicContact CG-CB 4.35Å; L107-V142 HydrophobicContact CD2-CG1 3.95Å
108	F	68.2	Low	72.3	Confident	60 Å²	60	61.6 Å²	61.6	26%	0.263	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	114.1	170.7	-167.1	-109.1	0	0	0	108.7	I8 K112 Y114	I8-F108 HydrophobicContact CD1-CB 3.73Å; I8-F108 HydrophobicContact CD1-CD1 3.3Å; I8-F108 HydrophobicContact CD1-CD2 3.65Å; I8-F108 HydrophobicContact CD1-CE1 3.62Å; I8-F108 HydrophobicContact CD1-CE2 3.93Å; I8-F108 HydrophobicContact CD1-CG 3.28Å; I8-F108 HydrophobicContact CD1-CZ 3.89Å; I8-F108 HydrophobicContact CG1-CB 3.73Å; I8-F108 HydrophobicContact CG1-CD1 3.99Å; I8-F108 HydrophobicContact CG1-CG 3.87Å; F108-K112 HydrophobicContact CE1-CB 4.27Å; F108-K112 HydrophobicContact CE1-CG 4.42Å; F108-K112 HydrophobicContact CE2-CB 4.41Å; F108-K112 WeakPolarHBondContact CE2-O 3.48Å; F108-K112 HydrophobicContact CZ-CB 3.72Å; F108-K112 HydrophobicContact CZ-CG 4.23Å; F108-Y114 HydrophobicContact CB-CE1 4.43Å; F108-Y114 AromaticContact CD2-CD1 3.84Å; F108-Y114 HydrophobicContact CD2-CD1 3.84Å; F108-Y114 HydrophobicContact CD2-CD2 4.29Å; F108-Y114 AromaticContact CD2-CE1 3.43Å; F108-Y114 HydrophobicContact CD2-CE1 3.43Å; F108-Y114 VanDerWaalsContact CD2-CE1 3.43Å; F108-Y114 AromaticContact CD2-CE2 3.99Å; F108-Y114 HydrophobicContact CD2-CE2 3.99Å; F108-Y114 HydrophobicContact CD2-CG 4.25Å; F108-Y114 AromaticContact CD2-CZ 3.55Å; F108-Y114 HydrophobicContact CE2-CD2 4.33Å; F108-Y114 HydrophobicContact CE2-CE1 4.06Å; F108-Y114 AromaticContact CE2-CE2 3.82Å; F108-Y114 HydrophobicContact CE2-CE2 3.82Å; F108-Y114 AromaticContact CE2-CZ 3.68Å; F108-Y114 HydrophobicContact CG-CE1 4.35Å
109	D	64.4	Low	73.4	Confident	8 Å²	8	60 Å²	60	4%	0.043	29%	0.29	C	S	.	.			trans	-76.3	159.3	179.3	-175.3	27.7	0	0	0	111	L107 N111 K112 R113 M115	L107-D109 HydrophobicContact CD1-CB 4.16Å; D109-N111 PolarHBondContact O-N 3.36Å; D109-N111 VanDerWaalsContact O-N 3.12Å; D109-N111 PolarHBondContact OD2-ND2 3.3Å; D109-K112 PolarHBondContact O-N 2.95Å; D109-R113 PolarHBondContact N-O 2.84Å; D109-M115 HydrophobicContact CB-CG 4.3Å
110	F	62.4	Low	74.1	Confident	112 Å²	112	56 Å²	56	49%	0.491	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-25.6	175.3	-66	-76.9	0	0	0	112.7	K112 L138 P139	F110-K112 PolarHBondContact O-N 2.9Å; F110-K112 VanDerWaalsContact O-N 3.14Å; F110-L138 HydrophobicContact CD2-CB 4.11Å; F110-L138 HydrophobicContact CD2-CD2 4.06Å; F110-L138 HydrophobicContact CE2-CB 4.01Å; F110-L138 HydrophobicContact CE2-CD2 4.09Å; F110-L138 HydrophobicContact CE2-CG 4.49Å; F110-P139 VanDerWaalsContact CE2-O 3.25Å; F110-P139 WeakPolarHBondContact CE2-O 3.36Å
111	N	59.5	Low	74.4	Confident	103 Å²	103	59.9 Å²	59.9	55%	0.551	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	12.4	174.3	-63.3	-47.1	0	0	0	113.9	D109 R113	D109-N111 PolarHBondContact O-N 3.36Å; D109-N111 VanDerWaalsContact O-N 3.12Å; D109-N111 PolarHBondContact OD2-ND2 3.3Å; N111-R113 HydrophobicContact CB-CG 4.47Å; N111-R113 PolarHBondContact ND2-NH2 2.83Å; N111-R113 PolarHBondContact O-N 3Å
112	K	61.1	Low	74.7	Confident	119 Å²	119	57 Å²	57	52%	0.517	28%	0.276	S	S	.	.	S	Bend	trans	57.4	26	-175	-53.2	179.3	-175	172.1	0	113.8	F108 D109 F110 D333	F108-K112 HydrophobicContact CE1-CB 4.27Å; F108-K112 HydrophobicContact CE1-CG 4.42Å; F108-K112 HydrophobicContact CE2-CB 4.41Å; F108-K112 WeakPolarHBondContact CE2-O 3.48Å; F108-K112 HydrophobicContact CZ-CB 3.72Å; F108-K112 HydrophobicContact CZ-CG 4.23Å; D109-K112 PolarHBondContact O-N 2.95Å; F110-K112 PolarHBondContact O-N 2.9Å; F110-K112 VanDerWaalsContact O-N 3.14Å; K112-D333 IonicContact NZ-OD1 2.71Å; K112-D333 PolarHBondContact NZ-OD1 3.19Å
113	R	63.6	Low	74.2	Confident	147 Å²	147	56.2 Å²	56.2	56%	0.555	29%	0.287	S	S	*	.			trans	-104	136.8	177.9	-69	-174.8	-66.9	-176.2	-1.2	109.9	D109 N111	D109-R113 PolarHBondContact N-O 2.84Å; N111-R113 HydrophobicContact CB-CG 4.47Å; N111-R113 PolarHBondContact ND2-NH2 2.83Å; N111-R113 PolarHBondContact O-N 3Å
114	Y	67.8	Low	73	Confident	35 Å²	35	67 Å²	67	14%	0.137	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	130.2	167.4	-70.3	-74.9	0	0	0	108.5	S6 V41 L107 F108	S6-Y114 WeakPolarHBondContact OG-CD1 3.46Å; S6-Y114 WeakPolarHBondContact OG-CE1 3.12Å; V41-Y114 HydrophobicContact CB-CE2 4.08Å; V41-Y114 WeakPolarHBondContact CB-OH 3.07Å; V41-Y114 HydrophobicContact CG1-CE2 3.58Å; V41-Y114 WeakPolarHBondContact CG1-OH 3.45Å; L107-Y114 WeakPolarHBondContact O-CA 3.47Å; F108-Y114 HydrophobicContact CB-CE1 4.43Å; F108-Y114 AromaticContact CD2-CD1 3.84Å; F108-Y114 HydrophobicContact CD2-CD1 3.84Å; F108-Y114 HydrophobicContact CD2-CD2 4.29Å; F108-Y114 AromaticContact CD2-CE1 3.43Å; F108-Y114 HydrophobicContact CD2-CE1 3.43Å; F108-Y114 VanDerWaalsContact CD2-CE1 3.43Å; F108-Y114 AromaticContact CD2-CE2 3.99Å; F108-Y114 HydrophobicContact CD2-CE2 3.99Å; F108-Y114 HydrophobicContact CD2-CG 4.25Å; F108-Y114 AromaticContact CD2-CZ 3.55Å; F108-Y114 HydrophobicContact CE2-CD2 4.33Å; F108-Y114 HydrophobicContact CE2-CE1 4.06Å; F108-Y114 AromaticContact CE2-CE2 3.82Å; F108-Y114 HydrophobicContact CE2-CE2 3.82Å; F108-Y114 AromaticContact CE2-CZ 3.68Å; F108-Y114 HydrophobicContact CG-CE1 4.35Å
115	M	69.1	Low	71.7	Confident	44 Å²	44	65 Å²	65	22%	0.217	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	132.4	172.1	-54.3	-140.1	-54.5	0	0	108.9	S106 L107 D109 T134	S106-M115 CarbonylContact C-O 3.6Å; S106-M115 WeakPolarHBondContact CA-O 3.27Å; L107-M115 HydrophobicContact CD1-CB 3.77Å; L107-M115 HydrophobicContact CD1-CE 4.43Å; L107-M115 HydrophobicContact CD1-CG 4.09Å; L107-M115 HydrophobicContact CG-CB 4.07Å; L107-M115 PolarHBondContact N-O 3.37Å; L107-M115 PolarHBondContact O-N 2.94Å; D109-M115 HydrophobicContact CB-CG 4.3Å; M115-T134 WeakPolarHBondContact CE-OG1 3.42Å
116	I	78.7	Confident	70.3	Confident	108 Å²	108	69.7 Å²	69.7	55%	0.554	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.6	116.6	173.8	-58.8	174.2	0	0	0	106.4	F104	F104-I116 HydrophobicContact CB-CG2 3.91Å; F104-I116 HydrophobicContact CD1-CG2 4.22Å; F104-I116 HydrophobicContact CG-CG2 4.36Å
117	N	81.2	Confident	69.5	Low	14 Å²	14	71.1 Å²	71.1	8%	0.075	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	133.1	177.9	-66.1	-67.1	0	0	0	109.8	F104 F105 L107 I133	F104-N117 WeakPolarHBondContact CA-O 3.07Å; F105-N117 HydrophobicContact CD1-CB 4.1Å; F105-N117 HydrophobicContact CE1-CB 3.5Å; F105-N117 VanDerWaalsContact CE1-CB 3.5Å; F105-N117 HydrophobicContact CE2-CB 4.49Å; F105-N117 HydrophobicContact CZ-CB 3.73Å; F105-N117 PolarHBondContact N-O 3.1Å; F105-N117 PolarHBondContact O-N 2.86Å; L107-N117 WeakPolarHBondContact CD2-ND2 3.45Å; N117-I133 PolarHBondContact OD1-O 3.14Å
118	K	84.7	Confident	69.5	Low	105 Å²	105	73.6 Å²	73.6	46%	0.457	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	137.6	171.2	-173.1	169.5	-178.1	160	0	109.7	S101 F104	S101-K118 WeakPolarHBondContact O-CE 3.39Å; S101-K118 PolarHBondContact O-NZ 3.3Å; F104-K118 HydrophobicContact CD1-CB 4.02Å; F104-K118 HydrophobicContact CD1-CG 4.25Å; F104-K118 HydrophobicContact CE1-CB 4.03Å; F104-K118 HydrophobicContact CE1-CD 4.2Å; F104-K118 HydrophobicContact CE1-CG 3.96Å
119	V	84.9	Confident	70	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	142.4	178.3	-170.5	0	0	0	0	109.3	L100 C103 F105 I130 C131 I147	L100-V119 HydrophobicContact CD2-CG1 3.9Å; L100-V119 HydrophobicContact CG-CG1 4.49Å; C103-V119 HydrophobicContact CB-CB 4.34Å; C103-V119 PolarHBondContact O-N 2.75Å; F105-V119 HydrophobicContact CD1-CG2 3.57Å; F105-V119 HydrophobicContact CE1-CG2 4.18Å; V119-I130 HydrophobicContact CG1-CB 3.55Å; V119-I130 HydrophobicContact CG1-CD1 3.62Å; V119-I130 HydrophobicContact CG1-CG1 4.19Å; V119-I130 HydrophobicContact CG1-CG2 3.79Å; V119-I130 HydrophobicContact CG2-CD1 4.36Å; V119-C131 CarbonylContact C-O 3.59Å; V119-I147 HydrophobicContact CG2-CG2 4.29Å
120	T	81.1	Confident	70.8	Confident	57 Å²	57	71.2 Å²	71.2	35%	0.35	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	159.7	174.2	58.5	0	0	0	0	110.8	C131	T120-C131 PolarHBondContact N-O 3.01Å; T120-C131 PolarHBondContact O-N 3.47Å; T120-C131 WeakPolarHBondContact OG1-CB 3.36Å; T120-C131 PolarHBondContact OG1-O 2.97Å
121	T	78	Confident	71.8	Confident	95 Å²	95	65.9 Å²	65.9	58%	0.583	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.9	131.2	172.4	48.9	0	0	0	0	110.3	L100 G123	L100-T121 HydrophobicContact CB-CG2 4.19Å; L100-T121 HydrophobicContact CD2-CG2 4.05Å; T121-G123 VanDerWaalsContact C-N 3.32Å; T121-G123 PolarHBondContact O-N 2.84Å
122	C	74.6	Confident	72.9	Confident	3 Å²	3	61 Å²	61	2%	0.02	33%	0.333	C	S	.	.			trans	-77.9	68	-178.2	-80.9	0	0	0	0	113.3	K124 S125 I130 C131	C122-K124 PolarHBondContact O-N 2.82Å; C122-S125 VanDerWaalsContact O-CB 3.29Å; C122-S125 WeakPolarHBondContact O-CB 3.17Å; C122-S125 PolarHBondContact O-N 3Å; C122-I130 PolarHBondContact SG-O 3.28Å; C122-C131 WeakPolarHBondContact CA-SG 3.47Å; C122-C131 HydrophobicContact CB-CB 4.17Å; C122-C131 WeakPolarHBondContact CB-SG 2.99Å; C122-C131 WeakPolarHBondContact SG-CA 3.14Å; C122-C131 WeakPolarHBondContact SG-CB 3.33Å; C122-C131 PolarHBondContact SG-N 2.9Å; C122-C131 CovalentContact SG-SG 2.03Å; C122-C131 PolarHBondContact SG-SG 3.46Å
123	G	70	Confident	73.6	Confident	66 Å²	66	59.9 Å²	59.9	68%	0.68	33%	0.331	S	S	*	.	S	Bend	trans	51.9	-136.7	-179.7	0	0	0	0	0	112.3	T121 S125	T121-G123 VanDerWaalsContact C-N 3.32Å; T121-G123 PolarHBondContact O-N 2.84Å; G123-S125 PolarHBondContact O-N 3.5Å
124	K	59.6	Low	74	Confident	227 Å²	227	53 Å²	53	99%	0.987	31%	0.306	S	S	*	.	S	Bend	trans	-74.8	44.7	177.1	-63.5	-175.1	-179.6	-179.4	0	113.5	C122	C122-K124 PolarHBondContact O-N 2.82Å
125	S	59.2	Low	73.9	Confident	32 Å²	32	57.7 Å²	57.7	22%	0.224	33%	0.333	C	S	.	.			trans	-74.9	138.4	-179.4	-171.9	0	0	0	0	111.6	C122 G123 G127 D129	C122-S125 VanDerWaalsContact O-CB 3.29Å; C122-S125 WeakPolarHBondContact O-CB 3.17Å; C122-S125 PolarHBondContact O-N 3Å; G123-S125 PolarHBondContact O-N 3.5Å; S125-G127 PolarHBondContact O-N 3.38Å; S125-D129 VanDerWaalsContact OG-CB 3.23Å; S125-D129 WeakPolarHBondContact OG-CB 3.35Å
126	T	57.1	Low	73.6	Confident	100 Å²	100	56.5 Å²	56.5	61%	0.613	33%	0.329	S	S	*	.			trans	-48.9	131.5	153.8	48.1	0	0	0	0	107.7	T128 D129	T126-T128 PolarHBondContact O-N 2.97Å; T126-D129 PolarHBondContact O-N 3.08Å
127	G	62.2	Low	72.5	Confident	57 Å²	57	57.8 Å²	57.8	59%	0.588	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	9.4	-162.7	0	0	0	0	0	118.2	S125 F182	S125-G127 PolarHBondContact O-N 3.38Å; G127-F182 WeakPolarHBondContact O-CE2 3.49Å; G127-F182 WeakPolarHBondContact O-CZ 3.23Å
128	T	72.9	Confident	71.2	Confident	54 Å²	54	62.1 Å²	62.1	33%	0.331	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-11	179	55.4	0	0	0	0	114.7	T126 E179 V180	T126-T128 PolarHBondContact O-N 2.97Å; T128-E179 WeakPolarHBondContact O-CA 3.2Å; T128-V180 WeakPolarHBondContact O-CG2 3.49Å; T128-V180 PolarHBondContact O-N 2.86Å
129	D	77.8	Confident	69.7	Low	14 Å²	14	60.4 Å²	60.4	8%	0.075	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	136.4	-179.1	-46.9	-9.5	0	0	0	111.8	S125 T126 L165 R168 A178	S125-D129 VanDerWaalsContact OG-CB 3.23Å; S125-D129 WeakPolarHBondContact OG-CB 3.35Å; T126-D129 PolarHBondContact O-N 3.08Å; D129-L165 HydrophobicContact CB-CD1 4.22Å; D129-L165 WeakPolarHBondContact OD2-CD1 3.49Å; D129-R168 IonicContact OD2-CZ 3.4Å; D129-R168 IonicContact OD2-NH1 2.62Å; D129-R168 PolarHBondContact OD2-NH1 2.81Å; D129-A178 WeakPolarHBondContact CA-O 3.08Å
130	I	81.9	Confident	68.5	Low	4 Å²	4	60.5 Å²	60.5	2%	0.021	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	151.4	175.7	60	149.3	0	0	0	111.6	L100 V119 C122 I147 I161 R177 A178 V180	L100-I130 HydrophobicContact CD2-CG2 3.82Å; V119-I130 HydrophobicContact CG1-CB 3.55Å; V119-I130 HydrophobicContact CG1-CD1 3.62Å; V119-I130 HydrophobicContact CG1-CG1 4.19Å; V119-I130 HydrophobicContact CG1-CG2 3.79Å; V119-I130 HydrophobicContact CG2-CD1 4.36Å; C122-I130 PolarHBondContact SG-O 3.28Å; I130-I147 HydrophobicContact CD1-CD1 3.48Å; I130-I147 VanDerWaalsContact CD1-CD1 3.48Å; I130-I147 HydrophobicContact CG1-CD1 4.37Å; I130-I147 HydrophobicContact CG2-CD1 4.34Å; I130-I161 HydrophobicContact CD1-CD1 4.31Å; I130-I161 HydrophobicContact CD1-CG1 4.26Å; I130-R177 WeakPolarHBondContact O-CA 3.46Å; I130-A178 HydrophobicContact CD1-CB 4.26Å; I130-A178 HydrophobicContact CG1-CB 3.99Å; I130-A178 WeakPolarHBondContact CG1-O 3.41Å; I130-A178 PolarHBondContact N-O 2.76Å; I130-A178 PolarHBondContact O-N 2.63Å; I130-V180 HydrophobicContact CB-CG1 4.48Å; I130-V180 HydrophobicContact CD1-CG1 3.69Å; I130-V180 HydrophobicContact CG1-CG1 3.57Å; I130-V180 HydrophobicContact CG2-CG1 4.12Å; I130-V180 HydrophobicContact CG2-CG2 3.88Å
131	C	82.6	Confident	67.6	Low	0 Å²	0	63.3 Å²	63.3	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	142.2	179	-81	0	0	0	0	108.7	V119 T120 C122 E175 K176	V119-C131 CarbonylContact C-O 3.59Å; T120-C131 PolarHBondContact N-O 3.01Å; T120-C131 PolarHBondContact O-N 3.47Å; T120-C131 WeakPolarHBondContact OG1-CB 3.36Å; T120-C131 PolarHBondContact OG1-O 2.97Å; C122-C131 WeakPolarHBondContact CA-SG 3.47Å; C122-C131 HydrophobicContact CB-CB 4.17Å; C122-C131 WeakPolarHBondContact CB-SG 2.99Å; C122-C131 WeakPolarHBondContact SG-CA 3.14Å; C122-C131 WeakPolarHBondContact SG-CB 3.33Å; C122-C131 PolarHBondContact SG-N 2.9Å; C122-C131 CovalentContact SG-SG 2.03Å; C122-C131 PolarHBondContact SG-SG 3.46Å; C131-E175 HydrophobicContact CB-CG 4.12Å; C131-E175 VanDerWaalsContact CB-OE1 3.29Å; C131-E175 WeakPolarHBondContact CB-OE1 3.46Å; C131-E175 PolarHBondContact SG-OE1 3.2Å; C131-K176 WeakPolarHBondContact CA-O 3.21Å
132	Y	82.1	Confident	67.1	Low	1 Å²	1	58.8 Å²	58.8	0%	0.004	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	146.4	173.4	62.7	-86.9	0	0	0	109.4	F105 T134 E175 K176 A178	F105-Y132 AromaticContact CE1-CD1 3.99Å; F105-Y132 HydrophobicContact CE1-CD1 3.99Å; F105-Y132 HydrophobicContact CE1-CD2 4.05Å; F105-Y132 AromaticContact CE1-CG 3.66Å; F105-Y132 HydrophobicContact CE1-CG 3.66Å; F105-Y132 HydrophobicContact CZ-CD1 4.03Å; F105-Y132 AromaticContact CZ-CD2 3.71Å; F105-Y132 HydrophobicContact CZ-CD2 3.71Å; F105-Y132 HydrophobicContact CZ-CE1 4.27Å; F105-Y132 AromaticContact CZ-CE2 3.96Å; F105-Y132 HydrophobicContact CZ-CE2 3.96Å; F105-Y132 AromaticContact CZ-CG 3.75Å; F105-Y132 HydrophobicContact CZ-CG 3.75Å; Y132-T134 HydrophobicContact CD2-CG2 4.23Å; Y132-T134 HydrophobicContact CE2-CG2 3.84Å; Y132-E175 CarbonylContact O-C 3.59Å; Y132-E175 WeakPolarHBondContact O-CA 3.21Å; Y132-K176 HydrophobicContact CD1-CB 4.45Å; Y132-K176 HydrophobicContact CD2-CB 4.25Å; Y132-K176 HydrophobicContact CE1-CB 3.9Å; Y132-K176 HydrophobicContact CE2-CB 3.68Å; Y132-K176 HydrophobicContact CE2-CG 4.13Å; Y132-K176 VanDerWaalsContact CZ-CB 3.48Å; Y132-K176 PolarHBondContact N-O 3.45Å; Y132-K176 PolarHBondContact O-N 2.86Å; Y132-A178 HydrophobicContact CE1-CB 3.98Å
133	I	77.1	Confident	67	Low	94 Å²	94	64.1 Å²	64.1	48%	0.482	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	129.6	176.7	-60.1	171.5	0	0	0	107	N117 N174	N117-I133 PolarHBondContact OD1-O 3.14Å; I133-N174 HydrophobicContact CG2-CB 4.04Å
134	T	72.5	Confident	67.1	Low	4 Å²	4	63.7 Å²	63.7	3%	0.025	37%	0.365	C	S	.	.			trans	-138.8	135.8	173.7	-177.2	0	0	0	0	110.8	M115 Y132 S136 N174 K176	M115-T134 WeakPolarHBondContact CE-OG1 3.42Å; Y132-T134 HydrophobicContact CD2-CG2 4.23Å; Y132-T134 HydrophobicContact CE2-CG2 3.84Å; T134-S136 PolarHBondContact O-N 3.45Å; T134-S136 PolarHBondContact OG1-N 3.49Å; T134-S136 PolarHBondContact OG1-OG 2.92Å; T134-N174 PolarHBondContact N-O 3.21Å; T134-N174 VanDerWaalsContact N-O 3.12Å; T134-N174 WeakPolarHBondContact O-CB 3.37Å; T134-K176 HydrophobicContact CG2-CG 3.81Å
135	D	65.1	Low	68	Low	133 Å²	133	53.8 Å²	53.8	71%	0.711	32%	0.324	S	S	*	.			trans	-77.5	-8.7	177.2	-62.2	-35.3	0	0	0	112.8	V137 N174	D135-V137 PolarHBondContact O-N 3.35Å; D135-N174 PolarHBondContact OD1-ND2 3.43Å
136	S	62.4	Low	69.1	Low	18 Å²	18	53 Å²	53	13%	0.126	32%	0.319	C	S	.	.			trans	-76.8	120.6	179.6	66.2	0	0	0	0	112.1	T134	T134-S136 PolarHBondContact O-N 3.45Å; T134-S136 PolarHBondContact OG1-N 3.49Å; T134-S136 PolarHBondContact OG1-OG 2.92Å
137	V	56.4	Low	70.4	Confident	135 Å²	135	48.4 Å²	48.4	82%	0.818	29%	0.291	S	S	*	.	S	Bend	trans	-70.4	-37.1	177.9	-178.3	0	0	0	0	112.2	D135	D135-V137 PolarHBondContact O-N 3.35Å
138	L	52.7	Low	71.5	Confident	106 Å²	106	47 Å²	47	56%	0.555	27%	0.27	S	S	*	.	S	Bend	trans	-80	144.3	178.2	-113.3	66.6	0	0	0	110.6	F110 P140	F110-L138 HydrophobicContact CD2-CB 4.11Å; F110-L138 HydrophobicContact CD2-CD2 4.06Å; F110-L138 HydrophobicContact CE2-CB 4.01Å; F110-L138 HydrophobicContact CE2-CD2 4.09Å; F110-L138 HydrophobicContact CE2-CG 4.49Å; L138-P140 WeakPolarHBondContact O-CD 3.38Å; L138-P140 VanDerWaalsContact O-N 3.1Å
139	P	53.8	Low	72.2	Confident	68 Å²	68	44.7 Å²	44.7	44%	0.442	26%	0.255	S	S	.	.			trans	-67.7	107.2	179.7	27	-31.9	0	0	0	110.3	F110 K164	F110-P139 VanDerWaalsContact CE2-O 3.25Å; F110-P139 WeakPolarHBondContact CE2-O 3.36Å; P139-K164 HydrophobicContact CB-CD 4.28Å
140	P	58.8	Low	72.4	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.013	27%	0.27	C	S	.	.			trans	-62.4	147.3	171.1	24.5	-27.1	0	0	0	108.6	L107 L138 V142	L107-P140 HydrophobicContact CD1-CB 3.83Å; L107-P140 HydrophobicContact CD1-CG 4.37Å; L107-P140 HydrophobicContact CD2-CB 3.78Å; L107-P140 HydrophobicContact CD2-CG 3.55Å; L107-P140 HydrophobicContact CG-CB 4.35Å; L138-P140 WeakPolarHBondContact O-CD 3.38Å; L138-P140 VanDerWaalsContact O-N 3.1Å; P140-V142 HydrophobicContact CB-CG1 4.36Å; P140-V142 HydrophobicContact CG-CG1 3.91Å; P140-V142 PolarHBondContact O-N 3.41Å
141	L	62	Low	72.2	Confident	117 Å²	117	51.7 Å²	51.7	61%	0.613	29%	0.292	S	S	*	.			trans	-65.7	84.9	169.9	-80.8	134.9	0	0	0	108.3
142	V	68.1	Low	71.8	Confident	0 Å²	0	60 Å²	60	0%	0	33%	0.331	C	S	.	.			trans	-83.6	-20.2	178.3	-69.4	0	0	0	0	112.6	F105 L107 P140 G144 S145 I161 K164	F105-V142 HydrophobicContact CE2-CB 4.37Å; F105-V142 HydrophobicContact CE2-CG1 3.77Å; F105-V142 HydrophobicContact CZ-CG1 4.25Å; L107-V142 HydrophobicContact CD2-CG1 3.95Å; P140-V142 HydrophobicContact CB-CG1 4.36Å; P140-V142 HydrophobicContact CG-CG1 3.91Å; P140-V142 PolarHBondContact O-N 3.41Å; V142-G144 PolarHBondContact O-N 3.4Å; V142-S145 VanDerWaalsContact O-CB 3.23Å; V142-S145 WeakPolarHBondContact O-CB 3.42Å; V142-S145 PolarHBondContact O-N 2.92Å; V142-S145 VanDerWaalsContact O-N 3.1Å; V142-S145 PolarHBondContact O-OG 3.49Å; V142-I161 HydrophobicContact CB-CD1 4.17Å; V142-I161 HydrophobicContact CB-CG2 4.18Å; V142-I161 HydrophobicContact CG2-CG2 4Å; V142-I161 WeakPolarHBondContact O-CB 2.97Å; V142-K164 HydrophobicContact CG2-CB 4.33Å
143	Y	72	Confident	71.4	Confident	115 Å²	115	63.3 Å²	63.3	45%	0.451	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	129.7	-178.2	-55.7	-92.6	0	0	0	111.6	S145 V162 K163 K164	Y143-S145 VanDerWaalsContact C-N 3.3Å; Y143-S145 PolarHBondContact O-N 2.78Å; Y143-V162 VanDerWaalsContact CD1-O 3.23Å; Y143-V162 WeakPolarHBondContact CD1-O 3.45Å; Y143-K163 HydrophobicContact CD1-CB 4.37Å; Y143-K163 HydrophobicContact CE1-CB 3.78Å; Y143-K164 HydrophobicContact CE1-CB 4.47Å; Y143-K164 VanDerWaalsContact CE1-N 3.29Å; Y143-K164 HydrophobicContact CE2-CB 4.4Å; Y143-K164 WeakPolarHBondContact OH-CB 3.43Å; Y143-K164 PolarHBondContact OH-N 3.13Å
144	G	72.5	Confident	71.3	Confident	56 Å²	56	61.3 Å²	61.3	58%	0.577	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	83	-2.5	-178.5	0	0	0	0	0	115.1	V142 I161	V142-G144 PolarHBondContact O-N 3.4Å; G144-I161 PolarHBondContact N-O 2.8Å
145	S	78.5	Confident	71.8	Confident	19 Å²	19	65.5 Å²	65.5	13%	0.133	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-70.3	131.6	174.8	-52.9	0	0	0	0	110.4	V142 Y143 I160 I161	V142-S145 VanDerWaalsContact O-CB 3.23Å; V142-S145 WeakPolarHBondContact O-CB 3.42Å; V142-S145 PolarHBondContact O-N 2.92Å; V142-S145 VanDerWaalsContact O-N 3.1Å; V142-S145 PolarHBondContact O-OG 3.49Å; Y143-S145 VanDerWaalsContact C-N 3.3Å; Y143-S145 PolarHBondContact O-N 2.78Å; S145-I160 WeakPolarHBondContact O-CA 3.35Å; S145-I161 PolarHBondContact O-N 3.22Å
146	A	81.6	Confident	72.6	Confident	15 Å²	15	62.5 Å²	62.5	12%	0.124	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	135.6	173.3	0	0	0	0	0	110.4	A157	A146-A157 HydrophobicContact CB-CB 4.46Å
147	I	84.5	Confident	73.5	Confident	5 Å²	5	61.6 Å²	61.6	3%	0.026	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	117.1	170.2	-60	-177.7	0	0	0	107.4	C103 V119 I130 A157 T158 A159 I161 V180	C103-I147 HydrophobicContact CB-CG2 3.95Å; V119-I147 HydrophobicContact CG2-CG2 4.29Å; I130-I147 HydrophobicContact CD1-CD1 3.48Å; I130-I147 VanDerWaalsContact CD1-CD1 3.48Å; I130-I147 HydrophobicContact CG1-CD1 4.37Å; I130-I147 HydrophobicContact CG2-CD1 4.34Å; I147-A157 CarbonylContact O-C 3.57Å; I147-A157 WeakPolarHBondContact O-CA 3.2Å; I147-T158 PolarHBondContact O-N 3.14Å; I147-A159 HydrophobicContact CB-CB 4.26Å; I147-A159 HydrophobicContact CD1-CB 4.07Å; I147-A159 HydrophobicContact CG1-CB 4.44Å; I147-A159 PolarHBondContact N-O 3.47Å; I147-I161 HydrophobicContact CD1-CG1 4.35Å; I147-I161 HydrophobicContact CG1-CG1 4.35Å; I147-V180 HydrophobicContact CD1-CB 4.28Å; I147-V180 HydrophobicContact CD1-CG1 3.37Å
148	I	87	Confident	74.6	Confident	28 Å²	28	55.9 Å²	55.9	14%	0.144	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	120.5	-176.3	-50.8	172.1	0	0	0	107.3	S4 I88 C103 F104 L155 Y156	S4-I148 VanDerWaalsContact CB-CD1 3.48Å; I88-I148 HydrophobicContact CD1-CB 4.06Å; I88-I148 HydrophobicContact CD1-CD1 4.2Å; I88-I148 HydrophobicContact CD1-CG1 3.62Å; I88-I148 HydrophobicContact CD1-CG2 3.65Å; C103-I148 CarbonylContact C-O 3.59Å; C103-I148 VanDerWaalsContact CA-O 3.27Å; C103-I148 WeakPolarHBondContact CA-O 3.34Å; F104-I148 PolarHBondContact N-O 3.25Å; F104-I148 PolarHBondContact O-N 3.35Å; I148-L155 HydrophobicContact CG2-CB 3.94Å; I148-L155 HydrophobicContact CG2-CD2 3.96Å; I148-L155 HydrophobicContact CG2-CG 4.37Å; I148-Y156 CarbonylContact C-O 3.52Å; I148-Y156 WeakPolarHBondContact CA-O 3.45Å
149	C	85.9	Confident	75.8	Confident	4 Å²	4	50.9 Å²	50.9	3%	0.027	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	139.3	173.4	-56.7	0	0	0	0	109.4	P98 D102 C103 Y156 T158	P98-C149 HydrophobicContact CB-CB 4.46Å; P98-C149 HydrophobicContact CG-CB 4.18Å; D102-C149 WeakPolarHBondContact O-CA 3.33Å; C103-C149 HydrophobicContact CB-CB 4.17Å; C103-C149 WeakPolarHBondContact CB-SG 3.39Å; C103-C149 WeakPolarHBondContact SG-CB 3.28Å; C103-C149 CovalentContact SG-SG 2.04Å; C103-C149 PolarHBondContact SG-SG 3.08Å; C149-Y156 PolarHBondContact N-O 3.49Å; C149-Y156 PolarHBondContact O-N 2.91Å; C149-T158 PolarHBondContact SG-OG1 3.21Å; C149-T158 VanDerWaalsContact SG-OG1 3.33Å
150	S	83.3	Confident	77	Confident	54 Å²	54	48.2 Å²	48.2	38%	0.378	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	126.9	172.6	-168.3	0	0	0	0	110.1	D102 S154	D102-S150 PolarHBondContact O-N 3.32Å; D102-S150 VanDerWaalsContact O-N 3.12Å; S150-S154 WeakPolarHBondContact CA-O 3.28Å
151	K	77	Confident	77.9	Confident	111 Å²	111	48.2 Å²	48.2	48%	0.483	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	123.7	171.1	-174.5	-175.9	177.2	-171.5	0	108.4	G153 S154 Y156	K151-G153 PolarHBondContact O-N 3.16Å; K151-G153 VanDerWaalsContact O-N 3.15Å; K151-S154 PolarHBondContact N-O 3.28Å; K151-S154 PolarHBondContact O-N 3.19Å; K151-Y156 HydrophobicContact CB-CD2 4.17Å; K151-Y156 HydrophobicContact CB-CE2 3.97Å
152	E	74.3	Confident	78.5	Confident	174 Å²	174	44.5 Å²	44.5	81%	0.813	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	37.1	176.9	-64.1	164.6	-149.8	0	0	113.3	S154	E152-S154 PolarHBondContact O-N 3.28Å
153	G	73.7	Confident	78.7	Confident	72 Å²	72	48.7 Å²	48.7	74%	0.742	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.7	-6.4	-178.8	0	0	0	0	0	115.3	K151	K151-G153 PolarHBondContact O-N 3.16Å; K151-G153 VanDerWaalsContact O-N 3.15Å
154	S	75.5	Confident	78.7	Confident	52 Å²	52	44.5 Å²	44.5	36%	0.364	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	143.3	174.9	-67.1	0	0	0	0	111.2	S150 K151 E152 Y156	S150-S154 WeakPolarHBondContact CA-O 3.28Å; K151-S154 PolarHBondContact N-O 3.28Å; K151-S154 PolarHBondContact O-N 3.19Å; E152-S154 PolarHBondContact O-N 3.28Å; S154-Y156 VanDerWaalsContact CB-CE2 3.44Å; S154-Y156 WeakPolarHBondContact CB-OH 3.37Å; S154-Y156 WeakPolarHBondContact O-CD2 3.39Å; S154-Y156 WeakPolarHBondContact O-CE2 3.37Å
155	L	82.1	Confident	78.5	Confident	92 Å²	92	43.6 Å²	43.6	48%	0.482	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	124.9	-178.9	-63.8	175	0	0	0	110.3	I88 C89 I148	I88-L155 WeakPolarHBondContact CG1-O 3.41Å; C89-L155 WeakPolarHBondContact CB-O 3.21Å; C89-L155 PolarHBondContact N-O 2.94Å; I148-L155 HydrophobicContact CG2-CB 3.94Å; I148-L155 HydrophobicContact CG2-CD2 3.96Å; I148-L155 HydrophobicContact CG2-CG 4.37Å
156	Y	81.9	Confident	77.7	Confident	69 Å²	69	48.7 Å²	48.7	27%	0.271	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	135.9	-176.8	-57.8	-88.2	0	0	0	111.7	C89 I148 C149 K151 S154 T158	C89-Y156 HydrophobicContact CB-CD1 3.67Å; C89-Y156 HydrophobicContact CB-CE1 3.9Å; C89-Y156 CarbonylContact O-C 3.57Å; C89-Y156 WeakPolarHBondContact O-CA 3.22Å; I148-Y156 CarbonylContact C-O 3.52Å; I148-Y156 WeakPolarHBondContact CA-O 3.45Å; C149-Y156 PolarHBondContact N-O 3.49Å; C149-Y156 PolarHBondContact O-N 2.91Å; K151-Y156 HydrophobicContact CB-CD2 4.17Å; K151-Y156 HydrophobicContact CB-CE2 3.97Å; S154-Y156 VanDerWaalsContact CB-CE2 3.44Å; S154-Y156 WeakPolarHBondContact CB-OH 3.37Å; S154-Y156 WeakPolarHBondContact O-CD2 3.39Å; S154-Y156 WeakPolarHBondContact O-CE2 3.37Å; Y156-T158 PolarHBondContact O-N 3.14Å
157	A	82.4	Confident	76.4	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	89.5	173	0	0	0	0	0	110.3	L2 I88 C89 P91 A146 I147	L2-A157 HydrophobicContact CD1-CB 4.38Å; I88-A157 HydrophobicContact CD1-CB 3.84Å; I88-A157 HydrophobicContact CG1-CB 4.11Å; I88-A157 HydrophobicContact CG2-CB 3.67Å; C89-A157 PolarHBondContact O-N 3.12Å; P91-A157 VanDerWaalsContact CD-O 3.28Å; P91-A157 WeakPolarHBondContact CD-O 3.27Å; A146-A157 HydrophobicContact CB-CB 4.46Å; I147-A157 CarbonylContact O-C 3.57Å; I147-A157 WeakPolarHBondContact O-CA 3.2Å
158	T	78.6	Confident	75.2	Confident	14 Å²	14	61.5 Å²	61.5	9%	0.086	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	-37.5	-173.4	-50.7	0	0	0	0	112.6	P98 I147 C149 Y156 F182 V183	P98-T158 HydrophobicContact CG-CG2 3.81Å; I147-T158 PolarHBondContact O-N 3.14Å; C149-T158 PolarHBondContact SG-OG1 3.21Å; C149-T158 VanDerWaalsContact SG-OG1 3.33Å; Y156-T158 PolarHBondContact O-N 3.14Å; T158-F182 HydrophobicContact CG2-CD1 4.42Å; T158-V183 PolarHBondContact O-N 3.07Å
159	A	77.7	Confident	73.9	Confident	2 Å²	2	69.4 Å²	69.4	2%	0.017	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	164	-172.2	0	0	0	0	0	112	I147 V180 S181 F182	I147-A159 HydrophobicContact CB-CB 4.26Å; I147-A159 HydrophobicContact CD1-CB 4.07Å; I147-A159 HydrophobicContact CG1-CB 4.44Å; I147-A159 PolarHBondContact N-O 3.47Å; A159-V180 HydrophobicContact CB-CB 4.1Å; A159-V180 HydrophobicContact CB-CG2 4.33Å; A159-S181 CarbonylContact C-O 3.56Å; A159-S181 VanDerWaalsContact CA-O 3.28Å; A159-S181 WeakPolarHBondContact CA-O 3.41Å; A159-F182 HydrophobicContact CB-CD1 3.64Å; A159-F182 HydrophobicContact CB-CE1 3.65Å
160	I	80.2	Confident	72.8	Confident	12 Å²	12	73.1 Å²	73.1	6%	0.062	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	137	177.1	-64.9	167	0	0	0	108.8	L2 V70 S145 V162 V180 S181 V183	L2-I160 HydrophobicContact CD2-CD1 3.88Å; V70-I160 HydrophobicContact CB-CD1 4.25Å; V70-I160 HydrophobicContact CG1-CD1 3.47Å; V70-I160 VanDerWaalsContact CG1-CD1 3.47Å; V70-I160 HydrophobicContact CG2-CB 4.19Å; V70-I160 HydrophobicContact CG2-CD1 3.76Å; V70-I160 HydrophobicContact CG2-CG1 4.49Å; S145-I160 WeakPolarHBondContact O-CA 3.35Å; I160-V162 PolarHBondContact O-N 2.78Å; I160-V180 CarbonylContact O-C 3.53Å; I160-V180 VanDerWaalsContact O-CA 3.22Å; I160-V180 WeakPolarHBondContact O-CA 3.23Å; I160-S181 PolarHBondContact N-O 3.31Å; I160-S181 PolarHBondContact O-N 3.21Å; I160-V183 HydrophobicContact CD1-CG2 3.83Å; I160-V183 HydrophobicContact CG1-CG2 3.84Å
