A0A5K4F3M9_SCHMA Loading...

Uncharacterized protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F3M9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 292 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.1	Very low	25.3	Very low	219 Å²	219	151.6 Å²	151.6	100%	1.079	79%	0.786	S	S	*	*				0	105.9	0	-157.3	166.3	134.6	0	0	105.6	E3	M1-E3 PolarHBondContact O-N 3.1Å
2	F	27	Very low	25.2	Very low	216 Å²	216	149.4 Å²	149.4	95%	0.947	78%	0.775	S	S	*	*			trans	-80.2	111.3	174.1	-89.6	-90.3	0	0	0	107
3	E	27.8	Very low	25	Very low	174 Å²	174	149.3 Å²	149.3	81%	0.813	77%	0.766	S	S	*	*			trans	-106.7	98	154.7	-82.1	-172.2	163.2	0	0	107	M1	M1-E3 PolarHBondContact O-N 3.1Å
4	S	36.3	Very low	24.6	Very low	109 Å²	109	149 Å²	149	76%	0.762	76%	0.756	S	S	*	*			trans	-91.3	127.6	147.4	-173.1	0	0	0	0	104.9
5	Q	25.2	Very low	24.5	Very low	176 Å²	176	152.1 Å²	152.1	82%	0.822	76%	0.763	S	S	*	*			trans	-169.5	111.1	145.2	-78.5	-128.2	0.6	0	0	109.1
6	V	21.1	Very low	24.5	Very low	110 Å²	110	153.1 Å²	153.1	67%	0.667	76%	0.761	S	S	*	*				92.9	109.9	101.9	171	0	0	0	0	112.8
7	T	22	Very low	24.6	Very low	108 Å²	108	152.3 Å²	152.3	66%	0.663	76%	0.759	S	S	*	*			trans	51.2	110.4	132.8	-41.9	0	0	0	0	119.4	V9	T7-V9 HydrophobicContact CG2-CG2 3.7Å
8	V	22	Very low	24.5	Very low	150 Å²	150	155.4 Å²	155.4	91%	0.909	76%	0.761	S	S	*	*			trans	-101.6	117.6	145	178.1	0	0	0	0	108.6
9	V	17.4	Very low	24.3	Very low	99 Å²	99	154.5 Å²	154.5	60%	0.6	76%	0.759	S	S	*	*			trans	-71.1	136.5	173.5	174.4	0	0	0	0	109.4	T7 F11	T7-V9 HydrophobicContact CG2-CG2 3.7Å; V9-F11 HydrophobicContact CG1-CE2 4.49Å
10	Q	27.1	Very low	24.3	Very low	143 Å²	143	150.3 Å²	150.3	67%	0.668	75%	0.751	S	S	*	*			trans	-3.7	139	145.7	-168.3	174.7	5.2	0	0	116.1
11	F	20.4	Very low	24.3	Very low	164 Å²	164	150 Å²	150	72%	0.719	75%	0.752	S	S	*	*				-176.2	134.6	116.6	-95.4	-70.7	0	0	0	112.3	V9	V9-F11 HydrophobicContact CG1-CE2 4.49Å
12	L	24	Very low	24.1	Very low	125 Å²	125	146.6 Å²	146.6	65%	0.654	74%	0.738	S	S	*	*			trans	-36.9	149.8	155.6	-71.9	132.2	0	0	0	112.1
13	F	22	Very low	24.1	Very low	148 Å²	148	143.4 Å²	143.4	65%	0.649	73%	0.726	S	S	*	*				156.3	144	110	-92.5	-71.4	0	0	0	115.4
14	F	20	Very low	23.9	Very low	145 Å²	145	141.8 Å²	141.8	64%	0.636	73%	0.728	S	S	*	*			trans	70.7	106.7	153	-57	-57.9	0	0	0	120.2	F16	F14-F16 AromaticContact CD1-CD2 3.89Å; F14-F16 HydrophobicContact CD1-CD2 3.89Å; F14-F16 AromaticContact CD1-CE2 3.98Å; F14-F16 HydrophobicContact CD1-CE2 3.98Å; F14-F16 HydrophobicContact CE1-CD2 4.5Å; F14-F16 HydrophobicContact CE1-CE2 4.14Å; F14-F16 HydrophobicContact CG-CD2 4.39Å
15	F	23.4	Very low	23.3	Very low	196 Å²	196	146 Å²	146	86%	0.86	73%	0.727	S	S	*	*				-98	104.9	129.4	-85.7	-80.3	0	0	0	109.3	I17	F15-I17 HydrophobicContact CD1-CD1 4.16Å; F15-I17 HydrophobicContact CD1-CG1 4.33Å
16	F	24.5	Very low	23.2	Very low	167 Å²	167	142 Å²	142	73%	0.732	71%	0.714	S	S	*	*			trans	-90.9	114.8	146.1	-95.7	-85.3	0	0	0	107.2	F14	F14-F16 AromaticContact CD1-CD2 3.89Å; F14-F16 HydrophobicContact CD1-CD2 3.89Å; F14-F16 AromaticContact CD1-CE2 3.98Å; F14-F16 HydrophobicContact CD1-CE2 3.98Å; F14-F16 HydrophobicContact CE1-CD2 4.5Å; F14-F16 HydrophobicContact CE1-CE2 4.14Å; F14-F16 HydrophobicContact CG-CD2 4.39Å
17	I	26.7	Very low	23.2	Very low	140 Å²	140	141.6 Å²	141.6	72%	0.718	72%	0.723	S	S	*	*			trans	-137.8	95.7	152.1	-57.6	179.9	0	0	0	102.9	F15	F15-I17 HydrophobicContact CD1-CD1 4.16Å; F15-I17 HydrophobicContact CD1-CG1 4.33Å
18	W	21.3	Very low	23.4	Very low	209 Å²	209	143.5 Å²	143.5	79%	0.792	72%	0.724	S	S	*	*				67.6	106.2	66.6	-156.1	-60.9	0	0	0	112.8
19	N	20.7	Very low	23.4	Very low	137 Å²	137	140.6 Å²	140.6	73%	0.733	71%	0.71	S	S	*	*			trans	28.6	145.7	151.9	-59.6	-63.2	0	0	0	119.3
20	A	24.7	Very low	23.8	Very low	71 Å²	71	143.1 Å²	143.1	59%	0.587	72%	0.719	S	S	*	*			cis	-170.7	156.8	15.9	0	0	0	0	0	107.7
21	D	25	Very low	23.7	Very low	145 Å²	145	144 Å²	144	78%	0.775	72%	0.723	S	S	*	*			trans	65.3	132.1	148.3	-58.3	-27.7	0	0	0	119.7
22	D	27.5	Very low	24.2	Very low	147 Å²	147	137.4 Å²	137.4	79%	0.786	70%	0.698	S	S	*	*			trans	69.5	76.3	164.7	-56.8	-20.9	0	0	0	115.7
23	Q	27.7	Very low	24.7	Very low	148 Å²	148	140.9 Å²	140.9	69%	0.692	71%	0.71	S	S	*	*				-146.9	104.2	96.2	-67.6	-144.9	-12.9	0	0	109.3	R25	Q23-R25 HydrophobicContact CB-CB 4.32Å; Q23-R25 HydrophobicContact CB-CG 4.39Å; Q23-R25 PolarHBondContact O-N 3.47Å; Q23-R25 VanDerWaalsContact OE1-CG 3.32Å
24	V	22.1	Very low	25.9	Very low	141 Å²	141	134.6 Å²	134.6	86%	0.855	69%	0.685	S	S	*	*			trans	-61.1	68.3	136.5	-176.7	0	0	0	0	106.1	T26	V24-T26 PolarHBondContact O-N 3.28Å; V24-T26 VanDerWaalsContact O-N 3.08Å
25	R	24	Very low	27.8	Very low	198 Å²	198	131 Å²	131	75%	0.747	68%	0.683	S	S	*	*			trans	-69.8	99.7	145.1	-102	178.2	-167.7	-134.6	0.8	101	Q23 A27	Q23-R25 HydrophobicContact CB-CB 4.32Å; Q23-R25 HydrophobicContact CB-CG 4.39Å; Q23-R25 PolarHBondContact O-N 3.47Å; Q23-R25 VanDerWaalsContact OE1-CG 3.32Å; R25-A27 PolarHBondContact O-N 3.14Å
26	T	22.9	Very low	30.6	Very low	91 Å²	91	123.9 Å²	123.9	56%	0.558	65%	0.653	S	S	*	*			trans	-13	115.8	143.3	15.6	0	0	0	0	107.6	V24 H28	V24-T26 PolarHBondContact O-N 3.28Å; V24-T26 VanDerWaalsContact O-N 3.08Å; T26-H28 PolarHBondContact O-N 3.28Å
27	A	22.5	Very low	33.2	Very low	102 Å²	102	116.1 Å²	116.1	84%	0.843	62%	0.619	S	S	*	*			trans	-56.8	75.7	148	0	0	0	0	0	104.9	R25 S29	R25-A27 PolarHBondContact O-N 3.14Å; A27-S29 PolarHBondContact O-N 3.45Å
28	H	24.7	Very low	35.8	Very low	148 Å²	148	109.9 Å²	109.9	69%	0.685	59%	0.588	S	S	*	*			trans	-45.8	102.6	133.6	-81.5	-85.1	0	0	0	100.8	T26 L30	T26-H28 PolarHBondContact O-N 3.28Å; H28-L30 PolarHBondContact O-N 3.03Å
29	S	23.2	Very low	38.6	Very low	89 Å²	89	100 Å²	100	62%	0.622	55%	0.551	S	S	*	*			trans	-29.8	93.5	138.5	173.2	0	0	0	0	104.7	A27 E31	A27-S29 PolarHBondContact O-N 3.45Å; S29-E31 PolarHBondContact O-N 2.92Å
30	L	25.4	Very low	41.2	Very low	152 Å²	152	93.5 Å²	93.5	80%	0.796	52%	0.516	S	S	*	.			trans	-61.7	86.6	155	-94.6	141.4	0	0	0	99.7	H28 S32	H28-L30 PolarHBondContact O-N 3.03Å; L30-S32 PolarHBondContact O-N 3.29Å
31	E	24.9	Very low	43.7	Very low	161 Å²	161	90.6 Å²	90.6	75%	0.752	49%	0.49	S	S	*	.			trans	-47.1	104.4	160.5	-79.5	-180	147.1	0	0	102.9	S29 E33	S29-E31 PolarHBondContact O-N 2.92Å; E31-E33 PolarHBondContact O-N 3.49Å
32	S	30.9	Very low	46	Very low	26 Å²	26	83.7 Å²	83.7	18%	0.182	45%	0.453	C	S	.	.			trans	-56.5	106.5	-178.4	180	0	0	0	0	106.1	L30 S34 A35 Y275	L30-S32 PolarHBondContact O-N 3.29Å; S32-S34 PolarHBondContact O-N 2.87Å; S32-A35 PolarHBondContact O-N 3.5Å; S32-Y275 PolarHBondContact OG-O 3.45Å
33	E	33.5	Very low	48.1	Very low	197 Å²	197	78 Å²	78	92%	0.921	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-0.7	-179.5	-88.4	-173.1	163.9	0	0	113	E31	E31-E33 PolarHBondContact O-N 3.49Å
34	S	48.3	Very low	50.2	Low	16 Å²	16	71 Å²	71	11%	0.112	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.2	59.8	168.8	64.6	0	0	0	0	113.7	S32 D36	S32-S34 PolarHBondContact O-N 2.87Å; S34-D36 PolarHBondContact O-N 2.81Å; S34-D36 VanDerWaalsContact O-N 3.09Å
35	A	60.6	Low	52.4	Low	71 Å²	71	66.8 Å²	66.8	59%	0.587	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-5.4	157.5	0	0	0	0	0	113.2	S32	S32-A35 PolarHBondContact O-N 3.5Å
36	D	81.9	Confident	54.5	Low	46 Å²	46	57.6 Å²	57.6	25%	0.246	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-7.7	-173.6	-163.3	32.6	0	0	0	114.7	S34 F113 S114 S115	S34-D36 PolarHBondContact O-N 2.81Å; S34-D36 VanDerWaalsContact O-N 3.09Å; D36-F113 CarbonylContact O-C 3.52Å; D36-F113 VanDerWaalsContact O-CA 3.28Å; D36-F113 WeakPolarHBondContact O-CA 3.11Å; D36-S114 WeakPolarHBondContact CA-OG 3.37Å; D36-S114 PolarHBondContact O-N 3.11Å; D36-S114 PolarHBondContact O-OG 3.35Å; D36-S114 VanDerWaalsContact O-OG 3.12Å; D36-S114 WeakPolarHBondContact OD1-CA 3.5Å; D36-S114 WeakPolarHBondContact OD1-CB 3.3Å; D36-S114 PolarHBondContact OD1-N 3.36Å; D36-S114 PolarHBondContact OD1-OG 2.82Å; D36-S115 WeakPolarHBondContact OD1-CB 3.35Å; D36-S115 PolarHBondContact OD1-N 3.35Å; D36-S115 PolarHBondContact OD1-OG 3.06Å; D36-S115 VanDerWaalsContact OD2-CB 3.31Å; D36-S115 WeakPolarHBondContact OD2-CB 3.28Å; D36-S115 PolarHBondContact OD2-OG 3.26Å
37	I	79.4	Confident	56.2	Low	4 Å²	4	60 Å²	60	2%	0.021	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	122.4	179.6	-60.7	169.5	0	0	0	109.6	V39 F113 Y201 E202 M205	I37-V39 HydrophobicContact CG2-CG2 4.07Å; I37-F113 HydrophobicContact CD1-CE1 4.16Å; I37-F113 HydrophobicContact CG1-CD1 3.94Å; I37-F113 HydrophobicContact CG1-CE1 3.67Å; I37-Y201 HydrophobicContact CD1-CD1 3.8Å; I37-Y201 HydrophobicContact CG2-CE1 4.33Å; I37-E202 HydrophobicContact CD1-CB 4.28Å; I37-M205 HydrophobicContact CD1-CB 4.29Å; I37-M205 HydrophobicContact CD1-CG 4.5Å
38	V	81	Confident	58.2	Low	9 Å²	9	59.3 Å²	59.3	6%	0.055	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	130.7	171.6	178.1	0	0	0	0	108.7	A111 M112 W126	V38-A111 VanDerWaalsContact O-CA 3.24Å; V38-A111 WeakPolarHBondContact O-CA 3.47Å; V38-M112 HydrophobicContact CB-CG 4.26Å; V38-M112 PolarHBondContact N-O 3.27Å; V38-M112 PolarHBondContact O-N 2.9Å; V38-W126 HydrophobicContact CB-CH2 4.21Å; V38-W126 HydrophobicContact CB-CZ2 4.39Å; V38-W126 HydrophobicContact CG1-CH2 4.02Å; V38-W126 HydrophobicContact CG2-CH2 4.36Å; V38-W126 HydrophobicContact CG2-CZ2 4.07Å
39	V	79.1	Confident	60.3	Low	2 Å²	2	54.4 Å²	54.4	1%	0.012	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	121.9	175.7	-171.5	0	0	0	0	108.8	I37 K109 A111 C211 L271 Y275	I37-V39 HydrophobicContact CG2-CG2 4.07Å; V39-K109 HydrophobicContact CG1-CB 4.06Å; V39-K109 HydrophobicContact CG1-CD 3.99Å; V39-K109 HydrophobicContact CG1-CG 4.46Å; V39-A111 HydrophobicContact CG1-CB 4.47Å; V39-A111 HydrophobicContact CG2-CB 3.93Å; V39-C211 HydrophobicContact CG1-CB 4.13Å; V39-C211 HydrophobicContact CG2-CB 4.45Å; V39-L271 PolarHBondContact N-O 2.93Å; V39-L271 CarbonylContact O-C 3.58Å; V39-L271 WeakPolarHBondContact O-CB 3.49Å; V39-L271 PolarHBondContact O-N 2.92Å; V39-Y275 HydrophobicContact CG2-CE2 3.87Å
40	T	76.3	Confident	62.6	Low	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	146	175.1	-176.1	0	0	0	0	110.3	L110 M112 L268 K269	T40-L110 HydrophobicContact CG2-CB 3.93Å; T40-L110 HydrophobicContact CG2-CD2 4.34Å; T40-L110 HydrophobicContact CG2-CG 4.46Å; T40-L110 WeakPolarHBondContact CG2-O 3.16Å; T40-L110 PolarHBondContact N-O 2.94Å; T40-L110 PolarHBondContact O-N 3.24Å; T40-M112 HydrophobicContact CG2-CE 3.91Å; T40-L268 HydrophobicContact CG2-CD2 3.81Å; T40-L268 WeakPolarHBondContact OG1-CD2 2.91Å; T40-K269 WeakPolarHBondContact CA-O 3.44Å; T40-K269 WeakPolarHBondContact CB-O 2.97Å; T40-K269 PolarHBondContact OG1-N 3.37Å; T40-K269 PolarHBondContact OG1-O 2.93Å
41	D	77.2	Confident	65	Low	9 Å²	9	52.6 Å²	52.6	5%	0.048	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	130	167.7	-65.6	-20.4	0	0	0	108.5	F43 V107 F108 K109 L268 K269	D41-F43 HydrophobicContact CB-CD2 4.2Å; D41-F43 HydrophobicContact CB-CE2 3.54Å; D41-F43 HydrophobicContact CB-CZ 4.25Å; D41-V107 HydrophobicContact CB-CG1 4.3Å; D41-F108 CarbonylContact C-O 3.55Å; D41-F108 WeakPolarHBondContact CA-O 3.24Å; D41-K109 WeakPolarHBondContact OD1-CD 3.38Å; D41-K109 WeakPolarHBondContact OD1-CE 3.36Å; D41-K109 IonicContact OD1-NZ 2.59Å; D41-K109 PolarHBondContact OD1-NZ 3.11Å; D41-K109 IonicContact OD2-NZ 3.79Å; D41-L268 VanDerWaalsContact O-CA 3.31Å; D41-L268 WeakPolarHBondContact O-CA 3.43Å; D41-L268 WeakPolarHBondContact O-CD2 3.13Å; D41-K269 HydrophobicContact CB-CB 4.41Å; D41-K269 PolarHBondContact N-O 3.26Å; D41-K269 PolarHBondContact O-N 3.26Å
42	L	72	Confident	67.7	Low	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	117	171.8	-177.3	80.8	0	0	0	108.5	V44 V72 V76 F108 L134 I265 L268	L42-V44 HydrophobicContact CD2-CG2 3.63Å; L42-V44 HydrophobicContact CG-CG2 3.79Å; L42-V72 HydrophobicContact CD2-CG1 3.49Å; L42-V72 VanDerWaalsContact CD2-CG1 3.49Å; L42-V76 HydrophobicContact CD2-CG2 4.14Å; L42-F108 HydrophobicContact CB-CB 4.15Å; L42-F108 PolarHBondContact N-O 2.73Å; L42-F108 PolarHBondContact O-N 3.41Å; L42-L134 HydrophobicContact CD1-CD1 4.5Å; L42-I265 HydrophobicContact CD1-CB 4.24Å; L42-I265 HydrophobicContact CD1-CD1 4.1Å; L42-I265 HydrophobicContact CD1-CG1 3.96Å; L42-I265 HydrophobicContact CD1-CG2 3.39Å; L42-I265 HydrophobicContact CG-CG2 4.42Å; L42-L268 HydrophobicContact CB-CD2 4.29Å; L42-L268 HydrophobicContact CD1-CD2 3.61Å; L42-L268 HydrophobicContact CD1-CG 4.05Å
43	F	72.9	Confident	69.8	Low	29 Å²	29	45.4 Å²	45.4	13%	0.127	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	114	-178.4	-69.9	-104.3	0	0	0	109.1	D41 L105 V107 I265 S266 E267 K269	D41-F43 HydrophobicContact CB-CD2 4.2Å; D41-F43 HydrophobicContact CB-CE2 3.54Å; D41-F43 HydrophobicContact CB-CZ 4.25Å; F43-L105 HydrophobicContact CB-CD1 4.11Å; F43-L105 HydrophobicContact CD1-CD2 4.41Å; F43-V107 HydrophobicContact CD1-CG2 3.78Å; F43-V107 HydrophobicContact CE1-CG1 4.21Å; F43-V107 HydrophobicContact CE1-CG2 3.67Å; F43-V107 HydrophobicContact CE2-CG1 4.49Å; F43-V107 HydrophobicContact CZ-CG1 4.19Å; F43-V107 HydrophobicContact CZ-CG2 4.45Å; F43-I265 CarbonylContact O-C 3.39Å; F43-I265 VanDerWaalsContact O-CA 3.28Å; F43-I265 WeakPolarHBondContact O-CA 3.46Å; F43-S266 WeakPolarHBondContact CB-OG 3.03Å; F43-S266 PolarHBondContact O-N 3.01Å; F43-E267 HydrophobicContact CB-CB 4.09Å; F43-E267 HydrophobicContact CD2-CB 3.56Å; F43-E267 WeakPolarHBondContact CD2-O 3.44Å; F43-E267 HydrophobicContact CE2-CB 4.15Å; F43-E267 HydrophobicContact CG-CB 3.91Å; F43-E267 PolarHBondContact N-O 3.35Å; F43-K269 HydrophobicContact CE2-CD 4.49Å
44	V	70.4	Confident	71.6	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	117.1	-171.2	172.6	0	0	0	0	111.1	L42 V46 V72 I106 F108 I263 R264	L42-V44 HydrophobicContact CD2-CG2 3.63Å; L42-V44 HydrophobicContact CG-CG2 3.79Å; V44-V46 HydrophobicContact CG1-CG1 3.88Å; V44-V72 HydrophobicContact CG2-CG2 4.38Å; V44-I106 PolarHBondContact N-O 3.03Å; V44-I106 PolarHBondContact O-N 2.8Å; V44-F108 HydrophobicContact CB-CD2 3.67Å; V44-F108 HydrophobicContact CB-CE2 3.56Å; V44-F108 HydrophobicContact CG1-CE2 3.96Å; V44-F108 HydrophobicContact CG2-CD2 3.53Å; V44-F108 HydrophobicContact CG2-CE2 3.83Å; V44-I263 HydrophobicContact CB-CG2 4.29Å; V44-I263 HydrophobicContact CG1-CB 3.92Å; V44-I263 HydrophobicContact CG1-CG1 3.89Å; V44-I263 HydrophobicContact CG1-CG2 3.48Å; V44-I263 VanDerWaalsContact CG1-CG2 3.48Å; V44-I263 HydrophobicContact CG2-CG2 3.87Å; V44-R264 CarbonylContact C-O 3.56Å; V44-R264 WeakPolarHBondContact CA-O 3.43Å
45	Y	70.1	Confident	72.9	Confident	53 Å²	53	39.3 Å²	39.3	21%	0.208	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	133.8	164.9	-55.1	-103.2	0	0	0	110.3	D103 Q104 L105 I262 R264 S266	Y45-D103 WeakPolarHBondContact CD1-O 3.35Å; Y45-D103 WeakPolarHBondContact CE1-O 3.25Å; Y45-Q104 CarbonylContact C-O 3.54Å; Y45-Q104 WeakPolarHBondContact CA-O 3.12Å; Y45-L105 HydrophobicContact CD1-CB 4.21Å; Y45-L105 HydrophobicContact CD1-CD1 4.4Å; Y45-L105 HydrophobicContact CD2-CD1 4.1Å; Y45-L105 HydrophobicContact CE1-CB 4.08Å; Y45-L105 HydrophobicContact CE1-CD1 4.26Å; Y45-L105 HydrophobicContact CE2-CD1 4Å; Y45-L105 HydrophobicContact CG-CD1 4.29Å; Y45-I262 VanDerWaalsContact O-O 3.12Å; Y45-R264 HydrophobicContact CD2-CB 3.87Å; Y45-R264 HydrophobicContact CG-CB 4.23Å; Y45-R264 PolarHBondContact N-O 2.9Å; Y45-R264 PolarHBondContact O-N 2.78Å; Y45-S266 WeakPolarHBondContact CE2-OG 3.42Å
46	V	66.6	Low	73.3	Confident	4 Å²	4	38.3 Å²	38.3	2%	0.024	18%	0.182	C	C	.	.			trans	-113.8	144.8	-179.8	-55.2	0	0	0	0	109.3	V44 W49 Y68 Q104 I106	V44-V46 HydrophobicContact CG1-CG1 3.88Å; V46-W49 HydrophobicContact CG2-CE3 4.43Å; V46-Y68 HydrophobicContact CB-CE1 4.25Å; V46-Y68 HydrophobicContact CG1-CD1 4.36Å; V46-Y68 HydrophobicContact CG1-CE1 3.77Å; V46-Y68 HydrophobicContact CG2-CE1 4.39Å; V46-Q104 HydrophobicContact CG2-CB 4.19Å; V46-Q104 WeakPolarHBondContact CG2-O 2.99Å; V46-Q104 PolarHBondContact N-O 3.24Å; V46-Q104 WeakPolarHBondContact O-CB 3.38Å; V46-Q104 VanDerWaalsContact O-CD 3.31Å; V46-Q104 PolarHBondContact O-OE1 3.08Å; V46-I106 HydrophobicContact CG1-CD1 3.86Å; V46-I106 HydrophobicContact CG1-CG1 4.32Å; V46-I106 HydrophobicContact CG2-CD1 4.06Å; V46-I106 HydrophobicContact CG2-CG1 4.43Å
47	R	59.9	Low	72.8	Confident	142 Å²	142	40.2 Å²	40.2	54%	0.536	20%	0.204	S	C	.	.	S	Bend	trans	-73.1	-34	-178.6	-73.3	-175.5	165.4	-155.1	-6.1	113.7	Q104 I262	R47-Q104 PolarHBondContact O-NE2 3.35Å; R47-Q104 PolarHBondContact O-OE1 2.79Å; R47-I262 HydrophobicContact CG-CB 4.33Å
48	E	63.3	Low	72.7	Confident	88 Å²	88	41.8 Å²	41.8	41%	0.411	21%	0.214	S	C	.	.	S	Bend	trans	-125.3	113.7	-179.4	-79.4	154.3	141.5	0	0	108.4	Y68 L259	E48-Y68 PolarHBondContact O-OH 3.44Å; E48-Y68 VanDerWaalsContact O-OH 3.06Å; E48-L259 HydrophobicContact CB-CD1 3.66Å; E48-L259 VanDerWaalsContact CD-CD1 3.42Å; E48-L259 HydrophobicContact CG-CD1 4.04Å; E48-L259 WeakPolarHBondContact OE1-CD2 3.09Å; E48-L259 WeakPolarHBondContact OE2-CB 3.28Å; E48-L259 VanDerWaalsContact OE2-CD1 3.24Å; E48-L259 WeakPolarHBondContact OE2-CD1 3.15Å; E48-L259 WeakPolarHBondContact OE2-CD2 3.08Å; E48-L259 WeakPolarHBondContact OE2-CG 3.42Å
49	W	68.4	Low	72.4	Confident	44 Å²	44	47.5 Å²	47.5	17%	0.167	24%	0.24	C	C	.	.			trans	-73.6	126.6	175.6	179.9	-101.3	0	0	0	109.5	V46 I53 P95 I101 I106	V46-W49 HydrophobicContact CG2-CE3 4.43Å; W49-I53 HydrophobicContact CD2-CG2 4.07Å; W49-I53 HydrophobicContact CE3-CG2 4.05Å; W49-I53 HydrophobicContact CH2-CG2 3.32Å; W49-I53 HydrophobicContact CZ2-CG2 3.3Å; W49-I53 HydrophobicContact CZ3-CG2 3.7Å; W49-P95 HydrophobicContact CH2-CG 4.31Å; W49-I101 HydrophobicContact CG-CG2 4.36Å; W49-I106 HydrophobicContact CE3-CG1 4.37Å; W49-I106 HydrophobicContact CZ3-CD1 4.38Å; W49-I106 HydrophobicContact CZ3-CG1 3.73Å
50	N	73.4	Confident	72.7	Confident	56 Å²	56	52.4 Å²	52.4	30%	0.299	26%	0.263	S	S	.	.			trans	-89.2	112.5	165.8	-174	-18.9	0	0	0	108.2	V52 I53 V64 Y68	N50-V52 PolarHBondContact O-N 2.84Å; N50-V52 WeakPolarHBondContact OD1-CB 3.1Å; N50-V52 WeakPolarHBondContact OD1-CG2 3.12Å; N50-V52 PolarHBondContact OD1-N 3.49Å; N50-I53 WeakPolarHBondContact O-CG2 3.34Å; N50-I53 PolarHBondContact O-N 2.61Å; N50-V64 HydrophobicContact CB-CG1 4.22Å; N50-V64 VanDerWaalsContact ND2-CG2 3.29Å; N50-V64 WeakPolarHBondContact ND2-CG2 3.47Å; N50-Y68 HydrophobicContact CB-CE2 4.03Å
51	E	75.8	Confident	73.1	Confident	148 Å²	148	52.4 Å²	52.4	69%	0.692	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-55.7	-26.4	-178.9	-65.1	-173.3	174	0	0	113.6	I53 G54	E51-I53 PolarHBondContact O-N 3.41Å; E51-G54 PolarHBondContact O-N 3.26Å
52	V	80	Confident	73.7	Confident	34 Å²	34	52.1 Å²	52.1	21%	0.206	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-56.6	-37	173.5	168	0	0	0	0	111.9	N50 G54 N55 V58 E60 F61 V64	N50-V52 PolarHBondContact O-N 2.84Å; N50-V52 WeakPolarHBondContact OD1-CB 3.1Å; N50-V52 WeakPolarHBondContact OD1-CG2 3.12Å; N50-V52 PolarHBondContact OD1-N 3.49Å; V52-G54 PolarHBondContact O-N 2.65Å; V52-G54 VanDerWaalsContact O-N 3.17Å; V52-N55 CarbonylContact O-C 3.53Å; V52-N55 PolarHBondContact O-N 3.33Å; V52-V58 HydrophobicContact CB-CG2 4.18Å; V52-V58 HydrophobicContact CG1-CG2 3.45Å; V52-V58 VanDerWaalsContact CG1-CG2 3.45Å; V52-V58 HydrophobicContact CG2-CG2 4.17Å; V52-E60 HydrophobicContact CG1-CB 4.35Å; V52-F61 HydrophobicContact CG1-CB 4.31Å; V52-F61 WeakPolarHBondContact O-CD2 3.48Å; V52-V64 HydrophobicContact CB-CG2 4Å; V52-V64 HydrophobicContact CG1-CB 4Å; V52-V64 HydrophobicContact CG1-CG2 3.55Å
53	I	74.7	Confident	74.5	Confident	1 Å²	1	57 Å²	57	1%	0.005	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-64.7	-23.7	179.4	-156.2	69.3	0	0	0	112.1	W49 N50 E51 F61 V64 V65 I92 P95 I106	W49-I53 HydrophobicContact CD2-CG2 4.07Å; W49-I53 HydrophobicContact CE3-CG2 4.05Å; W49-I53 HydrophobicContact CH2-CG2 3.32Å; W49-I53 HydrophobicContact CZ2-CG2 3.3Å; W49-I53 HydrophobicContact CZ3-CG2 3.7Å; N50-I53 WeakPolarHBondContact O-CG2 3.34Å; N50-I53 PolarHBondContact O-N 2.61Å; E51-I53 PolarHBondContact O-N 3.41Å; I53-F61 HydrophobicContact CD1-CE2 4.04Å; I53-V64 HydrophobicContact CB-CG1 4.34Å; I53-V64 HydrophobicContact CD1-CG1 4.05Å; I53-V65 HydrophobicContact CD1-CG2 3.8Å; I53-I92 HydrophobicContact CD1-CD1 3.6Å; I53-I92 HydrophobicContact CD1-CG2 4.1Å; I53-I92 HydrophobicContact CG1-CD1 4.4Å; I53-I92 HydrophobicContact CG1-CG2 4.3Å; I53-P95 WeakPolarHBondContact O-CD 3.42Å; I53-I106 HydrophobicContact CG1-CD1 4.39Å; I53-I106 HydrophobicContact CG2-CD1 4.39Å
