A0A3Q0KMD2_SCHMA Loading...

GRAM domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KMD2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 439 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	36.6	Very low	35.3	Very low	224 Å²	224	153.4 Å²	153.4	100%	1.103	78%	0.781	S	S	*	*				0	121	0	-65	159.8	77.1	0	0	105.3
2	I	36.2	Very low	34.8	Very low	145 Å²	145	149.3 Å²	149.3	74%	0.744	78%	0.777	S	S	*	*				61	107.1	55.8	-52.8	167.8	0	0	0	106.3
3	Q	37.6	Very low	34.4	Very low	170 Å²	170	145.5 Å²	145.5	79%	0.794	77%	0.771	S	S	*	*			cis	-146.2	167	26.9	-106.6	150.4	-69.1	0	0	108.8
4	D	38.6	Very low	34.2	Very low	129 Å²	129	145.2 Å²	145.2	69%	0.69	77%	0.77	S	S	*	*			cis	-172.1	178.5	-16.4	-123.5	58.7	0	0	0	107.4
5	S	40.1	Very low	34.3	Very low	101 Å²	101	144.1 Å²	144.1	71%	0.706	77%	0.771	S	S	*	*			cis	-157.3	-171	1.5	-147.6	0	0	0	0	110.9
6	E	34.3	Very low	34.2	Very low	174 Å²	174	139.6 Å²	139.6	81%	0.813	75%	0.747	S	S	*	*			trans	-143.1	-160.2	171.2	-129.5	-155.6	134.8	0	0	107.6
7	P	41	Very low	34.6	Very low	84 Å²	84	136.8 Å²	136.8	55%	0.545	74%	0.737	S	S	.	*			cis	-136.4	-161.7	-42	39.5	-21.7	0	0	0	114.5
8	Q	31.1	Very low	34.9	Very low	158 Å²	158	135.4 Å²	135.4	74%	0.738	73%	0.734	S	S	*	*			trans	73.9	112.8	146.5	-75.8	174.6	33.8	0	0	123.4
9	K	34.2	Very low	35.3	Very low	193 Å²	193	135.9 Å²	135.9	84%	0.839	73%	0.729	S	S	*	*				178.5	125.2	118.7	-94.4	157.2	-176.6	171.3	0	108
10	L	27.3	Very low	36	Very low	143 Å²	143	132.6 Å²	132.6	75%	0.749	72%	0.717	S	S	*	*				68.2	138.9	56.2	-68.4	176.1	0	0	0	114.7
11	L	31.6	Very low	37	Very low	166 Å²	166	129.4 Å²	129.4	87%	0.869	70%	0.704	S	S	*	*			trans	69.7	147.9	-175.5	-61.9	109.3	0	0	0	115.2
12	S	29.4	Very low	37.7	Very low	104 Å²	104	121.7 Å²	121.7	73%	0.727	68%	0.676	S	S	*	*			cis	-159.9	164.3	-9.9	43	0	0	0	0	113.1
13	S	29.6	Very low	38.2	Very low	100 Å²	100	118.4 Å²	118.4	70%	0.699	66%	0.658	S	S	*	*			trans	-40.6	131.1	173.2	50.7	0	0	0	0	119.4
14	N	31.6	Very low	39	Very low	142 Å²	142	115 Å²	115	76%	0.759	64%	0.642	S	S	*	*				180	117.6	122.6	-96.2	-44.7	0	0	0	109.3
15	V	35.4	Very low	40	Very low	129 Å²	129	115.7 Å²	115.7	78%	0.782	64%	0.639	S	S	*	*				51.5	93.8	87.1	-174.2	0	0	0	0	112.6
16	D	32.7	Very low	40.6	Very low	72 Å²	72	118.4 Å²	118.4	39%	0.385	64%	0.639	S	S	.	*			trans	-148.5	76.4	172.2	-166.2	-21.2	0	0	0	111	V18 K19	D16-V18 PolarHBondContact O-N 2.84Å; D16-K19 WeakPolarHBondContact OD2-CD 3.03Å; D16-K19 WeakPolarHBondContact OD2-CE 3.36Å; D16-K19 IonicContact OD2-NZ 2.92Å; D16-K19 PolarHBondContact OD2-NZ 2.94Å
17	P	41.1	Very low	41.5	Very low	91 Å²	91	111.5 Å²	111.5	59%	0.591	61%	0.607	S	S	*	*			trans	-66.7	-24.1	-175.7	26.3	-34	0	0	0	112.9	K19 S20	P17-K19 PolarHBondContact O-N 3.16Å; P17-S20 WeakPolarHBondContact O-CB 3.11Å; P17-S20 PolarHBondContact O-N 3.43Å; P17-S20 VanDerWaalsContact O-N 3.12Å; P17-S20 PolarHBondContact O-OG 3.23Å
18	V	40.7	Very low	42.1	Very low	112 Å²	112	114 Å²	114	68%	0.679	61%	0.606	S	S	*	*	H	α-helix	trans	-64.1	-40.7	-174.3	-174.5	0	0	0	0	111.3	D16 S20 S21	D16-V18 PolarHBondContact O-N 2.84Å; V18-S20 PolarHBondContact O-N 2.87Å; V18-S20 VanDerWaalsContact O-N 3.14Å; V18-S21 PolarHBondContact O-N 2.67Å
19	K	41.2	Very low	43	Very low	146 Å²	146	113.7 Å²	113.7	64%	0.635	60%	0.604	S	S	*	*	H	α-helix	trans	-62.3	-19.5	177	-71.8	175.3	-177.8	144.2	0	113.7	D16 P17	D16-K19 WeakPolarHBondContact OD2-CD 3.03Å; D16-K19 WeakPolarHBondContact OD2-CE 3.36Å; D16-K19 IonicContact OD2-NZ 2.92Å; D16-K19 PolarHBondContact OD2-NZ 2.94Å; P17-K19 PolarHBondContact O-N 3.16Å
20	S	50.5	Low	43.8	Very low	69 Å²	69	111.7 Å²	111.7	48%	0.483	60%	0.595	S	S	.	*	H	α-helix	trans	-70.5	-42.4	177.1	76.6	0	0	0	0	112.7	P17 V18 M23 Q24	P17-S20 WeakPolarHBondContact O-CB 3.11Å; P17-S20 PolarHBondContact O-N 3.43Å; P17-S20 VanDerWaalsContact O-N 3.12Å; P17-S20 PolarHBondContact O-OG 3.23Å; V18-S20 PolarHBondContact O-N 2.87Å; V18-S20 VanDerWaalsContact O-N 3.14Å; S20-M23 PolarHBondContact O-N 3.42Å; S20-Q24 WeakPolarHBondContact O-CB 3.18Å; S20-Q24 PolarHBondContact O-N 3.08Å
21	S	57	Low	44.9	Very low	66 Å²	66	111 Å²	111	46%	0.462	58%	0.584	S	S	.	*	H	α-helix	trans	-67.4	-49.4	-172.9	179.7	0	0	0	0	112.3	V18 M23 Q24 K25	V18-S21 PolarHBondContact O-N 2.67Å; S21-M23 VanDerWaalsContact C-N 3.3Å; S21-M23 PolarHBondContact O-N 3.07Å; S21-Q24 PolarHBondContact O-N 3.37Å; S21-K25 PolarHBondContact O-N 3.28Å
22	A	50.3	Low	46.1	Very low	62 Å²	62	104.3 Å²	104.3	51%	0.512	55%	0.548	S	S	.	.	H	α-helix	trans	-61.1	-38.2	178.7	0	0	0	0	0	112.4	K25 K26	A22-K25 PolarHBondContact O-N 3.1Å; A22-K26 PolarHBondContact O-N 3.44Å
23	M	48	Very low	47.2	Very low	75 Å²	75	107.5 Å²	107.5	37%	0.369	55%	0.548	S	S	.	.	H	α-helix	trans	-76.9	-30.5	177.8	-175	160.8	33.5	0	0	112.7	S20 S21 K26 I27 R71	S20-M23 PolarHBondContact O-N 3.42Å; S21-M23 VanDerWaalsContact C-N 3.3Å; S21-M23 PolarHBondContact O-N 3.07Å; M23-K26 PolarHBondContact O-N 3.39Å; M23-I27 HydrophobicContact CG-CD1 4.37Å; M23-I27 WeakPolarHBondContact O-CG1 3.49Å; M23-I27 PolarHBondContact O-N 3.4Å; M23-R71 VanDerWaalsContact SD-CZ 3.55Å; M23-R71 PolarHBondContact SD-NH1 3.5Å
24	Q	53.7	Low	48.4	Very low	98 Å²	98	109.9 Å²	109.9	46%	0.458	55%	0.553	S	S	.	*	H	α-helix	trans	-66.7	-37.7	169.9	-176.5	166.5	-20.3	0	0	111.7	S20 S21 R28	S20-Q24 WeakPolarHBondContact O-CB 3.18Å; S20-Q24 PolarHBondContact O-N 3.08Å; S21-Q24 PolarHBondContact O-N 3.37Å; Q24-R28 WeakPolarHBondContact O-CG 3.36Å; Q24-R28 PolarHBondContact O-N 2.8Å
25	K	58.6	Low	49.9	Very low	144 Å²	144	104.3 Å²	104.3	63%	0.626	52%	0.523	S	S	*	.	H	α-helix	trans	-61.5	-48.9	168.8	-73.6	-173.2	177	-174.7	0	111.8	S21 A22 I27 R28 Q29	S21-K25 PolarHBondContact O-N 3.28Å; A22-K25 PolarHBondContact O-N 3.1Å; K25-I27 VanDerWaalsContact C-N 3.34Å; K25-I27 PolarHBondContact O-N 3.05Å; K25-R28 PolarHBondContact O-N 3.4Å; K25-Q29 WeakPolarHBondContact O-CB 3.15Å; K25-Q29 PolarHBondContact O-N 2.8Å
26	K	54.2	Low	51.4	Low	159 Å²	159	101.7 Å²	101.7	69%	0.691	52%	0.516	S	S	*	.	H	α-helix	trans	-59.5	-38.4	177.8	-78.7	-171.5	174.6	-176.9	0	113.6	A22 M23 K30	A22-K26 PolarHBondContact O-N 3.44Å; M23-K26 PolarHBondContact O-N 3.39Å; K26-K30 WeakPolarHBondContact O-CB 3.5Å; K26-K30 PolarHBondContact O-N 3.43Å; K26-K30 VanDerWaalsContact O-N 3.08Å
27	I	52.9	Low	53.5	Low	29 Å²	29	99.6 Å²	99.6	15%	0.149	51%	0.505	C	S	.	.	H	α-helix	trans	-68.6	-44.6	176.2	-69.2	168.5	0	0	0	110.9	M23 K25 Q29 K30 Y31 F32	M23-I27 HydrophobicContact CG-CD1 4.37Å; M23-I27 WeakPolarHBondContact O-CG1 3.49Å; M23-I27 PolarHBondContact O-N 3.4Å; K25-I27 VanDerWaalsContact C-N 3.34Å; K25-I27 PolarHBondContact O-N 3.05Å; I27-Q29 PolarHBondContact O-N 3.27Å; I27-K30 PolarHBondContact O-N 3.06Å; I27-Y31 HydrophobicContact CG2-CD2 4.46Å; I27-Y31 PolarHBondContact O-N 3.11Å; I27-F32 HydrophobicContact CG2-CD2 4.25Å; I27-F32 HydrophobicContact CG2-CE2 3.9Å
28	R	53	Low	55.4	Low	136 Å²	136	98.7 Å²	98.7	51%	0.513	50%	0.495	S	S	.	.	H	α-helix	trans	-54.9	-49.6	172.8	-79	178.5	166.5	-179.1	-6.7	111.7	Q24 K25 K30 F32	Q24-R28 WeakPolarHBondContact O-CG 3.36Å; Q24-R28 PolarHBondContact O-N 2.8Å; K25-R28 PolarHBondContact O-N 3.4Å; R28-K30 PolarHBondContact O-N 2.76Å; R28-F32 CarbonylContact O-C 3.35Å; R28-F32 WeakPolarHBondContact O-CA 3.44Å; R28-F32 WeakPolarHBondContact O-CB 3.26Å; R28-F32 PolarHBondContact O-N 3.18Å
29	Q	50.4	Low	57.6	Low	152 Å²	152	96.5 Å²	96.5	71%	0.71	48%	0.476	S	S	*	.	H	α-helix	trans	-74.2	-24.2	-174.2	-160.5	173.3	16.1	0	0	114.6	K25 I27	K25-Q29 WeakPolarHBondContact O-CB 3.15Å; K25-Q29 PolarHBondContact O-N 2.8Å; I27-Q29 PolarHBondContact O-N 3.27Å
30	K	51.2	Low	59.8	Low	150 Å²	150	91.1 Å²	91.1	65%	0.652	46%	0.459	S	S	*	.	H	α-helix	trans	-93.4	-31.4	-177.1	-156	177.9	-173.9	-172.2	0	114.5	K26 I27 R28	K26-K30 WeakPolarHBondContact O-CB 3.5Å; K26-K30 PolarHBondContact O-N 3.43Å; K26-K30 VanDerWaalsContact O-N 3.08Å; I27-K30 PolarHBondContact O-N 3.06Å; R28-K30 PolarHBondContact O-N 2.76Å
31	Y	49.6	Very low	61.6	Low	130 Å²	130	88.7 Å²	88.7	51%	0.51	44%	0.439	S	S	.	.	H	α-helix	trans	-120.1	-25.7	-175.2	-57.6	-70.5	0	0	0	114.2	I27 I73	I27-Y31 HydrophobicContact CG2-CD2 4.46Å; I27-Y31 PolarHBondContact O-N 3.11Å; Y31-I73 HydrophobicContact CD1-CD1 3.74Å; Y31-I73 HydrophobicContact CD2-CD1 4.28Å; Y31-I73 HydrophobicContact CE1-CD1 4.13Å; Y31-I73 HydrophobicContact CG-CD1 3.83Å
32	F	56.6	Low	63.2	Low	25 Å²	25	89.5 Å²	89.5	11%	0.11	44%	0.435	C	S	.	.			trans	-106.5	41.9	-176.3	-61.7	-61.9	0	0	0	111.4	I27 R28 N34 D35 V37 Y57 C59 N64	I27-F32 HydrophobicContact CG2-CD2 4.25Å; I27-F32 HydrophobicContact CG2-CE2 3.9Å; R28-F32 CarbonylContact O-C 3.35Å; R28-F32 WeakPolarHBondContact O-CA 3.44Å; R28-F32 WeakPolarHBondContact O-CB 3.26Å; R28-F32 PolarHBondContact O-N 3.18Å; F32-N34 VanDerWaalsContact C-N 3.32Å; F32-N34 PolarHBondContact O-N 2.86Å; F32-D35 WeakPolarHBondContact CB-O 3.48Å; F32-V37 HydrophobicContact CD1-CG2 3.96Å; F32-V37 HydrophobicContact CD2-CG2 3.7Å; F32-V37 HydrophobicContact CE1-CG2 4.04Å; F32-V37 HydrophobicContact CE2-CG2 3.74Å; F32-V37 HydrophobicContact CG-CG2 3.8Å; F32-V37 HydrophobicContact CZ-CG2 3.92Å; F32-Y57 HydrophobicContact CE2-CD1 4.32Å; F32-Y57 HydrophobicContact CZ-CD1 4.32Å; F32-Y57 HydrophobicContact CZ-CG 4.31Å; F32-C59 WeakPolarHBondContact CE1-SG 3.35Å; F32-N64 HydrophobicContact CE1-CB 4.43Å; F32-N64 HydrophobicContact CZ-CB 4.39Å
33	K	53.5	Low	65	Low	170 Å²	170	86.7 Å²	86.7	74%	0.739	41%	0.411	S	S	*	.	S	Bend	trans	-60.6	-38.1	-175.9	-79.1	-169.4	172.7	-172.6	0	113.4
34	N	54.2	Low	66.9	Low	150 Å²	150	84.8 Å²	84.8	80%	0.802	40%	0.402	S	S	*	.	S	Bend	trans	-119.8	-0.3	-174.1	-61.1	15.3	0	0	0	112.9	F32	F32-N34 VanDerWaalsContact C-N 3.32Å; F32-N34 PolarHBondContact O-N 2.86Å
35	D	63.3	Low	68.5	Low	25 Å²	25	80.7 Å²	80.7	13%	0.134	38%	0.384	C	S	.	.	S	Bend	trans	-133.5	120.2	-170.6	-170.4	-10.2	0	0	0	111.2	F32 V37 C59 H60 S61	F32-D35 WeakPolarHBondContact CB-O 3.48Å; D35-V37 PolarHBondContact O-N 3.33Å; D35-C59 WeakPolarHBondContact OD1-CB 3.29Å; D35-C59 VanDerWaalsContact OD2-CB 3.31Å; D35-C59 WeakPolarHBondContact OD2-CB 3.32Å; D35-H60 WeakPolarHBondContact OD1-CB 3.36Å; D35-H60 PolarHBondContact OD1-N 3.24Å; D35-H60 PolarHBondContact OD2-N 3.37Å; D35-S61 WeakPolarHBondContact OD2-CB 3.12Å; D35-S61 PolarHBondContact OD2-N 3.27Å; D35-S61 PolarHBondContact OD2-OG 3.18Å
36	A	67.8	Low	69.8	Low	75 Å²	75	77.6 Å²	77.6	62%	0.62	37%	0.372	S	S	*	.			trans	-78.5	120.9	-178.1	0	0	0	0	0	111.5	I38	A36-I38 WeakPolarHBondContact O-CG1 3.5Å; A36-I38 PolarHBondContact O-N 3.09Å
37	V	75.1	Confident	71	Confident	28 Å²	28	73.4 Å²	73.4	17%	0.17	36%	0.363	C	S	.	.			trans	-61.5	105.9	166.6	176.4	0	0	0	0	109.2	F32 D35 A40 Y57	F32-V37 HydrophobicContact CD1-CG2 3.96Å; F32-V37 HydrophobicContact CD2-CG2 3.7Å; F32-V37 HydrophobicContact CE1-CG2 4.04Å; F32-V37 HydrophobicContact CE2-CG2 3.74Å; F32-V37 HydrophobicContact CG-CG2 3.8Å; F32-V37 HydrophobicContact CZ-CG2 3.92Å; D35-V37 PolarHBondContact O-N 3.33Å; V37-A40 HydrophobicContact CG1-CB 4.34Å; V37-Y57 HydrophobicContact CG1-CD1 3.7Å; V37-Y57 HydrophobicContact CG1-CE1 4.45Å; V37-Y57 HydrophobicContact CG2-CD1 3.98Å
38	I	81.9	Confident	71.7	Confident	71 Å²	71	81.1 Å²	81.1	36%	0.364	40%	0.398	S	S	.	.			trans	-73.5	-51.6	-179.3	-52.4	175.4	0	0	0	109.9	A36 V58 H60 F117 Y121	A36-I38 WeakPolarHBondContact O-CG1 3.5Å; A36-I38 PolarHBondContact O-N 3.09Å; I38-V58 PolarHBondContact N-O 2.81Å; I38-H60 HydrophobicContact CD1-CB 4.44Å; I38-F117 HydrophobicContact CG2-CZ 3.97Å; I38-Y121 HydrophobicContact CD1-CE1 4.08Å; I38-Y121 HydrophobicContact CD1-CE2 4.06Å; I38-Y121 WeakPolarHBondContact CD1-OH 3.41Å
39	K	85.9	Confident	72.5	Confident	67 Å²	67	82.6 Å²	82.6	29%	0.291	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	157.3	-179.8	-156.9	161.5	169.6	-151.5	0	110	Y41 V58 S113 F117	K39-Y41 HydrophobicContact CB-CE2 4.43Å; K39-Y41 HydrophobicContact CD-CE1 4.27Å; K39-Y41 HydrophobicContact CD-CE2 4.44Å; K39-Y41 WeakPolarHBondContact CD-OH 3.38Å; K39-Y41 WeakPolarHBondContact CE-OH 3.4Å; K39-Y41 HydrophobicContact CG-CE1 4.31Å; K39-Y41 HydrophobicContact CG-CE2 4.17Å; K39-Y41 PolarHBondContact NZ-OH 3.18Å; K39-V58 PolarHBondContact N-O 2.9Å; K39-V58 PolarHBondContact O-N 2.89Å; K39-S113 PolarHBondContact NZ-O 3.22Å; K39-S113 PolarHBondContact NZ-OG 3Å; K39-S113 VanDerWaalsContact NZ-OG 3.14Å; K39-F117 HydrophobicContact CB-CD1 4.5Å; K39-F117 HydrophobicContact CB-CE1 3.79Å; K39-F117 HydrophobicContact CB-CE2 4.48Å; K39-F117 HydrophobicContact CB-CZ 3.79Å; K39-F117 HydrophobicContact CD-CD1 4.21Å; K39-F117 HydrophobicContact CD-CD2 3.95Å; K39-F117 HydrophobicContact CD-CE1 4.18Å; K39-F117 HydrophobicContact CD-CE2 3.94Å; K39-F117 HydrophobicContact CD-CG 4.08Å; K39-F117 HydrophobicContact CD-CZ 4.05Å
40	A	87.5	Confident	73.8	Confident	33 Å²	33	81 Å²	81	27%	0.273	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	136.2	179.2	0	0	0	0	0	112.5	V37 L56 Y57	V37-A40 HydrophobicContact CG1-CB 4.34Å; A40-L56 CarbonylContact C-O 3.52Å; A40-L56 WeakPolarHBondContact CA-O 3.48Å; A40-L56 WeakPolarHBondContact CB-O 3.47Å; A40-Y57 HydrophobicContact CB-CD1 3.76Å; A40-Y57 HydrophobicContact CB-CE1 4.07Å; A40-Y57 HydrophobicContact CB-CG 4.14Å
41	Y	89.9	Confident	75.3	Confident	18 Å²	18	77.7 Å²	77.7	7%	0.071	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	146.8	-172.1	-55.2	-80.8	0	0	0	111.2	K39 K55 L56 V58 S113 A114 F117	K39-Y41 HydrophobicContact CB-CE2 4.43Å; K39-Y41 HydrophobicContact CD-CE1 4.27Å; K39-Y41 HydrophobicContact CD-CE2 4.44Å; K39-Y41 WeakPolarHBondContact CD-OH 3.38Å; K39-Y41 WeakPolarHBondContact CE-OH 3.4Å; K39-Y41 HydrophobicContact CG-CE1 4.31Å; K39-Y41 HydrophobicContact CG-CE2 4.17Å; K39-Y41 PolarHBondContact NZ-OH 3.18Å; Y41-K55 CarbonylContact O-C 3.52Å; Y41-K55 WeakPolarHBondContact O-CA 3.29Å; Y41-K55 WeakPolarHBondContact O-CG 3.43Å; Y41-L56 HydrophobicContact CD2-CD2 4.3Å; Y41-L56 PolarHBondContact N-O 2.91Å; Y41-L56 PolarHBondContact O-N 2.9Å; Y41-V58 HydrophobicContact CD2-CG2 4.49Å; Y41-V58 HydrophobicContact CE2-CG2 4.18Å; Y41-S113 PolarHBondContact OH-O 3.22Å; Y41-A114 HydrophobicContact CD1-CB 3.66Å; Y41-A114 HydrophobicContact CD2-CB 4.3Å; Y41-A114 HydrophobicContact CE1-CB 3.69Å; Y41-A114 HydrophobicContact CE2-CB 4.33Å; Y41-A114 HydrophobicContact CG-CB 3.96Å; Y41-F117 AromaticContact CE2-CD1 3.99Å; Y41-F117 HydrophobicContact CE2-CD1 3.99Å; Y41-F117 WeakPolarHBondContact OH-CB 3.37Å; Y41-F117 WeakPolarHBondContact OH-CD1 3.39Å; Y41-F117 WeakPolarHBondContact OH-CG 3.27Å
42	K	89.2	Confident	76.9	Confident	83 Å²	83	72.6 Å²	72.6	36%	0.361	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	136.2	161.9	-54.3	177.9	-153.4	144.5	0	107.9	F108 E109	K42-F108 WeakPolarHBondContact O-CA 3.42Å; K42-E109 HydrophobicContact CB-CB 4.13Å; K42-E109 WeakPolarHBondContact CD-OE2 3.38Å; K42-E109 WeakPolarHBondContact CE-OE2 3.26Å; K42-E109 VanDerWaalsContact CG-OE2 3.31Å; K42-E109 WeakPolarHBondContact CG-OE2 3.3Å; K42-E109 IonicContact NZ-OE1 2.64Å; K42-E109 PolarHBondContact NZ-OE1 2.89Å; K42-E109 IonicContact NZ-OE2 2.64Å; K42-E109 PolarHBondContact NZ-OE2 2.94Å; K42-E109 PolarHBondContact O-N 2.86Å
43	C	88.5	Confident	78.3	Confident	3 Å²	3	74.2 Å²	74.2	2%	0.02	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161	164.2	178	52.7	0	0	0	0	108.3	V54 A106 F108	C43-V54 PolarHBondContact N-O 2.62Å; C43-V54 CarbonylContact O-C 3.56Å; C43-V54 WeakPolarHBondContact O-CG2 3.43Å; C43-V54 PolarHBondContact O-N 3.19Å; C43-A106 CarbonylContact C-O 3.56Å; C43-A106 WeakPolarHBondContact CA-O 3.44Å; C43-A106 VanDerWaalsContact CB-O 3.27Å; C43-A106 WeakPolarHBondContact CB-O 3.44Å; C43-F108 HydrophobicContact CB-CD1 3.54Å; C43-F108 HydrophobicContact CB-CD2 4.46Å; C43-F108 HydrophobicContact CB-CE1 3.71Å; C43-F108 HydrophobicContact CB-CG 3.95Å; C43-F108 HydrophobicContact CB-CZ 4.26Å
44	D	88.2	Confident	80	Confident	35 Å²	35	66.3 Å²	66.3	19%	0.187	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	134.6	171	-63.7	-30.9	0	0	0	109.6	N51 T52 P53 L105 A106 N107	D44-N51 HydrophobicContact CB-CB 4.34Å; D44-T52 CarbonylContact C-O 3.55Å; D44-T52 WeakPolarHBondContact CA-O 3.42Å; D44-P53 VanDerWaalsContact OD1-CA 3.25Å; D44-P53 WeakPolarHBondContact OD1-CA 3.44Å; D44-L105 WeakPolarHBondContact O-CA 3.32Å; D44-A106 PolarHBondContact N-O 3.46Å; D44-A106 PolarHBondContact O-N 3.38Å; D44-N107 HydrophobicContact CB-CB 4.21Å; D44-N107 WeakPolarHBondContact OD2-CB 3.24Å; D44-N107 PolarHBondContact OD2-ND2 3.02Å
45	L	87.7	Confident	81.6	Confident	12 Å²	12	61.1 Å²	61.1	6%	0.063	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	113.2	164.9	174.1	65.3	0	0	0	107.2	T52 V54 L74 Y103 L105	L45-T52 PolarHBondContact N-O 3.27Å; L45-T52 PolarHBondContact O-N 2.71Å; L45-V54 HydrophobicContact CB-CG1 3.87Å; L45-V54 HydrophobicContact CB-CG2 4.05Å; L45-L74 HydrophobicContact CD2-CD2 4.33Å; L45-Y103 HydrophobicContact CD1-CD1 4.12Å; L45-L105 HydrophobicContact CB-CD2 4.21Å; L45-L105 HydrophobicContact CD1-CD2 3.78Å
46	M	85.9	Confident	82.8	Confident	79 Å²	79	59.9 Å²	59.9	39%	0.389	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	121.8	172.2	-54.7	-174.8	66.7	0	0	108.3	N51 T104 A106	M46-N51 WeakPolarHBondContact CG-OD1 3.48Å; M46-T104 HydrophobicContact CB-CG2 3.91Å; M46-T104 HydrophobicContact CG-CG2 4.1Å; M46-T104 PolarHBondContact N-O 3.49Å; M46-T104 HydrophobicContact SD-CG2 3.84Å; M46-A106 HydrophobicContact CG-CB 3.9Å; M46-A106 HydrophobicContact SD-CB 3.51Å; M46-A106 VanDerWaalsContact SD-CB 3.51Å
47	S	78.6	Confident	83.8	Confident	70 Å²	70	57.9 Å²	57.9	49%	0.49	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	113.3	172.3	-174.3	0	0	0	0	110.8	N49 I50	S47-N49 PolarHBondContact O-N 3.3Å; S47-I50 PolarHBondContact N-O 3.37Å; S47-I50 PolarHBondContact O-N 3.39Å
48	Q	67.9	Low	84.3	Confident	192 Å²	192	56.5 Å²	56.5	90%	0.897	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	-18.9	172.2	-65.2	-174.2	-12.1	0	0	119.5
49	N	68.8	Low	84.4	Confident	166 Å²	166	53.1 Å²	53.1	89%	0.888	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	177.8	-4.4	162	-94.1	-30.9	0	0	0	112.1	S47	S47-N49 PolarHBondContact O-N 3.3Å
50	I	78.1	Confident	83.9	Confident	120 Å²	120	52 Å²	52	62%	0.615	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.6	116.6	-175.8	-55.3	177.9	0	0	0	110.3	S47 T52	S47-I50 PolarHBondContact N-O 3.37Å; S47-I50 PolarHBondContact O-N 3.39Å; I50-T52 PolarHBondContact O-N 3.24Å
51	N	81.9	Confident	83.3	Confident	79 Å²	79	53.5 Å²	53.5	42%	0.422	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	111.1	169.5	-70.4	-1	0	0	0	109.4	D44 M46	D44-N51 HydrophobicContact CB-CB 4.34Å; M46-N51 WeakPolarHBondContact CG-OD1 3.48Å