161	I	78	Confident	71.8	Confident	1 Å²	1	75.1 Å²	75.1	1%	0.005	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	111	175.9	-62.5	177.8	0	0	0	109.2	F105 I130 V142 G144 S145 I147 A178 V180	F105-I161 HydrophobicContact CD1-CD1 4.24Å; F105-I161 HydrophobicContact CD2-CD1 3.74Å; F105-I161 HydrophobicContact CE1-CD1 4.35Å; F105-I161 HydrophobicContact CE2-CD1 3.86Å; F105-I161 HydrophobicContact CG-CD1 3.93Å; F105-I161 HydrophobicContact CZ-CD1 4.17Å; I130-I161 HydrophobicContact CD1-CD1 4.31Å; I130-I161 HydrophobicContact CD1-CG1 4.26Å; V142-I161 HydrophobicContact CB-CD1 4.17Å; V142-I161 HydrophobicContact CB-CG2 4.18Å; V142-I161 HydrophobicContact CG2-CG2 4Å; V142-I161 WeakPolarHBondContact O-CB 2.97Å; G144-I161 PolarHBondContact N-O 2.8Å; S145-I161 PolarHBondContact O-N 3.22Å; I147-I161 HydrophobicContact CD1-CG1 4.35Å; I147-I161 HydrophobicContact CG1-CG1 4.35Å; I161-A178 HydrophobicContact CG2-CB 3.9Å; I161-V180 HydrophobicContact CG1-CG1 4.06Å
162	V	73.8	Confident	71.5	Confident	40 Å²	40	73.7 Å²	73.7	24%	0.242	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	-46.3	-178.8	176.9	0	0	0	0	111	Y143 I160 E179 S181	Y143-V162 VanDerWaalsContact CD1-O 3.23Å; Y143-V162 WeakPolarHBondContact CD1-O 3.45Å; I160-V162 PolarHBondContact O-N 2.78Å; V162-E179 PolarHBondContact N-O 3.04Å; V162-S181 VanDerWaalsContact CG2-CB 3.45Å
163	K	72.8	Confident	71.1	Confident	87 Å²	87	73.9 Å²	73.9	38%	0.378	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	150.7	176.1	69	-175.2	-171.2	-123.5	0	114.6	Y143 A178 E179	Y143-K163 HydrophobicContact CD1-CB 4.37Å; Y143-K163 HydrophobicContact CE1-CB 3.78Å; K163-A178 CarbonylContact O-C 3.55Å; K163-A178 WeakPolarHBondContact O-CA 3.16Å; K163-E179 WeakPolarHBondContact CD-OE2 3.49Å; K163-E179 VanDerWaalsContact CE-CD 3.44Å; K163-E179 WeakPolarHBondContact CE-OE2 3.25Å; K163-E179 HydrophobicContact CG-CB 3.8Å; K163-E179 WeakPolarHBondContact CG-OE2 3.49Å; K163-E179 PolarHBondContact N-O 3.17Å; K163-E179 IonicContact NZ-OE1 3.35Å; K163-E179 PolarHBondContact NZ-OE1 3.2Å; K163-E179 IonicContact NZ-OE2 3.08Å; K163-E179 PolarHBondContact NZ-OE2 3.08Å; K163-E179 PolarHBondContact O-N 2.8Å
164	K	70.8	Confident	70.9	Confident	27 Å²	27	73.7 Å²	73.7	12%	0.117	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	130.3	166.6	-169.9	177.4	177.6	173.6	0	109.1	P139 V142 Y143 L166	P139-K164 HydrophobicContact CB-CD 4.28Å; V142-K164 HydrophobicContact CG2-CB 4.33Å; Y143-K164 HydrophobicContact CE1-CB 4.47Å; Y143-K164 VanDerWaalsContact CE1-N 3.29Å; Y143-K164 HydrophobicContact CE2-CB 4.4Å; Y143-K164 WeakPolarHBondContact OH-CB 3.43Å; Y143-K164 PolarHBondContact OH-N 3.13Å; K164-L166 HydrophobicContact CB-CD1 4.3Å; K164-L166 HydrophobicContact CD-CD1 3.82Å; K164-L166 HydrophobicContact CG-CD1 4.01Å; K164-L166 PolarHBondContact O-N 2.88Å
165	L	68.8	Low	71	Confident	37 Å²	37	72.2 Å²	72.2	19%	0.194	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	101.9	174.7	-65.9	170.9	0	0	0	108.3	D129 N167 R177 E179	D129-L165 HydrophobicContact CB-CD1 4.22Å; D129-L165 WeakPolarHBondContact OD2-CD1 3.49Å; L165-N167 PolarHBondContact O-N 2.99Å; L165-R177 HydrophobicContact CB-CB 4.16Å; L165-R177 HydrophobicContact CD1-CB 4.39Å; L165-R177 PolarHBondContact N-O 2.71Å; L165-E179 HydrophobicContact CD1-CB 4.32Å; L165-E179 HydrophobicContact CD2-CB 4.39Å; L165-E179 HydrophobicContact CG-CB 4.29Å
166	L	61.1	Low	70.8	Confident	126 Å²	126	71.2 Å²	71.2	66%	0.66	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-13.8	-171.6	-118.6	84.3	0	0	0	115.1	K164	K164-L166 HydrophobicContact CB-CD1 4.3Å; K164-L166 HydrophobicContact CD-CD1 3.82Å; K164-L166 HydrophobicContact CG-CD1 4.01Å; K164-L166 PolarHBondContact O-N 2.88Å
167	N	55.2	Low	70.7	Confident	155 Å²	155	69.9 Å²	69.9	83%	0.829	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.6	24.6	-162.8	-70.5	-6.3	0	0	0	115.7	L165	L165-N167 PolarHBondContact O-N 2.99Å
168	R	60.1	Low	70.6	Confident	134 Å²	134	69.9 Å²	69.9	51%	0.506	35%	0.349	S	S	.	.	S	Bend	trans	-109.9	134.3	176.1	-72.6	-171.5	177.4	-174.5	-3.8	110.9	D129	D129-R168 IonicContact OD2-CZ 3.4Å; D129-R168 IonicContact OD2-NH1 2.62Å; D129-R168 PolarHBondContact OD2-NH1 2.81Å
169	K	58.6	Low	70.5	Confident	195 Å²	195	71.1 Å²	71.1	85%	0.848	35%	0.354	S	S	*	.			trans	-56.5	124.8	176.5	-73.3	-177.6	179.2	179	0	109.1
170	P	62.3	Low	70.5	Confident	82 Å²	82	71.3 Å²	71.3	53%	0.532	36%	0.355	S	S	.	.			trans	-66.7	140.5	176.3	27.3	-32.5	0	0	0	109.9	E175	P170-E175 HydrophobicContact CB-CB 4.34Å
171	S	63	Low	70.3	Confident	96 Å²	96	70.9 Å²	70.9	67%	0.671	35%	0.353	S	S	*	.	S	Bend	trans	-80.2	-28.3	175.2	-164.8	0	0	0	0	111.3	E175	S171-E175 WeakPolarHBondContact CA-OE2 3.27Å; S171-E175 WeakPolarHBondContact CB-OE2 3.42Å; S171-E175 PolarHBondContact N-OE2 2.91Å
172	V	69.8	Low	70.1	Confident	80 Å²	80	72.4 Å²	72.4	49%	0.485	36%	0.36	S	S	.	.	S	Bend	trans	-132.5	148.3	-179.6	-172.2	0	0	0	0	109.1	N174 E175	V172-N174 PolarHBondContact O-N 3.43Å; V172-E175 HydrophobicContact CB-CB 4.28Å; V172-E175 PolarHBondContact N-OE2 3.5Å; V172-E175 VanDerWaalsContact O-CB 3.24Å; V172-E175 WeakPolarHBondContact O-CB 3.37Å; V172-E175 PolarHBondContact O-N 2.86Å; V172-E175 VanDerWaalsContact O-N 3.07Å
173	K	66.5	Low	70	Confident	178 Å²	178	70.9 Å²	70.9	77%	0.774	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	136.3	171.7	-170.2	178.3	179.3	-176.1	0	109	E175	K173-E175 PolarHBondContact O-N 3.1Å
174	N	70.7	Confident	69.7	Low	68 Å²	68	67.2 Å²	67.2	36%	0.364	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.4	1.8	-178.8	-61.2	-5.2	0	0	0	116.6	I133 T134 D135 V172	I133-N174 HydrophobicContact CG2-CB 4.04Å; T134-N174 PolarHBondContact N-O 3.21Å; T134-N174 VanDerWaalsContact N-O 3.12Å; T134-N174 WeakPolarHBondContact O-CB 3.37Å; D135-N174 PolarHBondContact OD1-ND2 3.43Å; V172-N174 PolarHBondContact O-N 3.43Å
175	E	76.5	Confident	69.6	Low	22 Å²	22	67.6 Å²	67.6	10%	0.103	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	133.8	173.4	-170.8	-174.4	-143.9	0	0	111.2	C131 Y132 P170 S171 V172 K173	C131-E175 HydrophobicContact CB-CG 4.12Å; C131-E175 VanDerWaalsContact CB-OE1 3.29Å; C131-E175 WeakPolarHBondContact CB-OE1 3.46Å; C131-E175 PolarHBondContact SG-OE1 3.2Å; Y132-E175 CarbonylContact O-C 3.59Å; Y132-E175 WeakPolarHBondContact O-CA 3.21Å; P170-E175 HydrophobicContact CB-CB 4.34Å; S171-E175 WeakPolarHBondContact CA-OE2 3.27Å; S171-E175 WeakPolarHBondContact CB-OE2 3.42Å; S171-E175 PolarHBondContact N-OE2 2.91Å; V172-E175 HydrophobicContact CB-CB 4.28Å; V172-E175 PolarHBondContact N-OE2 3.5Å; V172-E175 VanDerWaalsContact O-CB 3.24Å; V172-E175 WeakPolarHBondContact O-CB 3.37Å; V172-E175 PolarHBondContact O-N 2.86Å; V172-E175 VanDerWaalsContact O-N 3.07Å; K173-E175 PolarHBondContact O-N 3.1Å
176	K	78.4	Confident	69.5	Low	70 Å²	70	69.2 Å²	69.2	30%	0.304	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	149.4	173	-58	-61.5	178.2	-171.2	0	109.1	C131 Y132 T134	C131-K176 WeakPolarHBondContact CA-O 3.21Å; Y132-K176 HydrophobicContact CD1-CB 4.45Å; Y132-K176 HydrophobicContact CD2-CB 4.25Å; Y132-K176 HydrophobicContact CE1-CB 3.9Å; Y132-K176 HydrophobicContact CE2-CB 3.68Å; Y132-K176 HydrophobicContact CE2-CG 4.13Å; Y132-K176 VanDerWaalsContact CZ-CB 3.48Å; Y132-K176 PolarHBondContact N-O 3.45Å; Y132-K176 PolarHBondContact O-N 2.86Å; T134-K176 HydrophobicContact CG2-CG 3.81Å
177	R	80.3	Confident	69.8	Low	42 Å²	42	67.4 Å²	67.4	16%	0.158	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	140.1	178.2	-58.7	-166.2	175.4	-135.9	-7.7	111	I130 L165	I130-R177 WeakPolarHBondContact O-CA 3.46Å; L165-R177 HydrophobicContact CB-CB 4.16Å; L165-R177 HydrophobicContact CD1-CB 4.39Å; L165-R177 PolarHBondContact N-O 2.71Å
178	A	78.7	Confident	70.3	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	144.9	173	0	0	0	0	0	110.4	D129 I130 Y132 I161 K163	D129-A178 WeakPolarHBondContact CA-O 3.08Å; I130-A178 HydrophobicContact CD1-CB 4.26Å; I130-A178 HydrophobicContact CG1-CB 3.99Å; I130-A178 WeakPolarHBondContact CG1-O 3.41Å; I130-A178 PolarHBondContact N-O 2.76Å; I130-A178 PolarHBondContact O-N 2.63Å; Y132-A178 HydrophobicContact CE1-CB 3.98Å; I161-A178 HydrophobicContact CG2-CB 3.9Å; K163-A178 CarbonylContact O-C 3.55Å; K163-A178 WeakPolarHBondContact O-CA 3.16Å
179	E	78.2	Confident	70.5	Confident	40 Å²	40	59.2 Å²	59.2	19%	0.187	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	135	168.1	-177.3	-171.5	-115.6	0	0	108.3	T128 V162 K163 L165	T128-E179 WeakPolarHBondContact O-CA 3.2Å; V162-E179 PolarHBondContact N-O 3.04Å; K163-E179 WeakPolarHBondContact CD-OE2 3.49Å; K163-E179 VanDerWaalsContact CE-CD 3.44Å; K163-E179 WeakPolarHBondContact CE-OE2 3.25Å; K163-E179 HydrophobicContact CG-CB 3.8Å; K163-E179 WeakPolarHBondContact CG-OE2 3.49Å; K163-E179 PolarHBondContact N-O 3.17Å; K163-E179 IonicContact NZ-OE1 3.35Å; K163-E179 PolarHBondContact NZ-OE1 3.2Å; K163-E179 IonicContact NZ-OE2 3.08Å; K163-E179 PolarHBondContact NZ-OE2 3.08Å; K163-E179 PolarHBondContact O-N 2.8Å; L165-E179 HydrophobicContact CD1-CB 4.32Å; L165-E179 HydrophobicContact CD2-CB 4.39Å; L165-E179 HydrophobicContact CG-CB 4.29Å
180	V	77.6	Confident	70.8	Confident	5 Å²	5	54.7 Å²	54.7	3%	0.03	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	151.7	-179.8	-66.9	0	0	0	0	110.9	T128 I130 I147 A159 I160 I161 F182	T128-V180 WeakPolarHBondContact O-CG2 3.49Å; T128-V180 PolarHBondContact O-N 2.86Å; I130-V180 HydrophobicContact CB-CG1 4.48Å; I130-V180 HydrophobicContact CD1-CG1 3.69Å; I130-V180 HydrophobicContact CG1-CG1 3.57Å; I130-V180 HydrophobicContact CG2-CG1 4.12Å; I130-V180 HydrophobicContact CG2-CG2 3.88Å; I147-V180 HydrophobicContact CD1-CB 4.28Å; I147-V180 HydrophobicContact CD1-CG1 3.37Å; A159-V180 HydrophobicContact CB-CB 4.1Å; A159-V180 HydrophobicContact CB-CG2 4.33Å; I160-V180 CarbonylContact O-C 3.53Å; I160-V180 VanDerWaalsContact O-CA 3.22Å; I160-V180 WeakPolarHBondContact O-CA 3.23Å; I161-V180 HydrophobicContact CG1-CG1 4.06Å; V180-F182 HydrophobicContact CG2-CE1 4Å; V180-F182 HydrophobicContact CG2-CE2 4.34Å; V180-F182 HydrophobicContact CG2-CZ 3.58Å
181	S	74.8	Confident	70.9	Confident	4 Å²	4	56.4 Å²	56.4	3%	0.028	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	130.6	168.2	-169.3	0	0	0	0	108.9	T63 A159 I160 V162	T63-S181 WeakPolarHBondContact CB-OG 3.47Å; T63-S181 PolarHBondContact OG1-OG 3.47Å; A159-S181 CarbonylContact C-O 3.56Å; A159-S181 VanDerWaalsContact CA-O 3.28Å; A159-S181 WeakPolarHBondContact CA-O 3.41Å; I160-S181 PolarHBondContact N-O 3.31Å; I160-S181 PolarHBondContact O-N 3.21Å; V162-S181 VanDerWaalsContact CG2-CB 3.45Å
182	F	74.1	Confident	70.9	Confident	32 Å²	32	54.1 Å²	54.1	14%	0.14	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	134.1	-178.8	-62	-68.1	0	0	0	110.3	T63 F97 G127 T158 A159 V180 A184	T63-F182 WeakPolarHBondContact CB-O 3.23Å; T63-F182 VanDerWaalsContact CG2-O 3.3Å; T63-F182 WeakPolarHBondContact CG2-O 3.2Å; F97-F182 HydrophobicContact CD2-CD1 4.31Å; F97-F182 HydrophobicContact CD2-CE1 4.08Å; F97-F182 HydrophobicContact CD2-CZ 4.38Å; F97-F182 AromaticContact CE2-CD1 3.54Å; F97-F182 HydrophobicContact CE2-CD1 3.54Å; F97-F182 HydrophobicContact CE2-CD2 4.32Å; F97-F182 AromaticContact CE2-CE1 2.96Å; F97-F182 HydrophobicContact CE2-CE1 2.96Å; F97-F182 AromaticContact CE2-CE2 3.78Å; F97-F182 HydrophobicContact CE2-CE2 3.78Å; F97-F182 HydrophobicContact CE2-CG 4.23Å; F97-F182 AromaticContact CE2-CZ 3.11Å; F97-F182 HydrophobicContact CE2-CZ 3.11Å; F97-F182 HydrophobicContact CZ-CD1 4.27Å; F97-F182 AromaticContact CZ-CE1 3.29Å; F97-F182 HydrophobicContact CZ-CE1 3.29Å; F97-F182 HydrophobicContact CZ-CE2 4.35Å; F97-F182 AromaticContact CZ-CZ 3.35Å; F97-F182 HydrophobicContact CZ-CZ 3.35Å; G127-F182 WeakPolarHBondContact O-CE2 3.49Å; G127-F182 WeakPolarHBondContact O-CZ 3.23Å; T158-F182 HydrophobicContact CG2-CD1 4.42Å; A159-F182 HydrophobicContact CB-CD1 3.64Å; A159-F182 HydrophobicContact CB-CE1 3.65Å; V180-F182 HydrophobicContact CG2-CE1 4Å; V180-F182 HydrophobicContact CG2-CE2 4.34Å; V180-F182 HydrophobicContact CG2-CZ 3.58Å; F182-A184 PolarHBondContact O-N 3.28Å
183	V	71.2	Confident	70.5	Confident	9 Å²	9	53.1 Å²	53.1	6%	0.055	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-76.7	127.4	-178.5	-170.8	0	0	0	0	108.7	L2 F61 L90 T158 I160	L2-V183 HydrophobicContact CD1-CG1 3.88Å; F61-V183 HydrophobicContact CE1-CG1 4.4Å; L90-V183 HydrophobicContact CD2-CB 4.2Å; L90-V183 HydrophobicContact CD2-CG1 3.34Å; T158-V183 PolarHBondContact O-N 3.07Å; I160-V183 HydrophobicContact CD1-CG2 3.83Å; I160-V183 HydrophobicContact CG1-CG2 3.84Å
184	A	67	Low	70.4	Confident	9 Å²	9	53.8 Å²	53.8	7%	0.074	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-65.6	152.8	176.8	0	0	0	0	0	111.1	F61 F182 E188	F61-A184 HydrophobicContact CE1-CB 3.91Å; F61-A184 HydrophobicContact CZ-CB 3.95Å; F182-A184 PolarHBondContact O-N 3.28Å; A184-E188 HydrophobicContact CB-CB 4.1Å; A184-E188 HydrophobicContact CB-CG 4.49Å
185	P	68.8	Low	69.8	Low	35 Å²	35	56.8 Å²	56.8	23%	0.227	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-57.3	159.6	177.9	-23.1	33	0	0	0	113.4	V93 E187 E188 L189	V93-P185 HydrophobicContact CB-CB 4.33Å; V93-P185 HydrophobicContact CB-CG 4.18Å; V93-P185 HydrophobicContact CG1-CG 4.47Å; V93-P185 HydrophobicContact CG2-CB 3.62Å; V93-P185 HydrophobicContact CG2-CG 3.95Å; P185-E187 VanDerWaalsContact CB-OE2 3.26Å; P185-E187 WeakPolarHBondContact CB-OE2 3.18Å; P185-E187 PolarHBondContact O-N 3.27Å; P185-E187 VanDerWaalsContact O-N 3.14Å; P185-E188 PolarHBondContact O-N 2.92Å; P185-L189 PolarHBondContact O-N 3.24Å
186	L	66.5	Low	68.6	Low	72 Å²	72	60 Å²	60	38%	0.377	28%	0.284	S	S	.	.	H	α-helix	trans	-56.7	-31.1	-177.2	-178.6	65.2	0	0	0	113	L90 E188 L189 H190	L90-L186 HydrophobicContact CD1-CB 4.23Å; L90-L186 HydrophobicContact CD1-CD1 3.89Å; L186-E188 VanDerWaalsContact C-N 3.3Å; L186-E188 PolarHBondContact O-N 2.59Å; L186-L189 HydrophobicContact CD1-CD2 4.13Å; L186-L189 WeakPolarHBondContact O-CB 3.39Å; L186-L189 PolarHBondContact O-N 3.42Å; L186-H190 PolarHBondContact O-N 2.93Å
187	E	67	Low	67.2	Low	88 Å²	88	60.9 Å²	60.9	41%	0.411	30%	0.299	S	S	.	.	H	α-helix	trans	-60.3	-41.2	178.4	-67.4	67.1	-146.9	0	0	111.5	V93 P185 H190 K191	V93-E187 HydrophobicContact CG2-CG 4.24Å; V93-E187 WeakPolarHBondContact CG2-OE2 3.26Å; P185-E187 VanDerWaalsContact CB-OE2 3.26Å; P185-E187 WeakPolarHBondContact CB-OE2 3.18Å; P185-E187 PolarHBondContact O-N 3.27Å; P185-E187 VanDerWaalsContact O-N 3.14Å; E187-H190 PolarHBondContact O-N 3.16Å; E187-K191 WeakPolarHBondContact O-CG 3.1Å; E187-K191 PolarHBondContact O-N 2.99Å; E187-K191 VanDerWaalsContact O-N 3.1Å
188	E	65.5	Low	65.1	Low	86 Å²	86	63.6 Å²	63.6	40%	0.402	32%	0.32	S	S	.	.	H	α-helix	trans	-73.3	-33.8	-178.7	-148.8	60.5	-160.2	0	0	110.9	A184 P185 L186 K191 Y192	A184-E188 HydrophobicContact CB-CB 4.1Å; A184-E188 HydrophobicContact CB-CG 4.49Å; P185-E188 PolarHBondContact O-N 2.92Å; L186-E188 VanDerWaalsContact C-N 3.3Å; L186-E188 PolarHBondContact O-N 2.59Å; E188-K191 PolarHBondContact O-N 2.72Å; E188-K191 IonicContact OE2-NZ 3.5Å; E188-K191 PolarHBondContact OE2-NZ 3Å; E188-Y192 WeakPolarHBondContact O-CB 3.3Å; E188-Y192 PolarHBondContact O-N 2.75Å
189	L	65	Low	62.7	Low	31 Å²	31	71.6 Å²	71.6	16%	0.162	36%	0.362	C	S	.	.	H	α-helix	trans	-61.3	-45.2	170.3	-176.6	64.6	0	0	0	111.9	F61 I72 L90 P185 L186 Y192 V193	F61-L189 HydrophobicContact CD2-CD1 3.98Å; F61-L189 HydrophobicContact CE2-CB 4.03Å; F61-L189 HydrophobicContact CE2-CD1 3.67Å; F61-L189 HydrophobicContact CE2-CG 4.5Å; F61-L189 HydrophobicContact CZ-CB 3.89Å; F61-L189 HydrophobicContact CZ-CD1 4.03Å; I72-L189 HydrophobicContact CD1-CD1 3.13Å; I72-L189 HydrophobicContact CG1-CD1 4.01Å; L90-L189 HydrophobicContact CD1-CD2 3.9Å; P185-L189 PolarHBondContact O-N 3.24Å; L186-L189 HydrophobicContact CD1-CD2 4.13Å; L186-L189 WeakPolarHBondContact O-CB 3.39Å; L186-L189 PolarHBondContact O-N 3.42Å; L189-Y192 PolarHBondContact O-N 3.2Å; L189-V193 HydrophobicContact CD1-CG2 4.22Å; L189-V193 HydrophobicContact CG-CG2 4.5Å; L189-V193 VanDerWaalsContact O-CG2 3.3Å; L189-V193 WeakPolarHBondContact O-CG2 3.4Å; L189-V193 PolarHBondContact O-N 3.28Å
190	H	64.9	Low	60.4	Low	99 Å²	99	74.5 Å²	74.5	46%	0.458	38%	0.384	S	S	.	.	H	α-helix	trans	-64.4	-39.8	178.3	-75.6	170.3	0	0	0	112.8	L186 E187 R194	L186-H190 PolarHBondContact O-N 2.93Å; E187-H190 PolarHBondContact O-N 3.16Å; H190-R194 WeakPolarHBondContact O-CG 2.91Å; H190-R194 PolarHBondContact O-N 3.01Å
191	K	65.4	Low	57.9	Low	119 Å²	119	82.1 Å²	82.1	52%	0.517	42%	0.424	S	S	.	.	H	α-helix	trans	-62.2	-47.4	174.6	-69.3	175.5	-162.9	160	0	111.4	E187 E188 R194 L195	E187-K191 WeakPolarHBondContact O-CG 3.1Å; E187-K191 PolarHBondContact O-N 2.99Å; E187-K191 VanDerWaalsContact O-N 3.1Å; E188-K191 PolarHBondContact O-N 2.72Å; E188-K191 IonicContact OE2-NZ 3.5Å; E188-K191 PolarHBondContact OE2-NZ 3Å; K191-R194 PolarHBondContact O-N 3.37Å; K191-L195 PolarHBondContact O-N 3.35Å; K191-L195 VanDerWaalsContact O-N 3.13Å
192	Y	61.3	Low	55.8	Low	48 Å²	48	88.2 Å²	88.2	19%	0.188	46%	0.461	C	S	.	.	H	α-helix	trans	-64.7	-43.4	-177.4	-170.5	-89.6	0	0	0	112.5	L59 P60 F61 L62 E188 L189 L195 N196	L59-Y192 HydrophobicContact CB-CE1 4.12Å; L59-Y192 HydrophobicContact CD2-CE1 4.24Å; P60-Y192 WeakPolarHBondContact O-CE1 3.18Å; P60-Y192 PolarHBondContact O-OH 2.81Å; F61-Y192 HydrophobicContact CD2-CD1 4.41Å; F61-Y192 HydrophobicContact CD2-CG 4.36Å; L62-Y192 HydrophobicContact CD1-CE2 4.42Å; E188-Y192 WeakPolarHBondContact O-CB 3.3Å; E188-Y192 PolarHBondContact O-N 2.75Å; L189-Y192 PolarHBondContact O-N 3.2Å; Y192-L195 PolarHBondContact O-N 2.77Å; Y192-N196 WeakPolarHBondContact CE1-ND2 3.39Å; Y192-N196 PolarHBondContact O-N 3.43Å; Y192-N196 PolarHBondContact OH-ND2 2.84Å
193	V	62.4	Low	53.6	Low	58 Å²	58	95.8 Å²	95.8	35%	0.352	49%	0.494	S	S	.	.	H	α-helix	trans	-65.5	-40.5	178.6	173.2	0	0	0	0	111.3	L189 S197	L189-V193 HydrophobicContact CD1-CG2 4.22Å; L189-V193 HydrophobicContact CG-CG2 4.5Å; L189-V193 VanDerWaalsContact O-CG2 3.3Å; L189-V193 WeakPolarHBondContact O-CG2 3.4Å; L189-V193 PolarHBondContact O-N 3.28Å; V193-S197 WeakPolarHBondContact O-CB 3.5Å; V193-S197 PolarHBondContact O-N 3.32Å; V193-S197 PolarHBondContact O-OG 2.86Å
194	R	63.2	Low	51.6	Low	192 Å²	192	100.8 Å²	100.8	73%	0.725	53%	0.529	S	S	*	.	H	α-helix	trans	-63.6	-44.3	177.1	-77.2	-177.8	-176.8	157.3	2	112.3	H190 K191 N196 S197	H190-R194 WeakPolarHBondContact O-CG 2.91Å; H190-R194 PolarHBondContact O-N 3.01Å; K191-R194 PolarHBondContact O-N 3.37Å; R194-N196 PolarHBondContact O-N 3Å; R194-S197 PolarHBondContact O-N 2.85Å
195	L	58.4	Low	49.8	Very low	132 Å²	132	108.6 Å²	108.6	69%	0.691	56%	0.564	S	S	*	*	H	α-helix	trans	-62.5	-41.2	-178.2	-112	80.5	0	0	0	113.1	K191 Y192	K191-L195 PolarHBondContact O-N 3.35Å; K191-L195 VanDerWaalsContact O-N 3.13Å; Y192-L195 PolarHBondContact O-N 2.77Å
196	N	52.8	Low	47.9	Very low	89 Å²	89	115.4 Å²	115.4	48%	0.476	59%	0.593	S	S	.	*	H	α-helix	trans	-89.5	0.7	-175.6	-78.2	-10.3	0	0	0	114.4	L59 Y192 R194	L59-N196 HydrophobicContact CD2-CB 4.09Å; Y192-N196 WeakPolarHBondContact CE1-ND2 3.39Å; Y192-N196 PolarHBondContact O-N 3.43Å; Y192-N196 PolarHBondContact OH-ND2 2.84Å; R194-N196 PolarHBondContact O-N 3Å
197	S	48.6	Very low	46.1	Very low	89 Å²	89	117.1 Å²	117.1	62%	0.622	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-9.3	175.8	-59.8	0	0	0	0	113.6	V193 R194	V193-S197 WeakPolarHBondContact O-CB 3.5Å; V193-S197 PolarHBondContact O-N 3.32Å; V193-S197 PolarHBondContact O-OG 2.86Å; R194-S197 PolarHBondContact O-N 2.85Å
198	T	34.8	Very low	44.1	Very low	98 Å²	98	121.8 Å²	121.8	60%	0.601	64%	0.639	S	S	*	*			trans	-126.3	98.9	-172.9	48.2	0	0	0	0	111.7
199	L	30.1	Very low	42.4	Very low	169 Å²	169	125.2 Å²	125.2	89%	0.885	66%	0.655	S	S	*	*			trans	-175.5	145.6	155.2	-124.9	92.9	0	0	0	111
200	P	28.9	Very low	40.6	Very low	100 Å²	100	129.8 Å²	129.8	65%	0.649	68%	0.679	S	S	*	*			cis	-127.1	148.3	-31	26.4	-6.9	0	0	0	113.7	V202	P200-V202 PolarHBondContact O-N 3.21Å
201	L	25.1	Very low	39	Very low	166 Å²	166	134.2 Å²	134.2	87%	0.869	70%	0.698	S	S	*	*			trans	-63.8	118.5	164.3	-124.7	86.6	0	0	0	109.6
202	V	31.8	Very low	37.2	Very low	131 Å²	131	137.3 Å²	137.3	79%	0.794	71%	0.711	S	S	*	*			trans	-93.8	114.5	165.4	176.8	0	0	0	0	107.9	P200	P200-V202 PolarHBondContact O-N 3.21Å
203	K	26.1	Very low	35.6	Very low	192 Å²	192	144.7 Å²	144.7	84%	0.835	74%	0.744	S	S	*	*			trans	-77.4	132.5	165.6	-67.5	178.1	176.1	-178.5	0	108.6
204	S	31.2	Very low	34	Very low	114 Å²	114	147 Å²	147	80%	0.797	77%	0.77	S	S	*	*			trans	-146.4	112.9	152.7	71.5	0	0	0	0	110.3
205	E	27.9	Very low	32.3	Very low	172 Å²	172	145.5 Å²	145.5	80%	0.804	77%	0.769	S	S	*	*			trans	-74.3	151.6	164.2	-72.2	170.2	142.6	0	0	110.7
206	H	29.5	Very low	31.2	Very low	179 Å²	179	144.9 Å²	144.9	83%	0.829	77%	0.772	S	S	*	*			trans	58.3	105	156.5	-63.8	-59.4	0	0	0	120.5
207	A	28.7	Very low	30.2	Very low	108 Å²	108	144 Å²	144	89%	0.893	79%	0.785	S	S	*	*			trans	-162.1	95.2	135.4	0	0	0	0	0	109.5
208	E	25.3	Very low	29.2	Very low	185 Å²	185	146.9 Å²	146.9	86%	0.864	79%	0.792	S	S	*	*			trans	-88.7	160	165.5	-152.3	170	-178.6	0	0	109.1
209	E	28.6	Very low	29	Very low	158 Å²	158	147.9 Å²	147.9	74%	0.738	80%	0.803	S	S	*	*			trans	71.1	105.2	165.2	-66.1	-167.7	152.1	0	0	118
210	N	28.9	Very low	28.8	Very low	127 Å²	127	143.8 Å²	143.8	68%	0.679	79%	0.785	S	S	*	*				169.7	146.8	85.6	-103.5	-43.2	0	0	0	114.2
211	F	29.3	Very low	28.9	Very low	192 Å²	192	144 Å²	144	84%	0.842	80%	0.796	S	S	*	*			trans	88.2	89.9	152.3	-92.9	-101.5	0	0	0	122.4
212	K	28.3	Very low	28.9	Very low	184 Å²	184	143.4 Å²	143.4	80%	0.8	79%	0.793	S	S	*	*			trans	-39.7	160.2	144.8	-70.8	168.2	172.4	168	0	116.3
213	K	28.7	Very low	28.8	Very low	203 Å²	203	144.4 Å²	144.4	88%	0.883	80%	0.8	S	S	*	*			trans	90.9	101.2	147.9	-79.7	170.3	178.4	-177.6	0	118.5
214	A	28.6	Very low	28.9	Very low	108 Å²	108	140.5 Å²	140.5	89%	0.893	80%	0.797	S	S	*	*				-171.7	131.2	112.2	0	0	0	0	0	111.3
215	K	28	Very low	29	Very low	160 Å²	160	140.1 Å²	140.1	70%	0.696	79%	0.791	S	S	*	*			trans	-120.9	173.5	173.4	-127.2	-155.7	172	176.6	0	107.8
216	P	34.9	Very low	29.2	Very low	119 Å²	119	140 Å²	140	77%	0.773	80%	0.796	S	S	*	*				-127.2	-173.8	-127	29.4	-3.7	0	0	0	113.8
217	G	30.8	Very low	29.1	Very low	71 Å²	71	137.7 Å²	137.7	73%	0.732	80%	0.795	S	S	*	*			trans	-142.2	114.9	161.7	0	0	0	0	0	109.1
218	L	27.7	Very low	29.2	Very low	148 Å²	148	144 Å²	144	78%	0.775	80%	0.796	S	S	*	*				72.3	108.3	70.7	-162.9	77.9	0	0	0	113.6
219	S	31.5	Very low	29.2	Very low	119 Å²	119	139.1 Å²	139.1	83%	0.832	79%	0.787	S	S	*	*				-162.1	149.2	122.6	76.9	0	0	0	0	111
220	T	26	Very low	29.5	Very low	84 Å²	84	139.1 Å²	139.1	52%	0.515	79%	0.792	S	S	.	*			trans	-113	147.1	-166.5	38.2	0	0	0	0	110.7
221	A	29.5	Very low	29.5	Very low	105 Å²	105	139.5 Å²	139.5	87%	0.868	80%	0.799	S	S	*	*			trans	-145.4	123.5	151	0	0	0	0	0	110.1
222	N	26.4	Very low	29.7	Very low	153 Å²	153	136 Å²	136	82%	0.818	79%	0.787	S	S	*	*			trans	-90.8	143.2	-179.6	-67	-36.8	0	0	0	110.3
223	T	30	Very low	30	Very low	152 Å²	152	136.8 Å²	136.8	93%	0.933	79%	0.79	S	S	*	*			trans	-142	126.8	149.1	-37.3	0	0	0	0	110
224	S	26.8	Very low	30.1	Very low	110 Å²	110	134.5 Å²	134.5	77%	0.769	78%	0.783	S	S	*	*			trans	-87.9	-179.4	-174.7	-137.7	0	0	0	0	111.8
225	P	33.5	Very low	30.3	Very low	105 Å²	105	135.3 Å²	135.3	68%	0.682	78%	0.779	S	S	*	*				-118.1	179.1	-125.3	20.8	6.4	0	0	0	112
226	N	32.1	Very low	30.5	Very low	169 Å²	169	135.7 Å²	135.7	90%	0.904	79%	0.787	S	S	*	*			trans	-143.3	127.3	158.8	-102.2	-24.2	0	0	0	112.8
227	T	27.7	Very low	30.1	Very low	131 Å²	131	135.7 Å²	135.7	80%	0.804	79%	0.791	S	S	*	*			trans	-70.7	139.2	-179.3	-48.8	0	0	0	0	111.8
228	R	30.1	Very low	30.2	Very low	241 Å²	241	138.6 Å²	138.6	91%	0.909	80%	0.796	S	S	*	*			trans	-153.7	111.6	149.7	-130.9	175	-173.8	177.2	1.9	111.6
229	A	26.8	Very low	30.1	Very low	83 Å²	83	140.9 Å²	140.9	69%	0.686	80%	0.8	S	S	*	*			trans	-65.6	140.7	169.2	0	0	0	0	0	110.4
230	N	33.8	Very low	30.2	Very low	157 Å²	157	144.1 Å²	144.1	84%	0.84	80%	0.802	S	S	*	*			trans	-144.1	113	163	-89.4	-28.7	0	0	0	110.2
231	T	29.3	Very low	30.5	Very low	135 Å²	135	143.8 Å²	143.8	83%	0.828	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-65	126.3	-179.6	-39.8	0	0	0	0	112
232	M	32.9	Very low	30.3	Very low	118 Å²	118	146.7 Å²	146.7	58%	0.581	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-85.5	116.7	165.8	-91.5	-171.9	173.9	0	0	110.2	Y321 L350	M232-Y321 HydrophobicContact CE-CD2 4.05Å; M232-Y321 HydrophobicContact CE-CE2 3.68Å; M232-Y321 HydrophobicContact SD-CD2 3.82Å; M232-Y321 HydrophobicContact SD-CE2 3.95Å; M232-L350 HydrophobicContact CE-CD1 4.28Å
233	K	34.9	Very low	30.5	Very low	201 Å²	201	143.5 Å²	143.5	87%	0.874	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-74.4	134	169.6	-73.7	-178.4	173.7	-175.9	0	110.6
234	Q	29.9	Very low	30.4	Very low	156 Å²	156	145.2 Å²	145.2	73%	0.729	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-81	148	165	-76.5	174.3	-55.9	0	0	110.7
235	P	34	Very low	30.5	Very low	125 Å²	125	144.3 Å²	144.3	81%	0.812	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-98.3	151.5	161.4	15.9	2.8	0	0	0	112.9
236	L	32	Very low	30.2	Very low	167 Å²	167	150.1 Å²	150.1	87%	0.874	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-71	151.9	-163.6	-75	66.4	0	0	0	116
237	S	26.2	Very low	30.1	Very low	120 Å²	120	146.9 Å²	146.9	84%	0.839	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-102.1	146.5	155.6	-79.4	0	0	0	0	110.6
238	P	33.8	Very low	30.3	Very low	131 Å²	131	146.8 Å²	146.8	85%	0.851	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-101.2	140.6	164.9	30.2	-17.9	0	0	0	113
239	K	25.6	Very low	30.1	Very low	197 Å²	197	141.7 Å²	141.7	86%	0.857	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-79.8	152.6	171.7	-68.5	175.6	172.8	-178.7	0	111.6
240	H	33.1	Very low	30.5	Very low	186 Å²	186	145.3 Å²	145.3	86%	0.861	80%	0.795	S	S	*	*			trans	171.7	143.5	140.4	-102.9	-74.8	0	0	0	107.1
241	S	30.9	Very low	30.3	Very low	77 Å²	77	144.6 Å²	144.6	54%	0.538	79%	0.791	S	S	.	*			cis	177.1	130.7	-19.5	38	0	0	0	0	104.2
242	D	26.5	Very low	30.2	Very low	167 Å²	167	143.5 Å²	143.5	89%	0.893	79%	0.789	S	S	*	*			trans	46.5	127.6	142	-45.2	-34.4	0	0	0	121
243	G	30.6	Very low	30	Very low	86 Å²	86	142.5 Å²	142.5	89%	0.887	80%	0.799	S	S	*	*			trans	179	69.6	173.9	0	0	0	0	0	112.3
244	E	26.7	Very low	29.9	Very low	188 Å²	188	138.2 Å²	138.2	88%	0.879	80%	0.795	S	S	*	*			trans	-68.2	140.2	179.9	-174.2	168.2	176.8	0	0	114
245	A	30.9	Very low	29.8	Very low	91 Å²	91	137.9 Å²	137.9	75%	0.752	80%	0.803	S	S	*	*			trans	164.3	107.8	140.6	0	0	0	0	0	108.8
246	R	26.5	Very low	29.8	Very low	227 Å²	227	138.6 Å²	138.6	86%	0.857	80%	0.799	S	S	*	*				90.7	138.5	64.4	-164.2	177.5	-161.2	173.1	6	111.4
247	S	29.8	Very low	29.8	Very low	100 Å²	100	138 Å²	138	70%	0.699	80%	0.797	S	S	*	*			trans	83	140.4	169.1	81.4	0	0	0	0	116.5
248	N	30.9	Very low	30	Very low	130 Å²	130	141.3 Å²	141.3	70%	0.695	79%	0.791	S	S	*	*			cis	-178.5	130.5	-13.8	-99	-10.3	0	0	0	102.1
249	D	27.7	Very low	30	Very low	133 Å²	133	139.4 Å²	139.4	71%	0.711	79%	0.786	S	S	*	*				54.1	118.4	114.6	-66.8	-37.3	0	0	0	115.2
250	L	34.6	Very low	30.4	Very low	159 Å²	159	136.1 Å²	136.1	83%	0.832	77%	0.774	S	S	*	*			trans	162.2	89.6	135.9	-87.4	145.4	0	0	0	106.7
251	N	28.9	Very low	30.4	Very low	143 Å²	143	137.6 Å²	137.6	77%	0.765	77%	0.773	S	S	*	*				59.8	131.4	90.2	-83.3	-22.6	0	0	0	114.9
252	S	27.1	Very low	30.6	Very low	111 Å²	111	140.6 Å²	140.6	78%	0.776	77%	0.774	S	S	*	*			trans	64.4	101.2	145.6	63.4	0	0	0	0	117.5
253	A	29.8	Very low	31.2	Very low	97 Å²	97	140.8 Å²	140.8	80%	0.802	77%	0.769	S	S	*	*				169.5	104.7	116.6	0	0	0	0	0	110.3
254	S	32.8	Very low	31.7	Very low	111 Å²	111	142.6 Å²	142.6	78%	0.776	76%	0.758	S	S	*	*			trans	174.5	72.8	139.3	40.3	0	0	0	0	108.9	I256	S254-I256 PolarHBondContact O-N 2.82Å
255	T	28.3	Very low	32.7	Very low	149 Å²	149	139 Å²	139	91%	0.914	75%	0.753	S	S	*	*			trans	-66.3	80.2	161.6	-54	0	0	0	0	108.7
256	I	32.7	Very low	33.7	Very low	140 Å²	140	142.1 Å²	142.1	72%	0.718	75%	0.754	S	S	*	*			trans	-143.8	122.9	166	-55.8	-178.4	0	0	0	107.7	S254	S254-I256 PolarHBondContact O-N 2.82Å
257	N	32	Very low	35.7	Very low	156 Å²	156	136.1 Å²	136.1	83%	0.834	74%	0.739	S	S	*	*			trans	80.7	63	175.5	-59.1	-26.9	0	0	0	118
