G4LWW6_SCHMA Loading...

Rna recognition motif (Rrm) domain containing protein, putative

AlphaFold DB , UniProt , Accession G4LWW6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 583 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	44.2	Very low	45.1	Very low	237 Å²	237	146.2 Å²	146.2	100%	1.167	79%	0.79	S	S	*	*				0	111.7	0	-63.5	151.6	82.7	0	0	106.6
2	S	44.5	Very low	45.3	Very low	105 Å²	105	145.4 Å²	145.4	73%	0.734	79%	0.785	S	S	*	*			cis	-153.4	145.7	-1.8	-62.5	0	0	0	0	109.5
3	T	47.3	Very low	45.7	Very low	130 Å²	130	146.2 Å²	146.2	80%	0.798	78%	0.781	S	S	*	*			trans	22.4	130.6	146.2	58.7	0	0	0	0	118.8
4	F	43.5	Very low	45.9	Very low	193 Å²	193	143.5 Å²	143.5	85%	0.846	78%	0.779	S	S	*	*				-163.5	146.6	59.3	-156.8	-106.1	0	0	0	112.1
5	S	45.1	Very low	45.8	Very low	99 Å²	99	141.5 Å²	141.5	69%	0.692	78%	0.78	S	S	*	*			trans	-29.7	158.3	155.7	-39.5	0	0	0	0	115.8
6	G	43.9	Very low	46.1	Very low	65 Å²	65	140.2 Å²	140.2	67%	0.67	78%	0.778	S	S	*	*			cis	123	131.4	12.7	0	0	0	0	0	109.9
7	E	45.7	Very low	46.1	Very low	175 Å²	175	145.4 Å²	145.4	82%	0.818	78%	0.783	S	S	*	*			trans	65.2	154.5	170.4	-62.4	-162.8	94.8	0	0	115.7
8	R	38.4	Very low	46.1	Very low	204 Å²	204	147.6 Å²	147.6	77%	0.77	79%	0.787	S	S	*	*			cis	174.6	146.2	-23.8	-120.7	177.7	165.5	-179.4	-6	103.1
9	S	47.9	Very low	46.1	Very low	100 Å²	100	152.4 Å²	152.4	70%	0.699	79%	0.793	S	S	*	*			trans	63.9	154.9	160.4	-59.5	0	0	0	0	116.3
10	Q	49.5	Very low	46.3	Very low	158 Å²	158	149.8 Å²	149.8	74%	0.738	79%	0.788	S	S	*	*			cis	-151.5	151.5	-12	-117.2	164.3	-38.4	0	0	108
11	D	45.6	Very low	46.6	Very low	142 Å²	142	148.4 Å²	148.4	76%	0.759	79%	0.788	S	S	*	*			trans	27	95.5	146.2	-51.1	-39.7	0	0	0	118.3
12	D	48.1	Very low	46.8	Very low	137 Å²	137	144.1 Å²	144.1	73%	0.733	77%	0.768	S	S	*	*			trans	-153.2	142.1	146	-126.5	-28.6	0	0	0	115.4
13	Q	50.1	Low	47	Very low	156 Å²	156	148.3 Å²	148.3	73%	0.729	77%	0.773	S	S	*	*			trans	47.7	94.8	155.8	-69.3	156.2	64.4	0	0	119.7
14	S	48.2	Very low	46.9	Very low	108 Å²	108	153 Å²	153	76%	0.755	78%	0.776	S	S	*	*				173.3	143.9	93.1	50.4	0	0	0	0	113	T16	S14-T16 PolarHBondContact O-N 2.89Å
15	S	45.3	Very low	46.8	Very low	113 Å²	113	154.9 Å²	154.9	79%	0.79	78%	0.778	S	S	*	*			trans	-72.2	90.4	-175.9	52.4	0	0	0	0	112.6	R17	S15-R17 VanDerWaalsContact C-N 3.26Å; S15-R17 PolarHBondContact O-N 3.01Å
16	T	51	Low	46.7	Very low	121 Å²	121	155.5 Å²	155.5	74%	0.742	78%	0.782	S	S	*	*			trans	-68.1	86.6	165	43.8	0	0	0	0	109.5	S14 H18	S14-T16 PolarHBondContact O-N 2.89Å; T16-H18 PolarHBondContact O-N 2.74Å
17	R	45.8	Very low	46.6	Very low	229 Å²	229	163 Å²	163	86%	0.864	79%	0.79	S	S	*	*			trans	-51.1	107.7	174.3	-79.2	-179.6	170.2	170.9	-3.2	109.6	S15 R19	S15-R17 VanDerWaalsContact C-N 3.26Å; S15-R17 PolarHBondContact O-N 3.01Å; R17-R19 VanDerWaalsContact C-N 3.34Å; R17-R19 PolarHBondContact O-N 3.12Å
18	H	46.1	Very low	46.4	Very low	185 Å²	185	159.7 Å²	159.7	86%	0.856	79%	0.787	S	S	*	*			trans	-56.1	95.9	173.7	-79.9	-84.5	0	0	0	109.8	T16 S20	T16-H18 PolarHBondContact O-N 2.74Å; H18-S20 PolarHBondContact O-N 2.79Å; H18-S20 VanDerWaalsContact O-N 3.12Å
19	R	46.1	Very low	46.7	Very low	239 Å²	239	161 Å²	161	90%	0.902	79%	0.792	S	S	*	*			trans	-76.6	102.6	175.1	-155	175.2	-165.5	-178.2	4	106.6	R17	R17-R19 VanDerWaalsContact C-N 3.34Å; R17-R19 PolarHBondContact O-N 3.12Å
20	S	50.1	Low	46.4	Very low	99 Å²	99	160.6 Å²	160.6	69%	0.692	79%	0.789	S	S	*	*			trans	-43.7	138.9	-175.3	-49.2	0	0	0	0	111.4	H18 I22	H18-S20 PolarHBondContact O-N 2.79Å; H18-S20 VanDerWaalsContact O-N 3.12Å; S20-I22 PolarHBondContact O-N 2.84Å
21	P	52.4	Low	46.2	Very low	121 Å²	121	158.5 Å²	158.5	79%	0.786	79%	0.789	S	S	*	*			trans	-53.1	120.6	180	-24.1	32.5	0	0	0	109.1	K23	P21-K23 PolarHBondContact O-N 2.93Å
22	I	48.8	Very low	46.1	Very low	148 Å²	148	158.7 Å²	158.7	76%	0.759	79%	0.79	S	S	*	*			trans	-63.8	95.4	168.1	-63.7	175.8	0	0	0	104.6	S20 R24	S20-I22 PolarHBondContact O-N 2.84Å; I22-R24 PolarHBondContact O-N 2.86Å
23	K	48.6	Very low	46.3	Very low	193 Å²	193	157.3 Å²	157.3	84%	0.839	79%	0.786	S	S	*	*			trans	-54.8	96.7	165.3	-84.1	-174.7	175.1	179.2	0	104.9	P21 R25	P21-K23 PolarHBondContact O-N 2.93Å; K23-R25 PolarHBondContact O-N 3.18Å
24	R	44.3	Very low	46.6	Very low	229 Å²	229	152.6 Å²	152.6	86%	0.864	77%	0.771	S	S	*	*			trans	-61.1	87.1	166.9	-75.1	-177.1	174.7	177.7	-0.9	104.5	I22 S26	I22-R24 PolarHBondContact O-N 2.86Å; R24-S26 PolarHBondContact O-N 2.8Å
25	R	41.5	Very low	47.2	Very low	231 Å²	231	157.3 Å²	157.3	87%	0.872	77%	0.772	S	S	*	*			trans	-57	100.2	168.6	-112	178.6	162.2	174.8	-6	103.8	K23 R27	K23-R25 PolarHBondContact O-N 3.18Å; R25-R27 PolarHBondContact O-N 2.7Å
26	S	43.2	Very low	48.3	Very low	112 Å²	112	152.2 Å²	152.2	78%	0.783	74%	0.736	S	S	*	*			trans	-56.4	89	165.6	-58.2	0	0	0	0	105.6	R24 S28	R24-S26 PolarHBondContact O-N 2.8Å; S26-S28 PolarHBondContact O-N 2.8Å
27	R	41.4	Very low	49.3	Very low	222 Å²	222	156.7 Å²	156.7	84%	0.838	74%	0.739	S	S	*	*			trans	-65.9	89.1	165.6	-87.3	179	164.8	152.1	-5.9	103.9	R25 R29	R25-R27 PolarHBondContact O-N 2.7Å; R27-R29 PolarHBondContact O-N 2.7Å
28	S	41.3	Very low	50.6	Low	107 Å²	107	147.6 Å²	147.6	75%	0.748	71%	0.711	S	S	*	*			trans	-48.3	89.8	151.8	24.2	0	0	0	0	106	S26 S30	S26-S28 PolarHBondContact O-N 2.8Å; S28-S30 PolarHBondContact O-N 2.72Å
29	R	44.5	Very low	52.4	Low	231 Å²	231	143.6 Å²	143.6	87%	0.872	69%	0.691	S	S	*	*			trans	-71.1	79.9	167.2	-81.1	178.2	165.1	160.9	-4.8	104.9	R27	R27-R29 PolarHBondContact O-N 2.7Å
30	S	41.6	Very low	54.2	Low	91 Å²	91	136.4 Å²	136.4	64%	0.636	66%	0.664	S	S	*	*			trans	-44.5	132	154.1	-51.3	0	0	0	0	106.3	S28 N32	S28-S30 PolarHBondContact O-N 2.72Å; S30-N32 PolarHBondContact O-N 2.85Å
31	P	47.3	Very low	56	Low	115 Å²	115	131.7 Å²	131.7	75%	0.747	63%	0.631	S	S	*	*			trans	-55.4	112.3	178.4	23.4	-32.2	0	0	0	106.2	V33	P31-V33 PolarHBondContact O-N 2.74Å
32	N	42.7	Very low	57.7	Low	145 Å²	145	126.6 Å²	126.6	78%	0.775	60%	0.597	S	S	*	*			trans	-74.7	90.6	-178.3	-170.6	5.5	0	0	0	105	S30 S34	S30-N32 PolarHBondContact O-N 2.85Å; N32-S34 PolarHBondContact O-N 2.87Å
33	V	51.8	Low	59.5	Low	108 Å²	108	119.5 Å²	119.5	66%	0.655	56%	0.561	S	S	*	*			trans	-64.5	81.5	174.2	-177.5	0	0	0	0	105.9	P31 R35	P31-V33 PolarHBondContact O-N 2.74Å; V33-R35 VanDerWaalsContact C-N 3.25Å; V33-R35 PolarHBondContact O-N 2.82Å
34	S	56.1	Low	61.3	Low	58 Å²	58	111.4 Å²	111.4	41%	0.406	53%	0.53	S	S	.	.			trans	-69.3	90.6	-178.9	52.9	0	0	0	0	106.4	N32 V36	N32-S34 PolarHBondContact O-N 2.87Å; S34-V36 PolarHBondContact O-N 2.71Å
35	R	61.3	Low	63.3	Low	206 Å²	206	103.1 Å²	103.1	78%	0.777	50%	0.503	S	S	*	.			trans	-46.2	107.9	178	179.1	-177.8	-68.4	-173.1	-2.6	108.1	V33 R37	V33-R35 VanDerWaalsContact C-N 3.25Å; V33-R35 PolarHBondContact O-N 2.82Å; R35-R37 VanDerWaalsContact O-CG 3.24Å; R35-R37 WeakPolarHBondContact O-CG 3.24Å; R35-R37 PolarHBondContact O-N 2.82Å; R35-R37 VanDerWaalsContact O-N 3.13Å
36	V	69	Low	65.3	Low	7 Å²	7	92.3 Å²	92.3	4%	0.042	46%	0.463	C	S	.	.			trans	-62.9	115.7	-174.2	178.8	0	0	0	0	107.5	S34 S38 A92 Q93 I96	S34-V36 PolarHBondContact O-N 2.71Å; V36-S38 WeakPolarHBondContact CG1-O 3.24Å; V36-A92 HydrophobicContact CG1-CB 4.19Å; V36-Q93 HydrophobicContact CB-CB 4.35Å; V36-Q93 HydrophobicContact CG2-CB 3.96Å; V36-Q93 HydrophobicContact CG2-CG 4.12Å; V36-I96 HydrophobicContact CG1-CD1 4.27Å; V36-I96 HydrophobicContact CG2-CD1 3.61Å
37	R	70.7	Confident	67.2	Low	214 Å²	214	87.5 Å²	87.5	81%	0.808	43%	0.429	S	S	*	.			trans	-95.9	-6.9	-177.8	-46.1	-174.2	179.1	179.4	-4	113.1	R35 Q113	R35-R37 VanDerWaalsContact O-CG 3.24Å; R35-R37 WeakPolarHBondContact O-CG 3.24Å; R35-R37 PolarHBondContact O-N 2.82Å; R35-R37 VanDerWaalsContact O-N 3.13Å; R37-Q113 VanDerWaalsContact N-NE2 3.11Å
38	S	73.8	Confident	69	Low	39 Å²	39	83.4 Å²	83.4	27%	0.273	41%	0.414	S	S	.	.			trans	-138.8	142.2	-169.4	-45.8	0	0	0	0	109.9	V36 R40 Q113	V36-S38 WeakPolarHBondContact CG1-O 3.24Å; S38-R40 PolarHBondContact O-N 2.87Å; S38-Q113 PolarHBondContact OG-NE2 3.25Å
39	K	83.6	Confident	70.8	Confident	100 Å²	100	84.8 Å²	84.8	44%	0.435	41%	0.413	S	S	.	.	S	Bend	trans	-71	-2.4	171.1	-57.6	-174.9	-176.5	-173.5	0	113.7	E85 F86 K87	K39-E85 WeakPolarHBondContact O-CA 3.43Å; K39-F86 WeakPolarHBondContact CB-O 3.49Å; K39-F86 WeakPolarHBondContact CD-O 3.45Å; K39-F86 PolarHBondContact O-N 2.79Å; K39-K87 WeakPolarHBondContact CE-O 3.06Å; K39-K87 PolarHBondContact NZ-O 3.12Å
40	R	84.2	Confident	72.3	Confident	89 Å²	89	74.8 Å²	74.8	34%	0.336	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	126.2	-174.2	-59.2	174.3	100	-142.8	13.6	110.3	S38 L83 M84 E85 E114	S38-R40 PolarHBondContact O-N 2.87Å; R40-L83 HydrophobicContact CB-CD1 4.47Å; R40-M84 WeakPolarHBondContact CA-O 3.46Å; R40-E85 HydrophobicContact CG-CB 4.09Å; R40-E85 HydrophobicContact CG-CG 3.84Å; R40-E85 IonicContact NE-OE2 3.88Å; R40-E85 PolarHBondContact NE-OE2 2.85Å; R40-E114 HydrophobicContact CB-CB 4.32Å; R40-E114 WeakPolarHBondContact CB-OE2 3.19Å; R40-E114 WeakPolarHBondContact CD-OE2 3.3Å; R40-E114 IonicContact CZ-OE2 3.58Å; R40-E114 IonicContact NE-OE2 3.84Å; R40-E114 IonicContact NH1-OE1 2.86Å; R40-E114 PolarHBondContact NH1-OE1 3.13Å; R40-E114 VanDerWaalsContact NH1-OE1 3.09Å; R40-E114 IonicContact NH1-OE2 3.79Å; R40-E114 PolarHBondContact NH1-OE2 2.99Å; R40-E114 PolarHBondContact O-N 2.88Å
41	I	87.7	Confident	74.2	Confident	0 Å²	0	75.1 Å²	75.1	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	146.3	178.8	64.6	156.7	0	0	0	109.9	I43 F59 L83 M84 F86 A92 A95 I96 V111 R112	I41-I43 HydrophobicContact CD1-CD1 4.26Å; I41-I43 HydrophobicContact CD1-CG1 3.96Å; I41-I43 HydrophobicContact CG1-CG1 4.46Å; I41-F59 HydrophobicContact CD1-CE1 3.71Å; I41-F59 HydrophobicContact CD1-CZ 4.47Å; I41-L83 CarbonylContact O-C 3.54Å; I41-L83 WeakPolarHBondContact O-CA 3.27Å; I41-L83 WeakPolarHBondContact O-CD1 3.46Å; I41-M84 HydrophobicContact CD1-CB 4.09Å; I41-M84 HydrophobicContact CD1-SD 4.48Å; I41-M84 HydrophobicContact CG1-CB 3.77Å; I41-M84 VanDerWaalsContact CG1-O 3.29Å; I41-M84 WeakPolarHBondContact CG1-O 3.4Å; I41-M84 PolarHBondContact N-O 3.17Å; I41-M84 PolarHBondContact O-N 2.98Å; I41-F86 HydrophobicContact CD1-CE2 3.66Å; I41-F86 HydrophobicContact CD1-CZ 4.42Å; I41-F86 HydrophobicContact CG1-CD2 4.42Å; I41-F86 HydrophobicContact CG1-CE2 3.89Å; I41-A92 HydrophobicContact CG2-CB 4.03Å; I41-A95 HydrophobicContact CD1-CB 4Å; I41-I96 HydrophobicContact CG2-CD1 3.76Å; I41-I96 HydrophobicContact CG2-CG1 3.94Å; I41-V111 HydrophobicContact CB-CG1 4.32Å; I41-V111 HydrophobicContact CD1-CG1 3.54Å; I41-V111 HydrophobicContact CG1-CG1 4.49Å; I41-R112 CarbonylContact C-O 3.57Å; I41-R112 VanDerWaalsContact CA-O 3.27Å; I41-R112 WeakPolarHBondContact CA-O 3.06Å; I41-R112 WeakPolarHBondContact CB-O 3.38Å
42	V	87.5	Confident	75.9	Confident	13 Å²	13	76.1 Å²	76.1	8%	0.079	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	128	170.3	179.2	0	0	0	0	108.2	L83 V111 R112 E114 D118 L122	V42-L83 HydrophobicContact CG2-CD1 3.79Å; V42-V111 WeakPolarHBondContact O-CA 3.42Å; V42-R112 PolarHBondContact N-O 3.47Å; V42-R112 PolarHBondContact O-N 2.97Å; V42-E114 HydrophobicContact CG2-CB 4.2Å; V42-E114 HydrophobicContact CG2-CG 4.41Å; V42-D118 HydrophobicContact CG2-CB 4.44Å; V42-L122 HydrophobicContact CG1-CD1 4.4Å; V42-L122 HydrophobicContact CG2-CD1 3.78Å
43	I	87.9	Confident	77.9	Confident	0 Å²	0	74.8 Å²	74.8	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	116.3	175.4	-51	168.2	0	0	0	106.6	I41 I46 L55 F59 L69 M81 G82 M84 L109 V111	I41-I43 HydrophobicContact CD1-CD1 4.26Å; I41-I43 HydrophobicContact CD1-CG1 3.96Å; I41-I43 HydrophobicContact CG1-CG1 4.46Å; I43-I46 HydrophobicContact CB-CD1 4.21Å; I43-I46 HydrophobicContact CB-CG1 4.49Å; I43-I46 HydrophobicContact CG2-CD1 3.92Å; I43-I46 HydrophobicContact CG2-CG1 3.71Å; I43-L55 HydrophobicContact CD1-CD2 4.01Å; I43-L55 HydrophobicContact CG2-CD2 4.36Å; I43-F59 HydrophobicContact CD1-CE1 3.89Å; I43-F59 HydrophobicContact CD1-CE2 3.79Å; I43-F59 HydrophobicContact CD1-CZ 3.39Å; I43-F59 HydrophobicContact CG1-CE1 4.38Å; I43-F59 HydrophobicContact CG1-CZ 3.85Å; I43-F59 HydrophobicContact CG2-CZ 4.35Å; I43-L69 HydrophobicContact CD1-CD1 4.18Å; I43-M81 CarbonylContact O-C 3.6Å; I43-M81 VanDerWaalsContact O-CA 3.31Å; I43-M81 WeakPolarHBondContact O-CA 3.42Å; I43-G82 PolarHBondContact N-O 3.04Å; I43-G82 PolarHBondContact O-N 3.14Å; I43-M84 HydrophobicContact CD1-CB 3.8Å; I43-M84 HydrophobicContact CD1-CE 3.82Å; I43-M84 HydrophobicContact CD1-SD 4.4Å; I43-L109 HydrophobicContact CG2-CD2 4.46Å; I43-V111 HydrophobicContact CG1-CG2 4.37Å; I43-V111 HydrophobicContact CG2-CG2 4.33Å
44	A	85.5	Confident	79.4	Confident	23 Å²	23	75.7 Å²	75.7	19%	0.19	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	167.4	177.9	0	0	0	0	0	111.5	I46 G80 M81 V110	A44-I46 VanDerWaalsContact C-N 3.27Å; A44-I46 PolarHBondContact O-N 2.73Å; A44-G80 CarbonylContact C-O 3.53Å; A44-G80 WeakPolarHBondContact CA-O 3.27Å; A44-M81 HydrophobicContact CB-CG 4.11Å; A44-M81 HydrophobicContact CB-SD 4.49Å; A44-V110 HydrophobicContact CB-CB 4.28Å; A44-V110 PolarHBondContact N-O 2.96Å; A44-V110 PolarHBondContact O-N 2.76Å
45	N	86.3	Confident	80.7	Confident	55 Å²	55	73 Å²	73	29%	0.294	33%	0.326	S	S	.	.			trans	60.7	31.2	-175.9	-162.9	48.2	0	0	0	114.2	G80 R107 K108 V110	N45-G80 PolarHBondContact N-O 3.47Å; N45-R107 VanDerWaalsContact OD1-CZ 3.32Å; N45-R107 PolarHBondContact OD1-NE 2.88Å; N45-R107 PolarHBondContact OD1-NH2 3.43Å; N45-K108 PolarHBondContact ND2-O 2.88Å; N45-V110 HydrophobicContact CB-CG2 4.02Å
46	I	84.5	Confident	81.8	Confident	4 Å²	4	66.5 Å²	66.5	2%	0.021	30%	0.303	C	S	.	.			trans	-66.4	127.1	173.1	-52.4	162.5	0	0	0	108	I43 A44 L50 L55 L71 G80 L109	I43-I46 HydrophobicContact CB-CD1 4.21Å; I43-I46 HydrophobicContact CB-CG1 4.49Å; I43-I46 HydrophobicContact CG2-CD1 3.92Å; I43-I46 HydrophobicContact CG2-CG1 3.71Å; A44-I46 VanDerWaalsContact C-N 3.27Å; A44-I46 PolarHBondContact O-N 2.73Å; I46-L50 HydrophobicContact CG2-CB 3.89Å; I46-L50 HydrophobicContact CG2-CD1 4.17Å; I46-L55 HydrophobicContact CD1-CD2 3.69Å; I46-L55 HydrophobicContact CG1-CD2 4.21Å; I46-L55 HydrophobicContact CG2-CD1 4.46Å; I46-L55 HydrophobicContact CG2-CD2 4.42Å; I46-L71 HydrophobicContact CD1-CD2 3.72Å; I46-G80 PolarHBondContact N-O 3.13Å; I46-G80 VanDerWaalsContact O-CA 3.28Å; I46-G80 WeakPolarHBondContact O-CA 3.29Å; I46-L109 HydrophobicContact CB-CD2 4.33Å; I46-L109 HydrophobicContact CG1-CD2 4.09Å; I46-L109 HydrophobicContact CG2-CD2 4.5Å
47	P	81.8	Confident	82.6	Confident	11 Å²	11	71 Å²	71	7%	0.071	32%	0.323	C	S	.	.			trans	-62.3	149.8	171.8	29.1	-38.6	0	0	0	111.5	D49 L50 R107	P47-D49 PolarHBondContact O-N 3.07Å; P47-L50 HydrophobicContact CG-CB 4.25Å; P47-L50 HydrophobicContact CG-CD1 3.44Å; P47-L50 VanDerWaalsContact CG-CD1 3.44Å; P47-L50 HydrophobicContact CG-CG 3.67Å; P47-L50 PolarHBondContact O-N 3.46Å; P47-R107 HydrophobicContact CB-CB 4.39Å
48	Y	80.7	Confident	83.3	Confident	135 Å²	135	62.3 Å²	62.3	53%	0.529	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-20.6	-170.7	-54.2	-49.9	0	0	0	113.3	L50 P78	Y48-L50 VanDerWaalsContact C-N 3.31Å; Y48-P78 HydrophobicContact CD1-CB 4.33Å; Y48-P78 HydrophobicContact CD1-CG 3.87Å; Y48-P78 VanDerWaalsContact CD1-O 3.23Å; Y48-P78 WeakPolarHBondContact CD1-O 3.25Å; Y48-P78 WeakPolarHBondContact CE1-O 3.46Å; Y48-P78 HydrophobicContact CG-CG 4.26Å
49	D	78.5	Confident	83.8	Confident	137 Å²	137	60.5 Å²	60.5	73%	0.733	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-5.2	178.7	-45.1	-86.8	0	0	0	113.7	P47	P47-D49 PolarHBondContact O-N 3.07Å
50	L	75.6	Confident	83.8	Confident	20 Å²	20	62.5 Å²	62.5	11%	0.105	29%	0.285	C	S	.	.			trans	-95.6	105.1	173.7	-72.8	178.9	0	0	0	111.7	I46 P47 Y48 K54 L55 L58 V104	I46-L50 HydrophobicContact CG2-CB 3.89Å; I46-L50 HydrophobicContact CG2-CD1 4.17Å; P47-L50 HydrophobicContact CG-CB 4.25Å; P47-L50 HydrophobicContact CG-CD1 3.44Å; P47-L50 VanDerWaalsContact CG-CD1 3.44Å; P47-L50 HydrophobicContact CG-CG 3.67Å; P47-L50 PolarHBondContact O-N 3.46Å; Y48-L50 VanDerWaalsContact C-N 3.31Å; L50-K54 HydrophobicContact CD2-CB 3.73Å; L50-K54 HydrophobicContact CD2-CD 3.92Å; L50-K54 HydrophobicContact CD2-CG 4.49Å; L50-L55 HydrophobicContact CD1-CD1 4.32Å; L50-L58 HydrophobicContact CD1-CD1 4.43Å; L50-L58 HydrophobicContact CD2-CD1 4.41Å; L50-V104 HydrophobicContact CD1-CB 3.88Å; L50-V104 HydrophobicContact CD1-CG1 3.49Å; L50-V104 VanDerWaalsContact CD1-CG1 3.49Å; L50-V104 HydrophobicContact CD1-CG2 4.4Å; L50-V104 HydrophobicContact CD2-CG1 3.95Å; L50-V104 HydrophobicContact CG-CG1 4.11Å
51	N	81.6	Confident	83.8	Confident	99 Å²	99	64.7 Å²	64.7	53%	0.529	30%	0.299	S	S	.	.			trans	-71.3	162.3	165.1	-69.2	-13.3	0	0	0	111.6	Q53 K54 L55	N51-Q53 PolarHBondContact O-N 2.83Å; N51-Q53 VanDerWaalsContact O-N 3.09Å; N51-K54 PolarHBondContact O-N 3.17Å; N51-L55 PolarHBondContact O-N 3.24Å; N51-L55 VanDerWaalsContact O-N 3.07Å
52	W	82.2	Confident	83.4	Confident	136 Å²	136	67.8 Å²	67.8	52%	0.515	31%	0.314	S	S	.	.	H	α-helix	trans	-54.2	-31.9	177.9	66.7	-95.6	0	0	0	112.8	K56 L69 L71	W52-K56 WeakPolarHBondContact O-CB 3Å; W52-K56 PolarHBondContact O-N 3.23Å; W52-L69 HydrophobicContact CB-CD2 4.11Å; W52-L69 WeakPolarHBondContact O-CD2 3.45Å; W52-L71 HydrophobicContact CB-CD1 3.72Å; W52-L71 HydrophobicContact CB-CG 3.9Å
53	Q	85.1	Confident	82.9	Confident	117 Å²	117	67.8 Å²	67.8	55%	0.547	31%	0.313	S	S	.	.	H	α-helix	trans	-62.4	-57.3	176.7	-67	173.5	-41.4	0	0	111.7	N51 L55 K56 E57	N51-Q53 PolarHBondContact O-N 2.83Å; N51-Q53 VanDerWaalsContact O-N 3.09Å; Q53-L55 VanDerWaalsContact C-N 3.3Å; Q53-L55 PolarHBondContact O-N 2.95Å; Q53-K56 PolarHBondContact O-N 2.86Å; Q53-E57 WeakPolarHBondContact O-CB 3.16Å; Q53-E57 PolarHBondContact O-N 2.99Å
54	K	83.7	Confident	81.8	Confident	127 Å²	127	69.3 Å²	69.3	55%	0.552	33%	0.329	S	S	*	.	H	α-helix	trans	-60.1	-39.7	177.5	-75.8	-175.4	176.2	176.6	0	111.9	L50 N51 E57 L58	L50-K54 HydrophobicContact CD2-CB 3.73Å; L50-K54 HydrophobicContact CD2-CD 3.92Å; L50-K54 HydrophobicContact CD2-CG 4.49Å; N51-K54 PolarHBondContact O-N 3.17Å; K54-E57 PolarHBondContact O-N 2.93Å; K54-L58 WeakPolarHBondContact O-CG 3.44Å; K54-L58 PolarHBondContact O-N 2.82Å
55	L	84.3	Confident	80.7	Confident	0 Å²	0	75.5 Å²	75.5	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-66.2	-42.5	177.1	-165.6	70.3	0	0	0	111.4	I43 I46 L50 N51 Q53 E57 L58 F59 L69 L71 L109	I43-L55 HydrophobicContact CD1-CD2 4.01Å; I43-L55 HydrophobicContact CG2-CD2 4.36Å; I46-L55 HydrophobicContact CD1-CD2 3.69Å; I46-L55 HydrophobicContact CG1-CD2 4.21Å; I46-L55 HydrophobicContact CG2-CD1 4.46Å; I46-L55 HydrophobicContact CG2-CD2 4.42Å; L50-L55 HydrophobicContact CD1-CD1 4.32Å; N51-L55 PolarHBondContact O-N 3.24Å; N51-L55 VanDerWaalsContact O-N 3.07Å; Q53-L55 VanDerWaalsContact C-N 3.3Å; Q53-L55 PolarHBondContact O-N 2.95Å; L55-E57 VanDerWaalsContact C-N 3.29Å; L55-E57 PolarHBondContact O-N 3.44Å; L55-L58 PolarHBondContact O-N 3.37Å; L55-F59 HydrophobicContact CD1-CD2 4.25Å; L55-F59 HydrophobicContact CD1-CE2 3.83Å; L55-F59 HydrophobicContact CG-CD2 4.22Å; L55-F59 HydrophobicContact CG-CE2 4.07Å; L55-F59 WeakPolarHBondContact O-CD2 3.26Å; L55-F59 PolarHBondContact O-N 3.32Å; L55-F59 VanDerWaalsContact O-N 3.14Å; L55-L69 HydrophobicContact CB-CD2 4.04Å; L55-L69 HydrophobicContact CD2-CD1 4.18Å; L55-L69 HydrophobicContact CD2-CD2 4.02Å; L55-L69 HydrophobicContact CG-CD2 4.27Å; L55-L71 HydrophobicContact CD2-CD2 3.97Å; L55-L109 HydrophobicContact CD1-CD1 3.93Å; L55-L109 HydrophobicContact CD1-CD2 4.33Å
56	K	84.4	Confident	79.7	Confident	71 Å²	71	74.4 Å²	74.4	31%	0.309	35%	0.347	S	S	.	.	H	α-helix	trans	-65	-33.3	175.1	-170.7	171.8	-176.2	171.5	0	112.2	W52 Q53 R60 T66 G67 L69	W52-K56 WeakPolarHBondContact O-CB 3Å; W52-K56 PolarHBondContact O-N 3.23Å; Q53-K56 PolarHBondContact O-N 2.86Å; K56-R60 WeakPolarHBondContact O-CB 3.32Å; K56-R60 PolarHBondContact O-N 2.54Å; K56-T66 WeakPolarHBondContact CE-OG1 3.38Å; K56-T66 HydrophobicContact CG-CG2 4.34Å; K56-T66 WeakPolarHBondContact CG-OG1 3.14Å; K56-G67 WeakPolarHBondContact CE-O 3.46Å; K56-G67 PolarHBondContact NZ-O 2.89Å; K56-G67 VanDerWaalsContact NZ-O 3.15Å; K56-L69 HydrophobicContact CB-CD2 4.09Å
57	E	84.5	Confident	79.1	Confident	100 Å²	100	75.2 Å²	75.2	47%	0.467	36%	0.357	S	S	.	.	H	α-helix	trans	-67.9	-49.3	175.6	-177.5	151.3	-121.3	0	0	112.3	Q53 K54 L55 F59 R60 E61	Q53-E57 WeakPolarHBondContact O-CB 3.16Å; Q53-E57 PolarHBondContact O-N 2.99Å; K54-E57 PolarHBondContact O-N 2.93Å; L55-E57 VanDerWaalsContact C-N 3.29Å; L55-E57 PolarHBondContact O-N 3.44Å; E57-F59 VanDerWaalsContact C-N 3.3Å; E57-F59 PolarHBondContact O-N 2.96Å; E57-R60 WeakPolarHBondContact O-CA 3.42Å; E57-R60 WeakPolarHBondContact O-CB 3.44Å; E57-R60 PolarHBondContact O-N 3.16Å; E57-R60 IonicContact OE1-CZ 3.18Å; E57-R60 IonicContact OE1-NH2 2.54Å; E57-R60 PolarHBondContact OE1-NH2 2.78Å; E57-E61 PolarHBondContact O-N 3.32Å
58	L	85.1	Confident	79	Confident	33 Å²	33	80.7 Å²	80.7	17%	0.173	38%	0.379	C	S	.	.	H	α-helix	trans	-56.2	-42.7	174.6	-72.4	167.9	0	0	0	112.4	L50 K54 L55 Q62 M99 F102 V104	L50-L58 HydrophobicContact CD1-CD1 4.43Å; L50-L58 HydrophobicContact CD2-CD1 4.41Å; K54-L58 WeakPolarHBondContact O-CG 3.44Å; K54-L58 PolarHBondContact O-N 2.82Å; L55-L58 PolarHBondContact O-N 3.37Å; L58-Q62 WeakPolarHBondContact O-CG 3.41Å; L58-Q62 PolarHBondContact O-N 3.28Å; L58-Q62 VanDerWaalsContact O-N 3.14Å; L58-M99 HydrophobicContact CB-CE 4.1Å; L58-F102 HydrophobicContact CD2-CE1 4.38Å; L58-V104 HydrophobicContact CD1-CG1 3.94Å; L58-V104 HydrophobicContact CD1-CG2 4Å
59	F	84.2	Confident	79.1	Confident	0 Å²	0	75.1 Å²	75.1	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-72	-30.4	176.6	-82.2	-109.6	0	0	0	112.6	I41 I43 L55 E57 I63 T66 M84 F86 A95 M99 L109 V111	I41-F59 HydrophobicContact CD1-CE1 3.71Å; I41-F59 HydrophobicContact CD1-CZ 4.47Å; I43-F59 HydrophobicContact CD1-CE1 3.89Å; I43-F59 HydrophobicContact CD1-CE2 3.79Å; I43-F59 HydrophobicContact CD1-CZ 3.39Å; I43-F59 HydrophobicContact CG1-CE1 4.38Å; I43-F59 HydrophobicContact CG1-CZ 3.85Å; I43-F59 HydrophobicContact CG2-CZ 4.35Å; L55-F59 HydrophobicContact CD1-CD2 4.25Å; L55-F59 HydrophobicContact CD1-CE2 3.83Å; L55-F59 HydrophobicContact CG-CD2 4.22Å; L55-F59 HydrophobicContact CG-CE2 4.07Å; L55-F59 WeakPolarHBondContact O-CD2 3.26Å; L55-F59 PolarHBondContact O-N 3.32Å; L55-F59 VanDerWaalsContact O-N 3.14Å; E57-F59 VanDerWaalsContact C-N 3.3Å; E57-F59 PolarHBondContact O-N 2.96Å; F59-I63 HydrophobicContact CB-CD1 4.04Å; F59-I63 HydrophobicContact CD1-CD1 3.35Å; F59-I63 HydrophobicContact CE1-CD1 4.12Å; F59-I63 HydrophobicContact CG-CD1 3.99Å; F59-I63 WeakPolarHBondContact O-CB 2.9Å; F59-I63 PolarHBondContact O-N 3.06Å; F59-T66 HydrophobicContact CB-CG2 3.63Å; F59-M84 HydrophobicContact CB-CE 3.78Å; F59-M84 HydrophobicContact CB-SD 4.01Å; F59-M84 HydrophobicContact CD1-CE 3.78Å; F59-M84 HydrophobicContact CD1-SD 3.46Å; F59-M84 WeakPolarHBondContact CD1-SD 3.03Å; F59-M84 HydrophobicContact CD2-CE 3.93Å; F59-M84 HydrophobicContact CE1-CE 4.32Å; F59-M84 HydrophobicContact CE1-SD 4.05Å; F59-M84 HydrophobicContact CE2-CE 4.44Å; F59-M84 HydrophobicContact CG-CE 3.56Å; F59-M84 HydrophobicContact CG-SD 3.83Å; F59-F86 HydrophobicContact CD1-CZ 4.07Å; F59-A95 HydrophobicContact CD1-CB 4.38Å; F59-A95 HydrophobicContact CE1-CB 4.21Å; F59-M99 HydrophobicContact CD1-CG 4.04Å; F59-M99 HydrophobicContact CD2-CE 3.61Å; F59-M99 HydrophobicContact CE1-CB 3.92Å; F59-M99 HydrophobicContact CE1-CG 3.85Å; F59-M99 HydrophobicContact CE2-CB 4.45Å; F59-M99 HydrophobicContact CE2-CE 3.61Å; F59-M99 HydrophobicContact CE2-CG 4.38Å; F59-M99 HydrophobicContact CG-CE 4.2Å; F59-M99 HydrophobicContact CG-CG 4.4Å; F59-M99 HydrophobicContact CZ-CB 3.85Å; F59-M99 HydrophobicContact CZ-CE 4.19Å; F59-M99 HydrophobicContact CZ-CG 4.04Å; F59-L109 HydrophobicContact CE2-CD1 4.24Å; F59-V111 HydrophobicContact CE1-CG2 4.23Å; F59-V111 HydrophobicContact CZ-CG2 3.72Å
60	R	84.7	Confident	79.2	Confident	142 Å²	142	70.4 Å²	70.4	54%	0.536	33%	0.333	S	S	.	.	H	α-helix	trans	-65.2	-45.3	173.4	179.6	-173.8	66.3	-173.1	-5.4	110.5	K56 E57 G64 T66	K56-R60 WeakPolarHBondContact O-CB 3.32Å; K56-R60 PolarHBondContact O-N 2.54Å; E57-R60 WeakPolarHBondContact O-CA 3.42Å; E57-R60 WeakPolarHBondContact O-CB 3.44Å; E57-R60 PolarHBondContact O-N 3.16Å; E57-R60 IonicContact OE1-CZ 3.18Å; E57-R60 IonicContact OE1-NH2 2.54Å; E57-R60 PolarHBondContact OE1-NH2 2.78Å; R60-G64 WeakPolarHBondContact O-CA 3.33Å; R60-G64 PolarHBondContact O-N 2.92Å; R60-G64 VanDerWaalsContact O-N 3.13Å; R60-T66 HydrophobicContact CB-CG2 4.13Å
61	E	85.1	Confident	79.4	Confident	135 Å²	135	71.3 Å²	71.3	63%	0.631	34%	0.337	S	S	*	.	H	α-helix	trans	-63.4	-49.5	-179	-172.8	-177.2	174.8	0	0	112.4	E57	E57-E61 PolarHBondContact O-N 3.32Å
62	Q	77.6	Confident	78.8	Confident	66 Å²	66	67.3 Å²	67.3	31%	0.308	32%	0.315	S	S	.	.	H	α-helix	trans	-82.2	-32.8	-172.2	-63.2	-61.4	-41.9	0	0	114.2	L58 K94 T98 M99	L58-Q62 WeakPolarHBondContact O-CG 3.41Å; L58-Q62 PolarHBondContact O-N 3.28Å; L58-Q62 VanDerWaalsContact O-N 3.14Å; Q62-K94 WeakPolarHBondContact O-CE 3.32Å; Q62-K94 PolarHBondContact O-NZ 2.81Å; Q62-T98 HydrophobicContact CB-CG2 4.46Å; Q62-M99 HydrophobicContact CB-SD 3.7Å; Q62-M99 HydrophobicContact CG-SD 3.73Å
63	I	77.2	Confident	78.2	Confident	12 Å²	12	63.8 Å²	63.8	6%	0.062	30%	0.303	C	S	.	.	H	α-helix	trans	-105.1	-39.2	-171.2	-59.7	143.2	0	0	0	111.7	F59 F86 G91 K94 A95 M99	F59-I63 HydrophobicContact CB-CD1 4.04Å; F59-I63 HydrophobicContact CD1-CD1 3.35Å; F59-I63 HydrophobicContact CE1-CD1 4.12Å; F59-I63 HydrophobicContact CG-CD1 3.99Å; F59-I63 WeakPolarHBondContact O-CB 2.9Å; F59-I63 PolarHBondContact O-N 3.06Å; I63-F86 HydrophobicContact CD1-CE1 4.31Å; I63-F86 HydrophobicContact CD1-CZ 4.01Å; I63-F86 HydrophobicContact CG2-CE1 3.97Å; I63-G91 WeakPolarHBondContact CG2-O 3.33Å; I63-K94 HydrophobicContact CG1-CG 4.48Å; I63-K94 HydrophobicContact CG2-CB 4.17Å; I63-K94 HydrophobicContact CG2-CD 4.12Å; I63-K94 HydrophobicContact CG2-CG 4.2Å; I63-K94 PolarHBondContact O-NZ 3.03Å; I63-A95 HydrophobicContact CD1-CB 3.45Å; I63-A95 VanDerWaalsContact CD1-CB 3.45Å; I63-A95 HydrophobicContact CG1-CB 4.14Å; I63-M99 HydrophobicContact CD1-CG 3.72Å; I63-M99 HydrophobicContact CG1-CG 4.34Å
64	G	66.2	Low	77	Confident	32 Å²	32	63.7 Å²	63.7	33%	0.33	30%	0.301	S	S	.	.	S	Bend	trans	78.9	140.6	-161.2	0	0	0	0	0	111.6	R60	R60-G64 WeakPolarHBondContact O-CA 3.33Å; R60-G64 PolarHBondContact O-N 2.92Å; R60-G64 VanDerWaalsContact O-N 3.13Å
65	F	60.6	Low	75.8	Confident	153 Å²	153	63.6 Å²	63.6	67%	0.671	31%	0.307	S	S	*	.			trans	54.5	94.4	-177.1	-62.5	-79.1	0	0	0	116.4	F86	F65-F86 VanDerWaalsContact O-CD1 3.3Å; F65-F86 WeakPolarHBondContact O-CD1 3.32Å
66	T	67.1	Low	74.7	Confident	32 Å²	32	66.2 Å²	66.2	20%	0.196	33%	0.333	C	S	.	.			trans	-94.8	135.4	167.8	51	0	0	0	0	112.1	K56 F59 R60 M84	K56-T66 WeakPolarHBondContact CE-OG1 3.38Å; K56-T66 HydrophobicContact CG-CG2 4.34Å; K56-T66 WeakPolarHBondContact CG-OG1 3.14Å; F59-T66 HydrophobicContact CB-CG2 3.63Å; R60-T66 HydrophobicContact CB-CG2 4.13Å; T66-M84 HydrophobicContact CG2-SD 4.48Å
67	G	72	Confident	73.9	Confident	22 Å²	22	70.3 Å²	70.3	23%	0.227	35%	0.351	C	S	.	.			trans	-94.7	-133.2	173.2	0	0	0	0	0	112.5	K56 E85	K56-G67 WeakPolarHBondContact CE-O 3.46Å; K56-G67 PolarHBondContact NZ-O 2.89Å; K56-G67 VanDerWaalsContact NZ-O 3.15Å; G67-E85 CarbonylContact C-O 3.57Å; G67-E85 WeakPolarHBondContact CA-O 3.46Å; G67-E85 PolarHBondContact N-O 2.84Å
68	F	78.9	Confident	73	Confident	125 Å²	125	68.3 Å²	68.3	55%	0.548	35%	0.347	S	S	.	.			trans	-81.2	128.5	-178.1	-172.1	-104.8	0	0	0	110.4	Q70 M84 E85	F68-Q70 HydrophobicContact CE1-CB 3.98Å; F68-M84 CarbonylContact O-C 3.57Å; F68-M84 WeakPolarHBondContact O-CA 3.45Å; F68-E85 HydrophobicContact CB-CB 4.4Å; F68-E85 PolarHBondContact N-O 2.79Å; F68-E85 VanDerWaalsContact N-O 3.12Å; F68-E85 PolarHBondContact O-N 2.87Å
69	L	83.1	Confident	72.3	Confident	19 Å²	19	69.7 Å²	69.7	10%	0.099	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	114.3	175.4	168.5	63.7	0	0	0	108.6	I43 W52 L55 K56 L71 M84	I43-L69 HydrophobicContact CD1-CD1 4.18Å; W52-L69 HydrophobicContact CB-CD2 4.11Å; W52-L69 WeakPolarHBondContact O-CD2 3.45Å; L55-L69 HydrophobicContact CB-CD2 4.04Å; L55-L69 HydrophobicContact CD2-CD1 4.18Å; L55-L69 HydrophobicContact CD2-CD2 4.02Å; L55-L69 HydrophobicContact CG-CD2 4.27Å; K56-L69 HydrophobicContact CB-CD2 4.09Å; L69-L71 HydrophobicContact CD1-CD2 4.21Å; L69-M84 HydrophobicContact CB-CE 4.17Å; L69-M84 HydrophobicContact CB-CG 4.49Å; L69-M84 HydrophobicContact CD1-CB 4.02Å; L69-M84 HydrophobicContact CD1-CE 3.94Å; L69-M84 HydrophobicContact CD2-CE 4Å; L69-M84 HydrophobicContact CG-CE 4.25Å