54	G	72.7	Confident	75.1	Confident	9 Å²	9	56.3 Å²	56.3	9%	0.093	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-83.4	-12	175.8	0	0	0	0	0	114.3	E51 V52 P98	E51-G54 PolarHBondContact O-N 3.26Å; V52-G54 PolarHBondContact O-N 2.65Å; V52-G54 VanDerWaalsContact O-N 3.17Å; G54-P98 WeakPolarHBondContact O-CB 3.1Å
55	N	75	Confident	76	Confident	76 Å²	76	56.3 Å²	56.3	41%	0.406	29%	0.286	S	S	.	.			trans	-127.8	85.7	-174.6	-172.7	2.6	0	0	0	110.1	V52 A57 V58	V52-N55 CarbonylContact O-C 3.53Å; V52-N55 PolarHBondContact O-N 3.33Å; N55-A57 PolarHBondContact O-N 3.29Å; N55-A57 VanDerWaalsContact OD1-CB 3.31Å; N55-A57 WeakPolarHBondContact OD1-CB 3.26Å; N55-A57 PolarHBondContact OD1-N 3.37Å; N55-V58 HydrophobicContact CB-CG1 4.25Å; N55-V58 WeakPolarHBondContact ND2-CG1 3.36Å; N55-V58 WeakPolarHBondContact O-CG2 2.75Å; N55-V58 PolarHBondContact O-N 2.81Å
56	D	68.9	Low	76.9	Confident	51 Å²	51	56 Å²	56	27%	0.273	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	0.7	177.2	70.6	-27.7	0	0	0	113.8	F61 P94 Y214 K218	D56-F61 HydrophobicContact CB-CD1 4.28Å; D56-F61 HydrophobicContact CB-CD2 4.09Å; D56-F61 HydrophobicContact CB-CE1 4.23Å; D56-F61 HydrophobicContact CB-CE2 4.04Å; D56-F61 HydrophobicContact CB-CG 4.21Å; D56-F61 HydrophobicContact CB-CZ 4.12Å; D56-P94 HydrophobicContact CB-CB 4.36Å; D56-Y214 HydrophobicContact CB-CE1 4.13Å; D56-Y214 WeakPolarHBondContact OD2-CE1 3.48Å; D56-Y214 PolarHBondContact OD2-OH 3.41Å; D56-K218 PolarHBondContact O-NZ 3.41Å
57	A	71.5	Confident	77.8	Confident	85 Å²	85	61.1 Å²	61.1	70%	0.702	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-16.1	171.8	0	0	0	0	0	113.4	N55	N55-A57 PolarHBondContact O-N 3.29Å; N55-A57 VanDerWaalsContact OD1-CB 3.31Å; N55-A57 WeakPolarHBondContact OD1-CB 3.26Å; N55-A57 PolarHBondContact OD1-N 3.37Å
58	V	77.2	Confident	78.9	Confident	38 Å²	38	55.7 Å²	55.7	23%	0.23	29%	0.289	C	S	.	.	S	Bend	trans	-81.4	150.5	-179.5	-48.6	0	0	0	0	111.9	V52 N55 E60 F61	V52-V58 HydrophobicContact CB-CG2 4.18Å; V52-V58 HydrophobicContact CG1-CG2 3.45Å; V52-V58 VanDerWaalsContact CG1-CG2 3.45Å; V52-V58 HydrophobicContact CG2-CG2 4.17Å; N55-V58 HydrophobicContact CB-CG1 4.25Å; N55-V58 WeakPolarHBondContact ND2-CG1 3.36Å; N55-V58 WeakPolarHBondContact O-CG2 2.75Å; N55-V58 PolarHBondContact O-N 2.81Å; V58-E60 VanDerWaalsContact C-N 3.32Å; V58-E60 PolarHBondContact O-N 3.11Å; V58-F61 HydrophobicContact CG2-CB 4.12Å; V58-F61 WeakPolarHBondContact O-CB 3.06Å; V58-F61 PolarHBondContact O-N 2.57Å
59	E	74.5	Confident	80.2	Confident	129 Å²	129	51.9 Å²	51.9	60%	0.603	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-37.1	-175.6	-173.5	165	-168.6	0	0	110.9	F61	E59-F61 PolarHBondContact O-N 3.12Å
60	E	85.3	Confident	81	Confident	105 Å²	105	52.2 Å²	52.2	49%	0.491	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-7.1	-178.9	-55.4	85.2	170.5	0	0	113.4	V52 V58 L62 D63 V64	V52-E60 HydrophobicContact CG1-CB 4.35Å; V58-E60 VanDerWaalsContact C-N 3.32Å; V58-E60 PolarHBondContact O-N 3.11Å; E60-L62 VanDerWaalsContact C-N 3.31Å; E60-L62 PolarHBondContact O-N 3.3Å; E60-D63 PolarHBondContact O-N 2.9Å; E60-D63 VanDerWaalsContact O-N 3.16Å; E60-V64 WeakPolarHBondContact O-CG2 3.26Å; E60-V64 PolarHBondContact O-N 2.86Å
61	F	85.9	Confident	81.3	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-53.2	-47.3	-177.4	172	-99.2	0	0	0	112.2	V52 I53 D56 V58 E59 D63 V64 V65 P94 N215 K218	V52-F61 HydrophobicContact CG1-CB 4.31Å; V52-F61 WeakPolarHBondContact O-CD2 3.48Å; I53-F61 HydrophobicContact CD1-CE2 4.04Å; D56-F61 HydrophobicContact CB-CD1 4.28Å; D56-F61 HydrophobicContact CB-CD2 4.09Å; D56-F61 HydrophobicContact CB-CE1 4.23Å; D56-F61 HydrophobicContact CB-CE2 4.04Å; D56-F61 HydrophobicContact CB-CG 4.21Å; D56-F61 HydrophobicContact CB-CZ 4.12Å; V58-F61 HydrophobicContact CG2-CB 4.12Å; V58-F61 WeakPolarHBondContact O-CB 3.06Å; V58-F61 PolarHBondContact O-N 2.57Å; E59-F61 PolarHBondContact O-N 3.12Å; F61-D63 VanDerWaalsContact C-N 3.35Å; F61-D63 PolarHBondContact O-N 2.81Å; F61-V64 PolarHBondContact O-N 3.24Å; F61-V65 HydrophobicContact CD1-CG2 4.18Å; F61-V65 HydrophobicContact CE1-CG2 3.7Å; F61-V65 HydrophobicContact CE2-CG2 4.06Å; F61-V65 HydrophobicContact CZ-CG2 3.63Å; F61-V65 WeakPolarHBondContact O-CG2 3.38Å; F61-V65 PolarHBondContact O-N 3.39Å; F61-P94 HydrophobicContact CE2-CB 4.36Å; F61-P94 HydrophobicContact CZ-CB 3.95Å; F61-N215 WeakPolarHBondContact CE1-OD1 3.33Å; F61-K218 HydrophobicContact CD1-CD 4.47Å
62	L	89.5	Confident	81.6	Confident	3 Å²	3	45.6 Å²	45.6	2%	0.016	25%	0.254	C	S	.	.	H	α-helix	trans	-68.4	-35.2	-177.5	-68.9	173.5	0	0	0	112.1	E60 V64 V65 D66 Y176 N215 K218 R219	E60-L62 VanDerWaalsContact C-N 3.31Å; E60-L62 PolarHBondContact O-N 3.3Å; L62-V64 VanDerWaalsContact C-N 3.3Å; L62-V64 PolarHBondContact O-N 2.96Å; L62-V65 WeakPolarHBondContact O-CB 3.38Å; L62-V65 PolarHBondContact O-N 2.99Å; L62-D66 VanDerWaalsContact O-CG 3.27Å; L62-D66 PolarHBondContact O-N 3.2Å; L62-Y176 HydrophobicContact CD1-CE1 4.34Å; L62-Y176 VanDerWaalsContact CD1-OH 3.23Å; L62-Y176 WeakPolarHBondContact CD1-OH 3.4Å; L62-N215 HydrophobicContact CD2-CB 4.18Å; L62-K218 HydrophobicContact CD1-CB 3.96Å; L62-K218 HydrophobicContact CD2-CB 4.29Å; L62-K218 HydrophobicContact CG-CB 4.48Å; L62-R219 HydrophobicContact CD1-CG 3.72Å; L62-R219 HydrophobicContact CD2-CG 4.28Å
63	D	89	Confident	81.9	Confident	101 Å²	101	45.7 Å²	45.7	54%	0.54	25%	0.253	S	S	.	.	H	α-helix	trans	-66.1	-37.6	176.4	-61.9	-14.4	0	0	0	111.1	E60 F61 D66 K67	E60-D63 PolarHBondContact O-N 2.9Å; E60-D63 VanDerWaalsContact O-N 3.16Å; F61-D63 VanDerWaalsContact C-N 3.35Å; F61-D63 PolarHBondContact O-N 2.81Å; D63-D66 PolarHBondContact O-N 2.91Å; D63-K67 WeakPolarHBondContact O-CB 3.21Å; D63-K67 PolarHBondContact O-N 3.24Å
64	V	85.9	Confident	82.2	Confident	15 Å²	15	49.2 Å²	49.2	9%	0.091	27%	0.274	C	S	.	.	H	α-helix	trans	-65.8	-45.2	173.4	175.6	0	0	0	0	110.2	N50 V52 I53 E60 F61 L62 D66 K67 Y68	N50-V64 HydrophobicContact CB-CG1 4.22Å; N50-V64 VanDerWaalsContact ND2-CG2 3.29Å; N50-V64 WeakPolarHBondContact ND2-CG2 3.47Å; V52-V64 HydrophobicContact CB-CG2 4Å; V52-V64 HydrophobicContact CG1-CB 4Å; V52-V64 HydrophobicContact CG1-CG2 3.55Å; I53-V64 HydrophobicContact CB-CG1 4.34Å; I53-V64 HydrophobicContact CD1-CG1 4.05Å; E60-V64 WeakPolarHBondContact O-CG2 3.26Å; E60-V64 PolarHBondContact O-N 2.86Å; F61-V64 PolarHBondContact O-N 3.24Å; L62-V64 VanDerWaalsContact C-N 3.3Å; L62-V64 PolarHBondContact O-N 2.96Å; V64-D66 VanDerWaalsContact C-N 3.34Å; V64-D66 PolarHBondContact O-N 3.45Å; V64-K67 PolarHBondContact O-N 2.91Å; V64-Y68 HydrophobicContact CG1-CD2 3.57Å; V64-Y68 HydrophobicContact CG1-CE2 3.59Å; V64-Y68 VanDerWaalsContact O-CD2 3.29Å; V64-Y68 WeakPolarHBondContact O-CD2 3.38Å; V64-Y68 PolarHBondContact O-N 3.36Å
65	V	87.8	Confident	82.4	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.006	28%	0.28	C	S	.	.	H	α-helix	trans	-55.2	-50	174.8	172.2	0	0	0	0	111.1	I53 F61 L62 K67 Y68 C69 I92	I53-V65 HydrophobicContact CD1-CG2 3.8Å; F61-V65 HydrophobicContact CD1-CG2 4.18Å; F61-V65 HydrophobicContact CE1-CG2 3.7Å; F61-V65 HydrophobicContact CE2-CG2 4.06Å; F61-V65 HydrophobicContact CZ-CG2 3.63Å; F61-V65 WeakPolarHBondContact O-CG2 3.38Å; F61-V65 PolarHBondContact O-N 3.39Å; L62-V65 WeakPolarHBondContact O-CB 3.38Å; L62-V65 PolarHBondContact O-N 2.99Å; V65-K67 VanDerWaalsContact C-N 3.35Å; V65-K67 PolarHBondContact O-N 3.49Å; V65-Y68 PolarHBondContact O-N 3.4Å; V65-C69 WeakPolarHBondContact O-CB 3.44Å; V65-C69 PolarHBondContact O-N 3.28Å; V65-I92 HydrophobicContact CB-CD1 4.32Å; V65-I92 HydrophobicContact CG1-CB 4.22Å; V65-I92 HydrophobicContact CG1-CD1 4.2Å; V65-I92 HydrophobicContact CG1-CG1 4.18Å; V65-I92 HydrophobicContact CG2-CB 4.27Å; V65-I92 HydrophobicContact CG2-CD1 4.21Å
66	D	90.5	Very high	82.7	Confident	47 Å²	47	46.9 Å²	46.9	25%	0.251	26%	0.261	S	S	.	.	H	α-helix	trans	-60.8	-43.1	-178.4	-70.2	-23.7	0	0	0	111.8	L62 D63 V64 C69 A70 R219	L62-D66 VanDerWaalsContact O-CG 3.27Å; L62-D66 PolarHBondContact O-N 3.2Å; D63-D66 PolarHBondContact O-N 2.91Å; V64-D66 VanDerWaalsContact C-N 3.34Å; V64-D66 PolarHBondContact O-N 3.45Å; D66-C69 PolarHBondContact O-N 3.49Å; D66-A70 PolarHBondContact O-N 2.94Å; D66-R219 IonicContact OD1-CZ 2.79Å; D66-R219 IonicContact OD1-NH1 2.62Å; D66-R219 PolarHBondContact OD1-NH1 3.12Å; D66-R219 IonicContact OD1-NH2 3.38Å; D66-R219 PolarHBondContact OD1-NH2 3.21Å; D66-R219 IonicContact OD2-CZ 3.01Å; D66-R219 IonicContact OD2-NH1 3.42Å; D66-R219 PolarHBondContact OD2-NH1 3.06Å; D66-R219 IonicContact OD2-NH2 3.54Å; D66-R219 PolarHBondContact OD2-NH2 3.35Å
67	K	85.4	Confident	83.5	Confident	111 Å²	111	47 Å²	47	48%	0.483	26%	0.259	S	S	.	.	H	α-helix	trans	-63.9	-46.6	177.1	-175.7	178.5	-178	177.6	0	112.6	D63 V64 V65 C69 A70 N71	D63-K67 WeakPolarHBondContact O-CB 3.21Å; D63-K67 PolarHBondContact O-N 3.24Å; V64-K67 PolarHBondContact O-N 2.91Å; V65-K67 VanDerWaalsContact C-N 3.35Å; V65-K67 PolarHBondContact O-N 3.49Å; K67-C69 VanDerWaalsContact C-N 3.31Å; K67-C69 PolarHBondContact O-N 3.18Å; K67-A70 PolarHBondContact O-N 2.82Å; K67-N71 PolarHBondContact O-N 2.62Å
68	Y	83.3	Confident	83.9	Confident	28 Å²	28	49.8 Å²	49.8	11%	0.11	26%	0.258	C	S	.	.	H	α-helix	trans	-63.7	-40.8	178.1	-92.6	-83.5	0	0	0	111.3	V46 E48 N50 V64 V65 N71 V72 I92 I106 F108	V46-Y68 HydrophobicContact CB-CE1 4.25Å; V46-Y68 HydrophobicContact CG1-CD1 4.36Å; V46-Y68 HydrophobicContact CG1-CE1 3.77Å; V46-Y68 HydrophobicContact CG2-CE1 4.39Å; E48-Y68 PolarHBondContact O-OH 3.44Å; E48-Y68 VanDerWaalsContact O-OH 3.06Å; N50-Y68 HydrophobicContact CB-CE2 4.03Å; V64-Y68 HydrophobicContact CG1-CD2 3.57Å; V64-Y68 HydrophobicContact CG1-CE2 3.59Å; V64-Y68 VanDerWaalsContact O-CD2 3.29Å; V64-Y68 WeakPolarHBondContact O-CD2 3.38Å; V64-Y68 PolarHBondContact O-N 3.36Å; V65-Y68 PolarHBondContact O-N 3.4Å; Y68-N71 PolarHBondContact O-N 2.76Å; Y68-V72 WeakPolarHBondContact O-CG2 3.3Å; Y68-V72 PolarHBondContact O-N 2.59Å; Y68-I92 HydrophobicContact CG-CD1 4.4Å; Y68-I106 HydrophobicContact CD1-CD1 3.83Å; Y68-I106 HydrophobicContact CE1-CD1 3.59Å; Y68-I106 HydrophobicContact CG-CD1 4.41Å; Y68-F108 HydrophobicContact CD1-CZ 4.01Å; Y68-F108 HydrophobicContact CG-CZ 4.33Å
69	C	88.9	Confident	83.8	Confident	7 Å²	7	51 Å²	51	5%	0.047	26%	0.263	C	S	.	.	H	α-helix	trans	-65.2	-42.4	177.9	-91.3	0	0	0	0	113.3	V65 D66 K67 N71 V72 L73 C90 D91	V65-C69 WeakPolarHBondContact O-CB 3.44Å; V65-C69 PolarHBondContact O-N 3.28Å; D66-C69 PolarHBondContact O-N 3.49Å; K67-C69 VanDerWaalsContact C-N 3.31Å; K67-C69 PolarHBondContact O-N 3.18Å; C69-N71 VanDerWaalsContact C-N 3.29Å; C69-N71 PolarHBondContact O-N 3.34Å; C69-V72 PolarHBondContact O-N 3.45Å; C69-L73 WeakPolarHBondContact O-CB 3.18Å; C69-L73 VanDerWaalsContact O-CG 3.3Å; C69-L73 WeakPolarHBondContact O-CG 3.19Å; C69-L73 PolarHBondContact O-N 3.05Å; C69-C90 WeakPolarHBondContact CA-SG 3.35Å; C69-C90 HydrophobicContact CB-CB 3.49Å; C69-C90 VanDerWaalsContact CB-CB 3.49Å; C69-C90 WeakPolarHBondContact CB-SG 3.48Å; C69-C90 WeakPolarHBondContact SG-CB 3.31Å; C69-C90 PolarHBondContact SG-O 2.83Å; C69-C90 CovalentContact SG-SG 2.06Å; C69-C90 PolarHBondContact SG-SG 2.97Å; C69-D91 VanDerWaalsContact SG-CA 3.55Å; C69-D91 PolarHBondContact SG-N 2.95Å
70	A	86.7	Confident	84.4	Confident	52 Å²	52	45.6 Å²	45.6	43%	0.43	24%	0.238	S	C	.	.	H	α-helix	trans	-57.5	-42.1	173.6	0	0	0	0	0	112.5	D66 K67 T74	D66-A70 PolarHBondContact O-N 2.94Å; K67-A70 PolarHBondContact O-N 2.82Å; A70-T74 PolarHBondContact O-N 2.85Å; A70-T74 VanDerWaalsContact O-N 3.12Å; A70-T74 PolarHBondContact O-OG1 3.43Å
71	N	79.8	Confident	84.6	Confident	62 Å²	62	44.8 Å²	44.8	33%	0.332	24%	0.241	S	C	.	.	H	α-helix	trans	-65.7	-44.6	176.7	-70.6	-11.8	0	0	0	112.1	K67 Y68 C69 T74 V75	K67-N71 PolarHBondContact O-N 2.62Å; Y68-N71 PolarHBondContact O-N 2.76Å; C69-N71 VanDerWaalsContact C-N 3.29Å; C69-N71 PolarHBondContact O-N 3.34Å; N71-T74 WeakPolarHBondContact O-CB 3.49Å; N71-T74 PolarHBondContact O-N 2.67Å; N71-V75 PolarHBondContact O-N 3.01Å
72	V	81.1	Confident	85	Confident	2 Å²	2	49 Å²	49	1%	0.012	26%	0.26	C	S	.	.	H	α-helix	trans	-61.7	-46.4	178.1	166.7	0	0	0	0	111.4	L42 V44 Y68 C69 T74 V75 V76 F108 I263	L42-V72 HydrophobicContact CD2-CG1 3.49Å; L42-V72 VanDerWaalsContact CD2-CG1 3.49Å; V44-V72 HydrophobicContact CG2-CG2 4.38Å; Y68-V72 WeakPolarHBondContact O-CG2 3.3Å; Y68-V72 PolarHBondContact O-N 2.59Å; C69-V72 PolarHBondContact O-N 3.45Å; V72-T74 VanDerWaalsContact C-N 3.27Å; V72-T74 PolarHBondContact O-N 2.8Å; V72-V75 PolarHBondContact O-N 3.09Å; V72-V76 HydrophobicContact CG1-CG2 4.15Å; V72-V76 WeakPolarHBondContact O-CB 3.47Å; V72-V76 VanDerWaalsContact O-CG2 3.3Å; V72-V76 WeakPolarHBondContact O-CG2 3.35Å; V72-V76 PolarHBondContact O-N 3.18Å; V72-F108 HydrophobicContact CB-CD1 4.46Å; V72-F108 HydrophobicContact CB-CE1 4.36Å; V72-F108 HydrophobicContact CG2-CD1 3.97Å; V72-F108 HydrophobicContact CG2-CD2 4.11Å; V72-F108 HydrophobicContact CG2-CE1 3.6Å; V72-F108 HydrophobicContact CG2-CE2 3.77Å; V72-F108 HydrophobicContact CG2-CG 4.19Å; V72-F108 HydrophobicContact CG2-CZ 3.51Å; V72-I263 HydrophobicContact CB-CD1 4.36Å; V72-I263 HydrophobicContact CG2-CD1 3.73Å
73	L	85.9	Confident	85.1	Confident	36 Å²	36	49 Å²	49	19%	0.188	26%	0.259	C	S	.	.	H	α-helix	trans	-60.1	-38.5	177.7	-69.9	179.8	0	0	0	112	C69 K77 L88 C90 L110	C69-L73 WeakPolarHBondContact O-CB 3.18Å; C69-L73 VanDerWaalsContact O-CG 3.3Å; C69-L73 WeakPolarHBondContact O-CG 3.19Å; C69-L73 PolarHBondContact O-N 3.05Å; L73-K77 WeakPolarHBondContact O-CG 3.48Å; L73-K77 PolarHBondContact O-N 2.74Å; L73-K77 VanDerWaalsContact O-N 3.16Å; L73-L88 HydrophobicContact CD2-CB 3.55Å; L73-L88 HydrophobicContact CD2-CD1 4.02Å; L73-L88 HydrophobicContact CD2-CG 4.45Å; L73-C90 HydrophobicContact CD1-CB 4.12Å; L73-C90 HydrophobicContact CD2-CB 3.97Å; L73-C90 HydrophobicContact CG-CB 3.9Å; L73-L110 HydrophobicContact CD2-CD1 3.6Å
74	T	82.1	Confident	85.3	Confident	75 Å²	75	49.9 Å²	49.9	46%	0.46	26%	0.26	S	S	.	.	H	α-helix	trans	-61.9	-51.3	175.6	-57.5	0	0	0	0	111.1	A70 N71 V72 V76 K77 E78	A70-T74 PolarHBondContact O-N 2.85Å; A70-T74 VanDerWaalsContact O-N 3.12Å; A70-T74 PolarHBondContact O-OG1 3.43Å; N71-T74 WeakPolarHBondContact O-CB 3.49Å; N71-T74 PolarHBondContact O-N 2.67Å; V72-T74 VanDerWaalsContact C-N 3.27Å; V72-T74 PolarHBondContact O-N 2.8Å; T74-V76 PolarHBondContact O-N 2.89Å; T74-K77 PolarHBondContact O-N 2.7Å; T74-E78 WeakPolarHBondContact O-CG 3.47Å; T74-E78 PolarHBondContact O-N 3.18Å
75	V	77	Confident	85.7	Confident	35 Å²	35	53.2 Å²	53.2	21%	0.212	28%	0.284	C	S	.	.	H	α-helix	trans	-64.8	-40.5	-179.6	170.3	0	0	0	0	112.2	N71 V72 K77 E78 L79 I263	N71-V75 PolarHBondContact O-N 3.01Å; V72-V75 PolarHBondContact O-N 3.09Å; V75-K77 VanDerWaalsContact C-N 3.27Å; V75-K77 PolarHBondContact O-N 3.06Å; V75-E78 PolarHBondContact O-N 3.35Å; V75-L79 HydrophobicContact CG1-CD1 4Å; V75-L79 HydrophobicContact CG1-CG 4.33Å; V75-L79 WeakPolarHBondContact O-CG 3.32Å; V75-L79 PolarHBondContact O-N 3.38Å; V75-I263 HydrophobicContact CB-CD1 4.02Å; V75-I263 HydrophobicContact CG1-CB 4.34Å; V75-I263 HydrophobicContact CG1-CG2 4.29Å; V75-I263 HydrophobicContact CG2-CD1 3.76Å
76	V	80.2	Confident	86	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.006	29%	0.286	C	S	.	.	H	α-helix	trans	-60.1	-39.3	177.6	163.2	0	0	0	0	111.2	L42 V72 T74 E80 L83 L88 L110	L42-V76 HydrophobicContact CD2-CG2 4.14Å; V72-V76 HydrophobicContact CG1-CG2 4.15Å; V72-V76 WeakPolarHBondContact O-CB 3.47Å; V72-V76 VanDerWaalsContact O-CG2 3.3Å; V72-V76 WeakPolarHBondContact O-CG2 3.35Å; V72-V76 PolarHBondContact O-N 3.18Å; T74-V76 PolarHBondContact O-N 2.89Å; V76-E80 PolarHBondContact O-N 2.86Å; V76-L83 HydrophobicContact CG1-CD1 3.27Å; V76-L88 HydrophobicContact CG1-CD1 4.24Å; V76-L110 HydrophobicContact CG1-CD2 4.22Å
77	K	85.9	Confident	86.2	Confident	54 Å²	54	53.3 Å²	53.3	24%	0.235	29%	0.287	C	S	.	.	H	α-helix	trans	-72.5	-34.2	175.8	-73.6	171.5	159.8	-144.2	0	113.6	L73 T74 V75 E80 P81 L83 E84 L88	L73-K77 WeakPolarHBondContact O-CG 3.48Å; L73-K77 PolarHBondContact O-N 2.74Å; L73-K77 VanDerWaalsContact O-N 3.16Å; T74-K77 PolarHBondContact O-N 2.7Å; V75-K77 VanDerWaalsContact C-N 3.27Å; V75-K77 PolarHBondContact O-N 3.06Å; K77-E80 CarbonylContact O-C 3.44Å; K77-P81 WeakPolarHBondContact O-CA 3.34Å; K77-L83 HydrophobicContact CG-CB 4.21Å; K77-E84 IonicContact NZ-OE2 3.79Å; K77-E84 PolarHBondContact NZ-OE2 3.03Å; K77-L88 HydrophobicContact CG-CD1 4.34Å
78	E	80.1	Confident	86.5	Confident	143 Å²	143	49 Å²	49	67%	0.668	27%	0.269	S	S	*	.	H	α-helix	trans	-64.4	-41.2	172.5	-72.7	177.6	175.6	0	0	112	T74 V75	T74-E78 WeakPolarHBondContact O-CG 3.47Å; T74-E78 PolarHBondContact O-N 3.18Å; V75-E78 PolarHBondContact O-N 3.35Å
79	L	75.9	Confident	86.9	Confident	64 Å²	64	47.6 Å²	47.6	34%	0.335	26%	0.263	S	S	.	.	H	α-helix	trans	-71.1	-37.6	177.4	-69.2	174.9	0	0	0	112.4	V75 T133 L134 I265	V75-L79 HydrophobicContact CG1-CD1 4Å; V75-L79 HydrophobicContact CG1-CG 4.33Å; V75-L79 WeakPolarHBondContact O-CG 3.32Å; V75-L79 PolarHBondContact O-N 3.38Å; L79-T133 WeakPolarHBondContact O-CG2 3.46Å; L79-L134 HydrophobicContact CB-CD2 4.06Å; L79-L134 HydrophobicContact CD1-CD2 4.05Å; L79-I265 HydrophobicContact CD1-CD1 3.63Å
80	E	86.6	Confident	86.8	Confident	16 Å²	16	47.5 Å²	47.5	8%	0.075	26%	0.263	C	S	.	.			trans	-130.6	88.4	178.7	-177.8	56.4	-105.3	0	0	111.4	V76 K77 K82 L83 Y121 L130 T133	V76-E80 PolarHBondContact O-N 2.86Å; K77-E80 CarbonylContact O-C 3.44Å; E80-K82 HydrophobicContact CG-CB 4.32Å; E80-K82 PolarHBondContact O-N 3.15Å; E80-K82 VanDerWaalsContact OE1-CB 3.32Å; E80-K82 WeakPolarHBondContact OE1-CB 3.33Å; E80-K82 VanDerWaalsContact OE1-CD 3.3Å; E80-K82 WeakPolarHBondContact OE1-CD 3.33Å; E80-K82 WeakPolarHBondContact OE1-CG 3.31Å; E80-K82 PolarHBondContact OE1-N 3.29Å; E80-L83 HydrophobicContact CB-CD1 3.98Å; E80-L83 HydrophobicContact CB-CG 4.11Å; E80-L83 HydrophobicContact CG-CD1 4.15Å; E80-L83 HydrophobicContact CG-CG 3.83Å; E80-L83 WeakPolarHBondContact O-CB 3.39Å; E80-L83 PolarHBondContact O-N 3.5Å; E80-Y121 VanDerWaalsContact CD-OH 3.29Å; E80-Y121 WeakPolarHBondContact CG-OH 3.5Å; E80-Y121 PolarHBondContact OE2-OH 3.3Å; E80-L130 HydrophobicContact CB-CD1 4.39Å; E80-L130 HydrophobicContact CG-CD1 4.17Å; E80-T133 HydrophobicContact CB-CG2 4Å; E80-T133 PolarHBondContact OE2-OG1 3.25Å
81	P	90.4	Very high	86.8	Confident	88 Å²	88	45.2 Å²	45.2	57%	0.571	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-60.3	-19.1	-177	-27.7	36.2	0	0	0	115	K77 L83 E84	K77-P81 WeakPolarHBondContact O-CA 3.34Å; P81-L83 PolarHBondContact O-N 2.9Å; P81-E84 WeakPolarHBondContact O-CB 3.49Å; P81-E84 WeakPolarHBondContact O-CG 3.47Å; P81-E84 PolarHBondContact O-N 3.38Å; P81-E84 VanDerWaalsContact O-N 3.16Å
82	K	92.7	Very high	86.9	Confident	89 Å²	89	42.2 Å²	42.2	39%	0.387	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-59.8	-28	173.9	-68.2	175	-171.8	165.9	0	112.4	E80 E84 S85 A120 Y121	E80-K82 HydrophobicContact CG-CB 4.32Å; E80-K82 PolarHBondContact O-N 3.15Å; E80-K82 VanDerWaalsContact OE1-CB 3.32Å; E80-K82 WeakPolarHBondContact OE1-CB 3.33Å; E80-K82 VanDerWaalsContact OE1-CD 3.3Å; E80-K82 WeakPolarHBondContact OE1-CD 3.33Å; E80-K82 WeakPolarHBondContact OE1-CG 3.31Å; E80-K82 PolarHBondContact OE1-N 3.29Å; K82-E84 PolarHBondContact O-N 2.98Å; K82-S85 PolarHBondContact O-N 2.95Å; K82-S85 PolarHBondContact O-OG 3.01Å; K82-A120 HydrophobicContact CB-CB 4.43Å; K82-Y121 HydrophobicContact CB-CE2 4.35Å; K82-Y121 HydrophobicContact CD-CD1 4.16Å; K82-Y121 HydrophobicContact CD-CD2 4.31Å; K82-Y121 HydrophobicContact CD-CE1 4.03Å; K82-Y121 HydrophobicContact CD-CE2 4.17Å; K82-Y121 HydrophobicContact CD-CG 4.32Å