52	T	84.1	Confident	83.1	Confident	24 Å²	24	52.8 Å²	52.8	15%	0.147	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	114.3	-172.9	-62.1	0	0	0	0	110.6	D44 L45 I50 V54	D44-T52 CarbonylContact C-O 3.55Å; D44-T52 WeakPolarHBondContact CA-O 3.42Å; L45-T52 PolarHBondContact N-O 3.27Å; L45-T52 PolarHBondContact O-N 2.71Å; I50-T52 PolarHBondContact O-N 3.24Å; T52-V54 HydrophobicContact CG2-CG1 4.35Å; T52-V54 PolarHBondContact O-N 3.1Å; T52-V54 VanDerWaalsContact O-N 3.08Å
53	P	86.1	Confident	82.9	Confident	59 Å²	59	48.9 Å²	48.9	38%	0.383	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	112.8	-178.7	24.6	-32.7	0	0	0	111.4	D44 H67 R68	D44-P53 VanDerWaalsContact OD1-CA 3.25Å; D44-P53 WeakPolarHBondContact OD1-CA 3.44Å; P53-H67 PolarHBondContact O-CE1 3.45Å; P53-R68 WeakPolarHBondContact O-CB 3.42Å; P53-R68 PolarHBondContact O-N 3.09Å
54	V	88.5	Confident	82.8	Confident	3 Å²	3	49.6 Å²	49.6	2%	0.018	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	167.5	178.8	-66.1	0	0	0	0	110.8	C43 L45 T52 L65 V66	C43-V54 PolarHBondContact N-O 2.62Å; C43-V54 CarbonylContact O-C 3.56Å; C43-V54 WeakPolarHBondContact O-CG2 3.43Å; C43-V54 PolarHBondContact O-N 3.19Å; L45-V54 HydrophobicContact CB-CG1 3.87Å; L45-V54 HydrophobicContact CB-CG2 4.05Å; T52-V54 HydrophobicContact CG2-CG1 4.35Å; T52-V54 PolarHBondContact O-N 3.1Å; T52-V54 VanDerWaalsContact O-N 3.08Å; V54-L65 HydrophobicContact CG2-CD2 4.15Å; V54-V66 CarbonylContact C-O 3.47Å; V54-V66 WeakPolarHBondContact CA-O 3.5Å
55	K	88.5	Confident	82.7	Confident	41 Å²	41	48 Å²	48	18%	0.178	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	114.1	159.2	-175.2	165.2	174.7	163.3	0	107.6	Y41 Y57 V66	Y41-K55 CarbonylContact O-C 3.52Å; Y41-K55 WeakPolarHBondContact O-CA 3.29Å; Y41-K55 WeakPolarHBondContact O-CG 3.43Å; K55-Y57 HydrophobicContact CB-CD2 4.38Å; K55-Y57 HydrophobicContact CB-CE2 3.83Å; K55-Y57 HydrophobicContact CD-CE2 3.73Å; K55-Y57 HydrophobicContact CG-CD2 4Å; K55-Y57 HydrophobicContact CG-CE2 3.5Å; K55-Y57 VanDerWaalsContact CG-CE2 3.5Å; K55-Y57 WeakPolarHBondContact O-CD2 3.36Å; K55-V66 PolarHBondContact N-O 2.88Å; K55-V66 PolarHBondContact O-N 3.16Å
56	L	88.9	Confident	82.5	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	126.2	170.5	176.2	65.1	0	0	0	108.5	A40 Y41 V58 L63 L65 L105 F108 L118	A40-L56 CarbonylContact C-O 3.52Å; A40-L56 WeakPolarHBondContact CA-O 3.48Å; A40-L56 WeakPolarHBondContact CB-O 3.47Å; Y41-L56 HydrophobicContact CD2-CD2 4.3Å; Y41-L56 PolarHBondContact N-O 2.91Å; Y41-L56 PolarHBondContact O-N 2.9Å; L56-V58 HydrophobicContact CD2-CG2 4.47Å; L56-V58 HydrophobicContact CG-CG2 4.44Å; L56-L63 HydrophobicContact CD1-CB 4.08Å; L56-L63 HydrophobicContact CD1-CD2 4.46Å; L56-L65 HydrophobicContact CB-CD2 4.31Å; L56-L65 HydrophobicContact CD1-CD2 3.81Å; L56-L65 HydrophobicContact CD1-CG 4.38Å; L56-L105 HydrophobicContact CD1-CD1 4.41Å; L56-L105 HydrophobicContact CD2-CD1 4.02Å; L56-F108 HydrophobicContact CD2-CE1 4.34Å; L56-L118 HydrophobicContact CD2-CD1 3.93Å; L56-L118 HydrophobicContact CD2-CD2 4.14Å
57	Y	87.7	Confident	82.2	Confident	32 Å²	32	47 Å²	47	13%	0.125	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	114.3	170.5	-72.6	-100.8	0	0	0	107.7	F32 V37 A40 K55 C59 N64 V66	F32-Y57 HydrophobicContact CE2-CD1 4.32Å; F32-Y57 HydrophobicContact CZ-CD1 4.32Å; F32-Y57 HydrophobicContact CZ-CG 4.31Å; V37-Y57 HydrophobicContact CG1-CD1 3.7Å; V37-Y57 HydrophobicContact CG1-CE1 4.45Å; V37-Y57 HydrophobicContact CG2-CD1 3.98Å; A40-Y57 HydrophobicContact CB-CD1 3.76Å; A40-Y57 HydrophobicContact CB-CE1 4.07Å; A40-Y57 HydrophobicContact CB-CG 4.14Å; K55-Y57 HydrophobicContact CB-CD2 4.38Å; K55-Y57 HydrophobicContact CB-CE2 3.83Å; K55-Y57 HydrophobicContact CD-CE2 3.73Å; K55-Y57 HydrophobicContact CG-CD2 4Å; K55-Y57 HydrophobicContact CG-CE2 3.5Å; K55-Y57 VanDerWaalsContact CG-CE2 3.5Å; K55-Y57 WeakPolarHBondContact O-CD2 3.36Å; Y57-C59 PolarHBondContact O-N 3.46Å; Y57-N64 PolarHBondContact N-O 2.9Å; Y57-N64 PolarHBondContact O-N 2.92Å; Y57-V66 HydrophobicContact CD2-CB 4.24Å; Y57-V66 HydrophobicContact CD2-CG2 3.66Å; Y57-V66 HydrophobicContact CE2-CB 4Å; Y57-V66 HydrophobicContact CE2-CG2 3.74Å
58	V	87	Confident	81.8	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	110	170	-172.4	0	0	0	0	107	I38 K39 Y41 L56 L63 F117 L118 Y121	I38-V58 PolarHBondContact N-O 2.81Å; K39-V58 PolarHBondContact N-O 2.9Å; K39-V58 PolarHBondContact O-N 2.89Å; Y41-V58 HydrophobicContact CD2-CG2 4.49Å; Y41-V58 HydrophobicContact CE2-CG2 4.18Å; L56-V58 HydrophobicContact CD2-CG2 4.47Å; L56-V58 HydrophobicContact CG-CG2 4.44Å; V58-L63 HydrophobicContact CB-CD2 4.17Å; V58-L63 HydrophobicContact CG1-CD2 3.86Å; V58-L63 HydrophobicContact CG2-CD2 3.89Å; V58-F117 HydrophobicContact CB-CE1 4.12Å; V58-F117 HydrophobicContact CG1-CE1 3.99Å; V58-F117 HydrophobicContact CG2-CE1 4.06Å; V58-L118 HydrophobicContact CG2-CD2 3.93Å; V58-Y121 HydrophobicContact CG1-CD1 3.56Å; V58-Y121 HydrophobicContact CG1-CE1 3.46Å; V58-Y121 VanDerWaalsContact CG1-CE1 3.46Å
59	C	83.3	Confident	81.5	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.238	C	C	.	.			trans	-108.2	-179.7	172.3	-54.5	0	0	0	0	108.6	F32 D35 Y57 A62 F79	F32-C59 WeakPolarHBondContact CE1-SG 3.35Å; D35-C59 WeakPolarHBondContact OD1-CB 3.29Å; D35-C59 VanDerWaalsContact OD2-CB 3.31Å; D35-C59 WeakPolarHBondContact OD2-CB 3.32Å; Y57-C59 PolarHBondContact O-N 3.46Å; C59-A62 WeakPolarHBondContact CB-O 3.39Å; C59-A62 PolarHBondContact N-O 2.74Å; C59-F79 WeakPolarHBondContact O-CE2 3.39Å
60	H	75.4	Confident	81.2	Confident	42 Å²	42	44.7 Å²	44.7	19%	0.194	23%	0.23	C	C	.	.	S	Bend	trans	-76.5	-40.9	-179	-163.6	85.6	0	0	0	112.9	D35 I38 F79 Y121 I167	D35-H60 WeakPolarHBondContact OD1-CB 3.36Å; D35-H60 PolarHBondContact OD1-N 3.24Å; D35-H60 PolarHBondContact OD2-N 3.37Å; I38-H60 HydrophobicContact CD1-CB 4.44Å; H60-F79 VanDerWaalsContact O-CD2 3.29Å; H60-F79 WeakPolarHBondContact O-CD2 3.46Å; H60-F79 WeakPolarHBondContact O-CE2 3.5Å; H60-Y121 PolarHBondContact ND1-OH 3.27Å; H60-I167 WeakPolarHBondContact CD2-CD1 3.44Å; H60-I167 WeakPolarHBondContact ND1-CG2 3.09Å; H60-I167 WeakPolarHBondContact NE2-CG1 3.43Å
61	S	76	Confident	80.4	Confident	65 Å²	65	44.5 Å²	44.5	46%	0.455	22%	0.222	S	C	.	.	S	Bend	trans	-84.2	-28.1	-178	66.3	0	0	0	0	114.1	D35 F79	D35-S61 WeakPolarHBondContact OD2-CB 3.12Å; D35-S61 PolarHBondContact OD2-N 3.27Å; D35-S61 PolarHBondContact OD2-OG 3.18Å; S61-F79 VanDerWaalsContact C-CD2 3.48Å; S61-F79 WeakPolarHBondContact O-CD2 3.11Å; S61-F79 PolarHBondContact O-N 3.45Å
62	A	84	Confident	79.3	Confident	3 Å²	3	50.4 Å²	50.4	3%	0.025	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	154.2	-168.5	0	0	0	0	0	114.3	C59 N64 L77 L78	C59-A62 WeakPolarHBondContact CB-O 3.39Å; C59-A62 PolarHBondContact N-O 2.74Å; A62-N64 PolarHBondContact O-ND2 3.09Å; A62-L77 CarbonylContact C-O 3.43Å; A62-L77 VanDerWaalsContact CA-O 3.27Å; A62-L77 WeakPolarHBondContact CA-O 3.29Å; A62-L77 WeakPolarHBondContact CB-O 3.47Å; A62-L78 HydrophobicContact CB-CD2 4.27Å
63	L	86.2	Confident	78.3	Confident	2 Å²	2	52.3 Å²	52.3	1%	0.01	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	114.4	162.5	-61.3	-177.4	0	0	0	109.7	L56 V58 L77 F79 I82 I95 L118	L56-L63 HydrophobicContact CD1-CB 4.08Å; L56-L63 HydrophobicContact CD1-CD2 4.46Å; V58-L63 HydrophobicContact CB-CD2 4.17Å; V58-L63 HydrophobicContact CG1-CD2 3.86Å; V58-L63 HydrophobicContact CG2-CD2 3.89Å; L63-L77 HydrophobicContact CB-CB 4.3Å; L63-L77 PolarHBondContact N-O 3.34Å; L63-L77 PolarHBondContact O-N 3.27Å; L63-F79 HydrophobicContact CD1-CE1 4.16Å; L63-F79 HydrophobicContact CD2-CE1 3.76Å; L63-F79 HydrophobicContact CD2-CZ 3.66Å; L63-F79 HydrophobicContact CG-CD1 4.5Å; L63-F79 HydrophobicContact CG-CE1 3.58Å; L63-F79 HydrophobicContact CG-CZ 3.86Å; L63-I82 HydrophobicContact CD1-CD1 3.77Å; L63-I82 HydrophobicContact CG-CD1 4.27Å; L63-I95 HydrophobicContact CD1-CD1 3.8Å; L63-L118 HydrophobicContact CD2-CD2 4.21Å
64	N	84.9	Confident	77.5	Confident	17 Å²	17	54.6 Å²	54.6	9%	0.091	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	117.7	-175	-77.5	-90.5	0	0	0	111.1	F32 Y57 A62 A76	F32-N64 HydrophobicContact CE1-CB 4.43Å; F32-N64 HydrophobicContact CZ-CB 4.39Å; Y57-N64 PolarHBondContact N-O 2.9Å; Y57-N64 PolarHBondContact O-N 2.92Å; A62-N64 PolarHBondContact O-ND2 3.09Å; N64-A76 WeakPolarHBondContact OD1-CB 3.44Å
65	L	86.2	Confident	76.8	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	110.7	-177.8	-71.2	167.9	0	0	0	111.1	V54 L56 L74 T75 L77 Y103 L105	V54-L65 HydrophobicContact CG2-CD2 4.15Å; L56-L65 HydrophobicContact CB-CD2 4.31Å; L56-L65 HydrophobicContact CD1-CD2 3.81Å; L56-L65 HydrophobicContact CD1-CG 4.38Å; L65-L74 PolarHBondContact O-N 2.99Å; L65-L74 VanDerWaalsContact O-N 3.09Å; L65-T75 PolarHBondContact N-O 3.31Å; L65-L77 HydrophobicContact CD1-CD1 4.15Å; L65-Y103 HydrophobicContact CD1-CD1 4.25Å; L65-L105 HydrophobicContact CD2-CD1 4.28Å; L65-L105 HydrophobicContact CD2-CD2 3.81Å
66	V	83.8	Confident	76.5	Confident	15 Å²	15	55.9 Å²	55.9	9%	0.091	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	111.8	-175.6	-174.7	0	0	0	0	111.2	V54 K55 Y57 I73	V54-V66 CarbonylContact C-O 3.47Å; V54-V66 WeakPolarHBondContact CA-O 3.5Å; K55-V66 PolarHBondContact N-O 2.88Å; K55-V66 PolarHBondContact O-N 3.16Å; Y57-V66 HydrophobicContact CD2-CB 4.24Å; Y57-V66 HydrophobicContact CD2-CG2 3.66Å; Y57-V66 HydrophobicContact CE2-CB 4Å; Y57-V66 HydrophobicContact CE2-CG2 3.74Å; V66-I73 HydrophobicContact CG2-CG1 4.32Å
67	H	79.7	Confident	76.2	Confident	56 Å²	56	56.1 Å²	56.1	26%	0.259	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	133.2	-177.1	-171.8	-18.5	0	0	0	112.5	P53 R71 R72	P53-H67 PolarHBondContact O-CE1 3.45Å; H67-R71 VanDerWaalsContact O-CA 3.28Å; H67-R71 WeakPolarHBondContact O-CA 3.39Å; H67-R71 PolarHBondContact O-N 2.67Å; H67-R72 PolarHBondContact N-O 2.99Å
68	R	69.9	Low	76	Confident	103 Å²	103	58.1 Å²	58.1	39%	0.389	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	139.7	167.4	-66.3	179	162.3	-143.6	-7.4	110.1	P53	P53-R68 WeakPolarHBondContact O-CB 3.42Å; P53-R68 PolarHBondContact O-N 3.09Å
69	P	62.9	Low	75.8	Confident	107 Å²	107	58.9 Å²	58.9	70%	0.695	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	cis	-85.9	-15.1	2.8	34	-35.7	0	0	0	114.5	R71	P69-R71 VanDerWaalsContact C-N 3.3Å; P69-R71 PolarHBondContact O-N 3.4Å
70	K	62.3	Low	75.6	Confident	169 Å²	169	62.8 Å²	62.8	74%	0.735	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-11.8	-164.2	-69.9	-178.3	177.6	174.4	0	116	R72	K70-R72 PolarHBondContact O-N 3.26Å
71	R	61.7	Low	75.9	Confident	117 Å²	117	64.4 Å²	64.4	44%	0.442	32%	0.324	S	S	.	.			trans	53	15.8	172.4	-67.6	-179	-170	-124.4	6.4	116.9	M23 H67 P69	M23-R71 VanDerWaalsContact SD-CZ 3.55Å; M23-R71 PolarHBondContact SD-NH1 3.5Å; H67-R71 VanDerWaalsContact O-CA 3.28Å; H67-R71 WeakPolarHBondContact O-CA 3.39Å; H67-R71 PolarHBondContact O-N 2.67Å; P69-R71 VanDerWaalsContact C-N 3.3Å; P69-R71 PolarHBondContact O-N 3.4Å
72	R	59	Low	76.3	Confident	203 Å²	203	61.4 Å²	61.4	77%	0.766	30%	0.303	S	S	*	.			trans	-73.9	134.8	162.1	-62.3	-176.4	-178.9	-174.7	-1.5	107.2	H67 K70 L74	H67-R72 PolarHBondContact N-O 2.99Å; K70-R72 PolarHBondContact O-N 3.26Å; R72-L74 PolarHBondContact O-N 2.99Å
73	I	61.8	Low	76.2	Confident	63 Å²	63	65.4 Å²	65.4	32%	0.323	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	123.3	168.5	-58.3	170.4	0	0	0	105	Y31 V66	Y31-I73 HydrophobicContact CD1-CD1 3.74Å; Y31-I73 HydrophobicContact CD2-CD1 4.28Å; Y31-I73 HydrophobicContact CE1-CD1 4.13Å; Y31-I73 HydrophobicContact CG-CD1 3.83Å; V66-I73 HydrophobicContact CG2-CG1 4.32Å
74	L	70.2	Confident	76.1	Confident	108 Å²	108	69.2 Å²	69.2	57%	0.565	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.8	-37.2	-179.9	-159.9	78.9	0	0	0	110.7	L45 L65 R72	L45-L74 HydrophobicContact CD2-CD2 4.33Å; L65-L74 PolarHBondContact O-N 2.99Å; L65-L74 VanDerWaalsContact O-N 3.09Å; R72-L74 PolarHBondContact O-N 2.99Å
75	T	74.2	Confident	76.2	Confident	20 Å²	20	69.4 Å²	69.4	12%	0.123	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	134.9	-175.1	-35.1	0	0	0	0	109.8	L65 L77 Y103	L65-T75 PolarHBondContact N-O 3.31Å; T75-L77 HydrophobicContact CG2-CD2 3.53Å; T75-L77 HydrophobicContact CG2-CG 3.79Å; T75-Y103 HydrophobicContact CG2-CE1 3.85Å
76	A	81.8	Confident	76.1	Confident	50 Å²	50	74 Å²	74	41%	0.413	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	104.6	164.1	0	0	0	0	0	106.9	N64 L78	N64-A76 WeakPolarHBondContact OD1-CB 3.44Å; A76-L78 PolarHBondContact O-N 3.27Å
77	L	83.1	Confident	76.1	Confident	5 Å²	5	76.2 Å²	76.2	3%	0.026	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	101.2	-178.8	-62.9	173.1	0	0	0	108.3	A62 L63 L65 T75 I82 I95 T97 Y103	A62-L77 CarbonylContact C-O 3.43Å; A62-L77 VanDerWaalsContact CA-O 3.27Å; A62-L77 WeakPolarHBondContact CA-O 3.29Å; A62-L77 WeakPolarHBondContact CB-O 3.47Å; L63-L77 HydrophobicContact CB-CB 4.3Å; L63-L77 PolarHBondContact N-O 3.34Å; L63-L77 PolarHBondContact O-N 3.27Å; L65-L77 HydrophobicContact CD1-CD1 4.15Å; T75-L77 HydrophobicContact CG2-CD2 3.53Å; T75-L77 HydrophobicContact CG2-CG 3.79Å; L77-I82 HydrophobicContact CB-CD1 4.28Å; L77-I82 HydrophobicContact CB-CG1 4.42Å; L77-I95 HydrophobicContact CD1-CD1 4.39Å; L77-I95 HydrophobicContact CD1-CG2 4.22Å; L77-T97 HydrophobicContact CD2-CG2 3.87Å; L77-Y103 HydrophobicContact CD1-CD2 4.04Å; L77-Y103 HydrophobicContact CD1-CE2 4.49Å; L77-Y103 HydrophobicContact CD1-CG 4.1Å; L77-Y103 HydrophobicContact CD2-CD2 4.1Å; L77-Y103 HydrophobicContact CD2-CE2 3.75Å
78	L	83.4	Confident	76	Confident	74 Å²	74	79.3 Å²	79.3	39%	0.387	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	141.4	174.5	-70.9	155.1	0	0	0	109.3	A62 A76 S80 Q81 I82	A62-L78 HydrophobicContact CB-CD2 4.27Å; A76-L78 PolarHBondContact O-N 3.27Å; L78-S80 WeakPolarHBondContact CB-OG 3.49Å; L78-S80 PolarHBondContact O-N 2.88Å; L78-S80 VanDerWaalsContact O-N 3.12Å; L78-Q81 HydrophobicContact CB-CG 4.1Å; L78-Q81 VanDerWaalsContact N-OE1 3.08Å; L78-Q81 WeakPolarHBondContact O-CB 3.37Å; L78-Q81 PolarHBondContact O-N 3.12Å; L78-I82 PolarHBondContact O-N 3.16Å
79	F	82.1	Confident	76.2	Confident	16 Å²	16	79.5 Å²	79.5	7%	0.07	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-22.4	179.7	-69.1	-63.6	0	0	0	113.4	C59 H60 S61 L63 Q81 I82 Y121 W122 I125 K129	C59-F79 WeakPolarHBondContact O-CE2 3.39Å; H60-F79 VanDerWaalsContact O-CD2 3.29Å; H60-F79 WeakPolarHBondContact O-CD2 3.46Å; H60-F79 WeakPolarHBondContact O-CE2 3.5Å; S61-F79 VanDerWaalsContact C-CD2 3.48Å; S61-F79 WeakPolarHBondContact O-CD2 3.11Å; S61-F79 PolarHBondContact O-N 3.45Å; L63-F79 HydrophobicContact CD1-CE1 4.16Å; L63-F79 HydrophobicContact CD2-CE1 3.76Å; L63-F79 HydrophobicContact CD2-CZ 3.66Å; L63-F79 HydrophobicContact CG-CD1 4.5Å; L63-F79 HydrophobicContact CG-CE1 3.58Å; L63-F79 HydrophobicContact CG-CZ 3.86Å; F79-Q81 VanDerWaalsContact C-N 3.34Å; F79-I82 HydrophobicContact CD1-CD1 4.03Å; F79-I82 HydrophobicContact CE1-CD1 4.44Å; F79-I82 PolarHBondContact O-N 3.35Å; F79-Y121 HydrophobicContact CE2-CE1 4.12Å; F79-Y121 HydrophobicContact CZ-CD1 4.31Å; F79-Y121 AromaticContact CZ-CE1 3.75Å; F79-Y121 HydrophobicContact CZ-CE1 3.75Å; F79-W122 HydrophobicContact CB-CZ3 4.38Å; F79-W122 HydrophobicContact CD1-CE3 4.09Å; F79-W122 AromaticContact CD1-CZ3 3.9Å; F79-W122 HydrophobicContact CD1-CZ3 3.9Å; F79-I125 HydrophobicContact CB-CG2 3.94Å; F79-I125 HydrophobicContact CD1-CD1 3.74Å; F79-I125 HydrophobicContact CD2-CD1 3.78Å; F79-I125 HydrophobicContact CE1-CD1 3.65Å; F79-I125 HydrophobicContact CE2-CD1 3.71Å; F79-I125 HydrophobicContact CG-CD1 3.81Å; F79-I125 HydrophobicContact CG-CG2 4.21Å; F79-I125 HydrophobicContact CZ-CD1 3.66Å; F79-K129 WeakPolarHBondContact O-CE 3.47Å; F79-K129 PolarHBondContact O-NZ 2.84Å
80	S	78.3	Confident	76.6	Confident	83 Å²	83	81.9 Å²	81.9	58%	0.58	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-35.6	169.1	52.3	0	0	0	0	113.3	L78	L78-S80 WeakPolarHBondContact CB-OG 3.49Å; L78-S80 PolarHBondContact O-N 2.88Å; L78-S80 VanDerWaalsContact O-N 3.12Å
81	Q	82.5	Confident	77.5	Confident	76 Å²	76	79 Å²	79	36%	0.355	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-13.4	-179.2	-63.6	170.6	-44.1	0	0	113.5	L78 F79 T97 T98	L78-Q81 HydrophobicContact CB-CG 4.1Å; L78-Q81 VanDerWaalsContact N-OE1 3.08Å; L78-Q81 WeakPolarHBondContact O-CB 3.37Å; L78-Q81 PolarHBondContact O-N 3.12Å; F79-Q81 VanDerWaalsContact C-N 3.34Å; Q81-T97 CarbonylContact O-C 3.59Å; Q81-T97 WeakPolarHBondContact O-CA 3.28Å; Q81-T97 WeakPolarHBondContact O-CB 3.48Å; Q81-T98 PolarHBondContact O-N 3.19Å; Q81-T98 PolarHBondContact O-OG1 3.27Å
82	I	83.8	Confident	78.6	Confident	1 Å²	1	74 Å²	74	1%	0.005	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	126.2	176.3	-58.9	174.1	0	0	0	108.7	L63 L77 L78 F79 I95 W122 K129	L63-I82 HydrophobicContact CD1-CD1 3.77Å; L63-I82 HydrophobicContact CG-CD1 4.27Å; L77-I82 HydrophobicContact CB-CD1 4.28Å; L77-I82 HydrophobicContact CB-CG1 4.42Å; L78-I82 PolarHBondContact O-N 3.16Å; F79-I82 HydrophobicContact CD1-CD1 4.03Å; F79-I82 HydrophobicContact CE1-CD1 4.44Å; F79-I82 PolarHBondContact O-N 3.35Å; I82-I95 HydrophobicContact CB-CG2 4.44Å; I82-I95 HydrophobicContact CD1-CG2 3.83Å; I82-I95 HydrophobicContact CG1-CG2 3.83Å; I82-I95 HydrophobicContact CG2-CG2 3.81Å; I82-W122 HydrophobicContact CB-CH2 3.6Å; I82-W122 HydrophobicContact CB-CZ2 4.27Å; I82-W122 HydrophobicContact CB-CZ3 3.95Å; I82-W122 HydrophobicContact CG2-CH2 3.49Å; I82-W122 VanDerWaalsContact CG2-CH2 3.49Å; I82-W122 HydrophobicContact CG2-CZ2 3.65Å; I82-W122 HydrophobicContact CG2-CZ3 3.97Å; I82-W122 WeakPolarHBondContact O-CH2 3.37Å; I82-K129 PolarHBondContact O-NZ 3.38Å
83	V	82.4	Confident	80	Confident	87 Å²	87	64.3 Å²	64.3	53%	0.527	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-51.1	174.8	177.1	0	0	0	0	109.4	H96 T98	V83-H96 PolarHBondContact N-O 2.97Å; V83-T98 HydrophobicContact CG2-CG2 3.59Å
84	E	84.5	Confident	81.3	Confident	82 Å²	82	62.1 Å²	62.1	38%	0.383	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	146.4	-173.9	-162.4	-177.5	168.9	0	0	111.3	K86 H96	E84-K86 HydrophobicContact CG-CG 4.15Å; E84-K86 WeakPolarHBondContact OE1-CE 3.46Å; E84-K86 WeakPolarHBondContact OE1-CG 3.27Å; E84-K86 IonicContact OE1-NZ 3.07Å; E84-K86 PolarHBondContact OE1-NZ 2.83Å; E84-K86 IonicContact OE2-NZ 2.67Å; E84-K86 PolarHBondContact OE2-NZ 3.05Å; E84-H96 PolarHBondContact N-O 2.83Å; E84-H96 PolarHBondContact O-N 2.79Å
85	L	86	Confident	82.1	Confident	22 Å²	22	57 Å²	57	12%	0.115	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	101.9	174	-174.1	154.6	0	0	0	107.5	V87 V93 I95 L118 W122	L85-V87 HydrophobicContact CD2-CG2 4.49Å; L85-V93 HydrophobicContact CD1-CG1 4.15Å; L85-V93 HydrophobicContact CD2-CG1 3.52Å; L85-V93 HydrophobicContact CG-CG1 3.61Å; L85-I95 HydrophobicContact CD1-CG1 4.43Å; L85-I95 HydrophobicContact CG-CG1 4.48Å; L85-L118 HydrophobicContact CD1-CB 4.26Å; L85-W122 HydrophobicContact CB-CD2 4.49Å; L85-W122 HydrophobicContact CB-CG 4.11Å; L85-W122 HydrophobicContact CD1-CB 4.41Å; L85-W122 HydrophobicContact CD1-CG 4.47Å