70	Q	79.7	Confident	71.9	Confident	38 Å²	38	70 Å²	70	18%	0.178	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	121.1	170.7	-167.8	57.7	57.5	0	0	109.2	F68 F72 G82 L83	F68-Q70 HydrophobicContact CE1-CB 3.98Å; Q70-F72 HydrophobicContact CB-CE2 4.03Å; Q70-F72 HydrophobicContact CB-CZ 4.34Å; Q70-F72 HydrophobicContact CG-CD2 4.27Å; Q70-F72 HydrophobicContact CG-CE1 4.21Å; Q70-F72 HydrophobicContact CG-CE2 3.66Å; Q70-F72 HydrophobicContact CG-CZ 3.63Å; Q70-G82 CarbonylContact O-C 3.6Å; Q70-G82 WeakPolarHBondContact O-CA 3.5Å; Q70-L83 HydrophobicContact CB-CB 4.44Å; Q70-L83 PolarHBondContact N-O 2.94Å; Q70-L83 PolarHBondContact O-N 3.41Å
71	L	79.6	Confident	71.8	Confident	38 Å²	38	65.9 Å²	65.9	20%	0.199	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	142.9	162.2	-68.2	-171.2	0	0	0	109.2	I46 W52 L55 L69	I46-L71 HydrophobicContact CD1-CD2 3.72Å; W52-L71 HydrophobicContact CB-CD1 3.72Å; W52-L71 HydrophobicContact CB-CG 3.9Å; L55-L71 HydrophobicContact CD2-CD2 3.97Å; L69-L71 HydrophobicContact CD1-CD2 4.21Å
72	F	70.4	Confident	71.8	Confident	16 Å²	16	59.5 Å²	59.5	7%	0.07	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	130.4	175.6	-66.5	-92.8	0	0	0	109.9	Q70 N79 M81 L83 L122 M125 V127	Q70-F72 HydrophobicContact CB-CE2 4.03Å; Q70-F72 HydrophobicContact CB-CZ 4.34Å; Q70-F72 HydrophobicContact CG-CD2 4.27Å; Q70-F72 HydrophobicContact CG-CE1 4.21Å; Q70-F72 HydrophobicContact CG-CE2 3.66Å; Q70-F72 HydrophobicContact CG-CZ 3.63Å; F72-N79 PolarHBondContact O-N 3.43Å; F72-M81 PolarHBondContact N-O 3.11Å; F72-L83 HydrophobicContact CE2-CB 3.86Å; F72-L122 HydrophobicContact CD2-CD2 3.5Å; F72-L122 VanDerWaalsContact CD2-CD2 3.5Å; F72-L122 HydrophobicContact CE1-CB 4.22Å; F72-L122 WeakPolarHBondContact CE1-O 3.41Å; F72-L122 HydrophobicContact CE2-CB 4.11Å; F72-L122 HydrophobicContact CE2-CD2 3.63Å; F72-L122 HydrophobicContact CE2-CG 4.32Å; F72-L122 HydrophobicContact CG-CD2 4.03Å; F72-L122 HydrophobicContact CZ-CB 3.87Å; F72-L122 HydrophobicContact CZ-CD2 4.24Å; F72-M125 HydrophobicContact CB-CB 4.31Å; F72-M125 HydrophobicContact CB-CE 3.61Å; F72-M125 HydrophobicContact CD1-CB 3.9Å; F72-M125 HydrophobicContact CG-CB 4.44Å; F72-M125 HydrophobicContact CG-CE 4.45Å; F72-V127 HydrophobicContact CD1-CG2 4.22Å; F72-V127 HydrophobicContact CE1-CG2 3.91Å
73	K	69.4	Low	72.2	Confident	62 Å²	62	57 Å²	57	27%	0.27	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	169.2	169	-61.4	-161.7	-169.2	163.2	0	108.9	K77 E126 D128	K73-K77 WeakPolarHBondContact CA-O 3.39Å; K73-K77 WeakPolarHBondContact CB-O 3.43Å; K73-E126 PolarHBondContact N-O 2.82Å; K73-D128 HydrophobicContact CB-CB 4.11Å; K73-D128 HydrophobicContact CD-CB 3.5Å; K73-D128 VanDerWaalsContact CD-CG 3.48Å; K73-D128 WeakPolarHBondContact CD-OD1 3.23Å; K73-D128 WeakPolarHBondContact CE-OD2 3.2Å; K73-D128 HydrophobicContact CG-CB 3.62Å; K73-D128 IonicContact NZ-OD1 3.93Å; K73-D128 PolarHBondContact NZ-OD1 3.3Å; K73-D128 IonicContact NZ-OD2 2.96Å; K73-D128 PolarHBondContact NZ-OD2 3.42Å
74	K	60.4	Low	72.7	Confident	114 Å²	114	56.5 Å²	56.5	50%	0.496	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	120.5	170	178.5	169.8	-177.9	177.2	0	107.5	G76 K77 N79	K74-G76 VanDerWaalsContact C-N 3.26Å; K74-G76 PolarHBondContact O-N 3.44Å; K74-K77 PolarHBondContact N-O 3.13Å; K74-K77 PolarHBondContact O-N 3.11Å; K74-K77 VanDerWaalsContact O-N 3.08Å; K74-N79 HydrophobicContact CB-CB 4.21Å; K74-N79 VanDerWaalsContact CB-ND2 3.32Å; K74-N79 WeakPolarHBondContact CB-ND2 3.49Å
75	N	57.9	Low	73.6	Confident	126 Å²	126	57.6 Å²	57.6	67%	0.674	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	43.4	-176.2	-49.3	33	0	0	0	111.3	K77 E126	N75-K77 PolarHBondContact O-N 2.92Å; N75-E126 PolarHBondContact N-OE2 3.21Å
76	G	61.2	Low	74.8	Confident	54 Å²	54	50.5 Å²	50.5	56%	0.557	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.1	-11.6	-176.4	0	0	0	0	0	116.4	K74	K74-G76 VanDerWaalsContact C-N 3.26Å; K74-G76 PolarHBondContact O-N 3.44Å
77	K	66.9	Low	75.6	Confident	157 Å²	157	56.7 Å²	56.7	68%	0.683	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.8	136.4	179.1	-64.7	-177.1	-179.9	-178.3	0	110.8	K73 K74 N75 N79	K73-K77 WeakPolarHBondContact CA-O 3.39Å; K73-K77 WeakPolarHBondContact CB-O 3.43Å; K74-K77 PolarHBondContact N-O 3.13Å; K74-K77 PolarHBondContact O-N 3.11Å; K74-K77 VanDerWaalsContact O-N 3.08Å; N75-K77 PolarHBondContact O-N 2.92Å; K77-N79 PolarHBondContact O-N 3.4Å; K77-N79 VanDerWaalsContact O-N 3.13Å
78	P	66.4	Low	76.2	Confident	58 Å²	58	58.4 Å²	58.4	38%	0.377	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	115.6	174.8	25.6	-32.3	0	0	0	109	Y48 G80	Y48-P78 HydrophobicContact CD1-CB 4.33Å; Y48-P78 HydrophobicContact CD1-CG 3.87Å; Y48-P78 VanDerWaalsContact CD1-O 3.23Å; Y48-P78 WeakPolarHBondContact CD1-O 3.25Å; Y48-P78 WeakPolarHBondContact CE1-O 3.46Å; Y48-P78 HydrophobicContact CG-CG 4.26Å; P78-G80 PolarHBondContact O-N 3.1Å; P78-G80 VanDerWaalsContact O-N 3.09Å
79	N	70	Confident	76.5	Confident	62 Å²	62	56.1 Å²	56.1	33%	0.332	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	12	-168.3	-141.4	15.5	0	0	0	113	F72 K74 K77 M81 M125	F72-N79 PolarHBondContact O-N 3.43Å; K74-N79 HydrophobicContact CB-CB 4.21Å; K74-N79 VanDerWaalsContact CB-ND2 3.32Å; K74-N79 WeakPolarHBondContact CB-ND2 3.49Å; K77-N79 PolarHBondContact O-N 3.4Å; K77-N79 VanDerWaalsContact O-N 3.13Å; N79-M81 PolarHBondContact O-N 3.21Å; N79-M125 HydrophobicContact CB-CE 4.02Å; N79-M125 WeakPolarHBondContact ND2-CE 3.44Å
80	G	76.6	Confident	76.5	Confident	8 Å²	8	62.5 Å²	62.5	8%	0.082	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	62	20.7	-176.7	0	0	0	0	0	114.3	A44 N45 I46 P78	A44-G80 CarbonylContact C-O 3.53Å; A44-G80 WeakPolarHBondContact CA-O 3.27Å; N45-G80 PolarHBondContact N-O 3.47Å; I46-G80 PolarHBondContact N-O 3.13Å; I46-G80 VanDerWaalsContact O-CA 3.28Å; I46-G80 WeakPolarHBondContact O-CA 3.29Å; P78-G80 PolarHBondContact O-N 3.1Å; P78-G80 VanDerWaalsContact O-N 3.09Å
81	M	82.1	Confident	76.8	Confident	55 Å²	55	61 Å²	61	27%	0.271	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	144.3	-177.2	-62.3	-166	-57.2	0	0	112.3	I43 A44 F72 N79 M125	I43-M81 CarbonylContact O-C 3.6Å; I43-M81 VanDerWaalsContact O-CA 3.31Å; I43-M81 WeakPolarHBondContact O-CA 3.42Å; A44-M81 HydrophobicContact CB-CG 4.11Å; A44-M81 HydrophobicContact CB-SD 4.49Å; F72-M81 PolarHBondContact N-O 3.11Å; N79-M81 PolarHBondContact O-N 3.21Å; M81-M125 HydrophobicContact CE-CE 3.54Å; M81-M125 HydrophobicContact CE-SD 3.72Å
82	G	85	Confident	77.1	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	162.2	176.8	0	0	0	0	0	112.3	I43 Q70	I43-G82 PolarHBondContact N-O 3.04Å; I43-G82 PolarHBondContact O-N 3.14Å; Q70-G82 CarbonylContact O-C 3.6Å; Q70-G82 WeakPolarHBondContact O-CA 3.5Å
83	L	86.8	Confident	77.8	Confident	15 Å²	15	61.5 Å²	61.5	8%	0.079	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	124.1	173.5	-176.4	75.8	0	0	0	107.6	R40 I41 V42 Q70 F72 E114 L122	R40-L83 HydrophobicContact CB-CD1 4.47Å; I41-L83 CarbonylContact O-C 3.54Å; I41-L83 WeakPolarHBondContact O-CA 3.27Å; I41-L83 WeakPolarHBondContact O-CD1 3.46Å; V42-L83 HydrophobicContact CG2-CD1 3.79Å; Q70-L83 HydrophobicContact CB-CB 4.44Å; Q70-L83 PolarHBondContact N-O 2.94Å; Q70-L83 PolarHBondContact O-N 3.41Å; F72-L83 HydrophobicContact CE2-CB 3.86Å; L83-E114 HydrophobicContact CD1-CB 4.39Å; L83-E114 HydrophobicContact CD1-CG 4.29Å; L83-L122 HydrophobicContact CB-CD1 4.45Å; L83-L122 HydrophobicContact CD1-CD1 4.12Å
84	M	86.2	Confident	78.6	Confident	1 Å²	1	62.9 Å²	62.9	1%	0.005	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	131.5	175.5	-175.1	-178.2	-71.5	0	0	110.1	R40 I41 I43 F59 T66 F68 L69 F86	R40-M84 WeakPolarHBondContact CA-O 3.46Å; I41-M84 HydrophobicContact CD1-CB 4.09Å; I41-M84 HydrophobicContact CD1-SD 4.48Å; I41-M84 HydrophobicContact CG1-CB 3.77Å; I41-M84 VanDerWaalsContact CG1-O 3.29Å; I41-M84 WeakPolarHBondContact CG1-O 3.4Å; I41-M84 PolarHBondContact N-O 3.17Å; I41-M84 PolarHBondContact O-N 2.98Å; I43-M84 HydrophobicContact CD1-CB 3.8Å; I43-M84 HydrophobicContact CD1-CE 3.82Å; I43-M84 HydrophobicContact CD1-SD 4.4Å; F59-M84 HydrophobicContact CB-CE 3.78Å; F59-M84 HydrophobicContact CB-SD 4.01Å; F59-M84 HydrophobicContact CD1-CE 3.78Å; F59-M84 HydrophobicContact CD1-SD 3.46Å; F59-M84 WeakPolarHBondContact CD1-SD 3.03Å; F59-M84 HydrophobicContact CD2-CE 3.93Å; F59-M84 HydrophobicContact CE1-CE 4.32Å; F59-M84 HydrophobicContact CE1-SD 4.05Å; F59-M84 HydrophobicContact CE2-CE 4.44Å; F59-M84 HydrophobicContact CG-CE 3.56Å; F59-M84 HydrophobicContact CG-SD 3.83Å; T66-M84 HydrophobicContact CG2-SD 4.48Å; F68-M84 CarbonylContact O-C 3.57Å; F68-M84 WeakPolarHBondContact O-CA 3.45Å; L69-M84 HydrophobicContact CB-CE 4.17Å; L69-M84 HydrophobicContact CB-CG 4.49Å; L69-M84 HydrophobicContact CD1-CB 4.02Å; L69-M84 HydrophobicContact CD1-CE 3.94Å; L69-M84 HydrophobicContact CD2-CE 4Å; L69-M84 HydrophobicContact CG-CE 4.25Å; M84-F86 HydrophobicContact CG-CD2 4.44Å; M84-F86 HydrophobicContact CG-CE2 3.94Å; M84-F86 HydrophobicContact CG-CZ 4.35Å; M84-F86 HydrophobicContact SD-CE1 4.38Å; M84-F86 HydrophobicContact SD-CE2 3.67Å; M84-F86 HydrophobicContact SD-CZ 3.52Å; M84-F86 VanDerWaalsContact SD-CZ 3.52Å
85	E	85.9	Confident	79.8	Confident	54 Å²	54	57.4 Å²	57.4	25%	0.252	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	132.3	175.9	-176.4	162.8	176.5	0	0	109.9	K39 R40 G67 F68	K39-E85 WeakPolarHBondContact O-CA 3.43Å; R40-E85 HydrophobicContact CG-CB 4.09Å; R40-E85 HydrophobicContact CG-CG 3.84Å; R40-E85 IonicContact NE-OE2 3.88Å; R40-E85 PolarHBondContact NE-OE2 2.85Å; G67-E85 CarbonylContact C-O 3.57Å; G67-E85 WeakPolarHBondContact CA-O 3.46Å; G67-E85 PolarHBondContact N-O 2.84Å; F68-E85 HydrophobicContact CB-CB 4.4Å; F68-E85 PolarHBondContact N-O 2.79Å; F68-E85 VanDerWaalsContact N-O 3.12Å; F68-E85 PolarHBondContact O-N 2.87Å
86	F	85.5	Confident	81.3	Confident	4 Å²	4	52.6 Å²	52.6	2%	0.018	27%	0.272	C	S	.	.			trans	-101.4	152	177.8	-75.7	-94.6	0	0	0	112	K39 I41 F59 I63 F65 M84 T88 A92 A95	K39-F86 WeakPolarHBondContact CB-O 3.49Å; K39-F86 WeakPolarHBondContact CD-O 3.45Å; K39-F86 PolarHBondContact O-N 2.79Å; I41-F86 HydrophobicContact CD1-CE2 3.66Å; I41-F86 HydrophobicContact CD1-CZ 4.42Å; I41-F86 HydrophobicContact CG1-CD2 4.42Å; I41-F86 HydrophobicContact CG1-CE2 3.89Å; F59-F86 HydrophobicContact CD1-CZ 4.07Å; I63-F86 HydrophobicContact CD1-CE1 4.31Å; I63-F86 HydrophobicContact CD1-CZ 4.01Å; I63-F86 HydrophobicContact CG2-CE1 3.97Å; F65-F86 VanDerWaalsContact O-CD1 3.3Å; F65-F86 WeakPolarHBondContact O-CD1 3.32Å; M84-F86 HydrophobicContact CG-CD2 4.44Å; M84-F86 HydrophobicContact CG-CE2 3.94Å; M84-F86 HydrophobicContact CG-CZ 4.35Å; M84-F86 HydrophobicContact SD-CE1 4.38Å; M84-F86 HydrophobicContact SD-CE2 3.67Å; M84-F86 HydrophobicContact SD-CZ 3.52Å; M84-F86 VanDerWaalsContact SD-CZ 3.52Å; F86-T88 VanDerWaalsContact C-N 3.32Å; F86-T88 VanDerWaalsContact CB-O 3.23Å; F86-T88 WeakPolarHBondContact CB-O 3.45Å; F86-A92 HydrophobicContact CB-CB 4.2Å; F86-A92 HydrophobicContact CD2-CB 3.83Å; F86-A92 HydrophobicContact CG-CB 4.18Å; F86-A95 HydrophobicContact CE1-CB 4.41Å; F86-A95 HydrophobicContact CE2-CB 3.74Å; F86-A95 HydrophobicContact CZ-CB 3.53Å
87	K	84.2	Confident	82.4	Confident	162 Å²	162	55.7 Å²	55.7	70%	0.704	27%	0.272	S	S	*	.	S	Bend	trans	-66	-38.1	169.8	-169.4	176.4	179.7	-176.6	0	111.3	K39	K39-K87 WeakPolarHBondContact CE-O 3.06Å; K39-K87 PolarHBondContact NZ-O 3.12Å
88	T	84.5	Confident	83.2	Confident	58 Å²	58	51 Å²	51	36%	0.356	26%	0.257	S	S	.	.	S	Bend	trans	-110.4	147.9	-177.7	57.6	0	0	0	0	111.8	F86 E90 G91 A92	F86-T88 VanDerWaalsContact C-N 3.32Å; F86-T88 VanDerWaalsContact CB-O 3.23Å; F86-T88 WeakPolarHBondContact CB-O 3.45Å; T88-E90 VanDerWaalsContact C-N 3.34Å; T88-G91 PolarHBondContact OG1-N 3.25Å; T88-G91 VanDerWaalsContact OG1-N 3.1Å; T88-A92 PolarHBondContact O-N 3.45Å
89	L	84	Confident	84	Confident	78 Å²	78	48.2 Å²	48.2	41%	0.408	24%	0.239	S	C	.	.	H	α-helix	trans	-70.9	-34.7	172.8	-177.9	144.4	0	0	0	111.2	A92 Q93	L89-A92 PolarHBondContact O-N 2.78Å; L89-Q93 PolarHBondContact O-N 2.82Å
90	E	83.6	Confident	84.7	Confident	153 Å²	153	48.4 Å²	48.4	72%	0.715	24%	0.238	S	C	*	.	H	α-helix	trans	-59.3	-43	173.2	-174.1	178	-176.9	0	0	112.2	T88 A92 Q93 K94	T88-E90 VanDerWaalsContact C-N 3.34Å; E90-A92 PolarHBondContact O-N 2.89Å; E90-Q93 PolarHBondContact O-N 2.81Å; E90-K94 WeakPolarHBondContact O-CB 3.24Å; E90-K94 PolarHBondContact O-N 2.88Å
91	G	85.7	Confident	85.1	Confident	6 Å²	6	55.9 Å²	55.9	6%	0.062	26%	0.263	C	S	.	.	H	α-helix	trans	-60.4	-43.4	174	0	0	0	0	0	112.2	I63 T88 Q93 A95	I63-G91 WeakPolarHBondContact CG2-O 3.33Å; T88-G91 PolarHBondContact OG1-N 3.25Å; T88-G91 VanDerWaalsContact OG1-N 3.1Å; G91-Q93 VanDerWaalsContact C-N 3.33Å; G91-Q93 PolarHBondContact O-N 2.83Å; G91-A95 WeakPolarHBondContact O-CB 3.29Å; G91-A95 PolarHBondContact O-N 3.25Å
92	A	85.6	Confident	85.2	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-64.2	-35.4	174.9	0	0	0	0	0	113	V36 I41 F86 T88 L89 E90 I96	V36-A92 HydrophobicContact CG1-CB 4.19Å; I41-A92 HydrophobicContact CG2-CB 4.03Å; F86-A92 HydrophobicContact CB-CB 4.2Å; F86-A92 HydrophobicContact CD2-CB 3.83Å; F86-A92 HydrophobicContact CG-CB 4.18Å; T88-A92 PolarHBondContact O-N 3.45Å; L89-A92 PolarHBondContact O-N 2.78Å; E90-A92 PolarHBondContact O-N 2.89Å; A92-I96 WeakPolarHBondContact O-CG1 3.24Å; A92-I96 PolarHBondContact O-N 3.43Å; A92-I96 VanDerWaalsContact O-N 3.16Å
93	Q	86.4	Confident	85.2	Confident	64 Å²	64	62.4 Å²	62.4	30%	0.299	29%	0.292	S	S	.	.	H	α-helix	trans	-71.1	-51.5	175.7	-178	172.4	-17.8	0	0	112.1	V36 L89 E90 G91 A95 I96 E97	V36-Q93 HydrophobicContact CB-CB 4.35Å; V36-Q93 HydrophobicContact CG2-CB 3.96Å; V36-Q93 HydrophobicContact CG2-CG 4.12Å; L89-Q93 PolarHBondContact O-N 2.82Å; E90-Q93 PolarHBondContact O-N 2.81Å; G91-Q93 VanDerWaalsContact C-N 3.33Å; G91-Q93 PolarHBondContact O-N 2.83Å; Q93-A95 PolarHBondContact O-N 3.45Å; Q93-I96 PolarHBondContact O-N 2.78Å; Q93-E97 HydrophobicContact CG-CG 4.5Å; Q93-E97 VanDerWaalsContact CG-OE1 3.24Å; Q93-E97 WeakPolarHBondContact CG-OE1 3.42Å; Q93-E97 PolarHBondContact NE2-OE1 2.95Å; Q93-E97 PolarHBondContact O-N 3.01Å
94	K	85.6	Confident	84.9	Confident	91 Å²	91	62.8 Å²	62.8	40%	0.396	30%	0.295	S	S	.	.	H	α-helix	trans	-56.9	-34.9	174.1	-176.2	178	174.2	-164.8	0	111.2	Q62 I63 E90 E97 T98	Q62-K94 WeakPolarHBondContact O-CE 3.32Å; Q62-K94 PolarHBondContact O-NZ 2.81Å; I63-K94 HydrophobicContact CG1-CG 4.48Å; I63-K94 HydrophobicContact CG2-CB 4.17Å; I63-K94 HydrophobicContact CG2-CD 4.12Å; I63-K94 HydrophobicContact CG2-CG 4.2Å; I63-K94 PolarHBondContact O-NZ 3.03Å; E90-K94 WeakPolarHBondContact O-CB 3.24Å; E90-K94 PolarHBondContact O-N 2.88Å; K94-E97 PolarHBondContact O-N 3.14Å; K94-T98 VanDerWaalsContact O-CB 3.27Å; K94-T98 WeakPolarHBondContact O-CB 3.18Å; K94-T98 PolarHBondContact O-N 3Å; K94-T98 PolarHBondContact O-OG1 3.3Å; K94-T98 VanDerWaalsContact O-OG1 3.07Å
95	A	86.6	Confident	84.5	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-63.8	-43.2	172.5	0	0	0	0	0	113.5	I41 F59 I63 F86 G91 Q93 E97 M99	I41-A95 HydrophobicContact CD1-CB 4Å; F59-A95 HydrophobicContact CD1-CB 4.38Å; F59-A95 HydrophobicContact CE1-CB 4.21Å; I63-A95 HydrophobicContact CD1-CB 3.45Å; I63-A95 VanDerWaalsContact CD1-CB 3.45Å; I63-A95 HydrophobicContact CG1-CB 4.14Å; F86-A95 HydrophobicContact CE1-CB 4.41Å; F86-A95 HydrophobicContact CE2-CB 3.74Å; F86-A95 HydrophobicContact CZ-CB 3.53Å; G91-A95 WeakPolarHBondContact O-CB 3.29Å; G91-A95 PolarHBondContact O-N 3.25Å; Q93-A95 PolarHBondContact O-N 3.45Å; A95-E97 VanDerWaalsContact C-N 3.32Å; A95-M99 WeakPolarHBondContact O-CA 3.35Å; A95-M99 VanDerWaalsContact O-CB 3.25Å; A95-M99 WeakPolarHBondContact O-CB 3.45Å; A95-M99 PolarHBondContact O-N 2.8Å
96	I	87.5	Confident	84.3	Confident	24 Å²	24	71.6 Å²	71.6	12%	0.123	36%	0.359	C	S	.	.	H	α-helix	trans	-68.7	-33	176.3	-71.3	161.1	0	0	0	111.3	V36 I41 A92 Q93 H100 V111 Q113	V36-I96 HydrophobicContact CG1-CD1 4.27Å; V36-I96 HydrophobicContact CG2-CD1 3.61Å; I41-I96 HydrophobicContact CG2-CD1 3.76Å; I41-I96 HydrophobicContact CG2-CG1 3.94Å; A92-I96 WeakPolarHBondContact O-CG1 3.24Å; A92-I96 PolarHBondContact O-N 3.43Å; A92-I96 VanDerWaalsContact O-N 3.16Å; Q93-I96 PolarHBondContact O-N 2.78Å; I96-H100 WeakPolarHBondContact O-CB 3.39Å; I96-V111 HydrophobicContact CB-CG1 4.49Å; I96-V111 HydrophobicContact CG1-CG1 3.83Å; I96-Q113 HydrophobicContact CD1-CB 4.11Å
97	E	85.6	Confident	84.3	Confident	119 Å²	119	74.9 Å²	74.9	56%	0.556	37%	0.372	S	S	*	.	H	α-helix	trans	-79.8	-43.3	-179.1	-70	171.3	-172	0	0	112.6	Q93 K94 A95	Q93-E97 HydrophobicContact CG-CG 4.5Å; Q93-E97 VanDerWaalsContact CG-OE1 3.24Å; Q93-E97 WeakPolarHBondContact CG-OE1 3.42Å; Q93-E97 PolarHBondContact NE2-OE1 2.95Å; Q93-E97 PolarHBondContact O-N 3.01Å; K94-E97 PolarHBondContact O-N 3.14Å; A95-E97 VanDerWaalsContact C-N 3.32Å
98	T	84	Confident	84.5	Confident	59 Å²	59	71.8 Å²	71.8	36%	0.362	36%	0.358	S	S	.	.	H	α-helix	trans	-90.7	-40.9	-175.4	-48.6	0	0	0	0	113.5	Q62 K94	Q62-T98 HydrophobicContact CB-CG2 4.46Å; K94-T98 VanDerWaalsContact O-CB 3.27Å; K94-T98 WeakPolarHBondContact O-CB 3.18Å; K94-T98 PolarHBondContact O-N 3Å; K94-T98 PolarHBondContact O-OG1 3.3Å; K94-T98 VanDerWaalsContact O-OG1 3.07Å
99	M	82.3	Confident	84.7	Confident	0 Å²	0	69 Å²	69	0%	0	34%	0.341	C	S	.	.	S	Bend	trans	-90.2	-6.3	-175.3	-60.8	-63.2	-75.9	0	0	113.7	L58 F59 Q62 I63 A95 R101 F102 L109 V111	L58-M99 HydrophobicContact CB-CE 4.1Å; F59-M99 HydrophobicContact CD1-CG 4.04Å; F59-M99 HydrophobicContact CD2-CE 3.61Å; F59-M99 HydrophobicContact CE1-CB 3.92Å; F59-M99 HydrophobicContact CE1-CG 3.85Å; F59-M99 HydrophobicContact CE2-CB 4.45Å; F59-M99 HydrophobicContact CE2-CE 3.61Å; F59-M99 HydrophobicContact CE2-CG 4.38Å; F59-M99 HydrophobicContact CG-CE 4.2Å; F59-M99 HydrophobicContact CG-CG 4.4Å; F59-M99 HydrophobicContact CZ-CB 3.85Å; F59-M99 HydrophobicContact CZ-CE 4.19Å; F59-M99 HydrophobicContact CZ-CG 4.04Å; Q62-M99 HydrophobicContact CB-SD 3.7Å; Q62-M99 HydrophobicContact CG-SD 3.73Å; I63-M99 HydrophobicContact CD1-CG 3.72Å; I63-M99 HydrophobicContact CG1-CG 4.34Å; A95-M99 WeakPolarHBondContact O-CA 3.35Å; A95-M99 VanDerWaalsContact O-CB 3.25Å; A95-M99 WeakPolarHBondContact O-CB 3.45Å; A95-M99 PolarHBondContact O-N 2.8Å; M99-R101 PolarHBondContact O-N 3.42Å; M99-F102 HydrophobicContact CE-CB 4.45Å; M99-F102 HydrophobicContact CE-CD1 4.12Å; M99-F102 HydrophobicContact CE-CG 4.23Å; M99-F102 PolarHBondContact O-N 3.29Å; M99-F102 HydrophobicContact SD-CB 4.41Å; M99-F102 HydrophobicContact SD-CD2 4.27Å; M99-F102 HydrophobicContact SD-CG 4.16Å; M99-L109 HydrophobicContact CE-CD1 4.22Å; M99-V111 HydrophobicContact CB-CG2 3.78Å
100	H	85.2	Confident	84.9	Confident	65 Å²	65	66.8 Å²	66.8	30%	0.301	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	117.2	173.9	-176.5	88.6	0	0	0	111	I96 F102 V111	I96-H100 WeakPolarHBondContact O-CB 3.39Å; H100-F102 VanDerWaalsContact C-N 3.34Å; H100-V111 HydrophobicContact CB-CB 4.46Å; H100-V111 PolarHBondContact ND1-O 3.37Å
101	R	85.6	Confident	85.1	Confident	166 Å²	166	59.6 Å²	59.6	63%	0.626	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	73	15.1	-173.3	-57.7	159.1	172.8	-92.1	-2	115.4	M99 E103 K108 L109	M99-R101 PolarHBondContact O-N 3.42Å; R101-E103 PolarHBondContact O-N 3.16Å; R101-K108 HydrophobicContact CB-CD 4.48Å; R101-L109 VanDerWaalsContact CA-O 3.26Å; R101-L109 WeakPolarHBondContact CA-O 3.46Å; R101-L109 PolarHBondContact N-O 2.79Å
102	F	84.3	Confident	85.1	Confident	65 Å²	65	66.5 Å²	66.5	29%	0.285	32%	0.322	S	S	.	.			trans	-58.5	127.9	170.8	-163.2	-95.7	0	0	0	110	L58 M99 H100 V104 K108 L109	L58-F102 HydrophobicContact CD2-CE1 4.38Å; M99-F102 HydrophobicContact CE-CB 4.45Å; M99-F102 HydrophobicContact CE-CD1 4.12Å; M99-F102 HydrophobicContact CE-CG 4.23Å; M99-F102 PolarHBondContact O-N 3.29Å; M99-F102 HydrophobicContact SD-CB 4.41Å; M99-F102 HydrophobicContact SD-CD2 4.27Å; M99-F102 HydrophobicContact SD-CG 4.16Å; H100-F102 VanDerWaalsContact C-N 3.34Å; F102-V104 HydrophobicContact CD1-CG2 3.57Å; F102-V104 HydrophobicContact CE1-CG2 4.01Å; F102-K108 CarbonylContact O-C 3.37Å; F102-K108 WeakPolarHBondContact O-CA 3.15Å; F102-L109 PolarHBondContact O-N 3.1Å
103	E	84.9	Confident	85	Confident	126 Å²	126	68.3 Å²	68.3	59%	0.589	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.1	120.6	-178.3	-78.6	171.3	-170.9	0	0	109.5	R101 K108	R101-E103 PolarHBondContact O-N 3.16Å; E103-K108 HydrophobicContact CG-CD 4.1Å; E103-K108 HydrophobicContact CG-CG 3.88Å; E103-K108 WeakPolarHBondContact OE1-CE 3.34Å; E103-K108 IonicContact OE1-NZ 2.67Å; E103-K108 PolarHBondContact OE1-NZ 3.35Å
104	V	79.7	Confident	84.7	Confident	23 Å²	23	67 Å²	67	14%	0.139	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	112.7	173.1	-161.2	0	0	0	0	108.9	L50 L58 F102 R107 L109	L50-V104 HydrophobicContact CD1-CB 3.88Å; L50-V104 HydrophobicContact CD1-CG1 3.49Å; L50-V104 VanDerWaalsContact CD1-CG1 3.49Å; L50-V104 HydrophobicContact CD1-CG2 4.4Å; L50-V104 HydrophobicContact CD2-CG1 3.95Å; L50-V104 HydrophobicContact CG-CG1 4.11Å; L58-V104 HydrophobicContact CD1-CG1 3.94Å; L58-V104 HydrophobicContact CD1-CG2 4Å; F102-V104 HydrophobicContact CD1-CG2 3.57Å; F102-V104 HydrophobicContact CE1-CG2 4.01Å; V104-R107 PolarHBondContact N-O 3.37Å; V104-R107 PolarHBondContact O-N 3.15Å; V104-L109 HydrophobicContact CG2-CD1 3.75Å; V104-L109 HydrophobicContact CG2-CG 3.97Å
105	G	77.9	Confident	84.3	Confident	65 Å²	65	66.2 Å²	66.2	67%	0.67	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	-143.6	-161.8	0	0	0	0	0	110.6	R107	G105-R107 PolarHBondContact O-N 3.28Å; G105-R107 VanDerWaalsContact O-N 3.12Å
106	D	82.3	Confident	83.4	Confident	175 Å²	175	70.3 Å²	70.3	94%	0.936	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	9.5	-176.8	-47.4	-72.8	0	0	0	114.4
107	R	85.9	Confident	82.4	Confident	73 Å²	73	78.7 Å²	78.7	28%	0.275	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	136.7	-169.6	-62.6	178.8	79.3	160	1.5	112.1	N45 P47 V104 G105	N45-R107 VanDerWaalsContact OD1-CZ 3.32Å; N45-R107 PolarHBondContact OD1-NE 2.88Å; N45-R107 PolarHBondContact OD1-NH2 3.43Å; P47-R107 HydrophobicContact CB-CB 4.39Å; V104-R107 PolarHBondContact N-O 3.37Å; V104-R107 PolarHBondContact O-N 3.15Å; G105-R107 PolarHBondContact O-N 3.28Å; G105-R107 VanDerWaalsContact O-N 3.12Å
108	K	87.8	Confident	81.5	Confident	97 Å²	97	75.1 Å²	75.1	42%	0.422	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	121.3	175.3	-52.7	-160.7	-179.8	-151.5	0	110.2	N45 R101 F102 E103	N45-K108 PolarHBondContact ND2-O 2.88Å; R101-K108 HydrophobicContact CB-CD 4.48Å; F102-K108 CarbonylContact O-C 3.37Å; F102-K108 WeakPolarHBondContact O-CA 3.15Å; E103-K108 HydrophobicContact CG-CD 4.1Å; E103-K108 HydrophobicContact CG-CG 3.88Å; E103-K108 WeakPolarHBondContact OE1-CE 3.34Å; E103-K108 IonicContact OE1-NZ 2.67Å; E103-K108 PolarHBondContact OE1-NZ 3.35Å
109	L	88.1	Confident	80.7	Confident	0 Å²	0	73.8 Å²	73.8	0%	0	37%	0.37	C	S	.	.			trans	-62.2	136.5	176.4	-65	-179.1	0	0	0	110.7	I43 I46 L55 F59 M99 R101 F102 V104	I43-L109 HydrophobicContact CG2-CD2 4.46Å; I46-L109 HydrophobicContact CB-CD2 4.33Å; I46-L109 HydrophobicContact CG1-CD2 4.09Å; I46-L109 HydrophobicContact CG2-CD2 4.5Å; L55-L109 HydrophobicContact CD1-CD1 3.93Å; L55-L109 HydrophobicContact CD1-CD2 4.33Å; F59-L109 HydrophobicContact CE2-CD1 4.24Å; M99-L109 HydrophobicContact CE-CD1 4.22Å; R101-L109 VanDerWaalsContact CA-O 3.26Å; R101-L109 WeakPolarHBondContact CA-O 3.46Å; R101-L109 PolarHBondContact N-O 2.79Å; F102-L109 PolarHBondContact O-N 3.1Å; V104-L109 HydrophobicContact CG2-CD1 3.75Å; V104-L109 HydrophobicContact CG2-CG 3.97Å
110	V	87.9	Confident	79.9	Confident	32 Å²	32	76.9 Å²	76.9	19%	0.194	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	89.2	178.2	-179.4	0	0	0	0	108.6	A44 N45 R112	A44-V110 HydrophobicContact CB-CB 4.28Å; A44-V110 PolarHBondContact N-O 2.96Å; A44-V110 PolarHBondContact O-N 2.76Å; N45-V110 HydrophobicContact CB-CG2 4.02Å; V110-R112 HydrophobicContact CG1-CG 4.19Å
111	V	88.2	Confident	78.9	Confident	1 Å²	1	80.7 Å²	80.7	1%	0.006	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	133	174.4	-176.1	0	0	0	0	110.3	I41 V42 I43 F59 I96 M99 H100	I41-V111 HydrophobicContact CB-CG1 4.32Å; I41-V111 HydrophobicContact CD1-CG1 3.54Å; I41-V111 HydrophobicContact CG1-CG1 4.49Å; V42-V111 WeakPolarHBondContact O-CA 3.42Å; I43-V111 HydrophobicContact CG1-CG2 4.37Å; I43-V111 HydrophobicContact CG2-CG2 4.33Å; F59-V111 HydrophobicContact CE1-CG2 4.23Å; F59-V111 HydrophobicContact CZ-CG2 3.72Å; I96-V111 HydrophobicContact CB-CG1 4.49Å; I96-V111 HydrophobicContact CG1-CG1 3.83Å; M99-V111 HydrophobicContact CB-CG2 3.78Å; H100-V111 HydrophobicContact CB-CB 4.46Å; H100-V111 PolarHBondContact ND1-O 3.37Å
112	R	85.2	Confident	78	Confident	152 Å²	152	73.2 Å²	73.2	57%	0.574	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.7	160.3	179.3	-64.6	-176.2	179.5	162.9	3.9	110.6	I41 V42 V110	I41-R112 CarbonylContact C-O 3.57Å; I41-R112 VanDerWaalsContact CA-O 3.27Å; I41-R112 WeakPolarHBondContact CA-O 3.06Å; I41-R112 WeakPolarHBondContact CB-O 3.38Å; V42-R112 PolarHBondContact N-O 3.47Å; V42-R112 PolarHBondContact O-N 2.97Å; V110-R112 HydrophobicContact CG1-CG 4.19Å
113	Q	85	Confident	76.9	Confident	37 Å²	37	74.4 Å²	74.4	17%	0.173	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	143.8	167.1	-172.6	-175.4	-10.8	0	0	110.7	R37 S38 I96 T115	R37-Q113 VanDerWaalsContact N-NE2 3.11Å; S38-Q113 PolarHBondContact OG-NE2 3.25Å; I96-Q113 HydrophobicContact CD1-CB 4.11Å; Q113-T115 PolarHBondContact O-N 2.84Å
114	E	80	Confident	75.6	Confident	37 Å²	37	73 Å²	73	17%	0.173	41%	0.407	C	S	.	.			trans	-55.1	121.8	169.3	-174.9	175.8	-150.9	0	0	111.3	R40 V42 L83 A119	R40-E114 HydrophobicContact CB-CB 4.32Å; R40-E114 WeakPolarHBondContact CB-OE2 3.19Å; R40-E114 WeakPolarHBondContact CD-OE2 3.3Å; R40-E114 IonicContact CZ-OE2 3.58Å; R40-E114 IonicContact NE-OE2 3.84Å; R40-E114 IonicContact NH1-OE1 2.86Å; R40-E114 PolarHBondContact NH1-OE1 3.13Å; R40-E114 VanDerWaalsContact NH1-OE1 3.09Å; R40-E114 IonicContact NH1-OE2 3.79Å; R40-E114 PolarHBondContact NH1-OE2 2.99Å; R40-E114 PolarHBondContact O-N 2.88Å; V42-E114 HydrophobicContact CG2-CB 4.2Å; V42-E114 HydrophobicContact CG2-CG 4.41Å; L83-E114 HydrophobicContact CD1-CB 4.39Å; L83-E114 HydrophobicContact CD1-CG 4.29Å; E114-A119 HydrophobicContact CG-CB 4.3Å
115	T	76	Confident	74.5	Confident	75 Å²	75	73.4 Å²	73.4	46%	0.46	41%	0.407	S	S	.	.			trans	-107.9	146.3	173.2	-60.1	0	0	0	0	108.7	Q113 R117 D118 A119	Q113-T115 PolarHBondContact O-N 2.84Å; T115-R117 PolarHBondContact O-N 3.39Å; T115-D118 WeakPolarHBondContact O-CA 3.33Å; T115-D118 PolarHBondContact O-N 2.92Å; T115-A119 PolarHBondContact O-N 2.95Å
116	A	67.9	Low	73.3	Confident	86 Å²	86	76.3 Å²	76.3	71%	0.711	40%	0.403	S	S	*	.	H	α-helix	trans	-53.2	-31.3	-178.4	0	0	0	0	0	114.6	D118 A120	A116-D118 VanDerWaalsContact C-N 3.35Å; A116-A120 PolarHBondContact O-N 3.02Å; A116-A120 VanDerWaalsContact O-N 3.14Å
117	R	66.6	Low	72.1	Confident	200 Å²	200	70.7 Å²	70.7	76%	0.755	38%	0.375	S	S	*	.	H	α-helix	trans	-67.7	-32.5	173.7	-70.2	-176.8	178.1	173.1	-0.8	113.6	T115 R121	T115-R117 PolarHBondContact O-N 3.39Å; R117-R121 WeakPolarHBondContact O-CG 3.36Å; R117-R121 PolarHBondContact O-N 3.49Å
118	D	67.1	Low	70.2	Confident	44 Å²	44	71.6 Å²	71.6	24%	0.235	39%	0.385	C	S	.	.	H	α-helix	trans	-85	-35.6	179	-59.6	-49.4	0	0	0	110	V42 T115 A116 A120 R121 L122	V42-D118 HydrophobicContact CG2-CB 4.44Å; T115-D118 WeakPolarHBondContact O-CA 3.33Å; T115-D118 PolarHBondContact O-N 2.92Å; A116-D118 VanDerWaalsContact C-N 3.35Å; D118-A120 VanDerWaalsContact C-N 3.32Å; D118-A120 PolarHBondContact O-N 3.32Å; D118-R121 PolarHBondContact O-N 3.34Å; D118-R121 VanDerWaalsContact O-N 3.07Å; D118-R121 IonicContact OD1-NH1 3.46Å; D118-R121 PolarHBondContact OD1-NH1 2.8Å; D118-L122 WeakPolarHBondContact O-CB 3.48Å; D118-L122 WeakPolarHBondContact O-CD1 3.19Å; D118-L122 WeakPolarHBondContact O-CG 3.39Å; D118-L122 PolarHBondContact O-N 2.85Å
119	A	67.9	Low	67.9	Low	31 Å²	31	69.4 Å²	69.4	26%	0.256	39%	0.39	S	S	.	.	H	α-helix	trans	-53.6	-46.6	168	0	0	0	0	0	112.1	E114 T115 R121 L122 A123	E114-A119 HydrophobicContact CG-CB 4.3Å; T115-A119 PolarHBondContact O-N 2.95Å; A119-R121 VanDerWaalsContact C-N 3.32Å; A119-R121 PolarHBondContact O-N 3.14Å; A119-L122 PolarHBondContact O-N 3.18Å; A119-A123 VanDerWaalsContact O-CB 3.26Å; A119-A123 WeakPolarHBondContact O-CB 3.48Å; A119-A123 PolarHBondContact O-N 2.96Å