83	L	91.8	Very high	86.5	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.005	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-71	-8.3	179.8	-61.4	179.9	0	0	0	113.6	V76 K77 E80 P81 S85 V86 L88 M117 L130	V76-L83 HydrophobicContact CG1-CD1 3.27Å; K77-L83 HydrophobicContact CG-CB 4.21Å; E80-L83 HydrophobicContact CB-CD1 3.98Å; E80-L83 HydrophobicContact CB-CG 4.11Å; E80-L83 HydrophobicContact CG-CD1 4.15Å; E80-L83 HydrophobicContact CG-CG 3.83Å; E80-L83 WeakPolarHBondContact O-CB 3.39Å; E80-L83 PolarHBondContact O-N 3.5Å; P81-L83 PolarHBondContact O-N 2.9Å; L83-S85 PolarHBondContact O-N 3.23Å; L83-V86 HydrophobicContact CD2-CB 4.37Å; L83-V86 HydrophobicContact CD2-CG2 4.27Å; L83-V86 PolarHBondContact O-N 3.04Å; L83-V86 VanDerWaalsContact O-N 3.09Å; L83-L88 HydrophobicContact CB-CD1 4.18Å; L83-L88 HydrophobicContact CD1-CD1 4.3Å; L83-M117 HydrophobicContact CD2-CE 3.7Å; L83-M117 HydrophobicContact CD2-SD 3.42Å; L83-M117 WeakPolarHBondContact CD2-SD 3.45Å; L83-L130 HydrophobicContact CD1-CD1 3.86Å; L83-L130 HydrophobicContact CD2-CD1 4.41Å; L83-L130 HydrophobicContact CG-CD1 4.48Å
84	E	93.7	Very high	85.6	Confident	120 Å²	120	44.6 Å²	44.6	56%	0.561	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-63.1	-24	171.2	-70	-65.2	179.2	0	0	112.9	K77 P81 K82	K77-E84 IonicContact NZ-OE2 3.79Å; K77-E84 PolarHBondContact NZ-OE2 3.03Å; P81-E84 WeakPolarHBondContact O-CB 3.49Å; P81-E84 WeakPolarHBondContact O-CG 3.47Å; P81-E84 PolarHBondContact O-N 3.38Å; P81-E84 VanDerWaalsContact O-N 3.16Å; K82-E84 PolarHBondContact O-N 2.98Å
85	S	94.2	Very high	84.7	Confident	85 Å²	85	43.1 Å²	43.1	59%	0.594	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-91.6	1.4	176.3	66.9	0	0	0	0	114.2	K82 L83	K82-S85 PolarHBondContact O-N 2.95Å; K82-S85 PolarHBondContact O-OG 3.01Å; L83-S85 PolarHBondContact O-N 3.23Å
86	V	94.3	Very high	83.7	Confident	8 Å²	8	50.8 Å²	50.8	5%	0.048	26%	0.258	C	S	.	.	S	Bend	trans	-115.1	135.8	-173.6	-179.3	0	0	0	0	109.9	L83 L88 M112 E116 M117 A120	L83-V86 HydrophobicContact CD2-CB 4.37Å; L83-V86 HydrophobicContact CD2-CG2 4.27Å; L83-V86 PolarHBondContact O-N 3.04Å; L83-V86 VanDerWaalsContact O-N 3.09Å; V86-L88 HydrophobicContact CG1-CD2 3.95Å; V86-L88 PolarHBondContact O-N 3.16Å; V86-M112 HydrophobicContact CG1-CB 4.1Å; V86-E116 HydrophobicContact CG1-CB 4.1Å; V86-E116 HydrophobicContact CG2-CB 4.27Å; V86-M117 HydrophobicContact CB-SD 4.23Å; V86-M117 HydrophobicContact CG1-CG 4.19Å; V86-M117 HydrophobicContact CG1-SD 3.73Å; V86-M117 HydrophobicContact CG2-SD 3.76Å; V86-A120 HydrophobicContact CG2-CB 3.83Å
87	T	94.5	Very high	82.6	Confident	43 Å²	43	55.9 Å²	55.9	26%	0.264	29%	0.285	S	S	.	.			trans	-70.8	117	170	-51	0	0	0	0	108.6	F113 E116 M205	T87-F113 HydrophobicContact CG2-CD2 4.39Å; T87-F113 HydrophobicContact CG2-CE2 4.01Å; T87-E116 WeakPolarHBondContact CA-OE2 3.19Å; T87-E116 VanDerWaalsContact CB-OE2 3.25Å; T87-E116 WeakPolarHBondContact CB-OE2 3.15Å; T87-E116 PolarHBondContact N-OE2 3.26Å; T87-E116 PolarHBondContact OG1-OE1 2.84Å; T87-E116 VanDerWaalsContact OG1-OE1 3.11Å; T87-E116 PolarHBondContact OG1-OE2 3.16Å; T87-E116 VanDerWaalsContact OG1-OE2 3.09Å; T87-M205 HydrophobicContact CG2-CE 4.17Å; T87-M205 WeakPolarHBondContact O-CE 3.22Å
88	L	91.5	Very high	81	Confident	19 Å²	19	56 Å²	56	10%	0.099	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	138.9	177.2	-59.7	179.4	0	0	0	110	L73 V76 K77 L83 V86 L110 A111 M112	L73-L88 HydrophobicContact CD2-CB 3.55Å; L73-L88 HydrophobicContact CD2-CD1 4.02Å; L73-L88 HydrophobicContact CD2-CG 4.45Å; V76-L88 HydrophobicContact CG1-CD1 4.24Å; K77-L88 HydrophobicContact CG-CD1 4.34Å; L83-L88 HydrophobicContact CB-CD1 4.18Å; L83-L88 HydrophobicContact CD1-CD1 4.3Å; V86-L88 HydrophobicContact CG1-CD2 3.95Å; V86-L88 PolarHBondContact O-N 3.16Å; L88-L110 HydrophobicContact CB-CD1 4.38Å; L88-L110 HydrophobicContact CD1-CD1 4.49Å; L88-L110 HydrophobicContact CD2-CD1 4.47Å; L88-A111 WeakPolarHBondContact CA-O 3.32Å; L88-M112 HydrophobicContact CD2-CB 3.81Å
89	S	91	Very high	79.4	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	149.6	166.7	-172.3	0	0	0	0	109.1	A111 M205 G208 Y209 C210	S89-A111 PolarHBondContact N-O 3.25Å; S89-A111 PolarHBondContact O-N 3.09Å; S89-M205 WeakPolarHBondContact CB-SD 3.39Å; S89-G208 VanDerWaalsContact OG-CA 3.27Å; S89-G208 WeakPolarHBondContact OG-CA 3.25Å; S89-G208 PolarHBondContact OG-O 3.46Å; S89-Y209 PolarHBondContact OG-N 2.63Å; S89-C210 WeakPolarHBondContact OG-CA 3.44Å; S89-C210 WeakPolarHBondContact OG-CB 3.31Å; S89-C210 PolarHBondContact OG-N 2.95Å; S89-C210 PolarHBondContact OG-O 3.39Å
90	C	86.8	Confident	78	Confident	5 Å²	5	56.7 Å²	56.7	3%	0.034	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	142.4	179	172.2	0	0	0	0	110.2	C69 L73 F108 K109 C210	C69-C90 WeakPolarHBondContact CA-SG 3.35Å; C69-C90 HydrophobicContact CB-CB 3.49Å; C69-C90 VanDerWaalsContact CB-CB 3.49Å; C69-C90 WeakPolarHBondContact CB-SG 3.48Å; C69-C90 WeakPolarHBondContact SG-CB 3.31Å; C69-C90 PolarHBondContact SG-O 2.83Å; C69-C90 CovalentContact SG-SG 2.06Å; C69-C90 PolarHBondContact SG-SG 2.97Å; L73-C90 HydrophobicContact CD1-CB 4.12Å; L73-C90 HydrophobicContact CD2-CB 3.97Å; L73-C90 HydrophobicContact CG-CB 3.9Å; C90-F108 WeakPolarHBondContact SG-CD1 3.28Å; C90-K109 CarbonylContact C-O 3.45Å; C90-K109 VanDerWaalsContact CA-O 3.25Å; C90-K109 WeakPolarHBondContact CA-O 3.48Å; C90-C210 CarbonylContact C-O 3.19Å
91	D	87.1	Confident	76.4	Confident	3 Å²	3	59.6 Å²	59.6	2%	0.016	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	171.3	168.6	-152.4	-13.6	0	0	0	110.7	C69 F108 K109 C210 C211 V212 N215	C69-D91 VanDerWaalsContact SG-CA 3.55Å; C69-D91 PolarHBondContact SG-N 2.95Å; D91-F108 CarbonylContact O-C 3.5Å; D91-F108 WeakPolarHBondContact O-CA 3.31Å; D91-K109 HydrophobicContact CB-CB 4.22Å; D91-K109 PolarHBondContact N-O 2.7Å; D91-K109 PolarHBondContact O-N 3.09Å; D91-C210 WeakPolarHBondContact CB-O 3.2Å; D91-C211 VanDerWaalsContact CB-N 3.31Å; D91-C211 PolarHBondContact OD2-N 3.23Å; D91-V212 HydrophobicContact CB-CG2 4.04Å; D91-V212 WeakPolarHBondContact OD2-CA 3.46Å; D91-V212 WeakPolarHBondContact OD2-CB 3.41Å; D91-V212 PolarHBondContact OD2-N 2.74Å; D91-N215 PolarHBondContact OD1-ND2 2.59Å
92	I	82.6	Confident	74.6	Confident	0 Å²	0	66 Å²	66	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	133.9	178.2	-64.4	173	0	0	0	109.8	I53 V65 Y68 P94 I106 F108 N215	I53-I92 HydrophobicContact CD1-CD1 3.6Å; I53-I92 HydrophobicContact CD1-CG2 4.1Å; I53-I92 HydrophobicContact CG1-CD1 4.4Å; I53-I92 HydrophobicContact CG1-CG2 4.3Å; V65-I92 HydrophobicContact CB-CD1 4.32Å; V65-I92 HydrophobicContact CG1-CB 4.22Å; V65-I92 HydrophobicContact CG1-CD1 4.2Å; V65-I92 HydrophobicContact CG1-CG1 4.18Å; V65-I92 HydrophobicContact CG2-CB 4.27Å; V65-I92 HydrophobicContact CG2-CD1 4.21Å; Y68-I92 HydrophobicContact CG-CD1 4.4Å; I92-P94 VanDerWaalsContact O-CD 3.28Å; I92-P94 WeakPolarHBondContact O-CD 3.36Å; I92-I106 HydrophobicContact CB-CG2 4.46Å; I92-I106 HydrophobicContact CD1-CG2 3.99Å; I92-I106 HydrophobicContact CG1-CG2 4.06Å; I92-I106 HydrophobicContact CG2-CG2 3.59Å; I92-F108 HydrophobicContact CD1-CD1 4.1Å; I92-F108 HydrophobicContact CD1-CE1 3.46Å; I92-F108 VanDerWaalsContact CD1-CE1 3.46Å; I92-F108 HydrophobicContact CD1-CZ 3.91Å; I92-F108 HydrophobicContact CG1-CD1 3.46Å; I92-F108 VanDerWaalsContact CG1-CD1 3.46Å; I92-F108 HydrophobicContact CG1-CE1 3.38Å; I92-F108 HydrophobicContact CG1-CG 4.29Å; I92-F108 HydrophobicContact CG1-CZ 4.11Å; I92-N215 PolarHBondContact O-ND2 3.47Å
93	I	72.6	Confident	72.8	Confident	64 Å²	64	65.8 Å²	65.8	33%	0.328	33%	0.334	S	S	.	.			trans	-77	115.7	165.7	-51.5	179	0	0	0	107.3	V107 K109 V212	I93-V107 HydrophobicContact CB-CB 4.48Å; I93-V107 HydrophobicContact CD1-CB 4.35Å; I93-V107 HydrophobicContact CD1-CG1 3.75Å; I93-V107 HydrophobicContact CG1-CG1 4.33Å; I93-V107 PolarHBondContact N-O 2.79Å; I93-K109 HydrophobicContact CD1-CD 4.2Å; I93-K109 VanDerWaalsContact CD1-CE 3.48Å; I93-K109 HydrophobicContact CG1-CD 4.27Å; I93-K109 HydrophobicContact CG1-CG 4.16Å; I93-V212 HydrophobicContact CG1-CG2 4.36Å
94	P	66.7	Low	71.7	Confident	23 Å²	23	69.2 Å²	69.2	15%	0.149	35%	0.35	C	S	.	.			trans	-59	135.4	175.4	21	-29.4	0	0	0	110	D56 F61 I92 R96 Y214	D56-P94 HydrophobicContact CB-CB 4.36Å; F61-P94 HydrophobicContact CE2-CB 4.36Å; F61-P94 HydrophobicContact CZ-CB 3.95Å; I92-P94 VanDerWaalsContact O-CD 3.28Å; I92-P94 WeakPolarHBondContact O-CD 3.36Å; P94-R96 PolarHBondContact O-N 2.85Å; P94-Y214 HydrophobicContact CG-CD1 4.12Å; P94-Y214 HydrophobicContact CG-CE1 4.4Å
95	P	64.2	Low	70.6	Confident	45 Å²	45	66 Å²	66	29%	0.292	34%	0.337	S	S	.	.			trans	-67.2	122.7	178.9	28.5	-33.6	0	0	0	109.4	W49 I53 N97	W49-P95 HydrophobicContact CH2-CG 4.31Å; I53-P95 WeakPolarHBondContact O-CD 3.42Å; P95-N97 PolarHBondContact O-N 3.17Å; P95-N97 VanDerWaalsContact O-N 3.11Å
96	R	55.9	Low	69.7	Low	196 Å²	196	62.1 Å²	62.1	74%	0.74	31%	0.309	S	S	*	.	S	Bend	trans	-62.3	-19.4	178.8	-68.6	-175.2	-177.4	177.2	-0	113.5	P94 T147 E148	P94-R96 PolarHBondContact O-N 2.85Å; R96-T147 PolarHBondContact NH1-O 3.44Å; R96-T147 PolarHBondContact NH2-O 3.32Å; R96-T147 VanDerWaalsContact NH2-O 3.1Å; R96-E148 PolarHBondContact NH2-O 2.94Å
97	N	56.1	Low	68.8	Low	108 Å²	108	63.3 Å²	63.3	58%	0.578	32%	0.317	S	S	*	.			trans	-142.7	98	179.9	-161.5	-8	0	0	0	110	P95 V99	P95-N97 PolarHBondContact O-N 3.17Å; P95-N97 VanDerWaalsContact O-N 3.11Å; N97-V99 PolarHBondContact O-N 2.83Å; N97-V99 VanDerWaalsContact OD1-CG2 3.3Å; N97-V99 WeakPolarHBondContact OD1-CG2 3.35Å
98	P	52.9	Low	68.1	Low	55 Å²	55	61.3 Å²	61.3	36%	0.357	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-66.3	-9.1	-178.1	25.5	-33.2	0	0	0	113.1	G54 N100 I101	G54-P98 WeakPolarHBondContact O-CB 3.1Å; P98-N100 PolarHBondContact O-N 2.93Å; P98-N100 VanDerWaalsContact O-N 3.09Å; P98-I101 VanDerWaalsContact O-CD1 3.31Å; P98-I101 WeakPolarHBondContact O-CD1 3.44Å; P98-I101 WeakPolarHBondContact O-CG1 3.48Å; P98-I101 PolarHBondContact O-N 2.89Å
99	V	46.6	Very low	67.7	Low	115 Å²	115	62 Å²	62	70%	0.697	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-64.8	-18.1	-176.3	-176.7	0	0	0	0	112.7	N97 I101	N97-V99 PolarHBondContact O-N 2.83Å; N97-V99 VanDerWaalsContact OD1-CG2 3.3Å; N97-V99 WeakPolarHBondContact OD1-CG2 3.35Å; V99-I101 VanDerWaalsContact C-N 3.31Å; V99-I101 PolarHBondContact O-N 2.97Å
100	N	46.7	Very low	67.3	Low	108 Å²	108	62.1 Å²	62.1	58%	0.578	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-92.9	38.8	175.6	-124.1	16.9	0	0	0	114.1	P98 R102 D103	P98-N100 PolarHBondContact O-N 2.93Å; P98-N100 VanDerWaalsContact O-N 3.09Å; N100-R102 PolarHBondContact O-N 3.1Å; N100-D103 PolarHBondContact O-N 3.05Å
101	I	53	Low	67.3	Low	76 Å²	76	61.9 Å²	61.9	39%	0.39	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-44.7	-24.2	166.4	-72.6	141.3	0	0	0	113	W49 P98 V99 D103 Q104	W49-I101 HydrophobicContact CG-CG2 4.36Å; P98-I101 VanDerWaalsContact O-CD1 3.31Å; P98-I101 WeakPolarHBondContact O-CD1 3.44Å; P98-I101 WeakPolarHBondContact O-CG1 3.48Å; P98-I101 PolarHBondContact O-N 2.89Å; V99-I101 VanDerWaalsContact C-N 3.31Å; V99-I101 PolarHBondContact O-N 2.97Å; I101-D103 PolarHBondContact O-N 2.85Å; I101-D103 VanDerWaalsContact O-N 3.11Å; I101-Q104 PolarHBondContact O-N 3.11Å; I101-Q104 VanDerWaalsContact O-N 3.16Å
102	R	51.1	Low	67.3	Low	224 Å²	224	61.7 Å²	61.7	85%	0.845	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-54.4	-31.9	-177	-71.3	-170	-172.5	-170.7	3.6	114.1	N100	N100-R102 PolarHBondContact O-N 3.1Å
103	D	56.6	Low	67.5	Low	83 Å²	83	62.3 Å²	62.3	44%	0.444	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-91.2	-8.4	-173.3	-61.2	-27.5	0	0	0	112.7	Y45 N100 I101 L105	Y45-D103 WeakPolarHBondContact CD1-O 3.35Å; Y45-D103 WeakPolarHBondContact CE1-O 3.25Å; N100-D103 PolarHBondContact O-N 3.05Å; I101-D103 PolarHBondContact O-N 2.85Å; I101-D103 VanDerWaalsContact O-N 3.11Å; D103-L105 HydrophobicContact CB-CB 4.07Å; D103-L105 PolarHBondContact O-N 2.86Å
104	Q	67.6	Low	68.2	Low	73 Å²	73	60.1 Å²	60.1	34%	0.341	30%	0.298	S	S	.	.			trans	42.5	32.7	-175.2	-50.6	-178.6	-38.4	0	0	112.7	Y45 V46 R47 I101	Y45-Q104 CarbonylContact C-O 3.54Å; Y45-Q104 WeakPolarHBondContact CA-O 3.12Å; V46-Q104 HydrophobicContact CG2-CB 4.19Å; V46-Q104 WeakPolarHBondContact CG2-O 2.99Å; V46-Q104 PolarHBondContact N-O 3.24Å; V46-Q104 WeakPolarHBondContact O-CB 3.38Å; V46-Q104 VanDerWaalsContact O-CD 3.31Å; V46-Q104 PolarHBondContact O-OE1 3.08Å; R47-Q104 PolarHBondContact O-NE2 3.35Å; R47-Q104 PolarHBondContact O-OE1 2.79Å; I101-Q104 PolarHBondContact O-N 3.11Å; I101-Q104 VanDerWaalsContact O-N 3.16Å
105	L	70.1	Confident	69.3	Low	52 Å²	52	61.8 Å²	61.8	27%	0.272	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	128.5	-171.7	174.9	63.6	0	0	0	109	F43 Y45 D103	F43-L105 HydrophobicContact CB-CD1 4.11Å; F43-L105 HydrophobicContact CD1-CD2 4.41Å; Y45-L105 HydrophobicContact CD1-CB 4.21Å; Y45-L105 HydrophobicContact CD1-CD1 4.4Å; Y45-L105 HydrophobicContact CD2-CD1 4.1Å; Y45-L105 HydrophobicContact CE1-CB 4.08Å; Y45-L105 HydrophobicContact CE1-CD1 4.26Å; Y45-L105 HydrophobicContact CE2-CD1 4Å; Y45-L105 HydrophobicContact CG-CD1 4.29Å; D103-L105 HydrophobicContact CB-CB 4.07Å; D103-L105 PolarHBondContact O-N 2.86Å
106	I	75.1	Confident	70.8	Confident	5 Å²	5	62.3 Å²	62.3	3%	0.026	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	133.2	175.3	-57	178.9	0	0	0	108.3	V44 V46 W49 I53 Y68 I92 F108	V44-I106 PolarHBondContact N-O 3.03Å; V44-I106 PolarHBondContact O-N 2.8Å; V46-I106 HydrophobicContact CG1-CD1 3.86Å; V46-I106 HydrophobicContact CG1-CG1 4.32Å; V46-I106 HydrophobicContact CG2-CD1 4.06Å; V46-I106 HydrophobicContact CG2-CG1 4.43Å; W49-I106 HydrophobicContact CE3-CG1 4.37Å; W49-I106 HydrophobicContact CZ3-CD1 4.38Å; W49-I106 HydrophobicContact CZ3-CG1 3.73Å; I53-I106 HydrophobicContact CG1-CD1 4.39Å; I53-I106 HydrophobicContact CG2-CD1 4.39Å; Y68-I106 HydrophobicContact CD1-CD1 3.83Å; Y68-I106 HydrophobicContact CE1-CD1 3.59Å; Y68-I106 HydrophobicContact CG-CD1 4.41Å; I92-I106 HydrophobicContact CB-CG2 4.46Å; I92-I106 HydrophobicContact CD1-CG2 3.99Å; I92-I106 HydrophobicContact CG1-CG2 4.06Å; I92-I106 HydrophobicContact CG2-CG2 3.59Å; I106-F108 HydrophobicContact CB-CD2 4.18Å; I106-F108 HydrophobicContact CB-CE2 3.56Å; I106-F108 HydrophobicContact CB-CZ 4.18Å; I106-F108 HydrophobicContact CD1-CZ 4.48Å; I106-F108 HydrophobicContact CG2-CD2 3.83Å; I106-F108 HydrophobicContact CG2-CE1 4.33Å; I106-F108 HydrophobicContact CG2-CE2 3.36Å; I106-F108 HydrophobicContact CG2-CG 4.48Å; I106-F108 HydrophobicContact CG2-CZ 3.66Å
107	V	76.7	Confident	72.4	Confident	33 Å²	33	53 Å²	53	20%	0.2	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	112.3	174.6	-173.6	0	0	0	0	108.9	D41 F43 I93	D41-V107 HydrophobicContact CB-CG1 4.3Å; F43-V107 HydrophobicContact CD1-CG2 3.78Å; F43-V107 HydrophobicContact CE1-CG1 4.21Å; F43-V107 HydrophobicContact CE1-CG2 3.67Å; F43-V107 HydrophobicContact CE2-CG1 4.49Å; F43-V107 HydrophobicContact CZ-CG1 4.19Å; F43-V107 HydrophobicContact CZ-CG2 4.45Å; I93-V107 HydrophobicContact CB-CB 4.48Å; I93-V107 HydrophobicContact CD1-CB 4.35Å; I93-V107 HydrophobicContact CD1-CG1 3.75Å; I93-V107 HydrophobicContact CG1-CG1 4.33Å; I93-V107 PolarHBondContact N-O 2.79Å
108	F	80.4	Confident	74.2	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	141.7	176.4	-68.7	-93	0	0	0	110.5	D41 L42 V44 Y68 V72 C90 D91 I92 I106	D41-F108 CarbonylContact C-O 3.55Å; D41-F108 WeakPolarHBondContact CA-O 3.24Å; L42-F108 HydrophobicContact CB-CB 4.15Å; L42-F108 PolarHBondContact N-O 2.73Å; L42-F108 PolarHBondContact O-N 3.41Å; V44-F108 HydrophobicContact CB-CD2 3.67Å; V44-F108 HydrophobicContact CB-CE2 3.56Å; V44-F108 HydrophobicContact CG1-CE2 3.96Å; V44-F108 HydrophobicContact CG2-CD2 3.53Å; V44-F108 HydrophobicContact CG2-CE2 3.83Å; Y68-F108 HydrophobicContact CD1-CZ 4.01Å; Y68-F108 HydrophobicContact CG-CZ 4.33Å; V72-F108 HydrophobicContact CB-CD1 4.46Å; V72-F108 HydrophobicContact CB-CE1 4.36Å; V72-F108 HydrophobicContact CG2-CD1 3.97Å; V72-F108 HydrophobicContact CG2-CD2 4.11Å; V72-F108 HydrophobicContact CG2-CE1 3.6Å; V72-F108 HydrophobicContact CG2-CE2 3.77Å; V72-F108 HydrophobicContact CG2-CG 4.19Å; V72-F108 HydrophobicContact CG2-CZ 3.51Å; C90-F108 WeakPolarHBondContact SG-CD1 3.28Å; D91-F108 CarbonylContact O-C 3.5Å; D91-F108 WeakPolarHBondContact O-CA 3.31Å; I92-F108 HydrophobicContact CD1-CD1 4.1Å; I92-F108 HydrophobicContact CD1-CE1 3.46Å; I92-F108 VanDerWaalsContact CD1-CE1 3.46Å; I92-F108 HydrophobicContact CD1-CZ 3.91Å; I92-F108 HydrophobicContact CG1-CD1 3.46Å; I92-F108 VanDerWaalsContact CG1-CD1 3.46Å; I92-F108 HydrophobicContact CG1-CE1 3.38Å; I92-F108 HydrophobicContact CG1-CG 4.29Å; I92-F108 HydrophobicContact CG1-CZ 4.11Å; I106-F108 HydrophobicContact CB-CD2 4.18Å; I106-F108 HydrophobicContact CB-CE2 3.56Å; I106-F108 HydrophobicContact CB-CZ 4.18Å; I106-F108 HydrophobicContact CD1-CZ 4.48Å; I106-F108 HydrophobicContact CG2-CD2 3.83Å; I106-F108 HydrophobicContact CG2-CE1 4.33Å; I106-F108 HydrophobicContact CG2-CE2 3.36Å; I106-F108 HydrophobicContact CG2-CG 4.48Å; I106-F108 HydrophobicContact CG2-CZ 3.66Å
109	K	82.3	Confident	76.2	Confident	35 Å²	35	57.9 Å²	57.9	15%	0.152	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	111.4	161.2	-65.4	-58.7	-165.8	-176.8	0	107.2	V39 D41 C90 D91 I93 C211 V212	V39-K109 HydrophobicContact CG1-CB 4.06Å; V39-K109 HydrophobicContact CG1-CD 3.99Å; V39-K109 HydrophobicContact CG1-CG 4.46Å; D41-K109 WeakPolarHBondContact OD1-CD 3.38Å; D41-K109 WeakPolarHBondContact OD1-CE 3.36Å; D41-K109 IonicContact OD1-NZ 2.59Å; D41-K109 PolarHBondContact OD1-NZ 3.11Å; D41-K109 IonicContact OD2-NZ 3.79Å; C90-K109 CarbonylContact C-O 3.45Å; C90-K109 VanDerWaalsContact CA-O 3.25Å; C90-K109 WeakPolarHBondContact CA-O 3.48Å; D91-K109 HydrophobicContact CB-CB 4.22Å; D91-K109 PolarHBondContact N-O 2.7Å; D91-K109 PolarHBondContact O-N 3.09Å; I93-K109 HydrophobicContact CD1-CD 4.2Å; I93-K109 VanDerWaalsContact CD1-CE 3.48Å; I93-K109 HydrophobicContact CG1-CD 4.27Å; I93-K109 HydrophobicContact CG1-CG 4.16Å; K109-C211 HydrophobicContact CB-CB 4.11Å; K109-C211 HydrophobicContact CG-CB 4.45Å; K109-V212 HydrophobicContact CG-CG2 3.81Å
110	L	83.3	Confident	78.4	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	122.2	169.3	-178.8	69.2	0	0	0	108.2	T40 L73 V76 L88 M112	T40-L110 HydrophobicContact CG2-CB 3.93Å; T40-L110 HydrophobicContact CG2-CD2 4.34Å; T40-L110 HydrophobicContact CG2-CG 4.46Å; T40-L110 WeakPolarHBondContact CG2-O 3.16Å; T40-L110 PolarHBondContact N-O 2.94Å; T40-L110 PolarHBondContact O-N 3.24Å; L73-L110 HydrophobicContact CD2-CD1 3.6Å; V76-L110 HydrophobicContact CG1-CD2 4.22Å; L88-L110 HydrophobicContact CB-CD1 4.38Å; L88-L110 HydrophobicContact CD1-CD1 4.49Å; L88-L110 HydrophobicContact CD2-CD1 4.47Å; L110-M112 HydrophobicContact CB-CE 4.47Å; L110-M112 HydrophobicContact CD2-CE 3.85Å; L110-M112 HydrophobicContact CG-CE 3.73Å
111	A	85.9	Confident	80.6	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	154.9	176.8	0	0	0	0	0	112.2	V38 V39 L88 S89 M205 C211	V38-A111 VanDerWaalsContact O-CA 3.24Å; V38-A111 WeakPolarHBondContact O-CA 3.47Å; V39-A111 HydrophobicContact CG1-CB 4.47Å; V39-A111 HydrophobicContact CG2-CB 3.93Å; L88-A111 WeakPolarHBondContact CA-O 3.32Å; S89-A111 PolarHBondContact N-O 3.25Å; S89-A111 PolarHBondContact O-N 3.09Å; A111-M205 VanDerWaalsContact C-CE 3.45Å; A111-M205 HydrophobicContact CB-CE 4.3Å; A111-M205 HydrophobicContact CB-SD 3.41Å; A111-M205 WeakPolarHBondContact CB-SD 3.22Å; A111-M205 VanDerWaalsContact O-CE 3.28Å; A111-M205 WeakPolarHBondContact O-CE 3.47Å; A111-C211 WeakPolarHBondContact CB-SG 3.44Å
112	M	86.6	Confident	82.6	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	158.3	-175.9	61.4	-147.6	74.9	0	0	110.7	V38 T40 V86 L88 L110 M117 W126 L130 M205	V38-M112 HydrophobicContact CB-CG 4.26Å; V38-M112 PolarHBondContact N-O 3.27Å; V38-M112 PolarHBondContact O-N 2.9Å; T40-M112 HydrophobicContact CG2-CE 3.91Å; V86-M112 HydrophobicContact CG1-CB 4.1Å; L88-M112 HydrophobicContact CD2-CB 3.81Å; L110-M112 HydrophobicContact CB-CE 4.47Å; L110-M112 HydrophobicContact CD2-CE 3.85Å; L110-M112 HydrophobicContact CG-CE 3.73Å; M112-M117 HydrophobicContact CB-CG 4.16Å; M112-M117 HydrophobicContact CG-CG 3.8Å; M112-M117 HydrophobicContact CG-SD 4.43Å; M112-M117 HydrophobicContact SD-CE 4.09Å; M112-M117 HydrophobicContact SD-CG 3.97Å; M112-M117 HydrophobicContact SD-SD 4.04Å; M112-W126 HydrophobicContact CG-CH2 4.03Å; M112-W126 HydrophobicContact SD-CH2 3.6Å; M112-W126 HydrophobicContact SD-CZ3 3.64Å; M112-L130 HydrophobicContact SD-CD2 4.06Å; M112-M205 VanDerWaalsContact CA-CE 3.46Å