258	R	29.8	Very low	37.8	Very low	188 Å²	188	137.3 Å²	137.3	71%	0.709	74%	0.737	S	S	*	*			trans	-98.2	77.2	154.5	-153.7	175.9	-172.7	148.3	-2.2	109.1	H260 Y262	R258-H260 PolarHBondContact O-N 3.14Å; R258-H260 VanDerWaalsContact O-N 3.07Å; R258-Y262 PolarHBondContact NH2-OH 3.41Å
259	A	34.2	Very low	40.2	Very low	92 Å²	92	134.5 Å²	134.5	76%	0.76	73%	0.725	S	S	*	*			trans	-66.6	102.7	157.1	0	0	0	0	0	106.5	Y261	A259-Y261 VanDerWaalsContact C-N 3.31Å; A259-Y261 PolarHBondContact O-N 3.26Å
260	H	33.7	Very low	42.5	Very low	128 Å²	128	131.9 Å²	131.9	59%	0.593	72%	0.715	S	S	*	*			trans	-61	86.6	178.6	-90.9	-124.7	0	0	0	110.5	R258 Y262	R258-H260 PolarHBondContact O-N 3.14Å; R258-H260 VanDerWaalsContact O-N 3.07Å; H260-Y262 HydrophobicContact CB-CD2 3.92Å; H260-Y262 HydrophobicContact CB-CE2 4.49Å; H260-Y262 AromaticContact CE1-CD2 3.86Å; H260-Y262 AromaticContact CE1-CE2 3.35Å; H260-Y262 WeakPolarHBondContact CE1-CE2 3.4Å; H260-Y262 AromaticContact CG-CD2 3.67Å; H260-Y262 AromaticContact CG-CE2 3.8Å; H260-Y262 AromaticContact ND1-CD2 3.11Å; H260-Y262 WeakPolarHBondContact ND1-CD2 3.48Å; H260-Y262 AromaticContact ND1-CE2 3.11Å; H260-Y262 WeakPolarHBondContact ND1-CE2 3.29Å; H260-Y262 PolarHBondContact O-N 3.05Å; H260-Y262 VanDerWaalsContact O-N 3.15Å
261	Y	34.2	Very low	44.5	Very low	216 Å²	216	127.9 Å²	127.9	85%	0.847	70%	0.697	S	S	*	*			trans	-81.4	67.5	158	-114.6	-87.7	0	0	0	108.5	A259 H263	A259-Y261 VanDerWaalsContact C-N 3.31Å; A259-Y261 PolarHBondContact O-N 3.26Å; Y261-H263 VanDerWaalsContact C-N 3.28Å; Y261-H263 PolarHBondContact O-N 3.44Å
262	Y	35.9	Very low	46.9	Very low	140 Å²	140	128.2 Å²	128.2	55%	0.549	69%	0.692	S	S	.	*			trans	-88.7	72.9	164.6	-79.9	-86.4	0	0	0	108.3	R258 H260 L264	R258-Y262 PolarHBondContact NH2-OH 3.41Å; H260-Y262 HydrophobicContact CB-CD2 3.92Å; H260-Y262 HydrophobicContact CB-CE2 4.49Å; H260-Y262 AromaticContact CE1-CD2 3.86Å; H260-Y262 AromaticContact CE1-CE2 3.35Å; H260-Y262 WeakPolarHBondContact CE1-CE2 3.4Å; H260-Y262 AromaticContact CG-CD2 3.67Å; H260-Y262 AromaticContact CG-CE2 3.8Å; H260-Y262 AromaticContact ND1-CD2 3.11Å; H260-Y262 WeakPolarHBondContact ND1-CD2 3.48Å; H260-Y262 AromaticContact ND1-CE2 3.11Å; H260-Y262 WeakPolarHBondContact ND1-CE2 3.29Å; H260-Y262 PolarHBondContact O-N 3.05Å; H260-Y262 VanDerWaalsContact O-N 3.15Å; Y262-L264 HydrophobicContact CD1-CD1 3.47Å; Y262-L264 VanDerWaalsContact CD1-CD1 3.47Å; Y262-L264 HydrophobicContact CE1-CD1 4.37Å; Y262-L264 HydrophobicContact CG-CD1 4.17Å; Y262-L264 PolarHBondContact O-N 3.44Å
263	H	37.5	Very low	49.3	Very low	172 Å²	172	130.1 Å²	130.1	80%	0.796	68%	0.682	S	S	*	*			trans	-77.3	73.9	152.8	-128.4	-63.1	0	0	0	105.9	Y261 S265	Y261-H263 VanDerWaalsContact C-N 3.28Å; Y261-H263 PolarHBondContact O-N 3.44Å; H263-S265 PolarHBondContact O-N 3.06Å
264	L	42	Very low	51.5	Low	123 Å²	123	128.8 Å²	128.8	64%	0.644	67%	0.667	S	S	*	*			trans	-58.6	122.8	157.2	-93.5	91.8	0	0	0	105.1	Y262 M266	Y262-L264 HydrophobicContact CD1-CD1 3.47Å; Y262-L264 VanDerWaalsContact CD1-CD1 3.47Å; Y262-L264 HydrophobicContact CE1-CD1 4.37Å; Y262-L264 HydrophobicContact CG-CD1 4.17Å; Y262-L264 PolarHBondContact O-N 3.44Å; L264-M266 PolarHBondContact O-N 3.1Å
265	S	47.5	Very low	53.6	Low	113 Å²	113	127.6 Å²	127.6	79%	0.79	65%	0.651	S	S	*	*			trans	-51.9	90.7	154.4	50.9	0	0	0	0	106.9	H263 D267	H263-S265 PolarHBondContact O-N 3.06Å; S265-D267 PolarHBondContact O-N 2.97Å; S265-D267 VanDerWaalsContact O-N 3.08Å
266	M	52.8	Low	55.8	Low	156 Å²	156	122.3 Å²	122.3	77%	0.768	62%	0.622	S	S	*	*			trans	-61	115.1	170.1	-137.7	171.5	-176.8	0	0	104.6	L264 L268	L264-M266 PolarHBondContact O-N 3.1Å; M266-L268 WeakPolarHBondContact O-CD1 3.32Å; M266-L268 PolarHBondContact O-N 3.34Å
267	D	66.8	Low	57.7	Low	101 Å²	101	121.6 Å²	121.6	54%	0.54	62%	0.616	S	S	.	*			trans	-58.7	108.2	171.2	-176.8	5.3	0	0	0	106.5	S265 T269 P270	S265-D267 PolarHBondContact O-N 2.97Å; S265-D267 VanDerWaalsContact O-N 3.08Å; D267-T269 PolarHBondContact O-N 2.8Å; D267-T269 WeakPolarHBondContact OD1-CB 3.38Å; D267-T269 PolarHBondContact OD1-N 3.19Å; D267-T269 PolarHBondContact OD1-OG1 3.14Å; D267-P270 WeakPolarHBondContact O-CD 3.48Å; D267-P270 WeakPolarHBondContact O-CG 3.37Å
268	L	75.4	Confident	59.5	Low	125 Å²	125	121.6 Å²	121.6	65%	0.654	61%	0.611	S	S	*	*	S	Bend	trans	-75.7	-8.3	177.2	-79.8	104.3	0	0	0	111.1	M266 V271 F272	M266-L268 WeakPolarHBondContact O-CD1 3.32Å; M266-L268 PolarHBondContact O-N 3.34Å; L268-V271 PolarHBondContact O-N 3.37Å; L268-V271 VanDerWaalsContact O-N 3.15Å; L268-F272 WeakPolarHBondContact O-CB 3.48Å; L268-F272 PolarHBondContact O-N 3.45Å
269	T	79.7	Confident	61.1	Low	71 Å²	71	119.4 Å²	119.4	44%	0.436	61%	0.609	S	S	.	*	H	α-helix	trans	-54.3	-48.5	177.6	-50	0	0	0	0	112.8	D267 V271 F272 R273	D267-T269 PolarHBondContact O-N 2.8Å; D267-T269 WeakPolarHBondContact OD1-CB 3.38Å; D267-T269 PolarHBondContact OD1-N 3.19Å; D267-T269 PolarHBondContact OD1-OG1 3.14Å; T269-V271 PolarHBondContact O-N 2.88Å; T269-F272 PolarHBondContact O-N 3.34Å; T269-R273 VanDerWaalsContact O-CB 3.29Å; T269-R273 WeakPolarHBondContact O-CB 3.5Å; T269-R273 PolarHBondContact O-N 3.48Å
270	P	77.5	Confident	62.2	Low	78 Å²	78	123 Å²	123	51%	0.506	60%	0.604	S	S	.	*	H	α-helix	trans	-63	-38.3	174.7	21.8	-34.9	0	0	0	113.3	D267 R273 S274	D267-P270 WeakPolarHBondContact O-CD 3.48Å; D267-P270 WeakPolarHBondContact O-CG 3.37Å; P270-R273 PolarHBondContact O-N 2.82Å; P270-S274 WeakPolarHBondContact O-CB 3.33Å; P270-S274 PolarHBondContact O-N 3.48Å
271	V	76.9	Confident	63	Low	76 Å²	76	121.8 Å²	121.8	46%	0.461	61%	0.607	S	S	.	*	H	α-helix	trans	-66	-46	177.4	-179.4	0	0	0	0	110.5	L268 T269 R273 S274 I275	L268-V271 PolarHBondContact O-N 3.37Å; L268-V271 VanDerWaalsContact O-N 3.15Å; T269-V271 PolarHBondContact O-N 2.88Å; V271-R273 PolarHBondContact O-N 3.23Å; V271-S274 PolarHBondContact O-N 3.45Å; V271-I275 HydrophobicContact CG1-CD1 3.95Å; V271-I275 VanDerWaalsContact O-CG1 3.29Å; V271-I275 WeakPolarHBondContact O-CG1 3.11Å; V271-I275 PolarHBondContact O-N 2.79Å
272	F	77.5	Confident	63.8	Low	150 Å²	150	119.2 Å²	119.2	66%	0.658	61%	0.608	S	S	*	*	H	α-helix	trans	-60.5	-44.9	175.3	176.1	-96.7	0	0	0	111.4	L268 T269 I275 A276	L268-F272 WeakPolarHBondContact O-CB 3.48Å; L268-F272 PolarHBondContact O-N 3.45Å; T269-F272 PolarHBondContact O-N 3.34Å; F272-I275 PolarHBondContact O-N 3.14Å; F272-A276 VanDerWaalsContact O-CB 3.29Å; F272-A276 WeakPolarHBondContact O-CB 3.33Å; F272-A276 PolarHBondContact O-N 3.44Å
273	R	77.5	Confident	64.4	Low	151 Å²	151	120 Å²	120	57%	0.57	62%	0.622	S	S	*	*	H	α-helix	trans	-64.4	-42.4	178.7	-159	-175	-66.4	-169.6	0.3	111.1	T269 P270 V271 A276 E277	T269-R273 VanDerWaalsContact O-CB 3.29Å; T269-R273 WeakPolarHBondContact O-CB 3.5Å; T269-R273 PolarHBondContact O-N 3.48Å; P270-R273 PolarHBondContact O-N 2.82Å; V271-R273 PolarHBondContact O-N 3.23Å; R273-A276 PolarHBondContact O-N 3.03Å; R273-E277 WeakPolarHBondContact O-CB 3.37Å; R273-E277 VanDerWaalsContact O-CG 3.3Å; R273-E277 WeakPolarHBondContact O-CG 3.43Å; R273-E277 PolarHBondContact O-N 3.26Å
274	S	75.8	Confident	64.8	Low	69 Å²	69	121.5 Å²	121.5	48%	0.483	62%	0.621	S	S	.	*	H	α-helix	trans	-64.9	-40.2	177	-162.7	0	0	0	0	112.3	P270 V271 E277 Q278	P270-S274 WeakPolarHBondContact O-CB 3.33Å; P270-S274 PolarHBondContact O-N 3.48Å; V271-S274 PolarHBondContact O-N 3.45Å; S274-E277 PolarHBondContact O-N 3.02Å; S274-Q278 VanDerWaalsContact O-CB 3.26Å; S274-Q278 WeakPolarHBondContact O-CB 3.35Å; S274-Q278 PolarHBondContact O-N 2.85Å
275	I	76.9	Confident	64.8	Low	85 Å²	85	120.2 Å²	120.2	44%	0.436	62%	0.62	S	S	.	*	H	α-helix	trans	-66	-44.1	174.4	-67.3	167.3	0	0	0	110.2	V271 F272 E277 Q278 Q279	V271-I275 HydrophobicContact CG1-CD1 3.95Å; V271-I275 VanDerWaalsContact O-CG1 3.29Å; V271-I275 WeakPolarHBondContact O-CG1 3.11Å; V271-I275 PolarHBondContact O-N 2.79Å; F272-I275 PolarHBondContact O-N 3.14Å; I275-E277 VanDerWaalsContact C-N 3.33Å; I275-E277 PolarHBondContact O-N 3.29Å; I275-Q278 PolarHBondContact O-N 3.08Å; I275-Q279 WeakPolarHBondContact O-CB 3.11Å; I275-Q279 PolarHBondContact O-N 2.98Å
276	A	74.5	Confident	64.5	Low	38 Å²	38	121.5 Å²	121.5	31%	0.314	62%	0.616	S	S	.	*	H	α-helix	trans	-61.6	-40.5	177.2	0	0	0	0	0	111.8	F272 R273 Y280	F272-A276 VanDerWaalsContact O-CB 3.29Å; F272-A276 WeakPolarHBondContact O-CB 3.33Å; F272-A276 PolarHBondContact O-N 3.44Å; R273-A276 PolarHBondContact O-N 3.03Å; A276-Y280 WeakPolarHBondContact O-CD2 3.34Å
277	E	74	Confident	63.8	Low	125 Å²	125	121.8 Å²	121.8	58%	0.584	61%	0.613	S	S	*	*	H	α-helix	trans	-69	-37	175.6	-74.2	169.1	-174.4	0	0	111.9	R273 S274 I275 Q279 Y280	R273-E277 WeakPolarHBondContact O-CB 3.37Å; R273-E277 VanDerWaalsContact O-CG 3.3Å; R273-E277 WeakPolarHBondContact O-CG 3.43Å; R273-E277 PolarHBondContact O-N 3.26Å; S274-E277 PolarHBondContact O-N 3.02Å; I275-E277 VanDerWaalsContact C-N 3.33Å; I275-E277 PolarHBondContact O-N 3.29Å; E277-Q279 PolarHBondContact O-N 3.11Å; E277-Y280 CarbonylContact O-C 3.57Å; E277-Y280 PolarHBondContact O-N 3.22Å
278	Q	69.6	Low	62.5	Low	157 Å²	157	122.5 Å²	122.5	73%	0.734	63%	0.626	S	S	*	*	H	α-helix	trans	-72.5	-27.9	-179.7	-159.5	172.5	22.3	0	0	113.2	S274 I275 Y280	S274-Q278 VanDerWaalsContact O-CB 3.26Å; S274-Q278 WeakPolarHBondContact O-CB 3.35Å; S274-Q278 PolarHBondContact O-N 2.85Å; I275-Q278 PolarHBondContact O-N 3.08Å; Q278-Y280 VanDerWaalsContact C-N 3.33Å
279	Q	63.3	Low	60.7	Low	141 Å²	141	124.1 Å²	124.1	66%	0.659	63%	0.63	S	S	*	*	H	α-helix	trans	-83.7	-10.9	179	-134.2	152.4	-0.8	0	0	113.2	I275 E277	I275-Q279 WeakPolarHBondContact O-CB 3.11Å; I275-Q279 PolarHBondContact O-N 2.98Å; E277-Q279 PolarHBondContact O-N 3.11Å
280	Y	57.8	Low	58.5	Low	169 Å²	169	125.1 Å²	125.1	66%	0.663	65%	0.645	S	S	*	*	S	Bend	trans	-138.1	81.5	178.1	-61.2	-79.1	0	0	0	110.7	A276 E277 Q278 N282	A276-Y280 WeakPolarHBondContact O-CD2 3.34Å; E277-Y280 CarbonylContact O-C 3.57Å; E277-Y280 PolarHBondContact O-N 3.22Å; Q278-Y280 VanDerWaalsContact C-N 3.33Å; Y280-N282 PolarHBondContact O-N 3.39Å
281	P	49.3	Very low	56.5	Low	102 Å²	102	130.5 Å²	130.5	66%	0.662	66%	0.661	S	S	*	*			trans	-68.8	105.9	171.4	5.6	7.8	0	0	0	109.1	D283	P281-D283 PolarHBondContact O-N 3.44Å
282	N	52.4	Low	54.3	Low	162 Å²	162	131.1 Å²	131.1	87%	0.866	67%	0.669	S	S	*	*	S	Bend	trans	58.3	8.9	152.5	-61.9	-26.8	0	0	0	121.8	Y280	Y280-N282 PolarHBondContact O-N 3.39Å
283	D	48.3	Very low	52.4	Low	156 Å²	156	129.4 Å²	129.4	83%	0.834	67%	0.673	S	S	*	*			trans	-122.6	18.9	-175.5	-106.9	-6.8	0	0	0	117	P281 P285	P281-D283 PolarHBondContact O-N 3.44Å; D283-P285 WeakPolarHBondContact O-CD 3.43Å
284	W	45.4	Very low	50.6	Low	203 Å²	203	127.9 Å²	127.9	77%	0.769	68%	0.68	S	S	*	*			trans	-80.8	120.2	163.8	-165.4	-96	0	0	0	108.9	I286	W284-I286 PolarHBondContact O-N 3.47Å
285	P	42.1	Very low	49.2	Very low	97 Å²	97	130 Å²	130	63%	0.63	69%	0.69	S	S	*	*			trans	-68.6	89.3	164.5	30	-29.2	0	0	0	105.7	D283 K287	D283-P285 WeakPolarHBondContact O-CD 3.43Å; P285-K287 PolarHBondContact O-N 3.24Å
286	I	41.4	Very low	47.9	Very low	139 Å²	139	135.1 Å²	135.1	71%	0.713	71%	0.71	S	S	*	*			trans	-63.4	82.5	150.7	-54.3	176.5	0	0	0	103	W284 S288	W284-I286 PolarHBondContact O-N 3.47Å; I286-S288 PolarHBondContact O-N 3.28Å
287	K	37.2	Very low	47.1	Very low	163 Å²	163	137.2 Å²	137.2	71%	0.709	72%	0.715	S	S	*	*			trans	-56.2	99.3	152.1	-81.9	-172.1	176	-174.8	0	103.5	P285 E289 A290	P285-K287 PolarHBondContact O-N 3.24Å; K287-E289 PolarHBondContact O-N 2.84Å; K287-A290 PolarHBondContact O-N 3.49Å
288	S	39.9	Very low	46.5	Very low	115 Å²	115	134.1 Å²	134.1	80%	0.804	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.6	18.4	169.1	50	0	0	0	0	112.4	I286	I286-S288 PolarHBondContact O-N 3.28Å
289	E	37.4	Very low	46.4	Very low	160 Å²	160	131.1 Å²	131.1	75%	0.748	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.1	15.6	178.6	-69.7	-169.7	143.9	0	0	113.2	K287 K291	K287-E289 PolarHBondContact O-N 2.84Å; E289-K291 PolarHBondContact O-N 3.25Å
290	A	34.5	Very low	46.7	Very low	91 Å²	91	127.8 Å²	127.8	75%	0.752	69%	0.692	S	S	*	*			trans	-69.8	78.3	156.5	0	0	0	0	0	108.1	K287 S292	K287-A290 PolarHBondContact O-N 3.49Å; A290-S292 PolarHBondContact O-N 3.45Å
291	K	35.4	Very low	47.3	Very low	191 Å²	191	119.9 Å²	119.9	83%	0.83	66%	0.661	S	S	*	*			trans	-39.3	116.7	160.5	-84.4	174	177.1	169	0	106.2	E289 P293	E289-K291 PolarHBondContact O-N 3.25Å; K291-P293 VanDerWaalsContact O-N 3.15Å
292	S	30.5	Very low	48.6	Very low	90 Å²	90	118.7 Å²	118.7	63%	0.629	65%	0.652	S	S	*	*			trans	-36.5	124.8	168.9	41.4	0	0	0	0	107.7	A290 T294	A290-S292 PolarHBondContact O-N 3.45Å; S292-T294 VanDerWaalsContact C-N 3.27Å; S292-T294 PolarHBondContact O-N 2.94Å
293	P	37.6	Very low	49.9	Very low	114 Å²	114	114.6 Å²	114.6	74%	0.74	63%	0.633	S	S	*	*			trans	-60.2	99.9	-175.7	24	-31	0	0	0	106.4	K291 T295	K291-P293 VanDerWaalsContact O-N 3.15Å; P293-T295 PolarHBondContact O-N 3.33Å; P293-T295 PolarHBondContact O-OG1 3.3Å
294	T	40.3	Very low	51.4	Low	118 Å²	118	107.7 Å²	107.7	72%	0.724	60%	0.595	S	S	*	*			trans	-73.2	69.3	170.5	45.3	0	0	0	0	105.6	S292 K296	S292-T294 VanDerWaalsContact C-N 3.27Å; S292-T294 PolarHBondContact O-N 2.94Å; T294-K296 PolarHBondContact O-N 3.47Å
295	T	45.3	Very low	53.1	Low	114 Å²	114	100.4 Å²	100.4	70%	0.699	58%	0.575	S	S	*	*			trans	-68.5	89	168.2	-41.3	0	0	0	0	104.6	P293 L297	P293-T295 PolarHBondContact O-N 3.33Å; P293-T295 PolarHBondContact O-OG1 3.3Å; T295-L297 PolarHBondContact O-N 3.33Å
296	K	50.9	Low	55.2	Low	193 Å²	193	103.6 Å²	103.6	84%	0.839	58%	0.579	S	S	*	*			trans	-53	104.9	173.3	-71.5	-175.6	179.1	179.8	0	106.4	T294	T294-K296 PolarHBondContact O-N 3.47Å
297	L	56.2	Low	57.3	Low	82 Å²	82	100.6 Å²	100.6	43%	0.429	56%	0.562	S	S	.	*			trans	-58.5	134.5	179.6	-146.5	73.4	0	0	0	107.1	T295 S299 A301 V302	T295-L297 PolarHBondContact O-N 3.33Å; L297-S299 PolarHBondContact O-N 2.86Å; L297-A301 HydrophobicContact CD2-CB 3.95Å; L297-A301 HydrophobicContact CG-CB 3.95Å; L297-V302 HydrophobicContact CB-CG2 3.89Å; L297-V302 HydrophobicContact CD2-CG2 4.16Å
298	P	62.6	Low	59.7	Low	60 Å²	60	94 Å²	94	39%	0.39	54%	0.535	S	S	.	.			trans	-49.3	136.7	177.5	-25.2	31.6	0	0	0	109.9	T300 A301 V302	P298-T300 PolarHBondContact O-N 2.97Å; P298-A301 HydrophobicContact CB-CB 4.43Å; P298-A301 WeakPolarHBondContact O-CA 3.27Å; P298-A301 WeakPolarHBondContact O-CB 3.44Å; P298-A301 PolarHBondContact O-N 3.2Å; P298-V302 PolarHBondContact O-N 2.96Å
299	S	66.9	Low	62	Low	94 Å²	94	93.1 Å²	93.1	66%	0.657	52%	0.524	S	S	*	.	H	α-helix	trans	-52.8	-33.3	-177.4	57.5	0	0	0	0	112.1	L297 V302 V303	L297-S299 PolarHBondContact O-N 2.86Å; S299-V302 PolarHBondContact O-N 3.34Å; S299-V303 VanDerWaalsContact O-CG2 3.3Å; S299-V303 WeakPolarHBondContact O-CG2 3.42Å; S299-V303 PolarHBondContact O-N 3.41Å
300	T	69.7	Low	64.4	Low	71 Å²	71	88.5 Å²	88.5	44%	0.436	51%	0.51	S	S	.	.	H	α-helix	trans	-62	-39.4	173.5	51.4	0	0	0	0	113.4	P298 F304	P298-T300 PolarHBondContact O-N 2.97Å; T300-F304 VanDerWaalsContact O-CB 3.25Å; T300-F304 WeakPolarHBondContact O-CB 3.41Å; T300-F304 PolarHBondContact O-N 3.06Å
301	A	70.8	Confident	67.1	Low	3 Å²	3	84.4 Å²	84.4	3%	0.025	48%	0.475	C	S	.	.	H	α-helix	trans	-73.3	-33.1	177.1	0	0	0	0	0	112.7	L297 P298 S305 V375 R382	L297-A301 HydrophobicContact CD2-CB 3.95Å; L297-A301 HydrophobicContact CG-CB 3.95Å; P298-A301 HydrophobicContact CB-CB 4.43Å; P298-A301 WeakPolarHBondContact O-CA 3.27Å; P298-A301 WeakPolarHBondContact O-CB 3.44Å; P298-A301 PolarHBondContact O-N 3.2Å; A301-S305 WeakPolarHBondContact O-CB 3.35Å; A301-S305 PolarHBondContact O-N 3.15Å; A301-S305 PolarHBondContact O-OG 2.97Å; A301-V375 HydrophobicContact CB-CG1 4.26Å; A301-R382 VanDerWaalsContact CB-NH2 3.32Å
302	V	75.1	Confident	69.7	Low	76 Å²	76	77.7 Å²	77.7	46%	0.461	45%	0.45	S	S	.	.	H	α-helix	trans	-67	-43.7	172.4	-178.6	0	0	0	0	110.5	L297 P298 S299 S305 K306	L297-V302 HydrophobicContact CB-CG2 3.89Å; L297-V302 HydrophobicContact CD2-CG2 4.16Å; P298-V302 PolarHBondContact O-N 2.96Å; S299-V302 PolarHBondContact O-N 3.34Å; V302-S305 WeakPolarHBondContact CA-OG 3.28Å; V302-S305 PolarHBondContact O-OG 3.03Å; V302-K306 WeakPolarHBondContact O-CB 3.34Å; V302-K306 PolarHBondContact O-N 2.94Å
303	V	79.6	Confident	72.6	Confident	77 Å²	77	79.3 Å²	79.3	47%	0.467	45%	0.447	S	S	.	.	H	α-helix	trans	-63.3	-44.4	175.3	172.5	0	0	0	0	111	S299 K306 Q307	S299-V303 VanDerWaalsContact O-CG2 3.3Å; S299-V303 WeakPolarHBondContact O-CG2 3.42Å; S299-V303 PolarHBondContact O-N 3.41Å; V303-K306 PolarHBondContact O-N 2.92Å; V303-Q307 WeakPolarHBondContact O-CG 3.38Å; V303-Q307 PolarHBondContact O-N 2.97Å
304	F	81.5	Confident	75	Confident	10 Å²	10	76.9 Å²	76.9	4%	0.044	43%	0.426	C	S	.	.	H	α-helix	trans	-61.8	-47.7	178.7	-175.7	-101.4	0	0	0	112.3	T300 K306 Q307 I308 L368 L371 V375 I386	T300-F304 VanDerWaalsContact O-CB 3.25Å; T300-F304 WeakPolarHBondContact O-CB 3.41Å; T300-F304 PolarHBondContact O-N 3.06Å; F304-K306 VanDerWaalsContact C-N 3.35Å; F304-K306 PolarHBondContact O-N 2.86Å; F304-Q307 PolarHBondContact O-N 2.83Å; F304-I308 HydrophobicContact CD1-CD1 3.71Å; F304-I308 HydrophobicContact CD1-CG1 4.45Å; F304-I308 HydrophobicContact CE1-CD1 3.1Å; F304-I308 HydrophobicContact CE1-CG1 4.08Å; F304-I308 HydrophobicContact CE2-CD1 4.42Å; F304-I308 HydrophobicContact CZ-CD1 3.51Å; F304-I308 HydrophobicContact CZ-CG1 4.2Å; F304-I308 PolarHBondContact O-N 3.04Å; F304-L368 HydrophobicContact CD2-CD2 3.73Å; F304-L368 HydrophobicContact CE2-CB 4.27Å; F304-L368 HydrophobicContact CE2-CD2 3.59Å; F304-L368 HydrophobicContact CZ-CD2 4.37Å; F304-L371 HydrophobicContact CD2-CB 4.34Å; F304-V375 HydrophobicContact CB-CG2 4.14Å; F304-V375 HydrophobicContact CD2-CG2 3.93Å; F304-V375 HydrophobicContact CG-CG2 3.96Å; F304-I386 HydrophobicContact CD1-CD1 4.46Å; F304-I386 HydrophobicContact CE1-CB 4.25Å; F304-I386 HydrophobicContact CE1-CD1 4.12Å; F304-I386 HydrophobicContact CE1-CG1 3.85Å; F304-I386 HydrophobicContact CE1-CG2 3.51Å; F304-I386 HydrophobicContact CE2-CG2 4.37Å; F304-I386 HydrophobicContact CZ-CG2 3.35Å
305	S	80.9	Confident	77.4	Confident	51 Å²	51	71.2 Å²	71.2	36%	0.357	39%	0.392	S	S	.	.	H	α-helix	trans	-62.2	-40.6	176.4	53.9	0	0	0	0	112.1	A301 V302 Q307 I308 T309	A301-S305 WeakPolarHBondContact O-CB 3.35Å; A301-S305 PolarHBondContact O-N 3.15Å; A301-S305 PolarHBondContact O-OG 2.97Å; V302-S305 WeakPolarHBondContact CA-OG 3.28Å; V302-S305 PolarHBondContact O-OG 3.03Å; S305-Q307 PolarHBondContact O-N 3.3Å; S305-I308 PolarHBondContact O-N 3.38Å; S305-T309 PolarHBondContact O-N 3.35Å; S305-T309 PolarHBondContact O-OG1 3Å
306	K	85.8	Confident	79.6	Confident	163 Å²	163	68.5 Å²	68.5	71%	0.709	38%	0.375	S	S	*	.	H	α-helix	trans	-61.4	-42.1	174.7	-172.6	176.2	179.9	178	0	112.4	V302 V303 F304 T309 S310	V302-K306 WeakPolarHBondContact O-CB 3.34Å; V302-K306 PolarHBondContact O-N 2.94Å; V303-K306 PolarHBondContact O-N 2.92Å; F304-K306 VanDerWaalsContact C-N 3.35Å; F304-K306 PolarHBondContact O-N 2.86Å; K306-T309 PolarHBondContact O-N 2.85Å; K306-S310 PolarHBondContact O-N 2.77Å
307	Q	85.7	Confident	81.5	Confident	76 Å²	76	64.6 Å²	64.6	36%	0.355	36%	0.36	S	S	.	.	H	α-helix	trans	-66.6	-40.7	176.7	-72.5	179.3	5.1	0	0	112.1	V303 F304 S305 S310 L311 L368	V303-Q307 WeakPolarHBondContact O-CG 3.38Å; V303-Q307 PolarHBondContact O-N 2.97Å; F304-Q307 PolarHBondContact O-N 2.83Å; S305-Q307 PolarHBondContact O-N 3.3Å; Q307-S310 PolarHBondContact O-N 3.41Å; Q307-L311 WeakPolarHBondContact O-CB 3.04Å; Q307-L311 PolarHBondContact O-N 2.86Å; Q307-L368 HydrophobicContact CB-CD2 3.67Å
308	I	86.7	Confident	83.1	Confident	26 Å²	26	61.1 Å²	61.1	13%	0.133	34%	0.341	C	S	.	.	H	α-helix	trans	-59.1	-48.8	172.6	-75.5	179.2	0	0	0	110.7	F304 S305 S310 L311 V312 L368 V389 L393	F304-I308 HydrophobicContact CD1-CD1 3.71Å; F304-I308 HydrophobicContact CD1-CG1 4.45Å; F304-I308 HydrophobicContact CE1-CD1 3.1Å; F304-I308 HydrophobicContact CE1-CG1 4.08Å; F304-I308 HydrophobicContact CE2-CD1 4.42Å; F304-I308 HydrophobicContact CZ-CD1 3.51Å; F304-I308 HydrophobicContact CZ-CG1 4.2Å; F304-I308 PolarHBondContact O-N 3.04Å; S305-I308 PolarHBondContact O-N 3.38Å; I308-S310 VanDerWaalsContact C-N 3.31Å; I308-S310 PolarHBondContact O-N 3.02Å; I308-L311 PolarHBondContact O-N 3.39Å; I308-V312 HydrophobicContact CG2-CG2 4.25Å; I308-V312 VanDerWaalsContact O-CG2 3.31Å; I308-V312 WeakPolarHBondContact O-CG2 3.41Å; I308-V312 PolarHBondContact O-N 2.99Å; I308-L368 HydrophobicContact CG1-CD1 4.21Å; I308-L368 HydrophobicContact CG1-CD2 4.16Å; I308-V389 HydrophobicContact CD1-CG1 4.05Å; I308-V389 HydrophobicContact CG2-CG1 4.3Å; I308-L393 HydrophobicContact CG2-CD1 4.35Å
309	T	87.9	Confident	84.4	Confident	96 Å²	96	62.4 Å²	62.4	59%	0.589	34%	0.342	S	S	*	.	H	α-helix	trans	-61.7	-40	-179.5	-57.3	0	0	0	0	111.7	S305 K306 V312 H313	S305-T309 PolarHBondContact O-N 3.35Å; S305-T309 PolarHBondContact O-OG1 3Å; K306-T309 PolarHBondContact O-N 2.85Å; T309-V312 PolarHBondContact O-N 3.38Å; T309-H313 PolarHBondContact O-N 3.4Å
310	S	89.1	Confident	85.5	Confident	63 Å²	63	60.8 Å²	60.8	44%	0.441	33%	0.328	S	S	.	.	H	α-helix	trans	-60.5	-46.7	174	-165.2	0	0	0	0	111.7	K306 Q307 I308 V312 H313 E314	K306-S310 PolarHBondContact O-N 2.77Å; Q307-S310 PolarHBondContact O-N 3.41Å; I308-S310 VanDerWaalsContact C-N 3.31Å; I308-S310 PolarHBondContact O-N 3.02Å; S310-V312 PolarHBondContact O-N 3.13Å; S310-H313 WeakPolarHBondContact O-CB 3.49Å; S310-H313 PolarHBondContact O-N 2.85Å; S310-E314 PolarHBondContact O-N 3.39Å
311	L	90.2	Very high	86.4	Confident	4 Å²	4	59.2 Å²	59.2	2%	0.021	32%	0.315	C	S	.	.	H	α-helix	trans	-66	-38.2	179.4	-178.7	61.7	0	0	0	112.3	Q307 I308 H313 E314 L315 C361 A364 L365 L368 L393	Q307-L311 WeakPolarHBondContact O-CB 3.04Å; Q307-L311 PolarHBondContact O-N 2.86Å; I308-L311 PolarHBondContact O-N 3.39Å; L311-H313 VanDerWaalsContact C-N 3.29Å; L311-H313 PolarHBondContact O-N 3Å; L311-E314 PolarHBondContact O-N 3.4Å; L311-L315 HydrophobicContact CD1-CG 4.41Å; L311-L315 HydrophobicContact CG-CD1 4.21Å; L311-L315 WeakPolarHBondContact O-CB 3.38Å; L311-L315 WeakPolarHBondContact O-CG 3.46Å; L311-L315 PolarHBondContact O-N 3.18Å; L311-C361 HydrophobicContact CD1-CB 4.04Å; L311-A364 HydrophobicContact CD1-CB 3.99Å; L311-L365 HydrophobicContact CD2-CD2 3.51Å; L311-L365 HydrophobicContact CD2-CG 3.72Å; L311-L368 HydrophobicContact CD2-CD1 3.6Å; L311-L393 HydrophobicContact CD2-CD1 4.19Å
312	V	91.1	Very high	87.1	Confident	50 Å²	50	59.3 Å²	59.3	30%	0.303	32%	0.315	S	S	.	.	H	α-helix	trans	-61.4	-40.5	173.7	170.1	0	0	0	0	111	I308 T309 S310 T316 L393	I308-V312 HydrophobicContact CG2-CG2 4.25Å; I308-V312 VanDerWaalsContact O-CG2 3.31Å; I308-V312 WeakPolarHBondContact O-CG2 3.41Å; I308-V312 PolarHBondContact O-N 2.99Å; T309-V312 PolarHBondContact O-N 3.38Å; S310-V312 PolarHBondContact O-N 3.13Å; V312-T316 WeakPolarHBondContact O-CB 3.24Å; V312-T316 PolarHBondContact O-N 2.62Å; V312-T316 PolarHBondContact O-OG1 3.13Å; V312-L393 HydrophobicContact CG2-CD2 3.62Å
313	H	91	Very high	87.7	Confident	125 Å²	125	63.9 Å²	63.9	58%	0.579	32%	0.324	S	S	*	.	H	α-helix	trans	-63.3	-50.7	175.9	-178.5	-79.9	0	0	0	111.2	T309 S310 L311 L315 T316 E317	T309-H313 PolarHBondContact O-N 3.4Å; S310-H313 WeakPolarHBondContact O-CB 3.49Å; S310-H313 PolarHBondContact O-N 2.85Å; L311-H313 VanDerWaalsContact C-N 3.29Å; L311-H313 PolarHBondContact O-N 3Å; H313-L315 PolarHBondContact O-N 2.78Å; H313-T316 PolarHBondContact O-N 3.08Å; H313-T316 VanDerWaalsContact O-N 3.12Å; H313-E317 IonicContact CE1-OE2 3.93Å; H313-E317 PolarHBondContact O-N 3.05Å
314	E	88.6	Confident	87.9	Confident	62 Å²	62	67 Å²	67	29%	0.29	33%	0.327	S	S	.	.	H	α-helix	trans	-57.6	-44.8	177	-72.7	175.9	-149.6	0	0	112.5	S310 L311 T316 E317 L318	S310-E314 PolarHBondContact O-N 3.39Å; L311-E314 PolarHBondContact O-N 3.4Å; E314-T316 VanDerWaalsContact C-N 3.31Å; E314-T316 PolarHBondContact O-N 2.83Å; E314-E317 PolarHBondContact O-N 2.9Å; E314-L318 WeakPolarHBondContact O-CB 3.39Å; E314-L318 PolarHBondContact O-N 3.33Å
315	L	89.8	Confident	87.9	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-63.2	-37.1	176.3	-75.8	172.1	0	0	0	112.5	L311 H313 E319 C361 L393 L397	L311-L315 HydrophobicContact CD1-CG 4.41Å; L311-L315 HydrophobicContact CG-CD1 4.21Å; L311-L315 WeakPolarHBondContact O-CB 3.38Å; L311-L315 WeakPolarHBondContact O-CG 3.46Å; L311-L315 PolarHBondContact O-N 3.18Å; H313-L315 PolarHBondContact O-N 2.78Å; L315-E319 WeakPolarHBondContact O-CB 3.48Å; L315-E319 PolarHBondContact O-N 3.38Å; L315-C361 HydrophobicContact CD2-CB 4.37Å; L315-L393 HydrophobicContact CD1-CB 4.46Å; L315-L393 HydrophobicContact CD1-CD2 3.85Å; L315-L397 HydrophobicContact CD2-CB 3.96Å; L315-L397 HydrophobicContact CD2-CD1 3.72Å; L315-L397 HydrophobicContact CD2-CG 4.4Å
316	T	91.3	Very high	88.1	Confident	56 Å²	56	70.9 Å²	70.9	34%	0.344	33%	0.334	S	S	.	.	H	α-helix	trans	-71.2	-40.8	178.5	-56.6	0	0	0	0	110.9	V312 H313 E314 E319 T320 R396	V312-T316 WeakPolarHBondContact O-CB 3.24Å; V312-T316 PolarHBondContact O-N 2.62Å; V312-T316 PolarHBondContact O-OG1 3.13Å; H313-T316 PolarHBondContact O-N 3.08Å; H313-T316 VanDerWaalsContact O-N 3.12Å; E314-T316 VanDerWaalsContact C-N 3.31Å; E314-T316 PolarHBondContact O-N 2.83Å; T316-E319 PolarHBondContact O-N 2.9Å; T316-T320 WeakPolarHBondContact O-CG2 3.43Å; T316-T320 PolarHBondContact O-N 2.82Å; T316-T320 PolarHBondContact O-OG1 3.02Å; T316-R396 PolarHBondContact OG1-NH1 3.36Å; T316-R396 PolarHBondContact OG1-NH2 3.45Å
317	E	90.4	Very high	87.8	Confident	112 Å²	112	67.2 Å²	67.2	52%	0.523	32%	0.319	S	S	.	.	H	α-helix	trans	-60.5	-48.3	173.7	-170.7	177.8	172.9	0	0	110.9	H313 E314 E319 T320 Y321	H313-E317 IonicContact CE1-OE2 3.93Å; H313-E317 PolarHBondContact O-N 3.05Å; E314-E317 PolarHBondContact O-N 2.9Å; E317-E319 VanDerWaalsContact C-N 3.3Å; E317-E319 PolarHBondContact O-N 2.97Å; E317-T320 PolarHBondContact O-N 3.07Å; E317-T320 PolarHBondContact O-OG1 2.97Å; E317-Y321 WeakPolarHBondContact O-CB 3.3Å; E317-Y321 PolarHBondContact O-N 2.9Å
318	L	89.5	Confident	87.1	Confident	8 Å²	8	66.2 Å²	66.2	4%	0.042	32%	0.321	C	S	.	.	H	α-helix	trans	-59.4	-39.2	176.1	-176	62.3	0	0	0	112.2	E314 Y321 I322 T354 V357 I358 L400	E314-L318 WeakPolarHBondContact O-CB 3.39Å; E314-L318 PolarHBondContact O-N 3.33Å; L318-Y321 HydrophobicContact CD1-CD1 4.34Å; L318-Y321 PolarHBondContact O-N 3.17Å; L318-I322 HydrophobicContact CD1-CD1 4.08Å; L318-I322 HydrophobicContact CG-CD1 4.04Å; L318-I322 WeakPolarHBondContact O-CG1 3.38Å; L318-I322 PolarHBondContact O-N 3Å; L318-T354 HydrophobicContact CD1-CG2 3.92Å; L318-V357 HydrophobicContact CB-CG1 4.47Å; L318-V357 HydrophobicContact CD1-CB 4.44Å; L318-V357 HydrophobicContact CD1-CG1 4.09Å; L318-V357 HydrophobicContact CD2-CG1 4.18Å; L318-V357 HydrophobicContact CG-CG1 4.47Å; L318-I358 HydrophobicContact CD2-CG1 3.8Å; L318-L400 HydrophobicContact CB-CD2 3.85Å; L318-L400 HydrophobicContact CD2-CD2 3.58Å; L318-L400 HydrophobicContact CD2-CG 4.25Å; L318-L400 HydrophobicContact CG-CD2 3.53Å; L318-L400 HydrophobicContact CG-CG 4.22Å
319	E	90.3	Very high	86.3	Confident	87 Å²	87	65.5 Å²	65.5	41%	0.407	32%	0.318	S	S	.	.	H	α-helix	trans	-64.9	-46.4	175.7	-175.8	175.6	177.4	0	0	112.3	L315 T316 E317 Y321 I322 R323 R396 L400	L315-E319 WeakPolarHBondContact O-CB 3.48Å; L315-E319 PolarHBondContact O-N 3.38Å; T316-E319 PolarHBondContact O-N 2.9Å; E317-E319 VanDerWaalsContact C-N 3.3Å; E317-E319 PolarHBondContact O-N 2.97Å; E319-Y321 VanDerWaalsContact C-N 3.27Å; E319-Y321 PolarHBondContact O-N 3.12Å; E319-I322 PolarHBondContact O-N 3.28Å; E319-R323 WeakPolarHBondContact O-CB 3.19Å; E319-R323 PolarHBondContact O-N 3.3Å; E319-R396 IonicContact OE2-CZ 3.03Å; E319-R396 IonicContact OE2-NE 2.78Å; E319-R396 PolarHBondContact OE2-NE 3.38Å; E319-R396 VanDerWaalsContact OE2-NE 3.16Å; E319-R396 IonicContact OE2-NH2 3Å; E319-R396 PolarHBondContact OE2-NH2 3.12Å; E319-L400 HydrophobicContact CB-CD1 4.17Å; E319-L400 HydrophobicContact CB-CD2 4.16Å; E319-L400 HydrophobicContact CG-CD1 4.37Å
320	T	90.8	Very high	85.5	Confident	61 Å²	61	65 Å²	65	37%	0.374	31%	0.314	S	S	.	.	H	α-helix	trans	-62.3	-38.9	176.3	62.8	0	0	0	0	111.6	T316 E317 R323 R324	T316-T320 WeakPolarHBondContact O-CG2 3.43Å; T316-T320 PolarHBondContact O-N 2.82Å; T316-T320 PolarHBondContact O-OG1 3.02Å; E317-T320 PolarHBondContact O-N 3.07Å; E317-T320 PolarHBondContact O-OG1 2.97Å; T320-R323 PolarHBondContact O-N 3.22Å; T320-R324 WeakPolarHBondContact O-CG 3.43Å; T320-R324 PolarHBondContact O-N 2.87Å