120	A	65.4	Low	65.2	Low	65 Å²	65	73.2 Å²	73.2	54%	0.537	43%	0.43	S	S	.	.	H	α-helix	trans	-64.4	-31.1	176.3	0	0	0	0	0	114.1	A116 D118 S124	A116-A120 PolarHBondContact O-N 3.02Å; A116-A120 VanDerWaalsContact O-N 3.14Å; D118-A120 VanDerWaalsContact C-N 3.32Å; D118-A120 PolarHBondContact O-N 3.32Å; A120-S124 PolarHBondContact O-OG 2.86Å
121	R	63.5	Low	62.7	Low	144 Å²	144	79 Å²	79	54%	0.543	46%	0.459	S	S	.	.	H	α-helix	trans	-74.4	-42.7	173.7	-74.1	176.6	179.7	138.3	-4.6	112.1	R117 D118 A119 S124 M125	R117-R121 WeakPolarHBondContact O-CG 3.36Å; R117-R121 PolarHBondContact O-N 3.49Å; D118-R121 PolarHBondContact O-N 3.34Å; D118-R121 VanDerWaalsContact O-N 3.07Å; D118-R121 IonicContact OD1-NH1 3.46Å; D118-R121 PolarHBondContact OD1-NH1 2.8Å; A119-R121 VanDerWaalsContact C-N 3.32Å; A119-R121 PolarHBondContact O-N 3.14Å; R121-S124 PolarHBondContact O-N 3.09Å; R121-S124 PolarHBondContact O-OG 2.79Å; R121-S124 VanDerWaalsContact O-OG 3.09Å; R121-M125 WeakPolarHBondContact O-CG 3.35Å; R121-M125 PolarHBondContact O-N 2.8Å
122	L	66.3	Low	60.3	Low	9 Å²	9	85 Å²	85	5%	0.047	49%	0.49	C	S	.	.	H	α-helix	trans	-68.4	-37.5	-179.6	-63.9	163.8	0	0	0	110.5	V42 F72 L83 D118 A119 S124 M125	V42-L122 HydrophobicContact CG1-CD1 4.4Å; V42-L122 HydrophobicContact CG2-CD1 3.78Å; F72-L122 HydrophobicContact CD2-CD2 3.5Å; F72-L122 VanDerWaalsContact CD2-CD2 3.5Å; F72-L122 HydrophobicContact CE1-CB 4.22Å; F72-L122 WeakPolarHBondContact CE1-O 3.41Å; F72-L122 HydrophobicContact CE2-CB 4.11Å; F72-L122 HydrophobicContact CE2-CD2 3.63Å; F72-L122 HydrophobicContact CE2-CG 4.32Å; F72-L122 HydrophobicContact CG-CD2 4.03Å; F72-L122 HydrophobicContact CZ-CB 3.87Å; F72-L122 HydrophobicContact CZ-CD2 4.24Å; L83-L122 HydrophobicContact CB-CD1 4.45Å; L83-L122 HydrophobicContact CD1-CD1 4.12Å; D118-L122 WeakPolarHBondContact O-CB 3.48Å; D118-L122 WeakPolarHBondContact O-CD1 3.19Å; D118-L122 WeakPolarHBondContact O-CG 3.39Å; D118-L122 PolarHBondContact O-N 2.85Å; A119-L122 PolarHBondContact O-N 3.18Å; L122-S124 PolarHBondContact O-N 3.22Å; L122-M125 PolarHBondContact O-N 2.96Å
123	A	60.9	Low	57.8	Low	91 Å²	91	83.8 Å²	83.8	75%	0.752	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-14.7	173.8	0	0	0	0	0	114.5	A119	A119-A123 VanDerWaalsContact O-CB 3.26Å; A119-A123 WeakPolarHBondContact O-CB 3.48Å; A119-A123 PolarHBondContact O-N 2.96Å
124	S	57.8	Low	55.3	Low	97 Å²	97	88.6 Å²	88.6	68%	0.678	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	16	176.4	48.1	0	0	0	0	113.1	A120 R121 L122	A120-S124 PolarHBondContact O-OG 2.86Å; R121-S124 PolarHBondContact O-N 3.09Å; R121-S124 PolarHBondContact O-OG 2.79Å; R121-S124 VanDerWaalsContact O-OG 3.09Å; L122-S124 PolarHBondContact O-N 3.22Å
125	M	56.2	Low	53.4	Low	31 Å²	31	92.2 Å²	92.2	15%	0.153	56%	0.561	C	S	.	*	S	Bend	trans	-116.5	134.7	-179.6	-75.9	172.6	52.6	0	0	111.2	F72 N79 M81 R121 L122 V127	F72-M125 HydrophobicContact CB-CB 4.31Å; F72-M125 HydrophobicContact CB-CE 3.61Å; F72-M125 HydrophobicContact CD1-CB 3.9Å; F72-M125 HydrophobicContact CG-CB 4.44Å; F72-M125 HydrophobicContact CG-CE 4.45Å; N79-M125 HydrophobicContact CB-CE 4.02Å; N79-M125 WeakPolarHBondContact ND2-CE 3.44Å; M81-M125 HydrophobicContact CE-CE 3.54Å; M81-M125 HydrophobicContact CE-SD 3.72Å; R121-M125 WeakPolarHBondContact O-CG 3.35Å; R121-M125 PolarHBondContact O-N 2.8Å; L122-M125 PolarHBondContact O-N 2.96Å; M125-V127 PolarHBondContact O-N 2.93Å
126	E	54.5	Low	51.4	Low	126 Å²	126	94.4 Å²	94.4	59%	0.589	57%	0.574	S	S	*	*			trans	-61.6	128.6	-177.3	-64.1	169.7	131.8	0	0	111.6	K73 N75	K73-E126 PolarHBondContact N-O 2.82Å; N75-E126 PolarHBondContact N-OE2 3.21Å
127	V	55.2	Low	50.2	Low	56 Å²	56	97.5 Å²	97.5	34%	0.339	58%	0.579	S	S	.	*	B	Isolated β-bridge	trans	-85.9	118.6	175.7	168.7	0	0	0	0	108.8	F72 M125 G129	F72-V127 HydrophobicContact CD1-CG2 4.22Å; F72-V127 HydrophobicContact CE1-CG2 3.91Å; M125-V127 PolarHBondContact O-N 2.93Å; V127-G129 PolarHBondContact O-N 3.32Å
128	D	46	Very low	48.8	Very low	93 Å²	93	93.2 Å²	93.2	50%	0.497	58%	0.577	S	S	.	*	S	Bend	trans	-87.4	101.9	173.2	-171.6	98	0	0	0	109.1	K73	K73-D128 HydrophobicContact CB-CB 4.11Å; K73-D128 HydrophobicContact CD-CB 3.5Å; K73-D128 VanDerWaalsContact CD-CG 3.48Å; K73-D128 WeakPolarHBondContact CD-OD1 3.23Å; K73-D128 WeakPolarHBondContact CE-OD2 3.2Å; K73-D128 HydrophobicContact CG-CB 3.62Å; K73-D128 IonicContact NZ-OD1 3.93Å; K73-D128 PolarHBondContact NZ-OD1 3.3Å; K73-D128 IonicContact NZ-OD2 2.96Å; K73-D128 PolarHBondContact NZ-OD2 3.42Å
129	G	40.6	Very low	47.1	Very low	51 Å²	51	98.7 Å²	98.7	53%	0.526	61%	0.607	S	S	.	*	S	Bend	trans	140	109.1	-167.7	0	0	0	0	0	108.3	V127	V127-G129 PolarHBondContact O-N 3.32Å
130	G	31.9	Very low	45.8	Very low	80 Å²	80	104 Å²	104	83%	0.825	63%	0.626	S	S	*	*	S	Bend	trans	-59.4	144.9	-169.6	0	0	0	0	0	113.6
131	L	35.3	Very low	44.2	Very low	154 Å²	154	105.7 Å²	105.7	81%	0.806	63%	0.634	S	S	*	*	S	Bend	trans	66.3	96.2	176.1	-157.5	84.1	0	0	0	114.7
132	L	37.8	Very low	43.3	Very low	126 Å²	126	102 Å²	102	66%	0.66	63%	0.628	S	S	*	*			trans	177	84.2	142.4	-83.1	-149.4	0	0	0	109.7
133	S	32.6	Very low	42.2	Very low	126 Å²	126	108.9 Å²	108.9	88%	0.881	66%	0.664	S	S	*	*			trans	-139	76.4	169.3	69.7	0	0	0	0	112.5
134	D	32.3	Very low	40.8	Very low	139 Å²	139	112 Å²	112	74%	0.743	67%	0.665	S	S	*	*				-162.4	128.5	123.9	-169.6	7.4	0	0	0	108.2
135	S	39.5	Very low	39.8	Very low	113 Å²	113	112 Å²	112	79%	0.79	67%	0.67	S	S	*	*			trans	-163.2	69.8	179.2	-78.8	0	0	0	0	110
136	T	34	Very low	39	Very low	120 Å²	120	115.2 Å²	115.2	74%	0.736	70%	0.703	S	S	*	*			trans	-93.4	68.6	156.3	42.2	0	0	0	0	110.8
137	N	43.8	Very low	38.3	Very low	152 Å²	152	114.3 Å²	114.3	81%	0.813	71%	0.705	S	S	*	*	S	Bend	trans	-174.3	140.7	145.2	-92.4	-39	0	0	0	111.2
138	P	35.4	Very low	37.8	Very low	110 Å²	110	114 Å²	114	71%	0.714	71%	0.713	S	S	*	*			trans	-101.4	96.7	-171.9	36.3	-30.6	0	0	0	113.1
139	N	32.4	Very low	37.8	Very low	159 Å²	159	113.4 Å²	113.4	85%	0.85	72%	0.715	S	S	*	*			trans	-168.5	150.4	154.5	-94.6	-31.8	0	0	0	110.2
140	E	39.9	Very low	38	Very low	141 Å²	141	114 Å²	114	66%	0.659	71%	0.708	S	S	*	*			trans	67.2	90.8	172.8	-55.5	-166.7	94.3	0	0	118.4	N251	E140-N251 PolarHBondContact OE2-ND2 2.84Å
141	S	33.3	Very low	39	Very low	101 Å²	101	111.8 Å²	111.8	71%	0.706	68%	0.676	S	S	*	*			trans	-113.1	96.3	161.3	49	0	0	0	0	110.6
142	V	44.8	Very low	39.8	Very low	68 Å²	68	106.6 Å²	106.6	41%	0.412	65%	0.651	S	S	.	*			trans	-123.6	117.5	179.6	-85.3	0	0	0	0	112.8	M144 Y254	V142-M144 PolarHBondContact O-N 3.38Å; V142-Y254 HydrophobicContact CG2-CE1 4.05Å; V142-Y254 HydrophobicContact CG2-CE2 4.11Å; V142-Y254 PolarHBondContact O-OH 3.07Å
143	N	41.6	Very low	40.5	Very low	152 Å²	152	105.9 Å²	105.9	81%	0.813	65%	0.654	S	S	*	*			trans	42.2	68.8	148.3	-59.7	-14.5	0	0	0	119.6	A145	N143-A145 PolarHBondContact O-N 2.81Å
144	M	33	Very low	41.4	Very low	157 Å²	157	106.6 Å²	106.6	77%	0.773	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	90.1	153.2	-75.1	-170.6	179.2	0	0	110.9	V142	V142-M144 PolarHBondContact O-N 3.38Å
145	A	36.3	Very low	42.4	Very low	96 Å²	96	103.4 Å²	103.4	79%	0.793	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-158.7	0.2	166	0	0	0	0	0	115	N143	N143-A145 PolarHBondContact O-N 2.81Å
146	A	39.9	Very low	43.2	Very low	100 Å²	100	99.5 Å²	99.5	83%	0.826	60%	0.595	S	S	*	*	S	Bend	trans	-132.2	37.3	-176.8	0	0	0	0	0	111.5	G148	A146-G148 PolarHBondContact O-N 3.37Å; A146-G148 VanDerWaalsContact O-N 3.1Å
147	T	39.6	Very low	44.3	Very low	106 Å²	106	96.3 Å²	96.3	65%	0.65	59%	0.586	S	S	*	*			trans	-72.3	99.2	-171.1	36.6	0	0	0	0	112.8	V150	T147-V150 HydrophobicContact CG2-CG2 4.25Å
148	G	44.2	Very low	44.8	Very low	49 Å²	49	97.3 Å²	97.3	51%	0.505	59%	0.585	S	S	.	*			trans	-62.2	171.1	146.4	0	0	0	0	0	111.2	A146 V150	A146-G148 PolarHBondContact O-N 3.37Å; A146-G148 VanDerWaalsContact O-N 3.1Å; G148-V150 PolarHBondContact O-N 3.2Å
149	P	46.8	Very low	45.8	Very low	82 Å²	82	94.1 Å²	94.1	53%	0.532	56%	0.564	S	S	.	*			trans	-63.8	114.2	-166.6	20.7	-28	0	0	0	112.4	F151 Y218	P149-F151 PolarHBondContact O-N 2.88Å; P149-Y218 WeakPolarHBondContact CG-OH 3.2Å; P149-Y218 WeakPolarHBondContact O-CE2 3.18Å
150	V	43.9	Very low	47	Very low	64 Å²	64	89.3 Å²	89.3	39%	0.388	55%	0.552	S	S	.	*			trans	-77.4	105.6	178.4	164.5	0	0	0	0	109.1	T147 G148 T152 M155 L253	T147-V150 HydrophobicContact CG2-CG2 4.25Å; G148-V150 PolarHBondContact O-N 3.2Å; V150-T152 HydrophobicContact CG1-CG2 4.43Å; V150-T152 PolarHBondContact O-N 2.9Å; V150-T152 VanDerWaalsContact O-N 3.13Å; V150-M155 VanDerWaalsContact O-SD 3.36Å; V150-L253 HydrophobicContact CG1-CD1 4.09Å; V150-L253 HydrophobicContact CG1-CD2 3.84Å; V150-L253 HydrophobicContact CG1-CG 4.48Å; V150-L253 HydrophobicContact CG2-CD2 4.24Å
151	F	52.5	Low	47.9	Very low	32 Å²	32	83.7 Å²	83.7	14%	0.14	53%	0.526	C	S	.	.			trans	-71.9	103.2	171.9	-69	-72.1	0	0	0	110.1	P149 M155 Y218 V221	P149-F151 PolarHBondContact O-N 2.88Å; F151-M155 HydrophobicContact CD1-CB 4.21Å; F151-M155 HydrophobicContact CD1-CE 3.78Å; F151-M155 HydrophobicContact CD1-SD 4.29Å; F151-M155 HydrophobicContact CE1-CE 4.01Å; F151-Y218 AromaticContact CD2-CD2 3.89Å; F151-Y218 HydrophobicContact CD2-CD2 3.89Å; F151-Y218 AromaticContact CD2-CE2 3.57Å; F151-Y218 HydrophobicContact CD2-CE2 3.57Å; F151-Y218 HydrophobicContact CE2-CD2 4.11Å; F151-Y218 AromaticContact CE2-CE2 3.55Å; F151-Y218 HydrophobicContact CE2-CE2 3.55Å; F151-Y218 AromaticContact CE2-CZ 3.97Å; F151-V221 HydrophobicContact CD1-CG1 4.06Å; F151-V221 HydrophobicContact CD2-CG1 3.94Å; F151-V221 HydrophobicContact CE1-CG1 4.16Å; F151-V221 HydrophobicContact CE2-CG1 4.04Å; F151-V221 HydrophobicContact CG-CG1 3.96Å; F151-V221 HydrophobicContact CZ-CG1 4.15Å
152	T	52	Low	48.8	Very low	46 Å²	46	85.1 Å²	85.1	28%	0.282	53%	0.526	S	S	.	.			trans	-73	162.1	171.3	72.2	0	0	0	0	110.9	V150 Q154 M155 L156	V150-T152 HydrophobicContact CG1-CG2 4.43Å; V150-T152 PolarHBondContact O-N 2.9Å; V150-T152 VanDerWaalsContact O-N 3.13Å; T152-Q154 PolarHBondContact O-N 3.43Å; T152-Q154 VanDerWaalsContact O-N 3.14Å; T152-Q154 PolarHBondContact OG1-N 2.81Å; T152-Q154 PolarHBondContact OG1-OE1 2.97Å; T152-M155 WeakPolarHBondContact O-CB 3.36Å; T152-M155 PolarHBondContact O-N 3.43Å; T152-M155 PolarHBondContact OG1-N 2.99Å; T152-L156 PolarHBondContact O-N 2.73Å
153	P	53	Low	49.4	Very low	110 Å²	110	83.8 Å²	83.8	71%	0.714	53%	0.526	S	S	*	.	H	α-helix	trans	-55.2	-28.8	170.6	-26.2	35.8	0	0	0	113.2	L156 G157	P153-L156 WeakPolarHBondContact O-CB 3.43Å; P153-L156 PolarHBondContact O-N 2.76Å; P153-G157 PolarHBondContact O-N 3.06Å; P153-G157 VanDerWaalsContact O-N 3.09Å
154	Q	52	Low	50.5	Low	141 Å²	141	81.2 Å²	81.2	66%	0.659	52%	0.517	S	S	*	.	H	α-helix	trans	-68.6	-39.3	173.7	-58.3	100.9	-10.7	0	0	112.5	T152 L156 G157 Q158	T152-Q154 PolarHBondContact O-N 3.43Å; T152-Q154 VanDerWaalsContact O-N 3.14Å; T152-Q154 PolarHBondContact OG1-N 2.81Å; T152-Q154 PolarHBondContact OG1-OE1 2.97Å; Q154-L156 VanDerWaalsContact C-N 3.31Å; Q154-G157 PolarHBondContact O-N 2.87Å; Q154-Q158 PolarHBondContact O-N 3.41Å
155	M	52.3	Low	52.3	Low	72 Å²	72	74 Å²	74	36%	0.355	48%	0.482	S	S	.	.	H	α-helix	trans	-65.9	-36.3	173	-64.8	179.2	74.2	0	0	111.4	V150 F151 T152 G157 Q158 V159	V150-M155 VanDerWaalsContact O-SD 3.36Å; F151-M155 HydrophobicContact CD1-CB 4.21Å; F151-M155 HydrophobicContact CD1-CE 3.78Å; F151-M155 HydrophobicContact CD1-SD 4.29Å; F151-M155 HydrophobicContact CE1-CE 4.01Å; T152-M155 WeakPolarHBondContact O-CB 3.36Å; T152-M155 PolarHBondContact O-N 3.43Å; T152-M155 PolarHBondContact OG1-N 2.99Å; M155-G157 VanDerWaalsContact C-N 3.31Å; M155-G157 PolarHBondContact O-N 3.42Å; M155-Q158 PolarHBondContact O-N 2.93Å; M155-V159 WeakPolarHBondContact O-CG2 3.36Å; M155-V159 PolarHBondContact O-N 2.82Å
156	L	56	Low	54.5	Low	31 Å²	31	69.6 Å²	69.6	16%	0.162	45%	0.445	C	S	.	.	H	α-helix	trans	-60.9	-40.3	175.5	-137.4	76.9	0	0	0	112.1	T152 P153 Q154 V159 G160 I161 V165 V221	T152-L156 PolarHBondContact O-N 2.73Å; P153-L156 WeakPolarHBondContact O-CB 3.43Å; P153-L156 PolarHBondContact O-N 2.76Å; Q154-L156 VanDerWaalsContact C-N 3.31Å; L156-V159 PolarHBondContact O-N 2.71Å; L156-G160 PolarHBondContact O-N 3.43Å; L156-I161 HydrophobicContact CD1-CD1 4.19Å; L156-I161 HydrophobicContact CD2-CG2 4.22Å; L156-I161 HydrophobicContact CG-CB 4.05Å; L156-I161 HydrophobicContact CG-CD1 4.21Å; L156-I161 HydrophobicContact CG-CG2 4.2Å; L156-I161 PolarHBondContact O-N 3.12Å; L156-V165 HydrophobicContact CD1-CG2 3.92Å; L156-V165 HydrophobicContact CD2-CG2 3.6Å; L156-V165 HydrophobicContact CG-CG2 4.3Å; L156-V221 HydrophobicContact CD1-CG1 4.2Å; L156-V221 HydrophobicContact CD1-CG2 4.12Å
157	G	58	Low	56.7	Low	53 Å²	53	65.9 Å²	65.9	55%	0.546	41%	0.412	S	S	.	.	H	α-helix	trans	-64.5	-38.6	173.1	0	0	0	0	0	113.6	P153 Q154 M155 V159 G160	P153-G157 PolarHBondContact O-N 3.06Å; P153-G157 VanDerWaalsContact O-N 3.09Å; Q154-G157 PolarHBondContact O-N 2.87Å; M155-G157 VanDerWaalsContact C-N 3.31Å; M155-G157 PolarHBondContact O-N 3.42Å; G157-V159 PolarHBondContact O-N 2.88Å; G157-G160 PolarHBondContact O-N 3.33Å
158	Q	53.3	Low	59	Low	173 Å²	173	61.2 Å²	61.2	81%	0.808	38%	0.383	S	S	*	.	H	α-helix	trans	-66	-25.6	175.8	-70.9	-175.3	-1	0	0	113.4	Q154 M155 G160	Q154-Q158 PolarHBondContact O-N 3.41Å; M155-Q158 PolarHBondContact O-N 2.93Å; Q158-G160 VanDerWaalsContact C-N 3.31Å
159	V	57.9	Low	61.1	Low	44 Å²	44	58.9 Å²	58.9	27%	0.267	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-0.7	174.7	-175.7	0	0	0	0	111.9	M155 L156 G157 I161 V224	M155-V159 WeakPolarHBondContact O-CG2 3.36Å; M155-V159 PolarHBondContact O-N 2.82Å; L156-V159 PolarHBondContact O-N 2.71Å; G157-V159 PolarHBondContact O-N 2.88Å; V159-I161 HydrophobicContact CB-CD1 4Å; V159-I161 HydrophobicContact CB-CG1 4.2Å; V159-I161 HydrophobicContact CG1-CD1 3.73Å; V159-I161 HydrophobicContact CG1-CG1 4.01Å; V159-V224 HydrophobicContact CG1-CB 4.47Å; V159-V224 HydrophobicContact CG1-CG1 3.54Å
160	G	57.4	Low	63.2	Low	58 Å²	58	58.5 Å²	58.5	60%	0.598	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.8	31.6	177.7	0	0	0	0	0	113.9	L156 G157 Q158 D162	L156-G160 PolarHBondContact O-N 3.43Å; G157-G160 PolarHBondContact O-N 3.33Å; Q158-G160 VanDerWaalsContact C-N 3.31Å; G160-D162 PolarHBondContact O-N 3.18Å
161	I	58	Low	65.4	Low	22 Å²	22	55.4 Å²	55.4	11%	0.113	33%	0.329	C	S	.	.			trans	-96.9	84.2	-178.8	-56.5	168.7	0	0	0	109.3	L156 V159 G163 V221 I241	L156-I161 HydrophobicContact CD1-CD1 4.19Å; L156-I161 HydrophobicContact CD2-CG2 4.22Å; L156-I161 HydrophobicContact CG-CB 4.05Å; L156-I161 HydrophobicContact CG-CD1 4.21Å; L156-I161 HydrophobicContact CG-CG2 4.2Å; L156-I161 PolarHBondContact O-N 3.12Å; V159-I161 HydrophobicContact CB-CD1 4Å; V159-I161 HydrophobicContact CB-CG1 4.2Å; V159-I161 HydrophobicContact CG1-CD1 3.73Å; V159-I161 HydrophobicContact CG1-CG1 4.01Å; I161-G163 PolarHBondContact O-N 3.15Å; I161-V221 HydrophobicContact CD1-CG1 4.46Å; I161-I241 HydrophobicContact CD1-CD1 4.47Å; I161-I241 HydrophobicContact CD1-CG1 3.77Å; I161-I241 HydrophobicContact CG1-CG1 4.05Å; I161-I241 HydrophobicContact CG2-CB 4.28Å; I161-I241 HydrophobicContact CG2-CG1 3.86Å
162	D	52.1	Low	67.2	Low	131 Å²	131	54.8 Å²	54.8	70%	0.701	33%	0.329	S	S	*	.			trans	-80	100.5	166.9	-73.9	-68.4	0	0	0	110.4	G160 R243	G160-D162 PolarHBondContact O-N 3.18Å; D162-R243 PolarHBondContact O-NE 3.24Å; D162-R243 PolarHBondContact O-NH2 2.78Å
163	G	58.6	Low	69	Low	41 Å²	41	55.6 Å²	55.6	42%	0.423	33%	0.331	S	S	.	.	S	Bend	trans	141.6	176	171.9	0	0	0	0	0	114.4	I161 V165	I161-G163 PolarHBondContact O-N 3.15Å; G163-V165 PolarHBondContact O-N 2.85Å
164	P	64.5	Low	70.6	Confident	97 Å²	97	50.6 Å²	50.6	63%	0.63	30%	0.298	S	S	*	.	P	Polyproline II helix	trans	-62.6	133.8	174.7	27.5	-34.2	0	0	0	110.4	T166	P164-T166 PolarHBondContact O-N 3.37Å
165	V	70.3	Confident	72.3	Confident	6 Å²	6	45.1 Å²	45.1	4%	0.036	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-67	124.9	174.1	-170.8	0	0	0	0	108.9	L156 G163 A217 V221 I241 A248 I252	L156-V165 HydrophobicContact CD1-CG2 3.92Å; L156-V165 HydrophobicContact CD2-CG2 3.6Å; L156-V165 HydrophobicContact CG-CG2 4.3Å; G163-V165 PolarHBondContact O-N 2.85Å; V165-A217 HydrophobicContact CG1-CB 3.9Å; V165-V221 HydrophobicContact CB-CG2 4.5Å; V165-V221 HydrophobicContact CG1-CG2 3.43Å; V165-V221 VanDerWaalsContact CG1-CG2 3.43Å; V165-V221 HydrophobicContact CG2-CG2 4.2Å; V165-I241 HydrophobicContact CG1-CD1 4.37Å; V165-A248 WeakPolarHBondContact O-CB 3.36Å; V165-A248 PolarHBondContact O-N 2.91Å; V165-I252 HydrophobicContact CB-CD1 4.01Å; V165-I252 HydrophobicContact CG2-CD1 4.29Å
166	T	81.6	Confident	73.9	Confident	3 Å²	3	48.5 Å²	48.5	2%	0.018	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-98.8	167.6	172.6	65.6	0	0	0	0	110.5	P164 S168 I241 D242	P164-T166 PolarHBondContact O-N 3.37Å; T166-S168 PolarHBondContact O-N 2.81Å; T166-S168 PolarHBondContact OG1-N 2.81Å; T166-S168 PolarHBondContact OG1-O 3.07Å; T166-S168 VanDerWaalsContact OG1-O 3.09Å; T166-I241 WeakPolarHBondContact OG1-CG2 3.03Å; T166-D242 WeakPolarHBondContact CB-O 3.46Å; T166-D242 WeakPolarHBondContact CG2-O 3.42Å; T166-D242 PolarHBondContact OG1-O 3.18Å
167	D	86.2	Confident	75.3	Confident	23 Å²	23	50.6 Å²	50.6	12%	0.123	30%	0.301	C	S	.	.	S	Bend	trans	-74.5	4.4	169.1	63.4	6.8	0	0	0	113.5	K213 F214 T246	D167-K213 IonicContact OD1-NZ 3.09Å; D167-K213 WeakPolarHBondContact OD2-CE 3.31Å; D167-K213 IonicContact OD2-NZ 3.83Å; D167-K213 PolarHBondContact OD2-NZ 3.22Å; D167-F214 PolarHBondContact O-N 3.09Å; D167-T246 PolarHBondContact OD1-N 3.21Å
168	S	87.8	Confident	76.5	Confident	7 Å²	7	48.2 Å²	48.2	5%	0.049	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	142.6	-166.6	-59.5	0	0	0	0	111.9	T166 L212 D242	T166-S168 PolarHBondContact O-N 2.81Å; T166-S168 PolarHBondContact OG1-N 2.81Å; T166-S168 PolarHBondContact OG1-O 3.07Å; T166-S168 VanDerWaalsContact OG1-O 3.09Å; S168-L212 CarbonylContact C-O 3.54Å; S168-L212 VanDerWaalsContact CA-O 3.22Å; S168-L212 WeakPolarHBondContact CA-O 3.22Å; S168-D242 PolarHBondContact O-N 3.37Å
169	V	89.5	Confident	78.2	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	126.6	-175	175.9	0	0	0	0	109.8	V171 I211 L212 F214 A220 V224 V239 K240	V169-V171 HydrophobicContact CG1-CG2 4.09Å; V169-I211 WeakPolarHBondContact O-CA 3.16Å; V169-L212 HydrophobicContact CB-CB 4.41Å; V169-L212 PolarHBondContact N-O 2.89Å; V169-L212 PolarHBondContact O-N 3.17Å; V169-F214 HydrophobicContact CB-CD2 4.42Å; V169-F214 HydrophobicContact CB-CE2 3.96Å; V169-F214 HydrophobicContact CG2-CD2 3.79Å; V169-F214 HydrophobicContact CG2-CE2 3.56Å; V169-A220 HydrophobicContact CG2-CB 3.5Å; V169-A220 VanDerWaalsContact CG2-CB 3.5Å; V169-V224 HydrophobicContact CG1-CG2 4.29Å; V169-V224 HydrophobicContact CG2-CG2 4.46Å; V169-V239 HydrophobicContact CG1-CG1 3.31Å; V169-K240 CarbonylContact C-O 3.58Å; V169-K240 WeakPolarHBondContact CA-O 3.28Å; V169-K240 WeakPolarHBondContact CG1-O 3.46Å
170	Y	90.8	Very high	79.6	Confident	74 Å²	74	47.6 Å²	47.6	29%	0.29	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	124	173.2	-179.2	-96.7	0	0	0	110	V209 I211 K240	Y170-V209 HydrophobicContact CD2-CG1 4.38Å; Y170-V209 HydrophobicContact CE2-CG1 3.41Å; Y170-V209 VanDerWaalsContact CE2-CG1 3.41Å; Y170-V209 WeakPolarHBondContact OH-CG1 3.23Å; Y170-I211 HydrophobicContact CD2-CG1 4.3Å; Y170-K240 PolarHBondContact N-O 3.03Å; Y170-K240 PolarHBondContact O-N 3.25Å
171	V	90.7	Very high	81.1	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	133.5	178.3	-171.3	0	0	0	0	109.2	V169 L174 F187 V209 G210 L212 M237 R238 V239	V169-V171 HydrophobicContact CG1-CG2 4.09Å; V171-L174 HydrophobicContact CB-CD1 4.24Å; V171-L174 HydrophobicContact CG1-CD1 3.86Å; V171-L174 HydrophobicContact CG1-CD2 3.74Å; V171-L174 HydrophobicContact CG1-CG 3.77Å; V171-F187 HydrophobicContact CG1-CE2 4.36Å; V171-F187 HydrophobicContact CG1-CZ 4.24Å; V171-F187 HydrophobicContact CG2-CE1 4.18Å; V171-F187 HydrophobicContact CG2-CE2 3.91Å; V171-F187 HydrophobicContact CG2-CZ 3.48Å; V171-F187 VanDerWaalsContact CG2-CZ 3.48Å; V171-V209 CarbonylContact O-C 3.57Å; V171-V209 WeakPolarHBondContact O-CA 3.34Å; V171-G210 PolarHBondContact N-O 3.44Å; V171-G210 PolarHBondContact O-N 2.93Å; V171-L212 HydrophobicContact CG2-CD1 3.39Å; V171-M237 HydrophobicContact CG1-CB 4.32Å; V171-R238 WeakPolarHBondContact CA-O 3.44Å; V171-V239 HydrophobicContact CG1-CG2 4.29Å; V171-V239 HydrophobicContact CG2-CG1 4.31Å; V171-V239 HydrophobicContact CG2-CG2 4.45Å
172	S	89.6	Confident	82.5	Confident	18 Å²	18	53.7 Å²	53.7	13%	0.126	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	163.7	-176.8	53	0	0	0	0	111.4	L174 G208 R238	S172-L174 PolarHBondContact O-N 3.33Å; S172-G208 CarbonylContact C-O 3.39Å; S172-R238 PolarHBondContact N-O 3.24Å; S172-R238 PolarHBondContact O-N 3.09Å; S172-R238 PolarHBondContact OG-O 2.79Å; S172-R238 VanDerWaalsContact OG-O 3.13Å
173	N	89.3	Confident	84.3	Confident	64 Å²	64	47.6 Å²	47.6	34%	0.342	25%	0.248	S	C	.	.	S	Bend	trans	57.9	34.7	-171.9	-163.3	43	0	0	0	113.7	G208 R235 P236	N173-G208 PolarHBondContact N-O 2.8Å; N173-G208 VanDerWaalsContact N-O 3.09Å; N173-R235 PolarHBondContact OD1-NE 3.33Å; N173-R235 PolarHBondContact OD1-NH2 3.46Å; N173-P236 PolarHBondContact ND2-O 3.18Å
174	L	86.8	Confident	85.7	Confident	4 Å²	4	49.6 Å²	49.6	2%	0.021	25%	0.245	C	C	.	.			trans	-70.7	147	167.6	-67.3	163	0	0	0	109.9	V171 S172 L183 G208 L232 R235 M237	V171-L174 HydrophobicContact CB-CD1 4.24Å; V171-L174 HydrophobicContact CG1-CD1 3.86Å; V171-L174 HydrophobicContact CG1-CD2 3.74Å; V171-L174 HydrophobicContact CG1-CG 3.77Å; S172-L174 PolarHBondContact O-N 3.33Å; L174-L183 HydrophobicContact CD1-CD1 3.59Å; L174-G208 PolarHBondContact N-O 3.35Å; L174-G208 WeakPolarHBondContact O-CA 3.19Å; L174-L232 HydrophobicContact CD2-CD2 4.34Å; L174-R235 PolarHBondContact O-NH1 3.13Å; L174-M237 HydrophobicContact CD2-CB 4.23Å
175	D	87.3	Confident	86.9	Confident	26 Å²	26	49.3 Å²	49.3	14%	0.139	24%	0.238	C	C	.	.			trans	-64	145.3	168.3	179.4	-113	0	0	0	111.6	S177 V178 K233	D175-S177 PolarHBondContact O-N 3.48Å; D175-S177 WeakPolarHBondContact OD1-CA 3.19Å; D175-S177 WeakPolarHBondContact OD1-CB 3.26Å; D175-S177 PolarHBondContact OD1-N 3.09Å; D175-S177 PolarHBondContact OD1-OG 3.45Å; D175-V178 HydrophobicContact CB-CG2 4.02Å; D175-V178 WeakPolarHBondContact O-CB 3.24Å; D175-V178 PolarHBondContact O-N 3.06Å; D175-V178 VanDerWaalsContact O-N 3.07Å; D175-K233 HydrophobicContact CB-CB 3.95Å
176	Y	86	Confident	87.7	Confident	143 Å²	143	50.4 Å²	50.4	56%	0.561	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-23.1	-175.8	-57.2	-51.2	0	0	0	112.5	V178 S206 R235	Y176-V178 VanDerWaalsContact C-N 3.27Å; Y176-V178 PolarHBondContact O-N 3.22Å; Y176-S206 WeakPolarHBondContact CD1-O 3.05Å; Y176-S206 PolarHBondContact O-OG 3.18Å; Y176-R235 VanDerWaalsContact CE2-NH1 3.34Å
177	S	85.6	Confident	88	Confident	76 Å²	76	50.3 Å²	50.3	53%	0.531	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	12.1	175.8	-26.3	0	0	0	0	113.5	D175 K233	D175-S177 PolarHBondContact O-N 3.48Å; D175-S177 WeakPolarHBondContact OD1-CA 3.19Å; D175-S177 WeakPolarHBondContact OD1-CB 3.26Å; D175-S177 PolarHBondContact OD1-N 3.09Å; D175-S177 PolarHBondContact OD1-OG 3.45Å; S177-K233 PolarHBondContact O-NZ 3.08Å
178	V	84.4	Confident	88.1	Confident	3 Å²	3	56.5 Å²	56.5	2%	0.018	27%	0.27	C	S	.	.			trans	-98.2	114.2	176.2	175.9	0	0	0	0	109.3	D175 Y176 K182 L183 I198 L232 K233	D175-V178 HydrophobicContact CB-CG2 4.02Å; D175-V178 WeakPolarHBondContact O-CB 3.24Å; D175-V178 PolarHBondContact O-N 3.06Å; D175-V178 VanDerWaalsContact O-N 3.07Å; Y176-V178 VanDerWaalsContact C-N 3.27Å; Y176-V178 PolarHBondContact O-N 3.22Å; V178-K182 HydrophobicContact CG1-CB 4.38Å; V178-L183 HydrophobicContact CG1-CB 4.15Å; V178-I198 WeakPolarHBondContact O-CD1 3.44Å; V178-L232 HydrophobicContact CG1-CD2 4.09Å; V178-L232 HydrophobicContact CG2-CD2 3.72Å; V178-L232 HydrophobicContact CG2-CG 4.14Å; V178-K233 HydrophobicContact CG2-CD 4.33Å
179	T	87.3	Confident	88	Confident	72 Å²	72	60.3 Å²	60.3	44%	0.442	30%	0.297	S	S	.	.			trans	-83.7	163.3	172	61.5	0	0	0	0	111.2	Q181 K182 L183	T179-Q181 PolarHBondContact O-N 3.14Å; T179-Q181 VanDerWaalsContact O-N 3.12Å; T179-K182 PolarHBondContact O-N 2.78Å; T179-K182 VanDerWaalsContact O-N 3.13Å; T179-L183 PolarHBondContact O-N 2.98Å; T179-L183 VanDerWaalsContact O-N 3.09Å
180	W	86.9	Confident	87.6	Confident	132 Å²	132	60.6 Å²	60.6	50%	0.5	30%	0.299	S	S	.	.	H	α-helix	trans	-57.7	-27	176.7	64.4	-96	0	0	0	112.5	K184 I198	W180-K184 HydrophobicContact CZ3-CD 4.47Å; W180-K184 VanDerWaalsContact O-CB 3.23Å; W180-K184 WeakPolarHBondContact O-CB 3.44Å; W180-K184 PolarHBondContact O-N 3.15Å; W180-I198 HydrophobicContact CB-CD1 4.34Å; W180-I198 HydrophobicContact CB-CG1 4.18Å; W180-I198 VanDerWaalsContact N-CD1 3.31Å
181	Q	90.1	Very high	87.4	Confident	109 Å²	109	57.7 Å²	57.7	51%	0.509	29%	0.292	S	S	.	.	H	α-helix	trans	-64.2	-55.1	174.2	-65.8	170.6	-33.9	0	0	111	T179 L183 K184 D185	T179-Q181 PolarHBondContact O-N 3.14Å; T179-Q181 VanDerWaalsContact O-N 3.12Å; Q181-L183 VanDerWaalsContact C-N 3.27Å; Q181-L183 PolarHBondContact O-N 2.81Å; Q181-K184 CarbonylContact O-C 3.57Å; Q181-K184 WeakPolarHBondContact O-CA 3.48Å; Q181-K184 WeakPolarHBondContact O-CB 3.34Å; Q181-K184 PolarHBondContact O-N 2.88Å; Q181-D185 PolarHBondContact O-N 2.83Å
182	K	88	Confident	87.3	Confident	99 Å²	99	64.4 Å²	64.4	43%	0.43	32%	0.321	S	S	.	.	H	α-helix	trans	-64.8	-35.6	-178.5	-174.3	57.5	175.6	179.6	0	112	V178 T179 D185 V186	V178-K182 HydrophobicContact CG1-CB 4.38Å; T179-K182 PolarHBondContact O-N 2.78Å; T179-K182 VanDerWaalsContact O-N 3.13Å; K182-D185 PolarHBondContact O-N 2.92Å; K182-V186 WeakPolarHBondContact O-CG2 3.47Å; K182-V186 PolarHBondContact O-N 3.49Å; K182-V186 VanDerWaalsContact O-N 3.09Å
183	L	88.3	Confident	87.3	Confident	2 Å²	2	64.4 Å²	64.4	1%	0.01	32%	0.319	C	S	.	.	H	α-helix	trans	-61.1	-48.4	171	-173.5	169.2	0	0	0	110.3	L174 V178 T179 Q181 D185 V186 F187 A196 I198 L212	L174-L183 HydrophobicContact CD1-CD1 3.59Å; V178-L183 HydrophobicContact CG1-CB 4.15Å; T179-L183 PolarHBondContact O-N 2.98Å; T179-L183 VanDerWaalsContact O-N 3.09Å; Q181-L183 VanDerWaalsContact C-N 3.27Å; Q181-L183 PolarHBondContact O-N 2.81Å; L183-D185 VanDerWaalsContact C-N 3.33Å; L183-D185 PolarHBondContact O-N 3.21Å; L183-V186 PolarHBondContact O-N 3.18Å; L183-F187 HydrophobicContact CD2-CD2 3.95Å; L183-F187 HydrophobicContact CD2-CE2 4.4Å; L183-F187 HydrophobicContact CG-CD2 4.3Å; L183-F187 HydrophobicContact CG-CE2 4.45Å; L183-F187 WeakPolarHBondContact O-CD2 3.11Å; L183-F187 PolarHBondContact O-N 2.86Å; L183-F187 VanDerWaalsContact O-N 3.09Å; L183-A196 HydrophobicContact CD2-CB 4.29Å; L183-I198 HydrophobicContact CD1-CD1 3.85Å; L183-I198 HydrophobicContact CD1-CG1 3.77Å; L183-L212 HydrophobicContact CD2-CD1 3.61Å; L183-L212 HydrophobicContact CD2-CD2 3.62Å; L183-L212 HydrophobicContact CD2-CG 3.59Å
184	K	89.3	Confident	87.3	Confident	83 Å²	83	66 Å²	66	36%	0.361	33%	0.327	S	S	.	.	H	α-helix	trans	-59.2	-41.4	175.6	-170.2	176.7	-175	174.4	0	112.3	W180 Q181 K188 I193 A196	W180-K184 HydrophobicContact CZ3-CD 4.47Å; W180-K184 VanDerWaalsContact O-CB 3.23Å; W180-K184 WeakPolarHBondContact O-CB 3.44Å; W180-K184 PolarHBondContact O-N 3.15Å; Q181-K184 CarbonylContact O-C 3.57Å; Q181-K184 WeakPolarHBondContact O-CA 3.48Å; Q181-K184 WeakPolarHBondContact O-CB 3.34Å; Q181-K184 PolarHBondContact O-N 2.88Å; K184-K188 WeakPolarHBondContact O-CB 3.34Å; K184-K188 PolarHBondContact O-N 2.85Å; K184-I193 HydrophobicContact CB-CD1 4.33Å; K184-I193 HydrophobicContact CG-CB 4.38Å; K184-I193 HydrophobicContact CG-CD1 3.77Å; K184-I193 HydrophobicContact CG-CG2 4.37Å; K184-I193 WeakPolarHBondContact O-CD1 3.4Å; K184-A196 HydrophobicContact CB-CB 4.48Å
185	D	88.8	Confident	87.2	Confident	91 Å²	91	68.5 Å²	68.5	49%	0.487	35%	0.345	S	S	.	.	H	α-helix	trans	-64.3	-41.8	178.9	-66.6	-29.9	0	0	0	113	Q181 K182 L183 K188	Q181-D185 PolarHBondContact O-N 2.83Å; K182-D185 PolarHBondContact O-N 2.92Å; L183-D185 VanDerWaalsContact C-N 3.33Å; L183-D185 PolarHBondContact O-N 3.21Å; D185-K188 WeakPolarHBondContact O-CB 2.9Å
186	V	87.6	Confident	87.3	Confident	30 Å²	30	68 Å²	68	18%	0.182	35%	0.345	C	S	.	.	H	α-helix	trans	-64.1	-51.9	176.8	170.3	0	0	0	0	110.1	K182 L183 K188 S189 F227 L232 M237	K182-V186 WeakPolarHBondContact O-CG2 3.47Å; K182-V186 PolarHBondContact O-N 3.49Å; K182-V186 VanDerWaalsContact O-N 3.09Å; L183-V186 PolarHBondContact O-N 3.18Å; V186-K188 VanDerWaalsContact C-N 3.27Å; V186-K188 PolarHBondContact O-N 3.28Å; V186-S189 PolarHBondContact O-N 2.96Å; V186-F227 HydrophobicContact CG1-CD1 3.75Å; V186-F227 HydrophobicContact CG1-CE1 3.49Å; V186-F227 VanDerWaalsContact CG1-CE1 3.49Å; V186-F227 HydrophobicContact CG1-CZ 4.03Å; V186-F227 WeakPolarHBondContact O-CZ 3.37Å; V186-L232 HydrophobicContact CG2-CD1 4.37Å; V186-M237 HydrophobicContact CG1-CE 4.45Å