113	F	87	Confident	84.4	Confident	12 Å²	12	42.8 Å²	42.8	5%	0.053	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	126.4	167.9	-67.3	-64.2	0	0	0	110.7	D36 I37 T87 S115 E116 M117 E202 M205 K206	D36-F113 CarbonylContact O-C 3.52Å; D36-F113 VanDerWaalsContact O-CA 3.28Å; D36-F113 WeakPolarHBondContact O-CA 3.11Å; I37-F113 HydrophobicContact CD1-CE1 4.16Å; I37-F113 HydrophobicContact CG1-CD1 3.94Å; I37-F113 HydrophobicContact CG1-CE1 3.67Å; T87-F113 HydrophobicContact CG2-CD2 4.39Å; T87-F113 HydrophobicContact CG2-CE2 4.01Å; F113-S115 VanDerWaalsContact C-N 3.27Å; F113-S115 PolarHBondContact O-N 3.05Å; F113-E116 HydrophobicContact CB-CB 4.1Å; F113-E116 HydrophobicContact CB-CG 3.91Å; F113-E116 HydrophobicContact CD2-CG 4.49Å; F113-E116 PolarHBondContact O-N 3.05Å; F113-M117 VanDerWaalsContact O-CG 3.31Å; F113-M117 WeakPolarHBondContact O-CG 3.37Å; F113-M117 PolarHBondContact O-N 3.37Å; F113-E202 HydrophobicContact CE1-CG 3.8Å; F113-E202 HydrophobicContact CZ-CG 3.76Å; F113-M205 HydrophobicContact CE1-CG 4.14Å; F113-M205 HydrophobicContact CE2-CG 4.02Å; F113-M205 HydrophobicContact CZ-CB 4.3Å; F113-M205 HydrophobicContact CZ-CG 3.69Å; F113-K206 HydrophobicContact CE2-CG 4.15Å; F113-K206 HydrophobicContact CZ-CG 4.14Å
114	S	87.3	Confident	85.8	Confident	19 Å²	19	44.4 Å²	44.4	13%	0.133	24%	0.241	C	C	.	.	H	α-helix	trans	-62.2	-35.1	176.5	43.8	0	0	0	0	112.3	D36 M117 E118	D36-S114 WeakPolarHBondContact CA-OG 3.37Å; D36-S114 PolarHBondContact O-N 3.11Å; D36-S114 PolarHBondContact O-OG 3.35Å; D36-S114 VanDerWaalsContact O-OG 3.12Å; D36-S114 WeakPolarHBondContact OD1-CA 3.5Å; D36-S114 WeakPolarHBondContact OD1-CB 3.3Å; D36-S114 PolarHBondContact OD1-N 3.36Å; D36-S114 PolarHBondContact OD1-OG 2.82Å; S114-M117 PolarHBondContact O-N 3.47Å; S114-E118 WeakPolarHBondContact O-CB 3.39Å; S114-E118 VanDerWaalsContact O-CG 3.26Å; S114-E118 WeakPolarHBondContact O-CG 3.46Å; S114-E118 PolarHBondContact O-N 3.46Å
115	S	90.8	Very high	86.7	Confident	58 Å²	58	48.4 Å²	48.4	41%	0.406	26%	0.257	S	S	.	.	H	α-helix	trans	-64.9	-40.4	178.4	64.2	0	0	0	0	112.3	D36 F113 K119	D36-S115 WeakPolarHBondContact OD1-CB 3.35Å; D36-S115 PolarHBondContact OD1-N 3.35Å; D36-S115 PolarHBondContact OD1-OG 3.06Å; D36-S115 VanDerWaalsContact OD2-CB 3.31Å; D36-S115 WeakPolarHBondContact OD2-CB 3.28Å; D36-S115 PolarHBondContact OD2-OG 3.26Å; F113-S115 VanDerWaalsContact C-N 3.27Å; F113-S115 PolarHBondContact O-N 3.05Å; S115-K119 PolarHBondContact O-N 3.02Å; S115-K119 VanDerWaalsContact O-N 3.11Å
116	E	94.2	Very high	87.4	Confident	56 Å²	56	46.5 Å²	46.5	26%	0.262	25%	0.246	S	C	.	.	H	α-helix	trans	-69.3	-40.5	174.6	-66.8	-176.2	161.3	0	0	111.3	V86 T87 F113 K119 A120	V86-E116 HydrophobicContact CG1-CB 4.1Å; V86-E116 HydrophobicContact CG2-CB 4.27Å; T87-E116 WeakPolarHBondContact CA-OE2 3.19Å; T87-E116 VanDerWaalsContact CB-OE2 3.25Å; T87-E116 WeakPolarHBondContact CB-OE2 3.15Å; T87-E116 PolarHBondContact N-OE2 3.26Å; T87-E116 PolarHBondContact OG1-OE1 2.84Å; T87-E116 VanDerWaalsContact OG1-OE1 3.11Å; T87-E116 PolarHBondContact OG1-OE2 3.16Å; T87-E116 VanDerWaalsContact OG1-OE2 3.09Å; F113-E116 HydrophobicContact CB-CB 4.1Å; F113-E116 HydrophobicContact CB-CG 3.91Å; F113-E116 HydrophobicContact CD2-CG 4.49Å; F113-E116 PolarHBondContact O-N 3.05Å; E116-K119 PolarHBondContact O-N 3.28Å; E116-A120 WeakPolarHBondContact O-CB 3.06Å; E116-A120 PolarHBondContact O-N 3.21Å
117	M	90.2	Very high	87.8	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.6	-44.4	174.8	-70.5	-61.2	-69.6	0	0	112.1	L83 V86 M112 F113 S114 K119 A120 Y121 W126 L130	L83-M117 HydrophobicContact CD2-CE 3.7Å; L83-M117 HydrophobicContact CD2-SD 3.42Å; L83-M117 WeakPolarHBondContact CD2-SD 3.45Å; V86-M117 HydrophobicContact CB-SD 4.23Å; V86-M117 HydrophobicContact CG1-CG 4.19Å; V86-M117 HydrophobicContact CG1-SD 3.73Å; V86-M117 HydrophobicContact CG2-SD 3.76Å; M112-M117 HydrophobicContact CB-CG 4.16Å; M112-M117 HydrophobicContact CG-CG 3.8Å; M112-M117 HydrophobicContact CG-SD 4.43Å; M112-M117 HydrophobicContact SD-CE 4.09Å; M112-M117 HydrophobicContact SD-CG 3.97Å; M112-M117 HydrophobicContact SD-SD 4.04Å; F113-M117 VanDerWaalsContact O-CG 3.31Å; F113-M117 WeakPolarHBondContact O-CG 3.37Å; F113-M117 PolarHBondContact O-N 3.37Å; S114-M117 PolarHBondContact O-N 3.47Å; M117-K119 VanDerWaalsContact C-N 3.27Å; M117-K119 PolarHBondContact O-N 3.12Å; M117-A120 PolarHBondContact O-N 2.94Å; M117-Y121 HydrophobicContact CE-CD2 3.98Å; M117-Y121 HydrophobicContact CE-CE2 3.43Å; M117-Y121 VanDerWaalsContact CE-CE2 3.43Å; M117-Y121 WeakPolarHBondContact O-CB 3.25Å; M117-Y121 WeakPolarHBondContact O-CD2 3.25Å; M117-Y121 PolarHBondContact O-N 2.74Å; M117-Y121 HydrophobicContact SD-CE2 4.39Å; M117-W126 HydrophobicContact CB-CD2 3.5Å; M117-W126 VanDerWaalsContact CB-CE2 3.42Å; M117-W126 HydrophobicContact CB-CE3 3.97Å; M117-W126 HydrophobicContact CB-CG 3.81Å; M117-W126 HydrophobicContact CB-CH2 4.29Å; M117-W126 HydrophobicContact CB-CZ2 3.85Å; M117-W126 HydrophobicContact CB-CZ3 4.35Å; M117-W126 HydrophobicContact CE-CD2 3.87Å; M117-W126 HydrophobicContact CE-CE3 3.16Å; M117-W126 HydrophobicContact CE-CH2 4.32Å; M117-W126 HydrophobicContact CE-CZ3 3.45Å; M117-W126 VanDerWaalsContact CE-CZ3 3.45Å; M117-W126 HydrophobicContact CG-CD2 4.12Å; M117-W126 HydrophobicContact CG-CE3 4.1Å; M117-W126 HydrophobicContact CG-CH2 3.99Å; M117-W126 HydrophobicContact CG-CZ2 3.99Å; M117-W126 HydrophobicContact CG-CZ3 4.04Å; M117-W126 HydrophobicContact SD-CE3 4.47Å; M117-L130 HydrophobicContact CE-CB 4.42Å; M117-L130 HydrophobicContact CE-CD2 3.83Å
118	E	93.1	Very high	88	Confident	89 Å²	89	49.2 Å²	49.2	42%	0.416	27%	0.265	S	S	.	.	H	α-helix	trans	-58.3	-41	175.6	-80.3	177.7	-166.2	0	0	111.9	S114 S122 S123 D124	S114-E118 WeakPolarHBondContact O-CB 3.39Å; S114-E118 VanDerWaalsContact O-CG 3.26Å; S114-E118 WeakPolarHBondContact O-CG 3.46Å; S114-E118 PolarHBondContact O-N 3.46Å; E118-S122 CarbonylContact O-C 3.43Å; E118-S122 WeakPolarHBondContact O-CA 3.35Å; E118-S122 PolarHBondContact O-N 2.06Å; E118-S123 WeakPolarHBondContact CA-O 3.05Å; E118-S123 PolarHBondContact O-N 2.89Å; E118-S123 VanDerWaalsContact O-N 3.1Å; E118-D124 HydrophobicContact CG-CB 4.49Å
119	K	95.1	Very high	88.1	Confident	176 Å²	176	51.5 Å²	51.5	77%	0.765	28%	0.28	S	S	*	.	H	α-helix	trans	-67.7	-47.1	175.1	-175.6	179.3	177.6	-173.7	0	112	S115 E116 M117 Y121 S122	S115-K119 PolarHBondContact O-N 3.02Å; S115-K119 VanDerWaalsContact O-N 3.11Å; E116-K119 PolarHBondContact O-N 3.28Å; M117-K119 VanDerWaalsContact C-N 3.27Å; M117-K119 PolarHBondContact O-N 3.12Å; K119-Y121 VanDerWaalsContact C-N 3.31Å; K119-Y121 PolarHBondContact O-N 3.36Å; K119-S122 PolarHBondContact O-N 2.92Å
120	A	94.5	Very high	88	Confident	23 Å²	23	49.8 Å²	49.8	19%	0.19	27%	0.273	C	S	.	.	H	α-helix	trans	-63.7	-35.5	-178.7	0	0	0	0	0	112.5	K82 V86 E116 M117	K82-A120 HydrophobicContact CB-CB 4.43Å; V86-A120 HydrophobicContact CG2-CB 3.83Å; E116-A120 WeakPolarHBondContact O-CB 3.06Å; E116-A120 PolarHBondContact O-N 3.21Å; M117-A120 PolarHBondContact O-N 2.94Å
121	Y	92.5	Very high	87.7	Confident	24 Å²	24	53 Å²	53	9%	0.094	29%	0.287	C	S	.	.	H	α-helix	trans	-96	-9.5	178.6	-78.2	-101.3	0	0	0	114.1	E80 K82 M117 K119 S123 W126 S129 L130	E80-Y121 VanDerWaalsContact CD-OH 3.29Å; E80-Y121 WeakPolarHBondContact CG-OH 3.5Å; E80-Y121 PolarHBondContact OE2-OH 3.3Å; K82-Y121 HydrophobicContact CB-CE2 4.35Å; K82-Y121 HydrophobicContact CD-CD1 4.16Å; K82-Y121 HydrophobicContact CD-CD2 4.31Å; K82-Y121 HydrophobicContact CD-CE1 4.03Å; K82-Y121 HydrophobicContact CD-CE2 4.17Å; K82-Y121 HydrophobicContact CD-CG 4.32Å; M117-Y121 HydrophobicContact CE-CD2 3.98Å; M117-Y121 HydrophobicContact CE-CE2 3.43Å; M117-Y121 VanDerWaalsContact CE-CE2 3.43Å; M117-Y121 WeakPolarHBondContact O-CB 3.25Å; M117-Y121 WeakPolarHBondContact O-CD2 3.25Å; M117-Y121 PolarHBondContact O-N 2.74Å; M117-Y121 HydrophobicContact SD-CE2 4.39Å; K119-Y121 VanDerWaalsContact C-N 3.31Å; K119-Y121 PolarHBondContact O-N 3.36Å; Y121-S123 PolarHBondContact O-N 3.27Å; Y121-W126 HydrophobicContact CD1-CB 4.05Å; Y121-W126 HydrophobicContact CD2-CB 3.8Å; Y121-W126 HydrophobicContact CE2-CB 4.5Å; Y121-W126 HydrophobicContact CG-CB 3.52Å; Y121-S129 WeakPolarHBondContact CE1-OG 3.02Å; Y121-L130 WeakPolarHBondContact OH-CA 3.41Å; Y121-L130 WeakPolarHBondContact OH-CB 3.32Å
122	S	93.4	Very high	87.2	Confident	113 Å²	113	57.8 Å²	57.8	79%	0.79	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	37.3	-170	-56.9	0	0	0	0	112.6	E118 K119	E118-S122 CarbonylContact O-C 3.43Å; E118-S122 WeakPolarHBondContact O-CA 3.35Å; E118-S122 PolarHBondContact O-N 2.06Å; K119-S122 PolarHBondContact O-N 2.92Å
123	S	90.8	Very high	86.7	Confident	47 Å²	47	59.6 Å²	59.6	33%	0.329	32%	0.323	S	S	.	.	S	Bend	trans	-162.9	138.4	-172.6	-179.5	0	0	0	0	112.3	E118 Y121 K125 W126	E118-S123 WeakPolarHBondContact CA-O 3.05Å; E118-S123 PolarHBondContact O-N 2.89Å; E118-S123 VanDerWaalsContact O-N 3.1Å; Y121-S123 PolarHBondContact O-N 3.27Å; S123-K125 PolarHBondContact O-N 3.06Å; S123-K125 PolarHBondContact OG-N 2.99Å; S123-K125 VanDerWaalsContact OG-N 3.14Å; S123-W126 VanDerWaalsContact O-CD1 3.3Å
124	D	85.5	Confident	86.1	Confident	117 Å²	117	59 Å²	59	63%	0.626	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-13.9	170	67.1	-22.7	0	0	0	113.4	E118 W126	E118-D124 HydrophobicContact CG-CB 4.49Å; D124-W126 VanDerWaalsContact C-N 3.31Å
125	K	86.7	Confident	85.1	Confident	156 Å²	156	61.5 Å²	61.5	68%	0.678	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	26.5	176.1	-62.5	177.5	-171.5	178.2	0	112.5	S123 F127	S123-K125 PolarHBondContact O-N 3.06Å; S123-K125 PolarHBondContact OG-N 2.99Å; S123-K125 VanDerWaalsContact OG-N 3.14Å; K125-F127 PolarHBondContact O-N 2.82Å
126	W	85.3	Confident	83.9	Confident	13 Å²	13	63.3 Å²	63.3	5%	0.049	34%	0.343	C	S	.	.	H	α-helix	trans	-58.7	-33.9	-177.6	58.2	-101.8	0	0	0	113.2	V38 M112 M117 Y121 S123 D124 S128 S129 L130	V38-W126 HydrophobicContact CB-CH2 4.21Å; V38-W126 HydrophobicContact CB-CZ2 4.39Å; V38-W126 HydrophobicContact CG1-CH2 4.02Å; V38-W126 HydrophobicContact CG2-CH2 4.36Å; V38-W126 HydrophobicContact CG2-CZ2 4.07Å; M112-W126 HydrophobicContact CG-CH2 4.03Å; M112-W126 HydrophobicContact SD-CH2 3.6Å; M112-W126 HydrophobicContact SD-CZ3 3.64Å; M117-W126 HydrophobicContact CB-CD2 3.5Å; M117-W126 VanDerWaalsContact CB-CE2 3.42Å; M117-W126 HydrophobicContact CB-CE3 3.97Å; M117-W126 HydrophobicContact CB-CG 3.81Å; M117-W126 HydrophobicContact CB-CH2 4.29Å; M117-W126 HydrophobicContact CB-CZ2 3.85Å; M117-W126 HydrophobicContact CB-CZ3 4.35Å; M117-W126 HydrophobicContact CE-CD2 3.87Å; M117-W126 HydrophobicContact CE-CE3 3.16Å; M117-W126 HydrophobicContact CE-CH2 4.32Å; M117-W126 HydrophobicContact CE-CZ3 3.45Å; M117-W126 VanDerWaalsContact CE-CZ3 3.45Å; M117-W126 HydrophobicContact CG-CD2 4.12Å; M117-W126 HydrophobicContact CG-CE3 4.1Å; M117-W126 HydrophobicContact CG-CH2 3.99Å; M117-W126 HydrophobicContact CG-CZ2 3.99Å; M117-W126 HydrophobicContact CG-CZ3 4.04Å; M117-W126 HydrophobicContact SD-CE3 4.47Å; Y121-W126 HydrophobicContact CD1-CB 4.05Å; Y121-W126 HydrophobicContact CD2-CB 3.8Å; Y121-W126 HydrophobicContact CE2-CB 4.5Å; Y121-W126 HydrophobicContact CG-CB 3.52Å; S123-W126 VanDerWaalsContact O-CD1 3.3Å; D124-W126 VanDerWaalsContact C-N 3.31Å; W126-S128 VanDerWaalsContact C-N 3.32Å; W126-S128 PolarHBondContact O-N 3.48Å; W126-S129 WeakPolarHBondContact O-CB 3.36Å; W126-S129 PolarHBondContact O-N 3.5Å; W126-L130 HydrophobicContact CE3-CB 4.44Å; W126-L130 HydrophobicContact CE3-CD2 4.39Å; W126-L130 HydrophobicContact CZ3-CD2 3.96Å; W126-L130 PolarHBondContact O-N 3.27Å
127	F	81.5	Confident	82.3	Confident	20 Å²	20	61.3 Å²	61.3	9%	0.088	34%	0.337	C	S	.	.	H	α-helix	trans	-61.5	-39.2	-172.6	-174.4	-88.4	0	0	0	112.7	K125 S129 L130 K131 L268 N270	K125-F127 PolarHBondContact O-N 2.82Å; F127-S129 VanDerWaalsContact C-N 3.31Å; F127-S129 PolarHBondContact O-N 3.11Å; F127-L130 PolarHBondContact O-N 3.19Å; F127-K131 HydrophobicContact CD1-CB 4.28Å; F127-K131 HydrophobicContact CE1-CB 4.02Å; F127-K131 HydrophobicContact CE1-CD 4Å; F127-K131 HydrophobicContact CE1-CG 4.39Å; F127-K131 WeakPolarHBondContact O-CB 3.2Å; F127-K131 PolarHBondContact O-N 2.96Å; F127-L268 HydrophobicContact CZ-CB 4.43Å; F127-N270 VanDerWaalsContact CD1-CG 3.46Å; F127-N270 WeakPolarHBondContact CD1-ND2 3.29Å; F127-N270 WeakPolarHBondContact CD1-OD1 3.4Å; F127-N270 WeakPolarHBondContact CD2-OD1 3.31Å; F127-N270 HydrophobicContact CE1-CB 4.41Å; F127-N270 WeakPolarHBondContact CE1-ND2 3.46Å; F127-N270 WeakPolarHBondContact CE1-OD1 3.28Å; F127-N270 WeakPolarHBondContact CE2-OD1 3.47Å; F127-N270 WeakPolarHBondContact CG-OD1 3.14Å; F127-N270 HydrophobicContact CZ-CB 4.46Å; F127-N270 VanDerWaalsContact CZ-CG 3.48Å; F127-N270 WeakPolarHBondContact CZ-OD1 3.48Å
128	S	80.9	Confident	79.9	Confident	75 Å²	75	68.5 Å²	68.5	52%	0.524	38%	0.376	S	S	.	.	H	α-helix	trans	-61.6	-41.8	175.9	-67.5	0	0	0	0	111.5	W126 K131 D132	W126-S128 VanDerWaalsContact C-N 3.32Å; W126-S128 PolarHBondContact O-N 3.48Å; S128-K131 PolarHBondContact O-N 3.09Å; S128-D132 WeakPolarHBondContact O-CB 3.28Å; S128-D132 PolarHBondContact O-N 3.34Å
129	S	83	Confident	77.8	Confident	47 Å²	47	65.8 Å²	65.8	33%	0.329	36%	0.364	S	S	.	.	H	α-helix	trans	-67.3	-42.6	177	-173.1	0	0	0	0	112.1	Y121 W126 F127 D132 T133	Y121-S129 WeakPolarHBondContact CE1-OG 3.02Å; W126-S129 WeakPolarHBondContact O-CB 3.36Å; W126-S129 PolarHBondContact O-N 3.5Å; F127-S129 VanDerWaalsContact C-N 3.31Å; F127-S129 PolarHBondContact O-N 3.11Å; S129-D132 PolarHBondContact O-N 3.29Å; S129-T133 PolarHBondContact O-N 3.01Å; S129-T133 PolarHBondContact O-OG1 3.16Å
130	L	79.6	Confident	74.9	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-61.3	-48.4	176	174.5	65.4	0	0	0	110.7	E80 L83 M112 M117 Y121 W126 F127 D132 T133 L134	E80-L130 HydrophobicContact CB-CD1 4.39Å; E80-L130 HydrophobicContact CG-CD1 4.17Å; L83-L130 HydrophobicContact CD1-CD1 3.86Å; L83-L130 HydrophobicContact CD2-CD1 4.41Å; L83-L130 HydrophobicContact CG-CD1 4.48Å; M112-L130 HydrophobicContact SD-CD2 4.06Å; M117-L130 HydrophobicContact CE-CB 4.42Å; M117-L130 HydrophobicContact CE-CD2 3.83Å; Y121-L130 WeakPolarHBondContact OH-CA 3.41Å; Y121-L130 WeakPolarHBondContact OH-CB 3.32Å; W126-L130 HydrophobicContact CE3-CB 4.44Å; W126-L130 HydrophobicContact CE3-CD2 4.39Å; W126-L130 HydrophobicContact CZ3-CD2 3.96Å; W126-L130 PolarHBondContact O-N 3.27Å; F127-L130 PolarHBondContact O-N 3.19Å; L130-D132 PolarHBondContact O-N 3.42Å; L130-T133 PolarHBondContact O-N 3.39Å; L130-L134 HydrophobicContact CD1-CD1 3.72Å; L130-L134 HydrophobicContact CD1-CG 3.92Å; L130-L134 HydrophobicContact CD2-CD1 4.49Å; L130-L134 HydrophobicContact CG-CD1 3.93Å; L130-L134 HydrophobicContact CG-CG 4.37Å; L130-L134 WeakPolarHBondContact O-CB 3.18Å; L130-L134 WeakPolarHBondContact O-CG 3.25Å; L130-L134 PolarHBondContact O-N 2.8Å
131	K	77.2	Confident	72	Confident	69 Å²	69	66.8 Å²	66.8	30%	0.3	37%	0.372	S	S	.	.	H	α-helix	trans	-56.6	-51.1	177.8	-178.8	-176	-179.5	-171.9	0	110.3	F127 S128 T133 L134 E135 L268	F127-K131 HydrophobicContact CD1-CB 4.28Å; F127-K131 HydrophobicContact CE1-CB 4.02Å; F127-K131 HydrophobicContact CE1-CD 4Å; F127-K131 HydrophobicContact CE1-CG 4.39Å; F127-K131 WeakPolarHBondContact O-CB 3.2Å; F127-K131 PolarHBondContact O-N 2.96Å; S128-K131 PolarHBondContact O-N 3.09Å; K131-T133 VanDerWaalsContact C-N 3.34Å; K131-T133 PolarHBondContact O-N 3.24Å; K131-L134 PolarHBondContact O-N 3.07Å; K131-E135 WeakPolarHBondContact CE-OE1 3.21Å; K131-E135 WeakPolarHBondContact CE-OE2 3.33Å; K131-E135 HydrophobicContact CG-CG 4.05Å; K131-E135 IonicContact NZ-OE1 3.66Å; K131-E135 IonicContact NZ-OE2 3.95Å; K131-E135 VanDerWaalsContact O-CB 3.26Å; K131-E135 WeakPolarHBondContact O-CB 3.2Å; K131-E135 WeakPolarHBondContact O-CG 3Å; K131-E135 PolarHBondContact O-N 2.91Å; K131-L268 HydrophobicContact CB-CD1 4.47Å; K131-L268 HydrophobicContact CG-CB 4.31Å; K131-L268 HydrophobicContact CG-CD1 4.38Å
132	D	75.5	Confident	69.2	Low	100 Å²	100	71.6 Å²	71.6	54%	0.535	40%	0.399	S	S	.	.	H	α-helix	trans	-59.3	-43.7	178.1	-68.8	-15.2	0	0	0	111.1	S128 S129 L130 L134 S136	S128-D132 WeakPolarHBondContact O-CB 3.28Å; S128-D132 PolarHBondContact O-N 3.34Å; S129-D132 PolarHBondContact O-N 3.29Å; L130-D132 PolarHBondContact O-N 3.42Å; D132-L134 PolarHBondContact O-N 3.07Å; D132-S136 WeakPolarHBondContact O-CA 3.46Å; D132-S136 WeakPolarHBondContact O-CB 3.29Å; D132-S136 PolarHBondContact O-N 3.36Å; D132-S136 PolarHBondContact O-OG 2.76Å
133	T	77.3	Confident	65.9	Low	37 Å²	37	69.7 Å²	69.7	23%	0.227	39%	0.386	C	S	.	.	H	α-helix	trans	-59.8	-46.9	176.1	-60.5	0	0	0	0	111.8	L79 E80 S129 L130 K131 S136 G137	L79-T133 WeakPolarHBondContact O-CG2 3.46Å; E80-T133 HydrophobicContact CB-CG2 4Å; E80-T133 PolarHBondContact OE2-OG1 3.25Å; S129-T133 PolarHBondContact O-N 3.01Å; S129-T133 PolarHBondContact O-OG1 3.16Å; L130-T133 PolarHBondContact O-N 3.39Å; K131-T133 VanDerWaalsContact C-N 3.34Å; K131-T133 PolarHBondContact O-N 3.24Å; T133-S136 PolarHBondContact O-OG 3.32Å; T133-G137 PolarHBondContact O-N 3.11Å
134	L	73.9	Confident	62.8	Low	0 Å²	0	72.4 Å²	72.4	0%	0	40%	0.4	C	S	.	.	H	α-helix	trans	-76.2	-35.3	-175.8	-66.4	-177.5	0	0	0	113.1	L42 L79 L130 K131 D132 I265 L268	L42-L134 HydrophobicContact CD1-CD1 4.5Å; L79-L134 HydrophobicContact CB-CD2 4.06Å; L79-L134 HydrophobicContact CD1-CD2 4.05Å; L130-L134 HydrophobicContact CD1-CD1 3.72Å; L130-L134 HydrophobicContact CD1-CG 3.92Å; L130-L134 HydrophobicContact CD2-CD1 4.49Å; L130-L134 HydrophobicContact CG-CD1 3.93Å; L130-L134 HydrophobicContact CG-CG 4.37Å; L130-L134 WeakPolarHBondContact O-CB 3.18Å; L130-L134 WeakPolarHBondContact O-CG 3.25Å; L130-L134 PolarHBondContact O-N 2.8Å; K131-L134 PolarHBondContact O-N 3.07Å; D132-L134 PolarHBondContact O-N 3.07Å; L134-I265 HydrophobicContact CB-CD1 4.11Å; L134-I265 HydrophobicContact CB-CG2 4.33Å; L134-I265 HydrophobicContact CD2-CD1 3.89Å; L134-I265 HydrophobicContact CG-CD1 4.46Å; L134-L268 HydrophobicContact CB-CD1 3.56Å; L134-L268 HydrophobicContact CD1-CD1 3.62Å; L134-L268 HydrophobicContact CD1-CD2 4.4Å; L134-L268 HydrophobicContact CG-CD1 4.19Å
135	E	66.9	Low	59.9	Low	72 Å²	72	77 Å²	77	34%	0.336	41%	0.409	S	S	.	.	H	α-helix	trans	-81.2	-31.1	177.4	-70.5	-174.7	166.4	0	0	113.3	K131 G137 L268	K131-E135 WeakPolarHBondContact CE-OE1 3.21Å; K131-E135 WeakPolarHBondContact CE-OE2 3.33Å; K131-E135 HydrophobicContact CG-CG 4.05Å; K131-E135 IonicContact NZ-OE1 3.66Å; K131-E135 IonicContact NZ-OE2 3.95Å; K131-E135 VanDerWaalsContact O-CB 3.26Å; K131-E135 WeakPolarHBondContact O-CB 3.2Å; K131-E135 WeakPolarHBondContact O-CG 3Å; K131-E135 PolarHBondContact O-N 2.91Å; E135-G137 PolarHBondContact O-N 3.24Å; E135-L268 HydrophobicContact CG-CD1 4.49Å
136	S	64.6	Low	56.8	Low	96 Å²	96	74.8 Å²	74.8	67%	0.671	40%	0.403	S	S	*	.	H	α-helix	trans	-75.5	-12.3	171.2	67.5	0	0	0	0	112.5	D132 T133 D138	D132-S136 WeakPolarHBondContact O-CA 3.46Å; D132-S136 WeakPolarHBondContact O-CB 3.29Å; D132-S136 PolarHBondContact O-N 3.36Å; D132-S136 PolarHBondContact O-OG 2.76Å; T133-S136 PolarHBondContact O-OG 3.32Å; S136-D138 PolarHBondContact O-N 2.92Å
137	G	61.3	Low	53.9	Low	13 Å²	13	78.3 Å²	78.3	13%	0.134	43%	0.427	C	S	.	.	S	Bend	trans	-57.8	119.7	157.1	0	0	0	0	0	109.1	T133 E135 L139	T133-G137 PolarHBondContact O-N 3.11Å; E135-G137 PolarHBondContact O-N 3.24Å; G137-L139 PolarHBondContact O-N 3.43Å
138	D	40.4	Very low	51.2	Low	151 Å²	151	85.2 Å²	85.2	81%	0.807	46%	0.459	S	S	*	.	S	Bend	trans	-66.1	87.5	-168.9	-174.8	16.6	0	0	0	114.1	S136	S136-D138 PolarHBondContact O-N 2.92Å
139	L	47.3	Very low	48.5	Very low	33 Å²	33	90 Å²	90	17%	0.173	48%	0.478	C	S	.	.			trans	-151.6	125.6	-171.6	-61.2	164.1	0	0	0	109.8	G137 I263 R264 I265	G137-L139 PolarHBondContact O-N 3.43Å; L139-I263 WeakPolarHBondContact CD1-O 3.31Å; L139-I263 WeakPolarHBondContact CD2-O 3.45Å; L139-R264 VanDerWaalsContact CB-CA 3.49Å; L139-R264 HydrophobicContact CB-CB 3.63Å; L139-R264 HydrophobicContact CB-CG 4.32Å; L139-R264 HydrophobicContact CD1-CB 4.49Å; L139-R264 VanDerWaalsContact CD2-CA 3.43Å; L139-R264 HydrophobicContact CD2-CB 3.56Å; L139-R264 HydrophobicContact CD2-CG 3.33Å; L139-R264 VanDerWaalsContact CG-CA 3.5Å; L139-R264 HydrophobicContact CG-CB 3.93Å; L139-R264 HydrophobicContact CG-CG 4.27Å; L139-I265 WeakPolarHBondContact CB-O 3.36Å; L139-I265 HydrophobicContact CD1-CB 4.14Å; L139-I265 HydrophobicContact CD1-CG1 4.12Å