86	K	85.3	Confident	82.7	Confident	96 Å²	96	58.3 Å²	58.3	42%	0.417	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	122.5	178.5	-74.5	-169.8	168.4	94.7	0	110	E84 Q88 N94	E84-K86 HydrophobicContact CG-CG 4.15Å; E84-K86 WeakPolarHBondContact OE1-CE 3.46Å; E84-K86 WeakPolarHBondContact OE1-CG 3.27Å; E84-K86 IonicContact OE1-NZ 3.07Å; E84-K86 PolarHBondContact OE1-NZ 2.83Å; E84-K86 IonicContact OE2-NZ 2.67Å; E84-K86 PolarHBondContact OE2-NZ 3.05Å; K86-Q88 PolarHBondContact O-N 3.47Å; K86-N94 HydrophobicContact CB-CB 4.49Å; K86-N94 PolarHBondContact N-O 3.31Å; K86-N94 PolarHBondContact O-N 2.91Å
87	V	84.2	Confident	83	Confident	62 Å²	62	56.4 Å²	56.4	38%	0.376	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	116.8	163.8	-174.9	0	0	0	0	106.5	L85 N89 I115	L85-V87 HydrophobicContact CD2-CG2 4.49Å; V87-N89 WeakPolarHBondContact CG1-O 3.22Å; V87-I115 HydrophobicContact CB-CG2 4.38Å; V87-I115 HydrophobicContact CG1-CG2 3.75Å; V87-I115 HydrophobicContact CG2-CG2 3.65Å
88	Q	76.2	Confident	83	Confident	122 Å²	122	60.8 Å²	60.8	57%	0.57	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.9	-51.3	-176.9	-176	175.2	6.5	0	0	110.7	K86 S92 N94	K86-Q88 PolarHBondContact O-N 3.47Å; Q88-S92 PolarHBondContact N-O 3.48Å; Q88-N94 PolarHBondContact OE1-ND2 2.82Å
89	N	74.5	Confident	83	Confident	106 Å²	106	60.6 Å²	60.6	57%	0.567	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.8	169.6	172.9	-61.4	-15.9	0	0	0	108.7	V87 H91 S92	V87-N89 WeakPolarHBondContact CG1-O 3.22Å; N89-H91 PolarHBondContact O-N 3.28Å; N89-S92 PolarHBondContact N-OG 2.94Å; N89-S92 PolarHBondContact O-N 3.3Å
90	E	72.5	Confident	82.9	Confident	158 Å²	158	67 Å²	67	74%	0.738	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-5.7	175.8	-58.8	-171.5	147.5	0	0	114.7	S111 I115	E90-S111 WeakPolarHBondContact O-CB 3.44Å; E90-I115 WeakPolarHBondContact O-CD1 3.33Å
91	H	80.3	Confident	83.2	Confident	107 Å²	107	67.4 Å²	67.4	50%	0.495	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.9	3.6	-179.7	-51.8	-23	0	0	0	113.7	N89 A106	N89-H91 PolarHBondContact O-N 3.28Å; H91-A106 WeakPolarHBondContact O-CA 3.37Å
92	S	84.6	Confident	83.3	Confident	12 Å²	12	67 Å²	67	8%	0.084	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	142.6	-176.4	61.7	0	0	0	0	115.3	Q88 N89 L105	Q88-S92 PolarHBondContact N-O 3.48Å; N89-S92 PolarHBondContact N-OG 2.94Å; N89-S92 PolarHBondContact O-N 3.3Å; S92-L105 CarbonylContact C-O 3.5Å; S92-L105 VanDerWaalsContact CA-O 3.24Å; S92-L105 WeakPolarHBondContact CA-O 3.48Å
93	V	88.9	Confident	83.4	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	121.8	-178	-179.3	0	0	0	0	109.6	L85 I95 L105 F108 I115	L85-V93 HydrophobicContact CD1-CG1 4.15Å; L85-V93 HydrophobicContact CD2-CG1 3.52Å; L85-V93 HydrophobicContact CG-CG1 3.61Å; V93-I95 HydrophobicContact CG1-CG1 4.25Å; V93-L105 PolarHBondContact N-O 3.13Å; V93-L105 PolarHBondContact O-N 3.39Å; V93-F108 HydrophobicContact CB-CE2 4.37Å; V93-F108 HydrophobicContact CB-CZ 4.37Å; V93-F108 HydrophobicContact CG2-CE2 3.97Å; V93-F108 HydrophobicContact CG2-CZ 4.13Å; V93-I115 HydrophobicContact CG2-CD1 4.46Å; V93-I115 HydrophobicContact CG2-CG1 3.73Å
94	N	88.4	Confident	83.7	Confident	18 Å²	18	65.9 Å²	65.9	10%	0.096	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	120.1	173.1	-65.5	-20.7	0	0	0	109.3	K86 Q88 T102 T104	K86-N94 HydrophobicContact CB-CB 4.49Å; K86-N94 PolarHBondContact N-O 3.31Å; K86-N94 PolarHBondContact O-N 2.91Å; Q88-N94 PolarHBondContact OE1-ND2 2.82Å; N94-T102 HydrophobicContact CB-CG2 4.09Å; N94-T104 WeakPolarHBondContact OD1-CB 3.29Å; N94-T104 VanDerWaalsContact OD1-CG2 3.29Å; N94-T104 WeakPolarHBondContact OD1-CG2 3.37Å; N94-T104 PolarHBondContact OD1-OG1 3.09Å
95	I	88.1	Confident	83.9	Confident	1 Å²	1	62 Å²	62	1%	0.005	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	112	175.2	-54.8	171.4	0	0	0	107.7	L63 L77 I82 L85 V93 T102 Y103 L105	L63-I95 HydrophobicContact CD1-CD1 3.8Å; L77-I95 HydrophobicContact CD1-CD1 4.39Å; L77-I95 HydrophobicContact CD1-CG2 4.22Å; I82-I95 HydrophobicContact CB-CG2 4.44Å; I82-I95 HydrophobicContact CD1-CG2 3.83Å; I82-I95 HydrophobicContact CG1-CG2 3.83Å; I82-I95 HydrophobicContact CG2-CG2 3.81Å; L85-I95 HydrophobicContact CD1-CG1 4.43Å; L85-I95 HydrophobicContact CG-CG1 4.48Å; V93-I95 HydrophobicContact CG1-CG1 4.25Å; I95-T102 WeakPolarHBondContact O-CA 3.33Å; I95-Y103 PolarHBondContact N-O 3.48Å; I95-Y103 PolarHBondContact O-N 2.7Å; I95-L105 HydrophobicContact CD1-CD1 3.79Å; I95-L105 HydrophobicContact CD1-CG 4.48Å
96	H	86.6	Confident	84	Confident	47 Å²	47	61.2 Å²	61.2	22%	0.218	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	128.2	177.5	-58.9	-69.3	0	0	0	110.1	V83 E84 T102	V83-H96 PolarHBondContact N-O 2.97Å; E84-H96 PolarHBondContact N-O 2.83Å; E84-H96 PolarHBondContact O-N 2.79Å; H96-T102 WeakPolarHBondContact ND1-CG2 3.37Å; H96-T102 PolarHBondContact ND1-OG1 3.03Å
97	T	86.4	Confident	84	Confident	9 Å²	9	61.1 Å²	61.1	6%	0.055	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	164.5	-177.3	64.3	0	0	0	0	113.3	L77 Q81 S99 N100 E101 Y103	L77-T97 HydrophobicContact CD2-CG2 3.87Å; Q81-T97 CarbonylContact O-C 3.59Å; Q81-T97 WeakPolarHBondContact O-CA 3.28Å; Q81-T97 WeakPolarHBondContact O-CB 3.48Å; T97-S99 WeakPolarHBondContact CB-OG 3.36Å; T97-S99 PolarHBondContact O-N 3.32Å; T97-S99 PolarHBondContact OG1-N 2.72Å; T97-S99 PolarHBondContact OG1-OG 2.84Å; T97-N100 PolarHBondContact O-N 2.83Å; T97-E101 PolarHBondContact N-O 3.29Å; T97-E101 WeakPolarHBondContact OG1-CB 3.48Å; T97-E101 PolarHBondContact OG1-N 3.03Å; T97-E101 VanDerWaalsContact OG1-N 3.1Å; T97-E101 PolarHBondContact OG1-O 2.88Å; T97-Y103 HydrophobicContact CG2-CD2 3.94Å; T97-Y103 HydrophobicContact CG2-CE2 3.83Å
98	T	83.2	Confident	84.2	Confident	98 Å²	98	58.9 Å²	58.9	60%	0.601	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-18	170.2	54	0	0	0	0	113	Q81 V83 N100	Q81-T98 PolarHBondContact O-N 3.19Å; Q81-T98 PolarHBondContact O-OG1 3.27Å; V83-T98 HydrophobicContact CG2-CG2 3.59Å; T98-N100 PolarHBondContact O-N 2.89Å
99	S	84	Confident	84.6	Confident	69 Å²	69	58.7 Å²	58.7	48%	0.483	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	3.5	171.2	42.3	0	0	0	0	113.6	T97 E101	T97-S99 WeakPolarHBondContact CB-OG 3.36Å; T97-S99 PolarHBondContact O-N 3.32Å; T97-S99 PolarHBondContact OG1-N 2.72Å; T97-S99 PolarHBondContact OG1-OG 2.84Å; S99-E101 WeakPolarHBondContact CB-OE2 3.16Å; S99-E101 PolarHBondContact O-N 2.97Å; S99-E101 PolarHBondContact OG-OE2 2.97Å
100	N	79.9	Confident	85.1	Confident	151 Å²	151	62.2 Å²	62.2	81%	0.807	31%	0.314	S	S	*	.	S	Bend	trans	59.8	22.1	-171.5	-162.9	38.7	0	0	0	113.6	T97 T98	T97-N100 PolarHBondContact O-N 2.83Å; T98-N100 PolarHBondContact O-N 2.89Å
101	E	85	Confident	85.8	Confident	91 Å²	91	55.8 Å²	55.8	43%	0.425	29%	0.286	S	S	.	.			trans	-87.7	147.7	171.3	-59.3	170.1	117	0	0	109.2	T97 S99 Y103	T97-E101 PolarHBondContact N-O 3.29Å; T97-E101 WeakPolarHBondContact OG1-CB 3.48Å; T97-E101 PolarHBondContact OG1-N 3.03Å; T97-E101 VanDerWaalsContact OG1-N 3.1Å; T97-E101 PolarHBondContact OG1-O 2.88Å; S99-E101 WeakPolarHBondContact CB-OE2 3.16Å; S99-E101 PolarHBondContact O-N 2.97Å; S99-E101 PolarHBondContact OG-OE2 2.97Å; E101-Y103 HydrophobicContact CB-CD2 4.31Å; E101-Y103 HydrophobicContact CB-CE2 3.64Å; E101-Y103 PolarHBondContact OE1-OH 3.16Å; E101-Y103 PolarHBondContact OE2-OH 2.87Å
102	T	85.3	Confident	86	Confident	69 Å²	69	56 Å²	56	42%	0.423	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	113.7	175.8	-61.8	0	0	0	0	109.5	N94 I95 H96	N94-T102 HydrophobicContact CB-CG2 4.09Å; I95-T102 WeakPolarHBondContact O-CA 3.33Å; H96-T102 WeakPolarHBondContact ND1-CG2 3.37Å; H96-T102 PolarHBondContact ND1-OG1 3.03Å
103	Y	86.2	Confident	86.1	Confident	34 Å²	34	58 Å²	58	13%	0.133	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	101.6	178.3	-65.2	-97.6	0	0	0	109.1	L45 L65 T75 L77 I95 T97 E101	L45-Y103 HydrophobicContact CD1-CD1 4.12Å; L65-Y103 HydrophobicContact CD1-CD1 4.25Å; T75-Y103 HydrophobicContact CG2-CE1 3.85Å; L77-Y103 HydrophobicContact CD1-CD2 4.04Å; L77-Y103 HydrophobicContact CD1-CE2 4.49Å; L77-Y103 HydrophobicContact CD1-CG 4.1Å; L77-Y103 HydrophobicContact CD2-CD2 4.1Å; L77-Y103 HydrophobicContact CD2-CE2 3.75Å; I95-Y103 PolarHBondContact N-O 3.48Å; I95-Y103 PolarHBondContact O-N 2.7Å; T97-Y103 HydrophobicContact CG2-CD2 3.94Å; T97-Y103 HydrophobicContact CG2-CE2 3.83Å; E101-Y103 HydrophobicContact CB-CD2 4.31Å; E101-Y103 HydrophobicContact CB-CE2 3.64Å; E101-Y103 PolarHBondContact OE1-OH 3.16Å; E101-Y103 PolarHBondContact OE2-OH 2.87Å
104	T	88.2	Confident	86	Confident	29 Å²	29	58 Å²	58	18%	0.178	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	113	176.1	-64.7	0	0	0	0	110.2	M46 N94	M46-T104 HydrophobicContact CB-CG2 3.91Å; M46-T104 HydrophobicContact CG-CG2 4.1Å; M46-T104 PolarHBondContact N-O 3.49Å; M46-T104 HydrophobicContact SD-CG2 3.84Å; N94-T104 WeakPolarHBondContact OD1-CB 3.29Å; N94-T104 VanDerWaalsContact OD1-CG2 3.29Å; N94-T104 WeakPolarHBondContact OD1-CG2 3.37Å; N94-T104 PolarHBondContact OD1-OG1 3.09Å
105	L	89	Confident	85.9	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	127.2	173.9	-57.4	-179.8	0	0	0	109.3	D44 L45 L56 L65 S92 V93 I95 F108	D44-L105 WeakPolarHBondContact O-CA 3.32Å; L45-L105 HydrophobicContact CB-CD2 4.21Å; L45-L105 HydrophobicContact CD1-CD2 3.78Å; L56-L105 HydrophobicContact CD1-CD1 4.41Å; L56-L105 HydrophobicContact CD2-CD1 4.02Å; L65-L105 HydrophobicContact CD2-CD1 4.28Å; L65-L105 HydrophobicContact CD2-CD2 3.81Å; S92-L105 CarbonylContact C-O 3.5Å; S92-L105 VanDerWaalsContact CA-O 3.24Å; S92-L105 WeakPolarHBondContact CA-O 3.48Å; V93-L105 PolarHBondContact N-O 3.13Å; V93-L105 PolarHBondContact O-N 3.39Å; I95-L105 HydrophobicContact CD1-CD1 3.79Å; I95-L105 HydrophobicContact CD1-CG 4.48Å; L105-F108 HydrophobicContact CB-CE1 4.49Å; L105-F108 HydrophobicContact CB-CE2 4.04Å; L105-F108 HydrophobicContact CB-CZ 3.6Å; L105-F108 HydrophobicContact CD1-CZ 4.36Å; L105-F108 WeakPolarHBondContact O-CE2 3.35Å
106	A	87.5	Confident	85.7	Confident	7 Å²	7	60.5 Å²	60.5	6%	0.058	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	-176.9	-179.8	0	0	0	0	0	111.4	C43 D44 M46 H91 F108	C43-A106 CarbonylContact C-O 3.56Å; C43-A106 WeakPolarHBondContact CA-O 3.44Å; C43-A106 VanDerWaalsContact CB-O 3.27Å; C43-A106 WeakPolarHBondContact CB-O 3.44Å; D44-A106 PolarHBondContact N-O 3.46Å; D44-A106 PolarHBondContact O-N 3.38Å; M46-A106 HydrophobicContact CG-CB 3.9Å; M46-A106 HydrophobicContact SD-CB 3.51Å; M46-A106 VanDerWaalsContact SD-CB 3.51Å; H91-A106 WeakPolarHBondContact O-CA 3.37Å; A106-F108 VanDerWaalsContact C-N 3.25Å; A106-F108 PolarHBondContact O-N 2.86Å; A106-F108 VanDerWaalsContact O-N 3.14Å
107	N	85.8	Confident	85.8	Confident	94 Å²	94	60.6 Å²	60.6	50%	0.503	33%	0.325	S	S	.	.			trans	51.8	41.2	172.3	-60	-13.3	0	0	0	113.7	D44 E109	D44-N107 HydrophobicContact CB-CB 4.21Å; D44-N107 WeakPolarHBondContact OD2-CB 3.24Å; D44-N107 PolarHBondContact OD2-ND2 3.02Å; N107-E109 PolarHBondContact O-N 3.15Å
108	F	87.6	Confident	85.8	Confident	14 Å²	14	60.4 Å²	60.4	6%	0.061	32%	0.324	C	S	.	.			trans	-63.6	129.4	176.7	-70.3	-88.2	0	0	0	110.7	K42 C43 L56 V93 L105 A106 R110 S111 A114 L118	K42-F108 WeakPolarHBondContact O-CA 3.42Å; C43-F108 HydrophobicContact CB-CD1 3.54Å; C43-F108 HydrophobicContact CB-CD2 4.46Å; C43-F108 HydrophobicContact CB-CE1 3.71Å; C43-F108 HydrophobicContact CB-CG 3.95Å; C43-F108 HydrophobicContact CB-CZ 4.26Å; L56-F108 HydrophobicContact CD2-CE1 4.34Å; V93-F108 HydrophobicContact CB-CE2 4.37Å; V93-F108 HydrophobicContact CB-CZ 4.37Å; V93-F108 HydrophobicContact CG2-CE2 3.97Å; V93-F108 HydrophobicContact CG2-CZ 4.13Å; L105-F108 HydrophobicContact CB-CE1 4.49Å; L105-F108 HydrophobicContact CB-CE2 4.04Å; L105-F108 HydrophobicContact CB-CZ 3.6Å; L105-F108 HydrophobicContact CD1-CZ 4.36Å; L105-F108 WeakPolarHBondContact O-CE2 3.35Å; A106-F108 VanDerWaalsContact C-N 3.25Å; A106-F108 PolarHBondContact O-N 2.86Å; A106-F108 VanDerWaalsContact O-N 3.14Å; F108-R110 PolarHBondContact O-N 3.35Å; F108-S111 PolarHBondContact O-N 3.25Å; F108-A114 HydrophobicContact CB-CB 4.17Å; F108-A114 HydrophobicContact CD1-CB 3.46Å; F108-A114 VanDerWaalsContact CD1-CB 3.46Å; F108-A114 HydrophobicContact CE1-CB 3.99Å; F108-A114 HydrophobicContact CG-CB 3.91Å; F108-L118 HydrophobicContact CE1-CD1 4.27Å; F108-L118 HydrophobicContact CZ-CD1 4.27Å
109	E	84.8	Confident	85.9	Confident	118 Å²	118	62.5 Å²	62.5	55%	0.551	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-20.7	176.2	173.1	174.6	-147.3	0	0	113.5	K42 N107	K42-E109 HydrophobicContact CB-CB 4.13Å; K42-E109 WeakPolarHBondContact CD-OE2 3.38Å; K42-E109 WeakPolarHBondContact CE-OE2 3.26Å; K42-E109 VanDerWaalsContact CG-OE2 3.31Å; K42-E109 WeakPolarHBondContact CG-OE2 3.3Å; K42-E109 IonicContact NZ-OE1 2.64Å; K42-E109 PolarHBondContact NZ-OE1 2.89Å; K42-E109 IonicContact NZ-OE2 2.64Å; K42-E109 PolarHBondContact NZ-OE2 2.94Å; K42-E109 PolarHBondContact O-N 2.86Å; N107-E109 PolarHBondContact O-N 3.15Å
110	R	85.4	Confident	85.9	Confident	181 Å²	181	63.8 Å²	63.8	68%	0.683	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-145.3	81.1	168.5	-62.4	-175.8	-175.5	175.3	-1.5	108.3	F108 D112 S113 A114	F108-R110 PolarHBondContact O-N 3.35Å; R110-D112 PolarHBondContact O-N 3.43Å; R110-S113 PolarHBondContact O-N 3.4Å; R110-A114 VanDerWaalsContact O-CB 3.27Å; R110-A114 WeakPolarHBondContact O-CB 3.14Å; R110-A114 PolarHBondContact O-N 3.04Å
111	S	85.9	Confident	86.2	Confident	22 Å²	22	57.6 Å²	57.6	15%	0.154	29%	0.288	C	S	.	.	H	α-helix	trans	-38.5	-63.5	178.2	37.3	0	0	0	0	112.5	E90 F108 S113 A114 I115	E90-S111 WeakPolarHBondContact O-CB 3.44Å; F108-S111 PolarHBondContact O-N 3.25Å; S111-S113 PolarHBondContact O-N 2.58Å; S111-A114 WeakPolarHBondContact O-CB 3.28Å; S111-A114 PolarHBondContact O-N 3.23Å; S111-I115 WeakPolarHBondContact O-CB 3.1Å; S111-I115 VanDerWaalsContact O-CG1 3.3Å; S111-I115 WeakPolarHBondContact O-CG1 3.11Å; S111-I115 PolarHBondContact O-N 3.24Å
112	D	84.3	Confident	86.1	Confident	113 Å²	113	54.1 Å²	54.1	60%	0.604	27%	0.271	S	S	*	.	H	α-helix	trans	-69.1	-40.7	-165.3	-13.6	-46.2	0	0	0	110.4	R110 A114 A116	R110-D112 PolarHBondContact O-N 3.43Å; D112-A114 VanDerWaalsContact C-N 3.32Å; D112-A114 PolarHBondContact O-N 2.79Å; D112-A116 WeakPolarHBondContact O-CB 3.08Å; D112-A116 PolarHBondContact O-N 2.94Å
113	S	87	Confident	85.9	Confident	54 Å²	54	54.2 Å²	54.2	38%	0.378	27%	0.267	S	S	.	.	H	α-helix	trans	-70.9	-24.1	175	-163.2	0	0	0	0	113.7	K39 Y41 R110 S111 F117	K39-S113 PolarHBondContact NZ-O 3.22Å; K39-S113 PolarHBondContact NZ-OG 3Å; K39-S113 VanDerWaalsContact NZ-OG 3.14Å; Y41-S113 PolarHBondContact OH-O 3.22Å; R110-S113 PolarHBondContact O-N 3.4Å; S111-S113 PolarHBondContact O-N 2.58Å; S113-F117 WeakPolarHBondContact O-CB 3.34Å
114	A	86.8	Confident	85.5	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-81.5	-50.2	175.1	0	0	0	0	0	111.3	Y41 F108 R110 S111 D112 F117 L118	Y41-A114 HydrophobicContact CD1-CB 3.66Å; Y41-A114 HydrophobicContact CD2-CB 4.3Å; Y41-A114 HydrophobicContact CE1-CB 3.69Å; Y41-A114 HydrophobicContact CE2-CB 4.33Å; Y41-A114 HydrophobicContact CG-CB 3.96Å; F108-A114 HydrophobicContact CB-CB 4.17Å; F108-A114 HydrophobicContact CD1-CB 3.46Å; F108-A114 VanDerWaalsContact CD1-CB 3.46Å; F108-A114 HydrophobicContact CE1-CB 3.99Å; F108-A114 HydrophobicContact CG-CB 3.91Å; R110-A114 VanDerWaalsContact O-CB 3.27Å; R110-A114 WeakPolarHBondContact O-CB 3.14Å; R110-A114 PolarHBondContact O-N 3.04Å; S111-A114 WeakPolarHBondContact O-CB 3.28Å; S111-A114 PolarHBondContact O-N 3.23Å; D112-A114 VanDerWaalsContact C-N 3.32Å; D112-A114 PolarHBondContact O-N 2.79Å; A114-F117 PolarHBondContact O-N 2.84Å; A114-L118 WeakPolarHBondContact O-CB 3.33Å; A114-L118 VanDerWaalsContact O-CG 3.28Å; A114-L118 WeakPolarHBondContact O-CG 3.19Å; A114-L118 PolarHBondContact O-N 2.94Å
115	I	86.1	Confident	84.8	Confident	19 Å²	19	53.5 Å²	53.5	10%	0.097	27%	0.265	C	S	.	.	H	α-helix	trans	-66.9	-50.4	-176.8	-67.3	168.9	0	0	0	110.7	V87 E90 V93 S111 F117 L118 R119	V87-I115 HydrophobicContact CB-CG2 4.38Å; V87-I115 HydrophobicContact CG1-CG2 3.75Å; V87-I115 HydrophobicContact CG2-CG2 3.65Å; E90-I115 WeakPolarHBondContact O-CD1 3.33Å; V93-I115 HydrophobicContact CG2-CD1 4.46Å; V93-I115 HydrophobicContact CG2-CG1 3.73Å; S111-I115 WeakPolarHBondContact O-CB 3.1Å; S111-I115 VanDerWaalsContact O-CG1 3.3Å; S111-I115 WeakPolarHBondContact O-CG1 3.11Å; S111-I115 PolarHBondContact O-N 3.24Å; I115-F117 VanDerWaalsContact C-N 3.28Å; I115-F117 PolarHBondContact O-N 2.83Å; I115-L118 PolarHBondContact O-N 3.05Å; I115-R119 WeakPolarHBondContact O-CB 3.26Å; I115-R119 PolarHBondContact O-N 2.85Å
116	A	85.7	Confident	83.9	Confident	51 Å²	51	56.6 Å²	56.6	42%	0.421	28%	0.281	S	S	.	.	H	α-helix	trans	-62.9	-36	177.8	0	0	0	0	0	112	D112 N120	D112-A116 WeakPolarHBondContact O-CB 3.08Å; D112-A116 PolarHBondContact O-N 2.94Å; A116-N120 VanDerWaalsContact O-CB 3.26Å; A116-N120 WeakPolarHBondContact O-CB 3.48Å; A116-N120 PolarHBondContact O-N 2.87Å; A116-N120 PolarHBondContact O-OD1 2.86Å; A116-N120 VanDerWaalsContact O-OD1 3.07Å
117	F	87.4	Confident	82.6	Confident	49 Å²	49	62.1 Å²	62.1	22%	0.215	30%	0.304	C	S	.	.	H	α-helix	trans	-70.3	-44.1	175.3	179.3	-93.5	0	0	0	112.5	I38 K39 Y41 V58 S113 A114 I115 Y121	I38-F117 HydrophobicContact CG2-CZ 3.97Å; K39-F117 HydrophobicContact CB-CD1 4.5Å; K39-F117 HydrophobicContact CB-CE1 3.79Å; K39-F117 HydrophobicContact CB-CE2 4.48Å; K39-F117 HydrophobicContact CB-CZ 3.79Å; K39-F117 HydrophobicContact CD-CD1 4.21Å; K39-F117 HydrophobicContact CD-CD2 3.95Å; K39-F117 HydrophobicContact CD-CE1 4.18Å; K39-F117 HydrophobicContact CD-CE2 3.94Å; K39-F117 HydrophobicContact CD-CG 4.08Å; K39-F117 HydrophobicContact CD-CZ 4.05Å; Y41-F117 AromaticContact CE2-CD1 3.99Å; Y41-F117 HydrophobicContact CE2-CD1 3.99Å; Y41-F117 WeakPolarHBondContact OH-CB 3.37Å; Y41-F117 WeakPolarHBondContact OH-CD1 3.39Å; Y41-F117 WeakPolarHBondContact OH-CG 3.27Å; V58-F117 HydrophobicContact CB-CE1 4.12Å; V58-F117 HydrophobicContact CG1-CE1 3.99Å; V58-F117 HydrophobicContact CG2-CE1 4.06Å; S113-F117 WeakPolarHBondContact O-CB 3.34Å; A114-F117 PolarHBondContact O-N 2.84Å; I115-F117 VanDerWaalsContact C-N 3.28Å; I115-F117 PolarHBondContact O-N 2.83Å; F117-Y121 WeakPolarHBondContact O-CB 3.46Å; F117-Y121 PolarHBondContact O-N 2.82Å
118	L	86.1	Confident	81.4	Confident	5 Å²	5	60.3 Å²	60.3	3%	0.026	29%	0.293	C	S	.	.	H	α-helix	trans	-63.3	-43.5	177.7	-77.3	169.9	0	0	0	111.2	L56 V58 L63 L85 F108 A114 I115 W122	L56-L118 HydrophobicContact CD2-CD1 3.93Å; L56-L118 HydrophobicContact CD2-CD2 4.14Å; V58-L118 HydrophobicContact CG2-CD2 3.93Å; L63-L118 HydrophobicContact CD2-CD2 4.21Å; L85-L118 HydrophobicContact CD1-CB 4.26Å; F108-L118 HydrophobicContact CE1-CD1 4.27Å; F108-L118 HydrophobicContact CZ-CD1 4.27Å; A114-L118 WeakPolarHBondContact O-CB 3.33Å; A114-L118 VanDerWaalsContact O-CG 3.28Å; A114-L118 WeakPolarHBondContact O-CG 3.19Å; A114-L118 PolarHBondContact O-N 2.94Å; I115-L118 PolarHBondContact O-N 3.05Å; L118-W122 WeakPolarHBondContact O-CB 3.38Å; L118-W122 PolarHBondContact O-N 3.07Å