187	F	88.2	Confident	87.4	Confident	1 Å²	1	65.2 Å²	65.2	0%	0.004	34%	0.342	C	S	.	.	H	α-helix	trans	-72.7	-17	-175.3	-80.6	-89.5	0	0	0	114	V171 L183 S189 A190 G191 I193 L212 F214 A223 F227 M237 V239	V171-F187 HydrophobicContact CG1-CE2 4.36Å; V171-F187 HydrophobicContact CG1-CZ 4.24Å; V171-F187 HydrophobicContact CG2-CE1 4.18Å; V171-F187 HydrophobicContact CG2-CE2 3.91Å; V171-F187 HydrophobicContact CG2-CZ 3.48Å; V171-F187 VanDerWaalsContact CG2-CZ 3.48Å; L183-F187 HydrophobicContact CD2-CD2 3.95Å; L183-F187 HydrophobicContact CD2-CE2 4.4Å; L183-F187 HydrophobicContact CG-CD2 4.3Å; L183-F187 HydrophobicContact CG-CE2 4.45Å; L183-F187 WeakPolarHBondContact O-CD2 3.11Å; L183-F187 PolarHBondContact O-N 2.86Å; L183-F187 VanDerWaalsContact O-N 3.09Å; F187-S189 PolarHBondContact O-N 2.65Å; F187-S189 VanDerWaalsContact O-N 3.15Å; F187-A190 PolarHBondContact O-N 2.83Å; F187-G191 PolarHBondContact O-N 3.04Å; F187-I193 HydrophobicContact CB-CD1 3.61Å; F187-I193 HydrophobicContact CB-CG1 4.44Å; F187-L212 HydrophobicContact CB-CD2 3.52Å; F187-L212 HydrophobicContact CD1-CD1 4.1Å; F187-L212 HydrophobicContact CD1-CD2 4.23Å; F187-L212 HydrophobicContact CD2-CD1 4.01Å; F187-L212 HydrophobicContact CD2-CD2 4.14Å; F187-L212 HydrophobicContact CE1-CD1 4.16Å; F187-L212 HydrophobicContact CE2-CD1 4.08Å; F187-L212 HydrophobicContact CG-CD1 4.01Å; F187-L212 HydrophobicContact CG-CD2 3.7Å; F187-L212 HydrophobicContact CZ-CD1 4.16Å; F187-F214 HydrophobicContact CB-CZ 4.16Å; F187-F214 AromaticContact CD1-CZ 3.97Å; F187-F214 HydrophobicContact CD1-CZ 3.97Å; F187-F214 HydrophobicContact CG-CZ 4.49Å; F187-A223 HydrophobicContact CD1-CB 3.89Å; F187-A223 HydrophobicContact CE1-CB 4.1Å; F187-F227 AromaticContact CD1-CD2 3.5Å; F187-F227 HydrophobicContact CD1-CD2 3.5Å; F187-F227 VanDerWaalsContact CD1-CD2 3.5Å; F187-F227 AromaticContact CD1-CE2 3.96Å; F187-F227 HydrophobicContact CD1-CE2 3.96Å; F187-F227 HydrophobicContact CD1-CG 4.26Å; F187-F227 HydrophobicContact CE1-CB 3.83Å; F187-F227 AromaticContact CE1-CD2 3.55Å; F187-F227 HydrophobicContact CE1-CD2 3.55Å; F187-F227 HydrophobicContact CE1-CE2 4.44Å; F187-F227 AromaticContact CE1-CG 3.95Å; F187-F227 HydrophobicContact CE1-CG 3.95Å; F187-F227 HydrophobicContact CG-CD2 4.17Å; F187-F227 HydrophobicContact CG-CE2 4.32Å; F187-F227 HydrophobicContact CZ-CB 3.88Å; F187-F227 HydrophobicContact CZ-CD2 4.23Å; F187-F227 HydrophobicContact CZ-CG 4.21Å; F187-M237 HydrophobicContact CE2-SD 3.98Å; F187-M237 HydrophobicContact CZ-SD 4.03Å; F187-V239 HydrophobicContact CE1-CG1 3.88Å; F187-V239 HydrophobicContact CE1-CG2 4.34Å; F187-V239 HydrophobicContact CZ-CG1 4.09Å; F187-V239 HydrophobicContact CZ-CG2 3.84Å
188	K	88.6	Confident	87.6	Confident	152 Å²	152	62.8 Å²	62.8	66%	0.661	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-27.8	174.4	-171.6	179.9	179.7	-173.3	0	112.8	K184 D185 V186 A190 G191	K184-K188 WeakPolarHBondContact O-CB 3.34Å; K184-K188 PolarHBondContact O-N 2.85Å; D185-K188 WeakPolarHBondContact O-CB 2.9Å; V186-K188 VanDerWaalsContact C-N 3.27Å; V186-K188 PolarHBondContact O-N 3.28Å; K188-A190 VanDerWaalsContact C-N 3.28Å; K188-A190 PolarHBondContact O-N 2.82Å; K188-G191 PolarHBondContact O-N 3.43Å
189	S	85.1	Confident	87.7	Confident	88 Å²	88	67.4 Å²	67.4	62%	0.615	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-16.3	177.6	-49.4	0	0	0	0	114.1	V186 F187	V186-S189 PolarHBondContact O-N 2.96Å; F187-S189 PolarHBondContact O-N 2.65Å; F187-S189 VanDerWaalsContact O-N 3.15Å
190	A	80.6	Confident	87.7	Confident	5 Å²	5	67.9 Å²	67.9	4%	0.041	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-14.3	173.6	0	0	0	0	0	113.8	F187 K188 Q222 A223 M226 F227	F187-A190 PolarHBondContact O-N 2.83Å; K188-A190 VanDerWaalsContact C-N 3.28Å; K188-A190 PolarHBondContact O-N 2.82Å; A190-Q222 HydrophobicContact CB-CG 4.26Å; A190-A223 HydrophobicContact CB-CB 3.83Å; A190-M226 HydrophobicContact CB-SD 4.09Å; A190-F227 HydrophobicContact CB-CD2 4.28Å; A190-F227 HydrophobicContact CB-CE2 3.59Å
191	G	86.9	Confident	87.6	Confident	14 Å²	14	65 Å²	65	14%	0.144	34%	0.34	C	S	.	.	S	Bend	trans	164.6	-177.9	175.6	0	0	0	0	0	115.9	F187 K188 I193 E219	F187-G191 PolarHBondContact O-N 3.04Å; K188-G191 PolarHBondContact O-N 3.43Å; G191-I193 PolarHBondContact O-N 2.74Å; G191-E219 WeakPolarHBondContact CA-OE1 3.49Å
192	K	89.5	Confident	87	Confident	140 Å²	140	65.7 Å²	65.7	61%	0.609	36%	0.357	S	S	*	.			trans	-81	106.1	-177.6	-175.1	-179.5	179.5	-176.7	0	111.4	F214 S215 E219	K192-F214 CarbonylContact O-C 3.49Å; K192-S215 PolarHBondContact O-N 3.04Å; K192-E219 WeakPolarHBondContact CB-OE1 3.46Å; K192-E219 VanDerWaalsContact N-CD 3.32Å; K192-E219 PolarHBondContact N-OE1 3.38Å
193	I	89.1	Confident	86.5	Confident	19 Å²	19	68.4 Å²	68.4	10%	0.097	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	121.6	178.6	-58.1	159	0	0	0	110.6	K184 F187 G191 S195 A196 L212 K213 F214	K184-I193 HydrophobicContact CB-CD1 4.33Å; K184-I193 HydrophobicContact CG-CB 4.38Å; K184-I193 HydrophobicContact CG-CD1 3.77Å; K184-I193 HydrophobicContact CG-CG2 4.37Å; K184-I193 WeakPolarHBondContact O-CD1 3.4Å; F187-I193 HydrophobicContact CB-CD1 3.61Å; F187-I193 HydrophobicContact CB-CG1 4.44Å; G191-I193 PolarHBondContact O-N 2.74Å; I193-S195 VanDerWaalsContact CG2-O 3.28Å; I193-S195 WeakPolarHBondContact CG2-O 3.13Å; I193-A196 HydrophobicContact CG2-CB 4.25Å; I193-L212 HydrophobicContact CD1-CD2 3.65Å; I193-L212 HydrophobicContact CG1-CD2 3.85Å; I193-L212 HydrophobicContact CG2-CD2 4.06Å; I193-K213 CarbonylContact C-O 3.52Å; I193-F214 HydrophobicContact CG1-CD1 4.15Å; I193-F214 HydrophobicContact CG1-CE1 3.7Å; I193-F214 HydrophobicContact CG1-CZ 4.14Å
194	L	88.6	Confident	86	Confident	97 Å²	97	70.8 Å²	70.8	51%	0.508	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	-45.2	171.6	-64.1	-179.3	0	0	0	111.8	K213 F214	L194-K213 HydrophobicContact CB-CG 4.37Å; L194-K213 HydrophobicContact CD1-CG 4.35Å; L194-K213 PolarHBondContact N-O 2.89Å; L194-F214 WeakPolarHBondContact CD1-O 3.33Å
195	S	86.2	Confident	85.5	Confident	57 Å²	57	71.4 Å²	71.4	40%	0.399	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	149	180	-171.5	0	0	0	0	111.4	I193 L212 K213	I193-S195 VanDerWaalsContact CG2-O 3.28Å; I193-S195 WeakPolarHBondContact CG2-O 3.13Å; S195-L212 CarbonylContact O-C 3.56Å; S195-L212 WeakPolarHBondContact O-CA 3.22Å; S195-K213 PolarHBondContact N-O 2.8Å; S195-K213 PolarHBondContact O-N 3.4Å
196	A	89	Confident	85.1	Confident	16 Å²	16	68.7 Å²	68.7	13%	0.132	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	117.7	174.4	0	0	0	0	0	108.7	L183 K184 I193	L183-A196 HydrophobicContact CD2-CB 4.29Å; K184-A196 HydrophobicContact CB-CB 4.48Å; I193-A196 HydrophobicContact CG2-CB 4.25Å
197	V	87.9	Confident	84.9	Confident	83 Å²	83	74.6 Å²	74.6	50%	0.503	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	122.6	-177.8	-179.7	0	0	0	0	108.7	G210 I211	V197-G210 CarbonylContact O-C 3.59Å; V197-G210 WeakPolarHBondContact O-CA 3.42Å; V197-I211 PolarHBondContact N-O 2.88Å; V197-I211 PolarHBondContact O-N 3.34Å
198	I	89.5	Confident	84.8	Confident	26 Å²	26	74.7 Å²	74.7	13%	0.133	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	133.9	168.7	-65.3	-173.4	0	0	0	108.1	V178 W180 L183 T200	V178-I198 WeakPolarHBondContact O-CD1 3.44Å; W180-I198 HydrophobicContact CB-CD1 4.34Å; W180-I198 HydrophobicContact CB-CG1 4.18Å; W180-I198 VanDerWaalsContact N-CD1 3.31Å; L183-I198 HydrophobicContact CD1-CD1 3.85Å; L183-I198 HydrophobicContact CD1-CG1 3.77Å; I198-T200 PolarHBondContact O-N 2.96Å
199	K	87.4	Confident	84.8	Confident	99 Å²	99	68.6 Å²	68.6	43%	0.43	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	109.9	173.7	-64.9	-170.8	178.4	-177.1	0	108.5	R207 V209	K199-R207 VanDerWaalsContact O-CB 3.3Å; K199-R207 WeakPolarHBondContact O-CB 3.41Å; K199-R207 PolarHBondContact O-N 3.09Å; K199-V209 HydrophobicContact CD-CG1 4.08Å; K199-V209 HydrophobicContact CG-CG1 4.43Å; K199-V209 PolarHBondContact N-O 3.01Å
200	T	86	Confident	85.1	Confident	83 Å²	83	64.4 Å²	64.4	51%	0.509	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	158.3	166.8	53.6	0	0	0	0	110.1	I198 N205	I198-T200 PolarHBondContact O-N 2.96Å; T200-N205 CarbonylContact C-O 3.58Å; T200-N205 WeakPolarHBondContact CA-O 3.42Å
201	D	84.5	Confident	85.5	Confident	70 Å²	70	66.5 Å²	66.5	37%	0.374	37%	0.368	S	S	.	.			trans	-83.8	175	167.6	-139.8	-42.4	0	0	0	110.5	E203 G204 N205 R207	D201-E203 PolarHBondContact O-N 3.08Å; D201-G204 PolarHBondContact O-N 3.28Å; D201-N205 PolarHBondContact N-O 3.48Å; D201-R207 HydrophobicContact CB-CG 3.87Å; D201-R207 IonicContact OD2-NE 2.68Å
202	S	78.5	Confident	85.7	Confident	124 Å²	124	65.8 Å²	65.8	87%	0.867	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-23.4	-178.5	-47.1	0	0	0	0	112.6	G204	S202-G204 VanDerWaalsContact C-N 3.32Å
203	E	76.6	Confident	85.7	Confident	157 Å²	157	62 Å²	62	73%	0.734	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	3.2	176	-57.2	178.6	147.2	0	0	113.4	D201 N205	D201-E203 PolarHBondContact O-N 3.08Å; E203-N205 PolarHBondContact O-N 3.35Å; E203-N205 PolarHBondContact OE2-ND2 3.18Å
204	G	77.2	Confident	85.8	Confident	52 Å²	52	61 Å²	61	54%	0.536	34%	0.34	S	S	.	.	S	Bend	trans	80.6	-8.5	-174.3	0	0	0	0	0	114.8	D201 S202	D201-G204 PolarHBondContact O-N 3.28Å; S202-G204 VanDerWaalsContact C-N 3.32Å
205	N	79.8	Confident	85.8	Confident	96 Å²	96	58.7 Å²	58.7	51%	0.513	33%	0.331	S	S	.	.			trans	-65.8	131.7	177.4	-69.2	-42.9	0	0	0	111.8	T200 D201 E203 R207	T200-N205 CarbonylContact C-O 3.58Å; T200-N205 WeakPolarHBondContact CA-O 3.42Å; D201-N205 PolarHBondContact N-O 3.48Å; E203-N205 PolarHBondContact O-N 3.35Å; E203-N205 PolarHBondContact OE2-ND2 3.18Å; N205-R207 PolarHBondContact O-N 3.3Å
206	S	81.2	Confident	85.6	Confident	33 Å²	33	57.6 Å²	57.6	23%	0.231	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	127.6	175.7	-65.2	0	0	0	0	111.4	Y176 G208	Y176-S206 WeakPolarHBondContact CD1-O 3.05Å; Y176-S206 PolarHBondContact O-OG 3.18Å; S206-G208 PolarHBondContact O-N 2.85Å; S206-G208 VanDerWaalsContact O-N 3.16Å
207	R	82.7	Confident	85.4	Confident	154 Å²	154	57.4 Å²	57.4	58%	0.581	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.2	10	177.7	-61.5	-176.7	64.8	176.8	2.2	114.3	K199 D201 N205 V209	K199-R207 VanDerWaalsContact O-CB 3.3Å; K199-R207 WeakPolarHBondContact O-CB 3.41Å; K199-R207 PolarHBondContact O-N 3.09Å; D201-R207 HydrophobicContact CB-CG 3.87Å; D201-R207 IonicContact OD2-NE 2.68Å; N205-R207 PolarHBondContact O-N 3.3Å; R207-V209 PolarHBondContact O-N 3Å
208	G	85.7	Confident	85.2	Confident	3 Å²	3	57.6 Å²	57.6	3%	0.031	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	64.3	21	-175.4	0	0	0	0	0	114.2	S172 N173 L174 S206	S172-G208 CarbonylContact C-O 3.39Å; N173-G208 PolarHBondContact N-O 2.8Å; N173-G208 VanDerWaalsContact N-O 3.09Å; L174-G208 PolarHBondContact N-O 3.35Å; L174-G208 WeakPolarHBondContact O-CA 3.19Å; S206-G208 PolarHBondContact O-N 2.85Å; S206-G208 VanDerWaalsContact O-N 3.16Å
209	V	89.3	Confident	85.1	Confident	25 Å²	25	57.8 Å²	57.8	15%	0.152	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	135.7	-175.7	172	0	0	0	0	109.9	Y170 V171 K199 R207	Y170-V209 HydrophobicContact CD2-CG1 4.38Å; Y170-V209 HydrophobicContact CE2-CG1 3.41Å; Y170-V209 VanDerWaalsContact CE2-CG1 3.41Å; Y170-V209 WeakPolarHBondContact OH-CG1 3.23Å; V171-V209 CarbonylContact O-C 3.57Å; V171-V209 WeakPolarHBondContact O-CA 3.34Å; K199-V209 HydrophobicContact CD-CG1 4.08Å; K199-V209 HydrophobicContact CG-CG1 4.43Å; K199-V209 PolarHBondContact N-O 3.01Å; R207-V209 PolarHBondContact O-N 3Å
210	G	89.9	Confident	85.1	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	159.3	175.8	0	0	0	0	0	113.1	V171 V197	V171-G210 PolarHBondContact N-O 3.44Å; V171-G210 PolarHBondContact O-N 2.93Å; V197-G210 CarbonylContact O-C 3.59Å; V197-G210 WeakPolarHBondContact O-CA 3.42Å
211	I	90.3	Very high	85.1	Confident	48 Å²	48	49.4 Å²	49.4	25%	0.246	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	124.8	173	-58.1	175.8	0	0	0	107.3	V169 Y170 V197	V169-I211 WeakPolarHBondContact O-CA 3.16Å; Y170-I211 HydrophobicContact CD2-CG1 4.3Å; V197-I211 PolarHBondContact N-O 2.88Å; V197-I211 PolarHBondContact O-N 3.34Å
212	L	91	Very high	85.2	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	146.2	166.4	-65.9	105.9	0	0	0	110.1	S168 V169 V171 L183 F187 I193 S195 F214	S168-L212 CarbonylContact C-O 3.54Å; S168-L212 VanDerWaalsContact CA-O 3.22Å; S168-L212 WeakPolarHBondContact CA-O 3.22Å; V169-L212 HydrophobicContact CB-CB 4.41Å; V169-L212 PolarHBondContact N-O 2.89Å; V169-L212 PolarHBondContact O-N 3.17Å; V171-L212 HydrophobicContact CG2-CD1 3.39Å; L183-L212 HydrophobicContact CD2-CD1 3.61Å; L183-L212 HydrophobicContact CD2-CD2 3.62Å; L183-L212 HydrophobicContact CD2-CG 3.59Å; F187-L212 HydrophobicContact CB-CD2 3.52Å; F187-L212 HydrophobicContact CD1-CD1 4.1Å; F187-L212 HydrophobicContact CD1-CD2 4.23Å; F187-L212 HydrophobicContact CD2-CD1 4.01Å; F187-L212 HydrophobicContact CD2-CD2 4.14Å; F187-L212 HydrophobicContact CE1-CD1 4.16Å; F187-L212 HydrophobicContact CE2-CD1 4.08Å; F187-L212 HydrophobicContact CG-CD1 4.01Å; F187-L212 HydrophobicContact CG-CD2 3.7Å; F187-L212 HydrophobicContact CZ-CD1 4.16Å; I193-L212 HydrophobicContact CD1-CD2 3.65Å; I193-L212 HydrophobicContact CG1-CD2 3.85Å; I193-L212 HydrophobicContact CG2-CD2 4.06Å; S195-L212 CarbonylContact O-C 3.56Å; S195-L212 WeakPolarHBondContact O-CA 3.22Å; L212-F214 HydrophobicContact CB-CD2 4.34Å; L212-F214 HydrophobicContact CB-CE2 3.85Å; L212-F214 HydrophobicContact CD2-CE2 4.22Å; L212-F214 HydrophobicContact CD2-CZ 4.07Å
213	K	90.3	Very high	85.6	Confident	59 Å²	59	42.7 Å²	42.7	26%	0.257	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	122.5	162.6	-176	167.7	177.3	128.9	0	109.2	D167 I193 L194 S195 T246	D167-K213 IonicContact OD1-NZ 3.09Å; D167-K213 WeakPolarHBondContact OD2-CE 3.31Å; D167-K213 IonicContact OD2-NZ 3.83Å; D167-K213 PolarHBondContact OD2-NZ 3.22Å; I193-K213 CarbonylContact C-O 3.52Å; L194-K213 HydrophobicContact CB-CG 4.37Å; L194-K213 HydrophobicContact CD1-CG 4.35Å; L194-K213 PolarHBondContact N-O 2.89Å; S195-K213 PolarHBondContact N-O 2.8Å; S195-K213 PolarHBondContact O-N 3.4Å; K213-T246 PolarHBondContact NZ-OG1 3.06Å
214	F	90.4	Very high	86.2	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	167.2	175.8	-75.2	-86.9	0	0	0	111.6	D167 V169 F187 K192 I193 L194 L212 N216 E219 A220 A223	D167-F214 PolarHBondContact O-N 3.09Å; V169-F214 HydrophobicContact CB-CD2 4.42Å; V169-F214 HydrophobicContact CB-CE2 3.96Å; V169-F214 HydrophobicContact CG2-CD2 3.79Å; V169-F214 HydrophobicContact CG2-CE2 3.56Å; F187-F214 HydrophobicContact CB-CZ 4.16Å; F187-F214 AromaticContact CD1-CZ 3.97Å; F187-F214 HydrophobicContact CD1-CZ 3.97Å; F187-F214 HydrophobicContact CG-CZ 4.49Å; K192-F214 CarbonylContact O-C 3.49Å; I193-F214 HydrophobicContact CG1-CD1 4.15Å; I193-F214 HydrophobicContact CG1-CE1 3.7Å; I193-F214 HydrophobicContact CG1-CZ 4.14Å; L194-F214 WeakPolarHBondContact CD1-O 3.33Å; L212-F214 HydrophobicContact CB-CD2 4.34Å; L212-F214 HydrophobicContact CB-CE2 3.85Å; L212-F214 HydrophobicContact CD2-CE2 4.22Å; L212-F214 HydrophobicContact CD2-CZ 4.07Å; F214-N216 VanDerWaalsContact C-N 3.31Å; F214-E219 HydrophobicContact CB-CB 4.06Å; F214-E219 HydrophobicContact CD1-CB 3.61Å; F214-E219 HydrophobicContact CE1-CB 4.35Å; F214-E219 HydrophobicContact CG-CB 3.99Å; F214-A220 HydrophobicContact CD2-CB 4.07Å; F214-A223 HydrophobicContact CE1-CB 4.4Å; F214-A223 HydrophobicContact CE2-CB 3.99Å; F214-A223 HydrophobicContact CZ-CB 3.67Å
215	S	87.7	Confident	86.6	Confident	47 Å²	47	37.7 Å²	37.7	33%	0.329	19%	0.188	S	C	.	.	S	Bend	trans	-70.4	-34.4	170.8	-176.1	0	0	0	0	110.5	K192 E219	K192-S215 PolarHBondContact O-N 3.04Å; S215-E219 WeakPolarHBondContact CB-OE2 3.46Å; S215-E219 PolarHBondContact N-OE2 3.47Å; S215-E219 VanDerWaalsContact N-OE2 3.09Å
216	N	82.7	Confident	86.8	Confident	35 Å²	35	36.8 Å²	36.8	19%	0.187	18%	0.181	C	C	.	.	S	Bend	trans	-136.8	142.2	-174	-74.6	76.7	0	0	0	112.7	F214 Y218 E219 A220 P256	F214-N216 VanDerWaalsContact C-N 3.31Å; N216-Y218 PolarHBondContact O-N 2.67Å; N216-E219 HydrophobicContact CB-CG 4.05Å; N216-E219 PolarHBondContact N-OE2 2.87Å; N216-E219 WeakPolarHBondContact O-CB 3.32Å; N216-E219 PolarHBondContact O-N 3.14Å; N216-A220 PolarHBondContact O-N 3.05Å; N216-P256 WeakPolarHBondContact ND2-CD 3.47Å; N216-P256 WeakPolarHBondContact OD1-CG 3.39Å
217	A	84.5	Confident	87	Confident	11 Å²	11	36.2 Å²	36.2	9%	0.091	18%	0.175	C	C	.	.	H	α-helix	trans	-57	-30.8	173.6	0	0	0	0	0	113.4	V165 A220 V221 A248 I252	V165-A217 HydrophobicContact CG1-CB 3.9Å; A217-A220 WeakPolarHBondContact O-CB 3.36Å; A217-A220 PolarHBondContact O-N 2.97Å; A217-V221 PolarHBondContact O-N 2.58Å; A217-V221 VanDerWaalsContact O-N 3.13Å; A217-A248 HydrophobicContact CB-CB 3.82Å; A217-I252 HydrophobicContact CB-CG2 4.38Å
218	Y	83.1	Confident	87.2	Confident	87 Å²	87	32 Å²	32	34%	0.341	16%	0.164	S	C	.	.	H	α-helix	trans	-61.2	-44	173.3	177.4	-90.5	0	0	0	112.6	P149 F151 N216 A220 V221 Q222	P149-Y218 WeakPolarHBondContact CG-OH 3.2Å; P149-Y218 WeakPolarHBondContact O-CE2 3.18Å; F151-Y218 AromaticContact CD2-CD2 3.89Å; F151-Y218 HydrophobicContact CD2-CD2 3.89Å; F151-Y218 AromaticContact CD2-CE2 3.57Å; F151-Y218 HydrophobicContact CD2-CE2 3.57Å; F151-Y218 HydrophobicContact CE2-CD2 4.11Å; F151-Y218 AromaticContact CE2-CE2 3.55Å; F151-Y218 HydrophobicContact CE2-CE2 3.55Å; F151-Y218 AromaticContact CE2-CZ 3.97Å; N216-Y218 PolarHBondContact O-N 2.67Å; Y218-A220 VanDerWaalsContact C-N 3.29Å; Y218-A220 PolarHBondContact O-N 3.25Å; Y218-V221 PolarHBondContact O-N 3.17Å; Y218-Q222 WeakPolarHBondContact O-CB 3.45Å; Y218-Q222 PolarHBondContact O-N 2.91Å
219	E	88.1	Confident	87.3	Confident	31 Å²	31	36.9 Å²	36.9	15%	0.145	19%	0.189	C	C	.	.	H	α-helix	trans	-65	-35.8	177.7	-59.2	173	134.4	0	0	111	G191 K192 F214 S215 N216 Q222 A223	G191-E219 WeakPolarHBondContact CA-OE1 3.49Å; K192-E219 WeakPolarHBondContact CB-OE1 3.46Å; K192-E219 VanDerWaalsContact N-CD 3.32Å; K192-E219 PolarHBondContact N-OE1 3.38Å; F214-E219 HydrophobicContact CB-CB 4.06Å; F214-E219 HydrophobicContact CD1-CB 3.61Å; F214-E219 HydrophobicContact CE1-CB 4.35Å; F214-E219 HydrophobicContact CG-CB 3.99Å; S215-E219 WeakPolarHBondContact CB-OE2 3.46Å; S215-E219 PolarHBondContact N-OE2 3.47Å; S215-E219 VanDerWaalsContact N-OE2 3.09Å; N216-E219 HydrophobicContact CB-CG 4.05Å; N216-E219 PolarHBondContact N-OE2 2.87Å; N216-E219 WeakPolarHBondContact O-CB 3.32Å; N216-E219 PolarHBondContact O-N 3.14Å; E219-Q222 PolarHBondContact O-N 3.39Å; E219-A223 WeakPolarHBondContact O-CB 3.38Å; E219-A223 PolarHBondContact O-N 3.13Å
220	A	87.5	Confident	87.1	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-62.8	-43.7	174.5	0	0	0	0	0	112.2	V169 F214 N216 A217 Y218 A223 V224 I241	V169-A220 HydrophobicContact CG2-CB 3.5Å; V169-A220 VanDerWaalsContact CG2-CB 3.5Å; F214-A220 HydrophobicContact CD2-CB 4.07Å; N216-A220 PolarHBondContact O-N 3.05Å; A217-A220 WeakPolarHBondContact O-CB 3.36Å; A217-A220 PolarHBondContact O-N 2.97Å; Y218-A220 VanDerWaalsContact C-N 3.29Å; Y218-A220 PolarHBondContact O-N 3.25Å; A220-A223 PolarHBondContact O-N 2.81Å; A220-V224 WeakPolarHBondContact O-CG2 3.26Å; A220-V224 PolarHBondContact O-N 3.38Å; A220-I241 HydrophobicContact CB-CD1 4.02Å
221	V	86	Confident	86.7	Confident	5 Å²	5	46.2 Å²	46.2	3%	0.03	23%	0.234	C	C	.	.	H	α-helix	trans	-66.3	-44.6	175.5	175.9	0	0	0	0	111.3	F151 L156 I161 V165 A217 Y218 A223 V224 N225 I241	F151-V221 HydrophobicContact CD1-CG1 4.06Å; F151-V221 HydrophobicContact CD2-CG1 3.94Å; F151-V221 HydrophobicContact CE1-CG1 4.16Å; F151-V221 HydrophobicContact CE2-CG1 4.04Å; F151-V221 HydrophobicContact CG-CG1 3.96Å; F151-V221 HydrophobicContact CZ-CG1 4.15Å; L156-V221 HydrophobicContact CD1-CG1 4.2Å; L156-V221 HydrophobicContact CD1-CG2 4.12Å; I161-V221 HydrophobicContact CD1-CG1 4.46Å; V165-V221 HydrophobicContact CB-CG2 4.5Å; V165-V221 HydrophobicContact CG1-CG2 3.43Å; V165-V221 VanDerWaalsContact CG1-CG2 3.43Å; V165-V221 HydrophobicContact CG2-CG2 4.2Å; A217-V221 PolarHBondContact O-N 2.58Å; A217-V221 VanDerWaalsContact O-N 3.13Å; Y218-V221 PolarHBondContact O-N 3.17Å; V221-A223 VanDerWaalsContact C-N 3.32Å; V221-A223 PolarHBondContact O-N 3.21Å; V221-V224 PolarHBondContact O-N 2.95Å; V221-N225 PolarHBondContact O-N 3.1Å; V221-I241 HydrophobicContact CG2-CD1 4.18Å
222	Q	86.4	Confident	86.2	Confident	54 Å²	54	45.1 Å²	45.1	25%	0.252	23%	0.228	S	C	.	.	H	α-helix	trans	-59.9	-43.2	175.8	-179.7	175.5	-22.1	0	0	111.5	A190 Y218 E219 N225 M226	A190-Q222 HydrophobicContact CB-CG 4.26Å; Y218-Q222 WeakPolarHBondContact O-CB 3.45Å; Y218-Q222 PolarHBondContact O-N 2.91Å; E219-Q222 PolarHBondContact O-N 3.39Å; Q222-N225 PolarHBondContact O-N 2.95Å; Q222-M226 HydrophobicContact CG-CG 4.29Å; Q222-M226 HydrophobicContact CG-SD 3.58Å; Q222-M226 VanDerWaalsContact CG-SD 3.58Å; Q222-M226 PolarHBondContact NE2-SD 3.32Å; Q222-M226 WeakPolarHBondContact O-CB 3.23Å; Q222-M226 WeakPolarHBondContact O-CG 3.45Å; Q222-M226 PolarHBondContact O-N 3.45Å
223	A	87.2	Confident	85.4	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62	-41.4	176.1	0	0	0	0	0	112.8	F187 A190 F214 E219 A220 V221 F227	F187-A223 HydrophobicContact CD1-CB 3.89Å; F187-A223 HydrophobicContact CE1-CB 4.1Å; A190-A223 HydrophobicContact CB-CB 3.83Å; F214-A223 HydrophobicContact CE1-CB 4.4Å; F214-A223 HydrophobicContact CE2-CB 3.99Å; F214-A223 HydrophobicContact CZ-CB 3.67Å; E219-A223 WeakPolarHBondContact O-CB 3.38Å; E219-A223 PolarHBondContact O-N 3.13Å; A220-A223 PolarHBondContact O-N 2.81Å; V221-A223 VanDerWaalsContact C-N 3.32Å; V221-A223 PolarHBondContact O-N 3.21Å; A223-F227 HydrophobicContact CB-CD2 4.3Å; A223-F227 WeakPolarHBondContact O-CB 3.37Å; A223-F227 WeakPolarHBondContact O-CD2 3.4Å; A223-F227 PolarHBondContact O-N 2.82Å
224	V	88.7	Confident	85	Confident	5 Å²	5	55 Å²	55	3%	0.03	28%	0.278	C	S	.	.	H	α-helix	trans	-60.7	-48	173.2	172.6	0	0	0	0	110.5	V159 V169 A220 V221 M226 N228 V239 I241	V159-V224 HydrophobicContact CG1-CB 4.47Å; V159-V224 HydrophobicContact CG1-CG1 3.54Å; V169-V224 HydrophobicContact CG1-CG2 4.29Å; V169-V224 HydrophobicContact CG2-CG2 4.46Å; A220-V224 WeakPolarHBondContact O-CG2 3.26Å; A220-V224 PolarHBondContact O-N 3.38Å; V221-V224 PolarHBondContact O-N 2.95Å; V224-M226 PolarHBondContact O-N 3.09Å; V224-N228 WeakPolarHBondContact O-CB 3.4Å; V224-N228 PolarHBondContact O-N 2.8Å; V224-N228 VanDerWaalsContact O-N 3.1Å; V224-V239 HydrophobicContact CB-CG1 4.4Å; V224-V239 HydrophobicContact CG2-CG1 3.96Å; V224-I241 HydrophobicContact CG2-CD1 3.71Å; V224-I241 HydrophobicContact CG2-CG1 4.09Å
225	N	86.2	Confident	84.7	Confident	99 Å²	99	57.7 Å²	57.7	53%	0.529	29%	0.289	S	S	.	.	H	α-helix	trans	-65.8	-38.2	-178	-166.2	40.5	0	0	0	113.2	V221 Q222	V221-N225 PolarHBondContact O-N 3.1Å; Q222-N225 PolarHBondContact O-N 2.95Å
226	M	83.8	Confident	84.7	Confident	76 Å²	76	58.4 Å²	58.4	37%	0.374	29%	0.293	S	S	.	.	H	α-helix	trans	-80.9	-37.2	-178	-69.4	176.8	66.4	0	0	114	A190 Q222 V224 Q230	A190-M226 HydrophobicContact CB-SD 4.09Å; Q222-M226 HydrophobicContact CG-CG 4.29Å; Q222-M226 HydrophobicContact CG-SD 3.58Å; Q222-M226 VanDerWaalsContact CG-SD 3.58Å; Q222-M226 PolarHBondContact NE2-SD 3.32Å; Q222-M226 WeakPolarHBondContact O-CB 3.23Å; Q222-M226 WeakPolarHBondContact O-CG 3.45Å; Q222-M226 PolarHBondContact O-N 3.45Å; V224-M226 PolarHBondContact O-N 3.09Å; M226-Q230 WeakPolarHBondContact O-CG 3.11Å; M226-Q230 PolarHBondContact O-NE2 2.83Å
227	F	85.2	Confident	85	Confident	22 Å²	22	57 Å²	57	10%	0.096	29%	0.285	C	S	.	.	H	α-helix	trans	-105.1	-11.9	-169.6	-63.5	-62.9	0	0	0	115.3	V186 F187 A190 A223 N229 Q230 M237 V239	V186-F227 HydrophobicContact CG1-CD1 3.75Å; V186-F227 HydrophobicContact CG1-CE1 3.49Å; V186-F227 VanDerWaalsContact CG1-CE1 3.49Å; V186-F227 HydrophobicContact CG1-CZ 4.03Å; V186-F227 WeakPolarHBondContact O-CZ 3.37Å; F187-F227 AromaticContact CD1-CD2 3.5Å; F187-F227 HydrophobicContact CD1-CD2 3.5Å; F187-F227 VanDerWaalsContact CD1-CD2 3.5Å; F187-F227 AromaticContact CD1-CE2 3.96Å; F187-F227 HydrophobicContact CD1-CE2 3.96Å; F187-F227 HydrophobicContact CD1-CG 4.26Å; F187-F227 HydrophobicContact CE1-CB 3.83Å; F187-F227 AromaticContact CE1-CD2 3.55Å; F187-F227 HydrophobicContact CE1-CD2 3.55Å; F187-F227 HydrophobicContact CE1-CE2 4.44Å; F187-F227 AromaticContact CE1-CG 3.95Å; F187-F227 HydrophobicContact CE1-CG 3.95Å; F187-F227 HydrophobicContact CG-CD2 4.17Å; F187-F227 HydrophobicContact CG-CE2 4.32Å; F187-F227 HydrophobicContact CZ-CB 3.88Å; F187-F227 HydrophobicContact CZ-CD2 4.23Å; F187-F227 HydrophobicContact CZ-CG 4.21Å; A190-F227 HydrophobicContact CB-CD2 4.28Å; A190-F227 HydrophobicContact CB-CE2 3.59Å; A223-F227 HydrophobicContact CB-CD2 4.3Å; A223-F227 WeakPolarHBondContact O-CB 3.37Å; A223-F227 WeakPolarHBondContact O-CD2 3.4Å; A223-F227 PolarHBondContact O-N 2.82Å; F227-N229 PolarHBondContact O-N 3.29Å; F227-Q230 HydrophobicContact CD1-CG 4.19Å; F227-Q230 WeakPolarHBondContact O-CB 3.42Å; F227-Q230 PolarHBondContact O-N 3.46Å; F227-Q230 VanDerWaalsContact O-N 3.15Å; F227-M237 HydrophobicContact CB-SD 4.1Å; F227-M237 VanDerWaalsContact O-CG 3.24Å; F227-M237 WeakPolarHBondContact O-CG 3.32Å; F227-V239 HydrophobicContact CB-CG2 3.86Å; F227-V239 WeakPolarHBondContact O-CG2 3.28Å
228	N	87.4	Confident	85.2	Confident	66 Å²	66	62.7 Å²	62.7	35%	0.353	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	130	174.4	-173	49.5	0	0	0	110.8	V224 Q230 V239	V224-N228 WeakPolarHBondContact O-CB 3.4Å; V224-N228 PolarHBondContact O-N 2.8Å; V224-N228 VanDerWaalsContact O-N 3.1Å; N228-Q230 VanDerWaalsContact C-N 3.28Å; N228-Q230 PolarHBondContact O-N 3.2Å; N228-V239 HydrophobicContact CB-CB 4.18Å; N228-V239 PolarHBondContact OD1-N 3.22Å; N228-V239 PolarHBondContact OD1-O 3.43Å
229	N	86.8	Confident	85.5	Confident	104 Å²	104	58.6 Å²	58.6	56%	0.556	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.2	10.7	-173.5	-60.9	9	0	0	0	116.3	F227 M237	F227-N229 PolarHBondContact O-N 3.29Å; N229-M237 VanDerWaalsContact CA-O 3.25Å; N229-M237 WeakPolarHBondContact CA-O 3.48Å; N229-M237 PolarHBondContact N-O 3.42Å
230	Q	84.9	Confident	85.5	Confident	99 Å²	99	62.8 Å²	62.8	46%	0.463	31%	0.306	S	S	.	.			trans	-69.4	135.9	174.4	-70	-67	-6.6	0	0	112.2	M226 F227 N228 P236 M237	M226-Q230 WeakPolarHBondContact O-CG 3.11Å; M226-Q230 PolarHBondContact O-NE2 2.83Å; F227-Q230 HydrophobicContact CD1-CG 4.19Å; F227-Q230 WeakPolarHBondContact O-CB 3.42Å; F227-Q230 PolarHBondContact O-N 3.46Å; F227-Q230 VanDerWaalsContact O-N 3.15Å; N228-Q230 VanDerWaalsContact C-N 3.28Å; N228-Q230 PolarHBondContact O-N 3.2Å; Q230-P236 CarbonylContact O-C 3.52Å; Q230-P236 WeakPolarHBondContact O-CA 3.45Å; Q230-M237 HydrophobicContact CB-CE 4.17Å; Q230-M237 HydrophobicContact CB-CG 4.3Å; Q230-M237 WeakPolarHBondContact O-CG 3.39Å; Q230-M237 PolarHBondContact O-N 3.29Å
231	I	83.2	Confident	85.5	Confident	123 Å²	123	63.8 Å²	63.8	63%	0.631	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.9	124.3	178.9	-56.9	173.9	0	0	0	109.8	R235	I231-R235 WeakPolarHBondContact CA-O 3.49Å
232	L	78.4	Confident	85.4	Confident	25 Å²	25	64.6 Å²	64.6	13%	0.131	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	113.9	174.9	-179.1	68.7	0	0	0	109	L174 V178 V186 R235 M237	L174-L232 HydrophobicContact CD2-CD2 4.34Å; V178-L232 HydrophobicContact CG1-CD2 4.09Å; V178-L232 HydrophobicContact CG2-CD2 3.72Å; V178-L232 HydrophobicContact CG2-CG 4.14Å; V186-L232 HydrophobicContact CG2-CD1 4.37Å; L232-R235 PolarHBondContact N-O 3.09Å; L232-R235 PolarHBondContact O-N 3.42Å; L232-M237 HydrophobicContact CB-CE 3.52Å; L232-M237 HydrophobicContact CD2-CE 3.8Å; L232-M237 HydrophobicContact CG-CE 4.23Å
233	K	75.7	Confident	84.6	Confident	109 Å²	109	71.1 Å²	71.1	47%	0.474	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.9	60.5	-172.4	-62.1	-175.8	173.3	-173.4	0	111.3	D175 S177 V178 R235	D175-K233 HydrophobicContact CB-CB 3.95Å; S177-K233 PolarHBondContact O-NZ 3.08Å; V178-K233 HydrophobicContact CG2-CD 4.33Å; K233-R235 PolarHBondContact O-N 3.33Å
234	D	80.6	Confident	83.4	Confident	156 Å²	156	79.4 Å²	79.4	83%	0.834	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.8	9.1	175.6	-51.5	-59.6	0	0	0	116.7