140	S	35.3	Very low	45.7	Very low	59 Å²	59	93.4 Å²	93.4	41%	0.413	49%	0.493	S	S	.	.			trans	-103.2	125.7	-149.6	58.4	0	0	0	0	118.9
141	K	34	Very low	43.1	Very low	161 Å²	161	102.7 Å²	102.7	70%	0.7	53%	0.527	S	S	*	.			trans	59.4	121.7	139.8	-76.9	-172.4	174.4	-173.9	0	127
142	D	32.4	Very low	41	Very low	125 Å²	125	103.5 Å²	103.5	67%	0.668	53%	0.531	S	S	*	.			trans	84.2	89.2	132.1	-60.1	-20.5	0	0	0	124.9
143	S	24.6	Very low	38.8	Very low	73 Å²	73	103.7 Å²	103.7	51%	0.51	53%	0.532	S	S	.	.				83.8	126.4	105.5	-176.2	0	0	0	0	126.1	E267	S143-E267 WeakPolarHBondContact CA-OE1 3.39Å; S143-E267 PolarHBondContact N-OE1 3.41Å
144	T	26	Very low	36.7	Very low	104 Å²	104	102.5 Å²	102.5	64%	0.638	53%	0.527	S	S	*	.			trans	74.6	141.4	153.3	54.2	0	0	0	0	120.1
145	W	23.9	Very low	34.7	Very low	212 Å²	212	108.1 Å²	108.1	80%	0.803	55%	0.55	S	S	*	.			cis	-168.1	172.9	14.6	47.9	-75.9	0	0	0	111.7
146	I	22.7	Very low	33.4	Very low	110 Å²	110	107.3 Å²	107.3	56%	0.564	55%	0.545	S	S	*	.			trans	-107.4	153.5	-163.2	-65.3	161.4	0	0	0	114.1
147	T	24.8	Very low	32	Very low	88 Å²	88	106.7 Å²	106.7	54%	0.54	55%	0.553	S	S	.	*			trans	-174.8	133.3	141.9	37.9	0	0	0	0	115.3	R96	R96-T147 PolarHBondContact NH1-O 3.44Å; R96-T147 PolarHBondContact NH2-O 3.32Å; R96-T147 VanDerWaalsContact NH2-O 3.1Å
148	E	23.2	Very low	31.3	Very low	164 Å²	164	107.3 Å²	107.3	77%	0.766	56%	0.557	S	S	*	*			trans	98.4	139.1	157.1	-67.2	175.9	179.7	0	0	123.1	R96	R96-E148 PolarHBondContact NH2-O 2.94Å
149	L	24.5	Very low	31.6	Very low	176 Å²	176	108 Å²	108	92%	0.921	55%	0.553	S	S	*	*			trans	-104.8	133.9	-178	-78.4	160	0	0	0	110.4
150	N	24.6	Very low	31.8	Very low	119 Å²	119	107.1 Å²	107.1	64%	0.636	55%	0.549	S	S	*	.			trans	-112.5	140.2	177.7	-73.8	-29.6	0	0	0	112.4	F152	N150-F152 HydrophobicContact CB-CE1 4.48Å; N150-F152 HydrophobicContact CB-CE2 4.14Å; N150-F152 HydrophobicContact CB-CZ 3.97Å
151	R	24.3	Very low	32.9	Very low	194 Å²	194	108.4 Å²	108.4	73%	0.732	56%	0.555	S	S	*	*			trans	-84	137.8	162.3	-173.9	-177.4	-171.9	-178.7	1.9	108.2
152	F	34.4	Very low	34.6	Very low	86 Å²	86	105.2 Å²	105.2	38%	0.377	55%	0.545	S	S	.	.			trans	-115.7	124	179.8	-64.2	-83.6	0	0	0	110.3	N150 Y214	N150-F152 HydrophobicContact CB-CE1 4.48Å; N150-F152 HydrophobicContact CB-CE2 4.14Å; N150-F152 HydrophobicContact CB-CZ 3.97Å; F152-Y214 AromaticContact CD1-CD2 3.95Å; F152-Y214 HydrophobicContact CD1-CD2 3.95Å; F152-Y214 HydrophobicContact CD1-CE2 4Å; F152-Y214 HydrophobicContact CD2-CD2 4.19Å; F152-Y214 AromaticContact CE1-CD2 3.4Å; F152-Y214 HydrophobicContact CE1-CD2 3.4Å; F152-Y214 AromaticContact CE1-CE2 3.54Å; F152-Y214 HydrophobicContact CE1-CE2 3.54Å; F152-Y214 HydrophobicContact CE1-CG 4.45Å; F152-Y214 AromaticContact CE2-CD2 3.68Å; F152-Y214 HydrophobicContact CE2-CD2 3.68Å; F152-Y214 HydrophobicContact CE2-CG 4.32Å; F152-Y214 HydrophobicContact CG-CD2 4.32Å; F152-Y214 AromaticContact CZ-CD2 3.25Å; F152-Y214 HydrophobicContact CZ-CD2 3.25Å; F152-Y214 AromaticContact CZ-CE2 3.9Å; F152-Y214 HydrophobicContact CZ-CE2 3.9Å; F152-Y214 AromaticContact CZ-CG 3.96Å; F152-Y214 HydrophobicContact CZ-CG 3.96Å
153	D	28.9	Very low	36.6	Very low	105 Å²	105	104.8 Å²	104.8	56%	0.561	54%	0.543	S	S	*	.			trans	-110.1	122.4	171.3	-63.7	-37.1	0	0	0	108.1
154	G	33.5	Very low	39.4	Very low	12 Å²	12	102.9 Å²	102.9	12%	0.124	53%	0.526	C	S	.	.			trans	-105.3	155.3	172.8	0	0	0	0	0	111.4	F284	G154-F284 VanDerWaalsContact O-CD1 3.28Å; G154-F284 WeakPolarHBondContact O-CD1 3.39Å
155	Y	30.9	Very low	42.3	Very low	118 Å²	118	98.6 Å²	98.6	46%	0.463	50%	0.5	S	S	.	.			trans	-112.1	121.9	174.2	-100.3	-82.2	0	0	0	110.2	S285 D287	Y155-S285 WeakPolarHBondContact CE1-O 3.47Å; Y155-S285 VanDerWaalsContact OH-CB 3.3Å; Y155-S285 WeakPolarHBondContact OH-CB 3.4Å; Y155-S285 PolarHBondContact OH-OG 3.47Å; Y155-S285 VanDerWaalsContact OH-OG 3.06Å; Y155-D287 HydrophobicContact CE1-CB 3.8Å; Y155-D287 WeakPolarHBondContact CE1-O 3.43Å; Y155-D287 WeakPolarHBondContact OH-CB 3.41Å; Y155-D287 PolarHBondContact OH-N 3.21Å; Y155-D287 VanDerWaalsContact OH-N 3.12Å; Y155-D287 PolarHBondContact OH-OD2 3.31Å
156	F	39.3	Very low	45.6	Very low	55 Å²	55	92.9 Å²	92.9	24%	0.241	49%	0.492	C	S	.	.			trans	-125	123.9	165.4	-67.8	-66.2	0	0	0	108.7	A158 H221 I224 V225 F284	F156-A158 PolarHBondContact O-N 3.1Å; F156-H221 AromaticContact CE1-NE2 3.65Å; F156-H221 AromaticContact CE2-CD2 3.6Å; F156-H221 AromaticContact CE2-NE2 3.8Å; F156-H221 AromaticContact CZ-CD2 3.21Å; F156-H221 WeakPolarHBondContact CZ-CD2 3.28Å; F156-H221 AromaticContact CZ-CE1 3.64Å; F156-H221 AromaticContact CZ-CG 3.86Å; F156-H221 AromaticContact CZ-NE2 3.07Å; F156-H221 WeakPolarHBondContact CZ-NE2 3.07Å; F156-I224 HydrophobicContact CE2-CG2 4.18Å; F156-I224 HydrophobicContact CZ-CG2 4.3Å; F156-V225 HydrophobicContact CE1-CG2 3.47Å; F156-V225 VanDerWaalsContact CE1-CG2 3.47Å; F156-V225 HydrophobicContact CZ-CG2 3.77Å; F156-F284 AromaticContact CD2-CD1 3.8Å; F156-F284 HydrophobicContact CD2-CD1 3.8Å; F156-F284 AromaticContact CD2-CE1 3.45Å; F156-F284 HydrophobicContact CD2-CE1 3.45Å; F156-F284 VanDerWaalsContact CD2-CE1 3.45Å; F156-F284 HydrophobicContact CD2-CZ 4.21Å; F156-F284 HydrophobicContact CE2-CD1 4.39Å; F156-F284 AromaticContact CE2-CE1 3.62Å; F156-F284 HydrophobicContact CE2-CE1 3.62Å; F156-F284 HydrophobicContact CE2-CZ 4.26Å
157	G	35.4	Very low	48.8	Very low	82 Å²	82	91.8 Å²	91.8	85%	0.845	49%	0.485	S	S	*	.			trans	-93	83.5	165.4	0	0	0	0	0	108.7
158	A	46.5	Very low	51.9	Low	26 Å²	26	87.6 Å²	87.6	22%	0.215	46%	0.459	C	S	.	.			trans	-144.6	117.3	173.7	0	0	0	0	0	112.7	F156 V160 M228	F156-A158 PolarHBondContact O-N 3.1Å; A158-V160 PolarHBondContact O-N 3.14Å; A158-M228 HydrophobicContact CB-CE 3.31Å
159	F	47	Very low	55.3	Low	166 Å²	166	83.5 Å²	83.5	73%	0.728	44%	0.438	S	S	*	.			trans	-64.8	95.2	171.7	-57.2	-77.8	0	0	0	109.9
160	V	51.7	Low	58.7	Low	15 Å²	15	80.2 Å²	80.2	9%	0.091	42%	0.422	C	S	.	.			trans	-78	124.6	163.2	-176	0	0	0	0	106.6	A158 D162 K164 F188 V190 M228	A158-V160 PolarHBondContact O-N 3.14Å; V160-D162 WeakPolarHBondContact CG1-O 3.34Å; V160-K164 HydrophobicContact CG1-CG 3.99Å; V160-F188 HydrophobicContact CB-CD1 4.1Å; V160-F188 HydrophobicContact CG1-CB 4.41Å; V160-F188 HydrophobicContact CG1-CD1 3.58Å; V160-F188 HydrophobicContact CG1-CE1 4.12Å; V160-F188 HydrophobicContact CG1-CG 4.22Å; V160-F188 HydrophobicContact CG2-CD1 3.95Å; V160-F188 HydrophobicContact CG2-CE1 4.06Å; V160-V190 HydrophobicContact CB-CG2 4.41Å; V160-V190 HydrophobicContact CG1-CG2 4.28Å; V160-V190 WeakPolarHBondContact O-CB 3.24Å; V160-V190 WeakPolarHBondContact O-CG1 3.12Å; V160-V190 WeakPolarHBondContact O-CG2 3.36Å; V160-M228 HydrophobicContact CG2-CE 4.26Å; V160-M228 HydrophobicContact CG2-SD 4.33Å
161	T	59.3	Low	61.9	Low	86 Å²	86	75 Å²	75	53%	0.528	39%	0.394	S	S	.	.			trans	-101.7	-16.5	-178.3	48.1	0	0	0	0	113.3
162	D	67.8	Low	65.2	Low	93 Å²	93	65.7 Å²	65.7	50%	0.497	36%	0.359	S	S	.	.	S	Bend	trans	-140.8	161.4	-168.1	-54.7	-63.7	0	0	0	110.5	V160 K164	V160-D162 WeakPolarHBondContact CG1-O 3.34Å; D162-K164 WeakPolarHBondContact O-CG 3.3Å; D162-K164 PolarHBondContact O-N 3.41Å
163	D	75	Confident	68.1	Low	116 Å²	116	62.7 Å²	62.7	62%	0.62	35%	0.349	S	S	*	.			trans	-60.8	125.2	167.4	-179.8	3.6	0	0	0	110	C165	D163-C165 WeakPolarHBondContact OD1-CB 3.18Å; D163-C165 PolarHBondContact OD1-N 3.31Å; D163-C165 PolarHBondContact OD1-SG 3.48Å
164	K	82.7	Confident	71.2	Confident	34 Å²	34	64.1 Å²	64.1	15%	0.148	35%	0.352	C	S	.	.			trans	-120	11.8	-176	-70.1	-69	174.4	-177.9	0	113.4	V160 D162 S166 E167 L168 F188 L227	V160-K164 HydrophobicContact CG1-CG 3.99Å; D162-K164 WeakPolarHBondContact O-CG 3.3Å; D162-K164 PolarHBondContact O-N 3.41Å; K164-S166 VanDerWaalsContact C-N 3.34Å; K164-S166 PolarHBondContact O-N 3.29Å; K164-E167 VanDerWaalsContact CD-CD 3.47Å; K164-E167 HydrophobicContact CD-CG 4.48Å; K164-E167 WeakPolarHBondContact CD-OE1 3.34Å; K164-E167 VanDerWaalsContact CD-OE2 3.29Å; K164-E167 WeakPolarHBondContact CD-OE2 3.31Å; K164-E167 IonicContact NZ-OE1 2.64Å; K164-E167 PolarHBondContact NZ-OE1 2.93Å; K164-E167 IonicContact NZ-OE2 2.9Å; K164-E167 PolarHBondContact NZ-OE2 3.04Å; K164-E167 PolarHBondContact O-N 2.85Å; K164-E167 VanDerWaalsContact O-N 3.14Å; K164-L168 WeakPolarHBondContact O-CB 3.02Å; K164-L168 PolarHBondContact O-N 3.29Å; K164-F188 HydrophobicContact CB-CD1 4.49Å; K164-F188 HydrophobicContact CB-CD2 4.09Å; K164-F188 HydrophobicContact CB-CE1 4.01Å; K164-F188 HydrophobicContact CB-CE2 3.62Å; K164-F188 HydrophobicContact CB-CZ 3.56Å; K164-L227 HydrophobicContact CB-CD2 4.23Å
165	C	88.8	Confident	74.1	Confident	13 Å²	13	66.5 Å²	66.5	9%	0.088	36%	0.359	C	S	.	.	H	α-helix	trans	-60.8	-39.6	-175.2	-71.6	0	0	0	0	113.6	D163 E167 L168 K169 M183 C186 S187	D163-C165 WeakPolarHBondContact OD1-CB 3.18Å; D163-C165 PolarHBondContact OD1-N 3.31Å; D163-C165 PolarHBondContact OD1-SG 3.48Å; C165-E167 PolarHBondContact O-N 3.1Å; C165-L168 PolarHBondContact O-N 2.83Å; C165-K169 VanDerWaalsContact O-CB 3.28Å; C165-K169 WeakPolarHBondContact O-CB 3.34Å; C165-K169 PolarHBondContact O-N 3.02Å; C165-M183 HydrophobicContact CB-CE 4.48Å; C165-M183 WeakPolarHBondContact O-CE 3.05Å; C165-C186 VanDerWaalsContact CA-SG 3.52Å; C165-C186 HydrophobicContact CB-CB 3.6Å; C165-C186 WeakPolarHBondContact CB-SG 3.16Å; C165-C186 VanDerWaalsContact SG-CA 3.59Å; C165-C186 WeakPolarHBondContact SG-CB 3.19Å; C165-C186 PolarHBondContact SG-O 3.25Å; C165-C186 CovalentContact SG-SG 2.04Å; C165-C186 PolarHBondContact SG-SG 3.47Å; C165-S187 PolarHBondContact SG-N 2.98Å
166	S	91.6	Very high	77	Confident	93 Å²	93	61.2 Å²	61.2	65%	0.65	34%	0.338	S	S	*	.	H	α-helix	trans	-65.7	-37.4	176.3	-61.5	0	0	0	0	113.1	K164 N170	K164-S166 VanDerWaalsContact C-N 3.34Å; K164-S166 PolarHBondContact O-N 3.29Å; S166-N170 PolarHBondContact O-N 3.24Å; S166-N170 PolarHBondContact O-ND2 3.47Å
167	E	91.6	Very high	79.6	Confident	87 Å²	87	63.1 Å²	63.1	41%	0.407	36%	0.356	S	S	.	.	H	α-helix	trans	-71.9	-43.5	176.7	-68.4	169.7	-137.7	0	0	110.8	K164 C165 K169 N170 V171 L227	K164-E167 VanDerWaalsContact CD-CD 3.47Å; K164-E167 HydrophobicContact CD-CG 4.48Å; K164-E167 WeakPolarHBondContact CD-OE1 3.34Å; K164-E167 VanDerWaalsContact CD-OE2 3.29Å; K164-E167 WeakPolarHBondContact CD-OE2 3.31Å; K164-E167 IonicContact NZ-OE1 2.64Å; K164-E167 PolarHBondContact NZ-OE1 2.93Å; K164-E167 IonicContact NZ-OE2 2.9Å; K164-E167 PolarHBondContact NZ-OE2 3.04Å; K164-E167 PolarHBondContact O-N 2.85Å; K164-E167 VanDerWaalsContact O-N 3.14Å; C165-E167 PolarHBondContact O-N 3.1Å; E167-K169 VanDerWaalsContact C-N 3.33Å; E167-K169 PolarHBondContact O-N 2.92Å; E167-N170 PolarHBondContact O-N 2.96Å; E167-V171 WeakPolarHBondContact O-CG2 3.42Å; E167-V171 PolarHBondContact O-N 3.36Å; E167-L227 HydrophobicContact CB-CD1 3.59Å
168	L	89.8	Confident	82.4	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-60.2	-43.8	175.9	-178.5	57.2	0	0	0	111.4	K164 C165 N170 V171 M172 M183 F188 I195 M197 I224 L227	K164-L168 WeakPolarHBondContact O-CB 3.02Å; K164-L168 PolarHBondContact O-N 3.29Å; C165-L168 PolarHBondContact O-N 2.83Å; L168-N170 VanDerWaalsContact C-N 3.34Å; L168-N170 PolarHBondContact O-N 2.98Å; L168-V171 PolarHBondContact O-N 3.14Å; L168-M172 HydrophobicContact CD1-CG 4.06Å; L168-M172 HydrophobicContact CD1-SD 4.02Å; L168-M172 HydrophobicContact CD2-SD 4.35Å; L168-M172 HydrophobicContact CG-CG 4.31Å; L168-M172 HydrophobicContact CG-SD 3.76Å; L168-M172 WeakPolarHBondContact O-CB 3.35Å; L168-M172 VanDerWaalsContact O-CG 3.31Å; L168-M172 WeakPolarHBondContact O-CG 3.48Å; L168-M172 PolarHBondContact O-N 3.41Å; L168-M183 HydrophobicContact CD2-SD 4.38Å; L168-F188 HydrophobicContact CD2-CE2 4.29Å; L168-F188 HydrophobicContact CD2-CZ 4.1Å; L168-I195 HydrophobicContact CD2-CG2 4.27Å; L168-M197 HydrophobicContact CD2-CE 3.64Å; L168-I224 HydrophobicContact CD1-CG1 3.85Å; L168-I224 HydrophobicContact CD2-CG1 4.23Å; L168-L227 HydrophobicContact CB-CD2 3.92Å; L168-L227 HydrophobicContact CD1-CD2 4.24Å
169	K	94	Very high	84.6	Confident	77 Å²	77	59 Å²	59	34%	0.335	32%	0.316	S	S	.	.	H	α-helix	trans	-51.7	-52.8	173.3	175.3	159	-176.3	163.5	0	111.4	C165 E167 V171 M172 S173 G180 M183	C165-K169 VanDerWaalsContact O-CB 3.28Å; C165-K169 WeakPolarHBondContact O-CB 3.34Å; C165-K169 PolarHBondContact O-N 3.02Å; E167-K169 VanDerWaalsContact C-N 3.33Å; E167-K169 PolarHBondContact O-N 2.92Å; K169-V171 PolarHBondContact O-N 2.79Å; K169-M172 PolarHBondContact O-N 3.19Å; K169-S173 PolarHBondContact O-N 2.69Å; K169-S173 PolarHBondContact O-OG 3.31Å; K169-G180 WeakPolarHBondContact CD-O 3.4Å; K169-G180 VanDerWaalsContact CE-O 3.31Å; K169-G180 WeakPolarHBondContact CE-O 3.45Å; K169-G180 WeakPolarHBondContact CG-O 3.37Å; K169-M183 HydrophobicContact CB-CE 3.74Å
170	N	94.7	Very high	86.8	Confident	108 Å²	108	51.1 Å²	51.1	58%	0.578	28%	0.282	S	S	*	.	H	α-helix	trans	-62.4	-42.2	-179.2	-67.7	-24	0	0	0	112	S166 E167 L168 S173 E174	S166-N170 PolarHBondContact O-N 3.24Å; S166-N170 PolarHBondContact O-ND2 3.47Å; E167-N170 PolarHBondContact O-N 2.96Å; L168-N170 VanDerWaalsContact C-N 3.34Å; L168-N170 PolarHBondContact O-N 2.98Å; N170-S173 PolarHBondContact O-N 3.5Å; N170-E174 VanDerWaalsContact O-CB 3.31Å; N170-E174 WeakPolarHBondContact O-CB 3.27Å; N170-E174 PolarHBondContact O-N 2.91Å
171	V	93.4	Very high	88.9	Confident	8 Å²	8	55.7 Å²	55.7	5%	0.048	30%	0.302	C	S	.	.	H	α-helix	trans	-65.7	-39.6	177.6	174.3	0	0	0	0	111.6	E167 L168 K169 E174 K175 S223 E226 L227	E167-V171 WeakPolarHBondContact O-CG2 3.42Å; E167-V171 PolarHBondContact O-N 3.36Å; L168-V171 PolarHBondContact O-N 3.14Å; K169-V171 PolarHBondContact O-N 2.79Å; V171-E174 PolarHBondContact O-N 3.22Å; V171-K175 HydrophobicContact CG1-CD 4.4Å; V171-K175 WeakPolarHBondContact O-CG 3.42Å; V171-K175 PolarHBondContact O-N 3.4Å; V171-K175 VanDerWaalsContact O-N 3.1Å; V171-S223 WeakPolarHBondContact CG1-O 2.99Å; V171-E226 HydrophobicContact CG1-CB 3.8Å; V171-E226 HydrophobicContact CG1-CG 3.83Å; V171-L227 HydrophobicContact CG2-CB 4.34Å; V171-L227 HydrophobicContact CG2-CD1 4.25Å
172	M	93	Very high	90.2	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-62.6	-48.9	175.1	-73.9	172.7	64.8	0	0	111.2	L168 K169 E174 K175 Y176 L179 M183 M197 I199 I220 S223	L168-M172 HydrophobicContact CD1-CG 4.06Å; L168-M172 HydrophobicContact CD1-SD 4.02Å; L168-M172 HydrophobicContact CD2-SD 4.35Å; L168-M172 HydrophobicContact CG-CG 4.31Å; L168-M172 HydrophobicContact CG-SD 3.76Å; L168-M172 WeakPolarHBondContact O-CB 3.35Å; L168-M172 VanDerWaalsContact O-CG 3.31Å; L168-M172 WeakPolarHBondContact O-CG 3.48Å; L168-M172 PolarHBondContact O-N 3.41Å; K169-M172 PolarHBondContact O-N 3.19Å; M172-E174 VanDerWaalsContact C-N 3.33Å; M172-E174 PolarHBondContact O-N 3.31Å; M172-K175 PolarHBondContact O-N 3.3Å; M172-Y176 CarbonylContact O-C 3.44Å; M172-Y176 WeakPolarHBondContact O-CA 3.3Å; M172-Y176 PolarHBondContact O-N 2.97Å; M172-Y176 VanDerWaalsContact O-O 3.06Å; M172-L179 HydrophobicContact CE-CD1 4.47Å; M172-L179 HydrophobicContact CE-CD2 4.02Å; M172-L179 HydrophobicContact CE-CG 3.7Å; M172-M183 HydrophobicContact SD-SD 4Å; M172-M197 HydrophobicContact CE-SD 4.36Å; M172-I199 HydrophobicContact CE-CD1 4.39Å; M172-I220 HydrophobicContact CE-CG1 4.15Å; M172-S223 VanDerWaalsContact CG-CB 3.42Å; M172-S223 WeakPolarHBondContact CG-OG 3.41Å
173	S	95.8	Very high	91.1	Very high	22 Å²	22	48.6 Å²	48.6	15%	0.154	26%	0.261	C	S	.	.	H	α-helix	trans	-64.5	-34.3	178.1	-59.7	0	0	0	0	113.4	K169 N170 G180 E181	K169-S173 PolarHBondContact O-N 2.69Å; K169-S173 PolarHBondContact O-OG 3.31Å; N170-S173 PolarHBondContact O-N 3.5Å; S173-G180 VanDerWaalsContact OG-CA 3.25Å; S173-G180 WeakPolarHBondContact OG-CA 3.05Å; S173-G180 PolarHBondContact OG-N 3.17Å; S173-E181 WeakPolarHBondContact CB-OE2 3.46Å; S173-E181 PolarHBondContact OG-OE1 3.04Å; S173-E181 PolarHBondContact OG-OE2 3.01Å
174	E	94.6	Very high	91.4	Very high	135 Å²	135	46.6 Å²	46.6	63%	0.631	25%	0.248	S	C	*	.	H	α-helix	trans	-67.7	-44.4	176.8	-175.6	-175.1	179.3	0	0	111.8	N170 V171 M172 K230	N170-E174 VanDerWaalsContact O-CB 3.31Å; N170-E174 WeakPolarHBondContact O-CB 3.27Å; N170-E174 PolarHBondContact O-N 2.91Å; V171-E174 PolarHBondContact O-N 3.22Å; M172-E174 VanDerWaalsContact C-N 3.33Å; M172-E174 PolarHBondContact O-N 3.31Å; E174-K230 IonicContact OE1-NZ 3.75Å; E174-K230 IonicContact OE2-NZ 2.78Å; E174-K230 PolarHBondContact OE2-NZ 2.94Å
175	K	92.4	Very high	91.4	Very high	63 Å²	63	50.7 Å²	50.7	27%	0.274	27%	0.271	S	S	.	.	H	α-helix	trans	-79.2	-38.9	-179.1	-65.7	-168.7	79.6	156.3	0	112.8	V171 M172 S222 E226	V171-K175 HydrophobicContact CG1-CD 4.4Å; V171-K175 WeakPolarHBondContact O-CG 3.42Å; V171-K175 PolarHBondContact O-N 3.4Å; V171-K175 VanDerWaalsContact O-N 3.1Å; M172-K175 PolarHBondContact O-N 3.3Å; K175-S222 PolarHBondContact NZ-OG 3.44Å; K175-E226 HydrophobicContact CD-CB 4.11Å; K175-E226 HydrophobicContact CD-CG 4.16Å; K175-E226 IonicContact NZ-OE2 3.47Å
176	Y	93.5	Very high	91.2	Very high	7 Å²	7	51.2 Å²	51.2	3%	0.027	28%	0.275	C	S	.	.	S	Bend	trans	-133.1	94.5	-172.9	-56	-61.2	0	0	0	108.3	L62 M172 G178 L179 Y209 R219 S222	L62-Y176 HydrophobicContact CD1-CE1 4.34Å; L62-Y176 VanDerWaalsContact CD1-OH 3.23Å; L62-Y176 WeakPolarHBondContact CD1-OH 3.4Å; M172-Y176 CarbonylContact O-C 3.44Å; M172-Y176 WeakPolarHBondContact O-CA 3.3Å; M172-Y176 PolarHBondContact O-N 2.97Å; M172-Y176 VanDerWaalsContact O-O 3.06Å; Y176-G178 PolarHBondContact O-N 2.62Å; Y176-L179 HydrophobicContact CD2-CD2 3.8Å; Y176-L179 HydrophobicContact CG-CD2 4.07Å; Y176-L179 VanDerWaalsContact O-CB 3.23Å; Y176-L179 WeakPolarHBondContact O-CB 3.43Å; Y176-L179 PolarHBondContact O-N 3.06Å; Y176-Y209 VanDerWaalsContact CA-OH 3.31Å; Y176-Y209 WeakPolarHBondContact CA-OH 3.48Å; Y176-R219 HydrophobicContact CD1-CG 4.09Å; Y176-R219 HydrophobicContact CD2-CB 3.74Å; Y176-R219 HydrophobicContact CD2-CG 4.01Å; Y176-R219 HydrophobicContact CE1-CG 3.91Å; Y176-R219 HydrophobicContact CE2-CB 3.59Å; Y176-R219 HydrophobicContact CE2-CG 3.81Å; Y176-R219 WeakPolarHBondContact CE2-O 3.45Å; Y176-R219 HydrophobicContact CG-CB 4.31Å; Y176-R219 HydrophobicContact CG-CG 4.14Å; Y176-S222 PolarHBondContact OH-OG 3.44Å
177	P	94	Very high	90.6	Very high	95 Å²	95	49.5 Å²	49.5	62%	0.617	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.1	126	-174.5	-31.9	36	0	0	0	113.3	L179 Y209	P177-L179 VanDerWaalsContact C-N 3.29Å; P177-L179 PolarHBondContact O-N 2.85Å; P177-Y209 WeakPolarHBondContact CD-OH 3.45Å; P177-Y209 WeakPolarHBondContact O-CE2 3.19Å
178	G	93.9	Very high	89.9	Confident	21 Å²	21	46.6 Å²	46.6	22%	0.216	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.4	-13.8	179.7	0	0	0	0	0	115.4	Y176 E181	Y176-G178 PolarHBondContact O-N 2.62Å; G178-E181 WeakPolarHBondContact CA-OE2 3.5Å; G178-E181 PolarHBondContact N-OE2 2.79Å; G178-E181 PolarHBondContact O-N 3.01Å
179	L	92.7	Very high	89	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.005	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-36.4	-173.8	-173.9	62.9	0	0	0	113.1	M172 Y176 P177 E181 V182 L204 I207 Y209 R219	M172-L179 HydrophobicContact CE-CD1 4.47Å; M172-L179 HydrophobicContact CE-CD2 4.02Å; M172-L179 HydrophobicContact CE-CG 3.7Å; Y176-L179 HydrophobicContact CD2-CD2 3.8Å; Y176-L179 HydrophobicContact CG-CD2 4.07Å; Y176-L179 VanDerWaalsContact O-CB 3.23Å; Y176-L179 WeakPolarHBondContact O-CB 3.43Å; Y176-L179 PolarHBondContact O-N 3.06Å; P177-L179 VanDerWaalsContact C-N 3.29Å; P177-L179 PolarHBondContact O-N 2.85Å; L179-E181 VanDerWaalsContact C-N 3.29Å; L179-V182 HydrophobicContact CD1-CG2 4.21Å; L179-V182 WeakPolarHBondContact O-CG2 3.28Å; L179-L204 HydrophobicContact CD1-CD2 3.63Å; L179-I207 HydrophobicContact CB-CD1 4.38Å; L179-I207 HydrophobicContact CD1-CD1 4.17Å; L179-Y209 HydrophobicContact CB-CD2 4.24Å; L179-Y209 HydrophobicContact CB-CE2 4.12Å; L179-Y209 HydrophobicContact CD1-CD2 4.2Å; L179-R219 HydrophobicContact CD2-CB 3.78Å