119	R	85.3	Confident	79.8	Confident	143 Å²	143	63.9 Å²	63.9	54%	0.54	31%	0.308	S	S	.	.	H	α-helix	trans	-59.5	-57.2	173.7	179.9	178.1	175.6	164.9	2.7	111.4	I115 Y121 W122 E123	I115-R119 WeakPolarHBondContact O-CB 3.26Å; I115-R119 PolarHBondContact O-N 2.85Å; R119-Y121 VanDerWaalsContact C-N 3.3Å; R119-Y121 PolarHBondContact O-N 3.35Å; R119-W122 PolarHBondContact O-N 2.94Å; R119-E123 WeakPolarHBondContact CG-OE1 3.39Å; R119-E123 IonicContact CZ-OE1 3.61Å; R119-E123 IonicContact NE-OE1 2.82Å; R119-E123 PolarHBondContact NE-OE1 3.4Å; R119-E123 IonicContact NH2-OE1 3.48Å; R119-E123 PolarHBondContact NH2-OE1 2.78Å; R119-E123 WeakPolarHBondContact O-CG 3.42Å; R119-E123 PolarHBondContact O-N 2.86Å
120	N	85.4	Confident	77.7	Confident	96 Å²	96	62.7 Å²	62.7	51%	0.513	31%	0.312	S	S	.	.	H	α-helix	trans	-63.9	-36.1	-175.6	-65.5	11.9	0	0	0	112	A116 V124	A116-N120 VanDerWaalsContact O-CB 3.26Å; A116-N120 WeakPolarHBondContact O-CB 3.48Å; A116-N120 PolarHBondContact O-N 2.87Å; A116-N120 PolarHBondContact O-OD1 2.86Å; A116-N120 VanDerWaalsContact O-OD1 3.07Å; N120-V124 WeakPolarHBondContact O-CG2 3.47Å; N120-V124 PolarHBondContact O-N 3.34Å; N120-V124 VanDerWaalsContact O-N 3.16Å
121	Y	85.2	Confident	75.4	Confident	20 Å²	20	61.7 Å²	61.7	8%	0.078	31%	0.313	C	S	.	.	H	α-helix	trans	-72.3	-37.6	176.9	-169.6	-125.8	0	0	0	112	I38 V58 H60 F79 F117 R119 V124 I125	I38-Y121 HydrophobicContact CD1-CE1 4.08Å; I38-Y121 HydrophobicContact CD1-CE2 4.06Å; I38-Y121 WeakPolarHBondContact CD1-OH 3.41Å; V58-Y121 HydrophobicContact CG1-CD1 3.56Å; V58-Y121 HydrophobicContact CG1-CE1 3.46Å; V58-Y121 VanDerWaalsContact CG1-CE1 3.46Å; H60-Y121 PolarHBondContact ND1-OH 3.27Å; F79-Y121 HydrophobicContact CE2-CE1 4.12Å; F79-Y121 HydrophobicContact CZ-CD1 4.31Å; F79-Y121 AromaticContact CZ-CE1 3.75Å; F79-Y121 HydrophobicContact CZ-CE1 3.75Å; F117-Y121 WeakPolarHBondContact O-CB 3.46Å; F117-Y121 PolarHBondContact O-N 2.82Å; R119-Y121 VanDerWaalsContact C-N 3.3Å; R119-Y121 PolarHBondContact O-N 3.35Å; Y121-V124 PolarHBondContact O-N 2.86Å; Y121-I125 HydrophobicContact CD1-CD1 3.82Å; Y121-I125 HydrophobicContact CD2-CD1 4.49Å; Y121-I125 HydrophobicContact CE1-CD1 3.53Å; Y121-I125 HydrophobicContact CE2-CD1 4.21Å; Y121-I125 HydrophobicContact CE2-CG1 4.49Å; Y121-I125 HydrophobicContact CG-CD1 4.29Å; Y121-I125 WeakPolarHBondContact O-CG1 3.22Å; Y121-I125 PolarHBondContact O-N 2.96Å
122	W	82.4	Confident	72.9	Confident	18 Å²	18	64.5 Å²	64.5	7%	0.068	33%	0.332	C	S	.	.	H	α-helix	trans	-65.2	-40.1	171.9	-176.6	-119.8	0	0	0	112.3	F79 I82 L85 L118 R119 V124 I125 L126	F79-W122 HydrophobicContact CB-CZ3 4.38Å; F79-W122 HydrophobicContact CD1-CE3 4.09Å; F79-W122 AromaticContact CD1-CZ3 3.9Å; F79-W122 HydrophobicContact CD1-CZ3 3.9Å; I82-W122 HydrophobicContact CB-CH2 3.6Å; I82-W122 HydrophobicContact CB-CZ2 4.27Å; I82-W122 HydrophobicContact CB-CZ3 3.95Å; I82-W122 HydrophobicContact CG2-CH2 3.49Å; I82-W122 VanDerWaalsContact CG2-CH2 3.49Å; I82-W122 HydrophobicContact CG2-CZ2 3.65Å; I82-W122 HydrophobicContact CG2-CZ3 3.97Å; I82-W122 WeakPolarHBondContact O-CH2 3.37Å; L85-W122 HydrophobicContact CB-CD2 4.49Å; L85-W122 HydrophobicContact CB-CG 4.11Å; L85-W122 HydrophobicContact CD1-CB 4.41Å; L85-W122 HydrophobicContact CD1-CG 4.47Å; L118-W122 WeakPolarHBondContact O-CB 3.38Å; L118-W122 PolarHBondContact O-N 3.07Å; R119-W122 PolarHBondContact O-N 2.94Å; W122-V124 VanDerWaalsContact C-N 3.28Å; W122-V124 PolarHBondContact O-N 3.34Å; W122-I125 HydrophobicContact CE3-CB 4.39Å; W122-I125 HydrophobicContact CE3-CG2 4.29Å; W122-I125 HydrophobicContact CZ3-CG2 4.1Å; W122-I125 PolarHBondContact O-N 2.8Å; W122-L126 HydrophobicContact CD2-CG 4.17Å; W122-L126 HydrophobicContact CG-CD1 4.45Å; W122-L126 HydrophobicContact CG-CG 4.47Å; W122-L126 HydrophobicContact CH2-CD2 4.19Å; W122-L126 HydrophobicContact CZ2-CD1 4.47Å; W122-L126 HydrophobicContact CZ2-CD2 3.65Å; W122-L126 HydrophobicContact CZ2-CG 4.03Å; W122-L126 WeakPolarHBondContact O-CB 3.43Å; W122-L126 WeakPolarHBondContact O-CG 3.47Å; W122-L126 PolarHBondContact O-N 3.42Å
123	E	81.2	Confident	70.3	Confident	72 Å²	72	64.7 Å²	64.7	34%	0.336	34%	0.34	S	S	.	.	H	α-helix	trans	-63.7	-30.5	174	-73.3	-179.8	-158.5	0	0	112.7	R119 K127	R119-E123 WeakPolarHBondContact CG-OE1 3.39Å; R119-E123 IonicContact CZ-OE1 3.61Å; R119-E123 IonicContact NE-OE1 2.82Å; R119-E123 PolarHBondContact NE-OE1 3.4Å; R119-E123 IonicContact NH2-OE1 3.48Å; R119-E123 PolarHBondContact NH2-OE1 2.78Å; R119-E123 WeakPolarHBondContact O-CG 3.42Å; R119-E123 PolarHBondContact O-N 2.86Å; E123-K127 WeakPolarHBondContact O-CD 3.37Å; E123-K127 VanDerWaalsContact O-CG 3.27Å; E123-K127 WeakPolarHBondContact O-CG 3.44Å; E123-K127 PolarHBondContact O-N 2.85Å
124	V	78.5	Confident	67.5	Low	37 Å²	37	67 Å²	67	22%	0.224	36%	0.356	C	S	.	.	H	α-helix	trans	-70.7	-47	171.3	170.3	0	0	0	0	111.1	N120 Y121 W122 L126 K127 E128 L174	N120-V124 WeakPolarHBondContact O-CG2 3.47Å; N120-V124 PolarHBondContact O-N 3.34Å; N120-V124 VanDerWaalsContact O-N 3.16Å; Y121-V124 PolarHBondContact O-N 2.86Å; W122-V124 VanDerWaalsContact C-N 3.28Å; W122-V124 PolarHBondContact O-N 3.34Å; V124-L126 PolarHBondContact O-N 3.18Å; V124-K127 WeakPolarHBondContact O-CB 3.24Å; V124-K127 PolarHBondContact O-N 2.84Å; V124-E128 PolarHBondContact O-N 2.84Å; V124-L174 HydrophobicContact CG2-CD1 4.07Å
125	I	74.1	Confident	64.8	Low	10 Å²	10	78.2 Å²	78.2	5%	0.051	40%	0.4	C	S	.	.	H	α-helix	trans	-66.7	-35.3	179.5	-67.7	164.4	0	0	0	111.9	F79 Y121 W122 E128 K129	F79-I125 HydrophobicContact CB-CG2 3.94Å; F79-I125 HydrophobicContact CD1-CD1 3.74Å; F79-I125 HydrophobicContact CD2-CD1 3.78Å; F79-I125 HydrophobicContact CE1-CD1 3.65Å; F79-I125 HydrophobicContact CE2-CD1 3.71Å; F79-I125 HydrophobicContact CG-CD1 3.81Å; F79-I125 HydrophobicContact CG-CG2 4.21Å; F79-I125 HydrophobicContact CZ-CD1 3.66Å; Y121-I125 HydrophobicContact CD1-CD1 3.82Å; Y121-I125 HydrophobicContact CD2-CD1 4.49Å; Y121-I125 HydrophobicContact CE1-CD1 3.53Å; Y121-I125 HydrophobicContact CE2-CD1 4.21Å; Y121-I125 HydrophobicContact CE2-CG1 4.49Å; Y121-I125 HydrophobicContact CG-CD1 4.29Å; Y121-I125 WeakPolarHBondContact O-CG1 3.22Å; Y121-I125 PolarHBondContact O-N 2.96Å; W122-I125 HydrophobicContact CE3-CB 4.39Å; W122-I125 HydrophobicContact CE3-CG2 4.29Å; W122-I125 HydrophobicContact CZ3-CG2 4.1Å; W122-I125 PolarHBondContact O-N 2.8Å; I125-E128 WeakPolarHBondContact O-CB 3.46Å; I125-E128 PolarHBondContact O-N 3.07Å; I125-K129 PolarHBondContact O-N 2.89Å
126	L	69.2	Low	62	Low	66 Å²	66	81 Å²	81	35%	0.346	43%	0.433	S	S	.	.	H	α-helix	trans	-63.8	-40.6	172.5	-78.3	179.5	0	0	0	111.6	W122 V124 E128 K129 C130	W122-L126 HydrophobicContact CD2-CG 4.17Å; W122-L126 HydrophobicContact CG-CD1 4.45Å; W122-L126 HydrophobicContact CG-CG 4.47Å; W122-L126 HydrophobicContact CH2-CD2 4.19Å; W122-L126 HydrophobicContact CZ2-CD1 4.47Å; W122-L126 HydrophobicContact CZ2-CD2 3.65Å; W122-L126 HydrophobicContact CZ2-CG 4.03Å; W122-L126 WeakPolarHBondContact O-CB 3.43Å; W122-L126 WeakPolarHBondContact O-CG 3.47Å; W122-L126 PolarHBondContact O-N 3.42Å; V124-L126 PolarHBondContact O-N 3.18Å; L126-E128 VanDerWaalsContact C-N 3.33Å; L126-K129 PolarHBondContact O-N 3.42Å; L126-C130 PolarHBondContact O-N 2.85Å; L126-C130 VanDerWaalsContact O-N 3.08Å; L126-C130 PolarHBondContact O-SG 3.4Å; L126-C130 VanDerWaalsContact O-SG 3.4Å
127	K	60.7	Low	59.4	Low	122 Å²	122	83.8 Å²	83.8	53%	0.53	45%	0.45	S	S	.	.	H	α-helix	trans	-61.7	-42.6	172.6	-73.1	164.9	-174.6	169.2	0	110.6	E123 V124 C130 F131	E123-K127 WeakPolarHBondContact O-CD 3.37Å; E123-K127 VanDerWaalsContact O-CG 3.27Å; E123-K127 WeakPolarHBondContact O-CG 3.44Å; E123-K127 PolarHBondContact O-N 2.85Å; V124-K127 WeakPolarHBondContact O-CB 3.24Å; V124-K127 PolarHBondContact O-N 2.84Å; K127-C130 CarbonylContact O-C 3.58Å; K127-C130 WeakPolarHBondContact O-CA 3.44Å; K127-C130 PolarHBondContact O-N 2.98Å; K127-C130 VanDerWaalsContact O-N 3.09Å; K127-F131 HydrophobicContact CB-CD2 4.2Å; K127-F131 HydrophobicContact CB-CE2 4.31Å; K127-F131 WeakPolarHBondContact O-CB 3.31Å; K127-F131 WeakPolarHBondContact O-CD2 3.35Å; K127-F131 PolarHBondContact O-N 2.83Å
128	E	59.8	Low	56.5	Low	57 Å²	57	86.4 Å²	86.4	27%	0.266	47%	0.474	S	S	.	.	H	α-helix	trans	-62.2	-41.9	175.9	-168.8	173.5	-172.1	0	0	113.1	V124 I125 L126 C130 F131 S132	V124-E128 PolarHBondContact O-N 2.84Å; I125-E128 WeakPolarHBondContact O-CB 3.46Å; I125-E128 PolarHBondContact O-N 3.07Å; L126-E128 VanDerWaalsContact C-N 3.33Å; E128-C130 VanDerWaalsContact C-N 3.25Å; E128-C130 PolarHBondContact O-N 3.27Å; E128-F131 PolarHBondContact O-N 3.39Å; E128-S132 PolarHBondContact O-N 3.14Å; E128-S132 VanDerWaalsContact O-N 3.11Å; E128-S132 PolarHBondContact O-OG 2.81Å
129	K	55.5	Low	53.9	Low	88 Å²	88	91.6 Å²	91.6	38%	0.383	51%	0.508	S	S	.	.	H	α-helix	trans	-58.2	-36.3	170.4	-74.2	-171.4	-177.5	-176.7	0	112.4	F79 I82 I125 L126	F79-K129 WeakPolarHBondContact O-CE 3.47Å; F79-K129 PolarHBondContact O-NZ 2.84Å; I82-K129 PolarHBondContact O-NZ 3.38Å; I125-K129 PolarHBondContact O-N 2.89Å; L126-K129 PolarHBondContact O-N 3.42Å
130	C	40	Very low	51.1	Low	94 Å²	94	88.2 Å²	88.2	64%	0.635	51%	0.511	S	S	*	.	H	α-helix	trans	-82.1	-19.5	177.7	-67.8	0	0	0	0	114.3	L126 K127 E128	L126-C130 PolarHBondContact O-N 2.85Å; L126-C130 VanDerWaalsContact O-N 3.08Å; L126-C130 PolarHBondContact O-SG 3.4Å; L126-C130 VanDerWaalsContact O-SG 3.4Å; K127-C130 CarbonylContact O-C 3.58Å; K127-C130 WeakPolarHBondContact O-CA 3.44Å; K127-C130 PolarHBondContact O-N 2.98Å; K127-C130 VanDerWaalsContact O-N 3.09Å; E128-C130 VanDerWaalsContact C-N 3.25Å; E128-C130 PolarHBondContact O-N 3.27Å
131	F	36.8	Very low	48.5	Very low	159 Å²	159	91 Å²	91	70%	0.697	53%	0.525	S	S	*	.	H	α-helix	trans	-103.3	6.9	-179.9	-74.7	-59.1	0	0	0	114.2	K127 E128 P133	K127-F131 HydrophobicContact CB-CD2 4.2Å; K127-F131 HydrophobicContact CB-CE2 4.31Å; K127-F131 WeakPolarHBondContact O-CB 3.31Å; K127-F131 WeakPolarHBondContact O-CD2 3.35Å; K127-F131 PolarHBondContact O-N 2.83Å; E128-F131 PolarHBondContact O-N 3.39Å; F131-P133 VanDerWaalsContact O-CD 3.26Å; F131-P133 WeakPolarHBondContact O-CD 3.46Å
132	S	33	Very low	45.8	Very low	81 Å²	81	102.4 Å²	102.4	57%	0.566	57%	0.568	S	S	*	*	S	Bend	trans	-63.5	112.2	165.6	-65.8	0	0	0	0	109.3	E128 S134	E128-S132 PolarHBondContact O-N 3.14Å; E128-S132 VanDerWaalsContact O-N 3.11Å; E128-S132 PolarHBondContact O-OG 2.81Å; S132-S134 PolarHBondContact O-N 3.05Å
133	P	29.6	Very low	43.3	Very low	117 Å²	117	108 Å²	108	76%	0.76	60%	0.599	S	S	*	*			trans	-81.5	80.8	-163.8	32.7	-35.5	0	0	0	111.9	F131 Y135	F131-P133 VanDerWaalsContact O-CD 3.26Å; F131-P133 WeakPolarHBondContact O-CD 3.46Å; P133-Y135 PolarHBondContact O-N 3.33Å
134	S	29.2	Very low	40.7	Very low	104 Å²	104	113.5 Å²	113.5	73%	0.727	62%	0.622	S	S	*	*			trans	-64.9	123.6	152.1	-170.6	0	0	0	0	107.8	S132 G136	S132-S134 PolarHBondContact O-N 3.05Å; S134-G136 PolarHBondContact O-N 3.41Å; S134-G136 VanDerWaalsContact O-N 3.16Å
135	Y	29.8	Very low	38.5	Very low	235 Å²	235	118.9 Å²	118.9	92%	0.922	65%	0.654	S	S	*	*	S	Bend	trans	-62.7	116.8	-176.7	-82	-103.1	0	0	0	110.7	P133	P133-Y135 PolarHBondContact O-N 3.33Å
136	G	27.7	Very low	36.3	Very low	77 Å²	77	124.4 Å²	124.4	79%	0.794	68%	0.684	S	S	*	*	S	Bend	trans	87.7	62.9	162.4	0	0	0	0	0	117.2	S134	S134-G136 PolarHBondContact O-N 3.41Å; S134-G136 VanDerWaalsContact O-N 3.16Å
137	S	30.1	Very low	34.3	Very low	109 Å²	109	127 Å²	127	76%	0.762	70%	0.698	S	S	*	*			trans	-159.8	134.4	142.1	16.9	0	0	0	0	111.9
138	S	27	Very low	32.8	Very low	104 Å²	104	127.7 Å²	127.7	73%	0.727	71%	0.708	S	S	*	*			trans	-72.4	136.1	175.8	-175.5	0	0	0	0	110.3	A140	S138-A140 PolarHBondContact O-N 2.95Å
139	P	30.7	Very low	31.5	Very low	115 Å²	115	131.6 Å²	131.6	75%	0.747	74%	0.736	S	S	*	*	S	Bend	trans	-78.9	57.2	-177.3	33.9	-36.9	0	0	0	112.8
140	A	28	Very low	30.4	Very low	71 Å²	71	132.7 Å²	132.7	59%	0.587	75%	0.75	S	S	*	*			trans	-99.8	138.7	160	0	0	0	0	0	108.9	S138	S138-A140 PolarHBondContact O-N 2.95Å
141	N	29.3	Very low	30	Very low	154 Å²	154	134.8 Å²	134.8	82%	0.824	76%	0.755	S	S	*	*			trans	59.7	79.1	176.3	-55.4	-19.3	0	0	0	116
142	R	30	Very low	29.8	Very low	261 Å²	261	134.2 Å²	134.2	99%	0.985	76%	0.759	S	S	*	*			trans	-109.9	52.5	147.7	-81.5	-165.7	172.5	-170.9	-0.6	111.8
143	L	28.3	Very low	29.8	Very low	136 Å²	136	136.8 Å²	136.8	71%	0.712	77%	0.767	S	S	*	*			trans	-92	108.5	158.3	-96.3	166	0	0	0	107.8
144	F	27.5	Very low	30	Very low	187 Å²	187	138 Å²	138	82%	0.82	77%	0.767	S	S	*	*			trans	59.9	134.9	174.7	-55.6	-82.6	0	0	0	117.9
145	V	31.8	Very low	30.1	Very low	149 Å²	149	140.6 Å²	140.6	90%	0.903	77%	0.772	S	S	*	*				169.9	150	119.8	155.7	0	0	0	0	107.9
146	N	28	Very low	30.2	Very low	127 Å²	127	135.6 Å²	135.6	68%	0.679	77%	0.766	S	S	*	*			trans	-110.7	158.6	-169.1	-167.4	22.8	0	0	0	112.3
147	N	27.6	Very low	30.5	Very low	119 Å²	119	139.1 Å²	139.1	64%	0.636	77%	0.767	S	S	*	*			trans	68.7	135.3	162.3	-71.4	-18.5	0	0	0	121.1
148	N	28.9	Very low	30.8	Very low	137 Å²	137	140.7 Å²	140.7	73%	0.733	77%	0.767	S	S	*	*			trans	56.5	108.7	140.2	-55	-10	0	0	0	120.4
149	T	33.3	Very low	31.2	Very low	139 Å²	139	144.1 Å²	144.1	85%	0.853	78%	0.777	S	S	*	*				-165.9	157.9	98	15.2	0	0	0	0	115.1
150	T	31.2	Very low	31.5	Very low	112 Å²	112	145.8 Å²	145.8	69%	0.687	78%	0.778	S	S	*	*			trans	-40.6	154.8	178.4	32.7	0	0	0	0	121.2
151	N	32.5	Very low	32	Very low	137 Å²	137	147.1 Å²	147.1	73%	0.733	78%	0.779	S	S	*	*			trans	56.9	121	145.6	-56.5	-3.6	0	0	0	118
152	N	32.7	Very low	32.5	Very low	148 Å²	148	146.4 Å²	146.4	79%	0.791	77%	0.771	S	S	*	*				-163	166.7	65.1	-115.9	-27.5	0	0	0	114.9
153	N	31.7	Very low	33.1	Very low	135 Å²	135	137 Å²	137	72%	0.722	74%	0.744	S	S	*	*			trans	-69.3	140.3	-177.4	-50.7	-39.8	0	0	0	113.5
154	N	33.8	Very low	33.6	Very low	141 Å²	141	136 Å²	136	75%	0.754	74%	0.739	S	S	*	*				168.9	154.4	108.9	-83.4	-31	0	0	0	113.2
155	N	31.9	Very low	34.3	Very low	159 Å²	159	129.5 Å²	129.5	85%	0.85	72%	0.72	S	S	*	*			trans	59.3	79.8	161.2	-59.4	-4.9	0	0	0	118.6
156	T	31.5	Very low	35	Very low	130 Å²	130	127.3 Å²	127.3	80%	0.798	70%	0.702	S	S	*	*			trans	-129	94.6	165.2	55.8	0	0	0	0	111.4
157	N	34.3	Very low	36	Very low	151 Å²	151	123.1 Å²	123.1	81%	0.807	68%	0.679	S	S	*	*			trans	-145.5	-16.6	175.5	-93.9	-33.6	0	0	0	116.6
158	D	36.3	Very low	36.7	Very low	143 Å²	143	120.3 Å²	120.3	77%	0.765	67%	0.669	S	S	*	*	S	Bend	trans	-94	-12.4	-172.8	-92.7	-52	0	0	0	116.5	L160 T161	D158-L160 PolarHBondContact O-N 2.8Å; D158-T161 PolarHBondContact O-OG1 3.41Å
159	L	35.1	Very low	37.5	Very low	176 Å²	176	117.7 Å²	117.7	92%	0.921	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	3.6	-171	-152	69.1	0	0	0	114.7
160	L	38.2	Very low	38.3	Very low	149 Å²	149	113.2 Å²	113.2	78%	0.78	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.9	-6.8	-173	-78.2	164.2	0	0	0	114.7	D158	D158-L160 PolarHBondContact O-N 2.8Å
161	T	39.2	Very low	38.9	Very low	100 Å²	100	114.8 Å²	114.8	61%	0.613	62%	0.62	S	S	*	*	S	Bend	trans	-90.9	-22.4	-169.9	49.2	0	0	0	0	114.9	D158 P163	D158-T161 PolarHBondContact O-OG1 3.41Å; T161-P163 VanDerWaalsContact C-CD 3.45Å
162	H	39.8	Very low	39.6	Very low	138 Å²	138	112.5 Å²	112.5	64%	0.639	61%	0.608	S	S	*	*			trans	-122.3	28.7	-171.8	-89.3	-76.5	0	0	0	118.7	N164 A165	H162-N164 VanDerWaalsContact C-N 3.28Å; H162-N164 PolarHBondContact O-N 3.47Å; H162-A165 PolarHBondContact O-N 3.27Å
163	P	40.9	Very low	40.3	Very low	65 Å²	65	113 Å²	113	42%	0.422	60%	0.598	S	S	.	*	H	α-helix	trans	-56.1	-42.2	178.5	24.5	-33.4	0	0	0	112.4	T161 A165 I166 I167	T161-P163 VanDerWaalsContact C-CD 3.45Å; P163-A165 PolarHBondContact O-N 2.95Å; P163-I166 PolarHBondContact O-N 3.24Å; P163-I167 HydrophobicContact CB-CD1 4.23Å; P163-I167 WeakPolarHBondContact O-CD1 3.32Å; P163-I167 WeakPolarHBondContact O-CG1 3.43Å; P163-I167 PolarHBondContact O-N 3.09Å
164	N	39.7	Very low	40.9	Very low	114 Å²	114	110.6 Å²	110.6	61%	0.61	59%	0.585	S	S	*	*	H	α-helix	trans	-58.9	-20.4	-176.1	-66.1	-12.5	0	0	0	115.1	H162 S168	H162-N164 VanDerWaalsContact C-N 3.28Å; H162-N164 PolarHBondContact O-N 3.47Å; N164-S168 PolarHBondContact O-N 2.87Å; N164-S168 PolarHBondContact O-OG 2.87Å
165	A	41.5	Very low	41.5	Very low	50 Å²	50	108.5 Å²	108.5	41%	0.413	57%	0.573	S	S	.	*	H	α-helix	trans	-79.2	-47.4	178.5	0	0	0	0	0	112.1	H162 P163 I167 S168 D169	H162-A165 PolarHBondContact O-N 3.27Å; P163-A165 PolarHBondContact O-N 2.95Å; A165-I167 PolarHBondContact O-N 3.23Å; A165-S168 PolarHBondContact O-N 3.24Å; A165-S168 PolarHBondContact O-OG 2.83Å; A165-S168 VanDerWaalsContact O-OG 3.04Å; A165-D169 PolarHBondContact O-N 2.77Å
166	I	46.2	Very low	41.9	Very low	103 Å²	103	105.8 Å²	105.8	53%	0.528	56%	0.558	S	S	.	*	H	α-helix	trans	-60.8	-40.5	177.1	-57.3	172.2	0	0	0	109.8	P163 S168 D169 L170	P163-I166 PolarHBondContact O-N 3.24Å; I166-S168 VanDerWaalsContact C-N 3.33Å; I166-S168 PolarHBondContact O-N 2.88Å; I166-D169 PolarHBondContact O-N 2.88Å; I166-L170 HydrophobicContact CG2-CD1 4.13Å; I166-L170 WeakPolarHBondContact O-CB 3.38Å; I166-L170 WeakPolarHBondContact O-CG 3.4Å; I166-L170 PolarHBondContact O-N 3.18Å
167	I	49	Very low	42.1	Very low	40 Å²	40	103.7 Å²	103.7	21%	0.205	55%	0.548	C	S	.	.	H	α-helix	trans	-60.9	-38.8	178.4	-65.2	171.6	0	0	0	112.5	H60 P163 A165 Y171	H60-I167 WeakPolarHBondContact CD2-CD1 3.44Å; H60-I167 WeakPolarHBondContact ND1-CG2 3.09Å; H60-I167 WeakPolarHBondContact NE2-CG1 3.43Å; P163-I167 HydrophobicContact CB-CD1 4.23Å; P163-I167 WeakPolarHBondContact O-CD1 3.32Å; P163-I167 WeakPolarHBondContact O-CG1 3.43Å; P163-I167 PolarHBondContact O-N 3.09Å; A165-I167 PolarHBondContact O-N 3.23Å; I167-Y171 WeakPolarHBondContact O-CB 3.15Å; I167-Y171 PolarHBondContact O-N 3.19Å
168	S	43.9	Very low	42.4	Very low	60 Å²	60	105.2 Å²	105.2	42%	0.42	55%	0.548	S	S	.	.	H	α-helix	trans	-80	-33.1	-177.9	38.8	0	0	0	0	112.5	N164 A165 I166 Y171 N172	N164-S168 PolarHBondContact O-N 2.87Å; N164-S168 PolarHBondContact O-OG 2.87Å; A165-S168 PolarHBondContact O-N 3.24Å; A165-S168 PolarHBondContact O-OG 2.83Å; A165-S168 VanDerWaalsContact O-OG 3.04Å; I166-S168 VanDerWaalsContact C-N 3.33Å; I166-S168 PolarHBondContact O-N 2.88Å; S168-Y171 PolarHBondContact O-N 3.4Å; S168-N172 PolarHBondContact O-N 3.38Å; S168-N172 PolarHBondContact O-ND2 3.48Å