235	R	84.6	Confident	82	Confident	57 Å²	57	79.6 Å²	79.6	22%	0.215	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	130.2	175.8	-66.9	176.6	65	176.8	1.6	111.9	N173 L174 Y176 I231 L232 K233 M237	N173-R235 PolarHBondContact OD1-NE 3.33Å; N173-R235 PolarHBondContact OD1-NH2 3.46Å; L174-R235 PolarHBondContact O-NH1 3.13Å; Y176-R235 VanDerWaalsContact CE2-NH1 3.34Å; I231-R235 WeakPolarHBondContact CA-O 3.49Å; L232-R235 PolarHBondContact N-O 3.09Å; L232-R235 PolarHBondContact O-N 3.42Å; K233-R235 PolarHBondContact O-N 3.33Å; R235-M237 PolarHBondContact O-N 2.69Å
236	P	87.1	Confident	80.7	Confident	63 Å²	63	78.7 Å²	78.7	41%	0.409	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	114.4	176	29.2	-32.7	0	0	0	110.5	N173 Q230	N173-P236 PolarHBondContact ND2-O 3.18Å; Q230-P236 CarbonylContact O-C 3.52Å; Q230-P236 WeakPolarHBondContact O-CA 3.45Å
237	M	88.9	Confident	79.3	Confident	4 Å²	4	79.2 Å²	79.2	2%	0.02	39%	0.387	C	S	.	.			trans	-70.8	141.6	175.9	76.9	-177.7	76	0	0	110.7	V171 L174 V186 F187 F227 N229 Q230 L232 R235 V239	V171-M237 HydrophobicContact CG1-CB 4.32Å; L174-M237 HydrophobicContact CD2-CB 4.23Å; V186-M237 HydrophobicContact CG1-CE 4.45Å; F187-M237 HydrophobicContact CE2-SD 3.98Å; F187-M237 HydrophobicContact CZ-SD 4.03Å; F227-M237 HydrophobicContact CB-SD 4.1Å; F227-M237 VanDerWaalsContact O-CG 3.24Å; F227-M237 WeakPolarHBondContact O-CG 3.32Å; N229-M237 VanDerWaalsContact CA-O 3.25Å; N229-M237 WeakPolarHBondContact CA-O 3.48Å; N229-M237 PolarHBondContact N-O 3.42Å; Q230-M237 HydrophobicContact CB-CE 4.17Å; Q230-M237 HydrophobicContact CB-CG 4.3Å; Q230-M237 WeakPolarHBondContact O-CG 3.39Å; Q230-M237 PolarHBondContact O-N 3.29Å; L232-M237 HydrophobicContact CB-CE 3.52Å; L232-M237 HydrophobicContact CD2-CE 3.8Å; L232-M237 HydrophobicContact CG-CE 4.23Å; R235-M237 PolarHBondContact O-N 2.69Å; M237-V239 HydrophobicContact CG-CG2 3.9Å; M237-V239 HydrophobicContact SD-CG2 4.15Å
238	R	89	Confident	77.7	Confident	131 Å²	131	79.2 Å²	79.2	49%	0.494	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	119.3	177.3	-177.7	-171.1	-59.9	-83	6.1	109	V171 S172	V171-R238 WeakPolarHBondContact CA-O 3.44Å; S172-R238 PolarHBondContact N-O 3.24Å; S172-R238 PolarHBondContact O-N 3.09Å; S172-R238 PolarHBondContact OG-O 2.79Å; S172-R238 VanDerWaalsContact OG-O 3.13Å
239	V	90.6	Very high	75.8	Confident	2 Å²	2	81.4 Å²	81.4	1%	0.012	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	129.7	-169.2	-171.4	0	0	0	0	108.6	V169 V171 F187 V224 F227 N228 M237	V169-V239 HydrophobicContact CG1-CG1 3.31Å; V171-V239 HydrophobicContact CG1-CG2 4.29Å; V171-V239 HydrophobicContact CG2-CG1 4.31Å; V171-V239 HydrophobicContact CG2-CG2 4.45Å; F187-V239 HydrophobicContact CE1-CG1 3.88Å; F187-V239 HydrophobicContact CE1-CG2 4.34Å; F187-V239 HydrophobicContact CZ-CG1 4.09Å; F187-V239 HydrophobicContact CZ-CG2 3.84Å; V224-V239 HydrophobicContact CB-CG1 4.4Å; V224-V239 HydrophobicContact CG2-CG1 3.96Å; F227-V239 HydrophobicContact CB-CG2 3.86Å; F227-V239 WeakPolarHBondContact O-CG2 3.28Å; N228-V239 HydrophobicContact CB-CB 4.18Å; N228-V239 PolarHBondContact OD1-N 3.22Å; N228-V239 PolarHBondContact OD1-O 3.43Å; M237-V239 HydrophobicContact CG-CG2 3.9Å; M237-V239 HydrophobicContact SD-CG2 4.15Å
240	K	88	Confident	73.8	Confident	118 Å²	118	83 Å²	83	51%	0.513	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	154.3	-179	-67.1	-169.2	172.2	-166.3	0	110.5	V169 Y170 D242	V169-K240 CarbonylContact C-O 3.58Å; V169-K240 WeakPolarHBondContact CA-O 3.28Å; V169-K240 WeakPolarHBondContact CG1-O 3.46Å; Y170-K240 PolarHBondContact N-O 3.03Å; Y170-K240 PolarHBondContact O-N 3.25Å; K240-D242 PolarHBondContact O-N 2.76Å
241	I	87.6	Confident	71.7	Confident	22 Å²	22	83.4 Å²	83.4	11%	0.113	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	131.9	167.6	-59.7	-61	0	0	0	108.9	I161 V165 T166 A220 V221 V224	I161-I241 HydrophobicContact CD1-CD1 4.47Å; I161-I241 HydrophobicContact CD1-CG1 3.77Å; I161-I241 HydrophobicContact CG1-CG1 4.05Å; I161-I241 HydrophobicContact CG2-CB 4.28Å; I161-I241 HydrophobicContact CG2-CG1 3.86Å; V165-I241 HydrophobicContact CG1-CD1 4.37Å; T166-I241 WeakPolarHBondContact OG1-CG2 3.03Å; A220-I241 HydrophobicContact CB-CD1 4.02Å; V221-I241 HydrophobicContact CG2-CD1 4.18Å; V224-I241 HydrophobicContact CG2-CD1 3.71Å; V224-I241 HydrophobicContact CG2-CG1 4.09Å
242	D	83.7	Confident	69.6	Low	21 Å²	21	80.9 Å²	80.9	11%	0.112	41%	0.414	C	S	.	.			trans	-82.7	123.7	178.4	-177.5	26.8	0	0	0	110.8	T166 S168 K240 Q244 G245	T166-D242 WeakPolarHBondContact CB-O 3.46Å; T166-D242 WeakPolarHBondContact CG2-O 3.42Å; T166-D242 PolarHBondContact OG1-O 3.18Å; S168-D242 PolarHBondContact O-N 3.37Å; K240-D242 PolarHBondContact O-N 2.76Å; D242-Q244 VanDerWaalsContact C-N 3.26Å; D242-Q244 PolarHBondContact O-N 2.83Å; D242-Q244 PolarHBondContact OD1-N 3.03Å; D242-G245 PolarHBondContact O-N 3.06Å; D242-G245 PolarHBondContact OD2-N 3.3Å
243	R	69.7	Low	67.6	Low	191 Å²	191	83.9 Å²	83.9	72%	0.721	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-12.7	178.3	-69.6	-176.5	173.2	178.2	-1	113.4	D162	D162-R243 PolarHBondContact O-NE 3.24Å; D162-R243 PolarHBondContact O-NH2 2.78Å
244	Q	62.4	Low	65.7	Low	174 Å²	174	85.1 Å²	85.1	81%	0.813	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-2	174.5	-57.2	-64.3	-22	0	0	112.9	D242	D242-Q244 VanDerWaalsContact C-N 3.26Å; D242-Q244 PolarHBondContact O-N 2.83Å; D242-Q244 PolarHBondContact OD1-N 3.03Å
245	G	58	Low	64	Low	10 Å²	10	82.4 Å²	82.4	10%	0.103	42%	0.423	C	S	.	.	S	Bend	trans	-63	162.6	173.4	0	0	0	0	0	112.7	D242 P247	D242-G245 PolarHBondContact O-N 3.06Å; D242-G245 PolarHBondContact OD2-N 3.3Å; G245-P247 WeakPolarHBondContact O-CD 3.48Å; G245-P247 VanDerWaalsContact O-N 3.16Å
246	T	58.2	Low	62	Low	80 Å²	80	83.6 Å²	83.6	49%	0.491	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-61.7	121.1	170.5	-52.5	0	0	0	0	107.5	D167 K213 A248	D167-T246 PolarHBondContact OD1-N 3.21Å; K213-T246 PolarHBondContact NZ-OG1 3.06Å; T246-A248 PolarHBondContact O-N 2.83Å; T246-A248 VanDerWaalsContact O-N 3.13Å
247	P	55.9	Low	59.8	Low	87 Å²	87	86 Å²	86	57%	0.565	46%	0.456	S	S	*	.	B	Isolated β-bridge	trans	-61.2	123.1	176.8	25.3	-32.5	0	0	0	107.4	G245	G245-P247 WeakPolarHBondContact O-CD 3.48Å; G245-P247 VanDerWaalsContact O-N 3.16Å
248	A	51.4	Low	57.7	Low	21 Å²	21	94.3 Å²	94.3	17%	0.174	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-60.5	137.6	175.1	0	0	0	0	0	107.9	V165 A217 T246 V250 I252	V165-A248 WeakPolarHBondContact O-CB 3.36Å; V165-A248 PolarHBondContact O-N 2.91Å; A217-A248 HydrophobicContact CB-CB 3.82Å; T246-A248 PolarHBondContact O-N 2.83Å; T246-A248 VanDerWaalsContact O-N 3.13Å; A248-V250 PolarHBondContact O-N 2.87Å; A248-I252 HydrophobicContact CB-CG1 4.25Å
249	P	48.3	Very low	55.1	Low	112 Å²	112	100 Å²	100	73%	0.727	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-55	140.1	168.2	25.8	-33.5	0	0	0	108	N251	P249-N251 PolarHBondContact O-N 3.26Å
250	V	44.2	Very low	52.5	Low	137 Å²	137	105.5 Å²	105.5	83%	0.83	55%	0.551	S	S	*	*	S	Bend	trans	-63.3	9.2	-166.8	-72.8	0	0	0	0	116.2	A248 I252	A248-V250 PolarHBondContact O-N 2.87Å; V250-I252 PolarHBondContact O-N 3.13Å; V250-I252 VanDerWaalsContact O-N 3.14Å
251	N	40.6	Very low	50	Low	108 Å²	108	103.9 Å²	103.9	58%	0.578	57%	0.567	S	S	*	*			trans	-81.5	50.8	166.6	-88.1	31.7	0	0	0	112.1	E140 P249 L253	E140-N251 PolarHBondContact OE2-ND2 2.84Å; P249-N251 PolarHBondContact O-N 3.26Å; N251-L253 PolarHBondContact O-N 3.03Å
252	I	37.9	Very low	47.9	Very low	70 Å²	70	108.3 Å²	108.3	36%	0.359	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.2	66.5	-178.7	-47.8	156.4	0	0	0	110.4	V165 A217 A248 V250	V165-I252 HydrophobicContact CB-CD1 4.01Å; V165-I252 HydrophobicContact CG2-CD1 4.29Å; A217-I252 HydrophobicContact CB-CG2 4.38Å; A248-I252 HydrophobicContact CB-CG1 4.25Å; V250-I252 PolarHBondContact O-N 3.13Å; V250-I252 VanDerWaalsContact O-N 3.14Å
253	L	36.4	Very low	45.7	Very low	88 Å²	88	113.5 Å²	113.5	46%	0.461	64%	0.638	S	S	.	*	T	Hydrogen-bonded Turn	trans	-159.8	23.4	164.8	-141.4	77.7	0	0	0	117.9	V150 N251	V150-L253 HydrophobicContact CG1-CD1 4.09Å; V150-L253 HydrophobicContact CG1-CD2 3.84Å; V150-L253 HydrophobicContact CG1-CG 4.48Å; V150-L253 HydrophobicContact CG2-CD2 4.24Å; N251-L253 PolarHBondContact O-N 3.03Å
254	Y	37.8	Very low	44.1	Very low	136 Å²	136	107.7 Å²	107.7	53%	0.533	64%	0.638	S	S	.	*			trans	-132.5	133.6	169.7	-74.4	-84.1	0	0	0	112.8	V142	V142-Y254 HydrophobicContact CG2-CE1 4.05Å; V142-Y254 HydrophobicContact CG2-CE2 4.11Å; V142-Y254 PolarHBondContact O-OH 3.07Å
255	P	43.6	Very low	42.9	Very low	98 Å²	98	106.8 Å²	106.8	64%	0.636	64%	0.637	S	S	*	*			trans	-64.9	155.3	165.2	30.4	-34.3	0	0	0	109.5	S257	P255-S257 PolarHBondContact O-N 3.45Å
256	P	43.1	Very low	41.7	Very low	83 Å²	83	114.5 Å²	114.5	54%	0.539	68%	0.675	S	S	.	*			trans	-75.5	107.2	-178.1	31.9	-27.6	0	0	0	108.3	N216 Q258	N216-P256 WeakPolarHBondContact ND2-CD 3.47Å; N216-P256 WeakPolarHBondContact OD1-CG 3.39Å; P256-Q258 PolarHBondContact O-N 3.43Å
257	S	41.1	Very low	40.3	Very low	113 Å²	113	113.7 Å²	113.7	79%	0.79	68%	0.683	S	S	*	*			trans	-52.7	127.4	166.2	-67.8	0	0	0	0	109	P255 R259	P255-S257 PolarHBondContact O-N 3.45Å; S257-R259 PolarHBondContact O-N 3.32Å
258	Q	43.4	Very low	39.3	Very low	178 Å²	178	114.7 Å²	114.7	83%	0.832	69%	0.692	S	S	*	*			trans	-63.4	93.7	-168.6	-61.8	178.6	24.4	0	0	111.4	P256 T260	P256-Q258 PolarHBondContact O-N 3.43Å; Q258-T260 PolarHBondContact O-N 2.82Å
259	R	34.7	Very low	38.4	Very low	251 Å²	251	119.7 Å²	119.7	95%	0.947	72%	0.72	S	S	*	*			trans	-78.3	97.7	164.2	-80.9	-173.5	166.2	-157	-2.8	108.6	S257	S257-R259 PolarHBondContact O-N 3.32Å
260	T	35.8	Very low	37.7	Very low	118 Å²	118	119.3 Å²	119.3	72%	0.724	72%	0.72	S	S	*	*			trans	-128.2	112.1	173.2	50.7	0	0	0	0	110.5	Q258	Q258-T260 PolarHBondContact O-N 2.82Å
261	G	35.7	Very low	37	Very low	83 Å²	83	117.6 Å²	117.6	86%	0.856	71%	0.714	S	S	*	*			trans	75	142.4	177.6	0	0	0	0	0	114.4
262	S	43.7	Very low	36.8	Very low	116 Å²	116	121 Å²	121	81%	0.811	73%	0.729	S	S	*	*			cis	-155.1	132.3	-1.1	179.2	0	0	0	0	110
263	S	38.2	Very low	36.6	Very low	129 Å²	129	125.3 Å²	125.3	90%	0.902	75%	0.751	S	S	*	*			trans	-151.3	99.4	155.9	-81.7	0	0	0	0	106.6
264	G	36.5	Very low	36.5	Very low	70 Å²	70	126.5 Å²	126.5	72%	0.722	76%	0.764	S	S	*	*			trans	-87.5	149.5	-170.6	0	0	0	0	0	113.7
265	I	37.5	Very low	36.1	Very low	155 Å²	155	124.7 Å²	124.7	80%	0.795	77%	0.771	S	S	*	*			trans	-137.2	118.5	159.9	-66.5	-174	0	0	0	107.9
266	L	30.8	Very low	35.7	Very low	171 Å²	171	128 Å²	128	90%	0.895	78%	0.784	S	S	*	*			trans	57.3	125.9	158.2	-63.5	165.4	0	0	0	120.5
267	G	29.8	Very low	35.4	Very low	64 Å²	64	129.4 Å²	129.4	66%	0.66	79%	0.793	S	S	*	*			trans	121.8	91	132.9	0	0	0	0	0	118.6
268	S	35.8	Very low	34.8	Very low	108 Å²	108	130 Å²	130	76%	0.755	79%	0.786	S	S	*	*			trans	60.7	123.9	141.7	35	0	0	0	0	121.9
269	T	32.2	Very low	34.4	Very low	125 Å²	125	128.4 Å²	128.4	77%	0.767	78%	0.782	S	S	*	*			trans	69.8	107.5	142.8	58.8	0	0	0	0	120.9
270	S	32.1	Very low	34.4	Very low	105 Å²	105	122.4 Å²	122.4	73%	0.734	77%	0.769	S	S	*	*				80.8	99.2	124.6	-54.4	0	0	0	0	120.9
271	S	31	Very low	34.2	Very low	101 Å²	101	122.7 Å²	122.7	71%	0.706	77%	0.766	S	S	*	*				86.1	148.2	125	76	0	0	0	0	121.5
272	M	36.6	Very low	34.3	Very low	179 Å²	179	127.3 Å²	127.3	88%	0.882	77%	0.765	S	S	*	*			trans	85.4	104.1	162.1	-50.2	-158.7	-179.2	0	0	118.4
273	I	31.9	Very low	34.2	Very low	161 Å²	161	125.9 Å²	125.9	83%	0.826	75%	0.746	S	S	*	*			trans	-104.9	135.6	167	-58.1	165.6	0	0	0	107.8
274	P	34.9	Very low	34	Very low	112 Å²	112	125.4 Å²	125.4	73%	0.727	73%	0.729	S	S	*	*			trans	-131.8	124.5	132.7	29.7	-15.8	0	0	0	110.4
275	S	29.7	Very low	33.8	Very low	99 Å²	99	126 Å²	126	69%	0.692	72%	0.722	S	S	*	*				63.1	109.6	78.1	-59.3	0	0	0	0	113.3
276	N	34.2	Very low	33.8	Very low	167 Å²	167	121.2 Å²	121.2	89%	0.893	70%	0.703	S	S	*	*			trans	-160.8	157.3	160	-101.5	-26.4	0	0	0	110.9
277	P	38	Very low	34.4	Very low	113 Å²	113	117.1 Å²	117.1	73%	0.734	68%	0.682	S	S	*	*			trans	-118	172.1	-131.3	40.4	-32.2	0	0	0	116.6
278	I	28.8	Very low	34.9	Very low	126 Å²	126	119.8 Å²	119.8	65%	0.646	68%	0.68	S	S	*	*			trans	-62.6	144.2	175	-62.9	160.9	0	0	0	111.1
279	L	33.6	Very low	35.2	Very low	144 Å²	144	119.4 Å²	119.4	75%	0.754	67%	0.668	S	S	*	*			trans	-128	141.1	171.4	-89.5	168.1	0	0	0	111.6
280	N	34.6	Very low	35.7	Very low	125 Å²	125	115.8 Å²	115.8	67%	0.668	65%	0.651	S	S	*	*			trans	-81.5	148.3	-160.5	-74.4	-26.3	0	0	0	115.4	Q282 Q283	N280-Q282 PolarHBondContact O-N 3.46Å; N280-Q283 WeakPolarHBondContact O-CB 3.38Å; N280-Q283 PolarHBondContact O-N 2.95Å
281	D	32.9	Very low	36	Very low	124 Å²	124	113.5 Å²	113.5	66%	0.663	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-11.7	178.3	-108.4	-64.4	0	0	0	115.6	Q283 Q284	D281-Q283 PolarHBondContact O-N 3.13Å; D281-Q284 PolarHBondContact O-N 3.44Å; D281-Q284 PolarHBondContact OD1-NE2 2.97Å
282	Q	38.6	Very low	36.5	Very low	179 Å²	179	112.7 Å²	112.7	84%	0.836	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	-11.9	171	-157.7	171.3	-2.3	0	0	112.5	N280	N280-Q282 PolarHBondContact O-N 3.46Å
283	Q	39.9	Very low	36.9	Very low	86 Å²	86	106.6 Å²	106.6	40%	0.402	60%	0.598	S	S	.	*	H	α-helix	trans	-83	-19.1	179.5	-150.2	168.6	-9.2	0	0	113.5	N280 D281 S285 S286 N287	N280-Q283 WeakPolarHBondContact O-CB 3.38Å; N280-Q283 PolarHBondContact O-N 2.95Å; D281-Q283 PolarHBondContact O-N 3.13Å; Q283-S285 PolarHBondContact O-N 3.28Å; Q283-S286 VanDerWaalsContact CA-OG 3.3Å; Q283-S286 WeakPolarHBondContact CA-OG 2.96Å; Q283-S286 CarbonylContact O-C 3.56Å; Q283-S286 PolarHBondContact O-N 2.89Å; Q283-S286 PolarHBondContact O-OG 3.46Å; Q283-N287 WeakPolarHBondContact O-CB 3.02Å; Q283-N287 PolarHBondContact O-N 3.33Å; Q283-N287 PolarHBondContact O-ND2 3.35Å; Q283-N287 PolarHBondContact O-OD1 3.09Å
284	Q	35.5	Very low	37.6	Very low	120 Å²	120	104.4 Å²	104.4	56%	0.561	59%	0.593	S	S	*	*	H	α-helix	trans	-64.9	-37.9	-178.8	-61.6	-153.5	36.2	0	0	112.7	D281 N287 I288	D281-Q284 PolarHBondContact O-N 3.44Å; D281-Q284 PolarHBondContact OD1-NE2 2.97Å; Q284-N287 PolarHBondContact O-N 3.03Å; Q284-I288 PolarHBondContact O-N 3.39Å
285	S	32.4	Very low	37.9	Very low	82 Å²	82	104.7 Å²	104.7	57%	0.573	59%	0.587	S	S	*	*	H	α-helix	trans	-67.8	-37.5	174.3	-50.6	0	0	0	0	112.3	Q283 I289	Q283-S285 PolarHBondContact O-N 3.28Å; S285-I289 WeakPolarHBondContact O-CG1 3.37Å; S285-I289 PolarHBondContact O-N 3.14Å
286	S	36.4	Very low	38.7	Very low	54 Å²	54	102.9 Å²	102.9	38%	0.378	57%	0.57	S	S	.	*	H	α-helix	trans	-73.9	-24.5	174.2	54.8	0	0	0	0	113.1	Q283 I289 A290	Q283-S286 VanDerWaalsContact CA-OG 3.3Å; Q283-S286 WeakPolarHBondContact CA-OG 2.96Å; Q283-S286 CarbonylContact O-C 3.56Å; Q283-S286 PolarHBondContact O-N 2.89Å; Q283-S286 PolarHBondContact O-OG 3.46Å; S286-I289 PolarHBondContact O-N 2.81Å; S286-A290 WeakPolarHBondContact O-CB 3.34Å; S286-A290 PolarHBondContact O-N 3.33Å
287	N	42.5	Very low	38.8	Very low	86 Å²	86	98 Å²	98	46%	0.46	56%	0.558	S	S	.	*	H	α-helix	trans	-69.9	-37	177.1	-68.8	-18.5	0	0	0	111.7	Q283 Q284 A291	Q283-N287 WeakPolarHBondContact O-CB 3.02Å; Q283-N287 PolarHBondContact O-N 3.33Å; Q283-N287 PolarHBondContact O-ND2 3.35Å; Q283-N287 PolarHBondContact O-OD1 3.09Å; Q284-N287 PolarHBondContact O-N 3.03Å; N287-A291 WeakPolarHBondContact O-CB 2.93Å; N287-A291 PolarHBondContact O-N 3.19Å
288	I	40.8	Very low	38.8	Very low	120 Å²	120	96.7 Å²	96.7	62%	0.615	55%	0.545	S	S	*	.	H	α-helix	trans	-69	-42.4	174.6	-61	169.8	0	0	0	110.3	Q284 A291 L292	Q284-I288 PolarHBondContact O-N 3.39Å; I288-A291 PolarHBondContact O-N 3.27Å; I288-L292 WeakPolarHBondContact O-CB 3.43Å; I288-L292 PolarHBondContact O-N 3.49Å
289	I	43.1	Very low	39.1	Very low	100 Å²	100	99.4 Å²	99.4	51%	0.513	55%	0.552	S	S	.	*	H	α-helix	trans	-68.2	-42.3	177.6	-63.6	168.5	0	0	0	111.1	S285 S286 L292 V293	S285-I289 WeakPolarHBondContact O-CG1 3.37Å; S285-I289 PolarHBondContact O-N 3.14Å; S286-I289 PolarHBondContact O-N 2.81Å; I289-L292 WeakPolarHBondContact O-CB 3.24Å; I289-L292 PolarHBondContact O-N 2.73Å; I289-V293 HydrophobicContact CG2-CG2 4.47Å; I289-V293 WeakPolarHBondContact O-CG2 3.41Å; I289-V293 PolarHBondContact O-N 3.41Å
290	A	41.2	Very low	39.1	Very low	48 Å²	48	97.7 Å²	97.7	40%	0.397	55%	0.547	S	S	.	.	H	α-helix	trans	-66.7	-37.3	175.1	0	0	0	0	0	111.7	S286 V293 T294	S286-A290 WeakPolarHBondContact O-CB 3.34Å; S286-A290 PolarHBondContact O-N 3.33Å; A290-V293 PolarHBondContact O-N 3.03Å; A290-T294 WeakPolarHBondContact O-CB 3.34Å; A290-T294 PolarHBondContact O-N 3.2Å; A290-T294 PolarHBondContact O-OG1 3.06Å
291	A	39.3	Very low	38.8	Very low	57 Å²	57	98.2 Å²	98.2	47%	0.471	55%	0.55	S	S	.	*	H	α-helix	trans	-62.6	-43.8	171.2	0	0	0	0	0	111.2	N287 I288 T294 L295	N287-A291 WeakPolarHBondContact O-CB 2.93Å; N287-A291 PolarHBondContact O-N 3.19Å; I288-A291 PolarHBondContact O-N 3.27Å; A291-T294 PolarHBondContact O-N 3.41Å; A291-L295 WeakPolarHBondContact O-CB 3.34Å; A291-L295 PolarHBondContact O-N 3.38Å
292	L	42.1	Very low	38.7	Very low	85 Å²	85	97.1 Å²	97.1	45%	0.445	56%	0.558	S	S	.	*	H	α-helix	trans	-60.5	-49.3	173.3	-98.6	158.8	0	0	0	112.3	I288 I289 T294 L295 L296	I288-L292 WeakPolarHBondContact O-CB 3.43Å; I288-L292 PolarHBondContact O-N 3.49Å; I289-L292 WeakPolarHBondContact O-CB 3.24Å; I289-L292 PolarHBondContact O-N 2.73Å; L292-T294 VanDerWaalsContact C-N 3.32Å; L292-T294 PolarHBondContact O-N 3.15Å; L292-L295 PolarHBondContact O-N 3.46Å; L292-L296 HydrophobicContact CB-CD1 4.49Å; L292-L296 HydrophobicContact CD2-CD1 3.94Å; L292-L296 HydrophobicContact CD2-CG 4.44Å; L292-L296 WeakPolarHBondContact O-CB 3.19Å; L292-L296 WeakPolarHBondContact O-CD1 3.49Å; L292-L296 WeakPolarHBondContact O-CG 3.46Å; L292-L296 PolarHBondContact O-N 3.31Å
293	V	43.8	Very low	38.1	Very low	51 Å²	51	95.1 Å²	95.1	31%	0.309	55%	0.553	S	S	.	*	H	α-helix	trans	-61.7	-39.8	178	169.3	0	0	0	0	111.7	I289 A290 G297 L298	I289-V293 HydrophobicContact CG2-CG2 4.47Å; I289-V293 WeakPolarHBondContact O-CG2 3.41Å; I289-V293 PolarHBondContact O-N 3.41Å; A290-V293 PolarHBondContact O-N 3.03Å; V293-G297 PolarHBondContact O-N 2.96Å; V293-L298 HydrophobicContact CG1-CB 4.36Å; V293-L298 PolarHBondContact O-N 3.42Å
294	T	48	Very low	37.6	Very low	115 Å²	115	96.4 Å²	96.4	71%	0.706	57%	0.572	S	S	*	*	H	α-helix	trans	-70.2	-36.9	176.7	-53.9	0	0	0	0	111.9	A290 A291 L292	A290-T294 WeakPolarHBondContact O-CB 3.34Å; A290-T294 PolarHBondContact O-N 3.2Å; A290-T294 PolarHBondContact O-OG1 3.06Å; A291-T294 PolarHBondContact O-N 3.41Å; L292-T294 VanDerWaalsContact C-N 3.32Å; L292-T294 PolarHBondContact O-N 3.15Å
295	L	40.2	Very low	37.4	Very low	118 Å²	118	97.6 Å²	97.6	62%	0.618	58%	0.582	S	S	*	*	H	α-helix	trans	-75.6	-31.3	178	-169.5	70.9	0	0	0	112.6	A291 L292 G297	A291-L295 WeakPolarHBondContact O-CB 3.34Å; A291-L295 PolarHBondContact O-N 3.38Å; L292-L295 PolarHBondContact O-N 3.46Å; L295-G297 VanDerWaalsContact C-N 3.33Å
296	L	45.7	Very low	37.5	Very low	61 Å²	61	98.7 Å²	98.7	32%	0.319	59%	0.587	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.6	-6.2	177.5	-71.7	165.2	0	0	0	113.5	L292 L298	L292-L296 HydrophobicContact CB-CD1 4.49Å; L292-L296 HydrophobicContact CD2-CD1 3.94Å; L292-L296 HydrophobicContact CD2-CG 4.44Å; L292-L296 WeakPolarHBondContact O-CB 3.19Å; L292-L296 WeakPolarHBondContact O-CD1 3.49Å; L292-L296 WeakPolarHBondContact O-CG 3.46Å; L292-L296 PolarHBondContact O-N 3.31Å; L296-L298 HydrophobicContact CB-CD1 3.85Å; L296-L298 HydrophobicContact CB-CG 3.88Å; L296-L298 HydrophobicContact CD1-CD1 3.91Å; L296-L298 PolarHBondContact O-N 3.43Å; L296-L298 VanDerWaalsContact O-N 3.16Å
297	G	37.2	Very low	37.3	Very low	63 Å²	63	103.4 Å²	103.4	65%	0.649	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	63.2	18.4	-178.6	0	0	0	0	0	114.3	V293 L295 K299	V293-G297 PolarHBondContact O-N 2.96Å; L295-G297 VanDerWaalsContact C-N 3.33Å; G297-K299 PolarHBondContact O-N 3.31Å
298	L	38.2	Very low	36.9	Very low	87 Å²	87	103.6 Å²	103.6	46%	0.455	61%	0.611	S	S	.	*			trans	-71.7	94.1	-175.7	-74.7	168.8	0	0	0	110.2	V293 L296 T300	V293-L298 HydrophobicContact CG1-CB 4.36Å; V293-L298 PolarHBondContact O-N 3.42Å; L296-L298 HydrophobicContact CB-CD1 3.85Å; L296-L298 HydrophobicContact CB-CG 3.88Å; L296-L298 HydrophobicContact CD1-CD1 3.91Å; L296-L298 PolarHBondContact O-N 3.43Å; L296-L298 VanDerWaalsContact O-N 3.16Å; L298-T300 PolarHBondContact O-N 3.39Å
299	K	34.8	Very low	36.6	Very low	183 Å²	183	99.9 Å²	99.9	80%	0.796	60%	0.603	S	S	*	*			trans	-70.7	88	-178.8	-164.2	177.1	-176.2	-176.6	0	110.7	G297 N301	G297-K299 PolarHBondContact O-N 3.31Å; K299-N301 PolarHBondContact O-N 2.87Å
300	T	33.3	Very low	36.3	Very low	107 Å²	107	100.8 Å²	100.8	66%	0.656	61%	0.607	S	S	*	*			trans	-69.4	112.1	170.2	53.4	0	0	0	0	109.3	L298 A302	L298-T300 PolarHBondContact O-N 3.39Å; T300-A302 PolarHBondContact O-N 3.42Å
301	N	28.8	Very low	36.3	Very low	136 Å²	136	102 Å²	102	73%	0.727	61%	0.606	S	S	*	*			trans	-67	130.4	171.9	-64.1	-59.6	0	0	0	108.8	K299 D303	K299-N301 PolarHBondContact O-N 2.87Å; N301-D303 PolarHBondContact O-N 3Å
302	A	30.5	Very low	36.1	Very low	101 Å²	101	101.9 Å²	101.9	84%	0.835	60%	0.598	S	S	*	*	S	Bend	trans	-84.4	11.5	-165.7	0	0	0	0	0	114.7	T300	T300-A302 PolarHBondContact O-N 3.42Å
303	D	26	Very low	36	Very low	138 Å²	138	102.4 Å²	102.4	74%	0.738	60%	0.604	S	S	*	*	S	Bend	trans	-117.5	126.8	-174.8	-70.6	-64	0	0	0	111.4	N301	N301-D303 PolarHBondContact O-N 3Å
304	S	29.5	Very low	35.7	Very low	113 Å²	113	104.9 Å²	104.9	79%	0.79	62%	0.615	S	S	*	*	S	Bend	trans	58.2	100.9	173.6	56	0	0	0	0	118.2
305	N	32.3	Very low	35.2	Very low	144 Å²	144	105.6 Å²	105.6	77%	0.77	61%	0.605	S	S	*	*			trans	12.2	109.9	154.8	-170.7	20.3	0	0	0	119	Q307	N305-Q307 PolarHBondContact OD1-N 3.46Å
306	P	34	Very low	35.1	Very low	105 Å²	105	104.9 Å²	104.9	68%	0.682	60%	0.602	S	S	*	*				-144.7	91.5	129.8	34.3	-16.7	0	0	0	113.5	S308	P306-S308 PolarHBondContact O-N 3.39Å
307	Q	31.6	Very low	34.6	Very low	153 Å²	153	107.6 Å²	107.6	72%	0.715	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	4	172.3	-77.1	-164.4	-52.6	0	0	115.1	N305 I311	N305-Q307 PolarHBondContact OD1-N 3.46Å; Q307-I311 HydrophobicContact CB-CD1 4.28Å; Q307-I311 HydrophobicContact CG-CD1 4.5Å; Q307-I311 WeakPolarHBondContact O-CD1 3.38Å
308	S	35.1	Very low	34.7	Very low	90 Å²	90	108.1 Å²	108.1	63%	0.629	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.4	2.5	-163.9	53.1	0	0	0	0	116.6	P306	P306-S308 PolarHBondContact O-N 3.39Å
309	G	33.6	Very low	34.6	Very low	42 Å²	42	107.9 Å²	107.9	43%	0.433	62%	0.62	S	S	.	*	S	Bend	trans	-103.7	-64.9	-178.6	0	0	0	0	0	113.5	D312 V313	G309-D312 PolarHBondContact O-N 3.1Å; G309-V313 PolarHBondContact O-N 3.34Å
310	I	37.6	Very low	34.7	Very low	119 Å²	119	106.5 Å²	106.5	61%	0.61	62%	0.621	S	S	*	*	H	α-helix	trans	-80.3	-31.3	-171.4	-58.1	173.5	0	0	0	111.3	D312 V313 L314	I310-D312 VanDerWaalsContact C-N 3.25Å; I310-D312 PolarHBondContact O-N 3.25Å; I310-V313 PolarHBondContact O-N 2.83Å; I310-L314 HydrophobicContact CG2-CD1 4.15Å; I310-L314 PolarHBondContact O-N 3.26Å
311	I	40.1	Very low	34.9	Very low	73 Å²	73	105 Å²	105	37%	0.374	62%	0.62	S	S	.	*	H	α-helix	trans	-64.8	-35.1	173.3	-48.4	-172.4	0	0	0	109.7	Q307 L314 R315	Q307-I311 HydrophobicContact CB-CD1 4.28Å; Q307-I311 HydrophobicContact CG-CD1 4.5Å; Q307-I311 WeakPolarHBondContact O-CD1 3.38Å; I311-L314 PolarHBondContact O-N 3.41Å; I311-R315 VanDerWaalsContact CG2-NH2 3.27Å; I311-R315 WeakPolarHBondContact O-CB 3.28Å; I311-R315 PolarHBondContact O-N 3.01Å
312	D	35.9	Very low	35	Very low	56 Å²	56	106.1 Å²	106.1	30%	0.299	63%	0.626	S	S	.	*	H	α-helix	trans	-71	-32	176.3	-80.2	-83.7	0	0	0	113.5	G309 I310 R315 N316	G309-D312 PolarHBondContact O-N 3.1Å; I310-D312 VanDerWaalsContact C-N 3.25Å; I310-D312 PolarHBondContact O-N 3.25Å; D312-R315 IonicContact OD1-CZ 3.21Å; D312-R315 IonicContact OD1-NH1 3.15Å; D312-R315 PolarHBondContact OD1-NH1 3.44Å; D312-R315 IonicContact OD2-CZ 2.71Å; D312-R315 IonicContact OD2-NH1 3.82Å; D312-R315 PolarHBondContact OD2-NH1 2.91Å; D312-N316 VanDerWaalsContact O-CB 3.32Å; D312-N316 WeakPolarHBondContact O-CB 3.39Å; D312-N316 PolarHBondContact O-N 2.84Å; D312-N316 PolarHBondContact O-ND2 2.86Å
313	V	40.7	Very low	35.1	Very low	96 Å²	96	106.9 Å²	106.9	58%	0.582	62%	0.623	S	S	*	*	H	α-helix	trans	-68.5	-44.1	170.5	177.4	0	0	0	0	111.3	G309 I310 R315 N316 L317	G309-V313 PolarHBondContact O-N 3.34Å; I310-V313 PolarHBondContact O-N 2.83Å; V313-R315 VanDerWaalsContact C-N 3.35Å; V313-N316 PolarHBondContact O-N 2.85Å; V313-L317 PolarHBondContact O-N 2.89Å
314	L	37.2	Very low	35.3	Very low	103 Å²	103	106.3 Å²	106.3	54%	0.539	63%	0.629	S	S	.	*	H	α-helix	trans	-67.4	-34.3	175.8	-75.5	161.7	0	0	0	112.6	I310 I311 L317 A318	I310-L314 HydrophobicContact CG2-CD1 4.15Å; I310-L314 PolarHBondContact O-N 3.26Å; I311-L314 PolarHBondContact O-N 3.41Å; L314-L317 PolarHBondContact O-N 2.78Å; L314-A318 WeakPolarHBondContact O-CB 3.38Å; L314-A318 PolarHBondContact O-N 3.2Å
315	R	36	Very low	35.3	Very low	129 Å²	129	105 Å²	105	49%	0.487	63%	0.633	S	S	.	*	H	α-helix	trans	-70.5	-38.5	175.2	-168.5	-175.1	-63.4	130.8	-1.7	111	I311 D312 V313 A318 S319	I311-R315 VanDerWaalsContact CG2-NH2 3.27Å; I311-R315 WeakPolarHBondContact O-CB 3.28Å; I311-R315 PolarHBondContact O-N 3.01Å; D312-R315 IonicContact OD1-CZ 3.21Å; D312-R315 IonicContact OD1-NH1 3.15Å; D312-R315 PolarHBondContact OD1-NH1 3.44Å; D312-R315 IonicContact OD2-CZ 2.71Å; D312-R315 IonicContact OD2-NH1 3.82Å; D312-R315 PolarHBondContact OD2-NH1 2.91Å; V313-R315 VanDerWaalsContact C-N 3.35Å; R315-A318 PolarHBondContact O-N 3.23Å; R315-S319 VanDerWaalsContact O-CB 3.31Å; R315-S319 WeakPolarHBondContact O-CB 3.44Å; R315-S319 PolarHBondContact O-N 3.26Å; R315-S319 PolarHBondContact O-OG 2.95Å; R315-S319 VanDerWaalsContact O-OG 3.11Å
316	N	38.7	Very low	35.2	Very low	103 Å²	103	101.9 Å²	101.9	55%	0.551	64%	0.636	S	S	*	*	H	α-helix	trans	-66.6	-34.9	170.9	-84.9	-69.5	0	0	0	112.9	D312 V313 S319 N320	D312-N316 VanDerWaalsContact O-CB 3.32Å; D312-N316 WeakPolarHBondContact O-CB 3.39Å; D312-N316 PolarHBondContact O-N 2.84Å; D312-N316 PolarHBondContact O-ND2 2.86Å; V313-N316 PolarHBondContact O-N 2.85Å; N316-S319 WeakPolarHBondContact CA-OG 3.44Å; N316-S319 PolarHBondContact O-OG 2.93Å; N316-N320 PolarHBondContact O-N 3.18Å
317	L	36.2	Very low	34.8	Very low	119 Å²	119	103.8 Å²	103.8	62%	0.623	64%	0.639	S	S	*	*	H	α-helix	trans	-67.1	-37.1	172.6	-125.7	73.3	0	0	0	112	V313 L314	V313-L317 PolarHBondContact O-N 2.89Å; L314-L317 PolarHBondContact O-N 2.78Å
318	A	38.7	Very low	34.9	Very low	74 Å²	74	104.3 Å²	104.3	61%	0.612	65%	0.647	S	S	*	*	H	α-helix	trans	-76.1	-32.4	176.5	0	0	0	0	0	113.4	L314 R315 N320	L314-A318 WeakPolarHBondContact O-CB 3.38Å; L314-A318 PolarHBondContact O-N 3.2Å; R315-A318 PolarHBondContact O-N 3.23Å; A318-N320 VanDerWaalsContact C-N 3.33Å; A318-N320 PolarHBondContact O-N 3.44Å
319	S	36.5	Very low	34.5	Very low	82 Å²	82	105 Å²	105	57%	0.573	65%	0.647	S	S	*	*	H	α-helix	trans	-80.7	-8.3	-177.6	64.4	0	0	0	0	114.5	R315 N316 A321	R315-S319 VanDerWaalsContact O-CB 3.31Å; R315-S319 WeakPolarHBondContact O-CB 3.44Å; R315-S319 PolarHBondContact O-N 3.26Å; R315-S319 PolarHBondContact O-OG 2.95Å; R315-S319 VanDerWaalsContact O-OG 3.11Å; N316-S319 WeakPolarHBondContact CA-OG 3.44Å; N316-S319 PolarHBondContact O-OG 2.93Å; S319-A321 VanDerWaalsContact C-N 3.27Å; S319-A321 PolarHBondContact O-N 3.04Å
320	N	36.5	Very low	34.3	Very low	153 Å²	153	111.5 Å²	111.5	82%	0.818	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	6.2	177.3	-124.4	-4	0	0	0	113.4	N316 A318	N316-N320 PolarHBondContact O-N 3.18Å; A318-N320 VanDerWaalsContact C-N 3.33Å; A318-N320 PolarHBondContact O-N 3.44Å
321	A	37.3	Very low	34	Very low	77 Å²	77	109.1 Å²	109.1	64%	0.636	68%	0.676	S	S	*	*	S	Bend	trans	-103.5	84.7	178.1	0	0	0	0	0	112.1	S319	S319-A321 VanDerWaalsContact C-N 3.27Å; S319-A321 PolarHBondContact O-N 3.04Å
322	N	30.9	Very low	33.4	Very low	158 Å²	158	111.8 Å²	111.8	85%	0.845	70%	0.696	S	S	*	*			trans	70.2	127.6	171	-75.2	-24.9	0	0	0	119.3
323	P	32.9	Very low	33	Very low	118 Å²	118	116 Å²	116	77%	0.766	72%	0.723	S	S	*	*			trans	-94.5	129.5	172.6	35.8	-30.8	0	0	0	112.4
324	S	29.8	Very low	32.4	Very low	126 Å²	126	114.6 Å²	114.6	88%	0.881	73%	0.729	S	S	*	*			trans	173.9	131.1	142.9	34.6	0	0	0	0	113.1
325	G	29	Very low	32.1	Very low	84 Å²	84	115.3 Å²	115.3	87%	0.866	74%	0.742	S	S	*	*			trans	95.2	126.5	156.7	0	0	0	0	0	117.6
326	G	30.5	Very low	31.7	Very low	80 Å²	80	113.9 Å²	113.9	83%	0.825	75%	0.752	S	S	*	*			trans	98.3	56.8	154.4	0	0	0	0	0	117.3
327	L	26	Very low	31.3	Very low	144 Å²	144	116.3 Å²	116.3	75%	0.754	77%	0.765	S	S	*	*			trans	-63.5	134.6	166.3	-159.5	85.9	0	0	0	110.7