180	G	93.2	Very high	87.7	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-27.7	176.8	0	0	0	0	0	112.6	K169 S173 V182 M183	K169-G180 WeakPolarHBondContact CD-O 3.4Å; K169-G180 VanDerWaalsContact CE-O 3.31Å; K169-G180 WeakPolarHBondContact CE-O 3.45Å; K169-G180 WeakPolarHBondContact CG-O 3.37Å; S173-G180 VanDerWaalsContact OG-CA 3.25Å; S173-G180 WeakPolarHBondContact OG-CA 3.05Å; S173-G180 PolarHBondContact OG-N 3.17Å; G180-V182 VanDerWaalsContact C-N 3.32Å; G180-V182 PolarHBondContact O-N 2.79Å; G180-M183 WeakPolarHBondContact O-CB 3.35Å; G180-M183 PolarHBondContact O-N 2.83Å
181	E	94.8	Very high	86.3	Confident	110 Å²	110	48.4 Å²	48.4	51%	0.514	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-32.5	179.6	-70.2	78.5	-179.6	0	0	112.5	S173 G178 L179 M183	S173-E181 WeakPolarHBondContact CB-OE2 3.46Å; S173-E181 PolarHBondContact OG-OE1 3.04Å; S173-E181 PolarHBondContact OG-OE2 3.01Å; G178-E181 WeakPolarHBondContact CA-OE2 3.5Å; G178-E181 PolarHBondContact N-OE2 2.79Å; G178-E181 PolarHBondContact O-N 3.01Å; L179-E181 VanDerWaalsContact C-N 3.29Å; E181-M183 VanDerWaalsContact C-N 3.35Å
182	V	87.6	Confident	85.1	Confident	11 Å²	11	54.1 Å²	54.1	7%	0.067	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-3.5	-178.9	-54.9	0	0	0	0	113.9	L179 G180 E184 I199 E203 I207	L179-V182 HydrophobicContact CD1-CG2 4.21Å; L179-V182 WeakPolarHBondContact O-CG2 3.28Å; G180-V182 VanDerWaalsContact C-N 3.32Å; G180-V182 PolarHBondContact O-N 2.79Å; V182-E184 PolarHBondContact O-N 3.28Å; V182-I199 HydrophobicContact CB-CG2 4.29Å; V182-I199 HydrophobicContact CG2-CG2 3.67Å; V182-E203 HydrophobicContact CB-CB 3.84Å; V182-E203 HydrophobicContact CG1-CB 3.6Å; V182-I207 HydrophobicContact CG1-CD1 4Å; V182-I207 HydrophobicContact CG1-CG2 4.26Å; V182-I207 HydrophobicContact CG2-CD1 3.88Å
183	M	85.7	Confident	83.7	Confident	20 Å²	20	57.4 Å²	57.4	10%	0.099	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	120.3	175.7	-173.7	-172	68.5	0	0	110.5	C165 L168 K169 M172 G180 E181 C186 M197	C165-M183 HydrophobicContact CB-CE 4.48Å; C165-M183 WeakPolarHBondContact O-CE 3.05Å; L168-M183 HydrophobicContact CD2-SD 4.38Å; K169-M183 HydrophobicContact CB-CE 3.74Å; M172-M183 HydrophobicContact SD-SD 4Å; G180-M183 WeakPolarHBondContact O-CB 3.35Å; G180-M183 PolarHBondContact O-N 2.83Å; E181-M183 VanDerWaalsContact C-N 3.35Å; M183-C186 HydrophobicContact CE-CB 3.71Å; M183-C186 HydrophobicContact CG-CB 4.14Å; M183-C186 HydrophobicContact SD-CB 3.76Å; M183-M197 HydrophobicContact CG-CB 3.86Å; M183-M197 HydrophobicContact CG-CG 4.41Å; M183-M197 HydrophobicContact CG-SD 4.05Å; M183-M197 HydrophobicContact SD-CB 4.33Å; M183-M197 HydrophobicContact SD-CE 4.13Å; M183-M197 HydrophobicContact SD-SD 4.02Å
184	E	82.5	Confident	82.4	Confident	74 Å²	74	56.9 Å²	56.9	35%	0.346	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	160	177.1	-64.9	-179	-179.5	0	0	110.4	V182 C186 D198 K200	V182-E184 PolarHBondContact O-N 3.28Å; E184-C186 PolarHBondContact O-N 3.09Å; E184-D198 HydrophobicContact CB-CB 4.25Å; E184-D198 PolarHBondContact N-O 3.49Å; E184-D198 PolarHBondContact O-N 3.02Å; E184-K200 VanDerWaalsContact CD-NZ 3.32Å; E184-K200 IonicContact OE1-NZ 2.76Å; E184-K200 PolarHBondContact OE1-NZ 3.32Å; E184-K200 WeakPolarHBondContact OE2-CE 3.49Å; E184-K200 IonicContact OE2-NZ 2.82Å; E184-K200 PolarHBondContact OE2-NZ 2.63Å
185	N	82.5	Confident	81.4	Confident	119 Å²	119	51 Å²	51	64%	0.636	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	46.6	34.6	172.9	-56.4	-34.5	0	0	0	115.4	S187 D198	N185-S187 PolarHBondContact O-N 3.34Å; N185-D198 HydrophobicContact CB-CB 4.41Å; N185-D198 WeakPolarHBondContact CB-OD2 3.29Å; N185-D198 PolarHBondContact ND2-OD2 3.03Å
186	C	83.6	Confident	80.5	Confident	25 Å²	25	50.1 Å²	50.1	17%	0.169	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	134.2	178.5	173	0	0	0	0	110.2	C165 M183 E184 T196 M197	C165-C186 VanDerWaalsContact CA-SG 3.52Å; C165-C186 HydrophobicContact CB-CB 3.6Å; C165-C186 WeakPolarHBondContact CB-SG 3.16Å; C165-C186 VanDerWaalsContact SG-CA 3.59Å; C165-C186 WeakPolarHBondContact SG-CB 3.19Å; C165-C186 PolarHBondContact SG-O 3.25Å; C165-C186 CovalentContact SG-SG 2.04Å; C165-C186 PolarHBondContact SG-SG 3.47Å; M183-C186 HydrophobicContact CE-CB 3.71Å; M183-C186 HydrophobicContact CG-CB 4.14Å; M183-C186 HydrophobicContact SD-CB 3.76Å; E184-C186 PolarHBondContact O-N 3.09Å; C186-T196 CarbonylContact C-O 3.53Å; C186-T196 WeakPolarHBondContact CA-O 3.4Å; C186-M197 HydrophobicContact CB-CB 4.21Å
187	S	79.8	Confident	80	Confident	56 Å²	56	50.4 Å²	50.4	39%	0.392	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	142.9	169.8	67.9	0	0	0	0	112.1	C165 N185 I195 T196	C165-S187 PolarHBondContact SG-N 2.98Å; N185-S187 PolarHBondContact O-N 3.34Å; S187-I195 WeakPolarHBondContact O-CA 3.47Å; S187-T196 PolarHBondContact N-O 2.95Å; S187-T196 PolarHBondContact O-N 3.23Å; S187-T196 PolarHBondContact O-OG1 3.47Å; S187-T196 PolarHBondContact OG-OG1 3.29Å
188	F	77.6	Confident	79.2	Confident	26 Å²	26	48.1 Å²	48.1	11%	0.114	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	115.9	171.8	-76.6	-108.5	0	0	0	109.6	V160 K164 L168 V190 S194 I195	V160-F188 HydrophobicContact CB-CD1 4.1Å; V160-F188 HydrophobicContact CG1-CB 4.41Å; V160-F188 HydrophobicContact CG1-CD1 3.58Å; V160-F188 HydrophobicContact CG1-CE1 4.12Å; V160-F188 HydrophobicContact CG1-CG 4.22Å; V160-F188 HydrophobicContact CG2-CD1 3.95Å; V160-F188 HydrophobicContact CG2-CE1 4.06Å; K164-F188 HydrophobicContact CB-CD1 4.49Å; K164-F188 HydrophobicContact CB-CD2 4.09Å; K164-F188 HydrophobicContact CB-CE1 4.01Å; K164-F188 HydrophobicContact CB-CE2 3.62Å; K164-F188 HydrophobicContact CB-CZ 3.56Å; L168-F188 HydrophobicContact CD2-CE2 4.29Å; L168-F188 HydrophobicContact CD2-CZ 4.1Å; F188-V190 PolarHBondContact O-N 3.47Å; F188-S194 CarbonylContact C-O 3.52Å; F188-S194 WeakPolarHBondContact CA-O 3.48Å; F188-I195 HydrophobicContact CD1-CD1 3.87Å; F188-I195 HydrophobicContact CD1-CG1 3.52Å; F188-I195 HydrophobicContact CD2-CG2 4.22Å; F188-I195 HydrophobicContact CE1-CB 4.47Å; F188-I195 HydrophobicContact CE1-CD1 3.16Å; F188-I195 HydrophobicContact CE1-CG1 3.38Å; F188-I195 HydrophobicContact CE1-CG2 4.36Å; F188-I195 HydrophobicContact CE2-CD1 4.44Å; F188-I195 HydrophobicContact CE2-CG1 4.45Å; F188-I195 HydrophobicContact CE2-CG2 3.93Å; F188-I195 HydrophobicContact CG-CG1 4.18Å; F188-I195 HydrophobicContact CZ-CD1 3.49Å; F188-I195 VanDerWaalsContact CZ-CD1 3.49Å; F188-I195 HydrophobicContact CZ-CG1 3.87Å; F188-I195 HydrophobicContact CZ-CG2 4.01Å
189	D	70.2	Confident	78.5	Confident	49 Å²	49	47.9 Å²	47.9	26%	0.262	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	87.9	166.7	-173.8	-20.2	0	0	0	107.8	P191 K192 E193 S194	D189-P191 VanDerWaalsContact OD1-CD 3.28Å; D189-P191 WeakPolarHBondContact OD1-CD 3.42Å; D189-K192 HydrophobicContact CB-CB 4.27Å; D189-K192 CarbonylContact O-C 3.54Å; D189-K192 PolarHBondContact O-N 3.27Å; D189-K192 VanDerWaalsContact O-N 3.14Å; D189-K192 PolarHBondContact OD1-N 2.82Å; D189-K192 WeakPolarHBondContact OD2-CD 3.19Å; D189-K192 VanDerWaalsContact OD2-CE 3.31Å; D189-K192 WeakPolarHBondContact OD2-CE 3.48Å; D189-K192 WeakPolarHBondContact OD2-CG 3.03Å; D189-K192 IonicContact OD2-NZ 2.82Å; D189-K192 PolarHBondContact OD2-NZ 3.5Å; D189-E193 PolarHBondContact O-N 3.42Å; D189-S194 WeakPolarHBondContact CB-OG 3.36Å; D189-S194 PolarHBondContact N-O 3.43Å; D189-S194 PolarHBondContact O-N 2.62Å
190	V	66.8	Low	77.8	Confident	53 Å²	53	52.8 Å²	52.8	32%	0.321	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-53.7	-50.1	-178.2	162.2	0	0	0	0	112.6	V160 F188 K192 E193	V160-V190 HydrophobicContact CB-CG2 4.41Å; V160-V190 HydrophobicContact CG1-CG2 4.28Å; V160-V190 WeakPolarHBondContact O-CB 3.24Å; V160-V190 WeakPolarHBondContact O-CG1 3.12Å; V160-V190 WeakPolarHBondContact O-CG2 3.36Å; F188-V190 PolarHBondContact O-N 3.47Å; V190-K192 PolarHBondContact O-N 2.86Å; V190-E193 PolarHBondContact O-N 2.9Å
191	P	65.6	Low	76.9	Confident	121 Å²	121	54.1 Å²	54.1	79%	0.786	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-58.3	-31.2	176.6	-26.7	33.4	0	0	0	114.9	D189	D189-P191 VanDerWaalsContact OD1-CD 3.28Å; D189-P191 WeakPolarHBondContact OD1-CD 3.42Å
192	K	67.3	Low	76.1	Confident	128 Å²	128	52.3 Å²	52.3	56%	0.557	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-96	1.8	177.2	-60.6	-168.7	-163.4	121.1	0	113.6	D189 V190 S194	D189-K192 HydrophobicContact CB-CB 4.27Å; D189-K192 CarbonylContact O-C 3.54Å; D189-K192 PolarHBondContact O-N 3.27Å; D189-K192 VanDerWaalsContact O-N 3.14Å; D189-K192 PolarHBondContact OD1-N 2.82Å; D189-K192 WeakPolarHBondContact OD2-CD 3.19Å; D189-K192 VanDerWaalsContact OD2-CE 3.31Å; D189-K192 WeakPolarHBondContact OD2-CE 3.48Å; D189-K192 WeakPolarHBondContact OD2-CG 3.03Å; D189-K192 IonicContact OD2-NZ 2.82Å; D189-K192 PolarHBondContact OD2-NZ 3.5Å; V190-K192 PolarHBondContact O-N 2.86Å; K192-S194 PolarHBondContact O-N 3.28Å; K192-S194 VanDerWaalsContact O-N 3.12Å
193	E	64.8	Low	75.8	Confident	69 Å²	69	54.6 Å²	54.6	32%	0.322	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.2	39.9	-173.3	-57.6	-172.8	168.3	0	0	112.5	D189 V190	D189-E193 PolarHBondContact O-N 3.42Å; V190-E193 PolarHBondContact O-N 2.9Å
194	S	68.2	Low	75.7	Confident	11 Å²	11	53.8 Å²	53.8	8%	0.077	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	152.3	-174.5	71.4	0	0	0	0	113	F188 D189 K192	F188-S194 CarbonylContact C-O 3.52Å; F188-S194 WeakPolarHBondContact CA-O 3.48Å; D189-S194 WeakPolarHBondContact CB-OG 3.36Å; D189-S194 PolarHBondContact N-O 3.43Å; D189-S194 PolarHBondContact O-N 2.62Å; K192-S194 PolarHBondContact O-N 3.28Å; K192-S194 VanDerWaalsContact O-N 3.12Å
195	I	71.9	Confident	75.7	Confident	13 Å²	13	50.3 Å²	50.3	7%	0.067	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	123.7	-179.3	-48.8	173.7	0	0	0	106.7	L168 S187 F188 M197 I224	L168-I195 HydrophobicContact CD2-CG2 4.27Å; S187-I195 WeakPolarHBondContact O-CA 3.47Å; F188-I195 HydrophobicContact CD1-CD1 3.87Å; F188-I195 HydrophobicContact CD1-CG1 3.52Å; F188-I195 HydrophobicContact CD2-CG2 4.22Å; F188-I195 HydrophobicContact CE1-CB 4.47Å; F188-I195 HydrophobicContact CE1-CD1 3.16Å; F188-I195 HydrophobicContact CE1-CG1 3.38Å; F188-I195 HydrophobicContact CE1-CG2 4.36Å; F188-I195 HydrophobicContact CE2-CD1 4.44Å; F188-I195 HydrophobicContact CE2-CG1 4.45Å; F188-I195 HydrophobicContact CE2-CG2 3.93Å; F188-I195 HydrophobicContact CG-CG1 4.18Å; F188-I195 HydrophobicContact CZ-CD1 3.49Å; F188-I195 VanDerWaalsContact CZ-CD1 3.49Å; F188-I195 HydrophobicContact CZ-CG1 3.87Å; F188-I195 HydrophobicContact CZ-CG2 4.01Å; I195-M197 HydrophobicContact CG2-CE 3.86Å; I195-I224 HydrophobicContact CD1-CD1 3.75Å; I195-I224 HydrophobicContact CD1-CG1 3.88Å; I195-I224 HydrophobicContact CD1-CG2 4.02Å
196	T	75.4	Confident	76	Confident	44 Å²	44	48.9 Å²	48.9	27%	0.27	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	142.6	172	58.6	0	0	0	0	108.8	C186 S187 Y281	C186-T196 CarbonylContact C-O 3.53Å; C186-T196 WeakPolarHBondContact CA-O 3.4Å; S187-T196 PolarHBondContact N-O 2.95Å; S187-T196 PolarHBondContact O-N 3.23Å; S187-T196 PolarHBondContact O-OG1 3.47Å; S187-T196 PolarHBondContact OG-OG1 3.29Å; T196-Y281 HydrophobicContact CG2-CE2 4.34Å
197	M	82.1	Confident	76.4	Confident	12 Å²	12	50.1 Å²	50.1	6%	0.059	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	151.7	172.7	64.7	-172.4	69.1	0	0	109.1	L168 M172 M183 C186 I195 I199 I220	L168-M197 HydrophobicContact CD2-CE 3.64Å; M172-M197 HydrophobicContact CE-SD 4.36Å; M183-M197 HydrophobicContact CG-CB 3.86Å; M183-M197 HydrophobicContact CG-CG 4.41Å; M183-M197 HydrophobicContact CG-SD 4.05Å; M183-M197 HydrophobicContact SD-CB 4.33Å; M183-M197 HydrophobicContact SD-CE 4.13Å; M183-M197 HydrophobicContact SD-SD 4.02Å; C186-M197 HydrophobicContact CB-CB 4.21Å; I195-M197 HydrophobicContact CG2-CE 3.86Å; M197-I199 HydrophobicContact SD-CD1 4.26Å; M197-I220 HydrophobicContact CE-CG2 3.86Å; M197-I220 HydrophobicContact SD-CD1 4.15Å; M197-I220 HydrophobicContact SD-CG1 4.34Å; M197-I220 HydrophobicContact SD-CG2 3.97Å
198	D	77.7	Confident	76.9	Confident	48 Å²	48	48.5 Å²	48.5	26%	0.257	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	137.1	171.4	-67.9	-37.2	0	0	0	109.3	E184 N185 C279	E184-D198 HydrophobicContact CB-CB 4.25Å; E184-D198 PolarHBondContact N-O 3.49Å; E184-D198 PolarHBondContact O-N 3.02Å; N185-D198 HydrophobicContact CB-CB 4.41Å; N185-D198 WeakPolarHBondContact CB-OD2 3.29Å; N185-D198 PolarHBondContact ND2-OD2 3.03Å; D198-C279 PolarHBondContact OD1-SG 3.45Å
199	I	78.8	Confident	77.4	Confident	16 Å²	16	48.4 Å²	48.4	8%	0.082	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	123.6	170.1	-58.1	177.8	0	0	0	107.4	M172 V182 M197 L204 I220	M172-I199 HydrophobicContact CE-CD1 4.39Å; V182-I199 HydrophobicContact CB-CG2 4.29Å; V182-I199 HydrophobicContact CG2-CG2 3.67Å; M197-I199 HydrophobicContact SD-CD1 4.26Å; I199-L204 HydrophobicContact CG2-CD1 3.75Å; I199-L204 HydrophobicContact CG2-CD2 3.87Å; I199-L204 HydrophobicContact CG2-CG 3.51Å; I199-I220 HydrophobicContact CD1-CD1 3.98Å
200	K	77.9	Confident	77.7	Confident	104 Å²	104	46.1 Å²	46.1	45%	0.452	24%	0.236	S	C	.	.			trans	-74	133.8	176.7	-69.4	172.5	-176.1	142.3	0	109.9	E184 E202 E203 L204	E184-K200 VanDerWaalsContact CD-NZ 3.32Å; E184-K200 IonicContact OE1-NZ 2.76Å; E184-K200 PolarHBondContact OE1-NZ 3.32Å; E184-K200 WeakPolarHBondContact OE2-CE 3.49Å; E184-K200 IonicContact OE2-NZ 2.82Å; E184-K200 PolarHBondContact OE2-NZ 2.63Å; K200-E202 VanDerWaalsContact C-N 3.28Å; K200-E202 PolarHBondContact O-N 3.21Å; K200-E203 HydrophobicContact CB-CB 4.25Å; K200-E203 HydrophobicContact CB-CG 3.93Å; K200-E203 HydrophobicContact CD-CG 4.49Å; K200-E203 PolarHBondContact O-N 3.03Å; K200-L204 PolarHBondContact O-N 3.49Å; K200-L204 VanDerWaalsContact O-N 3.11Å
201	Y	74.4	Confident	77.8	Confident	28 Å²	28	43.8 Å²	43.8	11%	0.11	22%	0.223	C	C	.	.	H	α-helix	trans	-63.9	-35.1	-179.6	-156.7	-105.3	0	0	0	112.7	I37 E203 L204 M205 C210 C211 Y275	I37-Y201 HydrophobicContact CD1-CD1 3.8Å; I37-Y201 HydrophobicContact CG2-CE1 4.33Å; Y201-E203 VanDerWaalsContact C-N 3.28Å; Y201-E203 PolarHBondContact O-N 2.81Å; Y201-L204 HydrophobicContact CD2-CD1 4.44Å; Y201-L204 PolarHBondContact O-N 3.3Å; Y201-M205 WeakPolarHBondContact O-CB 3.36Å; Y201-M205 PolarHBondContact O-N 2.91Å; Y201-C210 WeakPolarHBondContact CE1-SG 3.33Å; Y201-C210 PolarHBondContact OH-SG 2.83Å; Y201-C211 WeakPolarHBondContact OH-CA 3.43Å; Y201-C211 WeakPolarHBondContact OH-CB 3.29Å; Y201-C211 PolarHBondContact OH-O 2.95Å; Y201-C211 VanDerWaalsContact OH-O 3.06Å; Y201-Y275 HydrophobicContact CD1-CD1 4.41Å; Y201-Y275 AromaticContact CD1-CD2 3.82Å; Y201-Y275 HydrophobicContact CD1-CD2 3.82Å; Y201-Y275 HydrophobicContact CD1-CE2 4.32Å; Y201-Y275 AromaticContact CD1-CG 3.86Å; Y201-Y275 HydrophobicContact CD1-CG 3.86Å; Y201-Y275 HydrophobicContact CD2-CD1 4.47Å; Y201-Y275 HydrophobicContact CE1-CD1 4.13Å; Y201-Y275 AromaticContact CE1-CD2 3.31Å; Y201-Y275 HydrophobicContact CE1-CD2 3.31Å; Y201-Y275 HydrophobicContact CE1-CE1 4.22Å; Y201-Y275 AromaticContact CE1-CE2 3.37Å; Y201-Y275 HydrophobicContact CE1-CE2 3.37Å; Y201-Y275 AromaticContact CE1-CG 3.7Å; Y201-Y275 HydrophobicContact CE1-CG 3.7Å; Y201-Y275 AromaticContact CE1-CZ 3.86Å; Y201-Y275 HydrophobicContact CE2-CD1 4.2Å; Y201-Y275 HydrophobicContact CE2-CE1 4.05Å; Y201-Y275 HydrophobicContact CG-CG 4.33Å; Y201-Y275 AromaticContact CZ-CD2 3.83Å; Y201-Y275 AromaticContact CZ-CE1 3.73Å; Y201-Y275 AromaticContact CZ-CE2 3.51Å; Y201-Y275 AromaticContact CZ-CZ 3.47Å; Y201-Y275 VanDerWaalsContact CZ-CZ 3.47Å; Y201-Y275 VanDerWaalsContact OH-CE2 3.25Å; Y201-Y275 WeakPolarHBondContact OH-CE2 3.42Å; Y201-Y275 PolarHBondContact OH-OH 2.9Å; Y201-Y275 VanDerWaalsContact OH-OH 3.05Å
202	E	77.1	Confident	78.5	Confident	71 Å²	71	39 Å²	39	33%	0.332	19%	0.191	S	C	.	.	H	α-helix	trans	-59.4	-38.5	172.4	-174.8	-174.4	159.2	0	0	112.3	I37 F113 K200 M205 K206	I37-E202 HydrophobicContact CD1-CB 4.28Å; F113-E202 HydrophobicContact CE1-CG 3.8Å; F113-E202 HydrophobicContact CZ-CG 3.76Å; K200-E202 VanDerWaalsContact C-N 3.28Å; K200-E202 PolarHBondContact O-N 3.21Å; E202-M205 WeakPolarHBondContact O-CB 3.15Å; E202-M205 PolarHBondContact O-N 3.05Å; E202-K206 WeakPolarHBondContact O-CG 3.35Å; E202-K206 PolarHBondContact O-N 3.23Å; E202-K206 VanDerWaalsContact OE1-CE 3.25Å; E202-K206 WeakPolarHBondContact OE1-CE 3.08Å; E202-K206 IonicContact OE1-NZ 2.74Å; E202-K206 PolarHBondContact OE1-NZ 2.99Å
203	E	81.9	Confident	78.8	Confident	60 Å²	60	35.2 Å²	35.2	28%	0.28	19%	0.188	S	C	.	.	H	α-helix	trans	-73.8	-37.8	178.9	-63.6	-56.9	134	0	0	111.4	V182 K200 Y201 M205 K206 I207	V182-E203 HydrophobicContact CB-CB 3.84Å; V182-E203 HydrophobicContact CG1-CB 3.6Å; K200-E203 HydrophobicContact CB-CB 4.25Å; K200-E203 HydrophobicContact CB-CG 3.93Å; K200-E203 HydrophobicContact CD-CG 4.49Å; K200-E203 PolarHBondContact O-N 3.03Å; Y201-E203 VanDerWaalsContact C-N 3.28Å; Y201-E203 PolarHBondContact O-N 2.81Å; E203-M205 VanDerWaalsContact C-N 3.29Å; E203-M205 PolarHBondContact O-N 3.45Å; E203-K206 PolarHBondContact O-N 3.48Å; E203-K206 IonicContact OE1-NZ 2.73Å; E203-K206 PolarHBondContact OE1-NZ 3.37Å; E203-I207 WeakPolarHBondContact O-CG1 3.31Å; E203-I207 PolarHBondContact O-N 3.48Å; E203-I207 VanDerWaalsContact O-N 3.14Å
204	L	83.3	Confident	79.4	Confident	3 Å²	3	34.3 Å²	34.3	2%	0.016	18%	0.182	C	C	.	.	H	α-helix	trans	-60.3	-39.8	170.1	-73.9	169.4	0	0	0	112.4	L179 I199 K200 Y201 I207 G208 Y209 C210 I216	L179-L204 HydrophobicContact CD1-CD2 3.63Å; I199-L204 HydrophobicContact CG2-CD1 3.75Å; I199-L204 HydrophobicContact CG2-CD2 3.87Å; I199-L204 HydrophobicContact CG2-CG 3.51Å; K200-L204 PolarHBondContact O-N 3.49Å; K200-L204 VanDerWaalsContact O-N 3.11Å; Y201-L204 HydrophobicContact CD2-CD1 4.44Å; Y201-L204 PolarHBondContact O-N 3.3Å; L204-I207 HydrophobicContact CD2-CD1 4.33Å; L204-I207 WeakPolarHBondContact O-CG1 3.41Å; L204-I207 PolarHBondContact O-N 2.8Å; L204-G208 PolarHBondContact O-N 3.46Å; L204-G208 VanDerWaalsContact O-N 3.1Å; L204-Y209 PolarHBondContact O-N 2.86Å; L204-C210 PolarHBondContact O-N 2.92Å; L204-I216 HydrophobicContact CD1-CD1 3.73Å; L204-I216 HydrophobicContact CD1-CG1 4.23Å; L204-I216 HydrophobicContact CD1-CG2 4.19Å
205	M	83.4	Confident	80.1	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62	-44.7	175.5	173	62.9	-151	0	0	111.2	I37 T87 S89 A111 M112 F113 Y201 E202 E203 I207 G208 C210	I37-M205 HydrophobicContact CD1-CB 4.29Å; I37-M205 HydrophobicContact CD1-CG 4.5Å; T87-M205 HydrophobicContact CG2-CE 4.17Å; T87-M205 WeakPolarHBondContact O-CE 3.22Å; S89-M205 WeakPolarHBondContact CB-SD 3.39Å; A111-M205 VanDerWaalsContact C-CE 3.45Å; A111-M205 HydrophobicContact CB-CE 4.3Å; A111-M205 HydrophobicContact CB-SD 3.41Å; A111-M205 WeakPolarHBondContact CB-SD 3.22Å; A111-M205 VanDerWaalsContact O-CE 3.28Å; A111-M205 WeakPolarHBondContact O-CE 3.47Å; M112-M205 VanDerWaalsContact CA-CE 3.46Å; F113-M205 HydrophobicContact CE1-CG 4.14Å; F113-M205 HydrophobicContact CE2-CG 4.02Å; F113-M205 HydrophobicContact CZ-CB 4.3Å; F113-M205 HydrophobicContact CZ-CG 3.69Å; Y201-M205 WeakPolarHBondContact O-CB 3.36Å; Y201-M205 PolarHBondContact O-N 2.91Å; E202-M205 WeakPolarHBondContact O-CB 3.15Å; E202-M205 PolarHBondContact O-N 3.05Å; E203-M205 VanDerWaalsContact C-N 3.29Å; E203-M205 PolarHBondContact O-N 3.45Å; M205-I207 VanDerWaalsContact C-N 3.33Å; M205-I207 PolarHBondContact O-N 3.42Å; M205-G208 PolarHBondContact O-N 3.35Å; M205-C210 HydrophobicContact CB-CB 4.11Å; M205-C210 HydrophobicContact SD-CB 4.28Å
206	K	89.2	Confident	80.6	Confident	90 Å²	90	33.3 Å²	33.3	39%	0.391	18%	0.176	S	C	.	.	H	α-helix	trans	-63.5	-34.8	177.8	-72.6	167.9	-173	163.1	0	113.5	F113 E202 E203	F113-K206 HydrophobicContact CE2-CG 4.15Å; F113-K206 HydrophobicContact CZ-CG 4.14Å; E202-K206 WeakPolarHBondContact O-CG 3.35Å; E202-K206 PolarHBondContact O-N 3.23Å; E202-K206 VanDerWaalsContact OE1-CE 3.25Å; E202-K206 WeakPolarHBondContact OE1-CE 3.08Å; E202-K206 IonicContact OE1-NZ 2.74Å; E202-K206 PolarHBondContact OE1-NZ 2.99Å; E203-K206 PolarHBondContact O-N 3.48Å; E203-K206 IonicContact OE1-NZ 2.73Å; E203-K206 PolarHBondContact OE1-NZ 3.37Å