169	D	44.6	Very low	42.2	Very low	81 Å²	81	100.9 Å²	100.9	43%	0.433	54%	0.537	S	S	.	.	H	α-helix	trans	-63.8	-45.1	166	-176.8	62.3	0	0	0	111.5	A165 I166 Y171 N172 R173	A165-D169 PolarHBondContact O-N 2.77Å; I166-D169 PolarHBondContact O-N 2.88Å; D169-Y171 VanDerWaalsContact C-N 3.29Å; D169-Y171 PolarHBondContact O-N 3.38Å; D169-N172 WeakPolarHBondContact O-CB 3.35Å; D169-N172 PolarHBondContact O-N 2.89Å; D169-N172 VanDerWaalsContact O-N 3.14Å; D169-R173 WeakPolarHBondContact O-CB 3.27Å; D169-R173 WeakPolarHBondContact O-CG 3.41Å; D169-R173 PolarHBondContact O-N 3.43Å; D169-R173 WeakPolarHBondContact OD2-CD 3.25Å
170	L	50.7	Low	42	Very low	46 Å²	46	96.6 Å²	96.6	24%	0.241	52%	0.522	C	S	.	.	H	α-helix	trans	-59.4	-38.2	175	-79.1	170.8	0	0	0	112.4	I166 R173 L174	I166-L170 HydrophobicContact CG2-CD1 4.13Å; I166-L170 WeakPolarHBondContact O-CB 3.38Å; I166-L170 WeakPolarHBondContact O-CG 3.4Å; I166-L170 PolarHBondContact O-N 3.18Å; L170-R173 PolarHBondContact O-N 3.32Å; L170-L174 VanDerWaalsContact O-CB 3.26Å; L170-L174 WeakPolarHBondContact O-CB 3.41Å; L170-L174 PolarHBondContact O-N 2.9Å
171	Y	44.7	Very low	41.9	Very low	145 Å²	145	95.6 Å²	95.6	57%	0.569	52%	0.522	S	S	*	.	H	α-helix	trans	-65.2	-42	175	-170.6	-109	0	0	0	112.1	I167 S168 D169 L174 L175	I167-Y171 WeakPolarHBondContact O-CB 3.15Å; I167-Y171 PolarHBondContact O-N 3.19Å; S168-Y171 PolarHBondContact O-N 3.4Å; D169-Y171 VanDerWaalsContact C-N 3.29Å; D169-Y171 PolarHBondContact O-N 3.38Å; Y171-L174 PolarHBondContact O-N 2.92Å; Y171-L175 HydrophobicContact CD1-CD1 3.77Å; Y171-L175 HydrophobicContact CE1-CD1 3.41Å; Y171-L175 VanDerWaalsContact CE1-CD1 3.41Å; Y171-L175 HydrophobicContact CE1-CG 4.44Å; Y171-L175 HydrophobicContact CG-CD1 4.48Å; Y171-L175 WeakPolarHBondContact O-CB 3.49Å; Y171-L175 PolarHBondContact O-N 3.36Å
172	N	46.4	Very low	41.5	Very low	89 Å²	89	96.3 Å²	96.3	48%	0.476	53%	0.526	S	S	.	.	H	α-helix	trans	-62.4	-47.3	172.8	-70.4	-27	0	0	0	111.3	S168 D169 L174 L175 I176	S168-N172 PolarHBondContact O-N 3.38Å; S168-N172 PolarHBondContact O-ND2 3.48Å; D169-N172 WeakPolarHBondContact O-CB 3.35Å; D169-N172 PolarHBondContact O-N 2.89Å; D169-N172 VanDerWaalsContact O-N 3.14Å; N172-L174 VanDerWaalsContact C-N 3.32Å; N172-L174 PolarHBondContact O-N 3.42Å; N172-L175 PolarHBondContact O-N 3.41Å; N172-I176 WeakPolarHBondContact O-CB 3.27Å; N172-I176 WeakPolarHBondContact O-CD1 3.13Å; N172-I176 VanDerWaalsContact O-CG1 3.22Å; N172-I176 WeakPolarHBondContact O-CG1 3.43Å; N172-I176 PolarHBondContact O-N 2.9Å
173	R	46.6	Very low	41.1	Very low	157 Å²	157	94.8 Å²	94.8	59%	0.592	53%	0.527	S	S	*	.	H	α-helix	trans	-63.3	-34.8	177.5	-69.3	-179.6	71.6	177.1	4.1	112.4	D169 L170 S177	D169-R173 WeakPolarHBondContact O-CB 3.27Å; D169-R173 WeakPolarHBondContact O-CG 3.41Å; D169-R173 PolarHBondContact O-N 3.43Å; D169-R173 WeakPolarHBondContact OD2-CD 3.25Å; L170-R173 PolarHBondContact O-N 3.32Å; R173-S177 WeakPolarHBondContact O-CB 3.14Å; R173-S177 PolarHBondContact O-N 2.86Å
174	L	45.5	Very low	40.5	Very low	85 Å²	85	96.2 Å²	96.2	45%	0.445	54%	0.538	S	S	.	.	H	α-helix	trans	-75	-31.7	177.1	-160.2	73.1	0	0	0	112.8	V124 L170 Y171 N172	V124-L174 HydrophobicContact CG2-CD1 4.07Å; L170-L174 VanDerWaalsContact O-CB 3.26Å; L170-L174 WeakPolarHBondContact O-CB 3.41Å; L170-L174 PolarHBondContact O-N 2.9Å; Y171-L174 PolarHBondContact O-N 2.92Å; N172-L174 VanDerWaalsContact C-N 3.32Å; N172-L174 PolarHBondContact O-N 3.42Å
175	L	45.4	Very low	40	Very low	97 Å²	97	97.7 Å²	97.7	51%	0.508	55%	0.545	S	S	.	.	H	α-helix	trans	-71.3	-39.2	170.4	-81.5	166.7	0	0	0	112.2	Y171 N172 K178	Y171-L175 HydrophobicContact CD1-CD1 3.77Å; Y171-L175 HydrophobicContact CE1-CD1 3.41Å; Y171-L175 VanDerWaalsContact CE1-CD1 3.41Å; Y171-L175 HydrophobicContact CE1-CG 4.44Å; Y171-L175 HydrophobicContact CG-CD1 4.48Å; Y171-L175 WeakPolarHBondContact O-CB 3.49Å; Y171-L175 PolarHBondContact O-N 3.36Å; N172-L175 PolarHBondContact O-N 3.41Å; L175-K178 WeakPolarHBondContact O-CB 3.11Å; L175-K178 PolarHBondContact O-N 2.73Å
176	I	41.6	Very low	39.3	Very low	103 Å²	103	101.6 Å²	101.6	53%	0.528	56%	0.564	S	S	.	*	H	α-helix	trans	-72.7	-34.7	176.8	-67	164.6	0	0	0	111	N172 K178 G179	N172-I176 WeakPolarHBondContact O-CB 3.27Å; N172-I176 WeakPolarHBondContact O-CD1 3.13Å; N172-I176 VanDerWaalsContact O-CG1 3.22Å; N172-I176 WeakPolarHBondContact O-CG1 3.43Å; N172-I176 PolarHBondContact O-N 2.9Å; I176-K178 PolarHBondContact O-N 3.47Å; I176-G179 PolarHBondContact O-N 2.87Å
177	S	34.6	Very low	38.6	Very low	86 Å²	86	101.2 Å²	101.2	60%	0.601	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	20	173.5	-170.5	0	0	0	0	114.1	R173 G179	R173-S177 WeakPolarHBondContact O-CB 3.14Å; R173-S177 PolarHBondContact O-N 2.86Å; S177-G179 VanDerWaalsContact C-N 3.34Å
178	K	40.5	Very low	37.8	Very low	182 Å²	182	105.8 Å²	105.8	79%	0.791	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-11	164.9	-83.2	-74.7	-178.8	179.6	0	113.6	L175 I176	L175-K178 WeakPolarHBondContact O-CB 3.11Å; L175-K178 PolarHBondContact O-N 2.73Å; I176-K178 PolarHBondContact O-N 3.47Å
179	G	32.7	Very low	37.1	Very low	53 Å²	53	108.7 Å²	108.7	55%	0.546	62%	0.621	S	S	.	*	S	Bend	trans	-79.5	143.5	169.3	0	0	0	0	0	112.6	I176 S177	I176-G179 PolarHBondContact O-N 2.87Å; S177-G179 VanDerWaalsContact C-N 3.34Å
180	S	31.4	Very low	36.5	Very low	85 Å²	85	108.4 Å²	108.4	59%	0.594	64%	0.637	S	S	*	*			trans	56.2	84.6	173.3	-152.5	0	0	0	0	117
181	T	35	Very low	35.7	Very low	129 Å²	129	109.5 Å²	109.5	79%	0.791	66%	0.659	S	S	*	*			trans	-121.4	81.9	143.4	-49.4	0	0	0	0	107.4	V183	T181-V183 VanDerWaalsContact C-N 3.34Å; T181-V183 PolarHBondContact O-N 2.78Å
182	T	31.6	Very low	35	Very low	114 Å²	114	107.5 Å²	107.5	70%	0.699	67%	0.673	S	S	*	*			trans	-67.9	92.4	173.6	48.8	0	0	0	0	109.2	S184	T182-S184 PolarHBondContact O-N 3.14Å
183	V	30.1	Very low	34.5	Very low	107 Å²	107	110 Å²	110	65%	0.648	69%	0.691	S	S	*	*			trans	-69.1	101	165.8	-179	0	0	0	0	106.9	T181 L185	T181-V183 VanDerWaalsContact C-N 3.34Å; T181-V183 PolarHBondContact O-N 2.78Å; V183-L185 HydrophobicContact CG1-CD2 3.91Å; V183-L185 HydrophobicContact CG1-CG 4.27Å; V183-L185 PolarHBondContact O-N 3.41Å
184	S	27.9	Very low	33.8	Very low	95 Å²	95	105.7 Å²	105.7	66%	0.664	70%	0.696	S	S	*	*			trans	-64.7	94.9	173	-60.2	0	0	0	0	109.2	T182 T186	T182-S184 PolarHBondContact O-N 3.14Å; S184-T186 PolarHBondContact O-N 3.39Å
185	L	29.5	Very low	33.1	Very low	144 Å²	144	106.9 Å²	106.9	75%	0.754	71%	0.712	S	S	*	*			trans	-75.1	58.1	176.5	-69.4	176.3	0	0	0	111.3	V183 S187	V183-L185 HydrophobicContact CG1-CD2 3.91Å; V183-L185 HydrophobicContact CG1-CG 4.27Å; V183-L185 PolarHBondContact O-N 3.41Å; L185-S187 PolarHBondContact O-N 3.44Å
186	T	27.6	Very low	32.6	Very low	133 Å²	133	110.4 Å²	110.4	82%	0.816	73%	0.729	S	S	*	*			trans	-88.3	53.7	167.9	55.8	0	0	0	0	110.3	S184	S184-T186 PolarHBondContact O-N 3.39Å
187	S	31.1	Very low	32.1	Very low	95 Å²	95	110 Å²	110	66%	0.664	74%	0.736	S	S	*	*			trans	-107.2	106	166	52.3	0	0	0	0	107.9	L185	L185-S187 PolarHBondContact O-N 3.44Å
188	T	32.7	Very low	31.9	Very low	136 Å²	136	113.5 Å²	113.5	83%	0.834	75%	0.747	S	S	*	*			trans	-56.1	143	-177	43.4	0	0	0	0	112.5	G190	T188-G190 PolarHBondContact O-N 2.96Å
189	S	29.9	Very low	31.6	Very low	120 Å²	120	109.5 Å²	109.5	84%	0.839	74%	0.743	S	S	*	*			trans	-65.4	88.7	173.4	53.8	0	0	0	0	111.3	G191	S189-G191 VanDerWaalsContact C-N 3.29Å; S189-G191 PolarHBondContact O-N 3.03Å
190	G	32	Very low	31.6	Very low	75 Å²	75	115.6 Å²	115.6	77%	0.773	76%	0.757	S	S	*	*			trans	-68.9	82.4	173.5	0	0	0	0	0	111.4	T188 A192	T188-G190 PolarHBondContact O-N 2.96Å; G190-A192 PolarHBondContact O-N 3Å
191	G	32.2	Very low	31.7	Very low	69 Å²	69	117 Å²	117	71%	0.711	76%	0.762	S	S	*	*			trans	-64.3	121.8	175	0	0	0	0	0	111.1	S189 T193	S189-G191 VanDerWaalsContact C-N 3.29Å; S189-G191 PolarHBondContact O-N 3.03Å; G191-T193 PolarHBondContact O-N 3.23Å
192	A	30.6	Very low	31.5	Very low	103 Å²	103	119.5 Å²	119.5	85%	0.851	77%	0.765	S	S	*	*			trans	-86.9	90.8	-177	0	0	0	0	0	112.2	G190	G190-A192 PolarHBondContact O-N 3Å
193	T	35.6	Very low	31.4	Very low	141 Å²	141	119.1 Å²	119.1	87%	0.865	77%	0.767	S	S	*	*			trans	-142	148.3	157	38.8	0	0	0	0	110	G191	G191-T193 PolarHBondContact O-N 3.23Å
194	G	32.5	Very low	31.3	Very low	67 Å²	67	120.2 Å²	120.2	69%	0.691	77%	0.773	S	S	*	*			trans	-84.5	150.4	-159.6	0	0	0	0	0	116.9
195	S	30.3	Very low	31.6	Very low	111 Å²	111	122.1 Å²	122.1	78%	0.776	78%	0.781	S	S	*	*			trans	77.4	160.5	134	71.9	0	0	0	0	121.8
196	I	34.2	Very low	31.6	Very low	171 Å²	171	118.7 Å²	118.7	88%	0.877	78%	0.78	S	S	*	*			trans	78.5	136.4	170.8	-43.9	-178.6	0	0	0	114.2
197	S	31.6	Very low	31.9	Very low	95 Å²	95	119 Å²	119	66%	0.664	78%	0.782	S	S	*	*			trans	-116.4	144.8	-165.7	54.3	0	0	0	0	113
198	N	30.4	Very low	31.8	Very low	158 Å²	158	123.9 Å²	123.9	85%	0.845	79%	0.791	S	S	*	*			trans	38.7	103.5	144.8	-56.4	4.2	0	0	0	119.4
199	S	34.6	Very low	31.7	Very low	99 Å²	99	126.5 Å²	126.5	69%	0.692	79%	0.791	S	S	*	*				-172.3	130.3	126.8	55.4	0	0	0	0	110.3
200	E	33.7	Very low	31.7	Very low	180 Å²	180	130 Å²	130	84%	0.841	79%	0.794	S	S	*	*			trans	54.4	144.7	137.8	-68.8	157	-148.5	0	0	120.5
201	T	32.6	Very low	31.4	Very low	115 Å²	115	135.1 Å²	135.1	71%	0.706	80%	0.797	S	S	*	*			cis	-164.4	157.5	-17	10	0	0	0	0	108.8
202	E	29.8	Very low	31.5	Very low	182 Å²	182	137.8 Å²	137.8	85%	0.85	81%	0.806	S	S	*	*			trans	66.3	164.6	150.9	-70.8	-174.8	154.2	0	0	122.9
203	S	30.8	Very low	31.4	Very low	105 Å²	105	138.2 Å²	138.2	73%	0.734	80%	0.802	S	S	*	*			trans	71.6	80	152.9	-151	0	0	0	0	121.7
204	V	28.6	Very low	31.1	Very low	130 Å²	130	138.3 Å²	138.3	79%	0.788	80%	0.796	S	S	*	*				48.8	149.4	109.3	-174.5	0	0	0	0	120.5
205	V	34.1	Very low	30.9	Very low	135 Å²	135	145.6 Å²	145.6	82%	0.818	80%	0.803	S	S	*	*			trans	83.1	127.9	-179.5	-167.1	0	0	0	0	114.1
206	G	28.7	Very low	30.8	Very low	72 Å²	72	149.8 Å²	149.8	74%	0.742	81%	0.807	S	S	*	*			cis	130.4	61.4	-7.8	0	0	0	0	0	115.2
207	V	33.7	Very low	30.5	Very low	141 Å²	141	150.8 Å²	150.8	86%	0.855	81%	0.805	S	S	*	*			trans	-127.8	131.2	173.3	-177.7	0	0	0	0	110.6
208	K	29.5	Very low	30.2	Very low	196 Å²	196	151.7 Å²	151.7	85%	0.852	81%	0.812	S	S	*	*			trans	-93.3	169.7	175.6	-80	-175.3	171.5	179.8	0	111.7
209	K	30.6	Very low	30.3	Very low	191 Å²	191	152.2 Å²	152.2	83%	0.83	81%	0.813	S	S	*	*			trans	88.1	106.4	138.4	-166.4	-171.4	-175.4	-176.1	0	117.3
210	Q	30.3	Very low	30	Very low	195 Å²	195	150.4 Å²	150.4	91%	0.911	81%	0.81	S	S	*	*				-150	116.8	118.8	-158.8	156.7	9.4	0	0	111.4
211	E	25.9	Very low	29.5	Very low	181 Å²	181	148.9 Å²	148.9	85%	0.846	81%	0.813	S	S	*	*			trans	-96.3	138.7	166.1	-66.2	172	121.3	0	0	108.6
212	S	33.2	Very low	29.2	Very low	126 Å²	126	149.1 Å²	149.1	88%	0.881	82%	0.818	S	S	*	*			trans	-109.2	131.1	164	55	0	0	0	0	109.1
213	S	28.2	Very low	29	Very low	112 Å²	112	149.2 Å²	149.2	78%	0.783	82%	0.816	S	S	*	*			trans	-109.4	-172.6	-161.9	-172.8	0	0	0	0	112.7
214	I	29.2	Very low	28.9	Very low	142 Å²	142	150.6 Å²	150.6	73%	0.728	82%	0.822	S	S	*	*			trans	77.7	88.5	161.9	-38	178.8	0	0	0	116.8
215	R	29.6	Very low	28.9	Very low	221 Å²	221	149.5 Å²	149.5	83%	0.834	82%	0.82	S	S	*	*				-158.1	116.6	102.1	-120.2	168.1	-78	-139.2	2.8	112.5
216	K	26.9	Very low	28.5	Very low	198 Å²	198	150.7 Å²	150.7	86%	0.861	82%	0.821	S	S	*	*			trans	-75.5	134	164.9	-76	-179.5	174.9	179.1	0	108.8
217	F	29	Very low	28.6	Very low	193 Å²	193	154.7 Å²	154.7	85%	0.846	82%	0.824	S	S	*	*			trans	-122.7	115.4	147	-90.8	-80.5	0	0	0	108.4
218	S	25.5	Very low	28.2	Very low	114 Å²	114	154.6 Å²	154.6	80%	0.797	81%	0.814	S	S	*	*			trans	-101.8	112.5	172.2	164.8	0	0	0	0	106.8
219	L	30.8	Very low	28.1	Very low	168 Å²	168	155.1 Å²	155.1	88%	0.88	82%	0.816	S	S	*	*			trans	-134.5	136.3	175.3	-147.5	73.9	0	0	0	112.2
220	G	28.4	Very low	28	Very low	61 Å²	61	151.4 Å²	151.4	63%	0.629	81%	0.806	S	S	*	*			trans	-36.8	137.9	-168.6	0	0	0	0	0	118.7	C222	G220-C222 PolarHBondContact O-N 3.39Å
221	V	24.8	Very low	27.9	Very low	149 Å²	149	150.2 Å²	150.2	90%	0.903	80%	0.8	S	S	*	*			trans	-66.7	93.1	158.2	178.9	0	0	0	0	108.7
222	C	25.3	Very low	28.1	Very low	119 Å²	119	149.3 Å²	149.3	80%	0.804	80%	0.8	S	S	*	*			trans	-88.5	110	172.4	-75.3	0	0	0	0	110.4	G220	G220-C222 PolarHBondContact O-N 3.39Å
223	K	26.3	Very low	27.9	Very low	185 Å²	185	149.5 Å²	149.5	80%	0.804	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-66.1	137.5	167.8	-63.9	175.5	178.6	177.2	0	109.5	S225	K223-S225 PolarHBondContact O-N 3.46Å
224	P	29.1	Very low	28	Very low	133 Å²	133	151.6 Å²	151.6	86%	0.864	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-62.2	117.3	154.2	-15.1	29.9	0	0	0	107.9
225	S	27.8	Very low	28	Very low	107 Å²	107	151.7 Å²	151.7	75%	0.748	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-70.8	139.2	177.6	49.4	0	0	0	0	110.9	K223 I227	K223-S225 PolarHBondContact O-N 3.46Å; S225-I227 PolarHBondContact O-N 3.35Å
226	L	26.1	Very low	27.9	Very low	161 Å²	161	146.8 Å²	146.8	84%	0.843	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-58.5	127	177.3	-169.7	134.4	0	0	0	110.3
227	I	31.1	Very low	28.2	Very low	155 Å²	155	142.8 Å²	142.8	80%	0.795	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-75.5	133.3	172.2	-68.5	179.5	0	0	0	108.7	S225	S225-I227 PolarHBondContact O-N 3.35Å
228	E	25.4	Very low	28.1	Very low	140 Å²	140	140.3 Å²	140.3	65%	0.654	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-77.6	123.9	-164.3	-176.6	170.1	-164.8	0	0	113.2	N230	E228-N230 HydrophobicContact CG-CB 4.03Å; E228-N230 PolarHBondContact OE1-ND2 2.84Å
229	F	26.1	Very low	28.5	Very low	206 Å²	206	143.8 Å²	143.8	90%	0.904	77%	0.77	S	S	*	*			trans	-116	113.1	156.7	-90.7	-84.9	0	0	0	107.5
230	N	28.3	Very low	28.3	Very low	114 Å²	114	143 Å²	143	61%	0.61	77%	0.767	S	S	*	*			trans	-137.8	141.3	-177.4	-106.1	-30.8	0	0	0	110.3	E228	E228-N230 HydrophobicContact CG-CB 4.03Å; E228-N230 PolarHBondContact OE1-ND2 2.84Å
231	H	29.1	Very low	28.5	Very low	170 Å²	170	147.5 Å²	147.5	79%	0.787	78%	0.775	S	S	*	*			trans	63.2	145	-172.1	-67.9	-113.7	0	0	0	115.1
232	L	29.6	Very low	28.7	Very low	161 Å²	161	146.7 Å²	146.7	84%	0.843	77%	0.765	S	S	*	*			cis	-117.6	172.4	9.2	-157.2	59.4	0	0	0	112.6
233	N	29.1	Very low	28.8	Very low	131 Å²	131	148 Å²	148	70%	0.701	76%	0.762	S	S	*	*			trans	-120.6	158.2	-154	-152.8	-9.2	0	0	0	112.6
234	K	29.7	Very low	28.9	Very low	155 Å²	155	142.5 Å²	142.5	67%	0.674	76%	0.758	S	S	*	*			trans	67.2	156.7	165	-67.9	157.6	159.6	-92.2	0	117
235	E	30.9	Very low	28.9	Very low	145 Å²	145	141.2 Å²	141.2	68%	0.678	75%	0.753	S	S	*	*			cis	-143	163.5	4	-149.1	120.2	-125.1	0	0	112.6
236	T	27.6	Very low	28.9	Very low	118 Å²	118	142 Å²	142	72%	0.724	75%	0.748	S	S	*	*			trans	-61.3	164.7	166.5	39.5	0	0	0	0	112
237	T	32.3	Very low	29	Very low	113 Å²	113	140.8 Å²	140.8	69%	0.693	74%	0.743	S	S	*	*			cis	-169.4	152.5	44.8	-31.8	0	0	0	0	113.5
238	N	27.6	Very low	29.1	Very low	141 Å²	141	139.5 Å²	139.5	75%	0.754	74%	0.742	S	S	*	*			trans	3.9	133.4	157.1	-52.9	-17.1	0	0	0	122.6
239	Q	33.6	Very low	29.2	Very low	187 Å²	187	140 Å²	140	87%	0.874	75%	0.748	S	S	*	*			trans	143.4	107.8	134.7	-78.7	176.5	22.5	0	0	109.2
240	N	27.3	Very low	29.5	Very low	152 Å²	152	139.8 Å²	139.8	81%	0.813	75%	0.749	S	S	*	*				84.2	144	53.3	-160.9	24.3	0	0	0	113.1
241	I	32	Very low	29.5	Very low	156 Å²	156	141.8 Å²	141.8	80%	0.8	76%	0.755	S	S	*	*			trans	81.4	142.3	-176.6	-51.6	167.2	0	0	0	115.4
242	N	28.1	Very low	29.5	Very low	131 Å²	131	139.4 Å²	139.4	70%	0.701	75%	0.748	S	S	*	*			cis	-167	156.4	-42.2	-145.2	3.1	0	0	0	112.1
243	I	28.7	Very low	29.8	Very low	146 Å²	146	138.9 Å²	138.9	75%	0.749	75%	0.746	S	S	*	*			trans	46	120.2	154.3	-66	159.7	0	0	0	121.6
244	G	27.5	Very low	29.7	Very low	70 Å²	70	140.1 Å²	140.1	72%	0.722	75%	0.753	S	S	*	*			trans	72.7	168.1	133.5	0	0	0	0	0	120.3
245	S	28.5	Very low	29.9	Very low	106 Å²	106	138.2 Å²	138.2	74%	0.741	76%	0.759	S	S	*	*			cis	-166.3	152.3	-22.6	-136.9	0	0	0	0	111.4
246	N	27.7	Very low	29.8	Very low	123 Å²	123	138.8 Å²	138.8	66%	0.658	77%	0.767	S	S	*	*			trans	68.2	124	149.4	-77	63.7	0	0	0	123.6
247	D	29.3	Very low	30	Very low	137 Å²	137	139.1 Å²	139.1	73%	0.733	77%	0.768	S	S	*	*				87.1	156.9	128.9	-58.7	-22.8	0	0	0	124.8
248	V	32.1	Very low	30	Very low	128 Å²	128	139.7 Å²	139.7	78%	0.776	77%	0.772	S	S	*	*			trans	81.9	81.6	163.7	-158.6	0	0	0	0	120
249	I	27.3	Very low	30.2	Very low	151 Å²	151	140 Å²	140	77%	0.774	77%	0.774	S	S	*	*				25.8	125.5	118.7	-52.5	166.4	0	0	0	118.5
250	Q	33.1	Very low	30.4	Very low	200 Å²	200	136.5 Å²	136.5	94%	0.935	77%	0.767	S	S	*	*			trans	-144.2	161.7	142.8	-111	179.3	13.5	0	0	111.4
251	H	29.1	Very low	30.8	Very low	156 Å²	156	136.1 Å²	136.1	72%	0.722	76%	0.763	S	S	*	*			trans	-152	140.5	-157.3	-179.4	-66.4	0	0	0	111.6
252	N	29.1	Very low	30.8	Very low	121 Å²	121	134.1 Å²	134.1	65%	0.647	76%	0.758	S	S	*	*			trans	64.8	160.9	178.5	-92.9	34.9	0	0	0	116
253	D	34.7	Very low	31.1	Very low	149 Å²	149	134.1 Å²	134.1	80%	0.797	76%	0.758	S	S	*	*			cis	-140.3	174.8	28.4	-102.6	-43.6	0	0	0	115.9
254	N	28	Very low	31.1	Very low	158 Å²	158	133.6 Å²	133.6	85%	0.845	76%	0.757	S	S	*	*			trans	-102.3	132.3	178.8	-90.1	-45	0	0	0	113.6
255	S	33.6	Very low	31.2	Very low	115 Å²	115	136.4 Å²	136.4	80%	0.804	76%	0.76	S	S	*	*			trans	-166.8	94.3	148.3	62.2	0	0	0	0	116.3
256	N	28.6	Very low	31	Very low	157 Å²	157	136.5 Å²	136.5	84%	0.84	76%	0.759	S	S	*	*				46.5	162	121	-127.8	-7.3	0	0	0	124.4
257	V	31.2	Very low	31.3	Very low	124 Å²	124	136.1 Å²	136.1	75%	0.752	77%	0.766	S	S	*	*			trans	65.2	138.3	172	-117.9	0	0	0	0	116.2
258	T	33.2	Very low	31.1	Very low	126 Å²	126	135.5 Å²	135.5	77%	0.773	77%	0.768	S	S	*	*			cis	-146.9	152.9	17.9	-43.9	0	0	0	0	113.4
259	N	31.7	Very low	31.1	Very low	148 Å²	148	135.7 Å²	135.7	79%	0.791	77%	0.771	S	S	*	*			trans	-86.1	-159.3	173	-61.9	-47.6	0	0	0	111.1
260	P	38.3	Very low	31	Very low	113 Å²	113	133.7 Å²	133.7	73%	0.734	77%	0.771	S	S	*	*			cis	-127.6	-173	-11.6	25	2.1	0	0	0	113.2
261	I	34.2	Very low	30.6	Very low	143 Å²	143	132 Å²	132	73%	0.733	77%	0.767	S	S	*	*				-176.1	127.4	73.6	-86.3	-179.2	0	0	0	111.9
262	V	32.4	Very low	30.5	Very low	115 Å²	115	129.6 Å²	129.6	70%	0.697	77%	0.768	S	S	*	*			trans	49.5	138	133.9	-174.5	0	0	0	0	120
263	N	34.3	Very low	30.5	Very low	130 Å²	130	131.1 Å²	131.1	70%	0.695	78%	0.776	S	S	*	*			cis	-139.6	146.5	22.9	-105.8	-40.7	0	0	0	109.8
264	N	29.2	Very low	30.4	Very low	136 Å²	136	131.8 Å²	131.8	73%	0.727	78%	0.778	S	S	*	*				60	139.7	75.7	-70.5	-24.3	0	0	0	116.1
265	V	30.2	Very low	30.5	Very low	129 Å²	129	130.2 Å²	130.2	78%	0.782	78%	0.776	S	S	*	*			cis	-156.8	167.6	-4	106.2	0	0	0	0	112
266	C	24	Very low	30.2	Very low	108 Å²	108	132.9 Å²	132.9	73%	0.73	78%	0.778	S	S	*	*			trans	-77	152.9	179.4	178.8	0	0	0	0	114.7
267	S	32.8	Very low	30.3	Very low	115 Å²	115	134.5 Å²	134.5	80%	0.804	78%	0.777	S	S	*	*			trans	-156.1	128.4	161.9	-80.3	0	0	0	0	113.4
268	T	26.9	Very low	30.2	Very low	124 Å²	124	135 Å²	135	76%	0.761	77%	0.772	S	S	*	*			trans	-106	147.1	164.2	47.2	0	0	0	0	109.9