328	N	33.6	Very low	30.9	Very low	164 Å²	164	117.9 Å²	117.9	88%	0.877	77%	0.774	S	S	*	*			trans	-159.9	79.5	144.2	-99.3	-18.5	0	0	0	110.7
329	T	27.7	Very low	30.4	Very low	105 Å²	105	118.8 Å²	118.8	64%	0.644	78%	0.776	S	S	*	*			trans	-56.2	131.1	156.5	37.3	0	0	0	0	111.9
330	L	28.5	Very low	30	Very low	179 Å²	179	119.3 Å²	119.3	94%	0.937	78%	0.78	S	S	*	*				-173.1	159.2	123.3	-138.2	63.4	0	0	0	112.3
331	G	30.6	Very low	29.6	Very low	68 Å²	68	118.5 Å²	118.5	70%	0.701	78%	0.776	S	S	*	*			trans	106.7	57.4	151.9	0	0	0	0	0	117.8
332	T	27.6	Very low	29.2	Very low	129 Å²	129	123.8 Å²	123.8	79%	0.791	78%	0.784	S	S	*	*			trans	-66.7	159.4	154.2	49.6	0	0	0	0	111.1
333	T	29.1	Very low	29.1	Very low	144 Å²	144	121.5 Å²	121.5	88%	0.883	78%	0.777	S	S	*	*			trans	86.2	137.3	-170.4	73.2	0	0	0	0	112.9
334	G	28.1	Very low	28.9	Very low	67 Å²	67	120.6 Å²	120.6	69%	0.691	77%	0.773	S	S	*	*			cis	144.5	121.2	7.3	0	0	0	0	0	108.3
335	S	30.2	Very low	29.2	Very low	118 Å²	118	123.5 Å²	123.5	83%	0.825	77%	0.772	S	S	*	*			trans	68	118.2	174.6	-58.3	0	0	0	0	118.7
336	S	28	Very low	29.2	Very low	100 Å²	100	123.5 Å²	123.5	70%	0.699	76%	0.759	S	S	*	*				66.6	117.2	126.1	-52.9	0	0	0	0	121.7
337	N	29.1	Very low	29.2	Very low	153 Å²	153	127.3 Å²	127.3	82%	0.818	76%	0.76	S	S	*	*			trans	78.8	128.2	137	-57.3	-13.6	0	0	0	120.4
338	N	29.1	Very low	29.3	Very low	152 Å²	152	125 Å²	125	81%	0.813	76%	0.755	S	S	*	*			trans	70.5	121.4	147.6	-95.3	3.7	0	0	0	121.1
339	S	26.6	Very low	29.3	Very low	93 Å²	93	123.1 Å²	123.1	65%	0.65	76%	0.756	S	S	*	*				82.4	111.2	128.5	-57.3	0	0	0	0	120.3
340	S	29.9	Very low	29.4	Very low	94 Å²	94	125.9 Å²	125.9	66%	0.657	77%	0.765	S	S	*	*				74.3	115.4	126.2	66.4	0	0	0	0	121
341	N	27.7	Very low	29.8	Very low	136 Å²	136	123.1 Å²	123.1	73%	0.727	76%	0.757	S	S	*	*			trans	77.8	156.6	131.9	-60.9	-12.4	0	0	0	120.3
342	F	28.8	Very low	29.6	Very low	187 Å²	187	127 Å²	127	82%	0.82	76%	0.762	S	S	*	*			trans	72.6	140.2	168.2	-63.1	-84.1	0	0	0	117.3
343	T	28.8	Very low	29.9	Very low	111 Å²	111	125.6 Å²	125.6	68%	0.681	76%	0.763	S	S	*	*			cis	-163	159.1	-27.1	-116.8	0	0	0	0	109.6
344	S	29	Very low	29.8	Very low	98 Å²	98	124 Å²	124	69%	0.685	76%	0.759	S	S	*	*			trans	-57.7	146.9	175.5	55.5	0	0	0	0	116
345	Q	35.1	Very low	30.2	Very low	187 Å²	187	126.9 Å²	126.9	87%	0.874	77%	0.765	S	S	*	*			trans	-179.4	142.7	143	-99.5	163.3	26.2	0	0	107
346	S	29.8	Very low	30	Very low	85 Å²	85	124.8 Å²	124.8	59%	0.594	76%	0.762	S	S	*	*			cis	158.9	164.6	-16.8	46.9	0	0	0	0	105.8
347	L	30.6	Very low	30	Very low	160 Å²	160	126.3 Å²	126.3	84%	0.838	77%	0.772	S	S	*	*			trans	81.1	136.5	171.2	-47.4	171.9	0	0	0	116.1
348	S	27.4	Very low	29.8	Very low	94 Å²	94	122.3 Å²	122.3	66%	0.657	77%	0.768	S	S	*	*			cis	146.4	125.1	-21.8	53.6	0	0	0	0	108.9
349	S	33.8	Very low	29.8	Very low	126 Å²	126	121.3 Å²	121.3	88%	0.881	76%	0.761	S	S	*	*			trans	177.4	147.6	148	-81.8	0	0	0	0	114
350	I	30.3	Very low	29.7	Very low	162 Å²	162	124.6 Å²	124.6	83%	0.831	77%	0.771	S	S	*	*			trans	-143.6	135	-163.7	-70.6	166.2	0	0	0	108.2
351	P	36.9	Very low	29.5	Very low	121 Å²	121	128.9 Å²	128.9	79%	0.786	77%	0.773	S	S	*	*				-122.5	177.6	70.3	7.4	17.4	0	0	0	113.4
352	D	25	Very low	29.2	Very low	151 Å²	151	127.7 Å²	127.7	81%	0.807	78%	0.776	S	S	*	*			cis	94	111.5	22.3	-161.6	19.9	0	0	0	116.9
353	A	34.3	Very low	29.1	Very low	98 Å²	98	128.5 Å²	128.5	81%	0.81	78%	0.775	S	S	*	*			trans	179.9	106.5	159.4	0	0	0	0	0	112.5
354	S	27.9	Very low	29	Very low	112 Å²	112	128.8 Å²	128.8	78%	0.783	78%	0.781	S	S	*	*			trans	-86.8	162.5	153.1	-79.5	0	0	0	0	109.3
355	P	35.5	Very low	29	Very low	126 Å²	126	127.1 Å²	127.1	82%	0.818	78%	0.779	S	S	*	*			cis	-150.3	166.4	35.3	41.7	-21	0	0	0	119.4
356	G	26	Very low	28.7	Very low	75 Å²	75	127.2 Å²	127.2	77%	0.773	78%	0.78	S	S	*	*			trans	92	165.6	132.4	0	0	0	0	0	120.2
357	S	28.3	Very low	28.9	Very low	131 Å²	131	129 Å²	129	92%	0.916	78%	0.782	S	S	*	*			trans	69.8	119.2	178.4	-150.5	0	0	0	0	116.7
358	G	24.6	Very low	29.6	Very low	70 Å²	70	125.5 Å²	125.5	72%	0.722	77%	0.769	S	S	*	*			trans	-90.3	152.6	-176.6	0	0	0	0	0	113.4
359	I	30.6	Very low	30.3	Very low	131 Å²	131	128.5 Å²	128.5	67%	0.672	77%	0.773	S	S	*	*			trans	-125.3	96.6	161.3	-61.4	-175.7	0	0	0	108.5	R361	I359-R361 HydrophobicContact CG2-CB 3.93Å; I359-R361 HydrophobicContact CG2-CG 3.52Å; I359-R361 PolarHBondContact O-N 3.4Å
360	N	24.2	Very low	30.8	Very low	162 Å²	162	127.6 Å²	127.6	87%	0.866	76%	0.758	S	S	*	*			trans	-72.1	100.2	157.7	-171.8	2.5	0	0	0	107
361	R	24.6	Very low	31.8	Very low	183 Å²	183	121.4 Å²	121.4	69%	0.691	73%	0.734	S	S	*	*			trans	-116.2	109.9	170.4	-97	-178.3	-153.4	-141.3	7.6	110.3	I359 Y363	I359-R361 HydrophobicContact CG2-CB 3.93Å; I359-R361 HydrophobicContact CG2-CG 3.52Å; I359-R361 PolarHBondContact O-N 3.4Å; R361-Y363 HydrophobicContact CB-CE2 4.49Å; R361-Y363 PolarHBondContact O-N 3.34Å
362	S	22.4	Very low	32.8	Very low	112 Å²	112	118.4 Å²	118.4	78%	0.783	71%	0.711	S	S	*	*			trans	-47.3	128.1	161.8	-39.6	0	0	0	0	110.7
363	Y	27	Very low	34.2	Very low	203 Å²	203	116 Å²	116	80%	0.796	70%	0.695	S	S	*	*			trans	-110	87.3	158.8	-84.7	-83.2	0	0	0	109.4	R361 G365	R361-Y363 HydrophobicContact CB-CE2 4.49Å; R361-Y363 PolarHBondContact O-N 3.34Å; Y363-G365 PolarHBondContact O-N 3.33Å
364	S	25.9	Very low	35.4	Very low	117 Å²	117	117.8 Å²	117.8	82%	0.818	69%	0.686	S	S	*	*			trans	-59.2	117	140.4	177.7	0	0	0	0	106.4
365	G	27.9	Very low	36.7	Very low	63 Å²	63	117.2 Å²	117.2	65%	0.649	67%	0.674	S	S	*	*			trans	-136.7	76.4	-170.3	0	0	0	0	0	110.5	Y363 L367	Y363-G365 PolarHBondContact O-N 3.33Å; G365-L367 PolarHBondContact O-N 3.18Å
366	Q	29.9	Very low	37.9	Very low	189 Å²	189	114 Å²	114	88%	0.883	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-61.7	119.9	172.9	-144.1	165.9	-3.7	0	0	108.2
367	L	34.6	Very low	39.3	Very low	124 Å²	124	114.1 Å²	114.1	65%	0.649	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-57.8	134	172.8	-90.1	149.6	0	0	0	108.9	G365 Q369 L398	G365-L367 PolarHBondContact O-N 3.18Å; L367-Q369 PolarHBondContact O-N 2.83Å; L367-L398 HydrophobicContact CD1-CD2 4.02Å
368	P	44.3	Very low	40.6	Very low	85 Å²	85	111 Å²	111	55%	0.552	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-61.7	136.9	179.5	23.5	-30.9	0	0	0	110.1	D370 G371	P368-D370 PolarHBondContact O-N 2.84Å; P368-G371 PolarHBondContact O-N 3.47Å
369	Q	43.2	Very low	42.1	Very low	158 Å²	158	108.6 Å²	108.6	74%	0.738	59%	0.594	S	S	*	*	H	α-helix	trans	-57.4	-25.4	-172.5	-139.5	170.2	1.8	0	0	112.4	L367 Q373	L367-Q369 PolarHBondContact O-N 2.83Å; Q369-Q373 WeakPolarHBondContact O-CG 3.22Å; Q369-Q373 PolarHBondContact O-N 3.39Å; Q369-Q373 PolarHBondContact O-NE2 2.75Å
370	D	43.8	Very low	43.4	Very low	106 Å²	106	106.1 Å²	106.1	57%	0.567	59%	0.585	S	S	*	*	H	α-helix	trans	-67.3	-38.6	176.7	-51.9	-71.2	0	0	0	113.4	P368 L372 Q373 Q374	P368-D370 PolarHBondContact O-N 2.84Å; D370-L372 VanDerWaalsContact C-N 3.31Å; D370-L372 PolarHBondContact O-N 3.2Å; D370-Q373 PolarHBondContact O-N 2.85Å; D370-Q374 WeakPolarHBondContact O-CG 3.36Å; D370-Q374 PolarHBondContact O-N 3.43Å
371	G	51.7	Low	44.9	Very low	32 Å²	32	102.7 Å²	102.7	33%	0.33	58%	0.579	S	S	.	*	H	α-helix	trans	-67.6	-34.4	179.6	0	0	0	0	0	112.3	P368 L375	P368-G371 PolarHBondContact O-N 3.47Å; G371-L375 PolarHBondContact O-N 2.66Å
372	L	56.2	Low	46.1	Very low	58 Å²	58	96.8 Å²	96.8	30%	0.304	58%	0.575	S	S	.	*	H	α-helix	trans	-71.8	-37.9	175.2	-142.3	167.1	0	0	0	110.9	D370 L375 I376 L393	D370-L372 VanDerWaalsContact C-N 3.31Å; D370-L372 PolarHBondContact O-N 3.2Å; L372-L375 PolarHBondContact O-N 2.86Å; L372-I376 HydrophobicContact CD2-CD1 3.5Å; L372-I376 HydrophobicContact CD2-CG1 4.03Å; L372-I376 WeakPolarHBondContact O-CG1 3.43Å; L372-I376 PolarHBondContact O-N 3.33Å; L372-L393 HydrophobicContact CD2-CD1 4.31Å; L372-L393 HydrophobicContact CD2-CD2 4Å
373	Q	55.5	Low	47.2	Very low	100 Å²	100	94.6 Å²	94.6	47%	0.467	57%	0.57	S	S	.	*	H	α-helix	trans	-66.8	-37.2	173.2	-78.2	167	87.5	0	0	113	Q369 D370 I376 S377	Q369-Q373 WeakPolarHBondContact O-CG 3.22Å; Q369-Q373 PolarHBondContact O-N 3.39Å; Q369-Q373 PolarHBondContact O-NE2 2.75Å; D370-Q373 PolarHBondContact O-N 2.85Å; Q373-I376 PolarHBondContact O-N 3.03Å; Q373-S377 VanDerWaalsContact O-CB 3.31Å; Q373-S377 WeakPolarHBondContact O-CB 3.18Å; Q373-S377 PolarHBondContact O-N 2.86Å; Q373-S377 PolarHBondContact O-OG 3.09Å
374	Q	59	Low	48.3	Very low	136 Å²	136	86.8 Å²	86.8	64%	0.636	54%	0.541	S	S	*	.	H	α-helix	trans	-65.7	-41.1	172.5	-74	-177.9	3.6	0	0	111.8	D370 S377 A378	D370-Q374 WeakPolarHBondContact O-CG 3.36Å; D370-Q374 PolarHBondContact O-N 3.43Å; Q374-S377 PolarHBondContact O-N 3.34Å; Q374-A378 VanDerWaalsContact O-CB 3.27Å; Q374-A378 WeakPolarHBondContact O-CB 3.47Å; Q374-A378 PolarHBondContact O-N 3.39Å
375	L	54.9	Low	49.9	Very low	100 Å²	100	83.3 Å²	83.3	52%	0.524	52%	0.517	S	S	.	.	H	α-helix	trans	-62	-45.4	174.1	-97.6	163.5	0	0	0	112.5	G371 L372 A378 A379	G371-L375 PolarHBondContact O-N 2.66Å; L372-L375 PolarHBondContact O-N 2.86Å; L375-A378 PolarHBondContact O-N 3.46Å; L375-A379 VanDerWaalsContact O-CB 3.3Å; L375-A379 WeakPolarHBondContact O-CB 3.4Å; L375-A379 PolarHBondContact O-N 2.9Å
376	I	60.9	Low	51.1	Low	58 Å²	58	86.7 Å²	86.7	30%	0.297	52%	0.516	S	S	.	.	H	α-helix	trans	-64.4	-44.2	176.5	-69.7	167.3	0	0	0	110.6	L372 Q373 A378 A379 V380 I389 L393	L372-I376 HydrophobicContact CD2-CD1 3.5Å; L372-I376 HydrophobicContact CD2-CG1 4.03Å; L372-I376 WeakPolarHBondContact O-CG1 3.43Å; L372-I376 PolarHBondContact O-N 3.33Å; Q373-I376 PolarHBondContact O-N 3.03Å; I376-A378 PolarHBondContact O-N 3.42Å; I376-A379 PolarHBondContact O-N 2.82Å; I376-V380 HydrophobicContact CG2-CG2 4.46Å; I376-V380 WeakPolarHBondContact O-CG2 3.37Å; I376-V380 PolarHBondContact O-N 3.28Å; I376-I389 HydrophobicContact CG1-CG2 4.27Å; I376-L393 HydrophobicContact CD1-CD1 4.17Å; I376-L393 HydrophobicContact CG1-CD1 4.12Å
377	S	55.6	Low	52.4	Low	78 Å²	78	82.9 Å²	82.9	55%	0.545	51%	0.506	S	S	.	.	H	α-helix	trans	-64.4	-40.6	179	-57.7	0	0	0	0	112.2	Q373 Q374 A381	Q373-S377 VanDerWaalsContact O-CB 3.31Å; Q373-S377 WeakPolarHBondContact O-CB 3.18Å; Q373-S377 PolarHBondContact O-N 2.86Å; Q373-S377 PolarHBondContact O-OG 3.09Å; Q374-S377 PolarHBondContact O-N 3.34Å; S377-A381 WeakPolarHBondContact O-CB 3.45Å; S377-A381 PolarHBondContact O-N 3.09Å
378	A	55.5	Low	53.4	Low	65 Å²	65	81.7 Å²	81.7	54%	0.537	50%	0.497	S	S	.	.	H	α-helix	trans	-67.1	-38	174.9	0	0	0	0	0	112.4	Q374 L375 I376 A381 G382	Q374-A378 VanDerWaalsContact O-CB 3.27Å; Q374-A378 WeakPolarHBondContact O-CB 3.47Å; Q374-A378 PolarHBondContact O-N 3.39Å; L375-A378 PolarHBondContact O-N 3.46Å; I376-A378 PolarHBondContact O-N 3.42Å; A378-A381 PolarHBondContact O-N 3.13Å; A378-G382 PolarHBondContact O-N 3.12Å
379	A	56.5	Low	54	Low	20 Å²	20	78 Å²	78	17%	0.165	47%	0.473	C	S	.	.	H	α-helix	trans	-68.1	-40.3	176.3	0	0	0	0	0	112.5	L375 I376 G382 G383 M384 I389	L375-A379 VanDerWaalsContact O-CB 3.3Å; L375-A379 WeakPolarHBondContact O-CB 3.4Å; L375-A379 PolarHBondContact O-N 2.9Å; I376-A379 PolarHBondContact O-N 2.82Å; A379-G382 PolarHBondContact O-N 3.09Å; A379-G383 PolarHBondContact O-N 3.44Å; A379-M384 HydrophobicContact CB-SD 3.76Å; A379-M384 WeakPolarHBondContact O-CB 3.48Å; A379-M384 PolarHBondContact O-N 3.42Å; A379-M384 VanDerWaalsContact O-N 3.11Å; A379-I389 HydrophobicContact CB-CD1 3.97Å; A379-I389 HydrophobicContact CB-CG1 3.84Å
380	V	57.2	Low	54.7	Low	80 Å²	80	73.4 Å²	73.4	49%	0.485	46%	0.455	S	S	.	.	H	α-helix	trans	-64.4	-44	172.6	171.2	0	0	0	0	110.9	I376 G382 G383 I389	I376-V380 HydrophobicContact CG2-CG2 4.46Å; I376-V380 WeakPolarHBondContact O-CG2 3.37Å; I376-V380 PolarHBondContact O-N 3.28Å; V380-G382 PolarHBondContact O-N 2.93Å; V380-G383 PolarHBondContact O-N 3.28Å; V380-I389 HydrophobicContact CG2-CD1 3.53Å
381	A	55.7	Low	55.2	Low	90 Å²	90	71.2 Å²	71.2	74%	0.744	45%	0.448	S	S	*	.	H	α-helix	trans	-63.8	-28.2	174.7	0	0	0	0	0	113	S377 A378 G383	S377-A381 WeakPolarHBondContact O-CB 3.45Å; S377-A381 PolarHBondContact O-N 3.09Å; A378-A381 PolarHBondContact O-N 3.13Å; A381-G383 PolarHBondContact O-N 3.41Å
382	G	49.4	Very low	55.3	Low	58 Å²	58	71.3 Å²	71.3	60%	0.598	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	2.9	171.9	0	0	0	0	0	115.2	A378 A379 V380 M384	A378-G382 PolarHBondContact O-N 3.12Å; A379-G382 PolarHBondContact O-N 3.09Å; V380-G382 PolarHBondContact O-N 2.93Å; G382-M384 VanDerWaalsContact C-N 3.34Å
383	G	47.2	Very low	55.4	Low	67 Å²	67	69.2 Å²	69.2	69%	0.691	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	14.2	178.7	0	0	0	0	0	114.9	A379 V380 A381	A379-G383 PolarHBondContact O-N 3.44Å; V380-G383 PolarHBondContact O-N 3.28Å; A381-G383 PolarHBondContact O-N 3.41Å
384	M	49.9	Very low	55.3	Low	38 Å²	38	67.4 Å²	67.4	19%	0.187	43%	0.43	C	S	.	.			trans	-71	137.8	176.6	-64.7	177	63	0	0	111	A379 G382 Q388 I389 V392	A379-M384 HydrophobicContact CB-SD 3.76Å; A379-M384 WeakPolarHBondContact O-CB 3.48Å; A379-M384 PolarHBondContact O-N 3.42Å; A379-M384 VanDerWaalsContact O-N 3.11Å; G382-M384 VanDerWaalsContact C-N 3.34Å; M384-Q388 VanDerWaalsContact CA-OE1 3.28Å; M384-Q388 HydrophobicContact CB-CB 4.29Å; M384-Q388 HydrophobicContact CE-CB 4.01Å; M384-I389 HydrophobicContact CB-CD1 4.31Å; M384-I389 HydrophobicContact CB-CG1 3.88Å; M384-I389 HydrophobicContact CE-CG1 4.36Å; M384-V392 HydrophobicContact CE-CG2 3.98Å
385	S	59.2	Low	55.2	Low	44 Å²	44	66.1 Å²	66.1	31%	0.308	43%	0.431	S	S	.	.			trans	-69.5	154.7	173.8	81.2	0	0	0	0	111.3	T387 Q388 I389	S385-T387 PolarHBondContact O-N 3.15Å; S385-T387 VanDerWaalsContact O-N 3.15Å; S385-T387 PolarHBondContact OG-N 3.44Å; S385-T387 PolarHBondContact OG-OG1 3.1Å; S385-Q388 WeakPolarHBondContact O-CA 3.3Å; S385-Q388 WeakPolarHBondContact O-CB 3.47Å; S385-Q388 PolarHBondContact O-N 3.05Å; S385-Q388 WeakPolarHBondContact OG-CG 3.21Å; S385-Q388 PolarHBondContact OG-N 3.47Å; S385-Q388 VanDerWaalsContact OG-N 3.07Å; S385-I389 WeakPolarHBondContact O-CG1 3.23Å; S385-I389 PolarHBondContact O-N 2.86Å
386	Q	53.4	Low	55.1	Low	135 Å²	135	66.4 Å²	66.4	63%	0.631	43%	0.433	S	S	*	.	H	α-helix	trans	-51	-37.3	170.9	-78.5	-74.6	5.1	0	0	112.5	T390	Q386-T390 VanDerWaalsContact O-CB 3.32Å; Q386-T390 WeakPolarHBondContact O-CB 3.5Å; Q386-T390 PolarHBondContact O-N 2.97Å; Q386-T390 PolarHBondContact O-OG1 2.98Å
387	T	57.3	Low	54.5	Low	109 Å²	109	66.5 Å²	66.5	67%	0.669	45%	0.448	S	S	*	.	H	α-helix	trans	-64.2	-42.5	173.7	9	0	0	0	0	112.7	S385 S391	S385-T387 PolarHBondContact O-N 3.15Å; S385-T387 VanDerWaalsContact O-N 3.15Å; S385-T387 PolarHBondContact OG-N 3.44Å; S385-T387 PolarHBondContact OG-OG1 3.1Å; T387-S391 WeakPolarHBondContact O-CB 3.2Å; T387-S391 PolarHBondContact O-N 3.32Å; T387-S391 PolarHBondContact O-OG 2.96Å
388	Q	54.5	Low	54.4	Low	98 Å²	98	65.9 Å²	65.9	46%	0.458	44%	0.438	S	S	.	.	H	α-helix	trans	-65.4	-47.1	176	-71.2	168.4	-8.3	0	0	110.9	M384 S385 T390 S391 V392	M384-Q388 VanDerWaalsContact CA-OE1 3.28Å; M384-Q388 HydrophobicContact CB-CB 4.29Å; M384-Q388 HydrophobicContact CE-CB 4.01Å; S385-Q388 WeakPolarHBondContact O-CA 3.3Å; S385-Q388 WeakPolarHBondContact O-CB 3.47Å; S385-Q388 PolarHBondContact O-N 3.05Å; S385-Q388 WeakPolarHBondContact OG-CG 3.21Å; S385-Q388 PolarHBondContact OG-N 3.47Å; S385-Q388 VanDerWaalsContact OG-N 3.07Å; Q388-T390 PolarHBondContact O-N 3.35Å; Q388-S391 WeakPolarHBondContact CA-OG 3.49Å; Q388-S391 PolarHBondContact O-N 2.95Å; Q388-S391 VanDerWaalsContact O-N 3.16Å; Q388-S391 PolarHBondContact O-OG 3.32Å; Q388-V392 WeakPolarHBondContact O-CG2 3.33Å; Q388-V392 PolarHBondContact O-N 3.18Å
389	I	57.2	Low	53.9	Low	9 Å²	9	67.7 Å²	67.7	5%	0.046	43%	0.434	C	S	.	.	H	α-helix	trans	-58.4	-47.5	177.3	-62.8	170.1	0	0	0	110.8	I376 A379 V380 M384 S385 S391 V392 L393	I376-I389 HydrophobicContact CG1-CG2 4.27Å; A379-I389 HydrophobicContact CB-CD1 3.97Å; A379-I389 HydrophobicContact CB-CG1 3.84Å; V380-I389 HydrophobicContact CG2-CD1 3.53Å; M384-I389 HydrophobicContact CB-CD1 4.31Å; M384-I389 HydrophobicContact CB-CG1 3.88Å; M384-I389 HydrophobicContact CE-CG1 4.36Å; S385-I389 WeakPolarHBondContact O-CG1 3.23Å; S385-I389 PolarHBondContact O-N 2.86Å; I389-S391 VanDerWaalsContact C-N 3.33Å; I389-S391 PolarHBondContact O-N 3.34Å; I389-V392 PolarHBondContact O-N 2.74Å; I389-L393 HydrophobicContact CG2-CD1 3.88Å; I389-L393 HydrophobicContact CG2-CG 4.46Å; I389-L393 WeakPolarHBondContact O-CB 3.32Å; I389-L393 WeakPolarHBondContact O-CG 3.48Å; I389-L393 PolarHBondContact O-N 2.88Å
390	T	58.1	Low	53	Low	61 Å²	61	74.7 Å²	74.7	37%	0.374	46%	0.464	S	S	.	.	H	α-helix	trans	-61.2	-42.2	177	-56	0	0	0	0	111.3	Q386 Q388 S394	Q386-T390 VanDerWaalsContact O-CB 3.32Å; Q386-T390 WeakPolarHBondContact O-CB 3.5Å; Q386-T390 PolarHBondContact O-N 2.97Å; Q386-T390 PolarHBondContact O-OG1 2.98Å; Q388-T390 PolarHBondContact O-N 3.35Å; T390-S394 VanDerWaalsContact O-CB 3.31Å; T390-S394 WeakPolarHBondContact O-CB 3.37Å; T390-S394 PolarHBondContact O-N 3.26Å; T390-S394 PolarHBondContact O-OG 3.38Å
391	S	53.5	Low	51.8	Low	60 Å²	60	78.2 Å²	78.2	42%	0.42	48%	0.48	S	S	.	.	H	α-helix	trans	-65.7	-42.3	178.8	71.7	0	0	0	0	112.1	T387 Q388 I389 S394 T395	T387-S391 WeakPolarHBondContact O-CB 3.2Å; T387-S391 PolarHBondContact O-N 3.32Å; T387-S391 PolarHBondContact O-OG 2.96Å; Q388-S391 WeakPolarHBondContact CA-OG 3.49Å; Q388-S391 PolarHBondContact O-N 2.95Å; Q388-S391 VanDerWaalsContact O-N 3.16Å; Q388-S391 PolarHBondContact O-OG 3.32Å; I389-S391 VanDerWaalsContact C-N 3.33Å; I389-S391 PolarHBondContact O-N 3.34Å; S391-S394 PolarHBondContact O-N 3Å; S391-T395 WeakPolarHBondContact O-CB 3.48Å; S391-T395 PolarHBondContact O-N 3.09Å; S391-T395 PolarHBondContact O-OG1 2.83Å
392	V	55.1	Low	50.5	Low	34 Å²	34	77.6 Å²	77.6	21%	0.206	47%	0.47	C	S	.	.	H	α-helix	trans	-66.4	-46	178.1	170.3	0	0	0	0	111.6	M384 Q388 I389 S394 T395 L396	M384-V392 HydrophobicContact CE-CG2 3.98Å; Q388-V392 WeakPolarHBondContact O-CG2 3.33Å; Q388-V392 PolarHBondContact O-N 3.18Å; I389-V392 PolarHBondContact O-N 2.74Å; V392-S394 VanDerWaalsContact C-N 3.3Å; V392-S394 PolarHBondContact O-N 3.39Å; V392-T395 PolarHBondContact O-N 3.16Å; V392-L396 HydrophobicContact CG1-CD1 3.74Å; V392-L396 WeakPolarHBondContact O-CB 3.09Å; V392-L396 WeakPolarHBondContact O-CD1 3.21Å; V392-L396 VanDerWaalsContact O-CG 3.3Å; V392-L396 WeakPolarHBondContact O-CG 3.4Å; V392-L396 PolarHBondContact O-N 2.86Å
393	L	58.5	Low	49.6	Very low	14 Å²	14	83.4 Å²	83.4	7%	0.073	48%	0.481	C	S	.	.	H	α-helix	trans	-63	-36	175.4	-69.9	170.8	0	0	0	112.4	L372 I376 I389 G397 L398 F399	L372-L393 HydrophobicContact CD2-CD1 4.31Å; L372-L393 HydrophobicContact CD2-CD2 4Å; I376-L393 HydrophobicContact CD1-CD1 4.17Å; I376-L393 HydrophobicContact CG1-CD1 4.12Å; I389-L393 HydrophobicContact CG2-CD1 3.88Å; I389-L393 HydrophobicContact CG2-CG 4.46Å; I389-L393 WeakPolarHBondContact O-CB 3.32Å; I389-L393 WeakPolarHBondContact O-CG 3.48Å; I389-L393 PolarHBondContact O-N 2.88Å; L393-G397 PolarHBondContact O-N 3.13Å; L393-L398 HydrophobicContact CD2-CB 4.2Å; L393-L398 HydrophobicContact CD2-CD1 4.2Å; L393-L398 PolarHBondContact O-N 3.47Å; L393-F399 HydrophobicContact CB-CB 4.44Å; L393-F399 HydrophobicContact CB-CD2 4.06Å; L393-F399 HydrophobicContact CD1-CD2 4.31Å; L393-F399 PolarHBondContact O-N 2.83Å
394	S	52.6	Low	48.7	Very low	62 Å²	62	84.6 Å²	84.6	43%	0.434	48%	0.479	S	S	.	.	H	α-helix	trans	-68.1	-44	174	-58.1	0	0	0	0	111.9	T390 S391 V392 L396 G397	T390-S394 VanDerWaalsContact O-CB 3.31Å; T390-S394 WeakPolarHBondContact O-CB 3.37Å; T390-S394 PolarHBondContact O-N 3.26Å; T390-S394 PolarHBondContact O-OG 3.38Å; S391-S394 PolarHBondContact O-N 3Å; V392-S394 VanDerWaalsContact C-N 3.3Å; V392-S394 PolarHBondContact O-N 3.39Å; S394-L396 VanDerWaalsContact C-N 3.32Å; S394-L396 PolarHBondContact O-N 3.46Å; S394-G397 PolarHBondContact O-N 3.49Å; S394-G397 VanDerWaalsContact O-N 3.1Å
395	T	57	Low	47.6	Very low	109 Å²	109	89.6 Å²	89.6	67%	0.669	51%	0.507	S	S	*	.	H	α-helix	trans	-65.5	-33.5	177.8	-60.3	0	0	0	0	112.5	S391 V392 G397	S391-T395 WeakPolarHBondContact O-CB 3.48Å; S391-T395 PolarHBondContact O-N 3.09Å; S391-T395 PolarHBondContact O-OG1 2.83Å; V392-T395 PolarHBondContact O-N 3.16Å; T395-G397 PolarHBondContact O-N 3.41Å
396	L	51.6	Low	46.1	Very low	105 Å²	105	96.3 Å²	96.3	55%	0.55	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-3.9	174.5	-71.5	164.8	0	0	0	113.6	V392 S394 L398	V392-L396 HydrophobicContact CG1-CD1 3.74Å; V392-L396 WeakPolarHBondContact O-CB 3.09Å; V392-L396 WeakPolarHBondContact O-CD1 3.21Å; V392-L396 VanDerWaalsContact O-CG 3.3Å; V392-L396 WeakPolarHBondContact O-CG 3.4Å; V392-L396 PolarHBondContact O-N 2.86Å; S394-L396 VanDerWaalsContact C-N 3.32Å; S394-L396 PolarHBondContact O-N 3.46Å; L396-L398 HydrophobicContact CB-CB 4.46Å; L396-L398 HydrophobicContact CB-CD1 3.83Å; L396-L398 HydrophobicContact CB-CG 3.85Å; L396-L398 HydrophobicContact CD1-CD1 4.05Å; L396-L398 PolarHBondContact O-N 3.19Å
397	G	48.5	Very low	44.9	Very low	60 Å²	60	98.7 Å²	98.7	62%	0.619	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.3	14.2	-175	0	0	0	0	0	114.1	L393 S394 T395 F399	L393-G397 PolarHBondContact O-N 3.13Å; S394-G397 PolarHBondContact O-N 3.49Å; S394-G397 VanDerWaalsContact O-N 3.1Å; T395-G397 PolarHBondContact O-N 3.41Å; G397-F399 VanDerWaalsContact C-N 3.3Å
398	L	53.3	Low	43.5	Very low	65 Å²	65	99.2 Å²	99.2	34%	0.34	55%	0.552	S	S	.	*			trans	-85	-4.8	-179	-64.2	174.5	0	0	0	112.8	L367 L393 L396	L367-L398 HydrophobicContact CD1-CD2 4.02Å; L393-L398 HydrophobicContact CD2-CB 4.2Å; L393-L398 HydrophobicContact CD2-CD1 4.2Å; L393-L398 PolarHBondContact O-N 3.47Å; L396-L398 HydrophobicContact CB-CB 4.46Å; L396-L398 HydrophobicContact CB-CD1 3.83Å; L396-L398 HydrophobicContact CB-CG 3.85Å; L396-L398 HydrophobicContact CD1-CD1 4.05Å; L396-L398 PolarHBondContact O-N 3.19Å
399	F	45.2	Very low	42.2	Very low	103 Å²	103	98 Å²	98	45%	0.452	57%	0.565	S	S	.	*			trans	-110.2	99.7	178.3	-141.5	-88.7	0	0	0	110.5	L393 G397 N401	L393-F399 HydrophobicContact CB-CB 4.44Å; L393-F399 HydrophobicContact CB-CD2 4.06Å; L393-F399 HydrophobicContact CD1-CD2 4.31Å; L393-F399 PolarHBondContact O-N 2.83Å; G397-F399 VanDerWaalsContact C-N 3.3Å; F399-N401 PolarHBondContact O-N 3.27Å
400	Q	38.3	Very low	40.8	Very low	168 Å²	168	105.9 Å²	105.9	79%	0.785	60%	0.602	S	S	*	*			trans	-82.3	102.9	167.9	-77.4	-168.5	3.9	0	0	109.6	S402	Q400-S402 PolarHBondContact O-N 3.25Å
401	N	32.7	Very low	39.5	Very low	153 Å²	153	111.3 Å²	111.3	82%	0.818	63%	0.628	S	S	*	*			trans	-79.8	70.4	172.1	-136.8	31.1	0	0	0	110.1	F399	F399-N401 PolarHBondContact O-N 3.27Å
402	S	27.4	Very low	38.4	Very low	78 Å²	78	113.1 Å²	113.1	55%	0.545	63%	0.633	S	S	.	*			trans	-89.4	106.6	174.1	-63.9	0	0	0	0	109.3	Q400	Q400-S402 PolarHBondContact O-N 3.25Å
403	H	31.2	Very low	37.3	Very low	179 Å²	179	116.7 Å²	116.7	83%	0.829	67%	0.666	S	S	*	*			trans	175.8	108.5	139.4	-86	-27.1	0	0	0	111.6
404	S	27.7	Very low	36.2	Very low	93 Å²	93	120.2 Å²	120.2	65%	0.65	69%	0.692	S	S	*	*			trans	-78.7	164.5	131.5	59.7	0	0	0	0	109.2
405	D	27.2	Very low	35.4	Very low	143 Å²	143	124 Å²	124	77%	0.765	71%	0.707	S	S	*	*	S	Bend	trans	85.8	136.9	166.2	-53.9	-66.7	0	0	0	118.7
406	H	28.5	Very low	34.5	Very low	184 Å²	184	126.1 Å²	126.1	85%	0.852	71%	0.713	S	S	*	*			trans	-80	125.2	-172.7	-64.7	-90.4	0	0	0	112.2
407	Q	28.2	Very low	33.5	Very low	185 Å²	185	128.8 Å²	128.8	86%	0.864	73%	0.726	S	S	*	*				-179.2	136.9	126.7	-101.6	163.7	1.2	0	0	113.1
408	S	26.6	Very low	32.7	Very low	121 Å²	121	129 Å²	129	85%	0.846	73%	0.728	S	S	*	*			trans	13.1	105.3	155.1	54.7	0	0	0	0	119.2
409	G	27.5	Very low	31.8	Very low	71 Å²	71	137 Å²	137	73%	0.732	75%	0.754	S	S	*	*			trans	-176.5	85.3	168.7	0	0	0	0	0	112.3	L411	G409-L411 PolarHBondContact O-N 3.42Å; G409-L411 VanDerWaalsContact O-N 3.14Å
410	Q	27.8	Very low	31	Very low	175 Å²	175	140 Å²	140	82%	0.818	77%	0.774	S	S	*	*			trans	-66.7	110.1	177.7	-73.4	178.2	-17.1	0	0	111.2
411	L	31.4	Very low	30.7	Very low	176 Å²	176	136.1 Å²	136.1	92%	0.921	78%	0.779	S	S	*	*			trans	-116	69.3	156.6	-68.8	178.5	0	0	0	108.8	G409 A413	G409-L411 PolarHBondContact O-N 3.42Å; G409-L411 VanDerWaalsContact O-N 3.14Å; L411-A413 PolarHBondContact O-N 3.32Å
412	N	30.9	Very low	30.6	Very low	98 Å²	98	132.7 Å²	132.7	52%	0.524	78%	0.78	S	S	.	*			trans	-65.7	123.9	171.9	-89.9	-20.6	0	0	0	109.7	S414	N412-S414 PolarHBondContact O-N 3.29Å
413	A	32.1	Very low	30.9	Very low	109 Å²	109	132.9 Å²	132.9	90%	0.901	79%	0.794	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	21.7	167.1	0	0	0	0	0	113.4	L411	L411-A413 PolarHBondContact O-N 3.32Å
414	S	34.4	Very low	30.9	Very low	87 Å²	87	128.2 Å²	128.2	61%	0.608	79%	0.794	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.8	-2	-170.5	-39.9	0	0	0	0	113.7	N412	N412-S414 PolarHBondContact O-N 3.29Å
415	N	36.5	Very low	31.1	Very low	141 Å²	141	130.4 Å²	130.4	75%	0.754	81%	0.808	S	S	*	*	S	Bend	trans	-106.1	6.7	-166.9	-80.4	14.9	0	0	0	115.6
416	I	37.5	Very low	31.5	Very low	155 Å²	155	127.5 Å²	127.5	80%	0.795	81%	0.812	S	S	*	*	S	Bend	trans	-121.3	29.1	-174.9	-42.5	-178	0	0	0	111.9
417	I	30.9	Very low	31.6	Very low	161 Å²	161	125.7 Å²	125.7	83%	0.826	81%	0.809	S	S	*	*			trans	-126.4	107.3	165.8	-58.4	-178.2	0	0	0	107.6
418	G	32	Very low	32	Very low	64 Å²	64	127.8 Å²	127.8	66%	0.66	81%	0.809	S	S	*	*			trans	-68.3	149.2	175.7	0	0	0	0	0	112
419	R	32.9	Very low	32.3	Very low	234 Å²	234	126.4 Å²	126.4	88%	0.883	80%	0.799	S	S	*	*				24.2	108.6	126.4	-69.2	176.2	165.2	172.4	-6.1	115.6
420	D	29.8	Very low	33.1	Very low	166 Å²	166	129.3 Å²	129.3	89%	0.888	80%	0.802	S	S	*	*				-176.8	136.1	107.6	-87.3	-29.3	0	0	0	112.3
421	G	30.7	Very low	33.3	Very low	86 Å²	86	127.2 Å²	127.2	89%	0.887	80%	0.797	S	S	*	*			trans	73.2	142.8	176.1	0	0	0	0	0	116.5
422	G	31.5	Very low	33.4	Very low	80 Å²	80	129.7 Å²	129.7	83%	0.825	79%	0.794	S	S	*	*			cis	159.4	124.6	-5.7	0	0	0	0	0	111.6
423	G	33.2	Very low	33.6	Very low	82 Å²	82	129.5 Å²	129.5	85%	0.845	80%	0.8	S	S	*	*			trans	81	136.1	-176	0	0	0	0	0	113.2
424	G	32.3	Very low	33.7	Very low	81 Å²	81	133 Å²	133	84%	0.835	80%	0.798	S	S	*	*			cis	91.4	128	28.4	0	0	0	0	0	109.3
425	C	32	Very low	33.8	Very low	140 Å²	140	138.7 Å²	138.7	95%	0.946	81%	0.812	S	S	*	*			cis	-165	174.3	3	53	0	0	0	0	108.6
426	G	35.3	Very low	33.7	Very low	82 Å²	82	139 Å²	139	85%	0.845	81%	0.814	S	S	*	*			trans	131.9	85.4	162.1	0	0	0	0	0	116.9
427	D	29.7	Very low	33.6	Very low	146 Å²	146	138.7 Å²	138.7	78%	0.781	81%	0.813	S	S	*	*			trans	-84.8	145.9	170.1	-178.8	13.1	0	0	0	111.7
428	R	37.4	Very low	33.5	Very low	228 Å²	228	133.7 Å²	133.7	86%	0.86	80%	0.802	S	S	*	*			trans	-178.3	106.3	147.1	-104.8	168.6	-119.9	-165	-2.5	114
429	S	32.7	Very low	33.6	Very low	93 Å²	93	141.4 Å²	141.4	65%	0.65	81%	0.813	S	S	*	*			trans	8.3	142.1	132.1	50.5	0	0	0	0	120.6
430	V	43.9	Very low	33.7	Very low	132 Å²	132	136.2 Å²	136.2	80%	0.8	81%	0.807	S	S	*	*				-160.1	142.8	100.6	174.6	0	0	0	0	110.8
431	D	32	Very low	34	Very low	131 Å²	131	132.4 Å²	132.4	70%	0.701	81%	0.807	S	S	*	*			trans	-37.1	162.8	168.1	-54.4	-106.6	0	0	0	117.5
432	R	33.4	Very low	34.1	Very low	227 Å²	227	138.2 Å²	138.2	86%	0.857	80%	0.802	S	S	*	*				-176.7	146.2	62.8	-134.1	158.4	-153.6	-176.4	4.9	115.6
433	S	34.7	Very low	34.3	Very low	95 Å²	95	139.7 Å²	139.7	66%	0.664	80%	0.799	S	S	*	*			trans	41.6	113.4	149.6	56.4	0	0	0	0	120.2
434	H	34.2	Very low	34.4	Very low	182 Å²	182	141.5 Å²	141.5	84%	0.843	78%	0.784	S	S	*	*				47.1	109.6	78.9	-91	94.2	0	0	0	115.7
435	F	37.2	Very low	34.8	Very low	207 Å²	207	148.8 Å²	148.8	91%	0.908	79%	0.788	S	S	*	*			trans	-156.8	123.7	136.3	-119.5	-77	0	0	0	110.3
436	D	34.9	Very low	34.9	Very low	147 Å²	147	148.8 Å²	148.8	79%	0.786	77%	0.774	S	S	*	*			trans	-100.6	124.1	169.1	-171.7	-64.1	0	0	0	107.8
437	N	34.2	Very low	34.8	Very low	148 Å²	148	152.2 Å²	152.2	79%	0.791	77%	0.772	S	S	*	*			trans	-168	138.4	155.2	-131.7	-22.2	0	0	0	110.6
438	G	30	Very low	35.3	Very low	57 Å²	57	149.9 Å²	149.9	59%	0.588	77%	0.766	S	S	*	*			trans	-82.5	165.3	173.1	0	0	0	0	0	112.7
439	Y	34.6	Very low	35.2	Very low	226 Å²	226	141.9 Å²	141.9	89%	0.886	76%	0.755	S	S	*	*				-177.1	126.3	127.9	-116.9	-100	0	0	0	111.6
440	V	33.4	Very low	35.4	Very low	124 Å²	124	142.7 Å²	142.7	75%	0.752	75%	0.752	S	S	*	*			trans	31.6	110.2	144.4	-172.9	0	0	0	0	119.4
441	G	36	Very low	35	Very low	87 Å²	87	145.2 Å²	145.2	90%	0.897	75%	0.749	S	S	*	*			trans	-136.8	93	164.3	0	0	0	0	0	112
442	R	33.7	Very low	35	Very low	208 Å²	208	150.4 Å²	150.4	79%	0.785	76%	0.759	S	S	*	*			trans	-99	130.7	-171.9	177	-170.4	-169.1	177.4	5.5	111.7
443	S	35.8	Very low	35.1	Very low	110 Å²	110	145.2 Å²	145.2	77%	0.769	75%	0.752	S	S	*	*			trans	164.8	160.5	131.5	-77.5	0	0	0	0	113.9