207	I	91.1	Very high	80.8	Confident	50 Å²	50	33 Å²	33	26%	0.256	17%	0.17	S	C	.	.	H	α-helix	trans	-91.9	-0.6	-179.8	68.9	179.8	0	0	0	113.9	L179 V182 E203 L204 M205 Y209	L179-I207 HydrophobicContact CB-CD1 4.38Å; L179-I207 HydrophobicContact CD1-CD1 4.17Å; V182-I207 HydrophobicContact CG1-CD1 4Å; V182-I207 HydrophobicContact CG1-CG2 4.26Å; V182-I207 HydrophobicContact CG2-CD1 3.88Å; E203-I207 WeakPolarHBondContact O-CG1 3.31Å; E203-I207 PolarHBondContact O-N 3.48Å; E203-I207 VanDerWaalsContact O-N 3.14Å; L204-I207 HydrophobicContact CD2-CD1 4.33Å; L204-I207 WeakPolarHBondContact O-CG1 3.41Å; L204-I207 PolarHBondContact O-N 2.8Å; M205-I207 VanDerWaalsContact C-N 3.33Å; M205-I207 PolarHBondContact O-N 3.42Å; I207-Y209 HydrophobicContact CD1-CD2 3.6Å; I207-Y209 HydrophobicContact CD1-CE2 4.22Å; I207-Y209 HydrophobicContact CG1-CD2 3.71Å; I207-Y209 HydrophobicContact CG1-CE2 4.41Å; I207-Y209 HydrophobicContact CG1-CG 4.43Å
208	G	91.1	Very high	80.9	Confident	23 Å²	23	34 Å²	34	24%	0.237	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.6	14.3	174.6	0	0	0	0	0	116	S89 L204 M205	S89-G208 VanDerWaalsContact OG-CA 3.27Å; S89-G208 WeakPolarHBondContact OG-CA 3.25Å; S89-G208 PolarHBondContact OG-O 3.46Å; L204-G208 PolarHBondContact O-N 3.46Å; L204-G208 VanDerWaalsContact O-N 3.1Å; M205-G208 PolarHBondContact O-N 3.35Å
209	Y	87	Confident	81.3	Confident	24 Å²	24	31.9 Å²	31.9	9%	0.094	16%	0.163	C	C	.	.			trans	-107.3	13.7	178.5	-63.2	-49.2	0	0	0	114	S89 Y176 P177 L179 L204 I207 I216	S89-Y209 PolarHBondContact OG-N 2.63Å; Y176-Y209 VanDerWaalsContact CA-OH 3.31Å; Y176-Y209 WeakPolarHBondContact CA-OH 3.48Å; P177-Y209 WeakPolarHBondContact CD-OH 3.45Å; P177-Y209 WeakPolarHBondContact O-CE2 3.19Å; L179-Y209 HydrophobicContact CB-CD2 4.24Å; L179-Y209 HydrophobicContact CB-CE2 4.12Å; L179-Y209 HydrophobicContact CD1-CD2 4.2Å; L204-Y209 PolarHBondContact O-N 2.86Å; I207-Y209 HydrophobicContact CD1-CD2 3.6Å; I207-Y209 HydrophobicContact CD1-CE2 4.22Å; I207-Y209 HydrophobicContact CG1-CD2 3.71Å; I207-Y209 HydrophobicContact CG1-CE2 4.41Å; I207-Y209 HydrophobicContact CG1-CG 4.43Å; Y209-I216 WeakPolarHBondContact O-CG1 3.06Å
210	C	77.5	Confident	81.6	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.161	C	C	.	.			trans	-76.5	136.1	163.9	-177.6	0	0	0	0	107.9	S89 C90 D91 Y201 L204 M205	S89-C210 WeakPolarHBondContact OG-CA 3.44Å; S89-C210 WeakPolarHBondContact OG-CB 3.31Å; S89-C210 PolarHBondContact OG-N 2.95Å; S89-C210 PolarHBondContact OG-O 3.39Å; C90-C210 CarbonylContact C-O 3.19Å; D91-C210 WeakPolarHBondContact CB-O 3.2Å; Y201-C210 WeakPolarHBondContact CE1-SG 3.33Å; Y201-C210 PolarHBondContact OH-SG 2.83Å; L204-C210 PolarHBondContact O-N 2.92Å; M205-C210 HydrophobicContact CB-CB 4.11Å; M205-C210 HydrophobicContact SD-CB 4.28Å
211	C	69	Low	81.8	Confident	5 Å²	5	29.4 Å²	29.4	3%	0.034	15%	0.152	C	C	.	.	S	Bend	cis	-157.3	6.7	39.6	-61.9	0	0	0	0	115.3	V39 D91 K109 A111 Y201	V39-C211 HydrophobicContact CG1-CB 4.13Å; V39-C211 HydrophobicContact CG2-CB 4.45Å; D91-C211 VanDerWaalsContact CB-N 3.31Å; D91-C211 PolarHBondContact OD2-N 3.23Å; K109-C211 HydrophobicContact CB-CB 4.11Å; K109-C211 HydrophobicContact CG-CB 4.45Å; A111-C211 WeakPolarHBondContact CB-SG 3.44Å; Y201-C211 WeakPolarHBondContact OH-CA 3.43Å; Y201-C211 WeakPolarHBondContact OH-CB 3.29Å; Y201-C211 PolarHBondContact OH-O 2.95Å; Y201-C211 VanDerWaalsContact OH-O 3.06Å
212	V	78.9	Confident	82.3	Confident	21 Å²	21	29.1 Å²	29.1	13%	0.127	16%	0.155	C	C	.	.			trans	-93.7	110.6	-179.2	-179.3	0	0	0	0	108.9	D91 I93 K109 Y214 N215 I216	D91-V212 HydrophobicContact CB-CG2 4.04Å; D91-V212 WeakPolarHBondContact OD2-CA 3.46Å; D91-V212 WeakPolarHBondContact OD2-CB 3.41Å; D91-V212 PolarHBondContact OD2-N 2.74Å; I93-V212 HydrophobicContact CG1-CG2 4.36Å; K109-V212 HydrophobicContact CG-CG2 3.81Å; V212-Y214 PolarHBondContact O-N 3.45Å; V212-N215 HydrophobicContact CB-CB 4.36Å; V212-N215 PolarHBondContact O-N 2.91Å; V212-I216 PolarHBondContact O-N 2.84Å; V212-I216 VanDerWaalsContact O-N 3.14Å
213	G	75.1	Confident	82.9	Confident	47 Å²	47	25.8 Å²	25.8	49%	0.485	14%	0.139	S	C	.	.	H	α-helix	trans	-51.9	-33.6	-179.2	0	0	0	0	0	114	Y217	G213-Y217 WeakPolarHBondContact O-CB 3.23Å; G213-Y217 PolarHBondContact O-N 2.79Å
214	Y	76.4	Confident	82.9	Confident	50 Å²	50	23.5 Å²	23.5	20%	0.196	13%	0.128	C	C	.	.	H	α-helix	trans	-64.9	-42.1	175.4	179.5	-110.5	0	0	0	113.4	D56 P94 F152 V212 Y217 K218	D56-Y214 HydrophobicContact CB-CE1 4.13Å; D56-Y214 WeakPolarHBondContact OD2-CE1 3.48Å; D56-Y214 PolarHBondContact OD2-OH 3.41Å; P94-Y214 HydrophobicContact CG-CD1 4.12Å; P94-Y214 HydrophobicContact CG-CE1 4.4Å; F152-Y214 AromaticContact CD1-CD2 3.95Å; F152-Y214 HydrophobicContact CD1-CD2 3.95Å; F152-Y214 HydrophobicContact CD1-CE2 4Å; F152-Y214 HydrophobicContact CD2-CD2 4.19Å; F152-Y214 AromaticContact CE1-CD2 3.4Å; F152-Y214 HydrophobicContact CE1-CD2 3.4Å; F152-Y214 AromaticContact CE1-CE2 3.54Å; F152-Y214 HydrophobicContact CE1-CE2 3.54Å; F152-Y214 HydrophobicContact CE1-CG 4.45Å; F152-Y214 AromaticContact CE2-CD2 3.68Å; F152-Y214 HydrophobicContact CE2-CD2 3.68Å; F152-Y214 HydrophobicContact CE2-CG 4.32Å; F152-Y214 HydrophobicContact CG-CD2 4.32Å; F152-Y214 AromaticContact CZ-CD2 3.25Å; F152-Y214 HydrophobicContact CZ-CD2 3.25Å; F152-Y214 AromaticContact CZ-CE2 3.9Å; F152-Y214 HydrophobicContact CZ-CE2 3.9Å; F152-Y214 AromaticContact CZ-CG 3.96Å; F152-Y214 HydrophobicContact CZ-CG 3.96Å; V212-Y214 PolarHBondContact O-N 3.45Å; Y214-Y217 WeakPolarHBondContact O-CB 3.5Å; Y214-Y217 PolarHBondContact O-N 2.98Å; Y214-K218 HydrophobicContact CD1-CD 4.41Å; Y214-K218 HydrophobicContact CE1-CD 3.71Å; Y214-K218 HydrophobicContact CE1-CG 4.12Å; Y214-K218 HydrophobicContact CE2-CG 4.25Å; Y214-K218 PolarHBondContact O-N 3.05Å
215	N	82.7	Confident	82.8	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-71.4	-37.9	179.5	-66.1	-11.3	0	0	0	110.7	F61 L62 D91 I92 V212 K218 R219	F61-N215 WeakPolarHBondContact CE1-OD1 3.33Å; L62-N215 HydrophobicContact CD2-CB 4.18Å; D91-N215 PolarHBondContact OD1-ND2 2.59Å; I92-N215 PolarHBondContact O-ND2 3.47Å; V212-N215 HydrophobicContact CB-CB 4.36Å; V212-N215 PolarHBondContact O-N 2.91Å; N215-K218 PolarHBondContact O-N 2.92Å; N215-R219 WeakPolarHBondContact O-CG 3.31Å; N215-R219 PolarHBondContact O-N 3.2Å
216	I	82.9	Confident	82.9	Confident	4 Å²	4	27.6 Å²	27.6	2%	0.021	15%	0.15	C	C	.	.	H	α-helix	trans	-58.1	-48.7	170.9	-62	158.8	0	0	0	110.2	L204 Y209 V212 K218 R219 I220 I280	L204-I216 HydrophobicContact CD1-CD1 3.73Å; L204-I216 HydrophobicContact CD1-CG1 4.23Å; L204-I216 HydrophobicContact CD1-CG2 4.19Å; Y209-I216 WeakPolarHBondContact O-CG1 3.06Å; V212-I216 PolarHBondContact O-N 2.84Å; V212-I216 VanDerWaalsContact O-N 3.14Å; I216-K218 PolarHBondContact O-N 3.18Å; I216-R219 WeakPolarHBondContact O-CB 3.35Å; I216-R219 PolarHBondContact O-N 3.32Å; I216-I220 HydrophobicContact CG2-CD1 4.02Å; I216-I220 WeakPolarHBondContact O-CG1 3.11Å; I216-I220 PolarHBondContact O-N 3.18Å; I216-I220 VanDerWaalsContact O-N 3.09Å; I216-I280 HydrophobicContact CG2-CD1 3.57Å
217	Y	79.8	Confident	82.6	Confident	37 Å²	37	23.8 Å²	23.8	15%	0.145	13%	0.134	C	C	.	.	H	α-helix	trans	-58.2	-47.3	175.1	167.4	-96.3	0	0	0	112.1	G213 Y214 R219 I220 H221	G213-Y217 WeakPolarHBondContact O-CB 3.23Å; G213-Y217 PolarHBondContact O-N 2.79Å; Y214-Y217 WeakPolarHBondContact O-CB 3.5Å; Y214-Y217 PolarHBondContact O-N 2.98Å; Y217-R219 VanDerWaalsContact C-N 3.27Å; Y217-R219 PolarHBondContact O-N 3.3Å; Y217-I220 PolarHBondContact O-N 3.44Å; Y217-H221 HydrophobicContact CE1-CB 4.26Å; Y217-H221 AromaticContact CZ-CD2 3.96Å; Y217-H221 VanDerWaalsContact O-CB 3.28Å; Y217-H221 WeakPolarHBondContact O-CB 3.28Å; Y217-H221 PolarHBondContact O-N 3.45Å; Y217-H221 PolarHBondContact OH-CD2 3.19Å
218	K	83.2	Confident	82	Confident	33 Å²	33	23.6 Å²	23.6	14%	0.143	13%	0.133	C	C	.	.	H	α-helix	trans	-59.6	-37.5	178.6	-80.6	-160.5	74.1	-169	0	112.2	D56 F61 L62 Y214 N215 I216 S222	D56-K218 PolarHBondContact O-NZ 3.41Å; F61-K218 HydrophobicContact CD1-CD 4.47Å; L62-K218 HydrophobicContact CD1-CB 3.96Å; L62-K218 HydrophobicContact CD2-CB 4.29Å; L62-K218 HydrophobicContact CG-CB 4.48Å; Y214-K218 HydrophobicContact CD1-CD 4.41Å; Y214-K218 HydrophobicContact CE1-CD 3.71Å; Y214-K218 HydrophobicContact CE1-CG 4.12Å; Y214-K218 HydrophobicContact CE2-CG 4.25Å; Y214-K218 PolarHBondContact O-N 3.05Å; N215-K218 PolarHBondContact O-N 2.92Å; I216-K218 PolarHBondContact O-N 3.18Å; K218-S222 WeakPolarHBondContact O-CB 3.21Å; K218-S222 PolarHBondContact O-N 3.29Å
219	R	87.7	Confident	81.3	Confident	4 Å²	4	27.3 Å²	27.3	2%	0.015	14%	0.142	C	C	.	.	H	α-helix	trans	-62.3	-50.9	174.8	-70.9	178.2	-164.6	-70.3	-2.2	110.9	L62 D66 Y176 L179 N215 I216 Y217 H221 S222 S223	L62-R219 HydrophobicContact CD1-CG 3.72Å; L62-R219 HydrophobicContact CD2-CG 4.28Å; D66-R219 IonicContact OD1-CZ 2.79Å; D66-R219 IonicContact OD1-NH1 2.62Å; D66-R219 PolarHBondContact OD1-NH1 3.12Å; D66-R219 IonicContact OD1-NH2 3.38Å; D66-R219 PolarHBondContact OD1-NH2 3.21Å; D66-R219 IonicContact OD2-CZ 3.01Å; D66-R219 IonicContact OD2-NH1 3.42Å; D66-R219 PolarHBondContact OD2-NH1 3.06Å; D66-R219 IonicContact OD2-NH2 3.54Å; D66-R219 PolarHBondContact OD2-NH2 3.35Å; Y176-R219 HydrophobicContact CD1-CG 4.09Å; Y176-R219 HydrophobicContact CD2-CB 3.74Å; Y176-R219 HydrophobicContact CD2-CG 4.01Å; Y176-R219 HydrophobicContact CE1-CG 3.91Å; Y176-R219 HydrophobicContact CE2-CB 3.59Å; Y176-R219 HydrophobicContact CE2-CG 3.81Å; Y176-R219 WeakPolarHBondContact CE2-O 3.45Å; Y176-R219 HydrophobicContact CG-CB 4.31Å; Y176-R219 HydrophobicContact CG-CG 4.14Å; L179-R219 HydrophobicContact CD2-CB 3.78Å; N215-R219 WeakPolarHBondContact O-CG 3.31Å; N215-R219 PolarHBondContact O-N 3.2Å; I216-R219 WeakPolarHBondContact O-CB 3.35Å; I216-R219 PolarHBondContact O-N 3.32Å; Y217-R219 VanDerWaalsContact C-N 3.27Å; Y217-R219 PolarHBondContact O-N 3.3Å; R219-H221 PolarHBondContact O-N 2.04Å; R219-S222 PolarHBondContact O-N 2.83Å; R219-S223 PolarHBondContact O-N 3.16Å; R219-S223 PolarHBondContact O-OG 2.75Å
220	I	85.2	Confident	80.6	Confident	10 Å²	10	30.6 Å²	30.6	5%	0.051	16%	0.157	C	C	.	.	H	α-helix	trans	-58.9	-49	177.8	-64.2	165.1	0	0	0	110.5	M172 M197 I199 I216 Y217 S222 S223 I224 I280	M172-I220 HydrophobicContact CE-CG1 4.15Å; M197-I220 HydrophobicContact CE-CG2 3.86Å; M197-I220 HydrophobicContact SD-CD1 4.15Å; M197-I220 HydrophobicContact SD-CG1 4.34Å; M197-I220 HydrophobicContact SD-CG2 3.97Å; I199-I220 HydrophobicContact CD1-CD1 3.98Å; I216-I220 HydrophobicContact CG2-CD1 4.02Å; I216-I220 WeakPolarHBondContact O-CG1 3.11Å; I216-I220 PolarHBondContact O-N 3.18Å; I216-I220 VanDerWaalsContact O-N 3.09Å; Y217-I220 PolarHBondContact O-N 3.44Å; I220-S222 PolarHBondContact O-N 3.49Å; I220-S223 WeakPolarHBondContact O-CB 3.23Å; I220-S223 PolarHBondContact O-N 3.05Å; I220-I224 HydrophobicContact CG2-CD1 3.78Å; I220-I224 WeakPolarHBondContact O-CG1 3.3Å; I220-I224 PolarHBondContact O-N 2.76Å; I220-I280 HydrophobicContact CD1-CD1 4.18Å
221	H	81.1	Confident	79.6	Confident	57 Å²	57	34.9 Å²	34.9	26%	0.264	18%	0.176	S	C	.	.	H	α-helix	trans	-59.2	-46.5	178	177.3	-77	0	0	0	112	F156 Y217 R219 S223 I224 V225	F156-H221 AromaticContact CE1-NE2 3.65Å; F156-H221 AromaticContact CE2-CD2 3.6Å; F156-H221 AromaticContact CE2-NE2 3.8Å; F156-H221 AromaticContact CZ-CD2 3.21Å; F156-H221 WeakPolarHBondContact CZ-CD2 3.28Å; F156-H221 AromaticContact CZ-CE1 3.64Å; F156-H221 AromaticContact CZ-CG 3.86Å; F156-H221 AromaticContact CZ-NE2 3.07Å; F156-H221 WeakPolarHBondContact CZ-NE2 3.07Å; Y217-H221 HydrophobicContact CE1-CB 4.26Å; Y217-H221 AromaticContact CZ-CD2 3.96Å; Y217-H221 VanDerWaalsContact O-CB 3.28Å; Y217-H221 WeakPolarHBondContact O-CB 3.28Å; Y217-H221 PolarHBondContact O-N 3.45Å; Y217-H221 PolarHBondContact OH-CD2 3.19Å; R219-H221 PolarHBondContact O-N 2.04Å; H221-S223 VanDerWaalsContact C-N 3.29Å; H221-S223 PolarHBondContact O-N 2.85Å; H221-I224 PolarHBondContact O-N 3.41Å; H221-V225 WeakPolarHBondContact O-CG2 3.42Å; H221-V225 PolarHBondContact O-N 2.95Å
222	S	85.2	Confident	78.7	Confident	23 Å²	23	37.4 Å²	37.4	16%	0.161	19%	0.194	C	C	.	.	H	α-helix	trans	-59.2	-40	176.3	179.8	0	0	0	0	111.9	K175 Y176 K218 R219 I220 E226	K175-S222 PolarHBondContact NZ-OG 3.44Å; Y176-S222 PolarHBondContact OH-OG 3.44Å; K218-S222 WeakPolarHBondContact O-CB 3.21Å; K218-S222 PolarHBondContact O-N 3.29Å; R219-S222 PolarHBondContact O-N 2.83Å; I220-S222 PolarHBondContact O-N 3.49Å; S222-E226 WeakPolarHBondContact O-CB 3.15Å; S222-E226 PolarHBondContact O-N 3.48Å
223	S	88.8	Confident	77	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-68.5	-38.7	175.3	-63.1	0	0	0	0	112.9	V171 M172 R219 I220 H221 E226 L227	V171-S223 WeakPolarHBondContact CG1-O 2.99Å; M172-S223 VanDerWaalsContact CG-CB 3.42Å; M172-S223 WeakPolarHBondContact CG-OG 3.41Å; R219-S223 PolarHBondContact O-N 3.16Å; R219-S223 PolarHBondContact O-OG 2.75Å; I220-S223 WeakPolarHBondContact O-CB 3.23Å; I220-S223 PolarHBondContact O-N 3.05Å; H221-S223 VanDerWaalsContact C-N 3.29Å; H221-S223 PolarHBondContact O-N 2.85Å; S223-E226 PolarHBondContact O-N 3.28Å; S223-L227 WeakPolarHBondContact O-CB 3.47Å; S223-L227 PolarHBondContact O-N 3.24Å
224	I	82.8	Confident	74.9	Confident	12 Å²	12	41.6 Å²	41.6	6%	0.062	22%	0.215	C	C	.	.	H	α-helix	trans	-63.6	-47	174.3	-67.1	160	0	0	0	110.3	F156 L168 I195 I220 H221 E226 L227 M228	F156-I224 HydrophobicContact CE2-CG2 4.18Å; F156-I224 HydrophobicContact CZ-CG2 4.3Å; L168-I224 HydrophobicContact CD1-CG1 3.85Å; L168-I224 HydrophobicContact CD2-CG1 4.23Å; I195-I224 HydrophobicContact CD1-CD1 3.75Å; I195-I224 HydrophobicContact CD1-CG1 3.88Å; I195-I224 HydrophobicContact CD1-CG2 4.02Å; I220-I224 HydrophobicContact CG2-CD1 3.78Å; I220-I224 WeakPolarHBondContact O-CG1 3.3Å; I220-I224 PolarHBondContact O-N 2.76Å; H221-I224 PolarHBondContact O-N 3.41Å; I224-E226 VanDerWaalsContact C-N 3.31Å; I224-E226 PolarHBondContact O-N 3.44Å; I224-L227 WeakPolarHBondContact O-CB 2.98Å; I224-L227 PolarHBondContact O-N 3.28Å; I224-M228 HydrophobicContact CG2-CG 4.42Å; I224-M228 VanDerWaalsContact O-CG 3.28Å; I224-M228 WeakPolarHBondContact O-CG 3.45Å; I224-M228 PolarHBondContact O-N 3.26Å
225	V	80.8	Confident	72.5	Confident	38 Å²	38	49.3 Å²	49.3	23%	0.23	24%	0.243	C	C	.	.	H	α-helix	trans	-56.2	-46.3	176	169.9	0	0	0	0	111.3	F156 H221 M228 K229	F156-V225 HydrophobicContact CE1-CG2 3.47Å; F156-V225 VanDerWaalsContact CE1-CG2 3.47Å; F156-V225 HydrophobicContact CZ-CG2 3.77Å; H221-V225 WeakPolarHBondContact O-CG2 3.42Å; H221-V225 PolarHBondContact O-N 2.95Å; V225-M228 PolarHBondContact O-N 2.78Å; V225-K229 HydrophobicContact CG1-CD 4.03Å; V225-K229 HydrophobicContact CG1-CG 4.37Å; V225-K229 WeakPolarHBondContact O-CG 3.31Å; V225-K229 PolarHBondContact O-N 3.02Å
226	E	85	Confident	69.8	Low	51 Å²	51	54.4 Å²	54.4	24%	0.238	27%	0.271	C	S	.	.	H	α-helix	trans	-61.1	-46.8	179	-174.8	65.1	-151.4	0	0	111.8	V171 K175 S222 S223 I224 M228 K229 K230	V171-E226 HydrophobicContact CG1-CB 3.8Å; V171-E226 HydrophobicContact CG1-CG 3.83Å; K175-E226 HydrophobicContact CD-CB 4.11Å; K175-E226 HydrophobicContact CD-CG 4.16Å; K175-E226 IonicContact NZ-OE2 3.47Å; S222-E226 WeakPolarHBondContact O-CB 3.15Å; S222-E226 PolarHBondContact O-N 3.48Å; S223-E226 PolarHBondContact O-N 3.28Å; I224-E226 VanDerWaalsContact C-N 3.31Å; I224-E226 PolarHBondContact O-N 3.44Å; E226-M228 VanDerWaalsContact C-N 3.28Å; E226-M228 PolarHBondContact O-N 3.27Å; E226-K229 PolarHBondContact O-N 3.16Å; E226-K230 WeakPolarHBondContact O-CG 3.01Å; E226-K230 PolarHBondContact O-N 3.47Å; E226-K230 WeakPolarHBondContact OE1-CE 3.28Å
227	L	83.8	Confident	67.2	Low	11 Å²	11	57.9 Å²	57.9	6%	0.058	30%	0.3	C	S	.	.	H	α-helix	trans	-56	-44.7	176	175.6	64.1	0	0	0	111.3	K164 E167 L168 V171 S223 I224 K231	K164-L227 HydrophobicContact CB-CD2 4.23Å; E167-L227 HydrophobicContact CB-CD1 3.59Å; L168-L227 HydrophobicContact CB-CD2 3.92Å; L168-L227 HydrophobicContact CD1-CD2 4.24Å; V171-L227 HydrophobicContact CG2-CB 4.34Å; V171-L227 HydrophobicContact CG2-CD1 4.25Å; S223-L227 WeakPolarHBondContact O-CB 3.47Å; S223-L227 PolarHBondContact O-N 3.24Å; I224-L227 WeakPolarHBondContact O-CB 2.98Å; I224-L227 PolarHBondContact O-N 3.28Å; L227-K231 PolarHBondContact O-N 3.15Å
228	M	77.8	Confident	64.8	Low	46 Å²	46	63.3 Å²	63.3	23%	0.227	33%	0.332	C	S	.	.	H	α-helix	trans	-71.3	-36	-179.2	-61.9	-51.1	-66.8	0	0	112.6	A158 V160 I224 V225 E226 K231 S232	A158-M228 HydrophobicContact CB-CE 3.31Å; V160-M228 HydrophobicContact CG2-CE 4.26Å; V160-M228 HydrophobicContact CG2-SD 4.33Å; I224-M228 HydrophobicContact CG2-CG 4.42Å; I224-M228 VanDerWaalsContact O-CG 3.28Å; I224-M228 WeakPolarHBondContact O-CG 3.45Å; I224-M228 PolarHBondContact O-N 3.26Å; V225-M228 PolarHBondContact O-N 2.78Å; E226-M228 VanDerWaalsContact C-N 3.28Å; E226-M228 PolarHBondContact O-N 3.27Å; M228-K231 WeakPolarHBondContact O-CB 3.33Å; M228-K231 PolarHBondContact O-N 2.83Å; M228-S232 PolarHBondContact O-N 3.44Å
229	K	77.8	Confident	62.1	Low	101 Å²	101	67.3 Å²	67.3	44%	0.439	35%	0.354	S	S	.	.	H	α-helix	trans	-66.1	-42.9	173.4	-75.6	177.1	179.7	175.4	0	112.5	V225 E226 K231 S232 N233	V225-K229 HydrophobicContact CG1-CD 4.03Å; V225-K229 HydrophobicContact CG1-CG 4.37Å; V225-K229 WeakPolarHBondContact O-CG 3.31Å; V225-K229 PolarHBondContact O-N 3.02Å; E226-K229 PolarHBondContact O-N 3.16Å; K229-K231 PolarHBondContact O-N 3.23Å; K229-K231 VanDerWaalsContact O-N 3.14Å; K229-S232 PolarHBondContact O-N 3.5Å; K229-S232 VanDerWaalsContact O-N 3.12Å; K229-S232 PolarHBondContact O-OG 3.44Å; K229-N233 PolarHBondContact O-N 2.9Å
230	K	70.2	Confident	59.2	Low	92 Å²	92	76 Å²	76	40%	0.4	39%	0.391	S	S	.	.	H	α-helix	trans	-55.4	-32.8	175.1	-75.6	-179.1	178	-179	0	110.8	E174 E226 G234	E174-K230 IonicContact OE1-NZ 3.75Å; E174-K230 IonicContact OE2-NZ 2.78Å; E174-K230 PolarHBondContact OE2-NZ 2.94Å; E226-K230 WeakPolarHBondContact O-CG 3.01Å; E226-K230 PolarHBondContact O-N 3.47Å; E226-K230 WeakPolarHBondContact OE1-CE 3.28Å; K230-G234 PolarHBondContact O-N 3.14Å; K230-G234 VanDerWaalsContact O-N 3.17Å
231	K	56.9	Low	56.3	Low	90 Å²	90	82.7 Å²	82.7	39%	0.391	43%	0.433	S	S	.	.	H	α-helix	trans	-75	-40.3	175.5	-165.3	-179	-180	-176.6	0	114.2	L227 M228 K229 N233 G234 W235	L227-K231 PolarHBondContact O-N 3.15Å; M228-K231 WeakPolarHBondContact O-CB 3.33Å; M228-K231 PolarHBondContact O-N 2.83Å; K229-K231 PolarHBondContact O-N 3.23Å; K229-K231 VanDerWaalsContact O-N 3.14Å; K231-N233 PolarHBondContact O-N 3.4Å; K231-G234 PolarHBondContact O-N 3.1Å; K231-G234 VanDerWaalsContact O-N 3.1Å; K231-W235 PolarHBondContact O-N 3.05Å
232	S	51.7	Low	53.6	Low	59 Å²	59	83.2 Å²	83.2	41%	0.413	45%	0.454	S	S	.	.	H	α-helix	trans	-60.6	-36.2	177.3	65.3	0	0	0	0	111.6	M228 K229 W235 N236	M228-S232 PolarHBondContact O-N 3.44Å; K229-S232 PolarHBondContact O-N 3.5Å; K229-S232 VanDerWaalsContact O-N 3.12Å; K229-S232 PolarHBondContact O-OG 3.44Å; S232-W235 PolarHBondContact O-N 3.22Å; S232-N236 PolarHBondContact O-N 2.94Å; S232-N236 VanDerWaalsContact O-N 3.07Å
233	N	41.6	Very low	50.7	Low	110 Å²	110	89.1 Å²	89.1	59%	0.588	49%	0.489	S	S	*	.	H	α-helix	trans	-74.4	-32.8	176.1	-65.8	-9.1	0	0	0	112.2	K229 K231 W235 N236 A237	K229-N233 PolarHBondContact O-N 2.9Å; K231-N233 PolarHBondContact O-N 3.4Å; N233-W235 VanDerWaalsContact C-N 3.35Å; N233-N236 PolarHBondContact O-N 3.12Å; N233-A237 WeakPolarHBondContact O-CB 3.39Å; N233-A237 PolarHBondContact O-N 3.24Å
234	G	32.3	Very low	47.9	Very low	45 Å²	45	94.5 Å²	94.5	46%	0.464	53%	0.527	S	S	.	.	H	α-helix	trans	-67	-31.6	171.5	0	0	0	0	0	113.9	K230 K231	K230-G234 PolarHBondContact O-N 3.14Å; K230-G234 VanDerWaalsContact O-N 3.17Å; K231-G234 PolarHBondContact O-N 3.1Å; K231-G234 VanDerWaalsContact O-N 3.1Å
235	W	24.7	Very low	45.2	Very low	212 Å²	212	102.2 Å²	102.2	80%	0.803	56%	0.563	S	S	*	*	H	α-helix	trans	-77.5	-35.8	175.2	-150	22.5	0	0	0	112	K231 S232 N233 A237	K231-W235 PolarHBondContact O-N 3.05Å; S232-W235 PolarHBondContact O-N 3.22Å; N233-W235 VanDerWaalsContact C-N 3.35Å; W235-A237 VanDerWaalsContact C-N 3.33Å
236	N	26.6	Very low	42.8	Very low	107 Å²	107	106.1 Å²	106.1	57%	0.572	59%	0.589	S	S	*	*	H	α-helix	trans	-72	-23.6	172.6	-75.6	-18.8	0	0	0	113.5	S232 N233 N238 I239	S232-N236 PolarHBondContact O-N 2.94Å; S232-N236 VanDerWaalsContact O-N 3.07Å; N233-N236 PolarHBondContact O-N 3.12Å; N236-N238 PolarHBondContact O-N 3.4Å; N236-I239 PolarHBondContact O-N 2.97Å
237	A	29.1	Very low	40.1	Very low	78 Å²	78	109.1 Å²	109.1	65%	0.645	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	-20.7	177.4	0	0	0	0	0	113.6	N233 W235	N233-A237 WeakPolarHBondContact O-CB 3.39Å; N233-A237 PolarHBondContact O-N 3.24Å; W235-A237 VanDerWaalsContact C-N 3.33Å