269	P	31.3	Very low	30	Very low	132 Å²	132	134.4 Å²	134.4	86%	0.857	76%	0.764	S	S	*	*			trans	-99.4	127.4	164.2	33.6	-27.5	0	0	0	111.1
270	S	24.3	Very low	30.1	Very low	109 Å²	109	134.6 Å²	134.6	76%	0.762	77%	0.765	S	S	*	*			trans	-114.7	156.8	173.1	61	0	0	0	0	111.6
271	L	25.4	Very low	29.6	Very low	165 Å²	165	135 Å²	135	86%	0.864	77%	0.765	S	S	*	*			trans	12.2	125.1	162.5	-95.6	63.9	0	0	0	119.5
272	S	26.7	Very low	29.7	Very low	104 Å²	104	134.3 Å²	134.3	73%	0.727	77%	0.768	S	S	*	*				177.8	171.9	119.2	43.3	0	0	0	0	113.5
273	N	30.3	Very low	29.6	Very low	153 Å²	153	134.7 Å²	134.7	82%	0.818	77%	0.77	S	S	*	*			trans	89.6	78.5	162.4	-56	-22.4	0	0	0	119.8
274	I	31.5	Very low	29.2	Very low	164 Å²	164	137.8 Å²	137.8	84%	0.841	77%	0.774	S	S	*	*			trans	-68.2	140.1	149.8	-73.3	163.1	0	0	0	108.5
275	P	30.1	Very low	29.4	Very low	124 Å²	124	139.7 Å²	139.7	81%	0.805	78%	0.778	S	S	*	*				-149.5	170.8	91.2	38.8	-18.7	0	0	0	118.4
276	M	27.2	Very low	29.2	Very low	171 Å²	171	140.5 Å²	140.5	84%	0.842	77%	0.773	S	S	*	*			trans	-71	148.7	-177.7	-58.5	154.1	58.2	0	0	114.5
277	K	31.8	Very low	29.7	Very low	191 Å²	191	142.9 Å²	142.9	83%	0.83	77%	0.774	S	S	*	*			trans	180	154.8	133.8	-100.1	-176.7	175.8	180	0	108.1
278	Q	28.1	Very low	29.7	Very low	136 Å²	136	142.8 Å²	142.8	64%	0.636	77%	0.768	S	S	*	*			cis	176	144.5	-26.9	-117.9	-169.5	-52.3	0	0	105.2
279	N	28.8	Very low	29.7	Very low	113 Å²	113	146.1 Å²	146.1	60%	0.604	77%	0.772	S	S	*	*			trans	62.7	113	147.7	-52.1	-3.9	0	0	0	121.1
280	N	34.1	Very low	29.7	Very low	151 Å²	151	145.9 Å²	145.9	81%	0.807	77%	0.768	S	S	*	*				156.4	112.3	120	-76.3	-19.3	0	0	0	108.3
281	T	27.9	Very low	29.7	Very low	122 Å²	122	150.5 Å²	150.5	75%	0.748	77%	0.771	S	S	*	*			cis	80.3	97.8	36.8	-48.2	0	0	0	0	114.3
282	T	35.4	Very low	30.3	Very low	129 Å²	129	149.6 Å²	149.6	79%	0.791	77%	0.766	S	S	*	*			trans	-169.8	122.7	143.3	23.7	0	0	0	0	109.9
283	V	31.9	Very low	30.5	Very low	123 Å²	123	150.8 Å²	150.8	75%	0.745	77%	0.765	S	S	*	*				74.2	106.5	104.2	173.9	0	0	0	0	114
284	Y	25.1	Very low	30.8	Very low	195 Å²	195	152.6 Å²	152.6	77%	0.765	77%	0.768	S	S	*	*				78.4	108.1	66.8	-101.6	-80	0	0	0	116.3
285	Q	33.1	Very low	30.7	Very low	175 Å²	175	150.6 Å²	150.6	82%	0.818	76%	0.764	S	S	*	*			trans	166.3	125.5	154	-96.5	166.3	23.7	0	0	106.2
286	Q	26.5	Very low	30.9	Very low	146 Å²	146	150.5 Å²	150.5	68%	0.682	76%	0.761	S	S	*	*			cis	72.1	82.6	5.3	-161.6	174.5	-2.6	0	0	117.8
287	H	35.3	Very low	31.1	Very low	159 Å²	159	148.9 Å²	148.9	74%	0.736	76%	0.756	S	S	*	*			trans	-138.9	102.9	146.2	-92.5	-87.1	0	0	0	106.8
288	T	31.3	Very low	31	Very low	113 Å²	113	144.9 Å²	144.9	69%	0.693	75%	0.747	S	S	*	*				79.3	143.1	79.2	57.4	0	0	0	0	114.7
289	K	28.3	Very low	31.2	Very low	194 Å²	194	145.2 Å²	145.2	84%	0.843	75%	0.753	S	S	*	*			trans	-91.3	155.6	-171	-51.4	167.6	-177.3	173.1	0	111.4
290	T	31.4	Very low	31.3	Very low	126 Å²	126	147.1 Å²	147.1	77%	0.773	76%	0.763	S	S	*	*			trans	-126.7	134.5	149.6	-52.4	0	0	0	0	108.6	N292	T290-N292 WeakPolarHBondContact CG2-OD1 3.04Å
291	Y	24.2	Very low	31.1	Very low	207 Å²	207	144 Å²	144	81%	0.812	75%	0.754	S	S	*	*			trans	-141.2	107.2	178.7	-139.7	-84.7	0	0	0	105.1
292	N	37.6	Very low	31.3	Very low	145 Å²	145	144.5 Å²	144.5	78%	0.775	75%	0.752	S	S	*	*			trans	-111.9	130.8	179	-76.1	18.6	0	0	0	109.3	T290	T290-N292 WeakPolarHBondContact CG2-OD1 3.04Å
293	N	30.3	Very low	31	Very low	129 Å²	129	145.3 Å²	145.3	69%	0.69	75%	0.751	S	S	*	*			trans	-105.1	127.3	175.8	-63.4	-29.3	0	0	0	109.3
294	E	36.1	Very low	31.2	Very low	192 Å²	192	147.2 Å²	147.2	90%	0.897	76%	0.757	S	S	*	*			trans	-151.9	105.5	156.3	-104.3	154.2	-149.2	0	0	104.7
295	T	30.3	Very low	31.4	Very low	122 Å²	122	146.5 Å²	146.5	75%	0.748	76%	0.758	S	S	*	*				79.5	149.5	54.6	-52.2	0	0	0	0	111.8
296	V	34.1	Very low	31.3	Very low	122 Å²	122	147.6 Å²	147.6	74%	0.739	76%	0.761	S	S	*	*			trans	90.5	83.2	175.1	-166	0	0	0	0	117.2
297	N	32.2	Very low	31.4	Very low	137 Å²	137	146.2 Å²	146.2	73%	0.733	76%	0.758	S	S	*	*				68.1	115.5	121.7	-73.7	2.5	0	0	0	124.5
298	T	29.1	Very low	31.3	Very low	107 Å²	107	148.5 Å²	148.5	66%	0.656	77%	0.766	S	S	*	*				73.2	123	121.4	64.3	0	0	0	0	123.3
299	N	31.9	Very low	31.3	Very low	143 Å²	143	149.9 Å²	149.9	77%	0.765	77%	0.769	S	S	*	*				90.1	127.7	128.7	-66.7	-1.9	0	0	0	121.8
300	N	32.4	Very low	31.3	Very low	152 Å²	152	151 Å²	151	81%	0.813	77%	0.768	S	S	*	*			trans	72.9	110.6	143.7	-89.4	-3.1	0	0	0	121.6
301	S	29.2	Very low	31.4	Very low	86 Å²	86	150 Å²	150	60%	0.601	76%	0.764	S	S	*	*				91.2	107.1	112.5	-157.7	0	0	0	0	118.7
302	N	31.7	Very low	31.6	Very low	133 Å²	133	146.9 Å²	146.9	71%	0.711	76%	0.761	S	S	*	*			trans	75	135.9	142.6	-62.8	-8.9	0	0	0	120.2
303	N	29.7	Very low	31.4	Very low	145 Å²	145	145.9 Å²	145.9	78%	0.775	76%	0.76	S	S	*	*			trans	59.2	88.7	152.7	-56.5	-15.2	0	0	0	117.3
304	N	35.5	Very low	31.4	Very low	163 Å²	163	145.3 Å²	145.3	87%	0.872	76%	0.761	S	S	*	*				-146.7	127.2	126.7	-109.2	-39.6	0	0	0	115
305	K	28.7	Very low	31.1	Very low	181 Å²	181	143.5 Å²	143.5	79%	0.787	76%	0.756	S	S	*	*			trans	-73	119.5	-178.5	166.7	-170.9	178.2	-177.2	0	110.3
306	F	31.2	Very low	30.9	Very low	198 Å²	198	141.2 Å²	141.2	87%	0.868	75%	0.745	S	S	*	*			trans	-133.4	147.4	167.2	-106.8	-90	0	0	0	112
307	N	29.2	Very low	31	Very low	117 Å²	117	141.3 Å²	141.3	63%	0.626	75%	0.746	S	S	*	*			trans	-87.1	129.5	-156.5	-62.8	-33.7	0	0	0	114.1	N309	N307-N309 PolarHBondContact O-N 2.9Å
308	F	33	Very low	31	Very low	206 Å²	206	139 Å²	139	90%	0.904	73%	0.734	S	S	*	*			trans	-75.3	93.3	151.2	-98.3	-87.7	0	0	0	109	R310	F308-R310 VanDerWaalsContact C-N 3.26Å; F308-R310 PolarHBondContact O-N 3.39Å
309	N	31.8	Very low	31.9	Very low	142 Å²	142	144.3 Å²	144.3	76%	0.759	74%	0.742	S	S	*	*			trans	-68.7	87.2	168.9	-82.9	2.9	0	0	0	109.5	N307 P311	N307-N309 PolarHBondContact O-N 2.9Å; N309-P311 WeakPolarHBondContact O-CD 3.12Å
310	R	28.9	Very low	32.4	Very low	217 Å²	217	142.8 Å²	142.8	82%	0.819	73%	0.734	S	S	*	*			trans	-79.6	114.1	176.8	-164.6	-173.8	-156	-162.5	7.5	108.7	F308 N312	F308-R310 VanDerWaalsContact C-N 3.26Å; F308-R310 PolarHBondContact O-N 3.39Å; R310-N312 PolarHBondContact O-N 2.79Å
311	P	33.3	Very low	32.9	Very low	106 Å²	106	146.5 Å²	146.5	69%	0.688	74%	0.737	S	S	*	*			trans	-64.9	128.1	170.2	27.2	-32.5	0	0	0	108.6	N309 V313	N309-P311 WeakPolarHBondContact O-CD 3.12Å; P311-V313 PolarHBondContact O-N 3.5Å
312	N	28.6	Very low	33.8	Very low	141 Å²	141	149.5 Å²	149.5	75%	0.754	74%	0.735	S	S	*	*			trans	-68.7	102.2	173.2	-86	-20	0	0	0	108.9	R310 T314	R310-N312 PolarHBondContact O-N 2.79Å; N312-T314 PolarHBondContact O-N 3.08Å
313	V	32.5	Very low	34.6	Very low	124 Å²	124	147.3 Å²	147.3	75%	0.752	73%	0.728	S	S	*	*			trans	-76	75.9	165.1	-174.3	0	0	0	0	107.9	P311 I315	P311-V313 PolarHBondContact O-N 3.5Å; V313-I315 PolarHBondContact O-N 2.87Å
314	T	29.7	Very low	35.6	Very low	117 Å²	117	146.2 Å²	146.2	72%	0.718	72%	0.716	S	S	*	*			trans	-60.1	118.8	159.1	39.5	0	0	0	0	107.6	N312 S316	N312-T314 PolarHBondContact O-N 3.08Å; T314-S316 PolarHBondContact O-N 2.99Å
315	I	29.5	Very low	36.2	Very low	154 Å²	154	142.8 Å²	142.8	79%	0.79	70%	0.698	S	S	*	*			trans	-75.7	79.8	-177.1	-53.5	173.9	0	0	0	108.3	V313 T317	V313-I315 PolarHBondContact O-N 2.87Å; I315-T317 PolarHBondContact O-N 2.86Å
316	S	27.9	Very low	37.3	Very low	75 Å²	75	138.1 Å²	138.1	52%	0.524	69%	0.685	S	S	.	*			trans	-69.5	126.2	170	-164.8	0	0	0	0	108.8	T314 D318	T314-S316 PolarHBondContact O-N 2.99Å; S316-D318 WeakPolarHBondContact CB-OD2 3.45Å; S316-D318 PolarHBondContact O-N 2.81Å; S316-D318 VanDerWaalsContact OG-CG 3.29Å; S316-D318 PolarHBondContact OG-OD2 2.85Å
317	T	35.2	Very low	38.1	Very low	124 Å²	124	131.8 Å²	131.8	76%	0.761	66%	0.66	S	S	*	*			trans	-81.8	50.3	-176	51	0	0	0	0	111.7	I315	I315-T317 PolarHBondContact O-N 2.86Å
318	D	32.9	Very low	39.1	Very low	88 Å²	88	129.5 Å²	129.5	47%	0.471	65%	0.65	S	S	.	*			trans	-84.2	132.7	-177.5	-62.8	-48.4	0	0	0	111	S316 N320	S316-D318 WeakPolarHBondContact CB-OD2 3.45Å; S316-D318 PolarHBondContact O-N 2.81Å; S316-D318 VanDerWaalsContact OG-CG 3.29Å; S316-D318 PolarHBondContact OG-OD2 2.85Å; D318-N320 PolarHBondContact O-N 2.87Å
319	W	46.4	Very low	39.7	Very low	219 Å²	219	129.8 Å²	129.8	83%	0.83	65%	0.646	S	S	*	*	S	Bend	trans	-71.6	16.6	-171.4	-75.5	63.5	0	0	0	114.5	W321	W319-W321 PolarHBondContact O-N 3.3Å; W319-W321 VanDerWaalsContact O-N 3.13Å
320	N	43.6	Very low	40.7	Very low	110 Å²	110	129.3 Å²	129.3	59%	0.588	64%	0.643	S	S	*	*			trans	-77.6	4.7	-170.8	-59.8	-17.8	0	0	0	113.9	D318 W322 N325	D318-N320 PolarHBondContact O-N 2.87Å; N320-W322 VanDerWaalsContact C-N 3.32Å; N320-W322 PolarHBondContact O-N 2.82Å; N320-N325 PolarHBondContact O-ND2 2.91Å
321	W	42.7	Very low	41.7	Very low	231 Å²	231	125 Å²	125	88%	0.875	63%	0.631	S	S	*	*			trans	-89.8	20.5	-174.9	-76.2	66.6	0	0	0	114.4	W319	W319-W321 PolarHBondContact O-N 3.3Å; W319-W321 VanDerWaalsContact O-N 3.13Å
322	W	47.5	Very low	42.1	Very low	148 Å²	148	127.9 Å²	127.9	56%	0.561	64%	0.64	S	S	*	*	S	Bend	trans	-62	147.3	171.2	-82.8	80.8	0	0	0	111.5	N320 F324 N325 M407	N320-W322 VanDerWaalsContact C-N 3.32Å; N320-W322 PolarHBondContact O-N 2.82Å; W322-F324 PolarHBondContact O-N 3.4Å; W322-N325 PolarHBondContact O-N 3.33Å; W322-M407 HydrophobicContact CH2-CE 3.84Å; W322-M407 HydrophobicContact CZ3-CE 4.45Å
323	P	49.7	Very low	42.9	Very low	87 Å²	87	124.7 Å²	124.7	57%	0.565	63%	0.633	S	S	*	*	H	α-helix	trans	-61.2	-15.2	-166.4	22	-34.9	0	0	0	115.7	N325 V326 L327	P323-N325 VanDerWaalsContact C-N 3.34Å; P323-V326 PolarHBondContact O-N 3.45Å; P323-L327 PolarHBondContact O-N 3.47Å
324	F	49.5	Very low	44.1	Very low	122 Å²	122	124.2 Å²	124.2	54%	0.535	64%	0.636	S	S	.	*	H	α-helix	trans	-65.5	-33.6	173.7	-69.8	-78.9	0	0	0	113.2	W322 V326 L327 T328	W322-F324 PolarHBondContact O-N 3.4Å; F324-V326 VanDerWaalsContact C-N 3.3Å; F324-V326 PolarHBondContact O-N 3.06Å; F324-L327 WeakPolarHBondContact O-CA 3.35Å; F324-L327 VanDerWaalsContact O-CB 3.3Å; F324-L327 WeakPolarHBondContact O-CB 3.41Å; F324-L327 PolarHBondContact O-N 3.41Å; F324-L327 VanDerWaalsContact O-N 3.07Å; F324-T328 PolarHBondContact O-N 2.83Å; F324-T328 PolarHBondContact O-OG1 2.98Å
325	N	47.9	Very low	45.5	Very low	91 Å²	91	121.6 Å²	121.6	49%	0.487	62%	0.621	S	S	.	*	H	α-helix	trans	-70.8	-25.7	176.1	-90.6	-22	0	0	0	113	N320 W322 P323 L327 T328 Y329	N320-N325 PolarHBondContact O-ND2 2.91Å; W322-N325 PolarHBondContact O-N 3.33Å; P323-N325 VanDerWaalsContact C-N 3.34Å; N325-L327 VanDerWaalsContact C-N 3.33Å; N325-T328 WeakPolarHBondContact CA-OG1 3.17Å; N325-T328 PolarHBondContact O-OG1 2.83Å; N325-Y329 PolarHBondContact O-N 3.49Å
326	V	52.3	Low	47.6	Very low	84 Å²	84	117.8 Å²	117.8	51%	0.509	61%	0.608	S	S	.	*	H	α-helix	trans	-72.4	-31.6	169.6	179.9	0	0	0	0	110.7	P323 F324 L330	P323-V326 PolarHBondContact O-N 3.45Å; F324-V326 VanDerWaalsContact C-N 3.3Å; F324-V326 PolarHBondContact O-N 3.06Å; V326-L330 HydrophobicContact CG1-CD1 4.18Å; V326-L330 WeakPolarHBondContact O-CB 3.42Å; V326-L330 PolarHBondContact O-N 2.87Å; V326-L330 VanDerWaalsContact O-N 3.14Å
327	L	48.5	Very low	49.6	Very low	65 Å²	65	122.4 Å²	122.4	34%	0.34	62%	0.621	S	S	.	*	H	α-helix	trans	-70.2	-43	176.2	-126.4	72.2	0	0	0	112.2	P323 F324 N325 Y329 L330 F331 F339	P323-L327 PolarHBondContact O-N 3.47Å; F324-L327 WeakPolarHBondContact O-CA 3.35Å; F324-L327 VanDerWaalsContact O-CB 3.3Å; F324-L327 WeakPolarHBondContact O-CB 3.41Å; F324-L327 PolarHBondContact O-N 3.41Å; F324-L327 VanDerWaalsContact O-N 3.07Å; N325-L327 VanDerWaalsContact C-N 3.33Å; L327-Y329 VanDerWaalsContact C-N 3.33Å; L327-L330 PolarHBondContact O-N 2.9Å; L327-F331 HydrophobicContact CG-CD2 4.44Å; L327-F331 PolarHBondContact O-N 2.93Å; L327-F339 HydrophobicContact CD2-CE1 3.88Å; L327-F339 HydrophobicContact CD2-CZ 4.32Å
328	T	49.6	Very low	51.4	Low	69 Å²	69	126.5 Å²	126.5	42%	0.423	62%	0.623	S	S	.	*	H	α-helix	trans	-70.5	-26.5	175.6	52.4	0	0	0	0	113.2	F324 N325 F331	F324-T328 PolarHBondContact O-N 2.83Å; F324-T328 PolarHBondContact O-OG1 2.98Å; N325-T328 WeakPolarHBondContact CA-OG1 3.17Å; N325-T328 PolarHBondContact O-OG1 2.83Å; T328-F331 CarbonylContact O-C 3.51Å
329	Y	46.9	Very low	53.4	Low	211 Å²	211	127 Å²	127	83%	0.827	62%	0.621	S	S	*	*	H	α-helix	trans	-75.9	-25.9	171	-122.9	-87.2	0	0	0	113.8	N325 L327	N325-Y329 PolarHBondContact O-N 3.49Å; L327-Y329 VanDerWaalsContact C-N 3.33Å
330	L	52.2	Low	54.9	Low	132 Å²	132	120 Å²	120	69%	0.691	60%	0.602	S	S	*	*	H	α-helix	trans	-87	-34.4	176.2	-87.8	164.9	0	0	0	112.9	V326 L327	V326-L330 HydrophobicContact CG1-CD1 4.18Å; V326-L330 WeakPolarHBondContact O-CB 3.42Å; V326-L330 PolarHBondContact O-N 2.87Å; V326-L330 VanDerWaalsContact O-N 3.14Å; L327-L330 PolarHBondContact O-N 2.9Å
331	F	50.3	Low	56.3	Low	128 Å²	128	119.5 Å²	119.5	56%	0.561	60%	0.598	S	S	*	*			trans	-104.6	94.2	173.1	-68.9	-84.9	0	0	0	109	L327 T328 A333	L327-F331 HydrophobicContact CG-CD2 4.44Å; L327-F331 PolarHBondContact O-N 2.93Å; T328-F331 CarbonylContact O-C 3.51Å; F331-A333 PolarHBondContact O-N 3.22Å; F331-A333 VanDerWaalsContact O-O 3.12Å
332	N	40.5	Very low	58.1	Low	165 Å²	165	114.9 Å²	114.9	88%	0.882	59%	0.587	S	S	*	*	S	Bend	trans	-71.3	30.6	177.5	-146.4	48.5	0	0	0	113.1
333	A	46.1	Very low	59.9	Low	74 Å²	74	111 Å²	111	61%	0.612	58%	0.577	S	S	*	*	S	Bend	trans	-152.7	138.6	178.8	0	0	0	0	0	107	F331	F331-A333 PolarHBondContact O-N 3.22Å; F331-A333 VanDerWaalsContact O-O 3.12Å
334	S	56.6	Low	61.3	Low	115 Å²	115	109.5 Å²	109.5	80%	0.804	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-55.7	131.1	-177.7	39.2	0	0	0	0	111.3	S336	S334-S336 PolarHBondContact O-N 3.46Å
335	P	60.1	Low	63.1	Low	62 Å²	62	110.3 Å²	110.3	40%	0.403	57%	0.572	S	S	.	*	P	Polyproline II helix	trans	-61.6	125	-176.6	23.9	-32.8	0	0	0	109.5	Q337 F339	P335-Q337 PolarHBondContact O-N 3.08Å; P335-F339 HydrophobicContact CB-CD1 4.08Å
336	S	73.3	Confident	64.9	Low	74 Å²	74	108.7 Å²	108.7	52%	0.517	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-52.1	140	-176.1	71	0	0	0	0	111	S334 R338 F339 T340	S334-S336 PolarHBondContact O-N 3.46Å; S336-R338 PolarHBondContact O-N 3.45Å; S336-F339 WeakPolarHBondContact O-CA 3.36Å; S336-F339 WeakPolarHBondContact O-CB 3.22Å; S336-F339 PolarHBondContact O-N 3.45Å; S336-F339 PolarHBondContact OG-N 3.06Å; S336-T340 PolarHBondContact O-N 3.47Å; S336-T340 PolarHBondContact O-OG1 3.33Å
337	Q	70.1	Confident	66.6	Low	171 Å²	171	108.5 Å²	108.5	80%	0.799	57%	0.567	S	S	*	*	H	α-helix	trans	-49.9	-34	-177.9	-170.2	-176.8	13	0	0	112.9	P335 T340 M341	P335-Q337 PolarHBondContact O-N 3.08Å; Q337-T340 PolarHBondContact O-N 2.88Å; Q337-M341 VanDerWaalsContact O-CB 3.29Å; Q337-M341 WeakPolarHBondContact O-CB 3.3Å; Q337-M341 PolarHBondContact O-N 2.93Å
338	R	73	Confident	68.5	Low	211 Å²	211	110.5 Å²	110.5	80%	0.796	58%	0.577	S	S	*	*	H	α-helix	trans	-65.3	-37.4	174.9	-64	-175.3	179.8	-168.3	-0.4	113.4	S336 M342	S336-R338 PolarHBondContact O-N 3.45Å; R338-M342 WeakPolarHBondContact O-CB 3.31Å; R338-M342 WeakPolarHBondContact O-CG 3.28Å; R338-M342 PolarHBondContact O-N 3.43Å
339	F	74.2	Confident	70.4	Confident	99 Å²	99	109 Å²	109	43%	0.434	58%	0.575	S	S	.	*	H	α-helix	trans	-68.2	-42.6	173.7	-177.8	-94.8	0	0	0	111.2	L327 P335 S336 M341 M342 I343	L327-F339 HydrophobicContact CD2-CE1 3.88Å; L327-F339 HydrophobicContact CD2-CZ 4.32Å; P335-F339 HydrophobicContact CB-CD1 4.08Å; S336-F339 WeakPolarHBondContact O-CA 3.36Å; S336-F339 WeakPolarHBondContact O-CB 3.22Å; S336-F339 PolarHBondContact O-N 3.45Å; S336-F339 PolarHBondContact OG-N 3.06Å; F339-M341 VanDerWaalsContact C-N 3.32Å; F339-M341 PolarHBondContact O-N 3.26Å; F339-M342 PolarHBondContact O-N 3.37Å; F339-I343 PolarHBondContact O-N 2.86Å
340	T	77.7	Confident	72.3	Confident	70 Å²	70	105.9 Å²	105.9	43%	0.429	57%	0.566	S	S	.	*	H	α-helix	trans	-63.6	-38.1	176.2	-39	0	0	0	0	111.7	S336 Q337 I343 A344	S336-T340 PolarHBondContact O-N 3.47Å; S336-T340 PolarHBondContact O-OG1 3.33Å; Q337-T340 PolarHBondContact O-N 2.88Å; T340-I343 WeakPolarHBondContact O-CG2 3.33Å; T340-A344 WeakPolarHBondContact O-CB 3.37Å; T340-A344 PolarHBondContact O-N 2.86Å
341	M	73.5	Confident	74	Confident	101 Å²	101	104.1 Å²	104.1	50%	0.498	56%	0.557	S	S	.	*	H	α-helix	trans	-67.8	-41	173	-168.7	176	-165.6	0	0	112.2	Q337 F339 A344 Y345	Q337-M341 VanDerWaalsContact O-CB 3.29Å; Q337-M341 WeakPolarHBondContact O-CB 3.3Å; Q337-M341 PolarHBondContact O-N 2.93Å; F339-M341 VanDerWaalsContact C-N 3.32Å; F339-M341 PolarHBondContact O-N 3.26Å; M341-A344 PolarHBondContact O-N 3.26Å; M341-Y345 HydrophobicContact CE-CE2 3.75Å; M341-Y345 WeakPolarHBondContact CE-OH 3.37Å; M341-Y345 HydrophobicContact CG-CD2 4Å; M341-Y345 HydrophobicContact CG-CE2 3.59Å; M341-Y345 VanDerWaalsContact O-CD2 3.23Å; M341-Y345 WeakPolarHBondContact O-CD2 3.36Å; M341-Y345 PolarHBondContact O-N 2.97Å; M341-Y345 HydrophobicContact SD-CE2 4.28Å
342	M	80.6	Confident	75.7	Confident	133 Å²	133	104.7 Å²	104.7	66%	0.655	56%	0.559	S	S	*	*	H	α-helix	trans	-63.9	-42.7	175.4	-78.1	-70.5	-66.8	0	0	112.7	R338 F339 Y345 A346	R338-M342 WeakPolarHBondContact O-CB 3.31Å; R338-M342 WeakPolarHBondContact O-CG 3.28Å; R338-M342 PolarHBondContact O-N 3.43Å; F339-M342 PolarHBondContact O-N 3.37Å; M342-Y345 PolarHBondContact O-N 3.24Å; M342-A346 WeakPolarHBondContact O-CB 3.47Å; M342-A346 PolarHBondContact O-N 3.03Å
343	I	85.5	Confident	77.9	Confident	68 Å²	68	102.6 Å²	102.6	35%	0.349	55%	0.548	S	S	.	.	H	α-helix	trans	-70.8	-34.3	176.6	-162.2	67.6	0	0	0	111.3	F339 T340 A346 I347	F339-I343 PolarHBondContact O-N 2.86Å; T340-I343 WeakPolarHBondContact O-CG2 3.33Å; I343-A346 HydrophobicContact CD1-CB 4.47Å; I343-A346 PolarHBondContact O-N 2.69Å; I343-I347 HydrophobicContact CG1-CD1 4.17Å; I343-I347 WeakPolarHBondContact O-CB 3.36Å; I343-I347 VanDerWaalsContact O-CG1 3.27Å; I343-I347 WeakPolarHBondContact O-CG1 3.06Å; I343-I347 PolarHBondContact O-N 3.14Å
344	A	79.2	Confident	79.8	Confident	55 Å²	55	101.2 Å²	101.2	46%	0.455	53%	0.534	S	S	.	.	H	α-helix	trans	-61.7	-45.4	171.9	0	0	0	0	0	112	T340 M341 I347 L348	T340-A344 WeakPolarHBondContact O-CB 3.37Å; T340-A344 PolarHBondContact O-N 2.86Å; M341-A344 PolarHBondContact O-N 3.26Å; A344-I347 PolarHBondContact O-N 2.92Å; A344-L348 WeakPolarHBondContact O-CB 3.4Å; A344-L348 PolarHBondContact O-N 3.48Å
345	Y	87.2	Confident	81.1	Confident	139 Å²	139	100 Å²	100	55%	0.545	52%	0.521	S	S	.	.	H	α-helix	trans	-66	-34.9	173.8	-74.5	-52.5	0	0	0	113.2	M341 M342 L348 G349	M341-Y345 HydrophobicContact CE-CE2 3.75Å; M341-Y345 WeakPolarHBondContact CE-OH 3.37Å; M341-Y345 HydrophobicContact CG-CD2 4Å; M341-Y345 HydrophobicContact CG-CE2 3.59Å; M341-Y345 VanDerWaalsContact O-CD2 3.23Å; M341-Y345 WeakPolarHBondContact O-CD2 3.36Å; M341-Y345 PolarHBondContact O-N 2.97Å; M341-Y345 HydrophobicContact SD-CE2 4.28Å; M342-Y345 PolarHBondContact O-N 3.24Å; Y345-L348 HydrophobicContact CD1-CD2 4.48Å; Y345-L348 PolarHBondContact O-N 2.97Å; Y345-G349 PolarHBondContact O-N 3.1Å