321	Y	88	Confident	84.2	Confident	38 Å²	38	69 Å²	69	15%	0.149	33%	0.326	C	S	.	.	H	α-helix	trans	-63.9	-50.2	176.5	167.9	-95	0	0	0	111.8	M232 E317 L318 E319 R323 R324 Y325 L350 T354	M232-Y321 HydrophobicContact CE-CD2 4.05Å; M232-Y321 HydrophobicContact CE-CE2 3.68Å; M232-Y321 HydrophobicContact SD-CD2 3.82Å; M232-Y321 HydrophobicContact SD-CE2 3.95Å; E317-Y321 WeakPolarHBondContact O-CB 3.3Å; E317-Y321 PolarHBondContact O-N 2.9Å; L318-Y321 HydrophobicContact CD1-CD1 4.34Å; L318-Y321 PolarHBondContact O-N 3.17Å; E319-Y321 VanDerWaalsContact C-N 3.27Å; E319-Y321 PolarHBondContact O-N 3.12Å; Y321-R323 VanDerWaalsContact C-N 3.3Å; Y321-R323 PolarHBondContact O-N 2.89Å; Y321-R324 PolarHBondContact O-N 3.26Å; Y321-Y325 WeakPolarHBondContact O-CB 3.42Å; Y321-Y325 PolarHBondContact O-N 3.46Å; Y321-L350 HydrophobicContact CE2-CD1 4.21Å; Y321-L350 WeakPolarHBondContact OH-CD1 3.33Å; Y321-L350 WeakPolarHBondContact OH-CD2 3.45Å; Y321-L350 WeakPolarHBondContact OH-CG 3.4Å; Y321-T354 HydrophobicContact CE1-CG2 4.25Å; Y321-T354 WeakPolarHBondContact CE1-OG1 3.41Å
322	I	86	Confident	82.9	Confident	4 Å²	4	70.6 Å²	70.6	2%	0.021	34%	0.335	C	S	.	.	H	α-helix	trans	-62.6	-38	177.9	-76	163.8	0	0	0	111.3	L318 E319 Y325 R326 L400 V403 H404	L318-I322 HydrophobicContact CD1-CD1 4.08Å; L318-I322 HydrophobicContact CG-CD1 4.04Å; L318-I322 WeakPolarHBondContact O-CG1 3.38Å; L318-I322 PolarHBondContact O-N 3Å; E319-I322 PolarHBondContact O-N 3.28Å; I322-Y325 PolarHBondContact O-N 3.04Å; I322-R326 WeakPolarHBondContact O-CB 3.43Å; I322-R326 PolarHBondContact O-N 3.42Å; I322-L400 HydrophobicContact CB-CD1 4.01Å; I322-L400 HydrophobicContact CD1-CD1 3.32Å; I322-L400 HydrophobicContact CD1-CD2 4.31Å; I322-L400 HydrophobicContact CD1-CG 3.52Å; I322-L400 HydrophobicContact CG1-CD1 4.22Å; I322-L400 HydrophobicContact CG2-CD1 4.18Å; I322-V403 HydrophobicContact CG2-CG1 3.81Å; I322-H404 HydrophobicContact CD1-CB 3.86Å; I322-H404 HydrophobicContact CG1-CB 4.43Å
323	R	87.2	Confident	81.3	Confident	173 Å²	173	74 Å²	74	65%	0.653	35%	0.351	S	S	*	.	H	α-helix	trans	-63	-47	175.5	-175.6	178.3	176.6	-176.1	-0.5	111.8	E319 T320 Y321 R326 Q327	E319-R323 WeakPolarHBondContact O-CB 3.19Å; E319-R323 PolarHBondContact O-N 3.3Å; T320-R323 PolarHBondContact O-N 3.22Å; Y321-R323 VanDerWaalsContact C-N 3.3Å; Y321-R323 PolarHBondContact O-N 2.89Å; R323-R326 WeakPolarHBondContact O-CB 3.39Å; R323-R326 PolarHBondContact O-N 3.42Å; R323-Q327 WeakPolarHBondContact O-CG 3.47Å; R323-Q327 PolarHBondContact O-N 2.88Å
324	R	84.9	Confident	79.7	Confident	143 Å²	143	70.2 Å²	70.2	54%	0.54	34%	0.339	S	S	.	.	H	α-helix	trans	-63.4	-43.4	176.4	-73.9	177.9	-171.2	170.6	4	111.7	T320 Y321 R326 Q327 S328	T320-R324 WeakPolarHBondContact O-CG 3.43Å; T320-R324 PolarHBondContact O-N 2.87Å; Y321-R324 PolarHBondContact O-N 3.26Å; R324-R326 VanDerWaalsContact C-N 3.3Å; R324-R326 PolarHBondContact O-N 3.23Å; R324-Q327 WeakPolarHBondContact O-CB 3.48Å; R324-Q327 PolarHBondContact O-N 3.15Å; R324-Q327 VanDerWaalsContact O-N 3.12Å; R324-S328 PolarHBondContact O-N 3.33Å; R324-S328 PolarHBondContact O-OG 3.5Å
325	Y	80.8	Confident	78.3	Confident	21 Å²	21	70.7 Å²	70.7	8%	0.082	34%	0.343	C	S	.	.	H	α-helix	trans	-61.3	-39.7	176.8	-178.2	-123.5	0	0	0	111.9	Y321 I322 S328 V329 M342 L350 L407 L411	Y321-Y325 WeakPolarHBondContact O-CB 3.42Å; Y321-Y325 PolarHBondContact O-N 3.46Å; I322-Y325 PolarHBondContact O-N 3.04Å; Y325-S328 PolarHBondContact O-OG 2.99Å; Y325-V329 HydrophobicContact CE2-CG2 4.3Å; Y325-V329 WeakPolarHBondContact O-CB 3.39Å; Y325-V329 WeakPolarHBondContact O-CG2 3.4Å; Y325-V329 PolarHBondContact O-N 3.02Å; Y325-M342 HydrophobicContact CE2-CE 3.7Å; Y325-M342 HydrophobicContact CE2-SD 3.99Å; Y325-M342 WeakPolarHBondContact OH-CE 3.42Å; Y325-L350 HydrophobicContact CD2-CD2 3.96Å; Y325-L350 HydrophobicContact CE2-CD2 3.61Å; Y325-L407 HydrophobicContact CD1-CD2 3.36Å; Y325-L407 HydrophobicContact CD1-CG 4.27Å; Y325-L407 HydrophobicContact CE1-CD2 3.79Å; Y325-L407 HydrophobicContact CE1-CG 4.21Å; Y325-L407 HydrophobicContact CG-CD2 4.3Å; Y325-L411 HydrophobicContact CE1-CD1 3.76Å; Y325-L411 WeakPolarHBondContact OH-CD1 3.18Å
326	R	84	Confident	76.8	Confident	120 Å²	120	78.9 Å²	78.9	45%	0.453	38%	0.375	S	S	.	.	H	α-helix	trans	-62	-45.2	171.8	-176.6	176.1	174.4	166.5	-0.2	111.7	I322 R323 R324 V329 T330 L407	I322-R326 WeakPolarHBondContact O-CB 3.43Å; I322-R326 PolarHBondContact O-N 3.42Å; R323-R326 WeakPolarHBondContact O-CB 3.39Å; R323-R326 PolarHBondContact O-N 3.42Å; R324-R326 VanDerWaalsContact C-N 3.3Å; R324-R326 PolarHBondContact O-N 3.23Å; R326-V329 PolarHBondContact O-N 2.96Å; R326-T330 HydrophobicContact CG-CG2 4.48Å; R326-T330 WeakPolarHBondContact O-CG2 3.24Å; R326-T330 PolarHBondContact O-N 2.76Å; R326-T330 PolarHBondContact O-OG1 2.83Å; R326-T330 VanDerWaalsContact O-OG1 3.07Å; R326-L407 HydrophobicContact CB-CD1 4.37Å; R326-L407 HydrophobicContact CB-CD2 3.92Å; R326-L407 HydrophobicContact CG-CD1 4.23Å
327	Q	81.5	Confident	75.3	Confident	86 Å²	86	79.8 Å²	79.8	40%	0.402	38%	0.378	S	S	.	.	H	α-helix	trans	-61.3	-49.8	179.8	-75.6	173.6	-39.4	0	0	111.9	R323 R324 V329 T330 E331	R323-Q327 WeakPolarHBondContact O-CG 3.47Å; R323-Q327 PolarHBondContact O-N 2.88Å; R324-Q327 WeakPolarHBondContact O-CB 3.48Å; R324-Q327 PolarHBondContact O-N 3.15Å; R324-Q327 VanDerWaalsContact O-N 3.12Å; Q327-V329 PolarHBondContact O-N 3.28Å; Q327-T330 VanDerWaalsContact CA-OG1 3.31Å; Q327-T330 WeakPolarHBondContact CA-OG1 3.31Å; Q327-T330 PolarHBondContact O-N 3.19Å; Q327-T330 PolarHBondContact O-OG1 2.76Å; Q327-E331 WeakPolarHBondContact O-CG 3.46Å; Q327-E331 PolarHBondContact O-N 3.36Å
328	S	70.4	Confident	73.8	Confident	56 Å²	56	74.9 Å²	74.9	39%	0.392	36%	0.355	S	S	.	.	H	α-helix	trans	-59.5	-31.3	178.1	60.9	0	0	0	0	112.4	R324 Y325 L332	R324-S328 PolarHBondContact O-N 3.33Å; R324-S328 PolarHBondContact O-OG 3.5Å; Y325-S328 PolarHBondContact O-OG 2.99Å; S328-L332 WeakPolarHBondContact O-CD1 3.43Å
329	V	69.5	Low	72.3	Confident	11 Å²	11	76.3 Å²	76.3	7%	0.067	37%	0.371	C	S	.	.	H	α-helix	trans	-78.3	-33.4	176.5	167.9	0	0	0	0	112.4	Y325 R326 Q327 L407 L411	Y325-V329 HydrophobicContact CE2-CG2 4.3Å; Y325-V329 WeakPolarHBondContact O-CB 3.39Å; Y325-V329 WeakPolarHBondContact O-CG2 3.4Å; Y325-V329 PolarHBondContact O-N 3.02Å; R326-V329 PolarHBondContact O-N 2.96Å; Q327-V329 PolarHBondContact O-N 3.28Å; V329-L407 HydrophobicContact CG1-CD1 4.43Å; V329-L411 HydrophobicContact CB-CD2 4.16Å; V329-L411 HydrophobicContact CG1-CD2 3.28Å; V329-L411 HydrophobicContact CG1-CG 4.02Å; V329-L411 HydrophobicContact CG2-CD1 4.09Å; V329-L411 HydrophobicContact CG2-CD2 3.73Å; V329-L411 HydrophobicContact CG2-CG 4.37Å
330	T	70.3	Confident	70.9	Confident	84 Å²	84	75.9 Å²	75.9	52%	0.515	38%	0.382	S	S	.	.	H	α-helix	trans	-77.3	-27.4	179.1	46.7	0	0	0	0	113.7	R326 Q327 L332	R326-T330 HydrophobicContact CG-CG2 4.48Å; R326-T330 WeakPolarHBondContact O-CG2 3.24Å; R326-T330 PolarHBondContact O-N 2.76Å; R326-T330 PolarHBondContact O-OG1 2.83Å; R326-T330 VanDerWaalsContact O-OG1 3.07Å; Q327-T330 VanDerWaalsContact CA-OG1 3.31Å; Q327-T330 WeakPolarHBondContact CA-OG1 3.31Å; Q327-T330 PolarHBondContact O-N 3.19Å; Q327-T330 PolarHBondContact O-OG1 2.76Å; T330-L332 PolarHBondContact O-N 2.72Å
331	E	63.4	Low	69.3	Low	147 Å²	147	76 Å²	76	69%	0.687	39%	0.39	S	S	*	.	S	Bend	trans	-71.3	-17.6	176.6	-74.6	169.8	-168.9	0	0	112.9	Q327 D333	Q327-E331 WeakPolarHBondContact O-CG 3.46Å; Q327-E331 PolarHBondContact O-N 3.36Å; E331-D333 PolarHBondContact O-N 3.34Å
332	L	63.2	Low	68.2	Low	39 Å²	39	75.5 Å²	75.5	20%	0.204	39%	0.389	C	S	.	.			trans	-77.5	105.6	174.3	-99.4	68.8	0	0	0	111.2	S328 T330 D337 L338 A341	S328-L332 WeakPolarHBondContact O-CD1 3.43Å; T330-L332 PolarHBondContact O-N 2.72Å; L332-D337 HydrophobicContact CD2-CB 4.09Å; L332-D337 WeakPolarHBondContact CD2-O 3.49Å; L332-D337 HydrophobicContact CG-CB 3.87Å; L332-L338 HydrophobicContact CB-CD1 4.36Å; L332-L338 HydrophobicContact CD2-CB 3.89Å; L332-L338 HydrophobicContact CD2-CD1 3.49Å; L332-L338 VanDerWaalsContact CD2-CD1 3.49Å; L332-L338 HydrophobicContact CD2-CG 4.25Å; L332-L338 VanDerWaalsContact CD2-N 3.31Å; L332-A341 HydrophobicContact CD1-CB 4.13Å; L332-A341 HydrophobicContact CD2-CB 3.6Å; L332-A341 HydrophobicContact CG-CB 4.45Å
333	D	57.1	Low	67.2	Low	121 Å²	121	78.2 Å²	78.2	65%	0.647	41%	0.406	S	S	*	.			trans	-81.2	-28.7	-178.8	-92.5	-35.9	0	0	0	113.6	K112 E331	K112-D333 IonicContact NZ-OD1 2.71Å; K112-D333 PolarHBondContact NZ-OD1 3.19Å; E331-D333 PolarHBondContact O-N 3.34Å
334	S	57.5	Low	66.2	Low	46 Å²	46	72.8 Å²	72.8	32%	0.322	39%	0.386	S	S	.	.	S	Bend	trans	-107	143.8	179.3	92.3	0	0	0	0	113	Y336 D337 L338	S334-Y336 PolarHBondContact O-N 2.83Å; S334-Y336 PolarHBondContact OG-N 2.61Å; S334-D337 WeakPolarHBondContact CB-OD2 3.41Å; S334-D337 PolarHBondContact O-N 3.45Å; S334-D337 PolarHBondContact OG-N 3.43Å; S334-D337 PolarHBondContact OG-OD2 2.7Å; S334-L338 PolarHBondContact O-N 2.84Å
335	L	59.2	Low	65.3	Low	71 Å²	71	70 Å²	70	37%	0.372	39%	0.388	S	S	.	.	H	α-helix	trans	-58	-30.7	172.8	-126	85.4	0	0	0	111.2	L338 D417 V418	L335-L338 WeakPolarHBondContact O-CB 3.19Å; L335-L338 PolarHBondContact O-N 2.68Å; L335-D417 HydrophobicContact CD2-CB 4.15Å; L335-V418 HydrophobicContact CB-CG2 3.76Å; L335-V418 VanDerWaalsContact CD2-CA 3.46Å; L335-V418 HydrophobicContact CD2-CB 4Å; L335-V418 HydrophobicContact CD2-CG2 3.41Å; L335-V418 VanDerWaalsContact CD2-CG2 3.41Å; L335-V418 VanDerWaalsContact CD2-N 3.27Å; L335-V418 HydrophobicContact CG-CB 4.39Å; L335-V418 HydrophobicContact CG-CG2 3.3Å; L335-V418 WeakPolarHBondContact O-CG2 3.43Å
336	Y	56.9	Low	64.8	Low	173 Å²	173	73.3 Å²	73.3	68%	0.678	40%	0.404	S	S	*	.	H	α-helix	trans	-70.6	-42.9	179.5	-171.6	-97.5	0	0	0	111.9	S334 L338 G339 A340	S334-Y336 PolarHBondContact O-N 2.83Å; S334-Y336 PolarHBondContact OG-N 2.61Å; Y336-L338 PolarHBondContact O-N 2.75Å; Y336-G339 PolarHBondContact O-N 3.46Å; Y336-G339 VanDerWaalsContact O-N 3.11Å; Y336-A340 PolarHBondContact O-N 3.28Å
337	D	60.3	Low	64.2	Low	75 Å²	75	69.3 Å²	69.3	40%	0.401	39%	0.389	S	S	.	.	H	α-helix	trans	-62.1	-29.5	177.3	-61	-37.2	0	0	0	111.4	L332 S334 G339 A340 A341	L332-D337 HydrophobicContact CD2-CB 4.09Å; L332-D337 WeakPolarHBondContact CD2-O 3.49Å; L332-D337 HydrophobicContact CG-CB 3.87Å; S334-D337 WeakPolarHBondContact CB-OD2 3.41Å; S334-D337 PolarHBondContact O-N 3.45Å; S334-D337 PolarHBondContact OG-N 3.43Å; S334-D337 PolarHBondContact OG-OD2 2.7Å; D337-G339 VanDerWaalsContact C-N 3.34Å; D337-G339 PolarHBondContact O-N 3.32Å; D337-A340 PolarHBondContact O-N 3.06Å; D337-A340 VanDerWaalsContact O-N 3.14Å; D337-A341 VanDerWaalsContact O-CB 3.28Å; D337-A341 WeakPolarHBondContact O-CB 3.4Å; D337-A341 PolarHBondContact O-N 3.38Å
338	L	59.4	Low	63.6	Low	9 Å²	9	67.2 Å²	67.2	5%	0.047	38%	0.382	C	S	.	.	H	α-helix	trans	-64.3	-37.5	177	-158.1	69	0	0	0	112.8	L332 S334 L335 Y336 L411 R414 F415	L332-L338 HydrophobicContact CB-CD1 4.36Å; L332-L338 HydrophobicContact CD2-CB 3.89Å; L332-L338 HydrophobicContact CD2-CD1 3.49Å; L332-L338 VanDerWaalsContact CD2-CD1 3.49Å; L332-L338 HydrophobicContact CD2-CG 4.25Å; L332-L338 VanDerWaalsContact CD2-N 3.31Å; S334-L338 PolarHBondContact O-N 2.84Å; L335-L338 WeakPolarHBondContact O-CB 3.19Å; L335-L338 PolarHBondContact O-N 2.68Å; Y336-L338 PolarHBondContact O-N 2.75Å; L338-L411 HydrophobicContact CD1-CD2 4.15Å; L338-L411 HydrophobicContact CD2-CD2 4.43Å; L338-R414 HydrophobicContact CD2-CB 3.58Å; L338-F415 HydrophobicContact CB-CE1 4.16Å; L338-F415 HydrophobicContact CB-CZ 4.45Å; L338-F415 HydrophobicContact CD1-CZ 4.2Å; L338-F415 HydrophobicContact CD2-CD1 4.22Å; L338-F415 HydrophobicContact CD2-CD2 4.37Å; L338-F415 HydrophobicContact CD2-CE1 3.97Å; L338-F415 HydrophobicContact CD2-CE2 4.11Å; L338-F415 HydrophobicContact CD2-CG 4.4Å; L338-F415 HydrophobicContact CD2-CZ 3.92Å; L338-F415 HydrophobicContact CG-CD1 4.33Å; L338-F415 HydrophobicContact CG-CE1 3.61Å; L338-F415 HydrophobicContact CG-CE2 4.11Å; L338-F415 HydrophobicContact CG-CZ 3.49Å; L338-F415 VanDerWaalsContact CG-CZ 3.49Å; L338-F415 WeakPolarHBondContact O-CE1 3.48Å; L338-F415 WeakPolarHBondContact O-CZ 3.34Å
339	G	58.4	Low	63.9	Low	37 Å²	37	71.6 Å²	71.6	38%	0.381	39%	0.39	S	S	.	.	H	α-helix	trans	-68.9	-33.9	172.4	0	0	0	0	0	113.2	Y336 D337	Y336-G339 PolarHBondContact O-N 3.46Å; Y336-G339 VanDerWaalsContact O-N 3.11Å; D337-G339 VanDerWaalsContact C-N 3.34Å; D337-G339 PolarHBondContact O-N 3.32Å
340	A	59.5	Low	64.3	Low	78 Å²	78	72.4 Å²	72.4	65%	0.645	39%	0.394	S	S	*	.	H	α-helix	trans	-80.4	-35.4	-178.8	0	0	0	0	0	113.4	Y336 D337	Y336-A340 PolarHBondContact O-N 3.28Å; D337-A340 PolarHBondContact O-N 3.06Å; D337-A340 VanDerWaalsContact O-N 3.14Å
341	A	58.8	Low	64.7	Low	65 Å²	65	68.6 Å²	68.6	54%	0.537	37%	0.371	S	S	.	.	H	α-helix	trans	-75.2	-25.4	-174.6	0	0	0	0	0	114	L332 D337	L332-A341 HydrophobicContact CD1-CB 4.13Å; L332-A341 HydrophobicContact CD2-CB 3.6Å; L332-A341 HydrophobicContact CG-CB 4.45Å; D337-A341 VanDerWaalsContact O-CB 3.28Å; D337-A341 WeakPolarHBondContact O-CB 3.4Å; D337-A341 PolarHBondContact O-N 3.38Å
342	M	63.4	Low	65.4	Low	26 Å²	26	67.2 Å²	67.2	13%	0.128	36%	0.364	C	S	.	.	S	Bend	trans	-152	111.3	178.1	-167.3	174.5	48.1	0	0	110.4	Y325 E346 R347 L350	Y325-M342 HydrophobicContact CE2-CE 3.7Å; Y325-M342 HydrophobicContact CE2-SD 3.99Å; Y325-M342 WeakPolarHBondContact OH-CE 3.42Å; M342-E346 HydrophobicContact CG-CB 3.86Å; M342-R347 HydrophobicContact CB-CG 4.33Å; M342-R347 HydrophobicContact CE-CB 4.04Å; M342-R347 HydrophobicContact CE-CG 3.29Å; M342-R347 HydrophobicContact CG-CG 3.68Å; M342-R347 PolarHBondContact O-NH1 3.14Å; M342-R347 HydrophobicContact SD-CB 4.35Å; M342-R347 HydrophobicContact SD-CG 3.76Å; M342-L350 HydrophobicContact SD-CD2 3.81Å
343	T	65.9	Low	66.4	Low	62 Å²	62	68.6 Å²	68.6	38%	0.38	37%	0.371	S	S	.	.			trans	-61.3	151.8	177.7	63.3	0	0	0	0	110.3	S345 E346 R347	T343-S345 PolarHBondContact O-N 3.37Å; T343-S345 PolarHBondContact OG1-OG 3.04Å; T343-E346 WeakPolarHBondContact CB-OE2 3.41Å; T343-E346 WeakPolarHBondContact CG2-OE2 3.46Å; T343-E346 PolarHBondContact N-OE2 3.25Å; T343-E346 WeakPolarHBondContact O-CB 3.41Å; T343-E346 PolarHBondContact O-N 2.93Å; T343-E346 WeakPolarHBondContact OG1-CB 3.4Å; T343-E346 WeakPolarHBondContact OG1-CG 3.27Å; T343-E346 PolarHBondContact OG1-N 3.17Å; T343-E346 PolarHBondContact OG1-OE2 3.14Å; T343-R347 VanDerWaalsContact O-CG 3.28Å; T343-R347 WeakPolarHBondContact O-CG 3.44Å; T343-R347 PolarHBondContact O-N 3.37Å
344	R	65.8	Low	67.7	Low	59 Å²	59	63 Å²	63	22%	0.223	34%	0.342	C	S	.	.	H	α-helix	trans	-54.6	-37.8	-178.7	-173.9	-178.3	-178.9	124.8	12	112.8	R347 V348 I515 V518	R344-R347 PolarHBondContact O-N 3.32Å; R344-V348 WeakPolarHBondContact O-CG2 3.25Å; R344-V348 PolarHBondContact O-N 3.06Å; R344-I515 VanDerWaalsContact CZ-CA 3.5Å; R344-I515 VanDerWaalsContact CZ-O 3.31Å; R344-I515 VanDerWaalsContact NH1-CA 3.3Å; R344-I515 VanDerWaalsContact NH1-CB 3.31Å; R344-I515 VanDerWaalsContact NH1-CG1 3.31Å; R344-I515 PolarHBondContact NH2-O 2.8Å; R344-V518 HydrophobicContact CG-CG1 4.11Å; R344-V518 VanDerWaalsContact NE-CB 3.32Å; R344-V518 VanDerWaalsContact NH2-C 3.33Å
345	S	65.6	Low	68.9	Low	84 Å²	84	62.8 Å²	62.8	59%	0.587	34%	0.337	S	S	*	.	H	α-helix	trans	-67.7	-42.6	176.8	49.9	0	0	0	0	111.9	T343 R347 V348 R349	T343-S345 PolarHBondContact O-N 3.37Å; T343-S345 PolarHBondContact OG1-OG 3.04Å; S345-R347 VanDerWaalsContact C-N 3.31Å; S345-R347 PolarHBondContact O-N 3.05Å; S345-V348 PolarHBondContact O-N 2.76Å; S345-R349 WeakPolarHBondContact O-CB 3.12Å; S345-R349 PolarHBondContact O-N 3.05Å
346	E	70.7	Confident	70	Confident	91 Å²	91	62.6 Å²	62.6	43%	0.425	34%	0.341	S	S	.	.	H	α-helix	trans	-60.4	-40.2	175.2	-74.2	165	150.4	0	0	111.6	M342 T343 V348 R349 L350	M342-E346 HydrophobicContact CG-CB 3.86Å; T343-E346 WeakPolarHBondContact CB-OE2 3.41Å; T343-E346 WeakPolarHBondContact CG2-OE2 3.46Å; T343-E346 PolarHBondContact N-OE2 3.25Å; T343-E346 WeakPolarHBondContact O-CB 3.41Å; T343-E346 PolarHBondContact O-N 2.93Å; T343-E346 WeakPolarHBondContact OG1-CB 3.4Å; T343-E346 WeakPolarHBondContact OG1-CG 3.27Å; T343-E346 PolarHBondContact OG1-N 3.17Å; T343-E346 PolarHBondContact OG1-OE2 3.14Å; E346-V348 PolarHBondContact O-N 3.44Å; E346-R349 PolarHBondContact O-N 3.09Å; E346-L350 WeakPolarHBondContact O-CB 3.11Å; E346-L350 PolarHBondContact O-N 3.24Å
347	R	71.3	Confident	71.3	Confident	35 Å²	35	57 Å²	57	13%	0.132	33%	0.325	C	S	.	.	H	α-helix	trans	-60.5	-46.3	177	-50.9	-153	-81.4	-89.7	8.4	112.7	M342 T343 R344 S345 L350 N351 F415	M342-R347 HydrophobicContact CB-CG 4.33Å; M342-R347 HydrophobicContact CE-CB 4.04Å; M342-R347 HydrophobicContact CE-CG 3.29Å; M342-R347 HydrophobicContact CG-CG 3.68Å; M342-R347 PolarHBondContact O-NH1 3.14Å; M342-R347 HydrophobicContact SD-CB 4.35Å; M342-R347 HydrophobicContact SD-CG 3.76Å; T343-R347 VanDerWaalsContact O-CG 3.28Å; T343-R347 WeakPolarHBondContact O-CG 3.44Å; T343-R347 PolarHBondContact O-N 3.37Å; R344-R347 PolarHBondContact O-N 3.32Å; S345-R347 VanDerWaalsContact C-N 3.31Å; S345-R347 PolarHBondContact O-N 3.05Å; R347-L350 PolarHBondContact O-N 3.34Å; R347-N351 WeakPolarHBondContact O-CB 3.49Å; R347-N351 PolarHBondContact O-N 2.72Å; R347-F415 VanDerWaalsContact CD-CZ 3.42Å; R347-F415 VanDerWaalsContact CZ-CD1 3.41Å; R347-F415 VanDerWaalsContact CZ-CE2 3.43Å; R347-F415 VanDerWaalsContact NH2-CD1 3.3Å; R347-F415 VanDerWaalsContact NH2-CG 3.34Å
348	V	69.7	Low	72.5	Confident	42 Å²	42	53.7 Å²	53.7	26%	0.255	31%	0.307	S	S	.	.	H	α-helix	trans	-64	-46.1	-179.5	173.2	0	0	0	0	109.5	R344 S345 E346 L350 N351 Q352 V518	R344-V348 WeakPolarHBondContact O-CG2 3.25Å; R344-V348 PolarHBondContact O-N 3.06Å; S345-V348 PolarHBondContact O-N 2.76Å; E346-V348 PolarHBondContact O-N 3.44Å; V348-L350 VanDerWaalsContact C-N 3.32Å; V348-L350 PolarHBondContact O-N 3.42Å; V348-N351 PolarHBondContact O-N 2.9Å; V348-Q352 HydrophobicContact CG1-CG 4.44Å; V348-Q352 WeakPolarHBondContact O-CB 3.34Å; V348-Q352 WeakPolarHBondContact O-CG 3.38Å; V348-Q352 PolarHBondContact O-N 3.47Å; V348-V518 HydrophobicContact CG2-CG1 3.71Å
349	R	75.7	Confident	73.6	Confident	148 Å²	148	60 Å²	60	56%	0.558	33%	0.334	S	S	*	.	H	α-helix	trans	-60.1	-43.7	177.2	-168.3	-178.6	75.7	89.4	-0.5	111.6	S345 E346 Q352 L353	S345-R349 WeakPolarHBondContact O-CB 3.12Å; S345-R349 PolarHBondContact O-N 3.05Å; E346-R349 PolarHBondContact O-N 3.09Å; R349-Q352 PolarHBondContact O-N 2.97Å; R349-L353 HydrophobicContact CG-CD1 4.42Å; R349-L353 WeakPolarHBondContact O-CG 3.36Å; R349-L353 PolarHBondContact O-N 2.86Å
350	L	77.7	Confident	74.8	Confident	28 Å²	28	60.9 Å²	60.9	15%	0.147	33%	0.334	C	S	.	.	H	α-helix	trans	-68.5	-42	-178	-166.8	65.6	0	0	0	112.2	M232 Y321 Y325 M342 E346 R347 V348 L353 T354	M232-L350 HydrophobicContact CE-CD1 4.28Å; Y321-L350 HydrophobicContact CE2-CD1 4.21Å; Y321-L350 WeakPolarHBondContact OH-CD1 3.33Å; Y321-L350 WeakPolarHBondContact OH-CD2 3.45Å; Y321-L350 WeakPolarHBondContact OH-CG 3.4Å; Y325-L350 HydrophobicContact CD2-CD2 3.96Å; Y325-L350 HydrophobicContact CE2-CD2 3.61Å; M342-L350 HydrophobicContact SD-CD2 3.81Å; E346-L350 WeakPolarHBondContact O-CB 3.11Å; E346-L350 PolarHBondContact O-N 3.24Å; R347-L350 PolarHBondContact O-N 3.34Å; V348-L350 VanDerWaalsContact C-N 3.32Å; V348-L350 PolarHBondContact O-N 3.42Å; L350-L353 PolarHBondContact O-N 2.62Å; L350-T354 PolarHBondContact O-N 3.41Å; L350-T354 PolarHBondContact O-OG1 3.37Å
351	N	78.8	Confident	76.2	Confident	5 Å²	5	57.1 Å²	57.1	3%	0.027	30%	0.304	C	S	.	.	H	α-helix	trans	-67.3	-38.9	175.4	-163.5	7.8	0	0	0	111.5	R347 V348 T354 L355 H404 N408 L525 Q529	R347-N351 WeakPolarHBondContact O-CB 3.49Å; R347-N351 PolarHBondContact O-N 2.72Å; V348-N351 PolarHBondContact O-N 2.9Å; N351-T354 PolarHBondContact O-N 2.95Å; N351-L355 WeakPolarHBondContact O-CB 3.28Å; N351-L355 WeakPolarHBondContact O-CG 3.46Å; N351-L355 PolarHBondContact O-N 3Å; N351-H404 PolarHBondContact OD1-NE2 3.16Å; N351-N408 PolarHBondContact ND2-ND2 3.5Å; N351-N408 PolarHBondContact OD1-ND2 2.77Å; N351-L525 WeakPolarHBondContact ND2-CD2 3.49Å; N351-Q529 PolarHBondContact OD1-NE2 3.25Å; N351-Q529 VanDerWaalsContact OD1-NE2 3.13Å
352	Q	79.9	Confident	77.3	Confident	117 Å²	117	56.6 Å²	56.6	55%	0.547	29%	0.29	S	S	.	.	H	α-helix	trans	-60.2	-45.4	173.3	-77.2	172.5	-12.3	0	0	112.2	V348 R349 L355 S356	V348-Q352 HydrophobicContact CG1-CG 4.44Å; V348-Q352 WeakPolarHBondContact O-CB 3.34Å; V348-Q352 WeakPolarHBondContact O-CG 3.38Å; V348-Q352 PolarHBondContact O-N 3.47Å; R349-Q352 PolarHBondContact O-N 2.97Å; Q352-L355 PolarHBondContact O-N 3.43Å; Q352-S356 PolarHBondContact O-N 3.33Å
353	L	82.9	Confident	78.2	Confident	69 Å²	69	58 Å²	58	36%	0.361	30%	0.3	S	S	.	.	H	α-helix	trans	-61.7	-47	175.4	-73.6	167.5	0	0	0	111.1	R349 L350 L355 S356 V357	R349-L353 HydrophobicContact CG-CD1 4.42Å; R349-L353 WeakPolarHBondContact O-CG 3.36Å; R349-L353 PolarHBondContact O-N 2.86Å; L350-L353 PolarHBondContact O-N 2.62Å; L353-L355 VanDerWaalsContact C-N 3.28Å; L353-L355 PolarHBondContact O-N 3.43Å; L353-S356 PolarHBondContact O-N 2.97Å; L353-S356 VanDerWaalsContact O-N 3.07Å; L353-S356 PolarHBondContact O-OG 3.14Å; L353-V357 WeakPolarHBondContact O-CG2 3.24Å; L353-V357 PolarHBondContact O-N 3.42Å; L353-V357 VanDerWaalsContact O-N 3.08Å
354	T	84.9	Confident	79.2	Confident	4 Å²	4	56.3 Å²	56.3	3%	0.025	29%	0.292	C	S	.	.	H	α-helix	trans	-59.8	-42.2	179.9	-49.6	0	0	0	0	111	L318 Y321 L350 N351 V357 I358 H404	L318-T354 HydrophobicContact CD1-CG2 3.92Å; Y321-T354 HydrophobicContact CE1-CG2 4.25Å; Y321-T354 WeakPolarHBondContact CE1-OG1 3.41Å; L350-T354 PolarHBondContact O-N 3.41Å; L350-T354 PolarHBondContact O-OG1 3.37Å; N351-T354 PolarHBondContact O-N 2.95Å; T354-V357 PolarHBondContact O-N 3.5Å; T354-I358 HydrophobicContact CG2-CD1 4.15Å; T354-I358 WeakPolarHBondContact O-CG1 3.39Å; T354-I358 PolarHBondContact O-N 3.21Å; T354-H404 VanDerWaalsContact CG2-CE1 3.49Å; T354-H404 WeakPolarHBondContact CG2-CE1 3.12Å
355	L	82.1	Confident	80.1	Confident	41 Å²	41	53.9 Å²	53.9	22%	0.215	28%	0.284	C	S	.	.	H	α-helix	trans	-64.6	-38.1	174.5	-79.9	174.2	0	0	0	113.8	N351 Q352 L353 V357 I358 K359 L525 Q529	N351-L355 WeakPolarHBondContact O-CB 3.28Å; N351-L355 WeakPolarHBondContact O-CG 3.46Å; N351-L355 PolarHBondContact O-N 3Å; Q352-L355 PolarHBondContact O-N 3.43Å; L353-L355 VanDerWaalsContact C-N 3.28Å; L353-L355 PolarHBondContact O-N 3.43Å; L355-V357 VanDerWaalsContact C-N 3.27Å; L355-V357 PolarHBondContact O-N 2.98Å; L355-I358 PolarHBondContact O-N 3.08Å; L355-K359 WeakPolarHBondContact O-CB 3.16Å; L355-K359 PolarHBondContact O-N 3.28Å; L355-L525 HydrophobicContact CD1-CD1 3.27Å; L355-L525 HydrophobicContact CD1-CD2 3.57Å; L355-L525 HydrophobicContact CD1-CG 3.57Å; L355-Q529 HydrophobicContact CD2-CG 3.76Å; L355-Q529 VanDerWaalsContact CG-NE2 3.3Å
356	S	81.9	Confident	80.9	Confident	66 Å²	66	55.6 Å²	55.6	46%	0.462	28%	0.281	S	S	.	.	H	α-helix	trans	-63.1	-36.6	175.3	69.3	0	0	0	0	112.2	Q352 L353 S360	Q352-S356 PolarHBondContact O-N 3.33Å; L353-S356 PolarHBondContact O-N 2.97Å; L353-S356 VanDerWaalsContact O-N 3.07Å; L353-S356 PolarHBondContact O-OG 3.14Å; S356-S360 WeakPolarHBondContact O-CB 3Å; S356-S360 PolarHBondContact O-N 3.36Å
357	V	86	Confident	81.4	Confident	56 Å²	56	59.7 Å²	59.7	34%	0.339	29%	0.292	S	S	.	.	H	α-helix	trans	-71.1	-43.8	177.2	177.5	0	0	0	0	110.7	L318 L353 T354 L355 K359 S360 C361	L318-V357 HydrophobicContact CB-CG1 4.47Å; L318-V357 HydrophobicContact CD1-CB 4.44Å; L318-V357 HydrophobicContact CD1-CG1 4.09Å; L318-V357 HydrophobicContact CD2-CG1 4.18Å; L318-V357 HydrophobicContact CG-CG1 4.47Å; L353-V357 WeakPolarHBondContact O-CG2 3.24Å; L353-V357 PolarHBondContact O-N 3.42Å; L353-V357 VanDerWaalsContact O-N 3.08Å; T354-V357 PolarHBondContact O-N 3.5Å; L355-V357 VanDerWaalsContact C-N 3.27Å; L355-V357 PolarHBondContact O-N 2.98Å; V357-K359 VanDerWaalsContact C-N 3.32Å; V357-K359 PolarHBondContact O-N 2.8Å; V357-S360 WeakPolarHBondContact O-CB 3.05Å; V357-S360 PolarHBondContact O-N 3.4Å; V357-S360 VanDerWaalsContact O-N 3.16Å; V357-C361 PolarHBondContact O-N 3.4Å; V357-C361 PolarHBondContact O-SG 2.99Å
358	I	83.6	Confident	82	Confident	5 Å²	5	58.1 Å²	58.1	3%	0.026	29%	0.287	C	S	.	.	H	α-helix	trans	-57.2	-47	174.7	-70.1	166.6	0	0	0	110.4	L318 T354 L355 S360 C361 E362 L397 T401 F532	L318-I358 HydrophobicContact CD2-CG1 3.8Å; T354-I358 HydrophobicContact CG2-CD1 4.15Å; T354-I358 WeakPolarHBondContact O-CG1 3.39Å; T354-I358 PolarHBondContact O-N 3.21Å; L355-I358 PolarHBondContact O-N 3.08Å; I358-S360 PolarHBondContact O-N 2.96Å; I358-C361 PolarHBondContact O-N 3.2Å; I358-E362 PolarHBondContact O-N 2.93Å; I358-L397 HydrophobicContact CG2-CD1 4.29Å; I358-T401 HydrophobicContact CD1-CG2 4.35Å; I358-T401 HydrophobicContact CG2-CG2 4.45Å; I358-F532 HydrophobicContact CG2-CE1 4.23Å
359	K	82.7	Confident	82.5	Confident	142 Å²	142	59.3 Å²	59.3	62%	0.617	29%	0.289	S	S	*	.	H	α-helix	trans	-63.7	-39.2	176.6	-172	175.4	-177.8	176.9	0	112.4	L355 V357 E362 T363	L355-K359 WeakPolarHBondContact O-CB 3.16Å; L355-K359 PolarHBondContact O-N 3.28Å; V357-K359 VanDerWaalsContact C-N 3.32Å; V357-K359 PolarHBondContact O-N 2.8Å; K359-E362 PolarHBondContact O-N 2.92Å; K359-T363 WeakPolarHBondContact O-CG2 3.24Å; K359-T363 PolarHBondContact O-N 3.28Å; K359-T363 PolarHBondContact O-OG1 2.74Å
360	S	85.2	Confident	82.5	Confident	55 Å²	55	55.8 Å²	55.8	39%	0.385	29%	0.292	S	S	.	.	H	α-helix	trans	-59.4	-49.4	174.4	-172.6	0	0	0	0	111.1	S356 V357 I358 E362 T363 A364	S356-S360 WeakPolarHBondContact O-CB 3Å; S356-S360 PolarHBondContact O-N 3.36Å; V357-S360 WeakPolarHBondContact O-CB 3.05Å; V357-S360 PolarHBondContact O-N 3.4Å; V357-S360 VanDerWaalsContact O-N 3.16Å; I358-S360 PolarHBondContact O-N 2.96Å; S360-E362 VanDerWaalsContact C-N 3.3Å; S360-E362 PolarHBondContact O-N 3.15Å; S360-T363 PolarHBondContact O-N 3.39Å; S360-T363 PolarHBondContact O-OG1 3.06Å; S360-A364 PolarHBondContact O-N 2.93Å
361	C	87.2	Confident	82.5	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-59.3	-41.2	177.7	-66.7	0	0	0	0	112	L311 L315 V357 I358 A364 L365 L397	L311-C361 HydrophobicContact CD1-CB 4.04Å; L315-C361 HydrophobicContact CD2-CB 4.37Å; V357-C361 PolarHBondContact O-N 3.4Å; V357-C361 PolarHBondContact O-SG 2.99Å; I358-C361 PolarHBondContact O-N 3.2Å; C361-A364 PolarHBondContact O-N 3.25Å; C361-L365 PolarHBondContact O-N 3.48Å; C361-L397 HydrophobicContact CB-CD1 3.85Å; C361-L397 HydrophobicContact CB-CD2 4.04Å
362	E	82.5	Confident	82.1	Confident	53 Å²	53	58.7 Å²	58.7	25%	0.248	31%	0.31	C	S	.	.	H	α-helix	trans	-61.8	-47.8	175.6	-175.4	-173	-177.2	0	0	111.5	I358 K359 S360 A364 L365 F366 L397 F532	I358-E362 PolarHBondContact O-N 2.93Å; K359-E362 PolarHBondContact O-N 2.92Å; S360-E362 VanDerWaalsContact C-N 3.3Å; S360-E362 PolarHBondContact O-N 3.15Å; E362-A364 VanDerWaalsContact C-N 3.26Å; E362-A364 PolarHBondContact O-N 3.47Å; E362-L365 WeakPolarHBondContact O-CB 3.31Å; E362-L365 PolarHBondContact O-N 2.84Å; E362-L365 VanDerWaalsContact O-N 3.15Å; E362-F366 HydrophobicContact CG-CD2 3.81Å; E362-F366 HydrophobicContact CG-CE2 3.53Å; E362-F366 VanDerWaalsContact O-CD2 3.24Å; E362-F366 WeakPolarHBondContact O-CD2 3.43Å; E362-F366 PolarHBondContact O-N 3.43Å; E362-F366 WeakPolarHBondContact OE1-CE2 3.25Å; E362-L397 HydrophobicContact CB-CD2 4.21Å; E362-F532 HydrophobicContact CG-CZ 4.46Å; E362-F532 WeakPolarHBondContact OE1-CE2 3.45Å; E362-F532 WeakPolarHBondContact OE2-CE2 3.44Å; E362-F532 WeakPolarHBondContact OE2-CZ 3.31Å
363	T	83.3	Confident	81.5	Confident	57 Å²	57	55.6 Å²	55.6	35%	0.35	31%	0.309	S	S	.	.	H	α-helix	trans	-63	-34	177	62.3	0	0	0	0	112.5	K359 S360 R367	K359-T363 WeakPolarHBondContact O-CG2 3.24Å; K359-T363 PolarHBondContact O-N 3.28Å; K359-T363 PolarHBondContact O-OG1 2.74Å; S360-T363 PolarHBondContact O-N 3.39Å; S360-T363 PolarHBondContact O-OG1 3.06Å; T363-R367 WeakPolarHBondContact O-CB 3.41Å; T363-R367 VanDerWaalsContact O-CG 3.25Å; T363-R367 WeakPolarHBondContact O-CG 3.29Å; T363-R367 PolarHBondContact O-N 3.37Å