444	K	35.7	Very low	34.7	Very low	120 Å²	120	147.7 Å²	147.7	52%	0.522	76%	0.758	S	S	.	*			cis	-179.9	105.9	-32.2	-173.4	-173.9	-176.2	-164.3	0	109.5	E446	K444-E446 WeakPolarHBondContact CE-OE1 3.47Å; K444-E446 WeakPolarHBondContact CE-OE2 3.38Å; K444-E446 WeakPolarHBondContact CG-OE1 3.14Å; K444-E446 IonicContact NZ-OE2 2.76Å
445	Y	40.8	Very low	34.5	Very low	235 Å²	235	143.4 Å²	143.4	92%	0.922	75%	0.748	S	S	*	*			trans	-141.7	132.6	158.6	-31.6	-73	0	0	0	111.6
446	E	32.5	Very low	34.2	Very low	139 Å²	139	144.3 Å²	144.3	65%	0.65	75%	0.746	S	S	*	*			trans	-136.5	157.1	-167.7	-64.3	148.4	-173.4	0	0	107.7	K444	K444-E446 WeakPolarHBondContact CE-OE1 3.47Å; K444-E446 WeakPolarHBondContact CE-OE2 3.38Å; K444-E446 WeakPolarHBondContact CG-OE1 3.14Å; K444-E446 IonicContact NZ-OE2 2.76Å
447	I	34.8	Very low	34.1	Very low	155 Å²	155	142.4 Å²	142.4	80%	0.795	74%	0.744	S	S	*	*			cis	-153.5	152.8	8.9	-147.4	166.8	0	0	0	108.5
448	S	39	Very low	34.3	Very low	96 Å²	96	140.3 Å²	140.3	67%	0.671	74%	0.741	S	S	*	*				163.7	142.3	99.1	-144.1	0	0	0	0	107.8
449	G	35.5	Very low	34.4	Very low	61 Å²	61	148.8 Å²	148.8	63%	0.629	76%	0.755	S	S	*	*				81.3	122.3	68	0	0	0	0	0	110.4
450	N	38.1	Very low	34.7	Very low	110 Å²	110	146.5 Å²	146.5	59%	0.588	75%	0.753	S	S	*	*				-171.9	147.3	51.4	-77.7	-26.9	0	0	0	114.8
451	Y	35.1	Very low	34.6	Very low	185 Å²	185	147.2 Å²	147.2	73%	0.725	75%	0.752	S	S	*	*			trans	-10.1	143.3	153.5	34.3	-94.5	0	0	0	119.5
452	R	31.5	Very low	34.5	Very low	240 Å²	240	148.8 Å²	148.8	91%	0.906	75%	0.749	S	S	*	*			cis	74.8	143.8	38.5	-142.5	-175.9	-156.2	168	7.4	114.8
453	V	34.7	Very low	34.9	Very low	118 Å²	118	149.1 Å²	149.1	72%	0.715	75%	0.752	S	S	*	*			trans	95.5	105.8	167.8	-169.5	0	0	0	0	118.5
454	D	27.4	Very low	35.1	Very low	146 Å²	146	151.7 Å²	151.7	78%	0.781	76%	0.757	S	S	*	*			trans	34.7	153.7	138.1	-60.6	-86.2	0	0	0	126.5
455	S	29.2	Very low	35.1	Very low	93 Å²	93	154.6 Å²	154.6	65%	0.65	78%	0.775	S	S	*	*			trans	105.3	104.8	144.6	-64.1	0	0	0	0	121.4
456	R	31.2	Very low	35	Very low	226 Å²	226	147.5 Å²	147.5	85%	0.853	77%	0.773	S	S	*	*				65.5	117.2	122.9	-62.9	173.9	180	-179.5	0.5	121
457	S	32.5	Very low	35.3	Very low	107 Å²	107	145 Å²	145	75%	0.748	78%	0.784	S	S	*	*			trans	90.9	154.9	133.6	86.3	0	0	0	0	120.3
458	S	38.7	Very low	35.8	Very low	104 Å²	104	142.5 Å²	142.5	73%	0.727	78%	0.781	S	S	*	*			trans	67.4	101.7	159.5	-49.2	0	0	0	0	116.1
459	R	32.4	Very low	36	Very low	235 Å²	235	145.4 Å²	145.4	89%	0.887	79%	0.788	S	S	*	*				46.4	99.3	66	-71.6	-171.6	175.2	155.2	0.8	114.6
460	Q	40	Very low	36.5	Very low	178 Å²	178	149 Å²	149	83%	0.832	79%	0.79	S	S	*	*			trans	178.4	121.3	132.4	-93.3	153.1	26.1	0	0	105.6
461	D	31.3	Very low	37.2	Very low	139 Å²	139	152.1 Å²	152.1	74%	0.743	80%	0.798	S	S	*	*				51.1	94.6	78.7	-68.6	-49.9	0	0	0	112.5
462	S	35.6	Very low	37.7	Very low	119 Å²	119	148 Å²	148	83%	0.832	79%	0.794	S	S	*	*			trans	-169.3	140.5	133.7	-85.6	0	0	0	0	113.9
463	Y	40.7	Very low	37.9	Very low	215 Å²	215	142.2 Å²	142.2	84%	0.843	79%	0.79	S	S	*	*			trans	-63.7	147.8	173.8	-45.3	-92.4	0	0	0	111.3
464	N	39.7	Very low	38	Very low	164 Å²	164	139.7 Å²	139.7	88%	0.877	79%	0.789	S	S	*	*			trans	-129.5	111	156.4	-163.2	12.3	0	0	0	110.2
465	M	36.4	Very low	39	Very low	181 Å²	181	138.7 Å²	138.7	89%	0.892	79%	0.793	S	S	*	*			trans	-105.3	141.4	171.9	-79.3	-87.9	-134.2	0	0	107.9
466	G	38.9	Very low	39.9	Very low	86 Å²	86	139.7 Å²	139.7	89%	0.887	80%	0.797	S	S	*	*			trans	132.7	133.2	161.9	0	0	0	0	0	115
467	G	39.5	Very low	40.2	Very low	86 Å²	86	136.2 Å²	136.2	89%	0.887	80%	0.796	S	S	*	*			trans	152.1	70.1	178.3	0	0	0	0	0	112.3
468	S	45	Very low	40.7	Very low	103 Å²	103	139.6 Å²	139.6	72%	0.72	80%	0.804	S	S	*	*			trans	-102.3	140.8	-171.9	-176.2	0	0	0	0	113.2
469	L	41.6	Very low	40.7	Very low	157 Å²	157	140.5 Å²	140.5	82%	0.822	81%	0.811	S	S	*	*			trans	-169.4	107.4	152.9	-128.6	61.4	0	0	0	107.5
470	M	47.7	Very low	41.1	Very low	136 Å²	136	133.2 Å²	133.2	67%	0.67	81%	0.809	S	S	*	*				55.7	132.2	83.3	-61.5	177.6	87	0	0	112.9
471	K	51.9	Low	41	Very low	176 Å²	176	136.7 Å²	136.7	77%	0.765	81%	0.814	S	S	*	*			cis	-170.7	-168.7	5.6	-121.9	-171.3	178.3	-175.7	0	107.9
472	P	46.6	Very low	41.3	Very low	98 Å²	98	133.3 Å²	133.3	64%	0.636	81%	0.813	S	S	*	*				-135.9	176.8	-81.1	38	-15.9	0	0	0	117.4
473	S	35.1	Very low	41.5	Very low	119 Å²	119	132.9 Å²	132.9	83%	0.832	81%	0.81	S	S	*	*			trans	53.2	132.6	141.8	62.2	0	0	0	0	124.4
474	G	37.2	Very low	41.7	Very low	66 Å²	66	133.6 Å²	133.6	68%	0.68	81%	0.812	S	S	*	*			trans	150.4	80.5	156.3	0	0	0	0	0	113.7
475	S	48.4	Very low	41.6	Very low	124 Å²	124	131 Å²	131	87%	0.867	81%	0.807	S	S	*	*				100	132.9	92.8	-70.7	0	0	0	0	113.3
476	P	48	Very low	41.9	Very low	114 Å²	114	134.3 Å²	134.3	74%	0.74	81%	0.81	S	S	*	*			trans	-108.2	179	-169.8	41.6	-36.4	0	0	0	115.6
477	N	35.9	Very low	42.2	Very low	153 Å²	153	134.9 Å²	134.9	82%	0.818	80%	0.8	S	S	*	*			trans	74.4	121.7	171.8	-66.1	-35.4	0	0	0	118.1
478	L	44.2	Very low	42.4	Very low	178 Å²	178	135.9 Å²	135.9	93%	0.932	79%	0.793	S	S	*	*			trans	-152	130.1	134.4	-136.4	75.7	0	0	0	110.5
479	S	39.6	Very low	42.7	Very low	123 Å²	123	138.1 Å²	138.1	86%	0.86	80%	0.797	S	S	*	*			trans	-83.7	136.8	173.6	44.5	0	0	0	0	110.7
480	G	39.5	Very low	42.9	Very low	83 Å²	83	141.9 Å²	141.9	86%	0.856	80%	0.801	S	S	*	*			trans	-140.7	96.3	-179.4	0	0	0	0	0	111.6
481	R	38.1	Very low	42.7	Very low	250 Å²	250	138.8 Å²	138.8	94%	0.943	80%	0.804	S	S	*	*			trans	-89.1	129.7	-179.6	-172.3	-175.1	-171.4	-174	4.1	109.4
482	G	38.4	Very low	42	Very low	69 Å²	69	140.1 Å²	140.1	71%	0.711	80%	0.804	S	S	*	*			trans	-154.3	110.6	177	0	0	0	0	0	112
483	S	38.2	Very low	42.1	Very low	109 Å²	109	142.8 Å²	142.8	76%	0.762	81%	0.813	S	S	*	*			trans	-116.5	140	177	-55.4	0	0	0	0	109.8
484	Y	46.7	Very low	42.5	Very low	230 Å²	230	144 Å²	144	90%	0.902	81%	0.805	S	S	*	*			trans	-147.2	125.6	159.1	33.8	-93.1	0	0	0	110.6
485	S	37.5	Very low	42.9	Very low	110 Å²	110	149 Å²	149	77%	0.769	82%	0.817	S	S	*	*			trans	-99.7	157.4	-178.4	-42.1	0	0	0	0	111
486	R	42.5	Very low	42.5	Very low	251 Å²	251	146.2 Å²	146.2	95%	0.947	81%	0.808	S	S	*	*			trans	153	145.4	156.2	-87.9	155.3	-170.3	-161.6	3.4	108.1
487	S	44	Very low	42.2	Very low	97 Å²	97	147 Å²	147	68%	0.678	81%	0.813	S	S	*	*			cis	-168	158.4	-6.2	176	0	0	0	0	109.2
488	S	44.1	Very low	42.4	Very low	107 Å²	107	149 Å²	149	75%	0.748	82%	0.818	S	S	*	*			trans	61.6	141.3	154.2	39.8	0	0	0	0	119.6
489	D	50.8	Low	42.5	Very low	150 Å²	150	148.6 Å²	148.6	80%	0.802	81%	0.811	S	S	*	*			cis	141.6	162.6	0.4	177.9	31.7	0	0	0	106.9
490	R	46.6	Very low	42.4	Very low	236 Å²	236	149.1 Å²	149.1	89%	0.891	80%	0.804	S	S	*	*			trans	81.3	116.3	-157	-50.9	168.9	-169.1	-174.4	3.6	111.5
491	G	42.8	Very low	43	Very low	72 Å²	72	152.9 Å²	152.9	74%	0.742	80%	0.804	S	S	*	*			cis	88.6	134.6	12.8	0	0	0	0	0	111.4
492	R	38.7	Very low	43.4	Very low	203 Å²	203	149.1 Å²	149.1	77%	0.766	80%	0.803	S	S	*	*			cis	176.8	112	-10.1	169.6	-165.2	-178.4	168.7	4.7	103.6	E494	R492-E494 IonicContact CZ-OE2 2.65Å; R492-E494 IonicContact NE-OE2 3.57Å; R492-E494 PolarHBondContact NE-OE2 2.82Å; R492-E494 IonicContact NH2-OE2 3.04Å; R492-E494 PolarHBondContact NH2-OE2 2.88Å
493	D	47.3	Very low	43.8	Very low	155 Å²	155	156.6 Å²	156.6	83%	0.829	81%	0.809	S	S	*	*			trans	-151	110.7	173.6	32.5	-25	0	0	0	110.8
494	E	44.3	Very low	44.4	Very low	143 Å²	143	162.2 Å²	162.2	67%	0.668	81%	0.814	S	S	*	*			trans	-89.5	120.2	179.2	-64	163.9	69.4	0	0	108.7	R492	R492-E494 IonicContact CZ-OE2 2.65Å; R492-E494 IonicContact NE-OE2 3.57Å; R492-E494 PolarHBondContact NE-OE2 2.82Å; R492-E494 IonicContact NH2-OE2 3.04Å; R492-E494 PolarHBondContact NH2-OE2 2.88Å
495	N	44.4	Very low	44.7	Very low	171 Å²	171	161 Å²	161	91%	0.914	82%	0.816	S	S	*	*			trans	-164	115.9	163.1	-96.8	-45.7	0	0	0	113.6
496	G	41.2	Very low	45.4	Very low	66 Å²	66	159 Å²	159	68%	0.68	80%	0.796	S	S	*	*			trans	84	113.6	151.7	0	0	0	0	0	118.5
497	P	41.2	Very low	46.2	Very low	132 Å²	132	148.9 Å²	148.9	86%	0.857	76%	0.763	S	S	*	*			trans	-83	119.3	168.9	32.5	-30.2	0	0	0	110.8
498	Q	40.9	Very low	47.5	Very low	195 Å²	195	149.7 Å²	149.7	91%	0.911	76%	0.756	S	S	*	*			trans	-112.5	127.2	166.6	-74.5	-169.2	-16.3	0	0	111.4
499	H	45.1	Very low	49.2	Very low	169 Å²	169	149.7 Å²	149.7	78%	0.782	74%	0.743	S	S	*	*			trans	-64.9	144.1	-166.5	-112.8	-143	0	0	0	114.8
500	N	38.4	Very low	50.9	Low	134 Å²	134	142.5 Å²	142.5	72%	0.717	71%	0.705	S	S	*	*			trans	27	116.1	138.4	-78.4	-44.7	0	0	0	119
501	N	51.4	Low	52.8	Low	162 Å²	162	132 Å²	132	87%	0.866	67%	0.667	S	S	*	*			trans	-138.3	8.1	153	-93.8	-38.8	0	0	0	115.2	R503	N501-R503 PolarHBondContact O-N 3.42Å
502	D	47.6	Very low	54.8	Low	170 Å²	170	128.6 Å²	128.6	91%	0.909	63%	0.631	S	S	*	*			trans	-82.1	40.8	174.3	-90.8	-55	0	0	0	113.7
503	R	45.6	Very low	57	Low	227 Å²	227	123.6 Å²	123.6	86%	0.857	62%	0.615	S	S	*	*			trans	-90.9	111.6	161.6	-85	-170.7	174.2	-172.3	-1	108.6	N501 Q505	N501-R503 PolarHBondContact O-N 3.42Å; R503-Q505 PolarHBondContact O-N 3.03Å
504	R	51.7	Low	58.7	Low	226 Å²	226	119 Å²	119	85%	0.853	59%	0.59	S	S	*	*			trans	-27.7	131.5	167.9	-55.8	170.2	-170.6	172.4	2.9	110.6	I506	R504-I506 VanDerWaalsContact C-N 3.3Å; R504-I506 WeakPolarHBondContact O-CG1 3.44Å; R504-I506 PolarHBondContact O-N 2.96Å
505	Q	52.1	Low	60.5	Low	204 Å²	204	112.2 Å²	112.2	95%	0.953	56%	0.559	S	S	*	*			trans	-53.6	93.1	177.3	-73.4	174	-12.3	0	0	110.8	R503	R503-Q505 PolarHBondContact O-N 3.03Å
506	I	53.6	Low	62	Low	68 Å²	68	104.1 Å²	104.1	35%	0.349	52%	0.516	S	S	.	.			trans	-85.5	125.8	167.1	-74.3	155.3	0	0	0	104.2	R504 E508 I558	R504-I506 VanDerWaalsContact C-N 3.3Å; R504-I506 WeakPolarHBondContact O-CG1 3.44Å; R504-I506 PolarHBondContact O-N 2.96Å; I506-E508 HydrophobicContact CG2-CG 4.17Å; I506-E508 PolarHBondContact O-N 3.23Å; I506-I558 HydrophobicContact CB-CD1 4.37Å; I506-I558 HydrophobicContact CD1-CD1 3.89Å; I506-I558 HydrophobicContact CG1-CD1 3.89Å; I506-I558 HydrophobicContact CG2-CB 4.44Å; I506-I558 HydrophobicContact CG2-CD1 3.54Å; I506-I558 HydrophobicContact CG2-CG1 3.58Å; I506-I558 HydrophobicContact CG2-CG2 4.15Å
507	P	58.3	Low	63.7	Low	39 Å²	39	107.3 Å²	107.3	25%	0.253	51%	0.511	S	S	.	.			trans	-68.1	101.9	173.2	28.6	-31.9	0	0	0	107	K509 I561 A582 E583	P507-K509 VanDerWaalsContact C-N 3.27Å; P507-I561 WeakPolarHBondContact O-CD1 3.31Å; P507-A582 HydrophobicContact CB-CB 4.12Å; P507-A582 HydrophobicContact CG-CB 4.37Å; P507-E583 WeakPolarHBondContact CA-O 3.11Å; P507-E583 WeakPolarHBondContact CB-O 3.35Å
508	E	71.4	Confident	65.4	Low	115 Å²	115	103.8 Å²	103.8	54%	0.537	49%	0.489	S	S	.	.			trans	-84.4	-6.2	175.9	-70.2	179.3	175.3	0	0	111.8	I506 T554 Y555 I561	I506-E508 HydrophobicContact CG2-CG 4.17Å; I506-E508 PolarHBondContact O-N 3.23Å; E508-T554 HydrophobicContact CB-CG2 4.14Å; E508-T554 VanDerWaalsContact O-CA 3.29Å; E508-T554 WeakPolarHBondContact O-CA 3.47Å; E508-T554 WeakPolarHBondContact O-CG2 3.41Å; E508-Y555 PolarHBondContact O-N 3.35Å; E508-Y555 VanDerWaalsContact O-N 3.1Å; E508-I561 WeakPolarHBondContact O-CD1 3.05Å
509	K	80.5	Confident	67	Low	106 Å²	106	95.7 Å²	95.7	46%	0.461	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	145.7	-171.7	-66.2	178.4	-176.2	175.9	0	112.5	P507 L553 T554 A582 E583	P507-K509 VanDerWaalsContact C-N 3.27Å; K509-L553 CarbonylContact C-O 3.59Å; K509-L553 WeakPolarHBondContact CA-O 3.34Å; K509-T554 HydrophobicContact CG-CG2 4.43Å; K509-A582 WeakPolarHBondContact O-CA 3.34Å; K509-E583 HydrophobicContact CB-CB 4.11Å; K509-E583 PolarHBondContact O-N 3.42Å
510	V	85.4	Confident	68.5	Low	0 Å²	0	92.3 Å²	92.3	0%	0	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	120.3	178.1	174	0	0	0	0	108.9	V512 L553 Y555 I561 V580 H581	V510-V512 HydrophobicContact CG1-CG2 4.21Å; V510-L553 HydrophobicContact CB-CB 4.36Å; V510-L553 PolarHBondContact N-O 2.74Å; V510-L553 PolarHBondContact O-N 2.91Å; V510-Y555 HydrophobicContact CB-CD2 4.4Å; V510-Y555 HydrophobicContact CB-CE2 4.02Å; V510-Y555 HydrophobicContact CG2-CD2 3.88Å; V510-Y555 HydrophobicContact CG2-CE2 3.76Å; V510-I561 HydrophobicContact CG2-CB 3.94Å; V510-I561 HydrophobicContact CG2-CD1 4.35Å; V510-I561 HydrophobicContact CG2-CG1 3.71Å; V510-I561 HydrophobicContact CG2-CG2 3.52Å; V510-V580 HydrophobicContact CG1-CG1 3.37Å; V510-H581 CarbonylContact C-O 3.5Å; V510-H581 WeakPolarHBondContact CA-O 3.37Å
511	V	86.4	Confident	70.4	Confident	15 Å²	15	88.3 Å²	88.3	9%	0.091	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	113.7	174.4	-165.7	0	0	0	0	108.7	K513 I550 A551 F552 H581 E583	V511-K513 HydrophobicContact CG1-CD 4.49Å; V511-K513 HydrophobicContact CG1-CG 4.04Å; V511-I550 HydrophobicContact CG1-CG2 4.16Å; V511-A551 WeakPolarHBondContact CA-O 3.04Å; V511-F552 HydrophobicContact CB-CD1 4.45Å; V511-F552 HydrophobicContact CB-CE1 4.38Å; V511-F552 HydrophobicContact CG1-CD1 4.19Å; V511-F552 HydrophobicContact CG1-CE1 3.87Å; V511-F552 HydrophobicContact CG1-CZ 4.26Å; V511-F552 HydrophobicContact CG2-CD1 3.74Å; V511-F552 HydrophobicContact CG2-CE1 3.65Å; V511-H581 PolarHBondContact N-O 3.07Å; V511-H581 PolarHBondContact O-N 2.83Å; V511-E583 HydrophobicContact CG2-CB 4.01Å
512	V	85.2	Confident	71.8	Confident	0 Å²	0	86.9 Å²	86.9	0%	0	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	128.7	171.3	-175.7	0	0	0	0	107.6	V510 L515 F528 I550 A551 L553 R579 V580	V510-V512 HydrophobicContact CG1-CG2 4.21Å; V512-L515 HydrophobicContact CB-CD1 4.06Å; V512-L515 HydrophobicContact CG1-CD1 3.7Å; V512-L515 HydrophobicContact CG1-CD2 3.98Å; V512-L515 HydrophobicContact CG1-CG 3.63Å; V512-F528 HydrophobicContact CB-CZ 4.24Å; V512-F528 HydrophobicContact CG1-CE2 4.21Å; V512-F528 HydrophobicContact CG1-CZ 3.9Å; V512-F528 HydrophobicContact CG2-CE1 3.8Å; V512-F528 HydrophobicContact CG2-CE2 3.78Å; V512-F528 HydrophobicContact CG2-CZ 3.3Å; V512-I550 CarbonylContact O-C 3.5Å; V512-I550 VanDerWaalsContact O-CA 3.26Å; V512-I550 WeakPolarHBondContact O-CA 3.44Å; V512-A551 HydrophobicContact CB-CB 4.39Å; V512-A551 PolarHBondContact N-O 3.2Å; V512-A551 PolarHBondContact O-N 3.27Å; V512-L553 HydrophobicContact CB-CD1 4.22Å; V512-L553 HydrophobicContact CG2-CD1 3.35Å; V512-R579 CarbonylContact C-O 3.48Å; V512-R579 WeakPolarHBondContact CA-O 3.31Å; V512-V580 HydrophobicContact CG1-CG2 4.18Å; V512-V580 HydrophobicContact CG2-CG1 4.19Å; V512-V580 HydrophobicContact CG2-CG2 4.15Å
513	K	85.4	Confident	73.5	Confident	98 Å²	98	80.9 Å²	80.9	43%	0.426	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	157.1	178.8	-58.7	-175.1	-179.6	-177.5	0	110.2	V511 L515 G549 I550 R579	V511-K513 HydrophobicContact CG1-CD 4.49Å; V511-K513 HydrophobicContact CG1-CG 4.04Å; K513-L515 VanDerWaalsContact C-N 3.26Å; K513-L515 PolarHBondContact O-N 3.39Å; K513-G549 CarbonylContact C-O 3.37Å; K513-G549 WeakPolarHBondContact CA-O 3.17Å; K513-I550 HydrophobicContact CG-CG1 4.42Å; K513-I550 HydrophobicContact CG-CG2 4.5Å; K513-R579 HydrophobicContact CB-CB 4.41Å; K513-R579 PolarHBondContact N-O 2.88Å; K513-R579 PolarHBondContact O-N 2.92Å
514	N	83.5	Confident	75.2	Confident	58 Å²	58	70.2 Å²	70.2	31%	0.31	34%	0.337	S	S	.	.	S	Bend	trans	60.8	31.4	-176.8	-162.7	42.3	0	0	0	114	G549 R576 R577	N514-G549 PolarHBondContact N-O 3.37Å; N514-R576 VanDerWaalsContact OD1-CZ 3.31Å; N514-R576 PolarHBondContact OD1-NE 3.49Å; N514-R576 PolarHBondContact OD1-NH2 2.77Å; N514-R577 PolarHBondContact ND2-O 3.41Å
515	L	80.9	Confident	76.7	Confident	2 Å²	2	64.1 Å²	64.1	1%	0.01	32%	0.317	C	S	.	.			trans	-57.6	143.9	161.7	-74.9	153	0	0	0	109.5	V512 K513 F519 V524 L539 G549 A551 L578	V512-L515 HydrophobicContact CB-CD1 4.06Å; V512-L515 HydrophobicContact CG1-CD1 3.7Å; V512-L515 HydrophobicContact CG1-CD2 3.98Å; V512-L515 HydrophobicContact CG1-CG 3.63Å; K513-L515 VanDerWaalsContact C-N 3.26Å; K513-L515 PolarHBondContact O-N 3.39Å; L515-F519 HydrophobicContact CD2-CD1 3.81Å; L515-F519 HydrophobicContact CD2-CE1 4.45Å; L515-V524 HydrophobicContact CD1-CG2 3.98Å; L515-V524 HydrophobicContact CD2-CG2 3.96Å; L515-L539 HydrophobicContact CD1-CD1 4.21Å; L515-G549 PolarHBondContact N-O 3.33Å; L515-G549 VanDerWaalsContact O-CA 3.28Å; L515-G549 WeakPolarHBondContact O-CA 3.4Å; L515-A551 HydrophobicContact CD1-CB 3.55Å; L515-L578 HydrophobicContact CB-CD2 4.35Å; L515-L578 HydrophobicContact CD2-CD1 4.32Å; L515-L578 HydrophobicContact CD2-CD2 3.72Å; L515-L578 HydrophobicContact CG-CD2 4Å
516	P	77	Confident	78.1	Confident	1 Å²	1	62.1 Å²	62.1	1%	0.006	30%	0.301	C	S	.	.			trans	-64.8	148.2	172.7	32	-36.9	0	0	0	110.3	S518 F519 F573 E574	P516-S518 PolarHBondContact O-N 2.74Å; P516-F519 HydrophobicContact CG-CB 4.18Å; P516-F519 HydrophobicContact CG-CD1 4.32Å; P516-F519 HydrophobicContact CG-CD2 3.39Å; P516-F519 HydrophobicContact CG-CE2 3.77Å; P516-F519 HydrophobicContact CG-CG 3.7Å; P516-F519 HydrophobicContact CG-CZ 4.37Å; P516-F519 PolarHBondContact O-N 2.95Å; P516-F519 VanDerWaalsContact O-N 3.09Å; P516-F573 HydrophobicContact CG-CB 4.19Å; P516-E574 HydrophobicContact CB-CB 4.08Å; P516-E574 HydrophobicContact CB-CG 4.42Å
517	F	77	Confident	79.5	Confident	132 Å²	132	60.3 Å²	60.3	58%	0.579	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-12.6	-174.9	-57.4	-43.9	0	0	0	113.4	S547	F517-S547 VanDerWaalsContact CD1-O 3.24Å; F517-S547 WeakPolarHBondContact CD1-O 3.33Å
518	S	76.8	Confident	80.5	Confident	58 Å²	58	58.6 Å²	58.6	41%	0.406	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-16.4	172.2	53.8	0	0	0	0	114.3	P516 D520 E574	P516-S518 PolarHBondContact O-N 2.74Å; S518-D520 PolarHBondContact O-N 3.34Å; S518-E574 WeakPolarHBondContact CB-OE2 3.27Å; S518-E574 PolarHBondContact OG-OE1 2.9Å; S518-E574 PolarHBondContact OG-OE2 3.28Å
519	F	73.1	Confident	81.1	Confident	26 Å²	26	61.1 Å²	61.1	11%	0.114	28%	0.284	C	S	.	.			trans	-81.9	120.7	-177.5	-91.4	-145	0	0	0	110.9	L515 P516 D523 V524 I527 L539 S547 F573	L515-F519 HydrophobicContact CD2-CD1 3.81Å; L515-F519 HydrophobicContact CD2-CE1 4.45Å; P516-F519 HydrophobicContact CG-CB 4.18Å; P516-F519 HydrophobicContact CG-CD1 4.32Å; P516-F519 HydrophobicContact CG-CD2 3.39Å; P516-F519 HydrophobicContact CG-CE2 3.77Å; P516-F519 HydrophobicContact CG-CG 3.7Å; P516-F519 HydrophobicContact CG-CZ 4.37Å; P516-F519 PolarHBondContact O-N 2.95Å; P516-F519 VanDerWaalsContact O-N 3.09Å; F519-D523 HydrophobicContact CD1-CB 4.35Å; F519-D523 HydrophobicContact CG-CB 4.4Å; F519-V524 HydrophobicContact CB-CG2 4.39Å; F519-V524 HydrophobicContact CD1-CG2 4.22Å; F519-I527 HydrophobicContact CD1-CD1 4.39Å; F519-I527 HydrophobicContact CE1-CD1 3.37Å; F519-I527 HydrophobicContact CZ-CD1 3.68Å; F519-L539 WeakPolarHBondContact O-CD2 3.38Å; F519-S547 PolarHBondContact O-OG 2.95Å; F519-F573 HydrophobicContact CE1-CD1 4.1Å; F519-F573 HydrophobicContact CE1-CE1 4.38Å; F519-F573 HydrophobicContact CE1-CG 4.39Å; F519-F573 HydrophobicContact CE2-CD1 4.34Å; F519-F573 HydrophobicContact CZ-CB 4.24Å; F519-F573 AromaticContact CZ-CD1 3.44Å; F519-F573 HydrophobicContact CZ-CD1 3.44Å; F519-F573 VanDerWaalsContact CZ-CD1 3.44Å; F519-F573 AromaticContact CZ-CE1 3.94Å; F519-F573 HydrophobicContact CZ-CE1 3.94Å; F519-F573 AromaticContact CZ-CG 4Å; F519-F573 HydrophobicContact CZ-CG 4Å
520	D	78	Confident	81.1	Confident	98 Å²	98	63.9 Å²	63.9	52%	0.524	30%	0.299	S	S	.	.			trans	-86	166.9	170.8	-78.1	-32.4	0	0	0	112	S518 H522 D523 V524	S518-D520 PolarHBondContact O-N 3.34Å; D520-H522 PolarHBondContact O-N 2.75Å; D520-D523 PolarHBondContact O-N 2.92Å; D520-D523 VanDerWaalsContact O-N 3.08Å; D520-V524 PolarHBondContact O-N 3.44Å; D520-V524 VanDerWaalsContact O-N 3.14Å
521	S	77.8	Confident	80.7	Confident	49 Å²	49	64.7 Å²	64.7	34%	0.343	30%	0.304	S	S	.	.	H	α-helix	trans	-53.6	-30.2	174.5	-177.3	0	0	0	0	111.8	K525	S521-K525 VanDerWaalsContact O-CB 3.24Å; S521-K525 WeakPolarHBondContact O-CB 3.49Å; S521-K525 PolarHBondContact O-N 2.85Å
522	H	81.4	Confident	80.2	Confident	133 Å²	133	64.7 Å²	64.7	62%	0.616	31%	0.307	S	S	*	.	H	α-helix	trans	-72.5	-38.5	179.6	-143.8	100.4	0	0	0	113.4	D520 K525 R526	D520-H522 PolarHBondContact O-N 2.75Å; H522-K525 PolarHBondContact O-N 3.44Å; H522-R526 WeakPolarHBondContact O-CB 3.3Å; H522-R526 PolarHBondContact O-N 2.81Å
523	D	83.2	Confident	79.9	Confident	44 Å²	44	69.3 Å²	69.3	24%	0.235	33%	0.332	C	S	.	.	H	α-helix	trans	-75.2	-41	178.7	-61.7	-60.8	0	0	0	111.4	F519 D520 K525 R526 I527	F519-D523 HydrophobicContact CD1-CB 4.35Å; F519-D523 HydrophobicContact CG-CB 4.4Å; D520-D523 PolarHBondContact O-N 2.92Å; D520-D523 VanDerWaalsContact O-N 3.08Å; D523-K525 VanDerWaalsContact C-N 3.31Å; D523-K525 PolarHBondContact O-N 3.41Å; D523-R526 PolarHBondContact O-N 2.83Å; D523-R526 IonicContact OD1-CZ 3Å; D523-R526 IonicContact OD1-NH1 3.81Å; D523-R526 PolarHBondContact OD1-NH1 2.92Å; D523-R526 VanDerWaalsContact OD1-NH1 3.15Å; D523-I527 WeakPolarHBondContact O-CB 3.41Å; D523-I527 WeakPolarHBondContact O-CG1 3.43Å; D523-I527 PolarHBondContact O-N 2.94Å
524	V	81.1	Confident	79.6	Confident	2 Å²	2	65.9 Å²	65.9	1%	0.012	32%	0.318	C	S	.	.	H	α-helix	trans	-55.1	-49	168.8	175.9	0	0	0	0	109.8	L515 F519 D520 R526 I527 F528 L539 A551 L553	L515-V524 HydrophobicContact CD1-CG2 3.98Å; L515-V524 HydrophobicContact CD2-CG2 3.96Å; F519-V524 HydrophobicContact CB-CG2 4.39Å; F519-V524 HydrophobicContact CD1-CG2 4.22Å; D520-V524 PolarHBondContact O-N 3.44Å; D520-V524 VanDerWaalsContact O-N 3.14Å; V524-R526 PolarHBondContact O-N 3.07Å; V524-I527 PolarHBondContact O-N 3.16Å; V524-F528 HydrophobicContact CG1-CD2 3.77Å; V524-F528 HydrophobicContact CG1-CE2 4.16Å; V524-F528 WeakPolarHBondContact O-CB 3.34Å; V524-F528 WeakPolarHBondContact O-CD2 3.43Å; V524-F528 PolarHBondContact O-N 3.05Å; V524-L539 HydrophobicContact CG2-CD1 4.38Å; V524-A551 HydrophobicContact CG1-CB 3.89Å; V524-L553 HydrophobicContact CG1-CD1 4.28Å; V524-L553 HydrophobicContact CG1-CD2 4.04Å; V524-L553 HydrophobicContact CG1-CG 4.44Å
525	K	82.1	Confident	79.4	Confident	99 Å²	99	68.2 Å²	68.2	43%	0.43	33%	0.33	S	S	.	.	H	α-helix	trans	-62	-40.2	177.5	-168.6	175.9	-168.3	168.5	0	112.8	S521 H522 D523 R529 L534	S521-K525 VanDerWaalsContact O-CB 3.24Å; S521-K525 WeakPolarHBondContact O-CB 3.49Å; S521-K525 PolarHBondContact O-N 2.85Å; H522-K525 PolarHBondContact O-N 3.44Å; D523-K525 VanDerWaalsContact C-N 3.31Å; D523-K525 PolarHBondContact O-N 3.41Å; K525-R529 WeakPolarHBondContact O-CB 3.24Å; K525-R529 PolarHBondContact O-N 2.76Å; K525-R529 VanDerWaalsContact O-N 3.15Å; K525-L534 HydrophobicContact CG-CD1 4.24Å
526	R	82.2	Confident	79.2	Confident	161 Å²	161	72.1 Å²	72.1	61%	0.608	35%	0.354	S	S	*	.	H	α-helix	trans	-62.4	-49.4	178.1	-175.4	-174.8	-64.7	142.7	4.6	111.3	H522 D523 V524	H522-R526 WeakPolarHBondContact O-CB 3.3Å; H522-R526 PolarHBondContact O-N 2.81Å; D523-R526 PolarHBondContact O-N 2.83Å; D523-R526 IonicContact OD1-CZ 3Å; D523-R526 IonicContact OD1-NH1 3.81Å; D523-R526 PolarHBondContact OD1-NH1 2.92Å; D523-R526 VanDerWaalsContact OD1-NH1 3.15Å; V524-R526 PolarHBondContact O-N 3.07Å
527	I	83	Confident	79.3	Confident	31 Å²	31	73.4 Å²	73.4	16%	0.159	36%	0.363	C	S	.	.	H	α-helix	trans	-71.4	-46.4	-173.3	-72.1	165.9	0	0	0	111.3	F519 D523 V524 E530 F568 F573	F519-I527 HydrophobicContact CD1-CD1 4.39Å; F519-I527 HydrophobicContact CE1-CD1 3.37Å; F519-I527 HydrophobicContact CZ-CD1 3.68Å; D523-I527 WeakPolarHBondContact O-CB 3.41Å; D523-I527 WeakPolarHBondContact O-CG1 3.43Å; D523-I527 PolarHBondContact O-N 2.94Å; V524-I527 PolarHBondContact O-N 3.16Å; I527-E530 WeakPolarHBondContact O-CB 3.48Å; I527-E530 PolarHBondContact O-N 3.41Å; I527-F568 HydrophobicContact CG2-CD1 4.04Å; I527-F568 HydrophobicContact CG2-CE1 3.19Å; I527-F568 HydrophobicContact CG2-CE2 4.29Å; I527-F568 HydrophobicContact CG2-CZ 3.34Å; I527-F568 WeakPolarHBondContact O-CZ 3.14Å; I527-F573 HydrophobicContact CD1-CE1 4.03Å; I527-F573 HydrophobicContact CD1-CZ 4.34Å; I527-F573 HydrophobicContact CG2-CZ 4.36Å
528	F	79.9	Confident	79.5	Confident	2 Å²	2	72.3 Å²	72.3	1%	0.009	36%	0.363	C	S	.	.	H	α-helix	trans	-75.2	-24.8	-178.4	-77.9	-78.4	0	0	0	113.4	V512 V524 E530 V531 G532 L534 L553 Y555 A564 F568 V580	V512-F528 HydrophobicContact CB-CZ 4.24Å; V512-F528 HydrophobicContact CG1-CE2 4.21Å; V512-F528 HydrophobicContact CG1-CZ 3.9Å; V512-F528 HydrophobicContact CG2-CE1 3.8Å; V512-F528 HydrophobicContact CG2-CE2 3.78Å; V512-F528 HydrophobicContact CG2-CZ 3.3Å; V524-F528 HydrophobicContact CG1-CD2 3.77Å; V524-F528 HydrophobicContact CG1-CE2 4.16Å; V524-F528 WeakPolarHBondContact O-CB 3.34Å; V524-F528 WeakPolarHBondContact O-CD2 3.43Å; V524-F528 PolarHBondContact O-N 3.05Å; F528-E530 VanDerWaalsContact C-N 3.25Å; F528-E530 PolarHBondContact O-N 3.32Å; F528-V531 PolarHBondContact O-N 2.99Å; F528-V531 VanDerWaalsContact O-N 3.16Å; F528-G532 PolarHBondContact O-N 2.73Å; F528-L534 HydrophobicContact CB-CD1 3.95Å; F528-L553 HydrophobicContact CB-CD2 3.42Å; F528-L553 VanDerWaalsContact CB-CD2 3.42Å; F528-L553 HydrophobicContact CD1-CD2 4.28Å; F528-L553 HydrophobicContact CD2-CD1 4.45Å; F528-L553 HydrophobicContact CD2-CD2 3.82Å; F528-L553 HydrophobicContact CG-CD2 3.57Å; F528-Y555 WeakPolarHBondContact CB-OH 3.37Å; F528-Y555 VanDerWaalsContact CD1-OH 3.24Å; F528-Y555 WeakPolarHBondContact CD1-OH 3.47Å; F528-A564 HydrophobicContact CD1-CB 4.21Å; F528-A564 HydrophobicContact CE1-CB 4.47Å; F528-F568 AromaticContact CD1-CD2 3.46Å; F528-F568 HydrophobicContact CD1-CD2 3.46Å; F528-F568 VanDerWaalsContact CD1-CD2 3.46Å; F528-F568 AromaticContact CD1-CE2 3.66Å; F528-F568 HydrophobicContact CD1-CE2 3.66Å; F528-F568 HydrophobicContact CD1-CG 4.23Å; F528-F568 HydrophobicContact CE1-CB 3.76Å; F528-F568 HydrophobicContact CE1-CD1 4.5Å; F528-F568 AromaticContact CE1-CD2 3.23Å; F528-F568 HydrophobicContact CE1-CD2 3.23Å; F528-F568 AromaticContact CE1-CE2 3.91Å; F528-F568 HydrophobicContact CE1-CE2 3.91Å; F528-F568 AromaticContact CE1-CG 3.59Å; F528-F568 HydrophobicContact CE1-CG 3.59Å; F528-F568 HydrophobicContact CG-CD2 4.42Å; F528-F568 HydrophobicContact CG-CE2 4.29Å; F528-F568 HydrophobicContact CZ-CB 3.97Å; F528-F568 HydrophobicContact CZ-CD2 4.01Å; F528-F568 AromaticContact CZ-CG 3.93Å; F528-F568 HydrophobicContact CZ-CG 3.93Å; F528-V580 HydrophobicContact CE1-CG2 4.43Å; F528-V580 HydrophobicContact CZ-CG2 4.33Å
529	R	82.5	Confident	79.8	Confident	168 Å²	168	70.2 Å²	70.2	63%	0.634	35%	0.347	S	S	*	.	H	α-helix	trans	-64.9	-24.4	172.2	-175.7	177.2	-173.3	-161.5	1	113.8	K525 V531 G532 L534	K525-R529 WeakPolarHBondContact O-CB 3.24Å; K525-R529 PolarHBondContact O-N 2.76Å; K525-R529 VanDerWaalsContact O-N 3.15Å; R529-V531 PolarHBondContact O-N 3.4Å; R529-G532 WeakPolarHBondContact CA-O 3.08Å; R529-L534 HydrophobicContact CB-CD1 4.41Å
530	E	81.2	Confident	80.3	Confident	165 Å²	165	70.8 Å²	70.8	77%	0.771	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-23.5	175	-168	178.4	173.5	0	0	112.2	I527 F528	I527-E530 WeakPolarHBondContact O-CB 3.48Å; I527-E530 PolarHBondContact O-N 3.41Å; F528-E530 VanDerWaalsContact C-N 3.25Å; F528-E530 PolarHBondContact O-N 3.32Å
531	V	76.6	Confident	80.3	Confident	17 Å²	17	69.8 Å²	69.8	10%	0.103	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-23	-170.7	-178.1	0	0	0	0	113.2	F528 R529 R563 A564 A567 F568	F528-V531 PolarHBondContact O-N 2.99Å; F528-V531 VanDerWaalsContact O-N 3.16Å; R529-V531 PolarHBondContact O-N 3.4Å; V531-R563 HydrophobicContact CG1-CB 3.41Å; V531-R563 VanDerWaalsContact CG1-CB 3.41Å; V531-R563 WeakPolarHBondContact CG1-O 3.34Å; V531-R563 PolarHBondContact O-NH1 2.96Å; V531-A564 HydrophobicContact CG1-CB 4.37Å; V531-A567 HydrophobicContact CG1-CB 4.18Å; V531-A567 HydrophobicContact CG2-CB 4.19Å; V531-F568 HydrophobicContact CB-CE2 3.87Å; V531-F568 HydrophobicContact CG1-CE2 4.48Å; V531-F568 HydrophobicContact CG2-CD2 4.31Å; V531-F568 HydrophobicContact CG2-CE2 3.32Å; V531-F568 HydrophobicContact CG2-CZ 3.71Å
532	G	75.9	Confident	80.1	Confident	14 Å²	14	69.8 Å²	69.8	14%	0.144	35%	0.347	C	S	.	.	S	Bend	trans	-171.3	162.7	167.9	0	0	0	0	0	112.8	F528 R529 L534 Y555	F528-G532 PolarHBondContact O-N 2.73Å; R529-G532 WeakPolarHBondContact CA-O 3.08Å; G532-L534 PolarHBondContact O-N 2.89Å; G532-Y555 WeakPolarHBondContact O-CE1 3.44Å
533	D	79.8	Confident	79.5	Confident	98 Å²	98	68.6 Å²	68.6	52%	0.524	36%	0.359	S	S	.	.			trans	-72.7	124.9	179.4	-79.2	-55.9	0	0	0	112	Y555 A556	D533-Y555 CarbonylContact O-C 3.57Å; D533-Y555 VanDerWaalsContact O-CA 3.32Å; D533-Y555 WeakPolarHBondContact O-CA 3.48Å; D533-Y555 WeakPolarHBondContact O-CD1 3.31Å; D533-A556 HydrophobicContact CB-CB 4.34Å; D533-A556 PolarHBondContact O-N 2.99Å