346	A	84.7	Confident	82.2	Confident	56 Å²	56	101.1 Å²	101.1	46%	0.463	52%	0.523	S	S	.	.	H	α-helix	trans	-65.2	-41.2	174.4	0	0	0	0	0	112	M342 I343 F350	M342-A346 WeakPolarHBondContact O-CB 3.47Å; M342-A346 PolarHBondContact O-N 3.03Å; I343-A346 HydrophobicContact CD1-CB 4.47Å; I343-A346 PolarHBondContact O-N 2.69Å; A346-F350 WeakPolarHBondContact O-CB 3.27Å; A346-F350 PolarHBondContact O-N 2.84Å
347	I	89	Confident	82.7	Confident	81 Å²	81	102.2 Å²	102.2	42%	0.415	52%	0.52	S	S	.	.	H	α-helix	trans	-66.6	-46.1	174.6	-68.4	163.8	0	0	0	110.5	I343 A344 G349 F350 L351	I343-I347 HydrophobicContact CG1-CD1 4.17Å; I343-I347 WeakPolarHBondContact O-CB 3.36Å; I343-I347 VanDerWaalsContact O-CG1 3.27Å; I343-I347 WeakPolarHBondContact O-CG1 3.06Å; I343-I347 PolarHBondContact O-N 3.14Å; A344-I347 PolarHBondContact O-N 2.92Å; I347-G349 PolarHBondContact O-N 2.71Å; I347-F350 PolarHBondContact O-N 2.89Å; I347-L351 HydrophobicContact CG2-CD1 3.94Å; I347-L351 HydrophobicContact CG2-CG 4.45Å; I347-L351 WeakPolarHBondContact O-CB 3.31Å; I347-L351 WeakPolarHBondContact O-CG 2.96Å; I347-L351 PolarHBondContact O-N 3.17Å
348	L	88.9	Confident	83.2	Confident	107 Å²	107	98.7 Å²	98.7	56%	0.56	51%	0.506	S	S	*	.	H	α-helix	trans	-62.6	-42.1	178.3	-172.6	67.7	0	0	0	111.9	A344 Y345 L351 F352	A344-L348 WeakPolarHBondContact O-CB 3.4Å; A344-L348 PolarHBondContact O-N 3.48Å; Y345-L348 HydrophobicContact CD1-CD2 4.48Å; Y345-L348 PolarHBondContact O-N 2.97Å; L348-L351 PolarHBondContact O-N 3.47Å; L348-F352 WeakPolarHBondContact O-CB 3.31Å; L348-F352 PolarHBondContact O-N 2.94Å
349	G	89.4	Confident	83.5	Confident	37 Å²	37	96.9 Å²	96.9	38%	0.381	50%	0.5	S	S	.	.	H	α-helix	trans	-64.2	-41.9	174.4	0	0	0	0	0	112.5	Y345 I347 F352 L353	Y345-G349 PolarHBondContact O-N 3.1Å; I347-G349 PolarHBondContact O-N 2.71Å; G349-F352 PolarHBondContact O-N 3.18Å; G349-L353 WeakPolarHBondContact O-CB 3.44Å; G349-L353 PolarHBondContact O-N 3.32Å
350	F	86.4	Confident	83.8	Confident	146 Å²	146	97.7 Å²	97.7	64%	0.64	51%	0.505	S	S	*	.	H	α-helix	trans	-64.3	-41.4	174.4	178.9	-96.9	0	0	0	112.4	A346 I347 S354	A346-F350 WeakPolarHBondContact O-CB 3.27Å; A346-F350 PolarHBondContact O-N 2.84Å; I347-F350 PolarHBondContact O-N 2.89Å; F350-S354 VanDerWaalsContact O-CB 3.27Å; F350-S354 WeakPolarHBondContact O-CB 3.44Å; F350-S354 PolarHBondContact O-N 3.34Å; F350-S354 PolarHBondContact O-OG 3.22Å
351	L	87.5	Confident	83.7	Confident	95 Å²	95	100.8 Å²	100.8	50%	0.497	51%	0.509	S	S	.	.	H	α-helix	trans	-61.6	-47.7	173.6	-74.9	167.1	0	0	0	111.1	I347 L348 L353 S354 T355	I347-L351 HydrophobicContact CG2-CD1 3.94Å; I347-L351 HydrophobicContact CG2-CG 4.45Å; I347-L351 WeakPolarHBondContact O-CB 3.31Å; I347-L351 WeakPolarHBondContact O-CG 2.96Å; I347-L351 PolarHBondContact O-N 3.17Å; L348-L351 PolarHBondContact O-N 3.47Å; L351-L353 PolarHBondContact O-N 3.47Å; L351-S354 WeakPolarHBondContact O-CB 3.39Å; L351-S354 PolarHBondContact O-N 3.07Å; L351-T355 PolarHBondContact O-N 3.41Å; L351-T355 PolarHBondContact O-OG1 3.36Å; L351-T355 VanDerWaalsContact O-OG1 3.1Å
352	F	87.1	Confident	83.7	Confident	139 Å²	139	100.7 Å²	100.7	61%	0.61	51%	0.51	S	S	*	.	H	α-helix	trans	-61.5	-44.5	178.9	-170.6	-109.1	0	0	0	112.3	L348 G349 S354 T355 I356	L348-F352 WeakPolarHBondContact O-CB 3.31Å; L348-F352 PolarHBondContact O-N 2.94Å; G349-F352 PolarHBondContact O-N 3.18Å; F352-S354 VanDerWaalsContact C-N 3.32Å; F352-S354 PolarHBondContact O-N 3.35Å; F352-T355 PolarHBondContact O-N 3.02Å; F352-I356 HydrophobicContact CD1-CD1 3.8Å; F352-I356 HydrophobicContact CE1-CD1 3.43Å; F352-I356 VanDerWaalsContact CE1-CD1 3.43Å; F352-I356 HydrophobicContact CE2-CD1 4.5Å; F352-I356 HydrophobicContact CG-CD1 4.48Å; F352-I356 HydrophobicContact CZ-CD1 3.83Å; F352-I356 WeakPolarHBondContact O-CG1 3.46Å; F352-I356 PolarHBondContact O-N 3.25Å
353	L	85.7	Confident	83.2	Confident	122 Å²	122	96.3 Å²	96.3	64%	0.639	50%	0.495	S	S	*	.	H	α-helix	trans	-64.3	-37.4	174.7	-132.7	73.2	0	0	0	112.1	G349 L351 I356 H357	G349-L353 WeakPolarHBondContact O-CB 3.44Å; G349-L353 PolarHBondContact O-N 3.32Å; L351-L353 PolarHBondContact O-N 3.47Å; L353-I356 PolarHBondContact O-N 2.86Å; L353-H357 VanDerWaalsContact O-CB 3.3Å; L353-H357 WeakPolarHBondContact O-CB 3.45Å; L353-H357 PolarHBondContact O-N 2.9Å
354	S	85.6	Confident	82	Confident	45 Å²	45	97.4 Å²	97.4	32%	0.315	50%	0.501	S	S	.	.	H	α-helix	trans	-66.2	-41.8	175.9	-61.2	0	0	0	0	111.8	F350 L351 F352 H357 L358	F350-S354 VanDerWaalsContact O-CB 3.27Å; F350-S354 WeakPolarHBondContact O-CB 3.44Å; F350-S354 PolarHBondContact O-N 3.34Å; F350-S354 PolarHBondContact O-OG 3.22Å; L351-S354 WeakPolarHBondContact O-CB 3.39Å; L351-S354 PolarHBondContact O-N 3.07Å; F352-S354 VanDerWaalsContact C-N 3.32Å; F352-S354 PolarHBondContact O-N 3.35Å; S354-H357 PolarHBondContact O-N 2.88Å; S354-L358 VanDerWaalsContact O-CB 3.22Å; S354-L358 WeakPolarHBondContact O-CB 3.43Å; S354-L358 PolarHBondContact O-N 2.69Å
355	T	83.5	Confident	81	Confident	89 Å²	89	99 Å²	99	55%	0.546	50%	0.501	S	S	.	.	H	α-helix	trans	-65.1	-42.2	175.3	-59.6	0	0	0	0	111.6	L351 F352 L358 Y359	L351-T355 PolarHBondContact O-N 3.41Å; L351-T355 PolarHBondContact O-OG1 3.36Å; L351-T355 VanDerWaalsContact O-OG1 3.1Å; F352-T355 PolarHBondContact O-N 3.02Å; T355-L358 PolarHBondContact O-N 2.64Å; T355-Y359 VanDerWaalsContact O-CB 3.31Å; T355-Y359 WeakPolarHBondContact O-CB 3.41Å; T355-Y359 PolarHBondContact O-N 3.4Å
356	I	85	Confident	79.2	Confident	86 Å²	86	98.3 Å²	98.3	44%	0.441	51%	0.507	S	S	.	.	H	α-helix	trans	-64	-45.2	174.6	-71.3	172	0	0	0	111	F352 L353 L358 Y359 H360	F352-I356 HydrophobicContact CD1-CD1 3.8Å; F352-I356 HydrophobicContact CE1-CD1 3.43Å; F352-I356 VanDerWaalsContact CE1-CD1 3.43Å; F352-I356 HydrophobicContact CE2-CD1 4.5Å; F352-I356 HydrophobicContact CG-CD1 4.48Å; F352-I356 HydrophobicContact CZ-CD1 3.83Å; F352-I356 WeakPolarHBondContact O-CG1 3.46Å; F352-I356 PolarHBondContact O-N 3.25Å; L353-I356 PolarHBondContact O-N 2.86Å; I356-L358 VanDerWaalsContact C-N 3.34Å; I356-L358 PolarHBondContact O-N 2.85Å; I356-Y359 PolarHBondContact O-N 3.27Å; I356-H360 WeakPolarHBondContact O-CB 3.31Å; I356-H360 PolarHBondContact O-N 3.48Å
357	H	82.2	Confident	77.6	Confident	96 Å²	96	102.7 Å²	102.7	44%	0.444	52%	0.522	S	S	.	.	H	α-helix	trans	-64.7	-37.3	177.4	177.8	-100.7	0	0	0	112.2	L353 S354 R361	L353-H357 VanDerWaalsContact O-CB 3.3Å; L353-H357 WeakPolarHBondContact O-CB 3.45Å; L353-H357 PolarHBondContact O-N 2.9Å; S354-H357 PolarHBondContact O-N 2.88Å; H357-R361 WeakPolarHBondContact O-CB 3.33Å; H357-R361 WeakPolarHBondContact O-CG 3.38Å; H357-R361 PolarHBondContact O-N 2.89Å
358	L	80.8	Confident	75.8	Confident	97 Å²	97	107.1 Å²	107.1	51%	0.508	54%	0.541	S	S	.	.	H	α-helix	trans	-67.3	-43.3	173.9	-178.2	61.8	0	0	0	111.6	S354 T355 I356 R361 L362	S354-L358 VanDerWaalsContact O-CB 3.22Å; S354-L358 WeakPolarHBondContact O-CB 3.43Å; S354-L358 PolarHBondContact O-N 2.69Å; T355-L358 PolarHBondContact O-N 2.64Å; I356-L358 VanDerWaalsContact C-N 3.34Å; I356-L358 PolarHBondContact O-N 2.85Å; L358-R361 WeakPolarHBondContact O-CB 3.46Å; L358-R361 PolarHBondContact O-N 3.4Å; L358-L362 HydrophobicContact CD1-CD1 4.39Å; L358-L362 HydrophobicContact CD1-CG 4.48Å; L358-L362 HydrophobicContact CG-CD1 4.04Å; L358-L362 WeakPolarHBondContact O-CB 3.32Å; L358-L362 WeakPolarHBondContact O-CG 3.45Å; L358-L362 PolarHBondContact O-N 2.83Å
359	Y	80.4	Confident	73.9	Confident	174 Å²	174	106.8 Å²	106.8	68%	0.682	54%	0.543	S	S	*	.	H	α-helix	trans	-63.1	-42.9	175.8	-173.5	-96.4	0	0	0	111.7	T355 I356 R361 L362 A363	T355-Y359 VanDerWaalsContact O-CB 3.31Å; T355-Y359 WeakPolarHBondContact O-CB 3.41Å; T355-Y359 PolarHBondContact O-N 3.4Å; I356-Y359 PolarHBondContact O-N 3.27Å; Y359-R361 VanDerWaalsContact C-N 3.34Å; Y359-R361 PolarHBondContact O-N 2.96Å; Y359-L362 PolarHBondContact O-N 2.9Å; Y359-A363 WeakPolarHBondContact O-CB 3.42Å; Y359-A363 PolarHBondContact O-N 3.2Å
360	H	79	Confident	71.5	Confident	116 Å²	116	106.3 Å²	106.3	54%	0.537	54%	0.539	S	S	.	.	H	α-helix	trans	-62.9	-38.6	173.8	-174.6	-90.2	0	0	0	112.2	I356 L364	I356-H360 WeakPolarHBondContact O-CB 3.31Å; I356-H360 PolarHBondContact O-N 3.48Å; H360-L364 WeakPolarHBondContact O-CB 3.18Å; H360-L364 WeakPolarHBondContact O-CG 3.33Å; H360-L364 PolarHBondContact O-N 3.01Å; H360-L364 VanDerWaalsContact O-N 3.15Å
361	R	77.4	Confident	69.4	Low	134 Å²	134	105.4 Å²	105.4	51%	0.506	55%	0.547	S	S	.	.	H	α-helix	trans	-64.4	-44.6	172	-86.3	-79.5	180	163.6	-4.8	112.4	H357 L358 Y359 L364 I365	H357-R361 WeakPolarHBondContact O-CB 3.33Å; H357-R361 WeakPolarHBondContact O-CG 3.38Å; H357-R361 PolarHBondContact O-N 2.89Å; L358-R361 WeakPolarHBondContact O-CB 3.46Å; L358-R361 PolarHBondContact O-N 3.4Å; Y359-R361 VanDerWaalsContact C-N 3.34Å; Y359-R361 PolarHBondContact O-N 2.96Å; R361-L364 PolarHBondContact O-N 3.46Å; R361-I365 WeakPolarHBondContact O-CD1 3.32Å; R361-I365 VanDerWaalsContact O-CG1 3.29Å; R361-I365 WeakPolarHBondContact O-CG1 3.43Å; R361-I365 PolarHBondContact O-N 3.47Å; R361-I365 VanDerWaalsContact O-N 3.13Å
362	L	73.7	Confident	67.1	Low	99 Å²	99	107 Å²	107	52%	0.518	56%	0.561	S	S	.	*	H	α-helix	trans	-64.2	-46.8	178.2	-75.3	164.6	0	0	0	111.3	L358 Y359 L364 I365 D366	L358-L362 HydrophobicContact CD1-CD1 4.39Å; L358-L362 HydrophobicContact CD1-CG 4.48Å; L358-L362 HydrophobicContact CG-CD1 4.04Å; L358-L362 WeakPolarHBondContact O-CB 3.32Å; L358-L362 WeakPolarHBondContact O-CG 3.45Å; L358-L362 PolarHBondContact O-N 2.83Å; Y359-L362 PolarHBondContact O-N 2.9Å; L362-L364 VanDerWaalsContact C-N 3.33Å; L362-L364 PolarHBondContact O-N 2.9Å; L362-I365 PolarHBondContact O-N 3.34Å; L362-I365 VanDerWaalsContact O-N 3.09Å; L362-D366 WeakPolarHBondContact O-CB 3.47Å; L362-D366 PolarHBondContact O-N 2.72Å
363	A	69.6	Low	65	Low	42 Å²	42	108.2 Å²	108.2	35%	0.347	57%	0.572	S	S	.	*	H	α-helix	trans	-59.3	-41.2	177	0	0	0	0	0	112.5	Y359 I365 L367	Y359-A363 WeakPolarHBondContact O-CB 3.42Å; Y359-A363 PolarHBondContact O-N 3.2Å; A363-I365 VanDerWaalsContact C-N 3.34Å; A363-I365 PolarHBondContact O-N 3Å; A363-L367 WeakPolarHBondContact O-CB 3.27Å; A363-L367 PolarHBondContact O-N 3.4Å
364	L	60.8	Low	63	Low	90 Å²	90	113.6 Å²	113.6	47%	0.471	58%	0.584	S	S	.	*	H	α-helix	trans	-64.2	-35.3	174.5	-81.2	169.3	0	0	0	113.2	H360 R361 L362 Q368	H360-L364 WeakPolarHBondContact O-CB 3.18Å; H360-L364 WeakPolarHBondContact O-CG 3.33Å; H360-L364 PolarHBondContact O-N 3.01Å; H360-L364 VanDerWaalsContact O-N 3.15Å; R361-L364 PolarHBondContact O-N 3.46Å; L362-L364 VanDerWaalsContact C-N 3.33Å; L362-L364 PolarHBondContact O-N 2.9Å; L364-Q368 PolarHBondContact O-N 2.94Å
365	I	57.8	Low	60.7	Low	90 Å²	90	123.2 Å²	123.2	46%	0.462	61%	0.613	S	S	.	*	H	α-helix	trans	-75.1	-41.3	178.3	-68.9	164.5	0	0	0	110.8	R361 L362 A363 L367 Q368 T369	R361-I365 WeakPolarHBondContact O-CD1 3.32Å; R361-I365 VanDerWaalsContact O-CG1 3.29Å; R361-I365 WeakPolarHBondContact O-CG1 3.43Å; R361-I365 PolarHBondContact O-N 3.47Å; R361-I365 VanDerWaalsContact O-N 3.13Å; L362-I365 PolarHBondContact O-N 3.34Å; L362-I365 VanDerWaalsContact O-N 3.09Å; A363-I365 VanDerWaalsContact C-N 3.34Å; A363-I365 PolarHBondContact O-N 3Å; I365-L367 VanDerWaalsContact C-N 3.34Å; I365-L367 PolarHBondContact O-N 3Å; I365-Q368 CarbonylContact O-C 3.53Å; I365-Q368 PolarHBondContact O-N 3.17Å; I365-T369 PolarHBondContact O-N 2.9Å; I365-T369 PolarHBondContact O-OG1 3.08Å
366	D	48.7	Very low	58.6	Low	123 Å²	123	123.1 Å²	123.1	66%	0.658	62%	0.622	S	S	*	*	H	α-helix	trans	-63.3	-41.4	177.2	-159.9	32.2	0	0	0	110.9	L362 Q368 T369 G370	L362-D366 WeakPolarHBondContact O-CB 3.47Å; L362-D366 PolarHBondContact O-N 2.72Å; D366-Q368 VanDerWaalsContact C-N 3.25Å; D366-Q368 PolarHBondContact O-N 2.81Å; D366-T369 PolarHBondContact O-N 3.34Å; D366-T369 VanDerWaalsContact O-N 3.09Å; D366-G370 PolarHBondContact O-N 2.83Å
367	L	51.9	Low	56.1	Low	148 Å²	148	122.2 Å²	122.2	78%	0.775	63%	0.633	S	S	*	*	H	α-helix	trans	-61.7	-25.2	170.4	-86.2	158.6	0	0	0	114.4	A363 I365	A363-L367 WeakPolarHBondContact O-CB 3.27Å; A363-L367 PolarHBondContact O-N 3.4Å; I365-L367 VanDerWaalsContact C-N 3.34Å; I365-L367 PolarHBondContact O-N 3Å
368	Q	50.9	Low	54.1	Low	174 Å²	174	125.4 Å²	125.4	81%	0.813	65%	0.652	S	S	*	*	H	α-helix	trans	-89.5	-15.4	173.2	-75.2	-165.2	-57	0	0	114.1	L364 I365 D366	L364-Q368 PolarHBondContact O-N 2.94Å; I365-Q368 CarbonylContact O-C 3.53Å; I365-Q368 PolarHBondContact O-N 3.17Å; D366-Q368 VanDerWaalsContact C-N 3.25Å; D366-Q368 PolarHBondContact O-N 2.81Å
369	T	48.4	Very low	52.1	Low	100 Å²	100	128 Å²	128	61%	0.613	66%	0.661	S	S	*	*	H	α-helix	trans	-111.6	-2	-176.1	-31.7	0	0	0	0	112.9	I365 D366	I365-T369 PolarHBondContact O-N 2.9Å; I365-T369 PolarHBondContact O-OG1 3.08Å; D366-T369 PolarHBondContact O-N 3.34Å; D366-T369 VanDerWaalsContact O-N 3.09Å
370	G	38.4	Very low	50.1	Low	28 Å²	28	126.5 Å²	126.5	29%	0.289	66%	0.66	S	S	.	*	S	Bend	trans	-58.7	164.2	175.2	0	0	0	0	0	115.1	D366 T372	D366-G370 PolarHBondContact O-N 2.83Å; G370-T372 VanDerWaalsContact C-N 3.29Å; G370-T372 PolarHBondContact O-N 3.23Å
371	P	42.7	Very low	48	Very low	126 Å²	126	129.5 Å²	129.5	82%	0.818	68%	0.675	S	S	*	*	S	Bend	trans	-80.9	46.8	-151.1	32.8	-39.1	0	0	0	116.7
372	T	39.2	Very low	46.1	Very low	129 Å²	129	128 Å²	128	79%	0.791	69%	0.685	S	S	*	*			trans	-81.9	-20.9	179.9	-46.8	0	0	0	0	113.1	G370 R374	G370-T372 VanDerWaalsContact C-N 3.29Å; G370-T372 PolarHBondContact O-N 3.23Å; T372-R374 PolarHBondContact O-N 3.39Å
373	I	44.1	Very low	44.8	Very low	164 Å²	164	127.8 Å²	127.8	84%	0.841	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	40.1	-177.9	-34.8	-178.6	0	0	0	112.5
374	R	42.8	Very low	43.6	Very low	235 Å²	235	131.2 Å²	131.2	89%	0.887	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.2	3.5	-179.3	-117.4	-178.7	-177.9	-178.5	1.4	115.3	T372	T372-R374 PolarHBondContact O-N 3.39Å
375	R	37.2	Very low	43	Very low	247 Å²	247	131.2 Å²	131.2	93%	0.932	71%	0.712	S	S	*	*	S	Bend	trans	-143.5	19.8	-177.3	-139.6	176.4	-174.6	173.9	1.7	117.7
376	A	39	Very low	42.6	Very low	88 Å²	88	130.2 Å²	130.2	73%	0.727	71%	0.713	S	S	*	*			trans	-152.3	144.8	154.8	0	0	0	0	0	107.1
377	G	33	Very low	42.7	Very low	66 Å²	66	129.4 Å²	129.4	68%	0.68	71%	0.709	S	S	*	*			cis	127.6	99.1	6.9	0	0	0	0	0	109.6
378	I	41.2	Very low	42.9	Very low	164 Å²	164	125.7 Å²	125.7	84%	0.841	70%	0.695	S	S	*	*			trans	78.5	120.8	169.4	-51.5	176.2	0	0	0	116
379	H	38	Very low	43.2	Very low	151 Å²	151	123.6 Å²	123.6	70%	0.699	69%	0.685	S	S	*	*			trans	82.1	118.8	156	-84.8	-131.7	0	0	0	124.4
380	Q	39.1	Very low	43.8	Very low	142 Å²	142	124 Å²	124	66%	0.664	68%	0.683	S	S	*	*			trans	72	99.4	132.2	-69.4	174.4	-50	0	0	122.6
381	Q	34.1	Very low	45.1	Very low	180 Å²	180	129 Å²	129	84%	0.841	70%	0.699	S	S	*	*				52.8	82.4	126.8	-65.5	175.3	-56.6	0	0	119.5
382	S	38.6	Very low	46.5	Very low	103 Å²	103	127.2 Å²	127.2	72%	0.72	68%	0.683	S	S	*	*			trans	-163.3	30.9	154.1	47.2	0	0	0	0	114.6	T384	S382-T384 PolarHBondContact O-N 2.85Å
383	S	44.3	Very low	47.9	Very low	93 Å²	93	126.4 Å²	126.4	65%	0.65	67%	0.673	S	S	*	*			trans	-90.6	13.8	-166.1	52.5	0	0	0	0	117.3	N387	S383-N387 PolarHBondContact O-ND2 3.29Å
384	T	46.2	Very low	49.4	Very low	114 Å²	114	123.4 Å²	123.4	70%	0.699	66%	0.655	S	S	*	*	S	Bend	trans	-99.9	-30.9	-177.2	43.7	0	0	0	0	114.7	S382	S382-T384 PolarHBondContact O-N 2.85Å
385	T	46.5	Very low	50.9	Low	90 Å²	90	114.9 Å²	114.9	55%	0.552	64%	0.635	S	S	*	*	H	α-helix	trans	-81.9	-38.9	-170.2	-19.4	0	0	0	0	114	N387 S388 E389	T385-N387 PolarHBondContact O-N 3.48Å; T385-S388 PolarHBondContact O-N 2.78Å; T385-S388 PolarHBondContact O-OG 3.42Å; T385-E389 PolarHBondContact O-N 2.94Å
386	S	50.1	Low	52.6	Low	70 Å²	70	107.7 Å²	107.7	49%	0.49	61%	0.612	S	S	.	*	H	α-helix	trans	-64	-40.1	-176.8	49.3	0	0	0	0	112.8	S388 E389 L390	S386-S388 VanDerWaalsContact C-N 3.31Å; S386-S388 PolarHBondContact O-N 2.64Å; S386-E389 PolarHBondContact O-N 3.26Å; S386-L390 PolarHBondContact O-N 3.35Å; S386-L390 VanDerWaalsContact O-N 3.1Å
387	N	51.1	Low	54.5	Low	106 Å²	106	108.4 Å²	108.4	57%	0.567	60%	0.603	S	S	*	*	H	α-helix	trans	-62.7	-36.6	178.7	-67.4	-35.3	0	0	0	112.1	S383 T385 H391	S383-N387 PolarHBondContact O-ND2 3.29Å; T385-N387 PolarHBondContact O-N 3.48Å; N387-H391 PolarHBondContact O-N 2.91Å; N387-H391 VanDerWaalsContact O-N 3.09Å
388	S	56.8	Low	56.7	Low	70 Å²	70	108.7 Å²	108.7	49%	0.49	59%	0.592	S	S	.	*	H	α-helix	trans	-70.1	-32.7	176.2	40.9	0	0	0	0	113.8	T385 S386 N392	T385-S388 PolarHBondContact O-N 2.78Å; T385-S388 PolarHBondContact O-OG 3.42Å; S386-S388 VanDerWaalsContact C-N 3.31Å; S386-S388 PolarHBondContact O-N 2.64Å; S388-N392 VanDerWaalsContact O-CB 3.29Å; S388-N392 WeakPolarHBondContact O-CB 3.33Å; S388-N392 PolarHBondContact O-N 3.12Å; S388-N392 VanDerWaalsContact O-N 3.16Å
389	E	55.8	Low	58.4	Low	129 Å²	129	108.5 Å²	108.5	60%	0.603	58%	0.582	S	S	*	*	H	α-helix	trans	-71.3	-40.2	175.2	-66.9	-173.1	161.1	0	0	111.5	T385 S386 N392 L393	T385-E389 PolarHBondContact O-N 2.94Å; S386-E389 PolarHBondContact O-N 3.26Å; E389-N392 PolarHBondContact O-N 3.49Å; E389-L393 WeakPolarHBondContact O-CG 3.49Å; E389-L393 PolarHBondContact O-N 3.13Å
390	L	61	Low	60.3	Low	108 Å²	108	105.9 Å²	105.9	57%	0.565	57%	0.572	S	S	*	*	H	α-helix	trans	-65.1	-45.6	178.5	-143	167.7	0	0	0	111.4	S386 N392 L393 E394	S386-L390 PolarHBondContact O-N 3.35Å; S386-L390 VanDerWaalsContact O-N 3.1Å; L390-N392 VanDerWaalsContact C-N 3.31Å; L390-N392 PolarHBondContact O-N 2.6Å; L390-L393 PolarHBondContact O-N 2.83Å; L390-E394 WeakPolarHBondContact O-CB 3.32Å; L390-E394 PolarHBondContact O-N 3.14Å
391	H	66.9	Low	62.1	Low	134 Å²	134	103.3 Å²	103.3	62%	0.62	57%	0.566	S	S	*	*	H	α-helix	trans	-64.6	-32.7	175.2	-119.9	-23.5	0	0	0	113	N387 E394 A395	N387-H391 PolarHBondContact O-N 2.91Å; N387-H391 VanDerWaalsContact O-N 3.09Å; H391-E394 IonicContact CE1-OE2 3.35Å; H391-E394 PolarHBondContact CE1-OE2 2.84Å; H391-E394 IonicContact CG-OE2 4Å; H391-E394 IonicContact ND1-OE2 2.83Å; H391-E394 PolarHBondContact ND1-OE2 2.93Å; H391-A395 WeakPolarHBondContact O-CB 3.21Å; H391-A395 PolarHBondContact O-N 3.28Å
392	N	71.7	Confident	64.3	Low	89 Å²	89	100.5 Å²	100.5	48%	0.476	55%	0.553	S	S	.	*	H	α-helix	trans	-70.7	-40.3	175.7	-170.1	-6.7	0	0	0	111.4	S388 E389 L390 A395 Q396	S388-N392 VanDerWaalsContact O-CB 3.29Å; S388-N392 WeakPolarHBondContact O-CB 3.33Å; S388-N392 PolarHBondContact O-N 3.12Å; S388-N392 VanDerWaalsContact O-N 3.16Å; E389-N392 PolarHBondContact O-N 3.49Å; L390-N392 VanDerWaalsContact C-N 3.31Å; L390-N392 PolarHBondContact O-N 2.6Å; N392-A395 PolarHBondContact O-N 2.83Å; N392-Q396 WeakPolarHBondContact O-CB 3.48Å; N392-Q396 VanDerWaalsContact O-CG 3.32Å; N392-Q396 WeakPolarHBondContact O-CG 3.42Å; N392-Q396 PolarHBondContact O-N 3.44Å; N392-Q396 PolarHBondContact OD1-NE2 3.39Å