364	A	85.8	Confident	80.6	Confident	26 Å²	26	59.2 Å²	59.2	22%	0.215	32%	0.318	C	S	.	.	H	α-helix	trans	-67.4	-41.9	173.7	0	0	0	0	0	111.8	L311 S360 C361 E362 R367 L368	L311-A364 HydrophobicContact CD1-CB 3.99Å; S360-A364 PolarHBondContact O-N 2.93Å; C361-A364 PolarHBondContact O-N 3.25Å; E362-A364 VanDerWaalsContact C-N 3.26Å; E362-A364 PolarHBondContact O-N 3.47Å; A364-R367 PolarHBondContact O-N 3.41Å; A364-L368 WeakPolarHBondContact O-CB 3.39Å; A364-L368 WeakPolarHBondContact O-CG 3.15Å; A364-L368 PolarHBondContact O-N 3.46Å
365	L	85.1	Confident	79.6	Confident	8 Å²	8	59.4 Å²	59.4	4%	0.042	32%	0.319	C	S	.	.	H	α-helix	trans	-60.5	-46.4	173.7	-80	171.8	0	0	0	112	L311 C361 E362 R367 L368 Q369 L390 L393 Q394 L397	L311-L365 HydrophobicContact CD2-CD2 3.51Å; L311-L365 HydrophobicContact CD2-CG 3.72Å; C361-L365 PolarHBondContact O-N 3.48Å; E362-L365 WeakPolarHBondContact O-CB 3.31Å; E362-L365 PolarHBondContact O-N 2.84Å; E362-L365 VanDerWaalsContact O-N 3.15Å; L365-R367 VanDerWaalsContact C-N 3.32Å; L365-R367 PolarHBondContact O-N 3.5Å; L365-L368 PolarHBondContact O-N 3.01Å; L365-Q369 WeakPolarHBondContact O-CB 3.38Å; L365-Q369 WeakPolarHBondContact O-CG 3.37Å; L365-Q369 PolarHBondContact O-N 2.93Å; L365-L390 HydrophobicContact CD2-CD2 4.27Å; L365-L393 HydrophobicContact CD2-CB 3.75Å; L365-L393 HydrophobicContact CD2-CD1 4.48Å; L365-Q394 HydrophobicContact CD1-CB 4.45Å; L365-L397 HydrophobicContact CD1-CB 4.31Å; L365-L397 HydrophobicContact CD1-CD2 3.62Å
366	F	81.1	Confident	78.6	Confident	119 Å²	119	58.8 Å²	58.8	52%	0.522	32%	0.316	S	S	.	.	H	α-helix	trans	-61.4	-40.2	176.6	-81	-62.6	0	0	0	112.4	E362 Q369 A370	E362-F366 HydrophobicContact CG-CD2 3.81Å; E362-F366 HydrophobicContact CG-CE2 3.53Å; E362-F366 VanDerWaalsContact O-CD2 3.24Å; E362-F366 WeakPolarHBondContact O-CD2 3.43Å; E362-F366 PolarHBondContact O-N 3.43Å; E362-F366 WeakPolarHBondContact OE1-CE2 3.25Å; F366-Q369 PolarHBondContact O-N 3.38Å; F366-A370 WeakPolarHBondContact O-CB 3.48Å; F366-A370 PolarHBondContact O-N 3.41Å
367	R	82.6	Confident	77.6	Confident	178 Å²	178	60.5 Å²	60.5	67%	0.672	33%	0.326	S	S	*	.	H	α-helix	trans	-63.5	-43	174.8	-74.7	171.3	180	173.7	1.1	111.8	T363 A364 L365 A370 L371	T363-R367 WeakPolarHBondContact O-CB 3.41Å; T363-R367 VanDerWaalsContact O-CG 3.25Å; T363-R367 WeakPolarHBondContact O-CG 3.29Å; T363-R367 PolarHBondContact O-N 3.37Å; A364-R367 PolarHBondContact O-N 3.41Å; L365-R367 VanDerWaalsContact C-N 3.32Å; L365-R367 PolarHBondContact O-N 3.5Å; R367-A370 PolarHBondContact O-N 3.34Å; R367-L371 WeakPolarHBondContact O-CG 3.36Å; R367-L371 PolarHBondContact O-N 3.42Å; R367-L371 VanDerWaalsContact O-N 3.13Å
368	L	82.9	Confident	76.4	Confident	2 Å²	2	66.1 Å²	66.1	1%	0.01	35%	0.348	C	S	.	.	H	α-helix	trans	-65	-43.1	176.8	-76.6	168.4	0	0	0	111.9	F304 Q307 I308 L311 A364 L365 A370 L371 C372 L390	F304-L368 HydrophobicContact CD2-CD2 3.73Å; F304-L368 HydrophobicContact CE2-CB 4.27Å; F304-L368 HydrophobicContact CE2-CD2 3.59Å; F304-L368 HydrophobicContact CZ-CD2 4.37Å; Q307-L368 HydrophobicContact CB-CD2 3.67Å; I308-L368 HydrophobicContact CG1-CD1 4.21Å; I308-L368 HydrophobicContact CG1-CD2 4.16Å; L311-L368 HydrophobicContact CD2-CD1 3.6Å; A364-L368 WeakPolarHBondContact O-CB 3.39Å; A364-L368 WeakPolarHBondContact O-CG 3.15Å; A364-L368 PolarHBondContact O-N 3.46Å; L365-L368 PolarHBondContact O-N 3.01Å; L368-A370 VanDerWaalsContact C-N 3.29Å; L368-A370 PolarHBondContact O-N 3.31Å; L368-L371 PolarHBondContact O-N 2.9Å; L368-L371 VanDerWaalsContact O-N 3.1Å; L368-C372 PolarHBondContact O-N 3.33Å; L368-C372 VanDerWaalsContact O-N 3.15Å; L368-C372 PolarHBondContact O-SG 3.48Å; L368-L390 HydrophobicContact CB-CD2 3.72Å; L368-L390 HydrophobicContact CD1-CD2 4.25Å
369	Q	80.4	Confident	75.6	Confident	67 Å²	67	70.1 Å²	70.1	31%	0.313	37%	0.37	S	S	.	.	H	α-helix	trans	-58.5	-41.3	174.3	-76.5	175.6	-15.4	0	0	111.6	L365 F366 L371 C372 L390	L365-Q369 WeakPolarHBondContact O-CB 3.38Å; L365-Q369 WeakPolarHBondContact O-CG 3.37Å; L365-Q369 PolarHBondContact O-N 2.93Å; F366-Q369 PolarHBondContact O-N 3.38Å; Q369-L371 VanDerWaalsContact C-N 3.3Å; Q369-L371 PolarHBondContact O-N 3.22Å; Q369-C372 WeakPolarHBondContact O-CB 3.19Å; Q369-C372 PolarHBondContact O-N 2.92Å; Q369-L390 HydrophobicContact CG-CD1 3.91Å
370	A	76.9	Confident	75.1	Confident	74 Å²	74	67.1 Å²	67.1	61%	0.612	37%	0.371	S	S	*	.	H	α-helix	trans	-65.6	-31.6	176.2	0	0	0	0	0	113.1	F366 R367 L368	F366-A370 WeakPolarHBondContact O-CB 3.48Å; F366-A370 PolarHBondContact O-N 3.41Å; R367-A370 PolarHBondContact O-N 3.34Å; L368-A370 VanDerWaalsContact C-N 3.29Å; L368-A370 PolarHBondContact O-N 3.31Å
371	L	76.5	Confident	74.4	Confident	56 Å²	56	72.4 Å²	72.4	29%	0.293	39%	0.39	S	S	.	.	H	α-helix	trans	-75.9	-25.9	177.9	-70.2	169.9	0	0	0	112.9	F304 R367 L368 Q369 G373 R374 V375	F304-L371 HydrophobicContact CD2-CB 4.34Å; R367-L371 WeakPolarHBondContact O-CG 3.36Å; R367-L371 PolarHBondContact O-N 3.42Å; R367-L371 VanDerWaalsContact O-N 3.13Å; L368-L371 PolarHBondContact O-N 2.9Å; L368-L371 VanDerWaalsContact O-N 3.1Å; Q369-L371 VanDerWaalsContact C-N 3.3Å; Q369-L371 PolarHBondContact O-N 3.22Å; L371-G373 VanDerWaalsContact C-N 3.26Å; L371-G373 PolarHBondContact O-N 2.89Å; L371-G373 VanDerWaalsContact O-N 3.14Å; L371-R374 WeakPolarHBondContact O-CB 2.97Å; L371-R374 PolarHBondContact O-N 3.47Å; L371-V375 WeakPolarHBondContact O-CG2 2.89Å; L371-V375 PolarHBondContact O-N 3.43Å
372	C	71.1	Confident	73.6	Confident	38 Å²	38	75.6 Å²	75.6	26%	0.257	40%	0.402	S	S	.	.	H	α-helix	trans	-52.6	-38.3	-177.2	-79.4	0	0	0	0	114.9	L368 Q369 R374 V375 I386 L390	L368-C372 PolarHBondContact O-N 3.33Å; L368-C372 VanDerWaalsContact O-N 3.15Å; L368-C372 PolarHBondContact O-SG 3.48Å; Q369-C372 WeakPolarHBondContact O-CB 3.19Å; Q369-C372 PolarHBondContact O-N 2.92Å; C372-R374 PolarHBondContact O-N 3.39Å; C372-V375 PolarHBondContact O-N 2.91Å; C372-I386 HydrophobicContact CB-CG2 4.43Å; C372-I386 WeakPolarHBondContact SG-CG2 3.49Å; C372-L390 WeakPolarHBondContact SG-CD1 3.03Å
373	G	65.8	Low	73.1	Confident	52 Å²	52	75.8 Å²	75.8	54%	0.536	41%	0.409	S	S	.	.	H	α-helix	trans	-62.9	-15.5	178.8	0	0	0	0	0	114.3	L371	L371-G373 VanDerWaalsContact C-N 3.26Å; L371-G373 PolarHBondContact O-N 2.89Å; L371-G373 VanDerWaalsContact O-N 3.14Å
374	R	65.9	Low	72.6	Confident	145 Å²	145	77 Å²	77	55%	0.547	41%	0.411	S	S	.	.	H	α-helix	trans	-109.3	-12.5	-174.2	-57.6	-176.2	-179.1	174.2	0.6	114.5	L371 C372	L371-R374 WeakPolarHBondContact O-CB 2.97Å; L371-R374 PolarHBondContact O-N 3.47Å; C372-R374 PolarHBondContact O-N 3.39Å
375	V	62.6	Low	72.3	Confident	8 Å²	8	81.6 Å²	81.6	5%	0.048	43%	0.428	C	S	.	.	H	α-helix	trans	-78.1	-37.6	-168.1	175.9	0	0	0	0	112.8	A301 F304 L371 C372 I386	A301-V375 HydrophobicContact CB-CG1 4.26Å; F304-V375 HydrophobicContact CB-CG2 4.14Å; F304-V375 HydrophobicContact CD2-CG2 3.93Å; F304-V375 HydrophobicContact CG-CG2 3.96Å; L371-V375 WeakPolarHBondContact O-CG2 2.89Å; L371-V375 PolarHBondContact O-N 3.43Å; C372-V375 PolarHBondContact O-N 2.91Å; V375-I386 HydrophobicContact CB-CD1 4.2Å; V375-I386 HydrophobicContact CG1-CD1 3.67Å
376	D	60.4	Low	72	Confident	28 Å²	28	81.8 Å²	81.8	15%	0.15	43%	0.429	C	S	.	.			trans	-167.9	93.9	176.2	-132	-29.8	0	0	0	112.1	Q378 R382	D376-Q378 PolarHBondContact O-N 3.06Å; D376-R382 VanDerWaalsContact OD2-CD 3.27Å; D376-R382 WeakPolarHBondContact OD2-CD 3.45Å; D376-R382 IonicContact OD2-CZ 3.39Å; D376-R382 IonicContact OD2-NE 3.21Å; D376-R382 IonicContact OD2-NH1 3.88Å; D376-R382 PolarHBondContact OD2-NH1 3.38Å
377	P	60.9	Low	71.9	Confident	101 Å²	101	80.1 Å²	80.1	66%	0.656	42%	0.419	S	S	*	.	S	Bend	trans	-73.7	-12.4	176.5	28.6	-32.5	0	0	0	113.4
378	Q	60.9	Low	71.8	Confident	174 Å²	174	72.5 Å²	72.5	81%	0.813	39%	0.391	S	S	*	.	S	Bend	trans	-93	-22.7	-171.2	-63.9	-170	0.6	0	0	113.8	D376	D376-Q378 PolarHBondContact O-N 3.06Å
379	N	67.9	Low	71.8	Confident	90 Å²	90	74 Å²	74	48%	0.481	40%	0.4	S	S	.	.			trans	-112.9	96.4	-177.9	-73.8	-36.4	0	0	0	111.3	Q381 R382 S383	N379-Q381 VanDerWaalsContact C-N 3.29Å; N379-Q381 PolarHBondContact O-N 3.01Å; N379-R382 HydrophobicContact CB-CB 3.84Å; N379-R382 PolarHBondContact O-N 3.19Å; N379-R382 VanDerWaalsContact O-N 3.1Å; N379-S383 PolarHBondContact O-N 3.38Å
380	A	71.5	Confident	71.9	Confident	78 Å²	78	71 Å²	71	65%	0.645	39%	0.386	S	S	*	.	H	α-helix	trans	-52	-47.1	178.5	0	0	0	0	0	112	R382 S383 E384	A380-R382 VanDerWaalsContact C-N 3.34Å; A380-R382 PolarHBondContact O-N 2.58Å; A380-S383 PolarHBondContact O-N 3.23Å; A380-S383 PolarHBondContact O-OG 3.49Å; A380-E384 PolarHBondContact O-N 3.41Å
381	Q	69.8	Low	72.1	Confident	167 Å²	167	69.6 Å²	69.6	78%	0.78	37%	0.369	S	S	*	.	H	α-helix	trans	-60.3	-39.5	179.3	-172.3	179.4	-1.9	0	0	113	N379 H385	N379-Q381 VanDerWaalsContact C-N 3.29Å; N379-Q381 PolarHBondContact O-N 3.01Å; Q381-H385 WeakPolarHBondContact O-CB 3.33Å; Q381-H385 PolarHBondContact O-N 3.3Å
382	R	71.2	Confident	72.4	Confident	66 Å²	66	70.7 Å²	70.7	25%	0.249	37%	0.374	C	S	.	.	H	α-helix	trans	-71.2	-40.7	178.5	-165.6	-176.9	-168.9	174.8	8.9	111.3	A301 D376 N379 A380 E384 H385 I386	A301-R382 VanDerWaalsContact CB-NH2 3.32Å; D376-R382 VanDerWaalsContact OD2-CD 3.27Å; D376-R382 WeakPolarHBondContact OD2-CD 3.45Å; D376-R382 IonicContact OD2-CZ 3.39Å; D376-R382 IonicContact OD2-NE 3.21Å; D376-R382 IonicContact OD2-NH1 3.88Å; D376-R382 PolarHBondContact OD2-NH1 3.38Å; N379-R382 HydrophobicContact CB-CB 3.84Å; N379-R382 PolarHBondContact O-N 3.19Å; N379-R382 VanDerWaalsContact O-N 3.1Å; A380-R382 VanDerWaalsContact C-N 3.34Å; A380-R382 PolarHBondContact O-N 2.58Å; R382-E384 VanDerWaalsContact C-N 3.3Å; R382-E384 PolarHBondContact O-N 2.92Å; R382-H385 PolarHBondContact O-N 2.96Å; R382-I386 HydrophobicContact CG-CD1 4.12Å; R382-I386 WeakPolarHBondContact O-CB 3.15Å; R382-I386 WeakPolarHBondContact O-CG1 3.49Å; R382-I386 PolarHBondContact O-N 3.38Å
383	S	71.8	Confident	73.2	Confident	58 Å²	58	69.3 Å²	69.3	41%	0.406	36%	0.364	S	S	.	.	H	α-helix	trans	-63.4	-38	176.9	78.2	0	0	0	0	111.9	N379 A380 R387	N379-S383 PolarHBondContact O-N 3.38Å; A380-S383 PolarHBondContact O-N 3.23Å; A380-S383 PolarHBondContact O-OG 3.49Å; S383-R387 WeakPolarHBondContact O-CB 3.36Å; S383-R387 PolarHBondContact O-N 3.3Å
384	E	74.2	Confident	73.9	Confident	81 Å²	81	68.8 Å²	68.8	38%	0.379	35%	0.347	S	S	.	.	H	α-helix	trans	-69.6	-45.4	175.5	179.2	167	-155.9	0	0	111.9	A380 R382 I386 R387 E388 N549	A380-E384 PolarHBondContact O-N 3.41Å; R382-E384 VanDerWaalsContact C-N 3.3Å; R382-E384 PolarHBondContact O-N 2.92Å; E384-I386 VanDerWaalsContact C-N 3.31Å; E384-I386 PolarHBondContact O-N 2.86Å; E384-R387 WeakPolarHBondContact O-CB 3.37Å; E384-R387 PolarHBondContact O-N 3.28Å; E384-R387 IonicContact OE1-NH2 3.88Å; E384-E388 PolarHBondContact O-N 3.01Å; E384-N549 PolarHBondContact OE1-ND2 3.44Å
385	H	79	Confident	74.6	Confident	123 Å²	123	64.8 Å²	64.8	57%	0.569	33%	0.334	S	S	*	.	H	α-helix	trans	-56	-47	174.6	175.1	71	0	0	0	111.5	Q381 R382 R387 E388 V389	Q381-H385 WeakPolarHBondContact O-CB 3.33Å; Q381-H385 PolarHBondContact O-N 3.3Å; R382-H385 PolarHBondContact O-N 2.96Å; H385-R387 PolarHBondContact O-N 3.06Å; H385-E388 PolarHBondContact O-N 3.42Å; H385-V389 WeakPolarHBondContact O-CG2 3.15Å; H385-V389 PolarHBondContact O-N 3.47Å
386	I	78.6	Confident	75.7	Confident	12 Å²	12	67.8 Å²	67.8	6%	0.062	34%	0.344	C	S	.	.	H	α-helix	trans	-60.6	-44.8	177.9	-72.5	169.3	0	0	0	111.5	F304 C372 V375 R382 E384 E388 V389 L390	F304-I386 HydrophobicContact CD1-CD1 4.46Å; F304-I386 HydrophobicContact CE1-CB 4.25Å; F304-I386 HydrophobicContact CE1-CD1 4.12Å; F304-I386 HydrophobicContact CE1-CG1 3.85Å; F304-I386 HydrophobicContact CE1-CG2 3.51Å; F304-I386 HydrophobicContact CE2-CG2 4.37Å; F304-I386 HydrophobicContact CZ-CG2 3.35Å; C372-I386 HydrophobicContact CB-CG2 4.43Å; C372-I386 WeakPolarHBondContact SG-CG2 3.49Å; V375-I386 HydrophobicContact CB-CD1 4.2Å; V375-I386 HydrophobicContact CG1-CD1 3.67Å; R382-I386 HydrophobicContact CG-CD1 4.12Å; R382-I386 WeakPolarHBondContact O-CB 3.15Å; R382-I386 WeakPolarHBondContact O-CG1 3.49Å; R382-I386 PolarHBondContact O-N 3.38Å; E384-I386 VanDerWaalsContact C-N 3.31Å; E384-I386 PolarHBondContact O-N 2.86Å; I386-E388 VanDerWaalsContact C-N 3.28Å; I386-E388 PolarHBondContact O-N 2.94Å; I386-V389 PolarHBondContact O-N 3.27Å; I386-L390 WeakPolarHBondContact O-CG 3.49Å; I386-L390 PolarHBondContact O-N 3.32Å; I386-L390 VanDerWaalsContact O-N 3.11Å
387	R	78.6	Confident	76.9	Confident	84 Å²	84	66.8 Å²	66.8	32%	0.317	34%	0.339	S	S	.	.	H	α-helix	trans	-59	-42.7	176.5	-174.7	-173.6	59.1	61.3	-1.6	111.1	S383 E384 H385 L390 N391	S383-R387 WeakPolarHBondContact O-CB 3.36Å; S383-R387 PolarHBondContact O-N 3.3Å; E384-R387 WeakPolarHBondContact O-CB 3.37Å; E384-R387 PolarHBondContact O-N 3.28Å; E384-R387 IonicContact OE1-NH2 3.88Å; H385-R387 PolarHBondContact O-N 3.06Å; R387-L390 PolarHBondContact O-N 2.97Å; R387-N391 PolarHBondContact NH1-ND2 3.15Å; R387-N391 VanDerWaalsContact NH1-ND2 3.12Å; R387-N391 PolarHBondContact O-N 3.45Å
388	E	79.8	Confident	77.7	Confident	18 Å²	18	62.1 Å²	62.1	8%	0.084	31%	0.309	C	S	.	.	H	α-helix	trans	-71.4	-39.3	-178.4	-161.3	55.5	-148.9	0	0	112.6	E384 H385 I386 L390 N391 I392	E384-E388 PolarHBondContact O-N 3.01Å; H385-E388 PolarHBondContact O-N 3.42Å; I386-E388 VanDerWaalsContact C-N 3.28Å; I386-E388 PolarHBondContact O-N 2.94Å; E388-L390 VanDerWaalsContact C-N 3.27Å; E388-L390 PolarHBondContact O-N 3.4Å; E388-N391 WeakPolarHBondContact O-CB 3.5Å; E388-N391 PolarHBondContact O-N 3.41Å; E388-N391 PolarHBondContact OE2-ND2 2.98Å; E388-I392 HydrophobicContact CG-CD1 4.4Å; E388-I392 WeakPolarHBondContact O-CG1 3.45Å; E388-I392 PolarHBondContact O-N 3.42Å
389	V	84.3	Confident	78.8	Confident	33 Å²	33	59.9 Å²	59.9	20%	0.2	30%	0.296	C	S	.	.	H	α-helix	trans	-57.8	-42.3	172.6	170.9	0	0	0	0	110.9	I308 H385 I386 I392 L393	I308-V389 HydrophobicContact CD1-CG1 4.05Å; I308-V389 HydrophobicContact CG2-CG1 4.3Å; H385-V389 WeakPolarHBondContact O-CG2 3.15Å; H385-V389 PolarHBondContact O-N 3.47Å; I386-V389 PolarHBondContact O-N 3.27Å; V389-I392 PolarHBondContact O-N 2.98Å; V389-L393 HydrophobicContact CG1-CD1 4.09Å; V389-L393 VanDerWaalsContact O-CG 3.32Å; V389-L393 WeakPolarHBondContact O-CG 3.48Å; V389-L393 PolarHBondContact O-N 2.9Å
390	L	82.5	Confident	79.7	Confident	6 Å²	6	56.2 Å²	56.2	3%	0.031	28%	0.277	C	S	.	.	H	α-helix	trans	-66.1	-39.9	176.6	-71.3	175.5	0	0	0	113.2	L365 L368 Q369 C372 I386 R387 E388 I392 L393 Q394	L365-L390 HydrophobicContact CD2-CD2 4.27Å; L368-L390 HydrophobicContact CB-CD2 3.72Å; L368-L390 HydrophobicContact CD1-CD2 4.25Å; Q369-L390 HydrophobicContact CG-CD1 3.91Å; C372-L390 WeakPolarHBondContact SG-CD1 3.03Å; I386-L390 WeakPolarHBondContact O-CG 3.49Å; I386-L390 PolarHBondContact O-N 3.32Å; I386-L390 VanDerWaalsContact O-N 3.11Å; R387-L390 PolarHBondContact O-N 2.97Å; E388-L390 VanDerWaalsContact C-N 3.27Å; E388-L390 PolarHBondContact O-N 3.4Å; L390-I392 VanDerWaalsContact C-N 3.32Å; L390-I392 PolarHBondContact O-N 2.93Å; L390-L393 PolarHBondContact O-N 2.6Å; L390-Q394 WeakPolarHBondContact O-CB 3.21Å; L390-Q394 PolarHBondContact O-N 2.84Å
391	N	80.1	Confident	80.1	Confident	44 Å²	44	52.6 Å²	52.6	24%	0.235	25%	0.246	C	C	.	.	H	α-helix	trans	-59.3	-44.4	173.9	-73.7	-15.1	0	0	0	111.2	R387 E388 Q394 F395	R387-N391 PolarHBondContact NH1-ND2 3.15Å; R387-N391 VanDerWaalsContact NH1-ND2 3.12Å; R387-N391 PolarHBondContact O-N 3.45Å; E388-N391 WeakPolarHBondContact O-CB 3.5Å; E388-N391 PolarHBondContact O-N 3.41Å; E388-N391 PolarHBondContact OE2-ND2 2.98Å; N391-Q394 PolarHBondContact O-N 3.07Å; N391-F395 PolarHBondContact O-N 2.97Å
392	I	83.9	Confident	80.5	Confident	79 Å²	79	47 Å²	47	41%	0.405	22%	0.222	S	C	.	.	H	α-helix	trans	-64.1	-41.6	177.9	-66.8	165.9	0	0	0	111.3	E388 V389 L390 F395 R396 I546	E388-I392 HydrophobicContact CG-CD1 4.4Å; E388-I392 WeakPolarHBondContact O-CG1 3.45Å; E388-I392 PolarHBondContact O-N 3.42Å; V389-I392 PolarHBondContact O-N 2.98Å; L390-I392 VanDerWaalsContact C-N 3.32Å; L390-I392 PolarHBondContact O-N 2.93Å; I392-F395 WeakPolarHBondContact O-CB 3.48Å; I392-F395 PolarHBondContact O-N 3.42Å; I392-R396 WeakPolarHBondContact O-CB 3.5Å; I392-R396 PolarHBondContact O-N 3.38Å; I392-I546 HydrophobicContact CD1-CD1 4.21Å; I392-I546 HydrophobicContact CG1-CD1 4.25Å
393	L	86.6	Confident	81	Confident	9 Å²	9	46.3 Å²	46.3	5%	0.047	23%	0.225	C	C	.	.	H	α-helix	trans	-66.3	-39.5	177.2	-68.2	170.6	0	0	0	111.9	I308 L311 V312 L315 L365 V389 L390 R396 L397	I308-L393 HydrophobicContact CG2-CD1 4.35Å; L311-L393 HydrophobicContact CD2-CD1 4.19Å; V312-L393 HydrophobicContact CG2-CD2 3.62Å; L315-L393 HydrophobicContact CD1-CB 4.46Å; L315-L393 HydrophobicContact CD1-CD2 3.85Å; L365-L393 HydrophobicContact CD2-CB 3.75Å; L365-L393 HydrophobicContact CD2-CD1 4.48Å; V389-L393 HydrophobicContact CG1-CD1 4.09Å; V389-L393 VanDerWaalsContact O-CG 3.32Å; V389-L393 WeakPolarHBondContact O-CG 3.48Å; V389-L393 PolarHBondContact O-N 2.9Å; L390-L393 PolarHBondContact O-N 2.6Å; L393-R396 PolarHBondContact O-N 2.71Å; L393-L397 PolarHBondContact O-N 3Å
394	Q	81.8	Confident	81.5	Confident	40 Å²	40	43.6 Å²	43.6	19%	0.187	21%	0.206	C	C	.	.	H	α-helix	trans	-62.8	-44.9	174.4	-173.2	176.2	7.1	0	0	111.2	L365 L390 N391 R396 L397 C398 V536	L365-Q394 HydrophobicContact CD1-CB 4.45Å; L390-Q394 WeakPolarHBondContact O-CB 3.21Å; L390-Q394 PolarHBondContact O-N 2.84Å; N391-Q394 PolarHBondContact O-N 3.07Å; Q394-R396 VanDerWaalsContact C-N 3.32Å; Q394-R396 PolarHBondContact O-N 3.02Å; Q394-L397 PolarHBondContact O-N 3.42Å; Q394-C398 WeakPolarHBondContact O-CB 3.37Å; Q394-C398 PolarHBondContact O-N 3.34Å; Q394-V536 HydrophobicContact CG-CG1 4.31Å
395	F	80.7	Confident	81.7	Confident	62 Å²	62	40 Å²	40	27%	0.272	19%	0.19	S	C	.	.	H	α-helix	trans	-57.4	-46.7	174.1	178.2	-138.2	0	0	0	111.7	N391 I392 L397 C398 K399 E540 I543	N391-F395 PolarHBondContact O-N 2.97Å; I392-F395 WeakPolarHBondContact O-CB 3.48Å; I392-F395 PolarHBondContact O-N 3.42Å; F395-L397 PolarHBondContact O-N 3.4Å; F395-C398 WeakPolarHBondContact O-CB 3.38Å; F395-C398 PolarHBondContact O-N 3.42Å; F395-K399 WeakPolarHBondContact O-CB 2.96Å; F395-K399 PolarHBondContact O-N 2.96Å; F395-E540 WeakPolarHBondContact CB-OE1 3.41Å; F395-E540 HydrophobicContact CD2-CG 4.44Å; F395-E540 WeakPolarHBondContact CD2-OE1 3.32Å; F395-E540 WeakPolarHBondContact CD2-OE2 3.49Å; F395-E540 WeakPolarHBondContact CE2-OE2 3.38Å; F395-E540 WeakPolarHBondContact CG-OE1 3.5Å; F395-I543 HydrophobicContact CE1-CD1 4.49Å; F395-I543 HydrophobicContact CZ-CD1 4.28Å
396	R	85.5	Confident	81.7	Confident	70 Å²	70	37.5 Å²	37.5	26%	0.264	19%	0.186	S	C	.	.	H	α-helix	trans	-61.4	-44.7	-179.6	-169	173.8	-178.7	-164.4	-4	111.3	T316 E319 I392 L393 Q394 C398 K399 L400	T316-R396 PolarHBondContact OG1-NH1 3.36Å; T316-R396 PolarHBondContact OG1-NH2 3.45Å; E319-R396 IonicContact OE2-CZ 3.03Å; E319-R396 IonicContact OE2-NE 2.78Å; E319-R396 PolarHBondContact OE2-NE 3.38Å; E319-R396 VanDerWaalsContact OE2-NE 3.16Å; E319-R396 IonicContact OE2-NH2 3Å; E319-R396 PolarHBondContact OE2-NH2 3.12Å; I392-R396 WeakPolarHBondContact O-CB 3.5Å; I392-R396 PolarHBondContact O-N 3.38Å; L393-R396 PolarHBondContact O-N 2.71Å; Q394-R396 VanDerWaalsContact C-N 3.32Å; Q394-R396 PolarHBondContact O-N 3.02Å; R396-C398 VanDerWaalsContact C-N 3.34Å; R396-K399 PolarHBondContact O-N 2.94Å; R396-L400 VanDerWaalsContact O-CB 3.3Å; R396-L400 WeakPolarHBondContact O-CB 3.35Å; R396-L400 PolarHBondContact O-N 2.89Å
397	L	85.5	Confident	81.8	Confident	8 Å²	8	37.7 Å²	37.7	4%	0.042	19%	0.187	C	C	.	.	H	α-helix	trans	-62	-41.7	175.3	-178.2	61.9	0	0	0	111.7	L315 I358 C361 E362 L365 L393 Q394 F395 L400 T401	L315-L397 HydrophobicContact CD2-CB 3.96Å; L315-L397 HydrophobicContact CD2-CD1 3.72Å; L315-L397 HydrophobicContact CD2-CG 4.4Å; I358-L397 HydrophobicContact CG2-CD1 4.29Å; C361-L397 HydrophobicContact CB-CD1 3.85Å; C361-L397 HydrophobicContact CB-CD2 4.04Å; E362-L397 HydrophobicContact CB-CD2 4.21Å; L365-L397 HydrophobicContact CD1-CB 4.31Å; L365-L397 HydrophobicContact CD1-CD2 3.62Å; L393-L397 PolarHBondContact O-N 3Å; Q394-L397 PolarHBondContact O-N 3.42Å; F395-L397 PolarHBondContact O-N 3.4Å; L397-L400 PolarHBondContact O-N 3.33Å; L397-T401 WeakPolarHBondContact O-CB 3.35Å; L397-T401 PolarHBondContact O-N 2.77Å; L397-T401 PolarHBondContact O-OG1 3.33Å
398	C	78.5	Confident	81.8	Confident	2 Å²	2	34.4 Å²	34.4	1%	0.014	18%	0.176	C	C	.	.	H	α-helix	trans	-60.3	-52.7	176.9	-173.1	0	0	0	0	111.9	Q394 F395 R396 L400 T401 N402 V536	Q394-C398 WeakPolarHBondContact O-CB 3.37Å; Q394-C398 PolarHBondContact O-N 3.34Å; F395-C398 WeakPolarHBondContact O-CB 3.38Å; F395-C398 PolarHBondContact O-N 3.42Å; R396-C398 VanDerWaalsContact C-N 3.34Å; C398-L400 VanDerWaalsContact C-N 3.26Å; C398-L400 PolarHBondContact O-N 3.4Å; C398-T401 PolarHBondContact O-N 2.95Å; C398-N402 WeakPolarHBondContact O-CB 3.41Å; C398-N402 PolarHBondContact O-N 2.92Å; C398-N402 PolarHBondContact O-ND2 3.28Å; C398-V536 HydrophobicContact CB-CB 4.27Å; C398-V536 HydrophobicContact CB-CG1 3.43Å; C398-V536 VanDerWaalsContact CB-CG1 3.43Å; C398-V536 WeakPolarHBondContact SG-CG1 3.34Å
399	K	83.2	Confident	81.6	Confident	128 Å²	128	36.2 Å²	36.2	56%	0.557	19%	0.186	S	C	*	.	H	α-helix	trans	-56.9	-43.4	178.1	-175.9	179.6	-179.6	-178	0	111.1	F395 R396 N402 V403	F395-K399 WeakPolarHBondContact O-CB 2.96Å; F395-K399 PolarHBondContact O-N 2.96Å; R396-K399 PolarHBondContact O-N 2.94Å; K399-N402 WeakPolarHBondContact O-CB 3.33Å; K399-N402 PolarHBondContact O-N 3.35Å; K399-V403 WeakPolarHBondContact O-CG2 3.36Å; K399-V403 PolarHBondContact O-N 3.36Å
400	L	85.8	Confident	81.1	Confident	12 Å²	12	37.3 Å²	37.3	6%	0.063	19%	0.193	C	C	.	.	H	α-helix	trans	-66.6	-40.2	180	-169.6	54.4	0	0	0	112.2	L318 E319 I322 R396 L397 C398 V403 H404	L318-L400 HydrophobicContact CB-CD2 3.85Å; L318-L400 HydrophobicContact CD2-CD2 3.58Å; L318-L400 HydrophobicContact CD2-CG 4.25Å; L318-L400 HydrophobicContact CG-CD2 3.53Å; L318-L400 HydrophobicContact CG-CG 4.22Å; E319-L400 HydrophobicContact CB-CD1 4.17Å; E319-L400 HydrophobicContact CB-CD2 4.16Å; E319-L400 HydrophobicContact CG-CD1 4.37Å; I322-L400 HydrophobicContact CB-CD1 4.01Å; I322-L400 HydrophobicContact CD1-CD1 3.32Å; I322-L400 HydrophobicContact CD1-CD2 4.31Å; I322-L400 HydrophobicContact CD1-CG 3.52Å; I322-L400 HydrophobicContact CG1-CD1 4.22Å; I322-L400 HydrophobicContact CG2-CD1 4.18Å; R396-L400 VanDerWaalsContact O-CB 3.3Å; R396-L400 WeakPolarHBondContact O-CB 3.35Å; R396-L400 PolarHBondContact O-N 2.89Å; L397-L400 PolarHBondContact O-N 3.33Å; C398-L400 VanDerWaalsContact C-N 3.26Å; C398-L400 PolarHBondContact O-N 3.4Å; L400-V403 PolarHBondContact O-N 2.92Å; L400-H404 WeakPolarHBondContact O-CB 3.4Å; L400-H404 PolarHBondContact O-N 3.41Å
401	T	81.1	Confident	80.8	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.012	19%	0.192	C	C	.	.	H	α-helix	trans	-65.7	-39.9	175.3	-54.7	0	0	0	0	111.8	I358 L397 C398 H404 S405 F532	I358-T401 HydrophobicContact CD1-CG2 4.35Å; I358-T401 HydrophobicContact CG2-CG2 4.45Å; L397-T401 WeakPolarHBondContact O-CB 3.35Å; L397-T401 PolarHBondContact O-N 2.77Å; L397-T401 PolarHBondContact O-OG1 3.33Å; C398-T401 PolarHBondContact O-N 2.95Å; T401-H404 PolarHBondContact O-N 3.44Å; T401-S405 WeakPolarHBondContact O-CB 3.38Å; T401-S405 PolarHBondContact O-N 3.39Å; T401-F532 HydrophobicContact CG2-CD1 3.81Å; T401-F532 HydrophobicContact CG2-CE1 4.05Å
402	N	78.3	Confident	80.4	Confident	49 Å²	49	38.3 Å²	38.3	26%	0.262	19%	0.194	S	C	.	.	H	α-helix	trans	-61.4	-46.1	173.7	-86.7	-53.6	0	0	0	112.4	C398 K399 H404 S405 S406 A533	C398-N402 WeakPolarHBondContact O-CB 3.41Å; C398-N402 PolarHBondContact O-N 2.92Å; C398-N402 PolarHBondContact O-ND2 3.28Å; K399-N402 WeakPolarHBondContact O-CB 3.33Å; K399-N402 PolarHBondContact O-N 3.35Å; N402-H404 VanDerWaalsContact C-N 3.35Å; N402-S405 PolarHBondContact O-N 3.42Å; N402-S406 WeakPolarHBondContact O-CB 3.21Å; N402-S406 PolarHBondContact O-N 2.88Å; N402-A533 WeakPolarHBondContact OD1-CB 3.49Å
403	V	81.6	Confident	79.9	Confident	52 Å²	52	41.1 Å²	41.1	32%	0.315	20%	0.203	S	C	.	.	H	α-helix	trans	-62.8	-42.8	176.9	172.8	0	0	0	0	110.9	I322 K399 L400 L407	I322-V403 HydrophobicContact CG2-CG1 3.81Å; K399-V403 WeakPolarHBondContact O-CG2 3.36Å; K399-V403 PolarHBondContact O-N 3.36Å; L400-V403 PolarHBondContact O-N 2.92Å; V403-L407 VanDerWaalsContact O-CB 3.29Å; V403-L407 WeakPolarHBondContact O-CB 3.34Å; V403-L407 PolarHBondContact O-N 3.1Å
404	H	81.5	Confident	79.3	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-62.7	-45.9	176.8	-175.1	59.3	0	0	0	112.5	I322 N351 T354 L400 T401 N402 L407 N408	I322-H404 HydrophobicContact CD1-CB 3.86Å; I322-H404 HydrophobicContact CG1-CB 4.43Å; N351-H404 PolarHBondContact OD1-NE2 3.16Å; T354-H404 VanDerWaalsContact CG2-CE1 3.49Å; T354-H404 WeakPolarHBondContact CG2-CE1 3.12Å; L400-H404 WeakPolarHBondContact O-CB 3.4Å; L400-H404 PolarHBondContact O-N 3.41Å; T401-H404 PolarHBondContact O-N 3.44Å; N402-H404 VanDerWaalsContact C-N 3.35Å; H404-L407 PolarHBondContact O-N 2.85Å; H404-N408 PolarHBondContact CD2-ND2 3.01Å; H404-N408 PolarHBondContact CE1-ND2 2.71Å; H404-N408 PolarHBondContact NE2-ND2 3.33Å; H404-N408 VanDerWaalsContact O-CG 3.3Å; H404-N408 PolarHBondContact O-N 2.95Å; H404-N408 PolarHBondContact O-ND2 3.5Å
405	S	78.5	Confident	78.7	Confident	7 Å²	7	44.4 Å²	44.4	5%	0.049	21%	0.213	C	C	.	.	H	α-helix	trans	-60.9	-49.5	177.1	-176.3	0	0	0	0	111.5	T401 N402 L407 N408 D409	T401-S405 WeakPolarHBondContact O-CB 3.38Å; T401-S405 PolarHBondContact O-N 3.39Å; N402-S405 PolarHBondContact O-N 3.42Å; S405-L407 VanDerWaalsContact C-N 3.32Å; S405-L407 PolarHBondContact O-N 3.07Å; S405-N408 PolarHBondContact O-N 3.38Å; S405-N408 VanDerWaalsContact O-N 3.14Å; S405-D409 PolarHBondContact O-N 3.49Å
406	S	79.5	Confident	78.1	Confident	70 Å²	70	42.4 Å²	42.4	49%	0.49	21%	0.207	S	C	.	.	H	α-helix	trans	-60.9	-39.7	177.7	177.6	0	0	0	0	112.6	N402 D409 V410	N402-S406 WeakPolarHBondContact O-CB 3.21Å; N402-S406 PolarHBondContact O-N 2.88Å; S406-D409 PolarHBondContact O-N 2.89Å; S406-V410 WeakPolarHBondContact O-CG2 3.3Å; S406-V410 PolarHBondContact O-N 3.13Å; S406-V410 VanDerWaalsContact O-N 3.15Å
407	L	81.3	Confident	77.3	Confident	16 Å²	16	42.2 Å²	42.2	8%	0.084	21%	0.211	C	C	.	.	H	α-helix	trans	-64	-42.9	175.3	-180	60	0	0	0	111.5	Y325 R326 V329 V403 H404 S405 D409 V410 L411	Y325-L407 HydrophobicContact CD1-CD2 3.36Å; Y325-L407 HydrophobicContact CD1-CG 4.27Å; Y325-L407 HydrophobicContact CE1-CD2 3.79Å; Y325-L407 HydrophobicContact CE1-CG 4.21Å; Y325-L407 HydrophobicContact CG-CD2 4.3Å; R326-L407 HydrophobicContact CB-CD1 4.37Å; R326-L407 HydrophobicContact CB-CD2 3.92Å; R326-L407 HydrophobicContact CG-CD1 4.23Å; V329-L407 HydrophobicContact CG1-CD1 4.43Å; V403-L407 VanDerWaalsContact O-CB 3.29Å; V403-L407 WeakPolarHBondContact O-CB 3.34Å; V403-L407 PolarHBondContact O-N 3.1Å; H404-L407 PolarHBondContact O-N 2.85Å; S405-L407 VanDerWaalsContact C-N 3.32Å; S405-L407 PolarHBondContact O-N 3.07Å; L407-D409 PolarHBondContact O-N 3.05Å; L407-V410 PolarHBondContact O-N 3.19Å; L407-L411 HydrophobicContact CG-CD1 4.24Å; L407-L411 WeakPolarHBondContact O-CB 3.29Å; L407-L411 VanDerWaalsContact O-CG 3.31Å; L407-L411 WeakPolarHBondContact O-CG 3.3Å; L407-L411 PolarHBondContact O-N 2.92Å
408	N	77.5	Confident	76.4	Confident	14 Å²	14	42.8 Å²	42.8	8%	0.075	22%	0.215	C	C	.	.	H	α-helix	trans	-64.4	-37.2	176.2	-72.1	-30.9	0	0	0	112.6	N351 H404 S405 L411 Y412 Q529	N351-N408 PolarHBondContact ND2-ND2 3.5Å; N351-N408 PolarHBondContact OD1-ND2 2.77Å; H404-N408 PolarHBondContact CD2-ND2 3.01Å; H404-N408 PolarHBondContact CE1-ND2 2.71Å; H404-N408 PolarHBondContact NE2-ND2 3.33Å; H404-N408 VanDerWaalsContact O-CG 3.3Å; H404-N408 PolarHBondContact O-N 2.95Å; H404-N408 PolarHBondContact O-ND2 3.5Å; S405-N408 PolarHBondContact O-N 3.38Å; S405-N408 VanDerWaalsContact O-N 3.14Å; N408-L411 PolarHBondContact O-N 2.89Å; N408-Y412 VanDerWaalsContact O-CB 3.31Å; N408-Y412 WeakPolarHBondContact O-CB 3.35Å; N408-Y412 PolarHBondContact O-N 3.17Å; N408-Q529 PolarHBondContact ND2-OE1 3.39Å