534	L	79.1	Confident	78.4	Confident	26 Å²	26	73.6 Å²	73.6	14%	0.136	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	116.8	-177.1	-67.9	173	0	0	0	111.1	K525 F528 R529 G532 L553 T554 Y555	K525-L534 HydrophobicContact CG-CD1 4.24Å; F528-L534 HydrophobicContact CB-CD1 3.95Å; R529-L534 HydrophobicContact CB-CD1 4.41Å; G532-L534 PolarHBondContact O-N 2.89Å; L534-L553 HydrophobicContact CD1-CD2 3.84Å; L534-L553 HydrophobicContact CD2-CB 3.87Å; L534-L553 HydrophobicContact CD2-CD2 3.58Å; L534-L553 HydrophobicContact CD2-CG 4.33Å; L534-L553 HydrophobicContact CG-CD2 4.38Å; L534-T554 CarbonylContact C-O 3.52Å; L534-Y555 HydrophobicContact CD2-CD1 3.83Å; L534-Y555 HydrophobicContact CD2-CD2 4.02Å; L534-Y555 HydrophobicContact CD2-CE1 3.52Å; L534-Y555 HydrophobicContact CD2-CE2 3.72Å; L534-Y555 HydrophobicContact CD2-CG 4.08Å; L534-Y555 VanDerWaalsContact CD2-CZ 3.46Å; L534-Y555 HydrophobicContact CG-CE1 4.19Å
535	N	79	Confident	77.7	Confident	107 Å²	107	76 Å²	76	57%	0.572	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.4	-50.2	169.8	-78.6	-5.7	0	0	0	111	T554	N535-T554 PolarHBondContact N-O 3.38Å
536	T	76.7	Confident	77.1	Confident	84 Å²	84	77.2 Å²	77.2	52%	0.515	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	144.7	178.5	57	0	0	0	0	111.2	L553 T554	T536-L553 CarbonylContact O-C 3.39Å; T536-L553 WeakPolarHBondContact O-CA 3.33Å; T536-T554 PolarHBondContact N-O 3.11Å; T536-T554 PolarHBondContact O-N 2.9Å; T536-T554 VanDerWaalsContact OG1-CB 3.24Å; T536-T554 WeakPolarHBondContact OG1-CB 3.3Å; T536-T554 PolarHBondContact OG1-OG1 2.84Å
537	C	78.5	Confident	76.5	Confident	28 Å²	28	69.9 Å²	69.9	19%	0.189	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	118.9	172.8	56.2	0	0	0	0	108.6	F552 L553	C537-F552 WeakPolarHBondContact CA-O 3.37Å; C537-L553 HydrophobicContact CB-CG 4.47Å
538	N	82.3	Confident	76	Confident	108 Å²	108	72.2 Å²	72.2	58%	0.578	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.4	114.9	178.9	-171.6	15.3	0	0	0	109.1	A551 F552	N538-A551 WeakPolarHBondContact O-CA 3.42Å; N538-F552 PolarHBondContact N-O 3.45Å; N538-F552 PolarHBondContact O-N 3.44Å
539	L	82.5	Confident	76	Confident	15 Å²	15	72.2 Å²	72.2	8%	0.079	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	126.9	174.8	-175.1	69.3	0	0	0	108.4	L515 F519 V524 T541 S547 I550 A551	L515-L539 HydrophobicContact CD1-CD1 4.21Å; F519-L539 WeakPolarHBondContact O-CD2 3.38Å; V524-L539 HydrophobicContact CG2-CD1 4.38Å; L539-T541 PolarHBondContact O-N 3.27Å; L539-S547 WeakPolarHBondContact CD2-OG 3.47Å; L539-I550 WeakPolarHBondContact CD1-O 3.22Å; L539-A551 HydrophobicContact CD1-CB 3.87Å
540	V	83.1	Confident	76.1	Confident	38 Å²	38	66.5 Å²	66.5	23%	0.23	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	108.8	174.5	-171.5	0	0	0	0	108.1	Q548 I550 F552	V540-Q548 HydrophobicContact CB-CB 4.39Å; V540-Q548 HydrophobicContact CG1-CB 4.25Å; V540-Q548 HydrophobicContact CG1-CG 4.16Å; V540-Q548 VanDerWaalsContact CG1-OE1 3.3Å; V540-Q548 WeakPolarHBondContact O-CB 3.49Å; V540-Q548 PolarHBondContact O-N 3.02Å; V540-I550 HydrophobicContact CB-CB 4.25Å; V540-I550 WeakPolarHBondContact CB-O 3.38Å; V540-I550 HydrophobicContact CG2-CB 4.1Å; V540-I550 HydrophobicContact CG2-CG2 3.98Å; V540-I550 PolarHBondContact N-O 2.89Å; V540-F552 HydrophobicContact CG2-CD2 3.75Å; V540-F552 HydrophobicContact CG2-CE2 3.51Å
541	T	77.7	Confident	76.3	Confident	77 Å²	77	58.7 Å²	58.7	47%	0.472	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	141.2	168.6	55.4	0	0	0	0	109.5	L539 H546	L539-T541 PolarHBondContact O-N 3.27Å; T541-H546 CarbonylContact C-O 3.59Å; T541-H546 WeakPolarHBondContact CA-O 3.46Å
542	D	74.2	Confident	76.8	Confident	49 Å²	49	61.6 Å²	61.6	26%	0.262	36%	0.355	S	S	.	.			trans	-68.8	167.1	171.2	-167.7	27.4	0	0	0	111	Q544 G545 H546 Q548	D542-Q544 PolarHBondContact O-N 2.92Å; D542-G545 PolarHBondContact O-N 2.93Å; D542-H546 PolarHBondContact N-O 3Å; D542-Q548 HydrophobicContact CB-CG 3.95Å; D542-Q548 PolarHBondContact OD1-NE2 3.49Å
543	A	69.2	Low	77.2	Confident	107 Å²	107	61 Å²	61	88%	0.884	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-16.3	179.3	0	0	0	0	0	113.9
544	Q	59.8	Low	77.4	Confident	149 Å²	149	57.4 Å²	57.4	70%	0.696	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	4.2	175.3	-60.1	-177.6	-8.4	0	0	114	D542 H546	D542-Q544 PolarHBondContact O-N 2.92Å; Q544-H546 VanDerWaalsContact C-N 3.27Å; Q544-H546 PolarHBondContact O-N 3.16Å
545	G	67.2	Low	77.6	Confident	54 Å²	54	56.2 Å²	56.2	56%	0.557	32%	0.324	S	S	*	.	S	Bend	trans	82.4	-8.1	-177.3	0	0	0	0	0	115	D542	D542-G545 PolarHBondContact O-N 2.93Å
546	H	67.9	Low	77.7	Confident	124 Å²	124	53.7 Å²	53.7	57%	0.574	32%	0.317	S	S	*	.			trans	-70.7	127.5	176.7	-62.7	110	0	0	0	111.8	T541 D542 Q544 Q548	T541-H546 CarbonylContact C-O 3.59Å; T541-H546 WeakPolarHBondContact CA-O 3.46Å; D542-H546 PolarHBondContact N-O 3Å; Q544-H546 VanDerWaalsContact C-N 3.27Å; Q544-H546 PolarHBondContact O-N 3.16Å; H546-Q548 PolarHBondContact O-N 3.5Å
547	S	71.5	Confident	77.9	Confident	7 Å²	7	54.3 Å²	54.3	5%	0.049	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	119.3	172.9	-58.8	0	0	0	0	111.1	F517 F519 L539 G549	F517-S547 VanDerWaalsContact CD1-O 3.24Å; F517-S547 WeakPolarHBondContact CD1-O 3.33Å; F519-S547 PolarHBondContact O-OG 2.95Å; L539-S547 WeakPolarHBondContact CD2-OG 3.47Å; S547-G549 PolarHBondContact O-N 2.94Å
548	Q	71.7	Confident	78	Confident	80 Å²	80	56 Å²	56	37%	0.374	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	6.8	179.4	-65.5	-167.4	-8.6	0	0	113.7	V540 D542 H546 I550	V540-Q548 HydrophobicContact CB-CB 4.39Å; V540-Q548 HydrophobicContact CG1-CB 4.25Å; V540-Q548 HydrophobicContact CG1-CG 4.16Å; V540-Q548 VanDerWaalsContact CG1-OE1 3.3Å; V540-Q548 WeakPolarHBondContact O-CB 3.49Å; V540-Q548 PolarHBondContact O-N 3.02Å; D542-Q548 HydrophobicContact CB-CG 3.95Å; D542-Q548 PolarHBondContact OD1-NE2 3.49Å; H546-Q548 PolarHBondContact O-N 3.5Å; Q548-I550 PolarHBondContact O-N 3.06Å
549	G	79.6	Confident	78	Confident	2 Å²	2	56.4 Å²	56.4	2%	0.021	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	68.3	20.1	-175.4	0	0	0	0	0	113.8	K513 N514 L515 S547	K513-G549 CarbonylContact C-O 3.37Å; K513-G549 WeakPolarHBondContact CA-O 3.17Å; N514-G549 PolarHBondContact N-O 3.37Å; L515-G549 PolarHBondContact N-O 3.33Å; L515-G549 VanDerWaalsContact O-CA 3.28Å; L515-G549 WeakPolarHBondContact O-CA 3.4Å; S547-G549 PolarHBondContact O-N 2.94Å
550	I	85.7	Confident	78	Confident	48 Å²	48	56 Å²	56	25%	0.246	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	126.7	179.3	-58.1	173.6	0	0	0	109.4	V511 V512 K513 L539 V540 Q548 F552	V511-I550 HydrophobicContact CG1-CG2 4.16Å; V512-I550 CarbonylContact O-C 3.5Å; V512-I550 VanDerWaalsContact O-CA 3.26Å; V512-I550 WeakPolarHBondContact O-CA 3.44Å; K513-I550 HydrophobicContact CG-CG1 4.42Å; K513-I550 HydrophobicContact CG-CG2 4.5Å; L539-I550 WeakPolarHBondContact CD1-O 3.22Å; V540-I550 HydrophobicContact CB-CB 4.25Å; V540-I550 WeakPolarHBondContact CB-O 3.38Å; V540-I550 HydrophobicContact CG2-CB 4.1Å; V540-I550 HydrophobicContact CG2-CG2 3.98Å; V540-I550 PolarHBondContact N-O 2.89Å; Q548-I550 PolarHBondContact O-N 3.06Å; I550-F552 HydrophobicContact CG2-CE2 4.06Å; I550-F552 HydrophobicContact CG2-CZ 4.46Å
551	A	84.3	Confident	78	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.008	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	138.5	172.8	0	0	0	0	0	111.2	V511 V512 L515 V524 N538 L539 L553	V511-A551 WeakPolarHBondContact CA-O 3.04Å; V512-A551 HydrophobicContact CB-CB 4.39Å; V512-A551 PolarHBondContact N-O 3.2Å; V512-A551 PolarHBondContact O-N 3.27Å; L515-A551 HydrophobicContact CD1-CB 3.55Å; V524-A551 HydrophobicContact CG1-CB 3.89Å; N538-A551 WeakPolarHBondContact O-CA 3.42Å; L539-A551 HydrophobicContact CD1-CB 3.87Å; A551-L553 HydrophobicContact CB-CD1 3.99Å
552	F	87.2	Confident	78.3	Confident	78 Å²	78	56.9 Å²	56.9	34%	0.342	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	117.3	169.6	-66.6	-88.3	0	0	0	108.5	V511 C537 N538 V540 I550	V511-F552 HydrophobicContact CB-CD1 4.45Å; V511-F552 HydrophobicContact CB-CE1 4.38Å; V511-F552 HydrophobicContact CG1-CD1 4.19Å; V511-F552 HydrophobicContact CG1-CE1 3.87Å; V511-F552 HydrophobicContact CG1-CZ 4.26Å; V511-F552 HydrophobicContact CG2-CD1 3.74Å; V511-F552 HydrophobicContact CG2-CE1 3.65Å; C537-F552 WeakPolarHBondContact CA-O 3.37Å; N538-F552 PolarHBondContact N-O 3.45Å; N538-F552 PolarHBondContact O-N 3.44Å; V540-F552 HydrophobicContact CG2-CD2 3.75Å; V540-F552 HydrophobicContact CG2-CE2 3.51Å; I550-F552 HydrophobicContact CG2-CE2 4.06Å; I550-F552 HydrophobicContact CG2-CZ 4.46Å
553	L	84.4	Confident	78.7	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.005	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	141.6	176.6	-61.1	98.9	0	0	0	108.9	K509 V510 V512 V524 F528 L534 T536 C537 A551 Y555	K509-L553 CarbonylContact C-O 3.59Å; K509-L553 WeakPolarHBondContact CA-O 3.34Å; V510-L553 HydrophobicContact CB-CB 4.36Å; V510-L553 PolarHBondContact N-O 2.74Å; V510-L553 PolarHBondContact O-N 2.91Å; V512-L553 HydrophobicContact CB-CD1 4.22Å; V512-L553 HydrophobicContact CG2-CD1 3.35Å; V524-L553 HydrophobicContact CG1-CD1 4.28Å; V524-L553 HydrophobicContact CG1-CD2 4.04Å; V524-L553 HydrophobicContact CG1-CG 4.44Å; F528-L553 HydrophobicContact CB-CD2 3.42Å; F528-L553 VanDerWaalsContact CB-CD2 3.42Å; F528-L553 HydrophobicContact CD1-CD2 4.28Å; F528-L553 HydrophobicContact CD2-CD1 4.45Å; F528-L553 HydrophobicContact CD2-CD2 3.82Å; F528-L553 HydrophobicContact CG-CD2 3.57Å; L534-L553 HydrophobicContact CD1-CD2 3.84Å; L534-L553 HydrophobicContact CD2-CB 3.87Å; L534-L553 HydrophobicContact CD2-CD2 3.58Å; L534-L553 HydrophobicContact CD2-CG 4.33Å; L534-L553 HydrophobicContact CG-CD2 4.38Å; T536-L553 CarbonylContact O-C 3.39Å; T536-L553 WeakPolarHBondContact O-CA 3.33Å; C537-L553 HydrophobicContact CB-CG 4.47Å; A551-L553 HydrophobicContact CB-CD1 3.99Å; L553-Y555 HydrophobicContact CB-CE2 4.13Å
554	T	83.5	Confident	79.4	Confident	23 Å²	23	56.5 Å²	56.5	14%	0.141	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	122.7	172.1	-45.4	0	0	0	0	107.3	E508 K509 L534 N535 T536	E508-T554 HydrophobicContact CB-CG2 4.14Å; E508-T554 VanDerWaalsContact O-CA 3.29Å; E508-T554 WeakPolarHBondContact O-CA 3.47Å; E508-T554 WeakPolarHBondContact O-CG2 3.41Å; K509-T554 HydrophobicContact CG-CG2 4.43Å; L534-T554 CarbonylContact C-O 3.52Å; N535-T554 PolarHBondContact N-O 3.38Å; T536-T554 PolarHBondContact N-O 3.11Å; T536-T554 PolarHBondContact O-N 2.9Å; T536-T554 VanDerWaalsContact OG1-CB 3.24Å; T536-T554 WeakPolarHBondContact OG1-CB 3.3Å; T536-T554 PolarHBondContact OG1-OG1 2.84Å
555	Y	84.2	Confident	80.6	Confident	1 Å²	1	51.3 Å²	51.3	0%	0.004	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	157.2	179.2	-73.9	-96.6	0	0	0	111.1	E508 V510 F528 G532 D533 L534 L553 I561 A564	E508-Y555 PolarHBondContact O-N 3.35Å; E508-Y555 VanDerWaalsContact O-N 3.1Å; V510-Y555 HydrophobicContact CB-CD2 4.4Å; V510-Y555 HydrophobicContact CB-CE2 4.02Å; V510-Y555 HydrophobicContact CG2-CD2 3.88Å; V510-Y555 HydrophobicContact CG2-CE2 3.76Å; F528-Y555 WeakPolarHBondContact CB-OH 3.37Å; F528-Y555 VanDerWaalsContact CD1-OH 3.24Å; F528-Y555 WeakPolarHBondContact CD1-OH 3.47Å; G532-Y555 WeakPolarHBondContact O-CE1 3.44Å; D533-Y555 CarbonylContact O-C 3.57Å; D533-Y555 VanDerWaalsContact O-CA 3.32Å; D533-Y555 WeakPolarHBondContact O-CA 3.48Å; D533-Y555 WeakPolarHBondContact O-CD1 3.31Å; L534-Y555 HydrophobicContact CD2-CD1 3.83Å; L534-Y555 HydrophobicContact CD2-CD2 4.02Å; L534-Y555 HydrophobicContact CD2-CE1 3.52Å; L534-Y555 HydrophobicContact CD2-CE2 3.72Å; L534-Y555 HydrophobicContact CD2-CG 4.08Å; L534-Y555 VanDerWaalsContact CD2-CZ 3.46Å; L534-Y555 HydrophobicContact CG-CE1 4.19Å; L553-Y555 HydrophobicContact CB-CE2 4.13Å; Y555-I561 HydrophobicContact CD2-CD1 4.38Å; Y555-I561 HydrophobicContact CD2-CG1 3.51Å; Y555-I561 HydrophobicContact CE2-CG1 4.39Å; Y555-I561 HydrophobicContact CG-CG1 3.79Å; Y555-A564 HydrophobicContact CE1-CB 4.44Å; Y555-A564 HydrophobicContact CE2-CB 4.01Å; Y555-A564 WeakPolarHBondContact OH-CB 3.39Å
556	A	81.1	Confident	81.4	Confident	53 Å²	53	55.8 Å²	55.8	44%	0.438	28%	0.277	S	S	.	.	S	Bend	trans	-70.2	-37.6	167.2	0	0	0	0	0	111.8	D533	D533-A556 HydrophobicContact CB-CB 4.34Å; D533-A556 PolarHBondContact O-N 2.99Å
557	D	80.1	Confident	82.2	Confident	97 Å²	97	51.4 Å²	51.4	52%	0.519	26%	0.262	S	S	.	.			trans	-118.3	143.2	-173.5	-69.3	-44.4	0	0	0	113.3	D559 G560 I561	D557-D559 VanDerWaalsContact C-N 3.28Å; D557-D559 PolarHBondContact O-N 2.88Å; D557-G560 PolarHBondContact O-N 3.43Å; D557-G560 VanDerWaalsContact O-N 3.11Å; D557-I561 PolarHBondContact O-N 3.39Å
558	I	81.1	Confident	82.6	Confident	64 Å²	64	51.3 Å²	51.3	33%	0.328	26%	0.261	S	S	.	.	H	α-helix	trans	-62.5	-37.2	174.1	-33.6	-178.2	0	0	0	111	I506 G560 I561 Y562	I506-I558 HydrophobicContact CB-CD1 4.37Å; I506-I558 HydrophobicContact CD1-CD1 3.89Å; I506-I558 HydrophobicContact CG1-CD1 3.89Å; I506-I558 HydrophobicContact CG2-CB 4.44Å; I506-I558 HydrophobicContact CG2-CD1 3.54Å; I506-I558 HydrophobicContact CG2-CG1 3.58Å; I506-I558 HydrophobicContact CG2-CG2 4.15Å; I558-G560 VanDerWaalsContact C-N 3.29Å; I558-G560 PolarHBondContact O-N 2.93Å; I558-I561 WeakPolarHBondContact O-CB 3.49Å; I558-I561 PolarHBondContact O-N 3.15Å; I558-I561 VanDerWaalsContact O-N 3.11Å; I558-Y562 HydrophobicContact CG2-CD2 4.12Å; I558-Y562 HydrophobicContact CG2-CE2 3.65Å; I558-Y562 WeakPolarHBondContact O-CD2 3.08Å; I558-Y562 PolarHBondContact O-N 3.36Å; I558-Y562 VanDerWaalsContact O-N 3.13Å
559	D	82.4	Confident	83.2	Confident	116 Å²	116	51.1 Å²	51.1	62%	0.62	26%	0.262	S	S	*	.	H	α-helix	trans	-64	-35.1	175.3	-69.4	-83.4	0	0	0	111.9	D557 I561 Y562 R563	D557-D559 VanDerWaalsContact C-N 3.28Å; D557-D559 PolarHBondContact O-N 2.88Å; D559-I561 PolarHBondContact O-N 3.4Å; D559-Y562 PolarHBondContact O-N 3.14Å; D559-R563 WeakPolarHBondContact O-CB 3.3Å; D559-R563 WeakPolarHBondContact O-CG 3.25Å; D559-R563 PolarHBondContact O-N 2.68Å
560	G	81.7	Confident	83.3	Confident	6 Å²	6	52.8 Å²	52.8	6%	0.062	28%	0.28	C	S	.	.	H	α-helix	trans	-58.1	-36.2	172.2	0	0	0	0	0	112.3	D557 I558 A564	D557-G560 PolarHBondContact O-N 3.43Å; D557-G560 VanDerWaalsContact O-N 3.11Å; I558-G560 VanDerWaalsContact C-N 3.29Å; I558-G560 PolarHBondContact O-N 2.93Å; G560-A564 WeakPolarHBondContact O-CB 3.36Å; G560-A564 PolarHBondContact O-N 3.21Å
561	I	83.3	Confident	83.1	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-72	-48.3	179.9	-65.5	175.6	0	0	0	111.7	P507 E508 V510 Y555 D557 I558 D559 A564 I565 A582	P507-I561 WeakPolarHBondContact O-CD1 3.31Å; E508-I561 WeakPolarHBondContact O-CD1 3.05Å; V510-I561 HydrophobicContact CG2-CB 3.94Å; V510-I561 HydrophobicContact CG2-CD1 4.35Å; V510-I561 HydrophobicContact CG2-CG1 3.71Å; V510-I561 HydrophobicContact CG2-CG2 3.52Å; Y555-I561 HydrophobicContact CD2-CD1 4.38Å; Y555-I561 HydrophobicContact CD2-CG1 3.51Å; Y555-I561 HydrophobicContact CE2-CG1 4.39Å; Y555-I561 HydrophobicContact CG-CG1 3.79Å; D557-I561 PolarHBondContact O-N 3.39Å; I558-I561 WeakPolarHBondContact O-CB 3.49Å; I558-I561 PolarHBondContact O-N 3.15Å; I558-I561 VanDerWaalsContact O-N 3.11Å; D559-I561 PolarHBondContact O-N 3.4Å; I561-A564 PolarHBondContact O-N 3.33Å; I561-I565 HydrophobicContact CG2-CD1 4.04Å; I561-I565 WeakPolarHBondContact O-CG1 3.32Å; I561-I565 PolarHBondContact O-N 3.44Å; I561-A582 HydrophobicContact CG2-CB 3.92Å
562	Y	84	Confident	82.6	Confident	133 Å²	133	60.5 Å²	60.5	52%	0.522	31%	0.314	S	S	.	.	H	α-helix	trans	-63.7	-43	176.8	-72.3	-61.1	0	0	0	111.8	I558 D559 A564 I565 D566	I558-Y562 HydrophobicContact CG2-CD2 4.12Å; I558-Y562 HydrophobicContact CG2-CE2 3.65Å; I558-Y562 WeakPolarHBondContact O-CD2 3.08Å; I558-Y562 PolarHBondContact O-N 3.36Å; I558-Y562 VanDerWaalsContact O-N 3.13Å; D559-Y562 PolarHBondContact O-N 3.14Å; Y562-A564 VanDerWaalsContact C-N 3.33Å; Y562-A564 PolarHBondContact O-N 3.3Å; Y562-I565 PolarHBondContact O-N 2.79Å; Y562-D566 WeakPolarHBondContact O-CB 3.35Å; Y562-D566 PolarHBondContact O-N 2.76Å
563	R	83.4	Confident	82	Confident	148 Å²	148	59.1 Å²	59.1	56%	0.558	31%	0.308	S	S	*	.	H	α-helix	trans	-63.2	-39.2	174.8	-65	173	92.1	-130.5	7.5	111.1	V531 D559 A567	V531-R563 HydrophobicContact CG1-CB 3.41Å; V531-R563 VanDerWaalsContact CG1-CB 3.41Å; V531-R563 WeakPolarHBondContact CG1-O 3.34Å; V531-R563 PolarHBondContact O-NH1 2.96Å; D559-R563 WeakPolarHBondContact O-CB 3.3Å; D559-R563 WeakPolarHBondContact O-CG 3.25Å; D559-R563 PolarHBondContact O-N 2.68Å; R563-A567 WeakPolarHBondContact O-CB 3.03Å; R563-A567 PolarHBondContact O-N 3.24Å
564	A	83.1	Confident	81.1	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-66.2	-38.8	177.8	0	0	0	0	0	113.1	F528 V531 Y555 G560 I561 Y562 F568	F528-A564 HydrophobicContact CD1-CB 4.21Å; F528-A564 HydrophobicContact CE1-CB 4.47Å; V531-A564 HydrophobicContact CG1-CB 4.37Å; Y555-A564 HydrophobicContact CE1-CB 4.44Å; Y555-A564 HydrophobicContact CE2-CB 4.01Å; Y555-A564 WeakPolarHBondContact OH-CB 3.39Å; G560-A564 WeakPolarHBondContact O-CB 3.36Å; G560-A564 PolarHBondContact O-N 3.21Å; I561-A564 PolarHBondContact O-N 3.33Å; Y562-A564 VanDerWaalsContact C-N 3.33Å; Y562-A564 PolarHBondContact O-N 3.3Å; A564-F568 WeakPolarHBondContact O-CB 3.49Å; A564-F568 WeakPolarHBondContact O-CD2 3.43Å; A564-F568 PolarHBondContact O-N 3.41Å
565	I	85.4	Confident	80.8	Confident	41 Å²	41	67.8 Å²	67.8	21%	0.21	37%	0.365	C	S	.	.	H	α-helix	trans	-65.3	-53.7	173.9	-67.8	157.9	0	0	0	110.1	I561 Y562 A567 F568 D569 V580 A582	I561-I565 HydrophobicContact CG2-CD1 4.04Å; I561-I565 WeakPolarHBondContact O-CG1 3.32Å; I561-I565 PolarHBondContact O-N 3.44Å; Y562-I565 PolarHBondContact O-N 2.79Å; I565-A567 VanDerWaalsContact C-N 3.33Å; I565-A567 PolarHBondContact O-N 3.46Å; I565-F568 PolarHBondContact O-N 3.25Å; I565-D569 HydrophobicContact CG2-CB 4.38Å; I565-D569 WeakPolarHBondContact O-CB 3.49Å; I565-D569 PolarHBondContact O-N 3.38Å; I565-V580 HydrophobicContact CB-CG1 4.49Å; I565-V580 HydrophobicContact CG1-CG1 3.9Å; I565-A582 HydrophobicContact CD1-CB 3.84Å
566	D	84.8	Confident	80.5	Confident	148 Å²	148	71.3 Å²	71.3	79%	0.791	38%	0.379	S	S	*	.	H	α-helix	trans	-62.9	-39.2	-177.1	-168.6	71.3	0	0	0	112.4	Y562	Y562-D566 WeakPolarHBondContact O-CB 3.35Å; Y562-D566 PolarHBondContact O-N 2.76Å
567	A	83.1	Confident	80.7	Confident	31 Å²	31	76.2 Å²	76.2	26%	0.256	39%	0.386	S	S	.	.	H	α-helix	trans	-80.7	-23.3	-178.6	0	0	0	0	0	114.4	V531 R563 I565 K571	V531-A567 HydrophobicContact CG1-CB 4.18Å; V531-A567 HydrophobicContact CG2-CB 4.19Å; R563-A567 WeakPolarHBondContact O-CB 3.03Å; R563-A567 PolarHBondContact O-N 3.24Å; I565-A567 VanDerWaalsContact C-N 3.33Å; I565-A567 PolarHBondContact O-N 3.46Å; A567-K571 WeakPolarHBondContact O-CD 3.4Å; A567-K571 WeakPolarHBondContact O-CE 3.32Å; A567-K571 PolarHBondContact O-NZ 3.34Å
568	F	80.2	Confident	80.9	Confident	5 Å²	5	71.6 Å²	71.6	2%	0.022	36%	0.361	C	S	.	.	H	α-helix	trans	-122	-18.4	-174.3	-65.4	-70.5	0	0	0	115.8	I527 F528 V531 A564 I565 G570 K571 F573 V580	I527-F568 HydrophobicContact CG2-CD1 4.04Å; I527-F568 HydrophobicContact CG2-CE1 3.19Å; I527-F568 HydrophobicContact CG2-CE2 4.29Å; I527-F568 HydrophobicContact CG2-CZ 3.34Å; I527-F568 WeakPolarHBondContact O-CZ 3.14Å; F528-F568 AromaticContact CD1-CD2 3.46Å; F528-F568 HydrophobicContact CD1-CD2 3.46Å; F528-F568 VanDerWaalsContact CD1-CD2 3.46Å; F528-F568 AromaticContact CD1-CE2 3.66Å; F528-F568 HydrophobicContact CD1-CE2 3.66Å; F528-F568 HydrophobicContact CD1-CG 4.23Å; F528-F568 HydrophobicContact CE1-CB 3.76Å; F528-F568 HydrophobicContact CE1-CD1 4.5Å; F528-F568 AromaticContact CE1-CD2 3.23Å; F528-F568 HydrophobicContact CE1-CD2 3.23Å; F528-F568 AromaticContact CE1-CE2 3.91Å; F528-F568 HydrophobicContact CE1-CE2 3.91Å; F528-F568 AromaticContact CE1-CG 3.59Å; F528-F568 HydrophobicContact CE1-CG 3.59Å; F528-F568 HydrophobicContact CG-CD2 4.42Å; F528-F568 HydrophobicContact CG-CE2 4.29Å; F528-F568 HydrophobicContact CZ-CB 3.97Å; F528-F568 HydrophobicContact CZ-CD2 4.01Å; F528-F568 AromaticContact CZ-CG 3.93Å; F528-F568 HydrophobicContact CZ-CG 3.93Å; V531-F568 HydrophobicContact CB-CE2 3.87Å; V531-F568 HydrophobicContact CG1-CE2 4.48Å; V531-F568 HydrophobicContact CG2-CD2 4.31Å; V531-F568 HydrophobicContact CG2-CE2 3.32Å; V531-F568 HydrophobicContact CG2-CZ 3.71Å; A564-F568 WeakPolarHBondContact O-CB 3.49Å; A564-F568 WeakPolarHBondContact O-CD2 3.43Å; A564-F568 PolarHBondContact O-N 3.41Å; I565-F568 PolarHBondContact O-N 3.25Å; F568-G570 PolarHBondContact O-N 3.04Å; F568-K571 HydrophobicContact CD1-CD 3.72Å; F568-K571 HydrophobicContact CE1-CD 4.15Å; F568-K571 PolarHBondContact O-N 3.27Å; F568-F573 HydrophobicContact CD1-CE2 4.38Å; F568-V580 HydrophobicContact CB-CG2 3.76Å
569	D	84.9	Confident	81.1	Confident	77 Å²	77	76.2 Å²	76.2	41%	0.412	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	119.1	174.4	-164.4	48	0	0	0	110	I565 R579 V580	I565-D569 HydrophobicContact CG2-CB 4.38Å; I565-D569 WeakPolarHBondContact O-CB 3.49Å; I565-D569 PolarHBondContact O-N 3.38Å; D569-R579 VanDerWaalsContact OD1-CA 3.23Å; D569-R579 WeakPolarHBondContact OD1-CA 3.32Å; D569-V580 HydrophobicContact CB-CB 4.19Å; D569-V580 PolarHBondContact OD1-N 3.4Å
570	G	81.6	Confident	81.2	Confident	37 Å²	37	70.7 Å²	70.7	38%	0.381	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.3	-5.4	-177.9	0	0	0	0	0	116.7	F568 M572 R577 L578	F568-G570 PolarHBondContact O-N 3.04Å; G570-M572 PolarHBondContact O-N 3.46Å; G570-R577 WeakPolarHBondContact O-CG 3.42Å; G570-L578 WeakPolarHBondContact CA-O 3.34Å; G570-L578 PolarHBondContact N-O 2.9Å
571	K	81.2	Confident	81.3	Confident	92 Å²	92	74.5 Å²	74.5	40%	0.4	36%	0.361	S	S	.	.			trans	-61.4	136	173	-91.4	-173.9	177.7	150.6	0	110.8	A567 F568 F573 R577 L578	A567-K571 WeakPolarHBondContact O-CD 3.4Å; A567-K571 WeakPolarHBondContact O-CE 3.32Å; A567-K571 PolarHBondContact O-NZ 3.34Å; F568-K571 HydrophobicContact CD1-CD 3.72Å; F568-K571 HydrophobicContact CE1-CD 4.15Å; F568-K571 PolarHBondContact O-N 3.27Å; K571-F573 HydrophobicContact CB-CD2 4.26Å; K571-F573 HydrophobicContact CB-CE2 3.9Å; K571-F573 HydrophobicContact CD-CE2 4.17Å; K571-R577 WeakPolarHBondContact O-CA 3.45Å; K571-L578 PolarHBondContact O-N 2.91Å
572	M	74	Confident	81.2	Confident	118 Å²	118	76.5 Å²	76.5	58%	0.581	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.9	123.2	173.8	-74.4	-171.2	178.9	0	0	111	G570 R576 R577	G570-M572 PolarHBondContact O-N 3.46Å; M572-R576 WeakPolarHBondContact CA-O 3.45Å; M572-R577 HydrophobicContact CE-CG 4.09Å; M572-R577 HydrophobicContact CG-CG 3.59Å
573	F	73.7	Confident	80.8	Confident	50 Å²	50	77 Å²	77	22%	0.219	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	126.3	165.3	-73.3	-90.9	0	0	0	108	P516 F519 I527 F568 K571 G575 R576 L578	P516-F573 HydrophobicContact CG-CB 4.19Å; F519-F573 HydrophobicContact CE1-CD1 4.1Å; F519-F573 HydrophobicContact CE1-CE1 4.38Å; F519-F573 HydrophobicContact CE1-CG 4.39Å; F519-F573 HydrophobicContact CE2-CD1 4.34Å; F519-F573 HydrophobicContact CZ-CB 4.24Å; F519-F573 AromaticContact CZ-CD1 3.44Å; F519-F573 HydrophobicContact CZ-CD1 3.44Å; F519-F573 VanDerWaalsContact CZ-CD1 3.44Å; F519-F573 AromaticContact CZ-CE1 3.94Å; F519-F573 HydrophobicContact CZ-CE1 3.94Å; F519-F573 AromaticContact CZ-CG 4Å; F519-F573 HydrophobicContact CZ-CG 4Å; I527-F573 HydrophobicContact CD1-CE1 4.03Å; I527-F573 HydrophobicContact CD1-CZ 4.34Å; I527-F573 HydrophobicContact CG2-CZ 4.36Å; F568-F573 HydrophobicContact CD1-CE2 4.38Å; K571-F573 HydrophobicContact CB-CD2 4.26Å; K571-F573 HydrophobicContact CB-CE2 3.9Å; K571-F573 HydrophobicContact CD-CE2 4.17Å; F573-G575 PolarHBondContact O-N 2.94Å; F573-G575 VanDerWaalsContact O-N 3.17Å; F573-R576 PolarHBondContact N-O 3.45Å; F573-R576 PolarHBondContact O-N 3.11Å; F573-L578 HydrophobicContact CD2-CD1 3.48Å; F573-L578 VanDerWaalsContact CD2-CD1 3.48Å; F573-L578 HydrophobicContact CD2-CD2 4.37Å; F573-L578 HydrophobicContact CD2-CG 3.78Å; F573-L578 HydrophobicContact CE2-CD1 3.6Å; F573-L578 HydrophobicContact CE2-CG 4.35Å
574	E	67.4	Low	80.7	Confident	139 Å²	139	73.4 Å²	73.4	65%	0.65	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.5	43.2	-176.6	-58.3	-171.3	165.9	0	0	114.1	P516 S518 R576	P516-E574 HydrophobicContact CB-CB 4.08Å; P516-E574 HydrophobicContact CB-CG 4.42Å; S518-E574 WeakPolarHBondContact CB-OE2 3.27Å; S518-E574 PolarHBondContact OG-OE1 2.9Å; S518-E574 PolarHBondContact OG-OE2 3.28Å; E574-R576 PolarHBondContact O-N 2.88Å
575	G	76.4	Confident	80.6	Confident	67 Å²	67	77.3 Å²	77.3	69%	0.691	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.9	-4	-178.5	0	0	0	0	0	115.4	F573	F573-G575 PolarHBondContact O-N 2.94Å; F573-G575 VanDerWaalsContact O-N 3.17Å
576	R	78.4	Confident	80.3	Confident	75 Å²	75	79.3 Å²	79.3	28%	0.283	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	129.3	178.9	-58.6	-179.4	75.4	141.4	-1.4	110.3	N514 M572 F573 E574	N514-R576 VanDerWaalsContact OD1-CZ 3.31Å; N514-R576 PolarHBondContact OD1-NE 3.49Å; N514-R576 PolarHBondContact OD1-NH2 2.77Å; M572-R576 WeakPolarHBondContact CA-O 3.45Å; F573-R576 PolarHBondContact N-O 3.45Å; F573-R576 PolarHBondContact O-N 3.11Å; E574-R576 PolarHBondContact O-N 2.88Å
577	R	84	Confident	80	Confident	155 Å²	155	75.2 Å²	75.2	59%	0.585	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.2	117	172.6	-78.5	-170.5	-97.3	-121.8	-5.2	110.5	N514 G570 K571 M572	N514-R577 PolarHBondContact ND2-O 3.41Å; G570-R577 WeakPolarHBondContact O-CG 3.42Å; K571-R577 WeakPolarHBondContact O-CA 3.45Å; M572-R577 HydrophobicContact CE-CG 4.09Å; M572-R577 HydrophobicContact CG-CG 3.59Å
578	L	85.5	Confident	79.9	Confident	1 Å²	1	78 Å²	78	1%	0.005	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-59.8	148	170.8	-56	-173.3	0	0	0	110	L515 G570 K571 F573	L515-L578 HydrophobicContact CB-CD2 4.35Å; L515-L578 HydrophobicContact CD2-CD1 4.32Å; L515-L578 HydrophobicContact CD2-CD2 3.72Å; L515-L578 HydrophobicContact CG-CD2 4Å; G570-L578 WeakPolarHBondContact CA-O 3.34Å; G570-L578 PolarHBondContact N-O 2.9Å; K571-L578 PolarHBondContact O-N 2.91Å; F573-L578 HydrophobicContact CD2-CD1 3.48Å; F573-L578 VanDerWaalsContact CD2-CD1 3.48Å; F573-L578 HydrophobicContact CD2-CD2 4.37Å; F573-L578 HydrophobicContact CD2-CG 3.78Å; F573-L578 HydrophobicContact CE2-CD1 3.6Å; F573-L578 HydrophobicContact CE2-CG 4.35Å
579	R	84.3	Confident	79.8	Confident	160 Å²	160	82.9 Å²	82.9	60%	0.604	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.3	126.5	167.3	-69.8	-169.8	179.7	-149.9	3.3	109.4	V512 K513 D569	V512-R579 CarbonylContact C-O 3.48Å; V512-R579 WeakPolarHBondContact CA-O 3.31Å; K513-R579 HydrophobicContact CB-CB 4.41Å; K513-R579 PolarHBondContact N-O 2.88Å; K513-R579 PolarHBondContact O-N 2.92Å; D569-R579 VanDerWaalsContact OD1-CA 3.23Å; D569-R579 WeakPolarHBondContact OD1-CA 3.32Å
580	V	85.8	Confident	79.5	Confident	0 Å²	0	83.3 Å²	83.3	0%	0	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	121.1	-173.4	-172.1	0	0	0	0	109.6	V510 V512 F528 I565 F568 D569	V510-V580 HydrophobicContact CG1-CG1 3.37Å; V512-V580 HydrophobicContact CG1-CG2 4.18Å; V512-V580 HydrophobicContact CG2-CG1 4.19Å; V512-V580 HydrophobicContact CG2-CG2 4.15Å; F528-V580 HydrophobicContact CE1-CG2 4.43Å; F528-V580 HydrophobicContact CZ-CG2 4.33Å; I565-V580 HydrophobicContact CB-CG1 4.49Å; I565-V580 HydrophobicContact CG1-CG1 3.9Å; F568-V580 HydrophobicContact CB-CG2 3.76Å; D569-V580 HydrophobicContact CB-CB 4.19Å; D569-V580 PolarHBondContact OD1-N 3.4Å
581	H	82.6	Confident	79.3	Confident	86 Å²	86	86.8 Å²	86.8	40%	0.398	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	137	-175.7	-59.2	-31.4	0	0	0	110.2	V510 V511	V510-H581 CarbonylContact C-O 3.5Å; V510-H581 WeakPolarHBondContact CA-O 3.37Å; V511-H581 PolarHBondContact N-O 3.07Å; V511-H581 PolarHBondContact O-N 2.83Å
582	A	82.5	Confident	79.2	Confident	44 Å²	44	86.4 Å²	86.4	36%	0.364	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	147.3	168.1	0	0	0	0	0	110.6	P507 K509 I561 I565	P507-A582 HydrophobicContact CB-CB 4.12Å; P507-A582 HydrophobicContact CG-CB 4.37Å; K509-A582 WeakPolarHBondContact O-CA 3.34Å; I561-A582 HydrophobicContact CG2-CB 3.92Å; I565-A582 HydrophobicContact CD1-CB 3.84Å
583	E	75.3	Confident	79.6	Confident	142 Å²	142	83.5 Å²	83.5	66%	0.664	41%	0.406	S	S	*	.			trans	-116	0	174.5	-178	-178	-169.5	0	0	110.9	P507 K509 V511	P507-E583 WeakPolarHBondContact CA-O 3.11Å; P507-E583 WeakPolarHBondContact CB-O 3.35Å; K509-E583 HydrophobicContact CB-CB 4.11Å; K509-E583 PolarHBondContact O-N 3.42Å; V511-E583 HydrophobicContact CG2-CB 4.01Å

Retrieved 583 of 583 residues in 137.2 ms (Link to these results)

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