393	L	68.8	Low	66.2	Low	112 Å²	112	99.4 Å²	99.4	59%	0.586	54%	0.539	S	S	*	.	H	α-helix	trans	-62.9	-41.9	171.7	-77.9	164.8	0	0	0	112.1	E389 L390 Q396 L397	E389-L393 WeakPolarHBondContact O-CG 3.49Å; E389-L393 PolarHBondContact O-N 3.13Å; L390-L393 PolarHBondContact O-N 2.83Å; L393-Q396 PolarHBondContact O-N 3.33Å; L393-L397 WeakPolarHBondContact O-CB 3.44Å; L393-L397 PolarHBondContact O-N 3.45Å
394	E	76	Confident	67.7	Low	100 Å²	100	98 Å²	98	47%	0.467	53%	0.526	S	S	.	.	H	α-helix	trans	-62.7	-43.2	174.8	-176.1	-177.1	-148.2	0	0	112.1	L390 H391 L397 T398	L390-E394 WeakPolarHBondContact O-CB 3.32Å; L390-E394 PolarHBondContact O-N 3.14Å; H391-E394 IonicContact CE1-OE2 3.35Å; H391-E394 PolarHBondContact CE1-OE2 2.84Å; H391-E394 IonicContact CG-OE2 4Å; H391-E394 IonicContact ND1-OE2 2.83Å; H391-E394 PolarHBondContact ND1-OE2 2.93Å; E394-L397 PolarHBondContact O-N 2.87Å; E394-T398 WeakPolarHBondContact O-CB 3.12Å; E394-T398 PolarHBondContact O-N 3.44Å; E394-T398 PolarHBondContact O-OG1 3.44Å
395	A	74.4	Confident	69.2	Low	57 Å²	57	95.3 Å²	95.3	47%	0.471	51%	0.512	S	S	.	.	H	α-helix	trans	-63	-42.1	174.6	0	0	0	0	0	112.1	H391 N392 T398 Y399	H391-A395 WeakPolarHBondContact O-CB 3.21Å; H391-A395 PolarHBondContact O-N 3.28Å; N392-A395 PolarHBondContact O-N 2.83Å; A395-T398 PolarHBondContact O-N 2.93Å; A395-Y399 WeakPolarHBondContact O-CB 3.3Å; A395-Y399 PolarHBondContact O-N 3.11Å
396	Q	72.8	Confident	70.7	Confident	96 Å²	96	97.5 Å²	97.5	45%	0.449	51%	0.514	S	S	.	.	H	α-helix	trans	-65.6	-40.1	175	-73.3	176	47.4	0	0	112.2	N392 L393 Y399 L400	N392-Q396 WeakPolarHBondContact O-CB 3.48Å; N392-Q396 VanDerWaalsContact O-CG 3.32Å; N392-Q396 WeakPolarHBondContact O-CG 3.42Å; N392-Q396 PolarHBondContact O-N 3.44Å; N392-Q396 PolarHBondContact OD1-NE2 3.39Å; L393-Q396 PolarHBondContact O-N 3.33Å; Q396-Y399 PolarHBondContact O-N 2.87Å; Q396-L400 VanDerWaalsContact O-CB 3.32Å; Q396-L400 WeakPolarHBondContact O-CB 3.47Å; Q396-L400 PolarHBondContact O-N 3.04Å
397	L	77.8	Confident	71.8	Confident	102 Å²	102	98.6 Å²	98.6	53%	0.534	51%	0.513	S	S	.	.	H	α-helix	trans	-66.5	-39.2	176.2	-170.8	68.3	0	0	0	111.6	L393 E394 L400 T401	L393-L397 WeakPolarHBondContact O-CB 3.44Å; L393-L397 PolarHBondContact O-N 3.45Å; E394-L397 PolarHBondContact O-N 2.87Å; L397-L400 PolarHBondContact O-N 2.92Å; L397-T401 WeakPolarHBondContact O-CB 3.45Å; L397-T401 PolarHBondContact O-N 3.26Å; L397-T401 PolarHBondContact O-OG1 2.68Å
398	T	78.8	Confident	73.1	Confident	72 Å²	72	99 Å²	99	44%	0.442	51%	0.513	S	S	.	.	H	α-helix	trans	-63.6	-46.7	174.1	-57.1	0	0	0	0	110.9	E394 A395 T401 Q402	E394-T398 WeakPolarHBondContact O-CB 3.12Å; E394-T398 PolarHBondContact O-N 3.44Å; E394-T398 PolarHBondContact O-OG1 3.44Å; A395-T398 PolarHBondContact O-N 2.93Å; T398-T401 PolarHBondContact O-N 3.37Å; T398-Q402 WeakPolarHBondContact O-CG 3.34Å; T398-Q402 PolarHBondContact O-N 3.45Å
399	Y	77.9	Confident	74.1	Confident	160 Å²	160	100.2 Å²	100.2	63%	0.627	51%	0.512	S	S	*	.	H	α-helix	trans	-62.3	-44	176.3	-177	-95	0	0	0	112.2	A395 Q396 T401 Q402 L403	A395-Y399 WeakPolarHBondContact O-CB 3.3Å; A395-Y399 PolarHBondContact O-N 3.11Å; Q396-Y399 PolarHBondContact O-N 2.87Å; Y399-T401 VanDerWaalsContact C-N 3.3Å; Y399-T401 PolarHBondContact O-N 3.31Å; Y399-Q402 PolarHBondContact O-N 3.22Å; Y399-L403 WeakPolarHBondContact O-CB 3.19Å; Y399-L403 PolarHBondContact O-N 2.94Å
400	L	78.2	Confident	75	Confident	96 Å²	96	98 Å²	98	50%	0.503	51%	0.507	S	S	.	.	H	α-helix	trans	-62.2	-38.1	175.3	-176.4	64.9	0	0	0	111.6	Q396 L397 L403 T404	Q396-L400 VanDerWaalsContact O-CB 3.32Å; Q396-L400 WeakPolarHBondContact O-CB 3.47Å; Q396-L400 PolarHBondContact O-N 3.04Å; L397-L400 PolarHBondContact O-N 2.92Å; L400-L403 PolarHBondContact O-N 2.91Å; L400-T404 VanDerWaalsContact O-CB 3.31Å; L400-T404 WeakPolarHBondContact O-CB 3.32Å; L400-T404 PolarHBondContact O-N 3.14Å; L400-T404 PolarHBondContact O-OG1 3.03Å
401	T	77.3	Confident	75.5	Confident	88 Å²	88	98.3 Å²	98.3	54%	0.54	51%	0.508	S	S	.	.	H	α-helix	trans	-67.3	-43.9	176.6	-58.1	0	0	0	0	111.3	L397 T398 Y399 T404 S405	L397-T401 WeakPolarHBondContact O-CB 3.45Å; L397-T401 PolarHBondContact O-N 3.26Å; L397-T401 PolarHBondContact O-OG1 2.68Å; T398-T401 PolarHBondContact O-N 3.37Å; Y399-T401 VanDerWaalsContact C-N 3.3Å; Y399-T401 PolarHBondContact O-N 3.31Å; T401-T404 PolarHBondContact O-N 2.92Å; T401-S405 PolarHBondContact O-N 3.45Å
402	Q	79.7	Confident	76	Confident	122 Å²	122	93.8 Å²	93.8	57%	0.57	50%	0.498	S	S	*	.	H	α-helix	trans	-63.8	-41.1	174.2	-71.2	-177.5	4.2	0	0	112.5	T398 Y399 T404 S405 K406	T398-Q402 WeakPolarHBondContact O-CG 3.34Å; T398-Q402 PolarHBondContact O-N 3.45Å; Y399-Q402 PolarHBondContact O-N 3.22Å; Q402-T404 VanDerWaalsContact C-N 3.31Å; Q402-S405 PolarHBondContact O-N 2.7Å; Q402-K406 PolarHBondContact O-N 3.33Å
403	L	78.7	Confident	76	Confident	80 Å²	80	97.6 Å²	97.6	42%	0.419	51%	0.507	S	S	.	.	H	α-helix	trans	-62.7	-40.5	174.4	-176.5	64.4	0	0	0	111.1	Y399 L400 K406 M407	Y399-L403 WeakPolarHBondContact O-CB 3.19Å; Y399-L403 PolarHBondContact O-N 2.94Å; L400-L403 PolarHBondContact O-N 2.91Å; L403-K406 PolarHBondContact O-N 3.19Å; L403-M407 WeakPolarHBondContact O-CG 3.44Å; L403-M407 PolarHBondContact O-N 2.64Å
404	T	74.5	Confident	76	Confident	63 Å²	63	96.9 Å²	96.9	39%	0.387	50%	0.503	S	S	.	.	H	α-helix	trans	-66.9	-40.3	176.4	-55.8	0	0	0	0	111.6	L400 T401 Q402 M407 I408	L400-T404 VanDerWaalsContact O-CB 3.31Å; L400-T404 WeakPolarHBondContact O-CB 3.32Å; L400-T404 PolarHBondContact O-N 3.14Å; L400-T404 PolarHBondContact O-OG1 3.03Å; T401-T404 PolarHBondContact O-N 2.92Å; Q402-T404 VanDerWaalsContact C-N 3.31Å; T404-M407 PolarHBondContact O-N 3.02Å; T404-I408 HydrophobicContact CG2-CD1 3.94Å; T404-I408 HydrophobicContact CG2-CG1 4.48Å; T404-I408 VanDerWaalsContact O-CG1 3.31Å; T404-I408 WeakPolarHBondContact O-CG1 3.37Å; T404-I408 PolarHBondContact O-N 2.92Å
405	S	78.1	Confident	75.4	Confident	57 Å²	57	95.6 Å²	95.6	40%	0.399	50%	0.502	S	S	.	.	H	α-helix	trans	-58.7	-49.9	172.7	-164.3	0	0	0	0	111	T401 Q402 M407 I408 E409	T401-S405 PolarHBondContact O-N 3.45Å; Q402-S405 PolarHBondContact O-N 2.7Å; S405-M407 VanDerWaalsContact C-N 3.31Å; S405-M407 PolarHBondContact O-N 3.17Å; S405-I408 PolarHBondContact O-N 2.9Å; S405-I408 VanDerWaalsContact O-N 3.08Å; S405-E409 WeakPolarHBondContact O-CB 3.23Å; S405-E409 VanDerWaalsContact O-CG 3.32Å; S405-E409 WeakPolarHBondContact O-CG 3.4Å; S405-E409 PolarHBondContact O-N 3.07Å; S405-E409 PolarHBondContact OG-OE1 3.05Å
406	K	79.1	Confident	75	Confident	137 Å²	137	96 Å²	96	60%	0.596	50%	0.502	S	S	*	.	H	α-helix	trans	-60.8	-37.2	175.9	-73.7	-175.7	174.9	-175.7	0	113.1	Q402 L403 T410	Q402-K406 PolarHBondContact O-N 3.33Å; L403-K406 PolarHBondContact O-N 3.19Å; K406-T410 WeakPolarHBondContact O-CB 3.05Å; K406-T410 WeakPolarHBondContact O-CG2 3.26Å; K406-T410 PolarHBondContact O-N 2.87Å; K406-T410 PolarHBondContact O-OG1 3.24Å
407	M	73.3	Confident	74.7	Confident	93 Å²	93	96.9 Å²	96.9	46%	0.458	51%	0.506	S	S	.	.	H	α-helix	trans	-65.5	-41.5	172.4	-77.1	-172.2	65.4	0	0	112.3	W322 L403 T404 S405 T410 L411	W322-M407 HydrophobicContact CH2-CE 3.84Å; W322-M407 HydrophobicContact CZ3-CE 4.45Å; L403-M407 WeakPolarHBondContact O-CG 3.44Å; L403-M407 PolarHBondContact O-N 2.64Å; T404-M407 PolarHBondContact O-N 3.02Å; S405-M407 VanDerWaalsContact C-N 3.31Å; S405-M407 PolarHBondContact O-N 3.17Å; M407-T410 WeakPolarHBondContact CA-OG1 3.39Å; M407-T410 PolarHBondContact O-OG1 2.88Å; M407-L411 WeakPolarHBondContact O-CB 3.18Å; M407-L411 PolarHBondContact O-N 3.43Å
408	I	78.6	Confident	73.8	Confident	113 Å²	113	97.4 Å²	97.4	58%	0.579	51%	0.509	S	S	*	.	H	α-helix	trans	-66.8	-42.9	176.5	-69.8	166.3	0	0	0	111	T404 S405 L411 G412	T404-I408 HydrophobicContact CG2-CD1 3.94Å; T404-I408 HydrophobicContact CG2-CG1 4.48Å; T404-I408 VanDerWaalsContact O-CG1 3.31Å; T404-I408 WeakPolarHBondContact O-CG1 3.37Å; T404-I408 PolarHBondContact O-N 2.92Å; S405-I408 PolarHBondContact O-N 2.9Å; S405-I408 VanDerWaalsContact O-N 3.08Å; I408-L411 PolarHBondContact O-N 3.29Å; I408-G412 PolarHBondContact O-N 3Å
409	E	77.2	Confident	72.7	Confident	97 Å²	97	98.8 Å²	98.8	45%	0.453	51%	0.513	S	S	.	.	H	α-helix	trans	-59.5	-52.5	174.9	-72.4	156.4	-137.8	0	0	111.1	S405 L411 G412 Y413	S405-E409 WeakPolarHBondContact O-CB 3.23Å; S405-E409 VanDerWaalsContact O-CG 3.32Å; S405-E409 WeakPolarHBondContact O-CG 3.4Å; S405-E409 PolarHBondContact O-N 3.07Å; S405-E409 PolarHBondContact OG-OE1 3.05Å; E409-L411 PolarHBondContact O-N 3.39Å; E409-G412 WeakPolarHBondContact O-CA 3.3Å; E409-G412 PolarHBondContact O-N 2.9Å; E409-G412 VanDerWaalsContact O-N 3.11Å; E409-Y413 WeakPolarHBondContact O-CD2 3.37Å; E409-Y413 PolarHBondContact O-N 2.77Å
410	T	73.9	Confident	71.7	Confident	81 Å²	81	93.7 Å²	93.7	50%	0.497	50%	0.501	S	S	.	.	H	α-helix	trans	-64.9	-35.8	178.4	47.9	0	0	0	0	113.2	K406 M407 G412 Y413 L414	K406-T410 WeakPolarHBondContact O-CB 3.05Å; K406-T410 WeakPolarHBondContact O-CG2 3.26Å; K406-T410 PolarHBondContact O-N 2.87Å; K406-T410 PolarHBondContact O-OG1 3.24Å; M407-T410 WeakPolarHBondContact CA-OG1 3.39Å; M407-T410 PolarHBondContact O-OG1 2.88Å; T410-G412 VanDerWaalsContact C-N 3.32Å; T410-Y413 PolarHBondContact O-N 3.47Å; T410-L414 WeakPolarHBondContact O-CB 3.47Å; T410-L414 WeakPolarHBondContact O-CG 3.29Å; T410-L414 PolarHBondContact O-N 2.98Å
411	L	72.4	Confident	70.5	Confident	115 Å²	115	95.6 Å²	95.6	60%	0.602	51%	0.506	S	S	*	.	H	α-helix	trans	-68	-33.9	172.8	-158	75.8	0	0	0	111.6	M407 I408 E409 T415	M407-L411 WeakPolarHBondContact O-CB 3.18Å; M407-L411 PolarHBondContact O-N 3.43Å; I408-L411 PolarHBondContact O-N 3.29Å; E409-L411 PolarHBondContact O-N 3.39Å; L411-T415 VanDerWaalsContact O-CB 3.3Å; L411-T415 WeakPolarHBondContact O-CB 3.47Å; L411-T415 PolarHBondContact O-N 3.19Å; L411-T415 PolarHBondContact O-OG1 3.38Å
412	G	76.3	Confident	69.2	Low	39 Å²	39	96 Å²	96	40%	0.402	51%	0.507	S	S	.	.	H	α-helix	trans	-64.6	-47.8	172.2	0	0	0	0	0	112.3	I408 E409 T410 T415 S416	I408-G412 PolarHBondContact O-N 3Å; E409-G412 WeakPolarHBondContact O-CA 3.3Å; E409-G412 PolarHBondContact O-N 2.9Å; E409-G412 VanDerWaalsContact O-N 3.11Å; T410-G412 VanDerWaalsContact C-N 3.32Å; G412-T415 PolarHBondContact O-N 2.97Å; G412-S416 PolarHBondContact O-N 2.94Å
413	Y	72.2	Confident	67.8	Low	170 Å²	170	96.7 Å²	96.7	67%	0.667	52%	0.515	S	S	*	.	H	α-helix	trans	-58.6	-50.2	173	-79.9	-68.5	0	0	0	111.6	E409 T410 T415 S416 E417	E409-Y413 WeakPolarHBondContact O-CD2 3.37Å; E409-Y413 PolarHBondContact O-N 2.77Å; T410-Y413 PolarHBondContact O-N 3.47Å; Y413-T415 VanDerWaalsContact C-N 3.3Å; Y413-T415 PolarHBondContact O-N 2.96Å; Y413-S416 PolarHBondContact O-N 2.87Å; Y413-S416 PolarHBondContact O-OG 2.82Å; Y413-E417 PolarHBondContact O-N 2.87Å
414	L	68.1	Low	66.4	Low	96 Å²	96	102.7 Å²	102.7	50%	0.503	53%	0.533	S	S	.	.	H	α-helix	trans	-58.5	-38.2	175.1	-81.2	162.8	0	0	0	112.9	T410 E417 L418	T410-L414 WeakPolarHBondContact O-CB 3.47Å; T410-L414 WeakPolarHBondContact O-CG 3.29Å; T410-L414 PolarHBondContact O-N 2.98Å; L414-E417 PolarHBondContact O-N 3.13Å; L414-L418 WeakPolarHBondContact O-CB 3.43Å; L414-L418 VanDerWaalsContact O-CG 3.26Å; L414-L418 WeakPolarHBondContact O-CG 3.47Å; L414-L418 PolarHBondContact O-N 3.33Å
415	T	64.3	Low	65	Low	73 Å²	73	104.1 Å²	104.1	45%	0.448	55%	0.545	S	S	.	.	H	α-helix	trans	-69.2	-35.2	175.7	-56.6	0	0	0	0	111.4	L411 G412 Y413 N419	L411-T415 VanDerWaalsContact O-CB 3.3Å; L411-T415 WeakPolarHBondContact O-CB 3.47Å; L411-T415 PolarHBondContact O-N 3.19Å; L411-T415 PolarHBondContact O-OG1 3.38Å; G412-T415 PolarHBondContact O-N 2.97Å; Y413-T415 VanDerWaalsContact C-N 3.3Å; Y413-T415 PolarHBondContact O-N 2.96Å; T415-N419 WeakPolarHBondContact O-CB 3.38Å; T415-N419 PolarHBondContact O-N 3.49Å
416	S	65.7	Low	63.1	Low	66 Å²	66	105.4 Å²	105.4	46%	0.462	55%	0.548	S	S	.	.	H	α-helix	trans	-69.6	-38.3	175.2	76.7	0	0	0	0	112.6	G412 Y413 N419 S420	G412-S416 PolarHBondContact O-N 2.94Å; Y413-S416 PolarHBondContact O-N 2.87Å; Y413-S416 PolarHBondContact O-OG 2.82Å; S416-N419 PolarHBondContact O-N 3.18Å; S416-S420 PolarHBondContact O-N 3.43Å
417	E	65.8	Low	61.5	Low	115 Å²	115	104.2 Å²	104.2	54%	0.537	55%	0.554	S	S	.	*	H	α-helix	trans	-67.9	-42.9	171.6	-72.1	-162.7	150.7	0	0	111.6	Y413 L414 N419 S420 F421	Y413-E417 PolarHBondContact O-N 2.87Å; L414-E417 PolarHBondContact O-N 3.13Å; E417-N419 VanDerWaalsContact C-N 3.29Å; E417-N419 PolarHBondContact O-N 3.36Å; E417-S420 PolarHBondContact O-N 2.93Å; E417-S420 VanDerWaalsContact O-N 3.13Å; E417-S420 PolarHBondContact O-OG 3.01Å; E417-F421 WeakPolarHBondContact O-CB 3.34Å; E417-F421 WeakPolarHBondContact O-CD2 3.39Å; E417-F421 PolarHBondContact O-N 3.48Å
418	L	59.7	Low	60	Low	113 Å²	113	108.5 Å²	108.5	59%	0.592	57%	0.573	S	S	*	*	H	α-helix	trans	-61	-39.2	175.8	-74.9	168.4	0	0	0	111.8	L414 V422	L414-L418 WeakPolarHBondContact O-CB 3.43Å; L414-L418 VanDerWaalsContact O-CG 3.26Å; L414-L418 WeakPolarHBondContact O-CG 3.47Å; L414-L418 PolarHBondContact O-N 3.33Å; L418-V422 WeakPolarHBondContact O-CB 3.23Å; L418-V422 VanDerWaalsContact O-CG2 3.23Å; L418-V422 WeakPolarHBondContact O-CG2 3.4Å; L418-V422 PolarHBondContact O-N 2.8Å
419	N	56.6	Low	58.2	Low	100 Å²	100	111 Å²	111	54%	0.535	58%	0.58	S	S	.	*	H	α-helix	trans	-68	-37.7	172.7	-84.2	-16.3	0	0	0	112.9	T415 S416 E417 V422 L423	T415-N419 WeakPolarHBondContact O-CB 3.38Å; T415-N419 PolarHBondContact O-N 3.49Å; S416-N419 PolarHBondContact O-N 3.18Å; E417-N419 VanDerWaalsContact C-N 3.29Å; E417-N419 PolarHBondContact O-N 3.36Å; N419-V422 PolarHBondContact O-N 3.4Å; N419-L423 WeakPolarHBondContact O-CG 3.48Å; N419-L423 PolarHBondContact O-N 3.36Å
420	S	56.9	Low	56.4	Low	54 Å²	54	115.7 Å²	115.7	38%	0.378	60%	0.599	S	S	.	*	H	α-helix	trans	-68.7	-38.3	176.7	75.6	0	0	0	0	111.8	S416 E417 L423 Y424	S416-S420 PolarHBondContact O-N 3.43Å; E417-S420 PolarHBondContact O-N 2.93Å; E417-S420 VanDerWaalsContact O-N 3.13Å; E417-S420 PolarHBondContact O-OG 3.01Å; S420-L423 PolarHBondContact O-N 3.01Å; S420-Y424 WeakPolarHBondContact O-CB 3.43Å; S420-Y424 PolarHBondContact O-N 3.19Å
421	F	52.7	Low	54.5	Low	136 Å²	136	116 Å²	116	60%	0.596	61%	0.605	S	S	*	*	H	α-helix	trans	-64.3	-42.4	171.2	-88.7	-73.6	0	0	0	112.3	E417 L423 Y424 S425	E417-F421 WeakPolarHBondContact O-CB 3.34Å; E417-F421 WeakPolarHBondContact O-CD2 3.39Å; E417-F421 PolarHBondContact O-N 3.48Å; F421-L423 VanDerWaalsContact C-N 3.29Å; F421-L423 PolarHBondContact O-N 3.41Å; F421-Y424 PolarHBondContact O-N 2.83Å; F421-S425 VanDerWaalsContact O-CB 3.31Å; F421-S425 WeakPolarHBondContact O-CB 3.31Å; F421-S425 PolarHBondContact O-N 3.21Å; F421-S425 PolarHBondContact O-OG 2.91Å
422	V	50	Low	53	Low	95 Å²	95	115.2 Å²	115.2	58%	0.576	61%	0.607	S	S	*	*	H	α-helix	trans	-63.4	-33.6	175.7	165.5	0	0	0	0	112.2	L418 N419	L418-V422 WeakPolarHBondContact O-CB 3.23Å; L418-V422 VanDerWaalsContact O-CG2 3.23Å; L418-V422 WeakPolarHBondContact O-CG2 3.4Å; L418-V422 PolarHBondContact O-N 2.8Å; N419-V422 PolarHBondContact O-N 3.4Å
423	L	49.5	Very low	51.3	Low	138 Å²	138	119.6 Å²	119.6	72%	0.723	62%	0.621	S	S	*	*	H	α-helix	trans	-72.5	-39.8	172.4	-74.5	164.9	0	0	0	112.3	N419 S420 F421	N419-L423 WeakPolarHBondContact O-CG 3.48Å; N419-L423 PolarHBondContact O-N 3.36Å; S420-L423 PolarHBondContact O-N 3.01Å; F421-L423 VanDerWaalsContact C-N 3.29Å; F421-L423 PolarHBondContact O-N 3.41Å
424	Y	49.9	Very low	49.8	Very low	206 Å²	206	120.5 Å²	120.5	81%	0.808	63%	0.631	S	S	*	*	H	α-helix	trans	-75	-27.1	178.6	-102.7	-85.6	0	0	0	114.3	S420 F421 N426	S420-Y424 WeakPolarHBondContact O-CB 3.43Å; S420-Y424 PolarHBondContact O-N 3.19Å; F421-Y424 PolarHBondContact O-N 2.83Å; Y424-N426 VanDerWaalsContact C-N 3.28Å; Y424-N426 PolarHBondContact O-N 3.39Å
425	S	44.7	Very low	48.3	Very low	92 Å²	92	120.3 Å²	120.3	64%	0.643	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	12.4	-177.9	67.6	0	0	0	0	114.4	F421	F421-S425 VanDerWaalsContact O-CB 3.31Å; F421-S425 WeakPolarHBondContact O-CB 3.31Å; F421-S425 PolarHBondContact O-N 3.21Å; F421-S425 PolarHBondContact O-OG 2.91Å
426	N	38.9	Very low	47.1	Very low	84 Å²	84	123.5 Å²	123.5	45%	0.449	66%	0.657	S	S	.	*			trans	-138.9	54.4	-179.4	-163.4	11.7	0	0	0	113.7	Y424 E428	Y424-N426 VanDerWaalsContact C-N 3.28Å; Y424-N426 PolarHBondContact O-N 3.39Å; N426-E428 PolarHBondContact O-N 3.27Å
427	P	45	Very low	45.7	Very low	113 Å²	113	128.3 Å²	128.3	73%	0.734	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-11.3	-176.9	30.3	-35.8	0	0	0	114.6
428	E	41.4	Very low	44.4	Very low	183 Å²	183	130.7 Å²	130.7	86%	0.855	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.3	11.3	-170.2	-62.1	-171.6	139	0	0	115	N426	N426-E428 PolarHBondContact O-N 3.27Å
429	K	40.5	Very low	43.6	Very low	165 Å²	165	135.4 Å²	135.4	72%	0.717	73%	0.727	S	S	*	*	S	Bend	trans	-127	13.6	-179.3	-77.9	-166.2	172.2	-175.9	0	116.8
430	F	39.4	Very low	42.9	Very low	195 Å²	195	137.2 Å²	137.2	86%	0.855	74%	0.737	S	S	*	*			trans	-129.7	47.6	169.5	-82.7	-81.6	0	0	0	112.1	P432	F430-P432 WeakPolarHBondContact O-CD 3.47Å
431	S	34	Very low	42.2	Very low	89 Å²	89	141.6 Å²	141.6	62%	0.622	76%	0.756	S	S	*	*			trans	-83.2	117.5	155.1	-177.6	0	0	0	0	108.4	D433	S431-D433 PolarHBondContact O-N 3.24Å; S431-D433 PolarHBondContact OG-OD1 3.36Å
432	P	41.7	Very low	41.6	Very low	98 Å²	98	141.9 Å²	141.9	64%	0.636	77%	0.765	S	S	*	*			trans	-81.8	102.1	168.9	31.8	-29.8	0	0	0	109	F430 Q434	F430-P432 WeakPolarHBondContact O-CD 3.47Å; P432-Q434 PolarHBondContact O-N 2.78Å
433	D	39.6	Very low	41.1	Very low	131 Å²	131	144.6 Å²	144.6	70%	0.701	78%	0.776	S	S	*	*			trans	-69.7	79.7	177.8	-69.7	-12.4	0	0	0	111.3	S431 S435	S431-D433 PolarHBondContact O-N 3.24Å; S431-D433 PolarHBondContact OG-OD1 3.36Å; D433-S435 PolarHBondContact O-N 2.9Å
434	Q	41.6	Very low	40.6	Very low	188 Å²	188	145.1 Å²	145.1	88%	0.879	78%	0.779	S	S	*	*			trans	-74.4	59.1	173.1	-66.9	-169.2	-3.7	0	0	111.2	P432	P432-Q434 PolarHBondContact O-N 2.78Å
435	S	36.6	Very low	40	Very low	93 Å²	93	141 Å²	141	65%	0.65	78%	0.777	S	S	*	*			trans	-149.6	39.7	-171.3	66.6	0	0	0	0	116.8	D433	D433-S435 PolarHBondContact O-N 2.9Å
436	T	38.9	Very low	39.6	Very low	140 Å²	140	144.5 Å²	144.5	86%	0.859	79%	0.787	S	S	*	*			trans	-155.8	77.5	157.8	46.6	0	0	0	0	112.4
437	L	37.4	Very low	39.7	Very low	166 Å²	166	149.2 Å²	149.2	87%	0.869	81%	0.813	S	S	*	*			trans	-153	72.3	163.5	-140.3	161.6	0	0	0	110.6
438	N	36.6	Very low	39.2	Very low	165 Å²	165	152.2 Å²	152.2	88%	0.882	82%	0.819	S	S	*	*			trans	-151.2	74.8	177	-111.5	-7.8	0	0	0	109.5
439	T	43.1	Very low	39	Very low	213 Å²	213	149.4 Å²	149.4	100%	1.307	82%	0.816	S	S	*	*			trans	-160.3	0	159.2	-61.8	0	0	0	0	106.9

Retrieved 439 of 439 residues in 68.1 ms (Link to these results)

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