409	D	75.2	Confident	75.8	Confident	57 Å²	57	44.2 Å²	44.2	31%	0.305	22%	0.221	S	C	.	.	H	α-helix	trans	-63.9	-44.9	176.5	-77.5	-7	0	0	0	111.8	S405 S406 L407 L411 Y412 K413 S526	S405-D409 PolarHBondContact O-N 3.49Å; S406-D409 PolarHBondContact O-N 2.89Å; L407-D409 PolarHBondContact O-N 3.05Å; D409-L411 VanDerWaalsContact C-N 3.35Å; D409-Y412 PolarHBondContact O-N 2.88Å; D409-K413 WeakPolarHBondContact O-CG 3.29Å; D409-K413 PolarHBondContact O-N 2.86Å; D409-S526 WeakPolarHBondContact OD1-CB 3.38Å; D409-S526 PolarHBondContact OD1-OG 2.76Å
410	V	75	Confident	75.1	Confident	55 Å²	55	45.4 Å²	45.4	33%	0.333	22%	0.222	S	C	.	.	H	α-helix	trans	-62.7	-44.6	176.1	172.7	0	0	0	0	110.5	S406 L407 K413 R414	S406-V410 WeakPolarHBondContact O-CG2 3.3Å; S406-V410 PolarHBondContact O-N 3.13Å; S406-V410 VanDerWaalsContact O-N 3.15Å; L407-V410 PolarHBondContact O-N 3.19Å; V410-K413 PolarHBondContact O-N 3.2Å; V410-R414 WeakPolarHBondContact O-CG 3.33Å; V410-R414 PolarHBondContact O-N 3.45Å
411	L	75.6	Confident	74.2	Confident	5 Å²	5	48.6 Å²	48.6	3%	0.026	25%	0.245	C	C	.	.	H	α-helix	trans	-60.7	-47.9	176.2	-79.6	173.8	0	0	0	112	Y325 V329 L338 L407 N408 D409 K413 R414 F415	Y325-L411 HydrophobicContact CE1-CD1 3.76Å; Y325-L411 WeakPolarHBondContact OH-CD1 3.18Å; V329-L411 HydrophobicContact CB-CD2 4.16Å; V329-L411 HydrophobicContact CG1-CD2 3.28Å; V329-L411 HydrophobicContact CG1-CG 4.02Å; V329-L411 HydrophobicContact CG2-CD1 4.09Å; V329-L411 HydrophobicContact CG2-CD2 3.73Å; V329-L411 HydrophobicContact CG2-CG 4.37Å; L338-L411 HydrophobicContact CD1-CD2 4.15Å; L338-L411 HydrophobicContact CD2-CD2 4.43Å; L407-L411 HydrophobicContact CG-CD1 4.24Å; L407-L411 WeakPolarHBondContact O-CB 3.29Å; L407-L411 VanDerWaalsContact O-CG 3.31Å; L407-L411 WeakPolarHBondContact O-CG 3.3Å; L407-L411 PolarHBondContact O-N 2.92Å; N408-L411 PolarHBondContact O-N 2.89Å; D409-L411 VanDerWaalsContact C-N 3.35Å; L411-K413 VanDerWaalsContact C-N 3.33Å; L411-K413 PolarHBondContact O-N 2.8Å; L411-R414 PolarHBondContact O-N 3.18Å; L411-F415 HydrophobicContact CB-CD2 4.32Å; L411-F415 HydrophobicContact CB-CE2 4.3Å; L411-F415 HydrophobicContact CD2-CE2 4Å; L411-F415 WeakPolarHBondContact O-CB 3.47Å; L411-F415 WeakPolarHBondContact O-CD2 3.41Å; L411-F415 PolarHBondContact O-N 2.93Å
412	Y	71.8	Confident	73.5	Confident	67 Å²	67	51.9 Å²	51.9	26%	0.263	27%	0.266	S	S	.	.	H	α-helix	trans	-56.3	-48.9	179.1	-178	-99.5	0	0	0	111	N408 D409 R414 F415 T416 E519 L522	N408-Y412 VanDerWaalsContact O-CB 3.31Å; N408-Y412 WeakPolarHBondContact O-CB 3.35Å; N408-Y412 PolarHBondContact O-N 3.17Å; D409-Y412 PolarHBondContact O-N 2.88Å; Y412-R414 PolarHBondContact O-N 3.49Å; Y412-F415 PolarHBondContact O-N 3.34Å; Y412-T416 HydrophobicContact CD1-CG2 4.14Å; Y412-T416 HydrophobicContact CE1-CG2 3.74Å; Y412-T416 HydrophobicContact CE2-CG2 4.21Å; Y412-T416 WeakPolarHBondContact O-CG2 3.26Å; Y412-T416 PolarHBondContact O-N 2.87Å; Y412-T416 PolarHBondContact O-OG1 2.85Å; Y412-E519 HydrophobicContact CE2-CB 4.42Å; Y412-E519 HydrophobicContact CE2-CG 4.05Å; Y412-L522 HydrophobicContact CD2-CB 4.48Å; Y412-L522 HydrophobicContact CD2-CD2 3.59Å; Y412-L522 HydrophobicContact CD2-CG 3.99Å; Y412-L522 HydrophobicContact CE2-CB 4.4Å; Y412-L522 HydrophobicContact CE2-CD2 4.15Å; Y412-L522 HydrophobicContact CE2-CG 4.39Å
413	K	73.8	Confident	72.9	Confident	137 Å²	137	53.4 Å²	53.4	60%	0.596	27%	0.271	S	S	*	.	H	α-helix	trans	-56.4	-52.8	176.3	-73.3	178.1	179.8	-178.1	0	111.6	D409 V410 L411 F415 T416 D417	D409-K413 WeakPolarHBondContact O-CG 3.29Å; D409-K413 PolarHBondContact O-N 2.86Å; V410-K413 PolarHBondContact O-N 3.2Å; L411-K413 VanDerWaalsContact C-N 3.33Å; L411-K413 PolarHBondContact O-N 2.8Å; K413-F415 VanDerWaalsContact C-N 3.32Å; K413-F415 PolarHBondContact O-N 3.26Å; K413-T416 WeakPolarHBondContact CA-OG1 3.49Å; K413-T416 PolarHBondContact O-N 3.4Å; K413-T416 VanDerWaalsContact O-N 3.15Å; K413-T416 PolarHBondContact O-OG1 3.35Å; K413-D417 PolarHBondContact O-N 3.04Å
414	R	73	Confident	72	Confident	100 Å²	100	56.1 Å²	56.1	38%	0.377	28%	0.283	S	S	.	.	H	α-helix	trans	-56.7	-45.3	178.3	-72.3	-178	177.7	-162.1	-2.3	111.8	L338 V410 L411 Y412 D417 V418	L338-R414 HydrophobicContact CD2-CB 3.58Å; V410-R414 WeakPolarHBondContact O-CG 3.33Å; V410-R414 PolarHBondContact O-N 3.45Å; L411-R414 PolarHBondContact O-N 3.18Å; Y412-R414 PolarHBondContact O-N 3.49Å; R414-D417 PolarHBondContact O-N 2.86Å; R414-V418 WeakPolarHBondContact O-CG2 3.26Å; R414-V418 PolarHBondContact O-N 3.35Å
415	F	69.9	Low	71.2	Confident	18 Å²	18	64.5 Å²	64.5	8%	0.079	32%	0.315	C	S	.	.	H	α-helix	trans	-64.7	-40.5	177.7	-79.6	-60.4	0	0	0	113.5	L338 R347 L411 Y412 K413 D417 V418 Q419	L338-F415 HydrophobicContact CB-CE1 4.16Å; L338-F415 HydrophobicContact CB-CZ 4.45Å; L338-F415 HydrophobicContact CD1-CZ 4.2Å; L338-F415 HydrophobicContact CD2-CD1 4.22Å; L338-F415 HydrophobicContact CD2-CD2 4.37Å; L338-F415 HydrophobicContact CD2-CE1 3.97Å; L338-F415 HydrophobicContact CD2-CE2 4.11Å; L338-F415 HydrophobicContact CD2-CG 4.4Å; L338-F415 HydrophobicContact CD2-CZ 3.92Å; L338-F415 HydrophobicContact CG-CD1 4.33Å; L338-F415 HydrophobicContact CG-CE1 3.61Å; L338-F415 HydrophobicContact CG-CE2 4.11Å; L338-F415 HydrophobicContact CG-CZ 3.49Å; L338-F415 VanDerWaalsContact CG-CZ 3.49Å; L338-F415 WeakPolarHBondContact O-CE1 3.48Å; L338-F415 WeakPolarHBondContact O-CZ 3.34Å; R347-F415 VanDerWaalsContact CD-CZ 3.42Å; R347-F415 VanDerWaalsContact CZ-CD1 3.41Å; R347-F415 VanDerWaalsContact CZ-CE2 3.43Å; R347-F415 VanDerWaalsContact NH2-CD1 3.3Å; R347-F415 VanDerWaalsContact NH2-CG 3.34Å; L411-F415 HydrophobicContact CB-CD2 4.32Å; L411-F415 HydrophobicContact CB-CE2 4.3Å; L411-F415 HydrophobicContact CD2-CE2 4Å; L411-F415 WeakPolarHBondContact O-CB 3.47Å; L411-F415 WeakPolarHBondContact O-CD2 3.41Å; L411-F415 PolarHBondContact O-N 2.93Å; Y412-F415 PolarHBondContact O-N 3.34Å; K413-F415 VanDerWaalsContact C-N 3.32Å; K413-F415 PolarHBondContact O-N 3.26Å; F415-D417 PolarHBondContact O-N 3.34Å; F415-V418 PolarHBondContact O-N 3.36Å; F415-Q419 PolarHBondContact O-N 3.46Å
416	T	67.6	Low	70.4	Confident	21 Å²	21	67.7 Å²	67.7	13%	0.129	33%	0.329	C	S	.	.	H	α-helix	trans	-64.2	-33.8	175.2	54.4	0	0	0	0	111.7	Y412 K413 Q419 R420	Y412-T416 HydrophobicContact CD1-CG2 4.14Å; Y412-T416 HydrophobicContact CE1-CG2 3.74Å; Y412-T416 HydrophobicContact CE2-CG2 4.21Å; Y412-T416 WeakPolarHBondContact O-CG2 3.26Å; Y412-T416 PolarHBondContact O-N 2.87Å; Y412-T416 PolarHBondContact O-OG1 2.85Å; K413-T416 WeakPolarHBondContact CA-OG1 3.49Å; K413-T416 PolarHBondContact O-N 3.4Å; K413-T416 VanDerWaalsContact O-N 3.15Å; K413-T416 PolarHBondContact O-OG1 3.35Å; T416-Q419 PolarHBondContact O-N 3.22Å; T416-R420 WeakPolarHBondContact O-CG 3.34Å; T416-R420 PolarHBondContact O-N 3.42Å
417	D	68.2	Low	69.5	Low	65 Å²	65	69.3 Å²	69.3	35%	0.348	33%	0.331	S	S	.	.	H	α-helix	trans	-71.5	-39.8	176.1	-65.8	-27.2	0	0	0	111.7	L335 K413 R414 F415 Q419 R420 C421	L335-D417 HydrophobicContact CD2-CB 4.15Å; K413-D417 PolarHBondContact O-N 3.04Å; R414-D417 PolarHBondContact O-N 2.86Å; F415-D417 PolarHBondContact O-N 3.34Å; D417-Q419 VanDerWaalsContact C-N 3.26Å; D417-Q419 PolarHBondContact O-N 3.41Å; D417-R420 PolarHBondContact O-N 3.38Å; D417-R420 IonicContact OD1-NH1 3.16Å; D417-R420 PolarHBondContact OD1-NH1 2.96Å; D417-C421 WeakPolarHBondContact O-CB 3.44Å; D417-C421 PolarHBondContact O-N 2.64Å; D417-C421 PolarHBondContact O-SG 2.99Å
418	V	67.9	Low	68.7	Low	21 Å²	21	72.4 Å²	72.4	13%	0.127	35%	0.351	C	S	.	.	H	α-helix	trans	-54.2	-48.3	170.3	-179.7	0	0	0	0	110.4	L335 R414 F415 R420 C421 C422	L335-V418 HydrophobicContact CB-CG2 3.76Å; L335-V418 VanDerWaalsContact CD2-CA 3.46Å; L335-V418 HydrophobicContact CD2-CB 4Å; L335-V418 HydrophobicContact CD2-CG2 3.41Å; L335-V418 VanDerWaalsContact CD2-CG2 3.41Å; L335-V418 VanDerWaalsContact CD2-N 3.27Å; L335-V418 HydrophobicContact CG-CB 4.39Å; L335-V418 HydrophobicContact CG-CG2 3.3Å; L335-V418 WeakPolarHBondContact O-CG2 3.43Å; R414-V418 WeakPolarHBondContact O-CG2 3.26Å; R414-V418 PolarHBondContact O-N 3.35Å; F415-V418 PolarHBondContact O-N 3.36Å; V418-R420 VanDerWaalsContact C-N 3.34Å; V418-R420 PolarHBondContact O-N 2.81Å; V418-C421 PolarHBondContact O-N 3.48Å; V418-C422 WeakPolarHBondContact O-CB 3.38Å; V418-C422 PolarHBondContact O-N 3.41Å; V418-C422 PolarHBondContact O-SG 3.03Å
419	Q	66.3	Low	67.7	Low	32 Å²	32	76.2 Å²	76.2	15%	0.15	37%	0.371	C	S	.	.	H	α-helix	trans	-67.5	-36.3	-176.8	-168.3	-175.1	-46.5	0	0	112.1	F415 T416 D417 K423 I515 E519	F415-Q419 PolarHBondContact O-N 3.46Å; T416-Q419 PolarHBondContact O-N 3.22Å; D417-Q419 VanDerWaalsContact C-N 3.26Å; D417-Q419 PolarHBondContact O-N 3.41Å; Q419-K423 VanDerWaalsContact NE2-NZ 3.17Å; Q419-K423 WeakPolarHBondContact O-CB 3.43Å; Q419-K423 VanDerWaalsContact O-CG 3.24Å; Q419-K423 WeakPolarHBondContact O-CG 3.31Å; Q419-K423 PolarHBondContact O-N 3.49Å; Q419-I515 VanDerWaalsContact CD-CG2 3.45Å; Q419-E519 PolarHBondContact NE2-OE1 2.9Å; Q419-E519 PolarHBondContact OE1-OE1 3.04Å
420	R	68.3	Low	66.8	Low	153 Å²	153	77.1 Å²	77.1	58%	0.577	37%	0.373	S	S	*	.	H	α-helix	trans	-64.4	-45.2	171.7	-75.4	173.1	-176.8	158.4	-4.9	111.3	T416 D417 V418 C422 K423 L424	T416-R420 WeakPolarHBondContact O-CG 3.34Å; T416-R420 PolarHBondContact O-N 3.42Å; D417-R420 PolarHBondContact O-N 3.38Å; D417-R420 IonicContact OD1-NH1 3.16Å; D417-R420 PolarHBondContact OD1-NH1 2.96Å; V418-R420 VanDerWaalsContact C-N 3.34Å; V418-R420 PolarHBondContact O-N 2.81Å; R420-C422 PolarHBondContact O-N 3.46Å; R420-K423 PolarHBondContact O-N 3.41Å; R420-L424 WeakPolarHBondContact O-CB 3.43Å; R420-L424 WeakPolarHBondContact O-CD1 3.35Å; R420-L424 PolarHBondContact O-N 2.87Å
421	C	66.2	Low	65.8	Low	79 Å²	79	79 Å²	79	53%	0.534	38%	0.381	S	S	.	.	H	α-helix	trans	-62	-41	176.3	-69.3	0	0	0	0	112.1	D417 V418 L424 R425	D417-C421 WeakPolarHBondContact O-CB 3.44Å; D417-C421 PolarHBondContact O-N 2.64Å; D417-C421 PolarHBondContact O-SG 2.99Å; V418-C421 PolarHBondContact O-N 3.48Å; C421-L424 PolarHBondContact O-N 3.39Å; C421-R425 WeakPolarHBondContact O-CB 3.03Å; C421-R425 PolarHBondContact O-N 3.28Å
422	C	65.7	Low	64.4	Low	70 Å²	70	82.1 Å²	82.1	47%	0.473	40%	0.403	S	S	.	.	H	α-helix	trans	-65.5	-43	174.7	-68.9	0	0	0	0	112.2	V418 R420 R425 Q426	V418-C422 WeakPolarHBondContact O-CB 3.38Å; V418-C422 PolarHBondContact O-N 3.41Å; V418-C422 PolarHBondContact O-SG 3.03Å; R420-C422 PolarHBondContact O-N 3.46Å; C422-R425 PolarHBondContact O-N 3.21Å; C422-Q426 PolarHBondContact O-N 3.41Å
423	K	66.6	Low	63.4	Low	82 Å²	82	84.5 Å²	84.5	36%	0.357	42%	0.42	S	S	.	.	H	α-helix	trans	-61.1	-44.6	173.9	-76.1	170.1	176.2	174.6	0	111.4	Q419 R420 Q426 L427	Q419-K423 VanDerWaalsContact NE2-NZ 3.17Å; Q419-K423 WeakPolarHBondContact O-CB 3.43Å; Q419-K423 VanDerWaalsContact O-CG 3.24Å; Q419-K423 WeakPolarHBondContact O-CG 3.31Å; Q419-K423 PolarHBondContact O-N 3.49Å; R420-K423 PolarHBondContact O-N 3.41Å; K423-Q426 PolarHBondContact O-N 2.99Å; K423-L427 WeakPolarHBondContact O-CG 2.78Å; K423-L427 PolarHBondContact O-N 3.16Å
424	L	63.4	Low	62.3	Low	109 Å²	109	83.6 Å²	83.6	57%	0.571	42%	0.422	S	S	*	.	H	α-helix	trans	-63.1	-44.1	175.3	-105.6	86.9	0	0	0	111.4	R420 C421 Q426 L427 V428	R420-L424 WeakPolarHBondContact O-CB 3.43Å; R420-L424 WeakPolarHBondContact O-CD1 3.35Å; R420-L424 PolarHBondContact O-N 2.87Å; C421-L424 PolarHBondContact O-N 3.39Å; L424-Q426 VanDerWaalsContact C-N 3.26Å; L424-Q426 PolarHBondContact O-N 2.92Å; L424-L427 PolarHBondContact O-N 3.42Å; L424-V428 WeakPolarHBondContact O-CB 3.18Å; L424-V428 WeakPolarHBondContact O-CG2 3.13Å; L424-V428 PolarHBondContact O-N 2.92Å
425	R	64.5	Low	61.1	Low	177 Å²	177	85.6 Å²	85.6	67%	0.668	44%	0.435	S	S	*	.	H	α-helix	trans	-59.1	-40.7	178	-172.7	176.6	-178.1	-174.8	0.4	111.3	C421 C422 L429	C421-R425 WeakPolarHBondContact O-CB 3.03Å; C421-R425 PolarHBondContact O-N 3.28Å; C422-R425 PolarHBondContact O-N 3.21Å; R425-L429 HydrophobicContact CG-CD1 4.04Å; R425-L429 WeakPolarHBondContact O-CB 3.31Å; R425-L429 WeakPolarHBondContact O-CD1 3.49Å; R425-L429 VanDerWaalsContact O-CG 3.27Å; R425-L429 WeakPolarHBondContact O-CG 3.41Å; R425-L429 PolarHBondContact O-N 3.08Å
426	Q	61.3	Low	59.8	Low	73 Å²	73	89.3 Å²	89.3	34%	0.341	46%	0.459	S	S	.	.	H	α-helix	trans	-66.7	-43.9	176.4	-169.7	173.4	-1	0	0	111.9	C422 K423 L424 L429 E430	C422-Q426 PolarHBondContact O-N 3.41Å; K423-Q426 PolarHBondContact O-N 2.99Å; L424-Q426 VanDerWaalsContact C-N 3.26Å; L424-Q426 PolarHBondContact O-N 2.92Å; Q426-L429 PolarHBondContact O-N 3.07Å; Q426-E430 WeakPolarHBondContact O-CB 3.47Å; Q426-E430 WeakPolarHBondContact O-CG 3Å; Q426-E430 PolarHBondContact O-N 2.93Å
427	L	61	Low	58.4	Low	104 Å²	104	94.8 Å²	94.8	55%	0.545	49%	0.488	S	S	.	.	H	α-helix	trans	-65.7	-37.9	176.1	-70.2	169.4	0	0	0	112.5	K423 L424 E430 N431	K423-L427 WeakPolarHBondContact O-CG 2.78Å; K423-L427 PolarHBondContact O-N 3.16Å; L424-L427 PolarHBondContact O-N 3.42Å; L427-E430 PolarHBondContact O-N 3.42Å; L427-N431 WeakPolarHBondContact O-CB 3.33Å; L427-N431 PolarHBondContact O-N 3.45Å
428	V	63.2	Low	57.2	Low	81 Å²	81	99 Å²	99	49%	0.491	51%	0.51	S	S	.	.	H	α-helix	trans	-68	-42.4	176.1	171.2	0	0	0	0	110.4	L424 E430 N431 C432	L424-V428 WeakPolarHBondContact O-CB 3.18Å; L424-V428 WeakPolarHBondContact O-CG2 3.13Å; L424-V428 PolarHBondContact O-N 2.92Å; V428-E430 VanDerWaalsContact C-N 3.34Å; V428-E430 PolarHBondContact O-N 3.49Å; V428-N431 PolarHBondContact O-N 3.44Å; V428-C432 WeakPolarHBondContact O-CB 3.41Å; V428-C432 PolarHBondContact O-N 3.29Å; V428-C432 PolarHBondContact O-SG 3.28Å
429	L	58	Low	55.7	Low	95 Å²	95	102.5 Å²	102.5	50%	0.497	54%	0.536	S	S	.	.	H	α-helix	trans	-63.1	-40	173.8	-76.4	162.8	0	0	0	111.7	R425 Q426 N431 N433	R425-L429 HydrophobicContact CG-CD1 4.04Å; R425-L429 WeakPolarHBondContact O-CB 3.31Å; R425-L429 WeakPolarHBondContact O-CD1 3.49Å; R425-L429 VanDerWaalsContact O-CG 3.27Å; R425-L429 WeakPolarHBondContact O-CG 3.41Å; R425-L429 PolarHBondContact O-N 3.08Å; Q426-L429 PolarHBondContact O-N 3.07Å; L429-N431 VanDerWaalsContact C-N 3.34Å; L429-N433 WeakPolarHBondContact O-CB 3.39Å; L429-N433 PolarHBondContact O-N 2.95Å; L429-N433 VanDerWaalsContact O-N 3.13Å; L429-N433 PolarHBondContact O-ND2 3.02Å
430	E	56.2	Low	54.5	Low	75 Å²	75	111.6 Å²	111.6	35%	0.35	57%	0.569	S	S	.	*	H	α-helix	trans	-64.1	-37.3	173.8	-75.8	-177.8	158.9	0	0	112.2	Q426 L427 V428 N434	Q426-E430 WeakPolarHBondContact O-CB 3.47Å; Q426-E430 WeakPolarHBondContact O-CG 3Å; Q426-E430 PolarHBondContact O-N 2.93Å; L427-E430 PolarHBondContact O-N 3.42Å; V428-E430 VanDerWaalsContact C-N 3.34Å; V428-E430 PolarHBondContact O-N 3.49Å; E430-N434 PolarHBondContact O-N 3.25Å; E430-N434 PolarHBondContact O-ND2 2.83Å; E430-N434 VanDerWaalsContact O-ND2 3.08Å
431	N	54.1	Low	52.8	Low	94 Å²	94	111.9 Å²	111.9	50%	0.503	58%	0.58	S	S	.	*	H	α-helix	trans	-78.5	-36.1	177.7	-103.6	25.7	0	0	0	113.6	L427 V428 L429 N433 N434 H435	L427-N431 WeakPolarHBondContact O-CB 3.33Å; L427-N431 PolarHBondContact O-N 3.45Å; V428-N431 PolarHBondContact O-N 3.44Å; L429-N431 VanDerWaalsContact C-N 3.34Å; N431-N433 VanDerWaalsContact C-N 3.31Å; N431-N433 PolarHBondContact O-N 2.98Å; N431-N434 PolarHBondContact O-N 2.86Å; N431-N434 VanDerWaalsContact O-N 3.14Å; N431-H435 WeakPolarHBondContact O-CB 3.39Å; N431-H435 PolarHBondContact O-CD2 2.95Å; N431-H435 VanDerWaalsContact O-CD2 3.3Å; N431-H435 PolarHBondContact O-N 3.3Å; N431-H435 VanDerWaalsContact O-N 3.1Å
432	C	46.1	Very low	51.4	Low	71 Å²	71	116.8 Å²	116.8	48%	0.48	60%	0.598	S	S	.	*	H	α-helix	trans	-65.8	-36.1	175.9	-72.6	0	0	0	0	111.4	V428 N434 H435	V428-C432 WeakPolarHBondContact O-CB 3.41Å; V428-C432 PolarHBondContact O-N 3.29Å; V428-C432 PolarHBondContact O-SG 3.28Å; C432-N434 PolarHBondContact O-N 3.47Å; C432-H435 PolarHBondContact O-N 2.99Å
433	N	49.9	Very low	49.8	Very low	118 Å²	118	121.6 Å²	121.6	63%	0.631	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	-15.2	174.5	-69.3	-7.2	0	0	0	113.3	L429 N431	L429-N433 WeakPolarHBondContact O-CB 3.39Å; L429-N433 PolarHBondContact O-N 2.95Å; L429-N433 VanDerWaalsContact O-N 3.13Å; L429-N433 PolarHBondContact O-ND2 3.02Å; N431-N433 VanDerWaalsContact C-N 3.31Å; N431-N433 PolarHBondContact O-N 2.98Å
434	N	50.8	Low	48.4	Very low	118 Å²	118	123.3 Å²	123.3	63%	0.631	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	-12.2	175.8	-68.7	-20.9	0	0	0	113.1	E430 N431 C432	E430-N434 PolarHBondContact O-N 3.25Å; E430-N434 PolarHBondContact O-ND2 2.83Å; E430-N434 VanDerWaalsContact O-ND2 3.08Å; N431-N434 PolarHBondContact O-N 2.86Å; N431-N434 VanDerWaalsContact O-N 3.14Å; C432-N434 PolarHBondContact O-N 3.47Å
435	H	47.4	Very low	47.2	Very low	141 Å²	141	124 Å²	124	65%	0.653	64%	0.644	S	S	*	*	S	Bend	trans	-107.8	8.5	-176	-84.9	-62.5	0	0	0	114.7	N431 C432 N437	N431-H435 WeakPolarHBondContact O-CB 3.39Å; N431-H435 PolarHBondContact O-CD2 2.95Å; N431-H435 VanDerWaalsContact O-CD2 3.3Å; N431-H435 PolarHBondContact O-N 3.3Å; N431-H435 VanDerWaalsContact O-N 3.1Å; C432-H435 PolarHBondContact O-N 2.99Å; H435-N437 PolarHBondContact O-N 3.4Å
436	T	42.2	Very low	45.8	Very low	96 Å²	96	125.5 Å²	125.5	59%	0.589	66%	0.655	S	S	*	*	S	Bend	trans	-73.5	-3.4	174.8	40.2	0	0	0	0	114.4
437	N	39.8	Very low	44.5	Very low	137 Å²	137	132.1 Å²	132.1	73%	0.733	68%	0.679	S	S	*	*	S	Bend	trans	-113	78.6	173	-67	-10.8	0	0	0	109.6	H435	H435-N437 PolarHBondContact O-N 3.4Å
438	N	41.8	Very low	43.3	Very low	152 Å²	152	132 Å²	132	81%	0.813	69%	0.686	S	S	*	*	S	Bend	trans	160.5	107.2	145.4	-80.6	-22.7	0	0	0	111.5
439	S	37.8	Very low	41.8	Very low	96 Å²	96	134.7 Å²	134.7	67%	0.671	70%	0.698	S	S	*	*			trans	54.7	117	133.8	-125.5	0	0	0	0	120.5
440	R	40.1	Very low	40.9	Very low	222 Å²	222	137.6 Å²	137.6	84%	0.838	71%	0.714	S	S	*	*			trans	59.6	115.9	134.3	-62.8	177.5	-160.9	-171	3.8	118.7
441	I	33.9	Very low	39.9	Very low	160 Å²	160	143 Å²	143	82%	0.821	74%	0.736	S	S	*	*			trans	47	104.1	133.9	-48.6	169.6	0	0	0	115.4
442	M	35.5	Very low	39	Very low	182 Å²	182	148.2 Å²	148.2	90%	0.897	75%	0.754	S	S	*	*			trans	-155.7	120.5	142.9	-156.1	110.5	80.9	0	0	110.8
443	E	32.5	Very low	38.4	Very low	170 Å²	170	150.6 Å²	150.6	79%	0.794	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-53.8	149.8	162.6	-75.9	-179.6	132.1	0	0	110.9
444	P	37.5	Very low	37.9	Very low	119 Å²	119	149.8 Å²	149.8	77%	0.773	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-63.6	131.8	179.9	27.1	-33.5	0	0	0	110.5
445	P	38.5	Very low	37.1	Very low	124 Å²	124	152.1 Å²	152.1	81%	0.805	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-71.1	134	-171.2	27.5	-32.4	0	0	0	111.5	Y447	P445-Y447 PolarHBondContact O-N 3.34Å
446	K	35.3	Very low	36.5	Very low	208 Å²	208	153.6 Å²	153.6	90%	0.904	80%	0.801	S	S	*	*			trans	-65.3	113.3	166.6	-71.5	175	-179.5	169.2	0	108.7	S448	K446-S448 PolarHBondContact O-N 3.47Å
447	Y	33	Very low	36.3	Very low	212 Å²	212	157.6 Å²	157.6	83%	0.831	81%	0.812	S	S	*	*			trans	-83.6	108.6	176.6	-162	-92.4	0	0	0	109.8	P445	P445-Y447 PolarHBondContact O-N 3.34Å
448	S	36.6	Very low	36.1	Very low	101 Å²	101	159 Å²	159	71%	0.706	82%	0.817	S	S	*	*			trans	-83.5	137.6	164.6	49.7	0	0	0	0	109.9	K446 D450	K446-S448 PolarHBondContact O-N 3.47Å; S448-D450 PolarHBondContact O-N 2.95Å
449	D	30.6	Very low	35.6	Very low	138 Å²	138	160.9 Å²	160.9	74%	0.738	82%	0.818	S	S	*	*			trans	-55.8	125.7	175.1	-74.1	-58.6	0	0	0	112.2
450	D	38.9	Very low	35.5	Very low	156 Å²	156	164.8 Å²	164.8	83%	0.834	83%	0.825	S	S	*	*			trans	-146.6	118.9	142.4	-87.5	-39.8	0	0	0	109.9	S448	S448-D450 PolarHBondContact O-N 2.95Å
451	K	35.3	Very low	35.2	Very low	187 Å²	187	159.6 Å²	159.6	81%	0.813	82%	0.822	S	S	*	*			trans	-90.2	157.5	177.6	-78.3	178.9	176.6	171.7	0	110.1
452	K	35	Very low	35.1	Very low	204 Å²	204	161.6 Å²	161.6	89%	0.887	83%	0.825	S	S	*	*			trans	85.8	116.4	157	-74.2	177.3	170.1	-179.3	0	116.7
453	S	34.1	Very low	34.9	Very low	122 Å²	122	157.2 Å²	157.2	85%	0.853	82%	0.818	S	S	*	*				126.4	79.6	128.6	-159.8	0	0	0	0	113
454	A	38.3	Very low	34.9	Very low	101 Å²	101	154.7 Å²	154.7	84%	0.835	82%	0.817	S	S	*	*			trans	-161.2	56.5	157	0	0	0	0	0	109.4
455	L	35.8	Very low	34.5	Very low	166 Å²	166	155.8 Å²	155.8	87%	0.869	82%	0.821	S	S	*	*			trans	-111.5	57.1	162.8	-174.4	71.4	0	0	0	107.2
456	E	33.8	Very low	34.2	Very low	173 Å²	173	155 Å²	155	81%	0.808	82%	0.818	S	S	*	*			trans	-157.4	69.1	175.6	-80.2	-60	147.3	0	0	105.9
457	E	37.6	Very low	34.2	Very low	179 Å²	179	152.1 Å²	152.1	84%	0.836	81%	0.812	S	S	*	*	S	Bend	trans	-165.1	116.6	154.7	-110.4	164.6	-156.1	0	0	111.2
458	M	35.3	Very low	34	Very low	167 Å²	167	148.8 Å²	148.8	82%	0.823	81%	0.808	S	S	*	*			trans	77.8	68.6	149.9	-68.9	176.5	179.9	0	0	118.6
459	K	31.8	Very low	33.9	Very low	192 Å²	192	152.8 Å²	152.8	84%	0.835	82%	0.816	S	S	*	*				-56.1	145.2	121.6	-75	174.3	175.9	173.7	0	109.4
460	H	35.8	Very low	34	Very low	178 Å²	178	158.3 Å²	158.3	82%	0.824	83%	0.826	S	S	*	*			trans	89.3	125.8	-176.4	-53.2	-48.4	0	0	0	112.8
461	S	34.2	Very low	33.6	Very low	112 Å²	112	157 Å²	157	78%	0.783	82%	0.824	S	S	*	*			cis	-156.6	156.4	11.8	-161.1	0	0	0	0	110
462	K	32.6	Very low	33.6	Very low	202 Å²	202	157.5 Å²	157.5	88%	0.878	83%	0.826	S	S	*	*			trans	-57.9	138.9	174.8	-67.1	152.7	171	178.3	0	111.8
463	A	31.5	Very low	33.4	Very low	91 Å²	91	158 Å²	158	75%	0.752	83%	0.829	S	S	*	*				-175.5	137.5	124.4	0	0	0	0	0	110.1
464	P	32.5	Very low	33.4	Very low	117 Å²	117	155.5 Å²	155.5	76%	0.76	82%	0.822	S	S	*	*			trans	-80.7	-179.2	163	36.9	-30.1	0	0	0	109.3
465	V	28.9	Very low	33.2	Very low	141 Å²	141	160.7 Å²	160.7	86%	0.855	83%	0.826	S	S	*	*			trans	98.9	125.2	-177.7	-172.7	0	0	0	0	110.4
466	S	31.1	Very low	33.7	Very low	107 Å²	107	157.7 Å²	157.7	75%	0.748	81%	0.814	S	S	*	*			cis	-155.3	155.5	16.6	28.8	0	0	0	0	110.9
467	L	35.2	Very low	34	Very low	149 Å²	149	152.9 Å²	152.9	78%	0.78	80%	0.798	S	S	*	*			trans	-48.6	157.7	156.8	-152.4	79.6	0	0	0	112.3
468	D	28.5	Very low	34.4	Very low	141 Å²	141	148.8 Å²	148.8	75%	0.754	78%	0.781	S	S	*	*			trans	86	139.7	164.7	-69.1	-31.7	0	0	0	120.7
469	Q	34.6	Very low	35.1	Very low	185 Å²	185	147.6 Å²	147.6	86%	0.864	77%	0.774	S	S	*	*			trans	91.2	68.2	168.2	-52.9	-177.5	3.4	0	0	117.8
470	R	33.8	Very low	36	Very low	254 Å²	254	144.9 Å²	144.9	96%	0.958	76%	0.764	S	S	*	*			trans	-146	60.7	138.8	-138.9	171.6	-172.4	174.3	1.8	113.2
471	T	30.5	Very low	36.6	Very low	129 Å²	129	142.3 Å²	142.3	79%	0.791	76%	0.756	S	S	*	*			trans	-83.5	119.2	154.4	11.8	0	0	0	0	108.4
472	K	34.3	Very low	37.2	Very low	197 Å²	197	140.5 Å²	140.5	86%	0.857	74%	0.735	S	S	*	*			trans	151.2	130.1	139.9	-82.5	169.8	-176.8	-177.5	0	111.4
473	K	32.2	Very low	38.1	Very low	215 Å²	215	138.2 Å²	138.2	94%	0.935	73%	0.732	S	S	*	*	S	Bend	trans	83.9	116.3	170.4	-55.1	-178.1	178.2	-175.7	0	114.6
474	G	33.6	Very low	38.9	Very low	70 Å²	70	138.6 Å²	138.6	72%	0.722	73%	0.726	S	S	*	*			cis	-150	139.8	6.7	0	0	0	0	0	111.2	V476	G474-V476 PolarHBondContact O-N 2.91Å
475	K	33.5	Very low	39.6	Very low	209 Å²	209	141.1 Å²	141.1	91%	0.909	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-56.5	125.1	157.7	-81.1	176.1	166.6	-172.3	0	107.5
476	V	46.3	Very low	40.2	Very low	103 Å²	103	138 Å²	138	62%	0.624	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-99.4	122.1	155.2	178.2	0	0	0	0	106	G474 E480	G474-V476 PolarHBondContact O-N 2.91Å; V476-E480 WeakPolarHBondContact CG1-OE2 3.34Å
477	P	40.6	Very low	41.1	Very low	73 Å²	73	136.3 Å²	136.3	47%	0.474	70%	0.702	S	S	.	*	P	Polyproline II helix	trans	-58.2	147.2	-175.8	-25	34.5	0	0	0	113.8	E479 E480	P477-E479 VanDerWaalsContact CB-OE2 3.27Å; P477-E479 WeakPolarHBondContact CB-OE2 3.37Å; P477-E479 PolarHBondContact O-N 3.31Å; P477-E480 PolarHBondContact O-N 3Å
478	L	45.9	Very low	41.6	Very low	92 Å²	92	136.5 Å²	136.5	48%	0.482	70%	0.699	S	S	.	*	G	3₁₀ helix	trans	-60.7	-10.4	-178.1	-172.8	56.4	0	0	0	114	I494	L478-I494 HydrophobicContact CD1-CD1 3.4Å; L478-I494 HydrophobicContact CD2-CD1 3.58Å; L478-I494 HydrophobicContact CG-CD1 4.12Å
479	E	49.5	Very low	42.7	Very low	143 Å²	143	134.4 Å²	134.4	67%	0.668	68%	0.683	S	S	*	*	G	3₁₀ helix	trans	-70.8	-26.4	177.1	-69.1	127.7	178.4	0	0	113.2	P477	P477-E479 VanDerWaalsContact CB-OE2 3.27Å; P477-E479 WeakPolarHBondContact CB-OE2 3.37Å; P477-E479 PolarHBondContact O-N 3.31Å
480	E	51.3	Low	44.6	Very low	135 Å²	135	129.5 Å²	129.5	63%	0.631	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-83.2	-14.7	-178	-100.9	179.1	166.4	0	0	114.5	V476 P477	V476-E480 WeakPolarHBondContact CG1-OE2 3.34Å; P477-E480 PolarHBondContact O-N 3Å
481	L	47.3	Very low	46.5	Very low	123 Å²	123	124.7 Å²	124.7	64%	0.644	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-16.5	174.9	-98.1	86.5	0	0	0	113.3
482	Q	48.2	Very low	48.6	Very low	75 Å²	75	121.8 Å²	121.8	35%	0.35	64%	0.643	S	S	.	*	H	α-helix	trans	-73.7	-31.1	-175.9	-134.6	156.6	8.3	0	0	111.9	G486 Q488	Q482-G486 PolarHBondContact O-N 3.33Å; Q482-Q488 HydrophobicContact CG-CG 4.18Å; Q482-Q488 VanDerWaalsContact NE2-CG 3.27Å
483	D	51.3	Low	50.3	Low	154 Å²	154	116 Å²	116	82%	0.824	62%	0.62	S	S	*	*	H	α-helix	trans	-80.5	-15.3	-179.8	-83.1	-13.2	0	0	0	114.6
484	T	48.5	Very low	52.2	Low	99 Å²	99	107.9 Å²	107.9	61%	0.607	59%	0.586	S	S	*	*	H	α-helix	trans	-97.6	-24.7	-174.1	-54	0	0	0	0	113.7
485	Y	47.4	Very low	54.5	Low	170 Å²	170	110.9 Å²	110.9	67%	0.667	58%	0.581	S	S	*	*	H	α-helix	trans	-127.9	-0.5	-175.9	-74.7	-83.3	0	0	0	115.1	V487	Y485-V487 WeakPolarHBondContact O-CG2 3.4Å; Y485-V487 PolarHBondContact O-N 3.42Å
486	G	40.4	Very low	56.5	Low	74 Å²	74	109.7 Å²	109.7	76%	0.763	57%	0.571	S	S	*	*			trans	59.8	17.2	174.4	0	0	0	0	0	114.7	Q482	Q482-G486 PolarHBondContact O-N 3.33Å
487	V	50.6	Low	57.7	Low	73 Å²	73	109.7 Å²	109.7	44%	0.442	56%	0.563	S	S	.	*			trans	-119.1	111.3	-179.3	177.7	0	0	0	0	107.4	Y485 F489	Y485-V487 WeakPolarHBondContact O-CG2 3.4Å; Y485-V487 PolarHBondContact O-N 3.42Å; V487-F489 HydrophobicContact CB-CE2 4.21Å; V487-F489 HydrophobicContact CB-CZ 4.33Å; V487-F489 HydrophobicContact CG1-CD1 4.12Å; V487-F489 HydrophobicContact CG1-CD2 4.16Å; V487-F489 HydrophobicContact CG1-CE1 3.71Å; V487-F489 HydrophobicContact CG1-CE2 3.74Å; V487-F489 HydrophobicContact CG1-CG 4.35Å; V487-F489 HydrophobicContact CG1-CZ 3.51Å; V487-F489 PolarHBondContact O-N 2.9Å
488	Q	45.2	Very low	59.3	Low	152 Å²	152	112.6 Å²	112.6	71%	0.71	57%	0.57	S	S	*	*			trans	-76.3	109.3	169.2	-56.7	-158.1	14.2	0	0	108.1	Q482	Q482-Q488 HydrophobicContact CG-CG 4.18Å; Q482-Q488 VanDerWaalsContact NE2-CG 3.27Å
489	F	52.9	Low	61.1	Low	98 Å²	98	111.1 Å²	111.1	43%	0.43	57%	0.571	S	S	.	*			trans	-87.6	125.6	164	-64.6	-69.9	0	0	0	108.3	V487 E493 I494 F497	V487-F489 HydrophobicContact CB-CE2 4.21Å; V487-F489 HydrophobicContact CB-CZ 4.33Å; V487-F489 HydrophobicContact CG1-CD1 4.12Å; V487-F489 HydrophobicContact CG1-CD2 4.16Å; V487-F489 HydrophobicContact CG1-CE1 3.71Å; V487-F489 HydrophobicContact CG1-CE2 3.74Å; V487-F489 HydrophobicContact CG1-CG 4.35Å; V487-F489 HydrophobicContact CG1-CZ 3.51Å; V487-F489 PolarHBondContact O-N 2.9Å; F489-E493 WeakPolarHBondContact CA-OE2 3.47Å; F489-E493 HydrophobicContact CB-CB 4.36Å; F489-E493 HydrophobicContact CD1-CB 4.39Å; F489-I494 HydrophobicContact CB-CD1 4.42Å; F489-I494 HydrophobicContact CB-CG1 3.98Å; F489-F497 AromaticContact CD1-CE2 3.64Å; F489-F497 HydrophobicContact CD1-CE2 3.64Å; F489-F497 HydrophobicContact CD1-CZ 4.42Å; F489-F497 AromaticContact CE1-CE2 3.62Å; F489-F497 HydrophobicContact CE1-CE2 3.62Å; F489-F497 HydrophobicContact CE1-CZ 4.02Å; F489-F497 HydrophobicContact CG-CE2 4.44Å; F489-F497 HydrophobicContact CZ-CE2 4.42Å
490	T	72.8	Confident	62.2	Low	82 Å²	82	109.8 Å²	109.8	50%	0.503	57%	0.565	S	S	.	*			trans	-63.4	151.6	169.2	52.1	0	0	0	0	110.2	A492 E493 I494	T490-A492 PolarHBondContact O-N 2.9Å; T490-A492 VanDerWaalsContact O-N 3.14Å; T490-E493 PolarHBondContact N-OE2 2.88Å; T490-E493 WeakPolarHBondContact O-CA 3.48Å; T490-E493 WeakPolarHBondContact O-CB 3.37Å; T490-E493 PolarHBondContact O-N 3.45Å; T490-E493 WeakPolarHBondContact OG1-CG 3.29Å; T490-E493 PolarHBondContact OG1-OE2 3.26Å; T490-I494 PolarHBondContact O-N 3.3Å
491	E	73.5	Confident	63.2	Low	152 Å²	152	108.9 Å²	108.9	71%	0.71	56%	0.559	S	S	*	*	H	α-helix	trans	-54.6	-35.2	178.4	-170.5	166.3	-158.7	0	0	111.8	E493 I494 E495	E491-E493 PolarHBondContact O-N 2.83Å; E491-I494 PolarHBondContact O-N 3.35Å; E491-E495 PolarHBondContact O-N 3.45Å; E491-E495 VanDerWaalsContact O-N 3.16Å