238	N	28.8	Very low	37.1	Very low	150 Å²	150	114.3 Å²	114.3	80%	0.802	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	3.8	175	-81	-18.9	0	0	0	114.3	N236	N236-N238 PolarHBondContact O-N 3.4Å
239	I	25.9	Very low	34.8	Very low	118 Å²	118	118 Å²	118	61%	0.605	67%	0.673	S	S	*	*	S	Bend	trans	-116	93.3	174.5	-55.6	-178.2	0	0	0	109.5	N236	N236-I239 PolarHBondContact O-N 2.97Å
240	K	26.9	Very low	32.2	Very low	185 Å²	185	118.4 Å²	118.4	80%	0.804	68%	0.684	S	S	*	*			trans	75.1	104.1	159.6	-64.3	-179.9	177.3	178	0	117.4	G242	K240-G242 PolarHBondContact O-N 3.4Å
241	T	24.3	Very low	30.3	Very low	152 Å²	152	120.3 Å²	120.3	93%	0.933	70%	0.703	S	S	*	*			trans	-31.7	114	130.9	49.8	0	0	0	0	111.8
242	G	25	Very low	28.8	Very low	68 Å²	68	124 Å²	124	70%	0.701	72%	0.719	S	S	*	*			trans	-171.4	92.9	176.1	0	0	0	0	0	110.1	K240 S244	K240-G242 PolarHBondContact O-N 3.4Å; G242-S244 PolarHBondContact O-N 3.03Å
243	T	23.7	Very low	27.6	Very low	146 Å²	146	127.6 Å²	127.6	90%	0.896	73%	0.734	S	S	*	*			trans	-48.1	126.7	176.5	-49	0	0	0	0	113.3
244	S	29.4	Very low	27	Very low	113 Å²	113	131.3 Å²	131.3	79%	0.79	75%	0.747	S	S	*	*			trans	-157.5	131.1	140.3	54.4	0	0	0	0	110.7	G242	G242-S244 PolarHBondContact O-N 3.03Å
245	E	27.1	Very low	26.8	Very low	175 Å²	175	135.6 Å²	135.6	82%	0.818	76%	0.76	S	S	*	*			trans	-56.7	163.3	-173.7	-89.4	172.5	148.2	0	0	116.8
246	P	30.8	Very low	27	Very low	119 Å²	119	129.7 Å²	129.7	77%	0.773	75%	0.751	S	S	*	*			trans	-76.9	131.2	-165.7	30.6	-33	0	0	0	112.1	T248	P246-T248 PolarHBondContact O-N 2.92Å
247	S	27.3	Very low	27.2	Very low	114 Å²	114	131.5 Å²	131.5	80%	0.797	76%	0.756	S	S	*	*			trans	-80.5	105.5	167.2	-59.2	0	0	0	0	109.1	T249	S247-T249 PolarHBondContact O-N 3.46Å
248	T	22	Very low	27.1	Very low	121 Å²	121	130.5 Å²	130.5	74%	0.742	75%	0.753	S	S	*	*			trans	-52.4	113.7	166.8	-42.3	0	0	0	0	110	P246 T250	P246-T248 PolarHBondContact O-N 2.92Å; T248-T250 HydrophobicContact CG2-CG2 4.38Å
249	T	28.4	Very low	27.2	Very low	122 Å²	122	127.5 Å²	127.5	75%	0.748	74%	0.737	S	S	*	*			trans	-115.3	94.6	154.6	-42.1	0	0	0	0	107.5	S247 V251	S247-T249 PolarHBondContact O-N 3.46Å; T249-V251 HydrophobicContact CG2-CG2 4.31Å; T249-V251 PolarHBondContact O-N 2.95Å
250	T	22.6	Very low	27.3	Very low	110 Å²	110	127.3 Å²	127.3	68%	0.675	74%	0.743	S	S	*	*			trans	-61.4	103.4	156.3	34.9	0	0	0	0	108.3	T248	T248-T250 HydrophobicContact CG2-CG2 4.38Å
251	V	31.1	Very low	27.9	Very low	133 Å²	133	120.2 Å²	120.2	81%	0.806	72%	0.717	S	S	*	*			trans	-94.7	106	148.8	-178.1	0	0	0	0	105.7	T249	T249-V251 HydrophobicContact CG2-CG2 4.31Å; T249-V251 PolarHBondContact O-N 2.95Å
252	K	24.6	Very low	28.6	Very low	167 Å²	167	116.5 Å²	116.5	73%	0.726	69%	0.691	S	S	*	*			trans	-70	142.1	170	-75.5	177.4	169.4	179.6	0	109.2
253	D	27.3	Very low	29.6	Very low	135 Å²	135	113.9 Å²	113.9	72%	0.722	66%	0.66	S	S	*	*			trans	43.4	103.4	146	-56.7	-30.2	0	0	0	117.8
254	E	28.8	Very low	30.8	Very low	187 Å²	187	112 Å²	112	87%	0.874	64%	0.637	S	S	*	*			trans	-127.1	99.7	132.7	-75.2	-167.6	169	0	0	109.1	S256	E254-S256 PolarHBondContact O-N 3.33Å
255	N	27.9	Very low	31.9	Very low	135 Å²	135	106.7 Å²	106.7	72%	0.722	60%	0.599	S	S	*	*			trans	-52.7	79	150	-81.3	-12.5	0	0	0	109	H257	N255-H257 PolarHBondContact O-N 3.33Å
256	S	30.1	Very low	33	Very low	89 Å²	89	99.2 Å²	99.2	62%	0.622	57%	0.567	S	S	*	*			trans	-80.2	76	154.1	73.9	0	0	0	0	106.6	E254 G258	E254-S256 PolarHBondContact O-N 3.33Å; S256-G258 PolarHBondContact O-N 2.95Å
257	H	29.9	Very low	33.8	Very low	144 Å²	144	95 Å²	95	67%	0.667	54%	0.537	S	S	*	.			trans	-44.4	114.5	155.7	-81.5	-85.4	0	0	0	106.2	N255 L259	N255-H257 PolarHBondContact O-N 3.33Å; H257-L259 PolarHBondContact O-N 3.14Å
258	G	28.4	Very low	34.7	Very low	58 Å²	58	90 Å²	90	60%	0.598	50%	0.501	S	S	*	.			trans	-52	106.1	179.7	0	0	0	0	0	108.6	S256	S256-G258 PolarHBondContact O-N 2.95Å
259	L	28.9	Very low	36.1	Very low	86 Å²	86	87.1 Å²	87.1	45%	0.45	48%	0.478	S	S	.	.			trans	-62.7	125.2	-170.3	-71.6	167.3	0	0	0	109.7	E48 H257 S261	E48-L259 HydrophobicContact CB-CD1 3.66Å; E48-L259 VanDerWaalsContact CD-CD1 3.42Å; E48-L259 HydrophobicContact CG-CD1 4.04Å; E48-L259 WeakPolarHBondContact OE1-CD2 3.09Å; E48-L259 WeakPolarHBondContact OE2-CB 3.28Å; E48-L259 VanDerWaalsContact OE2-CD1 3.24Å; E48-L259 WeakPolarHBondContact OE2-CD1 3.15Å; E48-L259 WeakPolarHBondContact OE2-CD2 3.08Å; E48-L259 WeakPolarHBondContact OE2-CG 3.42Å; H257-L259 PolarHBondContact O-N 3.14Å; L259-S261 VanDerWaalsContact C-N 3.28Å; L259-S261 PolarHBondContact O-N 3.32Å; L259-S261 PolarHBondContact O-OG 2.86Å
260	P	29.7	Very low	36.7	Very low	114 Å²	114	86.3 Å²	86.3	74%	0.74	47%	0.469	S	S	*	.			trans	-69.6	91.7	172.8	26.7	-29.7	0	0	0	108.3	I262	P260-I262 PolarHBondContact O-N 3.28Å
261	S	38.3	Very low	37.2	Very low	36 Å²	36	84.1 Å²	84.1	25%	0.252	45%	0.453	S	S	.	.			trans	-75.3	122.9	176.5	16.8	0	0	0	0	108.4	L259 I263	L259-S261 VanDerWaalsContact C-N 3.28Å; L259-S261 PolarHBondContact O-N 3.32Å; L259-S261 PolarHBondContact O-OG 2.86Å; S261-I263 PolarHBondContact O-N 3.01Å
262	I	39.5	Very low	37.1	Very low	75 Å²	75	87 Å²	87	39%	0.385	46%	0.455	S	S	.	.			trans	-85	109.7	161	-60.1	-164.4	0	0	0	106	Y45 R47 P260	Y45-I262 VanDerWaalsContact O-O 3.12Å; R47-I262 HydrophobicContact CG-CB 4.33Å; P260-I262 PolarHBondContact O-N 3.28Å
263	I	45.2	Very low	37.5	Very low	12 Å²	12	80.9 Å²	80.9	6%	0.062	43%	0.431	C	S	.	.			trans	-74.8	124.4	174.2	-73.6	172.4	0	0	0	107.4	V44 V72 V75 L139 S261 I265	V44-I263 HydrophobicContact CB-CG2 4.29Å; V44-I263 HydrophobicContact CG1-CB 3.92Å; V44-I263 HydrophobicContact CG1-CG1 3.89Å; V44-I263 HydrophobicContact CG1-CG2 3.48Å; V44-I263 VanDerWaalsContact CG1-CG2 3.48Å; V44-I263 HydrophobicContact CG2-CG2 3.87Å; V72-I263 HydrophobicContact CB-CD1 4.36Å; V72-I263 HydrophobicContact CG2-CD1 3.73Å; V75-I263 HydrophobicContact CB-CD1 4.02Å; V75-I263 HydrophobicContact CG1-CB 4.34Å; V75-I263 HydrophobicContact CG1-CG2 4.29Å; V75-I263 HydrophobicContact CG2-CD1 3.76Å; L139-I263 WeakPolarHBondContact CD1-O 3.31Å; L139-I263 WeakPolarHBondContact CD2-O 3.45Å; S261-I263 PolarHBondContact O-N 3.01Å; I263-I265 HydrophobicContact CG2-CG1 4.19Å
264	R	50.6	Low	37.4	Very low	107 Å²	107	79.7 Å²	79.7	40%	0.404	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	106.5	171.9	-54.8	-146.8	159.5	-175.9	-7.3	112.8	V44 Y45 L139 S266	V44-R264 CarbonylContact C-O 3.56Å; V44-R264 WeakPolarHBondContact CA-O 3.43Å; Y45-R264 HydrophobicContact CD2-CB 3.87Å; Y45-R264 HydrophobicContact CG-CB 4.23Å; Y45-R264 PolarHBondContact N-O 2.9Å; Y45-R264 PolarHBondContact O-N 2.78Å; L139-R264 VanDerWaalsContact CB-CA 3.49Å; L139-R264 HydrophobicContact CB-CB 3.63Å; L139-R264 HydrophobicContact CB-CG 4.32Å; L139-R264 HydrophobicContact CD1-CB 4.49Å; L139-R264 VanDerWaalsContact CD2-CA 3.43Å; L139-R264 HydrophobicContact CD2-CB 3.56Å; L139-R264 HydrophobicContact CD2-CG 3.33Å; L139-R264 VanDerWaalsContact CG-CA 3.5Å; L139-R264 HydrophobicContact CG-CB 3.93Å; L139-R264 HydrophobicContact CG-CG 4.27Å; R264-S266 PolarHBondContact O-N 3.29Å
265	I	50.8	Low	37.5	Very low	1 Å²	1	73 Å²	73	1%	0.005	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	101.4	176.9	-55.3	174.1	0	0	0	109.4	L42 F43 L79 L134 L139 I263	L42-I265 HydrophobicContact CD1-CB 4.24Å; L42-I265 HydrophobicContact CD1-CD1 4.1Å; L42-I265 HydrophobicContact CD1-CG1 3.96Å; L42-I265 HydrophobicContact CD1-CG2 3.39Å; L42-I265 HydrophobicContact CG-CG2 4.42Å; F43-I265 CarbonylContact O-C 3.39Å; F43-I265 VanDerWaalsContact O-CA 3.28Å; F43-I265 WeakPolarHBondContact O-CA 3.46Å; L79-I265 HydrophobicContact CD1-CD1 3.63Å; L134-I265 HydrophobicContact CB-CD1 4.11Å; L134-I265 HydrophobicContact CB-CG2 4.33Å; L134-I265 HydrophobicContact CD2-CD1 3.89Å; L134-I265 HydrophobicContact CG-CD1 4.46Å; L139-I265 WeakPolarHBondContact CB-O 3.36Å; L139-I265 HydrophobicContact CD1-CB 4.14Å; L139-I265 HydrophobicContact CD1-CG1 4.12Å; I263-I265 HydrophobicContact CG2-CG1 4.19Å
266	S	50.9	Low	37.4	Very low	19 Å²	19	69.2 Å²	69.2	13%	0.133	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	-28.3	179.5	52.6	0	0	0	0	114.4	F43 Y45 R264	F43-S266 WeakPolarHBondContact CB-OG 3.03Å; F43-S266 PolarHBondContact O-N 3.01Å; Y45-S266 WeakPolarHBondContact CE2-OG 3.42Å; R264-S266 PolarHBondContact O-N 3.29Å
267	E	48.2	Very low	37.2	Very low	30 Å²	30	68.2 Å²	68.2	14%	0.14	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	144.2	-174	-59.1	-166.4	163.8	0	0	112.3	F43 S143	F43-E267 HydrophobicContact CB-CB 4.09Å; F43-E267 HydrophobicContact CD2-CB 3.56Å; F43-E267 WeakPolarHBondContact CD2-O 3.44Å; F43-E267 HydrophobicContact CE2-CB 4.15Å; F43-E267 HydrophobicContact CG-CB 3.91Å; F43-E267 PolarHBondContact N-O 3.35Å; S143-E267 WeakPolarHBondContact CA-OE1 3.39Å; S143-E267 PolarHBondContact N-OE1 3.41Å
268	L	46.7	Very low	37.1	Very low	9 Å²	9	67.2 Å²	67.2	5%	0.047	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	131.3	167.8	-79.2	159.2	0	0	0	110.7	T40 D41 L42 F127 K131 L134 E135	T40-L268 HydrophobicContact CG2-CD2 3.81Å; T40-L268 WeakPolarHBondContact OG1-CD2 2.91Å; D41-L268 VanDerWaalsContact O-CA 3.31Å; D41-L268 WeakPolarHBondContact O-CA 3.43Å; D41-L268 WeakPolarHBondContact O-CD2 3.13Å; L42-L268 HydrophobicContact CB-CD2 4.29Å; L42-L268 HydrophobicContact CD1-CD2 3.61Å; L42-L268 HydrophobicContact CD1-CG 4.05Å; F127-L268 HydrophobicContact CZ-CB 4.43Å; K131-L268 HydrophobicContact CB-CD1 4.47Å; K131-L268 HydrophobicContact CG-CB 4.31Å; K131-L268 HydrophobicContact CG-CD1 4.38Å; L134-L268 HydrophobicContact CB-CD1 3.56Å; L134-L268 HydrophobicContact CD1-CD1 3.62Å; L134-L268 HydrophobicContact CD1-CD2 4.4Å; L134-L268 HydrophobicContact CG-CD1 4.19Å; E135-L268 HydrophobicContact CG-CD1 4.49Å
269	K	51	Low	37	Very low	61 Å²	61	68.9 Å²	68.9	27%	0.265	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	127.8	176.3	-71	-178	-176	167.5	0	112.5	T40 D41 F43 L271	T40-K269 WeakPolarHBondContact CA-O 3.44Å; T40-K269 WeakPolarHBondContact CB-O 2.97Å; T40-K269 PolarHBondContact OG1-N 3.37Å; T40-K269 PolarHBondContact OG1-O 2.93Å; D41-K269 HydrophobicContact CB-CB 4.41Å; D41-K269 PolarHBondContact N-O 3.26Å; D41-K269 PolarHBondContact O-N 3.26Å; F43-K269 HydrophobicContact CE2-CD 4.49Å; K269-L271 PolarHBondContact O-N 3.32Å
270	N	40.5	Very low	36.9	Very low	105 Å²	105	67.3 Å²	67.3	56%	0.561	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.2	107.2	170.6	-85.6	-40.7	0	0	0	111.7	F127	F127-N270 VanDerWaalsContact CD1-CG 3.46Å; F127-N270 WeakPolarHBondContact CD1-ND2 3.29Å; F127-N270 WeakPolarHBondContact CD1-OD1 3.4Å; F127-N270 WeakPolarHBondContact CD2-OD1 3.31Å; F127-N270 HydrophobicContact CE1-CB 4.41Å; F127-N270 WeakPolarHBondContact CE1-ND2 3.46Å; F127-N270 WeakPolarHBondContact CE1-OD1 3.28Å; F127-N270 WeakPolarHBondContact CE2-OD1 3.47Å; F127-N270 WeakPolarHBondContact CG-OD1 3.14Å; F127-N270 HydrophobicContact CZ-CB 4.46Å; F127-N270 VanDerWaalsContact CZ-CG 3.48Å; F127-N270 WeakPolarHBondContact CZ-OD1 3.48Å
271	L	32.5	Very low	36.7	Very low	64 Å²	64	69.5 Å²	69.5	34%	0.335	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	100	160.3	-102.6	144.1	0	0	0	108.2	V39 K269 V273	V39-L271 PolarHBondContact N-O 2.93Å; V39-L271 CarbonylContact O-C 3.58Å; V39-L271 WeakPolarHBondContact O-CB 3.49Å; V39-L271 PolarHBondContact O-N 2.92Å; K269-L271 PolarHBondContact O-N 3.32Å; L271-V273 HydrophobicContact CB-CG2 4.01Å; L271-V273 HydrophobicContact CD2-CG2 3.93Å; L271-V273 PolarHBondContact O-N 3.17Å
272	K	29.3	Very low	36.1	Very low	192 Å²	192	68.6 Å²	68.6	84%	0.835	36%	0.356	S	S	*	.			trans	-70.9	91.8	157.4	-81.2	-169	174.9	-169.4	0	106.6	N274	K272-N274 PolarHBondContact O-N 3.49Å
273	V	32.7	Very low	35.3	Very low	40 Å²	40	66.3 Å²	66.3	24%	0.242	35%	0.346	C	S	.	.			trans	-85.8	111.6	169.4	-168.7	0	0	0	0	106.6	L271 Y275	L271-V273 HydrophobicContact CB-CG2 4.01Å; L271-V273 HydrophobicContact CD2-CG2 3.93Å; L271-V273 PolarHBondContact O-N 3.17Å; V273-Y275 HydrophobicContact CB-CD2 3.61Å; V273-Y275 HydrophobicContact CB-CE2 3.32Å; V273-Y275 HydrophobicContact CB-CG 4.4Å; V273-Y275 HydrophobicContact CG1-CD1 3.95Å; V273-Y275 HydrophobicContact CG1-CD2 3.53Å; V273-Y275 HydrophobicContact CG1-CE1 3.74Å; V273-Y275 HydrophobicContact CG1-CE2 3.33Å; V273-Y275 HydrophobicContact CG1-CG 3.85Å; V273-Y275 VanDerWaalsContact CG1-CZ 3.43Å; V273-Y275 HydrophobicContact CG2-CE2 3.94Å; V273-Y275 PolarHBondContact O-N 2.64Å
274	N	26.4	Very low	34.5	Very low	109 Å²	109	66.8 Å²	66.8	58%	0.583	35%	0.348	S	S	*	.			trans	-74.9	85.2	169	-137.4	7.1	0	0	0	106.3	K272 T276	K272-N274 PolarHBondContact O-N 3.49Å; N274-T276 VanDerWaalsContact C-N 3.3Å; N274-T276 PolarHBondContact O-N 3.3Å
275	Y	30.1	Very low	33.2	Very low	46 Å²	46	64.4 Å²	64.4	18%	0.18	35%	0.348	C	S	.	.			trans	-73.8	89.8	174.3	-76.7	-75.7	0	0	0	108.1	S32 V39 Y201 V273 G277	S32-Y275 PolarHBondContact OG-O 3.45Å; V39-Y275 HydrophobicContact CG2-CE2 3.87Å; Y201-Y275 HydrophobicContact CD1-CD1 4.41Å; Y201-Y275 AromaticContact CD1-CD2 3.82Å; Y201-Y275 HydrophobicContact CD1-CD2 3.82Å; Y201-Y275 HydrophobicContact CD1-CE2 4.32Å; Y201-Y275 AromaticContact CD1-CG 3.86Å; Y201-Y275 HydrophobicContact CD1-CG 3.86Å; Y201-Y275 HydrophobicContact CD2-CD1 4.47Å; Y201-Y275 HydrophobicContact CE1-CD1 4.13Å; Y201-Y275 AromaticContact CE1-CD2 3.31Å; Y201-Y275 HydrophobicContact CE1-CD2 3.31Å; Y201-Y275 HydrophobicContact CE1-CE1 4.22Å; Y201-Y275 AromaticContact CE1-CE2 3.37Å; Y201-Y275 HydrophobicContact CE1-CE2 3.37Å; Y201-Y275 AromaticContact CE1-CG 3.7Å; Y201-Y275 HydrophobicContact CE1-CG 3.7Å; Y201-Y275 AromaticContact CE1-CZ 3.86Å; Y201-Y275 HydrophobicContact CE2-CD1 4.2Å; Y201-Y275 HydrophobicContact CE2-CE1 4.05Å; Y201-Y275 HydrophobicContact CG-CG 4.33Å; Y201-Y275 AromaticContact CZ-CD2 3.83Å; Y201-Y275 AromaticContact CZ-CE1 3.73Å; Y201-Y275 AromaticContact CZ-CE2 3.51Å; Y201-Y275 AromaticContact CZ-CZ 3.47Å; Y201-Y275 VanDerWaalsContact CZ-CZ 3.47Å; Y201-Y275 VanDerWaalsContact OH-CE2 3.25Å; Y201-Y275 WeakPolarHBondContact OH-CE2 3.42Å; Y201-Y275 PolarHBondContact OH-OH 2.9Å; Y201-Y275 VanDerWaalsContact OH-OH 3.05Å; V273-Y275 HydrophobicContact CB-CD2 3.61Å; V273-Y275 HydrophobicContact CB-CE2 3.32Å; V273-Y275 HydrophobicContact CB-CG 4.4Å; V273-Y275 HydrophobicContact CG1-CD1 3.95Å; V273-Y275 HydrophobicContact CG1-CD2 3.53Å; V273-Y275 HydrophobicContact CG1-CE1 3.74Å; V273-Y275 HydrophobicContact CG1-CE2 3.33Å; V273-Y275 HydrophobicContact CG1-CG 3.85Å; V273-Y275 VanDerWaalsContact CG1-CZ 3.43Å; V273-Y275 HydrophobicContact CG2-CE2 3.94Å; V273-Y275 PolarHBondContact O-N 2.64Å; Y275-G277 PolarHBondContact O-N 3.25Å
276	T	25.7	Very low	32	Very low	56 Å²	56	69.7 Å²	69.7	34%	0.344	38%	0.382	S	S	.	.			trans	-60.5	122.6	157.3	49.9	0	0	0	0	106.2	N274 H278	N274-T276 VanDerWaalsContact C-N 3.3Å; N274-T276 PolarHBondContact O-N 3.3Å; T276-H278 PolarHBondContact O-CD2 3.14Å; T276-H278 PolarHBondContact O-N 3.18Å; T276-H278 PolarHBondContact O-ND1 3.17Å; T276-H278 PolarHBondContact O-NE2 2.94Å; T276-H278 PolarHBondContact OG1-CE1 3.2Å; T276-H278 PolarHBondContact OG1-NE2 3.12Å
277	G	25.7	Very low	30.9	Very low	68 Å²	68	74 Å²	74	70%	0.701	40%	0.403	S	S	*	.			trans	-40.4	111	-179.7	0	0	0	0	0	111.1	Y275	Y275-G277 PolarHBondContact O-N 3.25Å
278	H	28.6	Very low	29.9	Very low	124 Å²	124	84 Å²	84	57%	0.574	44%	0.44	S	S	*	.			trans	-100	116.9	-177.9	-72.3	-56.6	0	0	0	107.9	T276 I280	T276-H278 PolarHBondContact O-CD2 3.14Å; T276-H278 PolarHBondContact O-N 3.18Å; T276-H278 PolarHBondContact O-ND1 3.17Å; T276-H278 PolarHBondContact O-NE2 2.94Å; T276-H278 PolarHBondContact OG1-CE1 3.2Å; T276-H278 PolarHBondContact OG1-NE2 3.12Å; H278-I280 PolarHBondContact O-N 3.3Å
279	C	25.6	Very low	28.9	Very low	92 Å²	92	88.6 Å²	88.6	62%	0.622	47%	0.473	S	S	*	.			trans	-55.9	125.2	163	-64.1	0	0	0	0	108.3	D198 Y281	D198-C279 PolarHBondContact OD1-SG 3.45Å; C279-Y281 PolarHBondContact O-N 2.93Å; C279-Y281 VanDerWaalsContact O-N 3.1Å
280	I	27.7	Very low	27.8	Very low	54 Å²	54	93 Å²	93	28%	0.277	50%	0.499	S	S	.	.			trans	-76.9	97.5	166.2	-61.5	176.7	0	0	0	106	I216 I220 H278 A282	I216-I280 HydrophobicContact CG2-CD1 3.57Å; I220-I280 HydrophobicContact CD1-CD1 4.18Å; H278-I280 PolarHBondContact O-N 3.3Å; I280-A282 PolarHBondContact O-N 3.1Å
281	Y	23.9	Very low	27.3	Very low	159 Å²	159	98 Å²	98	62%	0.624	52%	0.516	S	S	*	.			trans	-82.9	97.9	172.2	-168.2	-104.3	0	0	0	109	T196 C279 S283	T196-Y281 HydrophobicContact CG2-CE2 4.34Å; C279-Y281 PolarHBondContact O-N 2.93Å; C279-Y281 VanDerWaalsContact O-N 3.1Å; Y281-S283 VanDerWaalsContact CE1-CB 3.45Å; Y281-S283 PolarHBondContact O-N 3.07Å
282	A	26.7	Very low	27.2	Very low	18 Å²	18	107.8 Å²	107.8	15%	0.149	56%	0.556	C	S	.	*			trans	-87.2	99.3	167.6	0	0	0	0	0	108.7	I280 F284	I280-A282 PolarHBondContact O-N 3.1Å; A282-F284 HydrophobicContact CB-CE2 4Å; A282-F284 HydrophobicContact CB-CZ 4.03Å
283	S	22.5	Very low	27.1	Very low	27 Å²	27	103.6 Å²	103.6	19%	0.189	54%	0.542	C	S	.	.	P	Polyproline II helix	trans	-97.8	132.4	167.9	49.9	0	0	0	0	110.3	Y281	Y281-S283 VanDerWaalsContact CE1-CB 3.45Å; Y281-S283 PolarHBondContact O-N 3.07Å
284	F	29	Very low	26.8	Very low	22 Å²	22	106.9 Å²	106.9	10%	0.096	56%	0.558	C	S	.	*	P	Polyproline II helix	trans	-103.4	134.6	174.9	-54.6	-89.6	0	0	0	107.5	G154 F156 A282	G154-F284 VanDerWaalsContact O-CD1 3.28Å; G154-F284 WeakPolarHBondContact O-CD1 3.39Å; F156-F284 AromaticContact CD2-CD1 3.8Å; F156-F284 HydrophobicContact CD2-CD1 3.8Å; F156-F284 AromaticContact CD2-CE1 3.45Å; F156-F284 HydrophobicContact CD2-CE1 3.45Å; F156-F284 VanDerWaalsContact CD2-CE1 3.45Å; F156-F284 HydrophobicContact CD2-CZ 4.21Å; F156-F284 HydrophobicContact CE2-CD1 4.39Å; F156-F284 AromaticContact CE2-CE1 3.62Å; F156-F284 HydrophobicContact CE2-CE1 3.62Å; F156-F284 HydrophobicContact CE2-CZ 4.26Å; A282-F284 HydrophobicContact CB-CE2 4Å; A282-F284 HydrophobicContact CB-CZ 4.03Å
285	S	22.6	Very low	26.8	Very low	57 Å²	57	106.8 Å²	106.8	40%	0.399	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-80.4	130.8	179.6	178.3	0	0	0	0	109.7	Y155 D287	Y155-S285 WeakPolarHBondContact CE1-O 3.47Å; Y155-S285 VanDerWaalsContact OH-CB 3.3Å; Y155-S285 WeakPolarHBondContact OH-CB 3.4Å; Y155-S285 PolarHBondContact OH-OG 3.47Å; Y155-S285 VanDerWaalsContact OH-OG 3.06Å; S285-D287 PolarHBondContact O-N 2.93Å
286	P	25.3	Very low	26.6	Very low	111 Å²	111	110.4 Å²	110.4	72%	0.721	58%	0.578	S	S	*	*			trans	-81.5	68.2	169.3	34.1	-32.4	0	0	0	109.5	W288	P286-W288 VanDerWaalsContact C-N 3.34Å; P286-W288 PolarHBondContact O-N 3.18Å
287	D	28.1	Very low	26.7	Very low	109 Å²	109	113.8 Å²	113.8	58%	0.583	59%	0.593	S	S	*	*			trans	-79	104.8	144.5	-72.6	-46.3	0	0	0	104.9	Y155 S285	Y155-D287 HydrophobicContact CE1-CB 3.8Å; Y155-D287 WeakPolarHBondContact CE1-O 3.43Å; Y155-D287 WeakPolarHBondContact OH-CB 3.41Å; Y155-D287 PolarHBondContact OH-N 3.21Å; Y155-D287 VanDerWaalsContact OH-N 3.12Å; Y155-D287 PolarHBondContact OH-OD2 3.31Å; S285-D287 PolarHBondContact O-N 2.93Å
288	W	28	Very low	26.7	Very low	242 Å²	242	116.9 Å²	116.9	92%	0.917	59%	0.586	S	S	*	*				-168.4	78.3	122.3	-91.1	28.8	0	0	0	105	P286 D290	P286-W288 VanDerWaalsContact C-N 3.34Å; P286-W288 PolarHBondContact O-N 3.18Å; W288-D290 PolarHBondContact O-N 3.24Å
289	S	25.4	Very low	26.6	Very low	104 Å²	104	116.4 Å²	116.4	73%	0.727	59%	0.587	S	S	*	*			trans	-63.7	121	153.9	61	0	0	0	0	107.1	K291	S289-K291 PolarHBondContact O-N 3.06Å
290	D	27.1	Very low	26.7	Very low	154 Å²	154	118.2 Å²	118.2	82%	0.824	58%	0.584	S	S	*	*			trans	-30.4	102.4	170.8	-63	-50.9	0	0	0	112.8	W288 K292	W288-D290 PolarHBondContact O-N 3.24Å; D290-K292 VanDerWaalsContact C-N 3.32Å; D290-K292 PolarHBondContact O-N 3.49Å
291	K	30	Very low	26.6	Very low	209 Å²	209	123.6 Å²	123.6	91%	0.909	61%	0.61	S	S	*	*			trans	-75.2	99	151	-80.9	-171.7	179	177.1	0	105.9	S289	S289-K291 PolarHBondContact O-N 3.06Å
292	K	30.2	Very low	26.8	Very low	271 Å²	271	120.4 Å²	120.4	100%	1.178	61%	0.608	S	S	*	*			trans	-39.7	0	166.4	-77	179.4	173.6	176.5	0	113.1	D290	D290-K292 VanDerWaalsContact C-N 3.32Å; D290-K292 PolarHBondContact O-N 3.49Å

Retrieved 292 of 292 residues in 372.1 ms (Link to these results)

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