492	A	75.9	Confident	64.6	Low	68 Å²	68	108.1 Å²	108.1	56%	0.562	55%	0.552	S	S	*	*	H	α-helix	trans	-64.6	-32.9	173	0	0	0	0	0	114.3	T490 R496	T490-A492 PolarHBondContact O-N 2.9Å; T490-A492 VanDerWaalsContact O-N 3.14Å; A492-R496 WeakPolarHBondContact O-CB 3.3Å; A492-R496 PolarHBondContact O-N 3.34Å; A492-R496 VanDerWaalsContact O-N 3.08Å
493	E	70.2	Confident	66	Low	76 Å²	76	109.1 Å²	109.1	36%	0.355	56%	0.557	S	S	.	*	H	α-helix	trans	-72.7	-37	176.4	-76.5	166.2	144.5	0	0	111.4	F489 T490 E491 R496 F497	F489-E493 WeakPolarHBondContact CA-OE2 3.47Å; F489-E493 HydrophobicContact CB-CB 4.36Å; F489-E493 HydrophobicContact CD1-CB 4.39Å; T490-E493 PolarHBondContact N-OE2 2.88Å; T490-E493 WeakPolarHBondContact O-CA 3.48Å; T490-E493 WeakPolarHBondContact O-CB 3.37Å; T490-E493 PolarHBondContact O-N 3.45Å; T490-E493 WeakPolarHBondContact OG1-CG 3.29Å; T490-E493 PolarHBondContact OG1-OE2 3.26Å; E491-E493 PolarHBondContact O-N 2.83Å; E493-R496 WeakPolarHBondContact O-CB 3.39Å; E493-R496 PolarHBondContact O-N 2.68Å; E493-F497 HydrophobicContact CB-CD2 4.49Å; E493-F497 HydrophobicContact CB-CE2 4.2Å; E493-F497 WeakPolarHBondContact O-CD2 3.34Å; E493-F497 WeakPolarHBondContact O-CG 3.19Å; E493-F497 PolarHBondContact O-N 2.91Å
494	I	71.4	Confident	66.9	Low	45 Å²	45	104.3 Å²	104.3	23%	0.231	54%	0.538	C	S	.	.	H	α-helix	trans	-65.5	-43.8	177.3	-61.1	169.8	0	0	0	110.6	L478 F489 T490 E491 R496 F497 Q498	L478-I494 HydrophobicContact CD1-CD1 3.4Å; L478-I494 HydrophobicContact CD2-CD1 3.58Å; L478-I494 HydrophobicContact CG-CD1 4.12Å; F489-I494 HydrophobicContact CB-CD1 4.42Å; F489-I494 HydrophobicContact CB-CG1 3.98Å; T490-I494 PolarHBondContact O-N 3.3Å; E491-I494 PolarHBondContact O-N 3.35Å; I494-R496 VanDerWaalsContact C-N 3.34Å; I494-F497 PolarHBondContact O-N 3.44Å; I494-Q498 WeakPolarHBondContact O-CG 3.11Å; I494-Q498 PolarHBondContact O-N 2.89Å
495	E	81.1	Confident	67.8	Low	133 Å²	133	105.2 Å²	105.2	62%	0.621	53%	0.531	S	S	*	.	H	α-helix	trans	-61.8	-42.6	173.8	-71.7	-172.2	163.6	0	0	111.7	E491 F497 Q498 A499	E491-E495 PolarHBondContact O-N 3.45Å; E491-E495 VanDerWaalsContact O-N 3.16Å; E495-F497 PolarHBondContact O-N 2.89Å; E495-Q498 PolarHBondContact O-N 3.03Å; E495-A499 WeakPolarHBondContact O-CB 3.49Å; E495-A499 PolarHBondContact O-N 3.31Å
496	R	75.9	Confident	69.1	Low	184 Å²	184	100.7 Å²	100.7	69%	0.694	52%	0.52	S	S	*	.	H	α-helix	trans	-60.3	-43.9	174.9	-175.7	-176.9	-78.6	-170.8	-3.1	111.8	A492 E493 I494 Q498 A499 E500	A492-R496 WeakPolarHBondContact O-CB 3.3Å; A492-R496 PolarHBondContact O-N 3.34Å; A492-R496 VanDerWaalsContact O-N 3.08Å; E493-R496 WeakPolarHBondContact O-CB 3.39Å; E493-R496 PolarHBondContact O-N 2.68Å; I494-R496 VanDerWaalsContact C-N 3.34Å; R496-Q498 PolarHBondContact O-N 2.92Å; R496-A499 PolarHBondContact O-N 3.27Å; R496-E500 WeakPolarHBondContact O-CB 3.48Å; R496-E500 PolarHBondContact O-N 3.25Å
497	F	72.7	Confident	70.3	Confident	103 Å²	103	104 Å²	104	45%	0.452	51%	0.51	S	S	.	.	H	α-helix	trans	-65.7	-35.9	177.3	-73.6	-54.2	0	0	0	112.8	F489 E493 I494 E495 K501	F489-F497 AromaticContact CD1-CE2 3.64Å; F489-F497 HydrophobicContact CD1-CE2 3.64Å; F489-F497 HydrophobicContact CD1-CZ 4.42Å; F489-F497 AromaticContact CE1-CE2 3.62Å; F489-F497 HydrophobicContact CE1-CE2 3.62Å; F489-F497 HydrophobicContact CE1-CZ 4.02Å; F489-F497 HydrophobicContact CG-CE2 4.44Å; F489-F497 HydrophobicContact CZ-CE2 4.42Å; E493-F497 HydrophobicContact CB-CD2 4.49Å; E493-F497 HydrophobicContact CB-CE2 4.2Å; E493-F497 WeakPolarHBondContact O-CD2 3.34Å; E493-F497 WeakPolarHBondContact O-CG 3.19Å; E493-F497 PolarHBondContact O-N 2.91Å; I494-F497 PolarHBondContact O-N 3.44Å; E495-F497 PolarHBondContact O-N 2.89Å; F497-K501 VanDerWaalsContact O-CB 3.29Å; F497-K501 WeakPolarHBondContact O-CB 3.38Å; F497-K501 PolarHBondContact O-N 3.26Å
498	Q	74.4	Confident	70.7	Confident	133 Å²	133	104.9 Å²	104.9	62%	0.621	51%	0.51	S	S	*	.	H	α-helix	trans	-68.7	-40.6	175	-71	-173.6	11	0	0	111.9	I494 E495 R496 K501 Q502	I494-Q498 WeakPolarHBondContact O-CG 3.11Å; I494-Q498 PolarHBondContact O-N 2.89Å; E495-Q498 PolarHBondContact O-N 3.03Å; R496-Q498 PolarHBondContact O-N 2.92Å; Q498-K501 PolarHBondContact O-N 2.82Å; Q498-Q502 PolarHBondContact O-N 3.15Å
499	A	82.9	Confident	71.5	Confident	62 Å²	62	99.7 Å²	99.7	51%	0.512	49%	0.491	S	S	.	.	H	α-helix	trans	-62.3	-46	173.4	0	0	0	0	0	111.5	E495 R496 K501 Q502 E503	E495-A499 WeakPolarHBondContact O-CB 3.49Å; E495-A499 PolarHBondContact O-N 3.31Å; R496-A499 PolarHBondContact O-N 3.27Å; A499-K501 PolarHBondContact O-N 3.37Å; A499-Q502 PolarHBondContact O-N 2.89Å; A499-E503 WeakPolarHBondContact O-CB 3.32Å; A499-E503 PolarHBondContact O-N 3.42Å
500	E	71.9	Confident	72.1	Confident	114 Å²	114	98.3 Å²	98.3	53%	0.533	49%	0.49	S	S	.	.	H	α-helix	trans	-62.8	-41.6	177.3	-174.6	175.5	-170.4	0	0	111.9	R496 Q502 E503 A504	R496-E500 WeakPolarHBondContact O-CB 3.48Å; R496-E500 PolarHBondContact O-N 3.25Å; E500-Q502 VanDerWaalsContact C-N 3.34Å; E500-Q502 PolarHBondContact O-N 3.48Å; E500-E503 PolarHBondContact O-N 3.26Å; E500-A504 VanDerWaalsContact O-CB 3.27Å; E500-A504 WeakPolarHBondContact O-CB 3.36Å; E500-A504 PolarHBondContact O-N 3.19Å
501	K	73.6	Confident	71.4	Confident	116 Å²	116	99.8 Å²	99.8	50%	0.504	49%	0.491	S	S	.	.	H	α-helix	trans	-60.8	-42.9	174.7	-177.9	177.1	-179.3	174.5	0	111.8	F497 Q498 A499 R505	F497-K501 VanDerWaalsContact O-CB 3.29Å; F497-K501 WeakPolarHBondContact O-CB 3.38Å; F497-K501 PolarHBondContact O-N 3.26Å; Q498-K501 PolarHBondContact O-N 2.82Å; A499-K501 PolarHBondContact O-N 3.37Å; K501-R505 WeakPolarHBondContact O-CG 3.24Å; K501-R505 PolarHBondContact O-N 3.09Å; K501-R505 VanDerWaalsContact O-N 3.08Å
502	Q	75.5	Confident	70.6	Confident	107 Å²	107	97.7 Å²	97.7	50%	0.5	48%	0.48	S	S	.	.	H	α-helix	trans	-71	-39.7	179.1	-173.4	59.8	13.4	0	0	111.6	Q498 A499 E500 R505 V506	Q498-Q502 PolarHBondContact O-N 3.15Å; A499-Q502 PolarHBondContact O-N 2.89Å; E500-Q502 VanDerWaalsContact C-N 3.34Å; E500-Q502 PolarHBondContact O-N 3.48Å; Q502-R505 WeakPolarHBondContact O-CB 3.41Å; Q502-R505 PolarHBondContact O-N 2.92Å; Q502-V506 WeakPolarHBondContact O-CG2 3.13Å; Q502-V506 PolarHBondContact O-N 3.42Å
503	E	77.4	Confident	70.1	Confident	96 Å²	96	101.8 Å²	101.8	45%	0.449	48%	0.481	S	S	.	.	H	α-helix	trans	-62.4	-44.5	173.9	-169.1	-176.2	179	0	0	111.4	A499 E500 R505 V506 R507	A499-E503 WeakPolarHBondContact O-CB 3.32Å; A499-E503 PolarHBondContact O-N 3.42Å; E500-E503 PolarHBondContact O-N 3.26Å; E503-R505 VanDerWaalsContact C-N 3.29Å; E503-R505 PolarHBondContact O-N 2.8Å; E503-V506 PolarHBondContact O-N 3.01Å; E503-V506 VanDerWaalsContact O-N 3.13Å; E503-R507 HydrophobicContact CG-CG 4.43Å; E503-R507 WeakPolarHBondContact O-CG 3.38Å; E503-R507 PolarHBondContact O-N 3.34Å; E503-R507 IonicContact OE1-CZ 2.8Å; E503-R507 IonicContact OE1-NE 3.72Å; E503-R507 PolarHBondContact OE1-NE 3.01Å; E503-R507 VanDerWaalsContact OE1-NE 3.08Å; E503-R507 IonicContact OE1-NH2 2.8Å; E503-R507 PolarHBondContact OE1-NH2 3.18Å; E503-R507 IonicContact OE2-NH2 2.75Å; E503-R507 PolarHBondContact OE2-NH2 3Å
504	A	71.3	Confident	69.3	Low	53 Å²	53	102.5 Å²	102.5	44%	0.438	49%	0.487	S	S	.	.	H	α-helix	trans	-59	-40.5	175.7	0	0	0	0	0	111.7	E500 M508	E500-A504 VanDerWaalsContact O-CB 3.27Å; E500-A504 WeakPolarHBondContact O-CB 3.36Å; E500-A504 PolarHBondContact O-N 3.19Å; A504-M508 VanDerWaalsContact O-CB 3.24Å; A504-M508 WeakPolarHBondContact O-CB 3.45Å; A504-M508 PolarHBondContact O-N 3.39Å
505	R	67.6	Low	68.7	Low	119 Å²	119	102.2 Å²	102.2	45%	0.449	49%	0.485	S	S	.	.	H	α-helix	trans	-63.9	-42.5	173.6	-76.5	173.5	173.6	173.1	-5.5	112.5	K501 Q502 E503 M508 S509	K501-R505 WeakPolarHBondContact O-CG 3.24Å; K501-R505 PolarHBondContact O-N 3.09Å; K501-R505 VanDerWaalsContact O-N 3.08Å; Q502-R505 WeakPolarHBondContact O-CB 3.41Å; Q502-R505 PolarHBondContact O-N 2.92Å; E503-R505 VanDerWaalsContact C-N 3.29Å; E503-R505 PolarHBondContact O-N 2.8Å; R505-M508 PolarHBondContact O-N 3.38Å; R505-S509 WeakPolarHBondContact O-CB 3.33Å; R505-S509 PolarHBondContact O-N 2.75Å
506	V	74	Confident	67.9	Low	74 Å²	74	100.3 Å²	100.3	45%	0.448	48%	0.477	S	S	.	.	H	α-helix	trans	-65	-49.6	177.7	171.8	0	0	0	0	110.5	Q502 E503 M508 S509 V510	Q502-V506 WeakPolarHBondContact O-CG2 3.13Å; Q502-V506 PolarHBondContact O-N 3.42Å; E503-V506 PolarHBondContact O-N 3.01Å; E503-V506 VanDerWaalsContact O-N 3.13Å; V506-M508 VanDerWaalsContact C-N 3.27Å; V506-M508 PolarHBondContact O-N 3Å; V506-S509 WeakPolarHBondContact O-CB 3.24Å; V506-S509 PolarHBondContact O-N 2.96Å; V506-S509 PolarHBondContact O-OG 3.47Å; V506-V510 PolarHBondContact O-N 2.91Å
507	R	65	Low	67.4	Low	144 Å²	144	95.7 Å²	95.7	54%	0.543	47%	0.465	S	S	.	.	H	α-helix	trans	-55.7	-43.9	174.6	-69.8	-177.4	-164.9	169.7	2.1	110.7	E503 S509 V510 H511	E503-R507 HydrophobicContact CG-CG 4.43Å; E503-R507 WeakPolarHBondContact O-CG 3.38Å; E503-R507 PolarHBondContact O-N 3.34Å; E503-R507 IonicContact OE1-CZ 2.8Å; E503-R507 IonicContact OE1-NE 3.72Å; E503-R507 PolarHBondContact OE1-NE 3.01Å; E503-R507 VanDerWaalsContact OE1-NE 3.08Å; E503-R507 IonicContact OE1-NH2 2.8Å; E503-R507 PolarHBondContact OE1-NH2 3.18Å; E503-R507 IonicContact OE2-NH2 2.75Å; E503-R507 PolarHBondContact OE2-NH2 3Å; R507-S509 VanDerWaalsContact C-N 3.34Å; R507-S509 PolarHBondContact O-N 3.18Å; R507-V510 PolarHBondContact O-N 2.98Å; R507-H511 PolarHBondContact O-N 2.96Å; R507-H511 PolarHBondContact O-ND1 3.39Å
508	M	58.9	Low	66.8	Low	91 Å²	91	92.6 Å²	92.6	45%	0.448	46%	0.455	S	S	.	.	H	α-helix	trans	-63.9	-37.5	177.1	-166.4	59.7	62.4	0	0	112.5	A504 R505 V506 H511 K512	A504-M508 VanDerWaalsContact O-CB 3.24Å; A504-M508 WeakPolarHBondContact O-CB 3.45Å; A504-M508 PolarHBondContact O-N 3.39Å; R505-M508 PolarHBondContact O-N 3.38Å; V506-M508 VanDerWaalsContact C-N 3.27Å; V506-M508 PolarHBondContact O-N 3Å; M508-H511 PolarHBondContact O-N 3.37Å; M508-K512 WeakPolarHBondContact O-CB 3.33Å; M508-K512 PolarHBondContact O-N 3.3Å
509	S	63.5	Low	66.1	Low	43 Å²	43	88.1 Å²	88.1	30%	0.301	43%	0.434	S	S	.	.	H	α-helix	trans	-66.8	-35.8	177.3	83	0	0	0	0	112.9	R505 V506 R507 R513	R505-S509 WeakPolarHBondContact O-CB 3.33Å; R505-S509 PolarHBondContact O-N 2.75Å; V506-S509 WeakPolarHBondContact O-CB 3.24Å; V506-S509 PolarHBondContact O-N 2.96Å; V506-S509 PolarHBondContact O-OG 3.47Å; R507-S509 VanDerWaalsContact C-N 3.34Å; R507-S509 PolarHBondContact O-N 3.18Å; S509-R513 PolarHBondContact O-N 3.35Å; S509-R513 PolarHBondContact O-NH1 3.36Å
510	V	64.8	Low	65.3	Low	69 Å²	69	90 Å²	90	42%	0.418	43%	0.432	S	S	.	.	H	α-helix	trans	-67.3	-50.1	174.7	174.3	0	0	0	0	109.5	V506 R507 K512 R513 D514	V506-V510 PolarHBondContact O-N 2.91Å; R507-V510 PolarHBondContact O-N 2.98Å; V510-K512 VanDerWaalsContact C-N 3.26Å; V510-K512 PolarHBondContact O-N 3.03Å; V510-R513 PolarHBondContact O-N 2.91Å; V510-R513 VanDerWaalsContact O-N 3.09Å; V510-D514 PolarHBondContact O-N 3.31Å; V510-D514 VanDerWaalsContact O-N 3.14Å
511	H	58.6	Low	64.9	Low	113 Å²	113	91.1 Å²	91.1	52%	0.523	44%	0.435	S	S	.	.	H	α-helix	trans	-56.9	-40.4	176	-74.9	78.7	0	0	0	111.6	R507 M508 R513 D514 I515	R507-H511 PolarHBondContact O-N 2.96Å; R507-H511 PolarHBondContact O-ND1 3.39Å; M508-H511 PolarHBondContact O-N 3.37Å; H511-R513 PolarHBondContact O-N 3.41Å; H511-D514 PolarHBondContact O-N 2.9Å; H511-I515 VanDerWaalsContact O-CB 3.25Å; H511-I515 WeakPolarHBondContact O-CB 3.49Å; H511-I515 VanDerWaalsContact O-CD1 3.24Å; H511-I515 WeakPolarHBondContact O-CD1 3.32Å; H511-I515 WeakPolarHBondContact O-CG1 3.31Å; H511-I515 PolarHBondContact O-N 2.93Å
512	K	56.9	Low	64.4	Low	109 Å²	109	87.2 Å²	87.2	47%	0.474	42%	0.42	S	S	.	.	H	α-helix	trans	-59.5	-42.8	177	-175.2	-178.9	172.8	-174.6	0	112.9	M508 V510 I515 E516	M508-K512 WeakPolarHBondContact O-CB 3.33Å; M508-K512 PolarHBondContact O-N 3.3Å; V510-K512 VanDerWaalsContact C-N 3.26Å; V510-K512 PolarHBondContact O-N 3.03Å; K512-I515 WeakPolarHBondContact O-CB 3.48Å; K512-I515 PolarHBondContact O-N 3.12Å; K512-E516 WeakPolarHBondContact CE-OE1 3.35Å; K512-E516 WeakPolarHBondContact O-CG 3.5Å; K512-E516 PolarHBondContact O-N 3.11Å
513	R	63.7	Low	63.9	Low	153 Å²	153	84.6 Å²	84.6	58%	0.577	41%	0.413	S	S	*	.	H	α-helix	trans	-68.8	-42.6	179.6	-69.5	-172	-167.2	89.4	-7.2	112.2	S509 V510 H511 I515 E516 L517	S509-R513 PolarHBondContact O-N 3.35Å; S509-R513 PolarHBondContact O-NH1 3.36Å; V510-R513 PolarHBondContact O-N 2.91Å; V510-R513 VanDerWaalsContact O-N 3.09Å; H511-R513 PolarHBondContact O-N 3.41Å; R513-I515 PolarHBondContact O-N 3.07Å; R513-E516 PolarHBondContact O-N 3.35Å; R513-L517 PolarHBondContact O-N 3.18Å
514	D	55.1	Low	63.4	Low	92 Å²	92	85.6 Å²	85.6	49%	0.492	42%	0.416	S	S	.	.	H	α-helix	trans	-63.3	-36.1	176.4	-68	-19.9	0	0	0	111.3	V510 H511 V518	V510-D514 PolarHBondContact O-N 3.31Å; V510-D514 VanDerWaalsContact O-N 3.14Å; H511-D514 PolarHBondContact O-N 2.9Å; D514-V518 WeakPolarHBondContact O-CB 3.37Å; D514-V518 WeakPolarHBondContact O-CG2 3.45Å; D514-V518 PolarHBondContact O-N 2.91Å
515	I	58.4	Low	62.9	Low	38 Å²	38	85.3 Å²	85.3	20%	0.195	41%	0.407	C	S	.	.	H	α-helix	trans	-63.2	-47.6	173.3	-72.5	166.2	0	0	0	111.2	R344 Q419 H511 K512 R513 L517 V518 E519	R344-I515 VanDerWaalsContact CZ-CA 3.5Å; R344-I515 VanDerWaalsContact CZ-O 3.31Å; R344-I515 VanDerWaalsContact NH1-CA 3.3Å; R344-I515 VanDerWaalsContact NH1-CB 3.31Å; R344-I515 VanDerWaalsContact NH1-CG1 3.31Å; R344-I515 PolarHBondContact NH2-O 2.8Å; Q419-I515 VanDerWaalsContact CD-CG2 3.45Å; H511-I515 VanDerWaalsContact O-CB 3.25Å; H511-I515 WeakPolarHBondContact O-CB 3.49Å; H511-I515 VanDerWaalsContact O-CD1 3.24Å; H511-I515 WeakPolarHBondContact O-CD1 3.32Å; H511-I515 WeakPolarHBondContact O-CG1 3.31Å; H511-I515 PolarHBondContact O-N 2.93Å; K512-I515 WeakPolarHBondContact O-CB 3.48Å; K512-I515 PolarHBondContact O-N 3.12Å; R513-I515 PolarHBondContact O-N 3.07Å; I515-L517 VanDerWaalsContact C-N 3.35Å; I515-L517 PolarHBondContact O-N 3.43Å; I515-V518 PolarHBondContact O-N 3.43Å; I515-E519 VanDerWaalsContact CG2-OE1 3.24Å; I515-E519 WeakPolarHBondContact CG2-OE1 3.42Å; I515-E519 WeakPolarHBondContact O-CB 3.32Å; I515-E519 PolarHBondContact O-N 3.27Å
516	E	63.3	Low	62.5	Low	93 Å²	93	80.8 Å²	80.8	44%	0.435	39%	0.394	S	S	.	.	H	α-helix	trans	-63.8	-41.3	179.6	-73.6	168.2	-173.7	0	0	111.6	K512 R513 V518 E519 Q520	K512-E516 WeakPolarHBondContact CE-OE1 3.35Å; K512-E516 WeakPolarHBondContact O-CG 3.5Å; K512-E516 PolarHBondContact O-N 3.11Å; R513-E516 PolarHBondContact O-N 3.35Å; E516-V518 PolarHBondContact O-N 2.88Å; E516-E519 PolarHBondContact O-N 3.14Å; E516-Q520 WeakPolarHBondContact O-CB 3.46Å; E516-Q520 PolarHBondContact O-N 3.29Å
517	L	65.9	Low	61.9	Low	87 Å²	87	80.2 Å²	80.2	46%	0.455	39%	0.392	S	S	.	.	H	α-helix	trans	-62	-44.7	178.1	-178.2	67.9	0	0	0	112.3	R513 I515 Q520 K521	R513-L517 PolarHBondContact O-N 3.18Å; I515-L517 VanDerWaalsContact C-N 3.35Å; I515-L517 PolarHBondContact O-N 3.43Å; L517-Q520 PolarHBondContact O-N 3Å; L517-K521 PolarHBondContact O-N 2.87Å; L517-K521 VanDerWaalsContact O-N 3.07Å
518	V	59.1	Low	62	Low	38 Å²	38	78.9 Å²	78.9	23%	0.23	40%	0.396	C	S	.	.	H	α-helix	trans	-73.9	-31.1	-179.5	171.7	0	0	0	0	111.3	R344 V348 D514 I515 E516 Q520 K521 L522	R344-V518 HydrophobicContact CG-CG1 4.11Å; R344-V518 VanDerWaalsContact NE-CB 3.32Å; R344-V518 VanDerWaalsContact NH2-C 3.33Å; V348-V518 HydrophobicContact CG2-CG1 3.71Å; D514-V518 WeakPolarHBondContact O-CB 3.37Å; D514-V518 WeakPolarHBondContact O-CG2 3.45Å; D514-V518 PolarHBondContact O-N 2.91Å; I515-V518 PolarHBondContact O-N 3.43Å; E516-V518 PolarHBondContact O-N 2.88Å; V518-Q520 VanDerWaalsContact C-N 3.33Å; V518-K521 PolarHBondContact O-N 3.5Å; V518-L522 WeakPolarHBondContact O-CB 3.32Å; V518-L522 PolarHBondContact O-N 2.87Å
519	E	60.7	Low	62.2	Low	39 Å²	39	74.8 Å²	74.8	18%	0.182	38%	0.375	C	S	.	.	H	α-helix	trans	-62.1	-44.5	172.3	-91	168.4	-148.5	0	0	109.9	Y412 Q419 I515 E516 K521 L522 S523	Y412-E519 HydrophobicContact CE2-CB 4.42Å; Y412-E519 HydrophobicContact CE2-CG 4.05Å; Q419-E519 PolarHBondContact NE2-OE1 2.9Å; Q419-E519 PolarHBondContact OE1-OE1 3.04Å; I515-E519 VanDerWaalsContact CG2-OE1 3.24Å; I515-E519 WeakPolarHBondContact CG2-OE1 3.42Å; I515-E519 WeakPolarHBondContact O-CB 3.32Å; I515-E519 PolarHBondContact O-N 3.27Å; E516-E519 PolarHBondContact O-N 3.14Å; E519-K521 PolarHBondContact O-N 2.85Å; E519-L522 PolarHBondContact O-N 3.36Å; E519-S523 WeakPolarHBondContact O-CB 3.39Å; E519-S523 PolarHBondContact O-N 2.92Å; E519-S523 PolarHBondContact O-OG 3.4Å
520	Q	65.9	Low	62.3	Low	102 Å²	102	78 Å²	78	48%	0.477	38%	0.384	S	S	.	.	H	α-helix	trans	-64.1	-38.5	177.2	-164.7	-171.9	18.9	0	0	112.9	E516 L517 V518 S523 K524	E516-Q520 WeakPolarHBondContact O-CB 3.46Å; E516-Q520 PolarHBondContact O-N 3.29Å; L517-Q520 PolarHBondContact O-N 3Å; V518-Q520 VanDerWaalsContact C-N 3.33Å; Q520-S523 PolarHBondContact O-OG 3.37Å; Q520-S523 VanDerWaalsContact O-OG 3.05Å; Q520-K524 WeakPolarHBondContact O-CB 3.38Å; Q520-K524 VanDerWaalsContact O-CG 3.3Å; Q520-K524 WeakPolarHBondContact O-CG 3.43Å; Q520-K524 PolarHBondContact O-N 3.47Å
521	K	64.1	Low	62.3	Low	138 Å²	138	77.9 Å²	77.9	60%	0.6	38%	0.383	S	S	*	.	H	α-helix	trans	-66.7	-41.3	175.1	-73.2	-175.7	-179.4	-178.8	0	111.5	L517 V518 E519 L525	L517-K521 PolarHBondContact O-N 2.87Å; L517-K521 VanDerWaalsContact O-N 3.07Å; V518-K521 PolarHBondContact O-N 3.5Å; E519-K521 PolarHBondContact O-N 2.85Å; K521-L525 WeakPolarHBondContact O-CB 3.45Å; K521-L525 PolarHBondContact O-N 3.1Å; K521-L525 VanDerWaalsContact O-N 3.1Å
522	L	63	Low	62.3	Low	34 Å²	34	75.1 Å²	75.1	18%	0.178	37%	0.37	C	S	.	.	H	α-helix	trans	-72.7	-36.8	-178.4	-170.8	57.1	0	0	0	112.1	Y412 V518 E519 L525 S526	Y412-L522 HydrophobicContact CD2-CB 4.48Å; Y412-L522 HydrophobicContact CD2-CD2 3.59Å; Y412-L522 HydrophobicContact CD2-CG 3.99Å; Y412-L522 HydrophobicContact CE2-CB 4.4Å; Y412-L522 HydrophobicContact CE2-CD2 4.15Å; Y412-L522 HydrophobicContact CE2-CG 4.39Å; V518-L522 WeakPolarHBondContact O-CB 3.32Å; V518-L522 PolarHBondContact O-N 2.87Å; E519-L522 PolarHBondContact O-N 3.36Å; L522-L525 WeakPolarHBondContact O-CB 3.45Å; L522-L525 PolarHBondContact O-N 3.3Å; L522-S526 PolarHBondContact O-N 3.4Å
523	S	65.3	Low	62.5	Low	52 Å²	52	70 Å²	70	36%	0.364	35%	0.348	S	S	.	.	H	α-helix	trans	-65.9	-44.3	175.2	68.2	0	0	0	0	112.1	E519 Q520 L525 S526 S527	E519-S523 WeakPolarHBondContact O-CB 3.39Å; E519-S523 PolarHBondContact O-N 2.92Å; E519-S523 PolarHBondContact O-OG 3.4Å; Q520-S523 PolarHBondContact O-OG 3.37Å; Q520-S523 VanDerWaalsContact O-OG 3.05Å; S523-L525 VanDerWaalsContact C-N 3.25Å; S523-L525 PolarHBondContact O-N 3.29Å; S523-S526 PolarHBondContact O-N 2.97Å; S523-S527 PolarHBondContact O-N 2.81Å; S523-S527 PolarHBondContact O-OG 2.74Å
524	K	65.4	Low	62.3	Low	117 Å²	117	67.2 Å²	67.2	51%	0.509	34%	0.342	S	S	.	.	H	α-helix	trans	-60.1	-36.7	173	-74.9	178.5	178.3	-178	0	112.3	Q520 S527 L528	Q520-K524 WeakPolarHBondContact O-CB 3.38Å; Q520-K524 VanDerWaalsContact O-CG 3.3Å; Q520-K524 WeakPolarHBondContact O-CG 3.43Å; Q520-K524 PolarHBondContact O-N 3.47Å; K524-S527 WeakPolarHBondContact CA-OG 3.33Å; K524-S527 PolarHBondContact O-OG 2.93Å; K524-L528 WeakPolarHBondContact O-CB 3.37Å; K524-L528 VanDerWaalsContact O-CG 3.31Å; K524-L528 WeakPolarHBondContact O-CG 3.46Å; K524-L528 PolarHBondContact O-N 2.89Å
525	L	62	Low	62.6	Low	47 Å²	47	67.8 Å²	67.8	25%	0.246	35%	0.345	C	S	.	.	H	α-helix	trans	-70.4	-43.5	179.2	-164.8	61.5	0	0	0	112.1	N351 L355 K521 L522 S523 L528 Q529	N351-L525 WeakPolarHBondContact ND2-CD2 3.49Å; L355-L525 HydrophobicContact CD1-CD1 3.27Å; L355-L525 HydrophobicContact CD1-CD2 3.57Å; L355-L525 HydrophobicContact CD1-CG 3.57Å; K521-L525 WeakPolarHBondContact O-CB 3.45Å; K521-L525 PolarHBondContact O-N 3.1Å; K521-L525 VanDerWaalsContact O-N 3.1Å; L522-L525 WeakPolarHBondContact O-CB 3.45Å; L522-L525 PolarHBondContact O-N 3.3Å; S523-L525 VanDerWaalsContact C-N 3.25Å; S523-L525 PolarHBondContact O-N 3.29Å; L525-L528 PolarHBondContact O-N 3.45Å; L525-Q529 WeakPolarHBondContact O-CB 3.44Å; L525-Q529 WeakPolarHBondContact O-CG 3.44Å; L525-Q529 PolarHBondContact O-N 3.46Å
526	S	58.5	Low	62.5	Low	24 Å²	24	67.1 Å²	67.1	17%	0.168	34%	0.342	C	S	.	.	H	α-helix	trans	-61.9	-44.5	174.1	156.8	0	0	0	0	111.1	D409 L522 S523 L528 Q529 K530	D409-S526 WeakPolarHBondContact OD1-CB 3.38Å; D409-S526 PolarHBondContact OD1-OG 2.76Å; L522-S526 PolarHBondContact O-N 3.4Å; S523-S526 PolarHBondContact O-N 2.97Å; S526-L528 VanDerWaalsContact C-N 3.34Å; S526-L528 PolarHBondContact O-N 3.35Å; S526-Q529 PolarHBondContact O-N 2.92Å; S526-K530 WeakPolarHBondContact O-CB 3.25Å; S526-K530 PolarHBondContact O-N 2.98Å
527	S	61.1	Low	61.9	Low	61 Å²	61	65.9 Å²	65.9	43%	0.427	34%	0.338	S	S	.	.	H	α-helix	trans	-61.8	-41.7	176.2	61.3	0	0	0	0	112.3	S523 K524 K530 T531	S523-S527 PolarHBondContact O-N 2.81Å; S523-S527 PolarHBondContact O-OG 2.74Å; K524-S527 WeakPolarHBondContact CA-OG 3.33Å; K524-S527 PolarHBondContact O-OG 2.93Å; S527-K530 PolarHBondContact O-N 3.44Å; S527-T531 PolarHBondContact O-N 3.41Å; S527-T531 PolarHBondContact O-OG1 2.85Å; S527-T531 VanDerWaalsContact O-OG1 3.04Å
528	L	67.5	Low	61.3	Low	116 Å²	116	65.8 Å²	65.8	61%	0.607	35%	0.35	S	S	*	.	H	α-helix	trans	-66.6	-40.5	176.3	-77.2	167.3	0	0	0	112.3	K524 L525 S526 K530 T531 F532	K524-L528 WeakPolarHBondContact O-CB 3.37Å; K524-L528 VanDerWaalsContact O-CG 3.31Å; K524-L528 WeakPolarHBondContact O-CG 3.46Å; K524-L528 PolarHBondContact O-N 2.89Å; L525-L528 PolarHBondContact O-N 3.45Å; S526-L528 VanDerWaalsContact C-N 3.34Å; S526-L528 PolarHBondContact O-N 3.35Å; L528-K530 VanDerWaalsContact C-N 3.31Å; L528-K530 PolarHBondContact O-N 2.92Å; L528-T531 PolarHBondContact O-N 3Å; L528-F532 WeakPolarHBondContact O-CB 3.39Å; L528-F532 PolarHBondContact O-N 3.32Å
529	Q	63.4	Low	60.7	Low	5 Å²	5	70.8 Å²	70.8	2%	0.023	37%	0.371	C	S	.	.	H	α-helix	trans	-61.8	-40.1	173.9	-79	177.3	-14.3	0	0	111.4	N351 L355 N408 L525 S526 A533	N351-Q529 PolarHBondContact OD1-NE2 3.25Å; N351-Q529 VanDerWaalsContact OD1-NE2 3.13Å; L355-Q529 HydrophobicContact CD2-CG 3.76Å; L355-Q529 VanDerWaalsContact CG-NE2 3.3Å; N408-Q529 PolarHBondContact ND2-OE1 3.39Å; L525-Q529 WeakPolarHBondContact O-CB 3.44Å; L525-Q529 WeakPolarHBondContact O-CG 3.44Å; L525-Q529 PolarHBondContact O-N 3.46Å; S526-Q529 PolarHBondContact O-N 2.92Å; Q529-A533 VanDerWaalsContact O-CB 3.26Å; Q529-A533 WeakPolarHBondContact O-CB 3.4Å; Q529-A533 PolarHBondContact O-N 2.94Å
530	K	64.4	Low	60.4	Low	110 Å²	110	71.6 Å²	71.6	48%	0.478	38%	0.375	S	S	.	.	H	α-helix	trans	-65.7	-49.5	176.2	-176.9	175.1	176	178.5	0	111.5	S526 S527 L528 F532 A533 E534	S526-K530 WeakPolarHBondContact O-CB 3.25Å; S526-K530 PolarHBondContact O-N 2.98Å; S527-K530 PolarHBondContact O-N 3.44Å; L528-K530 VanDerWaalsContact C-N 3.31Å; L528-K530 PolarHBondContact O-N 2.92Å; K530-F532 VanDerWaalsContact C-N 3.3Å; K530-F532 PolarHBondContact O-N 3.21Å; K530-A533 PolarHBondContact O-N 3.31Å; K530-E534 WeakPolarHBondContact CE-OE1 3.47Å; K530-E534 HydrophobicContact CG-CG 4.45Å; K530-E534 WeakPolarHBondContact O-CB 3.21Å; K530-E534 VanDerWaalsContact O-CG 3.31Å; K530-E534 WeakPolarHBondContact O-CG 3.49Å; K530-E534 PolarHBondContact O-N 2.93Å
531	T	65.1	Low	59.7	Low	67 Å²	67	74.6 Å²	74.6	41%	0.411	39%	0.386	S	S	.	.	H	α-helix	trans	-61.7	-39.9	176.2	-57.2	0	0	0	0	111.8	S527 L528 E534 N535	S527-T531 PolarHBondContact O-N 3.41Å; S527-T531 PolarHBondContact O-OG1 2.85Å; S527-T531 VanDerWaalsContact O-OG1 3.04Å; L528-T531 PolarHBondContact O-N 3Å; T531-E534 PolarHBondContact O-N 3.15Å; T531-N535 WeakPolarHBondContact O-CB 3.39Å; T531-N535 PolarHBondContact O-N 3.4Å; T531-N535 PolarHBondContact O-ND2 3.05Å
532	F	59.6	Low	59.1	Low	55 Å²	55	68.5 Å²	68.5	24%	0.241	36%	0.361	C	S	.	.	H	α-helix	trans	-61.3	-48.5	174.4	178	-96.9	0	0	0	111.3	I358 E362 T401 L528 K530 E534 N535 V536	I358-F532 HydrophobicContact CG2-CE1 4.23Å; E362-F532 HydrophobicContact CG-CZ 4.46Å; E362-F532 WeakPolarHBondContact OE1-CE2 3.45Å; E362-F532 WeakPolarHBondContact OE2-CE2 3.44Å; E362-F532 WeakPolarHBondContact OE2-CZ 3.31Å; T401-F532 HydrophobicContact CG2-CD1 3.81Å; T401-F532 HydrophobicContact CG2-CE1 4.05Å; L528-F532 WeakPolarHBondContact O-CB 3.39Å; L528-F532 PolarHBondContact O-N 3.32Å; K530-F532 VanDerWaalsContact C-N 3.3Å; K530-F532 PolarHBondContact O-N 3.21Å; F532-E534 PolarHBondContact O-N 3.33Å; F532-N535 PolarHBondContact O-N 3.48Å; F532-V536 HydrophobicContact CD1-CG2 4.5Å; F532-V536 HydrophobicContact CE1-CG2 4.19Å; F532-V536 HydrophobicContact CE2-CG2 4.46Å; F532-V536 HydrophobicContact CZ-CG2 4.17Å; F532-V536 VanDerWaalsContact O-CG2 3.32Å; F532-V536 WeakPolarHBondContact O-CG2 3.38Å; F532-V536 PolarHBondContact O-N 2.95Å
533	A	60.1	Low	58.4	Low	1 Å²	1	71.8 Å²	71.8	1%	0.008	38%	0.378	C	S	.	.	H	α-helix	trans	-66	-38.3	179.4	0	0	0	0	0	112.3	N402 Q529 K530 V536 L537	N402-A533 WeakPolarHBondContact OD1-CB 3.49Å; Q529-A533 VanDerWaalsContact O-CB 3.26Å; Q529-A533 WeakPolarHBondContact O-CB 3.4Å; Q529-A533 PolarHBondContact O-N 2.94Å; K530-A533 PolarHBondContact O-N 3.31Å; A533-V536 PolarHBondContact O-N 3.42Å; A533-L537 WeakPolarHBondContact O-CB 3.4Å; A533-L537 WeakPolarHBondContact O-CG 3.49Å; A533-L537 PolarHBondContact O-N 3.22Å
534	E	61.1	Low	57.6	Low	96 Å²	96	72.3 Å²	72.3	45%	0.449	38%	0.381	S	S	.	.	H	α-helix	trans	-63	-42.6	173.6	-75.6	171.4	175.7	0	0	112	K530 T531 F532 V536 L537 A538	K530-E534 WeakPolarHBondContact CE-OE1 3.47Å; K530-E534 HydrophobicContact CG-CG 4.45Å; K530-E534 WeakPolarHBondContact O-CB 3.21Å; K530-E534 VanDerWaalsContact O-CG 3.31Å; K530-E534 WeakPolarHBondContact O-CG 3.49Å; K530-E534 PolarHBondContact O-N 2.93Å; T531-E534 PolarHBondContact O-N 3.15Å; F532-E534 PolarHBondContact O-N 3.33Å; E534-V536 VanDerWaalsContact C-N 3.32Å; E534-V536 PolarHBondContact O-N 3.39Å; E534-L537 PolarHBondContact O-N 2.84Å; E534-A538 WeakPolarHBondContact O-CB 3.25Å; E534-A538 PolarHBondContact O-N 3.44Å
535	N	60.3	Low	57	Low	104 Å²	104	72.3 Å²	72.3	56%	0.556	38%	0.378	S	S	*	.	H	α-helix	trans	-67.2	-32.3	177.3	-73.1	-22.6	0	0	0	112.7	T531 F532	T531-N535 WeakPolarHBondContact O-CB 3.39Å; T531-N535 PolarHBondContact O-N 3.4Å; T531-N535 PolarHBondContact O-ND2 3.05Å; F532-N535 PolarHBondContact O-N 3.48Å
536	V	55.8	Low	56.6	Low	23 Å²	23	74 Å²	74	14%	0.139	39%	0.386	C	S	.	.	H	α-helix	trans	-76.3	-34.7	173.7	-177.3	0	0	0	0	111.1	Q394 C398 F532 A533 E534 Q539	Q394-V536 HydrophobicContact CG-CG1 4.31Å; C398-V536 HydrophobicContact CB-CB 4.27Å; C398-V536 HydrophobicContact CB-CG1 3.43Å; C398-V536 VanDerWaalsContact CB-CG1 3.43Å; C398-V536 WeakPolarHBondContact SG-CG1 3.34Å; F532-V536 HydrophobicContact CD1-CG2 4.5Å; F532-V536 HydrophobicContact CE1-CG2 4.19Å; F532-V536 HydrophobicContact CE2-CG2 4.46Å; F532-V536 HydrophobicContact CZ-CG2 4.17Å; F532-V536 VanDerWaalsContact O-CG2 3.32Å; F532-V536 WeakPolarHBondContact O-CG2 3.38Å; F532-V536 PolarHBondContact O-N 2.95Å; A533-V536 PolarHBondContact O-N 3.42Å; E534-V536 VanDerWaalsContact C-N 3.32Å; E534-V536 PolarHBondContact O-N 3.39Å; V536-Q539 PolarHBondContact O-N 3.46Å
537	L	50.8	Low	56.4	Low	67 Å²	67	76.1 Å²	76.1	35%	0.351	40%	0.401	S	S	.	.	H	α-helix	trans	-67.8	-33.3	174.1	-74.6	170.2	0	0	0	112.9	A533 E534 Q539 E540	A533-L537 WeakPolarHBondContact O-CB 3.4Å; A533-L537 WeakPolarHBondContact O-CG 3.49Å; A533-L537 PolarHBondContact O-N 3.22Å; E534-L537 PolarHBondContact O-N 2.84Å; L537-Q539 PolarHBondContact O-N 2.95Å; L537-Q539 VanDerWaalsContact O-N 3.15Å; L537-E540 WeakPolarHBondContact O-CB 3.5Å; L537-E540 PolarHBondContact O-N 2.93Å; L537-E540 VanDerWaalsContact O-N 3.09Å
538	A	53.3	Low	56.6	Low	86 Å²	86	76.6 Å²	76.6	71%	0.711	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-15.7	176	0	0	0	0	0	113.2	E534	E534-A538 WeakPolarHBondContact O-CB 3.25Å; E534-A538 PolarHBondContact O-N 3.44Å
539	Q	48.2	Very low	56.3	Low	143 Å²	143	72.9 Å²	72.9	67%	0.668	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	3.7	175.7	-67.7	-176.2	-7.9	0	0	113.7	V536 L537	V536-Q539 PolarHBondContact O-N 3.46Å; L537-Q539 PolarHBondContact O-N 2.95Å; L537-Q539 VanDerWaalsContact O-N 3.15Å
540	E	52.4	Low	56.5	Low	56 Å²	56	75.4 Å²	75.4	26%	0.262	40%	0.402	S	S	.	.			trans	-105.9	98	-163.2	-171.5	127.2	-132.8	0	0	115.3	F395 L537 S542	F395-E540 WeakPolarHBondContact CB-OE1 3.41Å; F395-E540 HydrophobicContact CD2-CG 4.44Å; F395-E540 WeakPolarHBondContact CD2-OE1 3.32Å; F395-E540 WeakPolarHBondContact CD2-OE2 3.49Å; F395-E540 WeakPolarHBondContact CE2-OE2 3.38Å; F395-E540 WeakPolarHBondContact CG-OE1 3.5Å; L537-E540 WeakPolarHBondContact O-CB 3.5Å; L537-E540 PolarHBondContact O-N 2.93Å; L537-E540 VanDerWaalsContact O-N 3.09Å; E540-S542 PolarHBondContact OE1-OG 3.2Å
541	K	52	Low	56.8	Low	165 Å²	165	74.3 Å²	74.3	72%	0.717	40%	0.4	S	S	*	.			trans	-121.9	59.1	158.5	-169.5	-176.8	177.9	-179.5	0	109.2	R545	K541-R545 WeakPolarHBondContact O-CD 3.39Å; K541-R545 WeakPolarHBondContact O-CG 3.24Å
542	S	52.2	Low	57.2	Low	10 Å²	10	75.3 Å²	75.3	7%	0.07	40%	0.402	C	S	.	.			trans	-97.5	-23.2	-169.7	61.3	0	0	0	0	114.9	E540	E540-S542 PolarHBondContact OE1-OG 3.2Å
543	I	47	Very low	57.7	Low	103 Å²	103	75.1 Å²	75.1	53%	0.528	41%	0.411	S	S	.	.	H	α-helix	trans	-82.7	-35.7	-174.3	-65	171.5	0	0	0	113.7	F395 R545	F395-I543 HydrophobicContact CE1-CD1 4.49Å; F395-I543 HydrophobicContact CZ-CD1 4.28Å; I543-R545 VanDerWaalsContact C-N 3.29Å; I543-R545 PolarHBondContact O-N 3.04Å
544	S	48.5	Very low	58.5	Low	63 Å²	63	78.7 Å²	78.7	44%	0.441	44%	0.436	S	S	.	.	H	α-helix	trans	-63.4	-38.1	175.3	-168.9	0	0	0	0	111.4	I546 S547 D548	S544-I546 VanDerWaalsContact C-N 3.33Å; S544-I546 PolarHBondContact O-N 3.36Å; S544-S547 PolarHBondContact O-N 2.91Å; S544-D548 PolarHBondContact O-N 3.33Å; S544-D548 VanDerWaalsContact O-OD2 3.09Å; S544-D548 PolarHBondContact OG-OD2 3.21Å
545	R	53.8	Low	59.2	Low	117 Å²	117	78.1 Å²	78.1	44%	0.442	44%	0.435	S	S	.	.	H	α-helix	trans	-69.2	-29	-173.9	-59.3	-173.7	82.9	146.6	5.8	113	K541 I543 N549	K541-R545 WeakPolarHBondContact O-CD 3.39Å; K541-R545 WeakPolarHBondContact O-CG 3.24Å; I543-R545 VanDerWaalsContact C-N 3.29Å; I543-R545 PolarHBondContact O-N 3.04Å; R545-N549 WeakPolarHBondContact O-CB 3.22Å; R545-N549 PolarHBondContact O-N 3.23Å; R545-N549 PolarHBondContact O-OD1 3.2Å
546	I	53.4	Low	60.1	Low	81 Å²	81	78.1 Å²	78.1	42%	0.415	44%	0.436	S	S	.	.	H	α-helix	trans	-69.6	-41.6	176.1	-62.8	170.6	0	0	0	110.6	I392 S544 A550	I392-I546 HydrophobicContact CD1-CD1 4.21Å; I392-I546 HydrophobicContact CG1-CD1 4.25Å; S544-I546 VanDerWaalsContact C-N 3.33Å; S544-I546 PolarHBondContact O-N 3.36Å; I546-A550 VanDerWaalsContact O-CB 3.24Å; I546-A550 WeakPolarHBondContact O-CB 3.27Å; I546-A550 PolarHBondContact O-N 2.87Å
547	S	54.7	Low	61.2	Low	69 Å²	69	81.3 Å²	81.3	48%	0.483	46%	0.455	S	S	.	.	H	α-helix	trans	-63.7	-47.1	174.5	-173.2	0	0	0	0	110.7	S544 N549 A550 I551	S544-S547 PolarHBondContact O-N 2.91Å; S547-N549 PolarHBondContact O-N 3.34Å; S547-A550 PolarHBondContact O-N 2.88Å; S547-I551 VanDerWaalsContact O-CG1 3.24Å; S547-I551 WeakPolarHBondContact O-CG1 3.43Å; S547-I551 PolarHBondContact O-N 2.87Å
548	D	64.1	Low	62.5	Low	72 Å²	72	80.7 Å²	80.7	39%	0.385	46%	0.456	S	S	.	.	H	α-helix	trans	-61.1	-46.2	178.5	-60.2	-27.3	0	0	0	110.9	S544 A550 I551 I552	S544-D548 PolarHBondContact O-N 3.33Å; S544-D548 VanDerWaalsContact O-OD2 3.09Å; S544-D548 PolarHBondContact OG-OD2 3.21Å; D548-A550 VanDerWaalsContact C-N 3.34Å; D548-A550 PolarHBondContact O-N 3.34Å; D548-I551 PolarHBondContact O-N 3.42Å; D548-I552 WeakPolarHBondContact O-CB 3.15Å; D548-I552 WeakPolarHBondContact O-CD1 3.48Å; D548-I552 WeakPolarHBondContact O-CG1 3.46Å; D548-I552 PolarHBondContact O-N 2.89Å
549	N	62.2	Low	63.7	Low	38 Å²	38	80.2 Å²	80.2	20%	0.203	44%	0.441	C	S	.	.	H	α-helix	trans	-67.1	-32.7	178.4	-75.9	19.4	0	0	0	112.5	E384 R545 S547 A553	E384-N549 PolarHBondContact OE1-ND2 3.44Å; R545-N549 WeakPolarHBondContact O-CB 3.22Å; R545-N549 PolarHBondContact O-N 3.23Å; R545-N549 PolarHBondContact O-OD1 3.2Å; S547-N549 PolarHBondContact O-N 3.34Å; N549-A553 VanDerWaalsContact O-CB 3.25Å; N549-A553 WeakPolarHBondContact O-CB 3.49Å; N549-A553 PolarHBondContact O-N 2.8Å
550	A	66.6	Low	65.2	Low	58 Å²	58	74.8 Å²	74.8	48%	0.479	42%	0.424	S	S	.	.	H	α-helix	trans	-69.8	-39.3	173.8	0	0	0	0	0	111.8	I546 S547 D548 A553 S554	I546-A550 VanDerWaalsContact O-CB 3.24Å; I546-A550 WeakPolarHBondContact O-CB 3.27Å; I546-A550 PolarHBondContact O-N 2.87Å; S547-A550 PolarHBondContact O-N 2.88Å; D548-A550 VanDerWaalsContact C-N 3.34Å; D548-A550 PolarHBondContact O-N 3.34Å; A550-A553 PolarHBondContact O-N 3.14Å; A550-S554 WeakPolarHBondContact O-CB 3.34Å; A550-S554 PolarHBondContact O-N 3.45Å
551	I	71.7	Confident	66.6	Low	87 Å²	87	76.2 Å²	76.2	45%	0.446	43%	0.433	S	S	.	.	H	α-helix	trans	-62.8	-49.5	172.7	-66.8	162.9	0	0	0	109.4	S547 D548 A553 S554 D555	S547-I551 VanDerWaalsContact O-CG1 3.24Å; S547-I551 WeakPolarHBondContact O-CG1 3.43Å; S547-I551 PolarHBondContact O-N 2.87Å; D548-I551 PolarHBondContact O-N 3.42Å; I551-A553 VanDerWaalsContact C-N 3.32Å; I551-A553 PolarHBondContact O-N 2.78Å; I551-S554 CarbonylContact O-C 3.59Å; I551-S554 WeakPolarHBondContact O-CB 3.42Å; I551-S554 PolarHBondContact O-N 2.79Å; I551-S554 VanDerWaalsContact O-N 3.1Å; I551-D555 WeakPolarHBondContact O-CB 3.49Å; I551-D555 PolarHBondContact O-N 2.95Å
552	I	73.9	Confident	68.1	Low	88 Å²	88	73.5 Å²	73.5	45%	0.451	42%	0.422	S	S	.	.	H	α-helix	trans	-59.2	-42.5	177.1	-66.5	162.1	0	0	0	111.2	D548 D555 N556	D548-I552 WeakPolarHBondContact O-CB 3.15Å; D548-I552 WeakPolarHBondContact O-CD1 3.48Å; D548-I552 WeakPolarHBondContact O-CG1 3.46Å; D548-I552 PolarHBondContact O-N 2.89Å; I552-D555 PolarHBondContact O-N 2.91Å; I552-N556 WeakPolarHBondContact O-CB 3.35Å; I552-N556 PolarHBondContact O-N 2.99Å; I552-N556 PolarHBondContact O-ND2 2.91Å
553	A	70.4	Confident	69.4	Low	51 Å²	51	76.5 Å²	76.5	42%	0.421	44%	0.442	S	S	.	.	H	α-helix	trans	-65.1	-39.9	176.3	0	0	0	0	0	112.1	N549 A550 I551 N556 V557	N549-A553 VanDerWaalsContact O-CB 3.25Å; N549-A553 WeakPolarHBondContact O-CB 3.49Å; N549-A553 PolarHBondContact O-N 2.8Å; A550-A553 PolarHBondContact O-N 3.14Å; I551-A553 VanDerWaalsContact C-N 3.32Å; I551-A553 PolarHBondContact O-N 2.78Å; A553-N556 PolarHBondContact O-N 2.74Å; A553-V557 VanDerWaalsContact O-CG2 3.32Å; A553-V557 WeakPolarHBondContact O-CG2 3.37Å; A553-V557 PolarHBondContact O-N 3.35Å
554	S	75.5	Confident	71	Confident	76 Å²	76	76.9 Å²	76.9	53%	0.531	45%	0.445	S	S	.	.	H	α-helix	trans	-65	-42.4	174.9	-178.4	0	0	0	0	111.8	A550 I551 V557 S558	A550-S554 WeakPolarHBondContact O-CB 3.34Å; A550-S554 PolarHBondContact O-N 3.45Å; I551-S554 CarbonylContact O-C 3.59Å; I551-S554 WeakPolarHBondContact O-CB 3.42Å; I551-S554 PolarHBondContact O-N 2.79Å; I551-S554 VanDerWaalsContact O-N 3.1Å; S554-V557 PolarHBondContact O-N 2.67Å; S554-S558 WeakPolarHBondContact O-CB 3.43Å; S554-S558 PolarHBondContact O-N 2.83Å
555	D	77.4	Confident	72.5	Confident	83 Å²	83	81 Å²	81	44%	0.444	45%	0.454	S	S	.	.	H	α-helix	trans	-64.4	-43.9	176.2	-72.5	-16.9	0	0	0	110.8	I551 I552 V557 S558 D559	I551-D555 WeakPolarHBondContact O-CB 3.49Å; I551-D555 PolarHBondContact O-N 2.95Å; I552-D555 PolarHBondContact O-N 2.91Å; D555-V557 VanDerWaalsContact C-N 3.32Å; D555-V557 PolarHBondContact O-N 2.77Å; D555-S558 WeakPolarHBondContact O-CB 3.47Å; D555-S558 PolarHBondContact O-N 3.17Å; D555-S558 VanDerWaalsContact O-N 3.14Å; D555-D559 WeakPolarHBondContact O-CB 3.42Å; D555-D559 PolarHBondContact O-N 3.36Å
556	N	77.9	Confident	73.9	Confident	105 Å²	105	81.8 Å²	81.8	56%	0.561	46%	0.461	S	S	*	.	H	α-helix	trans	-59.9	-39.6	174.2	-73.8	-20.7	0	0	0	112.3	I552 A553 G560	I552-N556 WeakPolarHBondContact O-CB 3.35Å; I552-N556 PolarHBondContact O-N 2.99Å; I552-N556 PolarHBondContact O-ND2 2.91Å; A553-N556 PolarHBondContact O-N 2.74Å; N556-G560 PolarHBondContact O-N 2.98Å
557	V	78.3	Confident	75	Confident	90 Å²	90	80.8 Å²	80.8	55%	0.545	47%	0.465	S	S	.	.	H	α-helix	trans	-69.2	-40.5	174.9	170.5	0	0	0	0	111.1	A553 S554 D555 G560 N561	A553-V557 VanDerWaalsContact O-CG2 3.32Å; A553-V557 WeakPolarHBondContact O-CG2 3.37Å; A553-V557 PolarHBondContact O-N 3.35Å; S554-V557 PolarHBondContact O-N 2.67Å; D555-V557 VanDerWaalsContact C-N 3.32Å; D555-V557 PolarHBondContact O-N 2.77Å; V557-G560 PolarHBondContact O-N 3.49Å; V557-N561 WeakPolarHBondContact O-CB 3.46Å; V557-N561 VanDerWaalsContact O-CG 3.24Å; V557-N561 PolarHBondContact O-N 3.1Å; V557-N561 PolarHBondContact O-ND2 3.4Å
558	S	78.8	Confident	75.8	Confident	53 Å²	53	82.7 Å²	82.7	37%	0.371	47%	0.469	S	S	.	.	H	α-helix	trans	-61.8	-45.2	176.2	-175.1	0	0	0	0	111.8	S554 D555 N561 K562	S554-S558 WeakPolarHBondContact O-CB 3.43Å; S554-S558 PolarHBondContact O-N 2.83Å; D555-S558 WeakPolarHBondContact O-CB 3.47Å; D555-S558 PolarHBondContact O-N 3.17Å; D555-S558 VanDerWaalsContact O-N 3.14Å; S558-N561 WeakPolarHBondContact O-CB 3.25Å; S558-N561 PolarHBondContact O-N 3.42Å; S558-K562 WeakPolarHBondContact O-CG 3.48Å; S558-K562 PolarHBondContact O-N 3.33Å
559	D	78.6	Confident	76.4	Confident	76 Å²	76	85.6 Å²	85.6	41%	0.406	48%	0.48	S	S	.	.	H	α-helix	trans	-71.6	-35.1	177.3	-74.6	-15.6	0	0	0	112.5	D555 N561 K562 S563	D555-D559 WeakPolarHBondContact O-CB 3.42Å; D555-D559 PolarHBondContact O-N 3.36Å; D559-N561 VanDerWaalsContact C-N 3.33Å; D559-N561 PolarHBondContact O-N 3.13Å; D559-K562 PolarHBondContact O-N 3.41Å; D559-K562 IonicContact OD1-NZ 2.8Å; D559-K562 PolarHBondContact OD1-NZ 2.9Å; D559-S563 WeakPolarHBondContact O-CB 3.37Å; D559-S563 PolarHBondContact O-N 3.07Å; D559-S563 PolarHBondContact O-OG 2.72Å
560	G	80.1	Confident	76.9	Confident	29 Å²	29	93 Å²	93	30%	0.299	51%	0.505	S	S	.	.	H	α-helix	trans	-56.6	-46.9	167.3	0	0	0	0	0	111.5	N556 V557 K562 S563 I564	N556-G560 PolarHBondContact O-N 2.98Å; V557-G560 PolarHBondContact O-N 3.49Å; G560-K562 PolarHBondContact O-N 2.82Å; G560-S563 WeakPolarHBondContact O-CB 3.3Å; G560-S563 PolarHBondContact O-N 2.8Å; G560-S563 VanDerWaalsContact O-N 3.14Å; G560-I564 WeakPolarHBondContact O-CG1 3.41Å; G560-I564 PolarHBondContact O-N 3.22Å
561	N	82.5	Confident	77.1	Confident	86 Å²	86	96.6 Å²	96.6	46%	0.46	51%	0.512	S	S	.	.	H	α-helix	trans	-64.5	-38	177	-73.6	-19.6	0	0	0	112.7	V557 S558 D559 S563 I564 K565	V557-N561 WeakPolarHBondContact O-CB 3.46Å; V557-N561 VanDerWaalsContact O-CG 3.24Å; V557-N561 PolarHBondContact O-N 3.1Å; V557-N561 PolarHBondContact O-ND2 3.4Å; S558-N561 WeakPolarHBondContact O-CB 3.25Å; S558-N561 PolarHBondContact O-N 3.42Å; D559-N561 VanDerWaalsContact C-N 3.33Å; D559-N561 PolarHBondContact O-N 3.13Å; N561-S563 VanDerWaalsContact C-N 3.32Å; N561-I564 PolarHBondContact O-N 3.43Å; N561-K565 WeakPolarHBondContact O-CG 3.5Å; N561-K565 PolarHBondContact O-N 3.15Å
562	K	82.8	Confident	77	Confident	109 Å²	109	96 Å²	96	47%	0.474	51%	0.513	S	S	.	.	H	α-helix	trans	-63.2	-40.6	172.3	-68.5	172.4	-162.6	156.7	0	111.4	S558 D559 G560 K565 K566	S558-K562 WeakPolarHBondContact O-CG 3.48Å; S558-K562 PolarHBondContact O-N 3.33Å; D559-K562 PolarHBondContact O-N 3.41Å; D559-K562 IonicContact OD1-NZ 2.8Å; D559-K562 PolarHBondContact OD1-NZ 2.9Å; G560-K562 PolarHBondContact O-N 2.82Å; K562-K565 PolarHBondContact O-N 3.1Å; K562-K566 WeakPolarHBondContact O-CG 3.45Å; K562-K566 PolarHBondContact O-N 3.3Å
563	S	78.9	Confident	77.1	Confident	72 Å²	72	95.7 Å²	95.7	50%	0.503	52%	0.518	S	S	.	.	H	α-helix	trans	-66.2	-40.7	178	-58.9	0	0	0	0	111.5	D559 G560 N561 K566 A567	D559-S563 WeakPolarHBondContact O-CB 3.37Å; D559-S563 PolarHBondContact O-N 3.07Å; D559-S563 PolarHBondContact O-OG 2.72Å; G560-S563 WeakPolarHBondContact O-CB 3.3Å; G560-S563 PolarHBondContact O-N 2.8Å; G560-S563 VanDerWaalsContact O-N 3.14Å; N561-S563 VanDerWaalsContact C-N 3.32Å; S563-K566 PolarHBondContact O-N 3.32Å; S563-A567 WeakPolarHBondContact O-CB 3.27Å; S563-A567 PolarHBondContact O-N 3Å
564	I	80.1	Confident	77.4	Confident	112 Å²	112	97.3 Å²	97.3	57%	0.574	52%	0.523	S	S	*	.	H	α-helix	trans	-61.6	-46.1	172	-67.5	167	0	0	0	110.6	G560 N561 K566 A567 L568	G560-I564 WeakPolarHBondContact O-CG1 3.41Å; G560-I564 PolarHBondContact O-N 3.22Å; N561-I564 PolarHBondContact O-N 3.43Å; I564-K566 PolarHBondContact O-N 3.02Å; I564-A567 PolarHBondContact O-N 3.35Å; I564-L568 PolarHBondContact O-N 3.04Å
565	K	80.8	Confident	77.7	Confident	148 Å²	148	101.8 Å²	101.8	64%	0.643	53%	0.528	S	S	*	.	H	α-helix	trans	-59.5	-44.2	175.6	-75.7	179.9	-179.3	-177.1	0	112.2	N561 K562 L568 Q569	N561-K565 WeakPolarHBondContact O-CG 3.5Å; N561-K565 PolarHBondContact O-N 3.15Å; K562-K565 PolarHBondContact O-N 3.1Å; K565-L568 PolarHBondContact O-N 3.41Å; K565-Q569 WeakPolarHBondContact O-CG 3.42Å; K565-Q569 PolarHBondContact O-N 3.1Å
566	K	83	Confident	78	Confident	135 Å²	135	102.1 Å²	102.1	59%	0.587	53%	0.533	S	S	*	.	H	α-helix	trans	-63	-40.2	175.5	-74.2	177.2	-179	179.2	0	111.9	K562 S563 I564 Q569 R570	K562-K566 WeakPolarHBondContact O-CG 3.45Å; K562-K566 PolarHBondContact O-N 3.3Å; S563-K566 PolarHBondContact O-N 3.32Å; I564-K566 PolarHBondContact O-N 3.02Å; K566-Q569 PolarHBondContact O-N 3.3Å; K566-R570 WeakPolarHBondContact O-CG 3.39Å; K566-R570 PolarHBondContact O-N 3.17Å
567	A	77.1	Confident	78.4	Confident	59 Å²	59	105.2 Å²	105.2	49%	0.488	54%	0.537	S	S	.	.	H	α-helix	trans	-64	-42.5	176.1	0	0	0	0	0	111.7	S563 I564 R570 Q571	S563-A567 WeakPolarHBondContact O-CB 3.27Å; S563-A567 PolarHBondContact O-N 3Å; I564-A567 PolarHBondContact O-N 3.35Å; A567-R570 PolarHBondContact O-N 3.37Å; A567-Q571 PolarHBondContact O-N 3.1Å; A567-Q571 VanDerWaalsContact O-N 3.1Å
568	L	72	Confident	78.8	Confident	109 Å²	109	105.9 Å²	105.9	57%	0.571	54%	0.537	S	S	*	.	H	α-helix	trans	-65.4	-39	176.5	-166	68.7	0	0	0	112.2	I564 K565 Q571 T572	I564-L568 PolarHBondContact O-N 3.04Å; K565-L568 PolarHBondContact O-N 3.41Å; L568-Q571 PolarHBondContact O-N 3.14Å; L568-T572 PolarHBondContact O-N 3.41Å; L568-T572 PolarHBondContact O-OG1 3.33Å
569	Q	76.1	Confident	79.2	Confident	133 Å²	133	109.3 Å²	109.3	62%	0.621	55%	0.549	S	S	*	.	H	α-helix	trans	-65.1	-40.9	173.7	-76.5	180	-19.6	0	0	112.4	K565 K566 Q571 T572 S573	K565-Q569 WeakPolarHBondContact O-CG 3.42Å; K565-Q569 PolarHBondContact O-N 3.1Å; K566-Q569 PolarHBondContact O-N 3.3Å; Q569-Q571 VanDerWaalsContact C-N 3.3Å; Q569-Q571 PolarHBondContact O-N 3.26Å; Q569-T572 PolarHBondContact O-N 2.96Å; Q569-T572 VanDerWaalsContact O-N 3.14Å; Q569-S573 PolarHBondContact O-N 3.04Å
570	R	71.8	Confident	79.8	Confident	193 Å²	193	112.2 Å²	112.2	73%	0.728	56%	0.558	S	S	*	*	H	α-helix	trans	-60.1	-40.4	174.8	-77.7	179.4	177.2	177.1	-1.3	111.7	K566 A567 T572 S573 T574	K566-R570 WeakPolarHBondContact O-CG 3.39Å; K566-R570 PolarHBondContact O-N 3.17Å; A567-R570 PolarHBondContact O-N 3.37Å; R570-T572 VanDerWaalsContact C-N 3.29Å; R570-T572 PolarHBondContact O-N 2.85Å; R570-S573 PolarHBondContact O-N 3.39Å; R570-T574 PolarHBondContact O-N 3.29Å; R570-T574 PolarHBondContact O-OG1 3.49Å
571	Q	72.4	Confident	80.2	Confident	135 Å²	135	113.3 Å²	113.3	63%	0.631	56%	0.557	S	S	*	*	H	α-helix	trans	-64.5	-32.5	176.2	-169.8	175.8	9.9	0	0	112.8	A567 L568 Q569 T574 R575	A567-Q571 PolarHBondContact O-N 3.1Å; A567-Q571 VanDerWaalsContact O-N 3.1Å; L568-Q571 PolarHBondContact O-N 3.14Å; Q569-Q571 VanDerWaalsContact C-N 3.3Å; Q569-Q571 PolarHBondContact O-N 3.26Å; Q571-T574 PolarHBondContact O-OG1 2.99Å; Q571-T574 VanDerWaalsContact O-OG1 3.04Å; Q571-R575 PolarHBondContact O-N 3.04Å
572	T	69	Low	80.6	Confident	74 Å²	74	114.7 Å²	114.7	45%	0.454	56%	0.562	S	S	.	*	H	α-helix	trans	-72.5	-40.7	174.7	-53.6	0	0	0	0	111.3	L568 Q569 R570 R575 T576	L568-T572 PolarHBondContact O-N 3.41Å; L568-T572 PolarHBondContact O-OG1 3.33Å; Q569-T572 PolarHBondContact O-N 2.96Å; Q569-T572 VanDerWaalsContact O-N 3.14Å; R570-T572 VanDerWaalsContact C-N 3.29Å; R570-T572 PolarHBondContact O-N 2.85Å; T572-R575 PolarHBondContact O-N 2.91Å; T572-T576 PolarHBondContact O-N 3.41Å; T572-T576 VanDerWaalsContact O-N 3.1Å; T572-T576 PolarHBondContact O-OG1 3.36Å
573	S	75.3	Confident	81	Confident	82 Å²	82	113.3 Å²	113.3	57%	0.573	56%	0.562	S	S	*	*	H	α-helix	trans	-62.6	-43.7	178.2	-173.7	0	0	0	0	112.6	Q569 R570 R575 T576 W577	Q569-S573 PolarHBondContact O-N 3.04Å; R570-S573 PolarHBondContact O-N 3.39Å; S573-R575 VanDerWaalsContact C-N 3.31Å; S573-R575 PolarHBondContact O-N 3.14Å; S573-T576 PolarHBondContact O-N 3.29Å; S573-W577 PolarHBondContact O-N 3.29Å
574	T	78	Confident	81.6	Confident	84 Å²	84	113 Å²	113	52%	0.515	56%	0.557	S	S	.	*	H	α-helix	trans	-63.7	-37	176.5	53.6	0	0	0	0	112.2	R570 Q571 W577 L578	R570-T574 PolarHBondContact O-N 3.29Å; R570-T574 PolarHBondContact O-OG1 3.49Å; Q571-T574 PolarHBondContact O-OG1 2.99Å; Q571-T574 VanDerWaalsContact O-OG1 3.04Å; T574-W577 PolarHBondContact O-N 3.06Å; T574-L578 PolarHBondContact O-N 3.42Å
575	R	81.9	Confident	82.2	Confident	171 Å²	171	112 Å²	112	65%	0.645	55%	0.553	S	S	*	*	H	α-helix	trans	-63.4	-44.4	175.4	-168.8	177.3	74.9	148.9	1.8	112.1	Q571 T572 S573 W577 L578 M579	Q571-R575 PolarHBondContact O-N 3.04Å; T572-R575 PolarHBondContact O-N 2.91Å; S573-R575 VanDerWaalsContact C-N 3.31Å; S573-R575 PolarHBondContact O-N 3.14Å; R575-W577 VanDerWaalsContact C-N 3.33Å; R575-L578 PolarHBondContact O-N 3.09Å; R575-M579 WeakPolarHBondContact O-CG 3.4Å; R575-M579 PolarHBondContact O-N 3.42Å; R575-M579 VanDerWaalsContact O-N 3.09Å
576	T	83.2	Confident	82.7	Confident	89 Å²	89	109.2 Å²	109.2	55%	0.546	55%	0.548	S	S	.	.	H	α-helix	trans	-65.3	-38.9	178	-53	0	0	0	0	111.6	T572 S573 M579 F580	T572-T576 PolarHBondContact O-N 3.41Å; T572-T576 VanDerWaalsContact O-N 3.1Å; T572-T576 PolarHBondContact O-OG1 3.36Å; S573-T576 PolarHBondContact O-N 3.29Å; T576-M579 PolarHBondContact O-N 3.03Å; T576-F580 PolarHBondContact O-N 3.46Å
577	W	86.6	Confident	83.1	Confident	170 Å²	170	108.3 Å²	108.3	64%	0.644	54%	0.544	S	S	*	.	H	α-helix	trans	-65.6	-40.6	177.5	-170	75.6	0	0	0	112.5	S573 T574 R575 M579 F580 I581	S573-W577 PolarHBondContact O-N 3.29Å; T574-W577 PolarHBondContact O-N 3.06Å; R575-W577 VanDerWaalsContact C-N 3.33Å; W577-M579 PolarHBondContact O-N 3.44Å; W577-F580 PolarHBondContact O-N 3.28Å; W577-I581 HydrophobicContact CD2-CD1 3.66Å; W577-I581 HydrophobicContact CD2-CG1 4.45Å; W577-I581 HydrophobicContact CE3-CD1 3.41Å; W577-I581 VanDerWaalsContact CE3-CD1 3.41Å; W577-I581 HydrophobicContact CH2-CD1 3.35Å; W577-I581 HydrophobicContact CZ2-CD1 3.58Å; W577-I581 HydrophobicContact CZ3-CD1 3.25Å; W577-I581 WeakPolarHBondContact O-CG1 3.44Å; W577-I581 PolarHBondContact O-N 3.29Å
578	L	86.4	Confident	83.7	Confident	105 Å²	105	108.5 Å²	108.5	55%	0.55	54%	0.541	S	S	.	.	H	α-helix	trans	-61.9	-41.8	172.5	-78	168.8	0	0	0	112.1	T574 R575 F580 I581 M582	T574-L578 PolarHBondContact O-N 3.42Å; R575-L578 PolarHBondContact O-N 3.09Å; L578-F580 VanDerWaalsContact C-N 3.33Å; L578-F580 PolarHBondContact O-N 2.98Å; L578-I581 PolarHBondContact O-N 2.98Å; L578-M582 WeakPolarHBondContact O-CG 3.34Å; L578-M582 PolarHBondContact O-N 3.32Å
579	M	87.4	Confident	84.6	Confident	124 Å²	124	108.9 Å²	108.9	61%	0.611	54%	0.543	S	S	*	.	H	α-helix	trans	-61.8	-41.2	175.5	-72.7	-67.8	177.1	0	0	111.9	R575 T576 W577 M582 V583	R575-M579 WeakPolarHBondContact O-CG 3.4Å; R575-M579 PolarHBondContact O-N 3.42Å; R575-M579 VanDerWaalsContact O-N 3.09Å; T576-M579 PolarHBondContact O-N 3.03Å; W577-M579 PolarHBondContact O-N 3.44Å; M579-M582 PolarHBondContact O-N 3.02Å; M579-V583 WeakPolarHBondContact O-CG2 3.44Å; M579-V583 PolarHBondContact O-N 3.02Å
580	F	89.9	Confident	85.2	Confident	137 Å²	137	109.6 Å²	109.6	60%	0.601	54%	0.54	S	S	*	.	H	α-helix	trans	-61.6	-45.3	176.1	-178.4	-101.9	0	0	0	112	T576 W577 L578 M582 V583 V584	T576-F580 PolarHBondContact O-N 3.46Å; W577-F580 PolarHBondContact O-N 3.28Å; L578-F580 VanDerWaalsContact C-N 3.33Å; L578-F580 PolarHBondContact O-N 2.98Å; F580-M582 VanDerWaalsContact C-N 3.34Å; F580-M582 PolarHBondContact O-N 3.32Å; F580-V583 PolarHBondContact O-N 3.4Å; F580-V584 HydrophobicContact CD1-CG2 4.28Å; F580-V584 HydrophobicContact CE1-CG2 3.89Å; F580-V584 HydrophobicContact CE2-CG2 4.27Å; F580-V584 HydrophobicContact CZ-CG2 3.89Å; F580-V584 WeakPolarHBondContact O-CG2 3.36Å; F580-V584 PolarHBondContact O-N 3.5Å
581	I	90	Very high	85.9	Confident	52 Å²	52	106.5 Å²	106.5	27%	0.267	53%	0.532	S	S	.	.	H	α-helix	trans	-60.8	-43.8	176.2	-69.3	169.4	0	0	0	111.3	W577 L578 V583 V584 L585	W577-I581 HydrophobicContact CD2-CD1 3.66Å; W577-I581 HydrophobicContact CD2-CG1 4.45Å; W577-I581 HydrophobicContact CE3-CD1 3.41Å; W577-I581 VanDerWaalsContact CE3-CD1 3.41Å; W577-I581 HydrophobicContact CH2-CD1 3.35Å; W577-I581 HydrophobicContact CZ2-CD1 3.58Å; W577-I581 HydrophobicContact CZ3-CD1 3.25Å; W577-I581 WeakPolarHBondContact O-CG1 3.44Å; W577-I581 PolarHBondContact O-N 3.29Å; L578-I581 PolarHBondContact O-N 2.98Å; I581-V583 VanDerWaalsContact C-N 3.32Å; I581-V583 PolarHBondContact O-N 3.01Å; I581-V584 PolarHBondContact O-N 3Å; I581-L585 HydrophobicContact CG2-CD1 3.67Å; I581-L585 HydrophobicContact CG2-CG 4.09Å; I581-L585 WeakPolarHBondContact O-CB 3.41Å; I581-L585 WeakPolarHBondContact O-CG 3.44Å; I581-L585 PolarHBondContact O-N 3.02Å
582	M	89.1	Confident	86.5	Confident	115 Å²	115	105.6 Å²	105.6	57%	0.567	53%	0.531	S	S	*	.	H	α-helix	trans	-60.2	-42.4	178.6	-73.4	-61.9	-63.1	0	0	111.9	L578 M579 F580 T586	L578-M582 WeakPolarHBondContact O-CG 3.34Å; L578-M582 PolarHBondContact O-N 3.32Å; M579-M582 PolarHBondContact O-N 3.02Å; F580-M582 VanDerWaalsContact C-N 3.34Å; F580-M582 PolarHBondContact O-N 3.32Å; M582-T586 WeakPolarHBondContact O-CB 3.34Å; M582-T586 PolarHBondContact O-N 2.66Å; M582-T586 PolarHBondContact O-OG1 3.27Å
583	V	91.8	Very high	87.5	Confident	81 Å²	81	108.3 Å²	108.3	49%	0.491	54%	0.538	S	S	.	.	H	α-helix	trans	-63.9	-46.5	176.3	172.7	0	0	0	0	111.1	M579 F580 I581 T586 F587	M579-V583 WeakPolarHBondContact O-CG2 3.44Å; M579-V583 PolarHBondContact O-N 3.02Å; F580-V583 PolarHBondContact O-N 3.4Å; I581-V583 VanDerWaalsContact C-N 3.32Å; I581-V583 PolarHBondContact O-N 3.01Å; V583-T586 PolarHBondContact O-N 3.26Å; V583-F587 HydrophobicContact CG1-CD2 4.04Å; V583-F587 HydrophobicContact CG1-CE2 4.22Å; V583-F587 PolarHBondContact O-N 2.96Å
584	V	92.8	Very high	87.9	Confident	64 Å²	64	109 Å²	109	39%	0.388	54%	0.535	S	S	.	.	H	α-helix	trans	-62.5	-45.7	179.3	174	0	0	0	0	111.3	F580 I581 T586 F587 C588	F580-V584 HydrophobicContact CD1-CG2 4.28Å; F580-V584 HydrophobicContact CE1-CG2 3.89Å; F580-V584 HydrophobicContact CE2-CG2 4.27Å; F580-V584 HydrophobicContact CZ-CG2 3.89Å; F580-V584 WeakPolarHBondContact O-CG2 3.36Å; F580-V584 PolarHBondContact O-N 3.5Å; I581-V584 PolarHBondContact O-N 3Å; V584-T586 VanDerWaalsContact C-N 3.3Å; V584-T586 PolarHBondContact O-N 3Å; V584-F587 PolarHBondContact O-N 2.89Å; V584-C588 PolarHBondContact O-N 3.04Å; V584-C588 PolarHBondContact O-SG 3.37Å
585	L	91.5	Very high	88.4	Confident	93 Å²	93	115 Å²	115	49%	0.487	55%	0.55	S	S	.	.	H	α-helix	trans	-61.4	-39.1	176.6	-73.3	174.4	0	0	0	111.9	I581 C588 L589	I581-L585 HydrophobicContact CG2-CD1 3.67Å; I581-L585 HydrophobicContact CG2-CG 4.09Å; I581-L585 WeakPolarHBondContact O-CB 3.41Å; I581-L585 WeakPolarHBondContact O-CG 3.44Å; I581-L585 PolarHBondContact O-N 3.02Å; L585-C588 PolarHBondContact O-N 3.24Å; L585-L589 WeakPolarHBondContact O-CG 3.48Å; L585-L589 PolarHBondContact O-N 3.3Å
586	T	91.9	Very high	88.3	Confident	88 Å²	88	115.2 Å²	115.2	54%	0.54	56%	0.558	S	S	.	*	H	α-helix	trans	-64.1	-42.9	176.9	-50.7	0	0	0	0	111.2	M582 V583 V584 L589 W590	M582-T586 WeakPolarHBondContact O-CB 3.34Å; M582-T586 PolarHBondContact O-N 2.66Å; M582-T586 PolarHBondContact O-OG1 3.27Å; V583-T586 PolarHBondContact O-N 3.26Å; V584-T586 VanDerWaalsContact C-N 3.3Å; V584-T586 PolarHBondContact O-N 3Å; T586-L589 PolarHBondContact O-N 3.4Å; T586-W590 PolarHBondContact O-N 2.86Å
587	F	90.3	Very high	87.6	Confident	117 Å²	117	118.3 Å²	118.3	51%	0.513	58%	0.577	S	S	.	*	H	α-helix	trans	-63.5	-43.7	173.6	-95	-78.4	0	0	0	112.3	V583 V584 L589 W590 F591	V583-F587 HydrophobicContact CG1-CD2 4.04Å; V583-F587 HydrophobicContact CG1-CE2 4.22Å; V583-F587 PolarHBondContact O-N 2.96Å; V584-F587 PolarHBondContact O-N 2.89Å; F587-L589 VanDerWaalsContact C-N 3.3Å; F587-L589 PolarHBondContact O-N 3.33Å; F587-W590 HydrophobicContact CD1-CE3 4.45Å; F587-W590 PolarHBondContact O-N 3.22Å; F587-W590 VanDerWaalsContact O-N 3.15Å; F587-F591 HydrophobicContact CD1-CE2 4.07Å; F587-F591 WeakPolarHBondContact O-CD2 3.48Å; F587-F591 PolarHBondContact O-N 3.3Å
588	C	91.1	Very high	87.7	Confident	63 Å²	63	115.8 Å²	115.8	43%	0.426	57%	0.573	S	S	.	*	H	α-helix	trans	-56.7	-44	175.2	-72	0	0	0	0	111.9	V584 L585 F591 L592	V584-C588 PolarHBondContact O-N 3.04Å; V584-C588 PolarHBondContact O-SG 3.37Å; L585-C588 PolarHBondContact O-N 3.24Å; C588-F591 PolarHBondContact O-N 3.3Å; C588-L592 WeakPolarHBondContact O-CB 3.33Å; C588-L592 WeakPolarHBondContact O-CG 3.19Å; C588-L592 PolarHBondContact O-N 3.15Å
589	L	89.3	Confident	87.8	Confident	117 Å²	117	116.3 Å²	116.3	61%	0.613	57%	0.574	S	S	*	*	H	α-helix	trans	-66	-37.4	176.6	-70.2	173.1	0	0	0	112.2	L585 T586 F587 L592 H593	L585-L589 WeakPolarHBondContact O-CG 3.48Å; L585-L589 PolarHBondContact O-N 3.3Å; T586-L589 PolarHBondContact O-N 3.4Å; F587-L589 VanDerWaalsContact C-N 3.3Å; F587-L589 PolarHBondContact O-N 3.33Å; L589-L592 PolarHBondContact O-N 3.36Å; L589-H593 WeakPolarHBondContact O-CB 3.41Å; L589-H593 PolarHBondContact O-N 2.97Å
590	W	88.9	Confident	87.8	Confident	148 Å²	148	115.9 Å²	115.9	56%	0.561	57%	0.572	S	S	*	*	H	α-helix	trans	-65	-43.3	176.2	-171.1	63.9	0	0	0	112.2	T586 F587 H593 L594	T586-W590 PolarHBondContact O-N 2.86Å; F587-W590 HydrophobicContact CD1-CE3 4.45Å; F587-W590 PolarHBondContact O-N 3.22Å; F587-W590 VanDerWaalsContact O-N 3.15Å; W590-H593 WeakPolarHBondContact O-CB 3.5Å; W590-H593 PolarHBondContact O-N 3.33Å; W590-L594 HydrophobicContact CD2-CD1 4.22Å; W590-L594 HydrophobicContact CE3-CD1 4.37Å; W590-L594 HydrophobicContact CH2-CD1 3.94Å; W590-L594 HydrophobicContact CZ2-CD1 3.75Å; W590-L594 HydrophobicContact CZ3-CD1 4.24Å; W590-L594 PolarHBondContact O-N 3.3Å
591	F	87.8	Confident	87.7	Confident	128 Å²	128	114.6 Å²	114.6	56%	0.561	57%	0.571	S	S	*	*	H	α-helix	trans	-65.1	-38.7	174	-78.8	-67.9	0	0	0	112.9	F587 C588 H593 L594 Y595	F587-F591 HydrophobicContact CD1-CE2 4.07Å; F587-F591 WeakPolarHBondContact O-CD2 3.48Å; F587-F591 PolarHBondContact O-N 3.3Å; C588-F591 PolarHBondContact O-N 3.3Å; F591-H593 VanDerWaalsContact C-N 3.32Å; F591-L594 PolarHBondContact O-N 3.29Å; F591-Y595 PolarHBondContact O-N 2.94Å
592	L	85.4	Confident	87.5	Confident	115 Å²	115	118.6 Å²	118.6	60%	0.602	59%	0.59	S	S	*	*	H	α-helix	trans	-63.3	-39	174.1	-80.1	164.3	0	0	0	111.9	C588 L589 Y595 H596	C588-L592 WeakPolarHBondContact O-CB 3.33Å; C588-L592 WeakPolarHBondContact O-CG 3.19Å; C588-L592 PolarHBondContact O-N 3.15Å; L589-L592 PolarHBondContact O-N 3.36Å; L592-Y595 PolarHBondContact O-N 3.4Å; L592-H596 PolarHBondContact O-N 3.39Å
593	H	88.9	Confident	87.4	Confident	131 Å²	131	118.8 Å²	118.8	61%	0.606	59%	0.591	S	S	*	*	H	α-helix	trans	-63.4	-42.6	175	-169.6	90.3	0	0	0	111.6	L589 W590 F591 Y595 H596 V597	L589-H593 WeakPolarHBondContact O-CB 3.41Å; L589-H593 PolarHBondContact O-N 2.97Å; W590-H593 WeakPolarHBondContact O-CB 3.5Å; W590-H593 PolarHBondContact O-N 3.33Å; F591-H593 VanDerWaalsContact C-N 3.32Å; H593-Y595 PolarHBondContact O-N 3.04Å; H593-H596 PolarHBondContact O-N 2.99Å; H593-V597 PolarHBondContact O-N 3.45Å
594	L	83	Confident	87.1	Confident	97 Å²	97	121.5 Å²	121.5	51%	0.508	60%	0.598	S	S	.	*	H	α-helix	trans	-69	-18.5	176.9	-115.9	148.8	0	0	0	114.2	W590 F591	W590-L594 HydrophobicContact CD2-CD1 4.22Å; W590-L594 HydrophobicContact CE3-CD1 4.37Å; W590-L594 HydrophobicContact CH2-CD1 3.94Å; W590-L594 HydrophobicContact CZ2-CD1 3.75Å; W590-L594 HydrophobicContact CZ3-CD1 4.24Å; W590-L594 PolarHBondContact O-N 3.3Å; F591-L594 PolarHBondContact O-N 3.29Å
595	Y	88.2	Confident	86.7	Confident	210 Å²	210	125.9 Å²	125.9	82%	0.824	62%	0.615	S	S	*	*	H	α-helix	trans	-87.2	-24.4	176.3	-168.5	-95.2	0	0	0	112.6	F591 L592 H593	F591-Y595 PolarHBondContact O-N 2.94Å; L592-Y595 PolarHBondContact O-N 3.4Å; H593-Y595 PolarHBondContact O-N 3.04Å
596	H	80.2	Confident	86.3	Confident	175 Å²	175	128.7 Å²	128.7	81%	0.81	63%	0.625	S	S	*	*	H	α-helix	trans	-91.5	-21.5	179.3	-168.9	-74.5	0	0	0	113.1	L592 H593	L592-H596 PolarHBondContact O-N 3.39Å; H593-H596 PolarHBondContact O-N 2.99Å
597	V	69.9	Low	85.7	Confident	155 Å²	155	132.4 Å²	132.4	94%	0.939	63%	0.633	S	S	*	*			trans	-85.4	0	167.6	177.5	0	0	0	0	108.5	H593	H593-V597 PolarHBondContact O-N 3.45Å

Retrieved 597 of 597 residues in 235.9 ms (Link to these results)

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