A0A3Q0KFG0_SCHMA Loading...

Protein phosphatase AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KFG0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 387 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	37.3	Very low	34.7	Very low	232 Å²	232	156.4 Å²	156.4	100%	1.143	84%	0.835	S	S	*	*				0	88.2	0	-61.8	179.4	79.2	0	0	106.1
2	S	33.8	Very low	35.1	Very low	115 Å²	115	160.2 Å²	160.2	80%	0.804	84%	0.839	S	S	*	*				74.8	131.5	105.7	62.9	0	0	0	0	111.6
3	S	34.2	Very low	34.9	Very low	107 Å²	107	166.1 Å²	166.1	75%	0.748	84%	0.844	S	S	*	*			cis	-175	123.1	9.7	171.6	0	0	0	0	103.8
4	L	31.3	Very low	35.2	Very low	149 Å²	149	162.1 Å²	162.1	78%	0.78	83%	0.834	S	S	*	*				63.7	113.9	85.3	-140.5	100.7	0	0	0	116.6
5	M	34	Very low	35.4	Very low	160 Å²	160	159.6 Å²	159.6	79%	0.788	83%	0.829	S	S	*	*			trans	62.5	131	139.4	-66.8	-91.1	-164.7	0	0	122.9
6	S	37.3	Very low	35.2	Very low	109 Å²	109	155.8 Å²	155.8	76%	0.762	82%	0.821	S	S	*	*				-173.9	120.8	106.9	75.1	0	0	0	0	110.1
7	Q	35.1	Very low	35.3	Very low	171 Å²	171	159.1 Å²	159.1	80%	0.799	83%	0.827	S	S	*	*				57.1	124.4	100.6	-69.9	-170	-4.7	0	0	116.8
8	I	37.6	Very low	35.2	Very low	165 Å²	165	158.6 Å²	158.6	85%	0.846	83%	0.831	S	S	*	*				-175.3	130	109.7	-87.5	153.4	0	0	0	110.5
9	R	29.1	Very low	35.2	Very low	243 Å²	243	154.1 Å²	154.1	92%	0.917	83%	0.827	S	S	*	*			trans	-83.6	143.4	167.6	-74.6	172.2	173	163.8	-2.9	109.2
10	S	39.8	Very low	35	Very low	108 Å²	108	150.4 Å²	150.4	76%	0.755	83%	0.826	S	S	*	*			trans	-147.6	140.5	141.1	85.6	0	0	0	0	111.3
11	L	31.7	Very low	35	Very low	161 Å²	161	148 Å²	148	84%	0.843	82%	0.821	S	S	*	*			trans	-89.1	130.7	-172.6	-70.6	153	0	0	0	109.6
12	F	39.5	Very low	35.2	Very low	202 Å²	202	142.7 Å²	142.7	89%	0.886	80%	0.797	S	S	*	*			trans	-145.3	114.1	152	-78.7	-75.1	0	0	0	110.6
13	R	33.2	Very low	35.7	Very low	237 Å²	237	143.8 Å²	143.8	89%	0.894	79%	0.794	S	S	*	*			trans	-121.8	157.6	151	-109.4	-174.5	178.3	-178.1	0.5	104.4
14	P	38.7	Very low	36.4	Very low	110 Å²	110	145.5 Å²	145.5	71%	0.714	80%	0.795	S	S	*	*			cis	-149.4	-168.9	33.4	27.8	0.2	0	0	0	115.8
15	V	38.6	Very low	37.4	Very low	125 Å²	125	141.1 Å²	141.1	76%	0.758	78%	0.776	S	S	*	*			trans	97.9	98.9	150.5	-166.1	0	0	0	0	119.2
16	S	31.8	Very low	38.1	Very low	99 Å²	99	140.2 Å²	140.2	69%	0.692	77%	0.77	S	S	*	*			trans	20.6	120.8	144.9	61.1	0	0	0	0	121.2
17	K	37.5	Very low	38.8	Very low	212 Å²	212	137.9 Å²	137.9	92%	0.922	76%	0.758	S	S	*	*			trans	-128	121.6	134	-101.8	-179.1	178.3	177.7	0	109.7
18	V	33.1	Very low	39.3	Very low	150 Å²	150	136.1 Å²	136.1	91%	0.909	75%	0.748	S	S	*	*			trans	-63.5	124.2	167.9	170.3	0	0	0	0	108
19	G	34.9	Very low	40.1	Very low	73 Å²	73	132 Å²	132	75%	0.753	73%	0.727	S	S	*	*			trans	-152.3	84.8	173.1	0	0	0	0	0	108.2
20	G	31	Very low	41.5	Very low	79 Å²	79	130.8 Å²	130.8	81%	0.814	72%	0.722	S	S	*	*			trans	-79.4	114.4	171.9	0	0	0	0	0	109.7
21	S	34.8	Very low	43.1	Very low	102 Å²	102	135.9 Å²	135.9	71%	0.713	73%	0.725	S	S	*	*			trans	-173.1	132.3	154.2	-149.1	0	0	0	0	110.4
22	N	41.4	Very low	45.8	Very low	120 Å²	120	129.3 Å²	129.3	64%	0.642	69%	0.691	S	S	*	*			trans	86.4	18.8	161.3	-68.8	-2.1	0	0	0	123.9	S25	N22-S25 PolarHBondContact O-OG 3.05Å
23	N	44.8	Very low	48.4	Very low	138 Å²	138	122.4 Å²	122.4	74%	0.738	66%	0.66	S	S	*	*	H	α-helix	trans	-80.7	-15.8	169.5	-75.2	-3.5	0	0	0	114.8
24	N	48.2	Very low	51.4	Low	142 Å²	142	111.1 Å²	111.1	76%	0.759	62%	0.617	S	S	*	*	H	α-helix	trans	-80.9	-26.6	-177.4	-75.1	-12.9	0	0	0	113.2	F28	N24-F28 WeakPolarHBondContact O-CB 3.09Å; N24-F28 PolarHBondContact O-N 2.97Å; N24-F28 VanDerWaalsContact O-N 3.09Å
25	S	52.9	Low	54.1	Low	57 Å²	57	106.3 Å²	106.3	40%	0.399	59%	0.586	S	S	.	*	H	α-helix	trans	-71.8	-45.7	-179.4	46.5	0	0	0	0	112.1	N22 A27 F28 L29	N22-S25 PolarHBondContact O-OG 3.05Å; S25-A27 PolarHBondContact O-N 2.78Å; S25-F28 PolarHBondContact O-N 3.46Å; S25-L29 WeakPolarHBondContact O-CG 3.23Å; S25-L29 PolarHBondContact O-N 3.26Å
26	E	49	Very low	56.8	Low	141 Å²	141	100.9 Å²	100.9	66%	0.659	55%	0.552	S	S	*	*	H	α-helix	trans	-65.1	-39.8	177.6	-78.7	-169	154.8	0	0	112.8	F28 R30	E26-F28 VanDerWaalsContact C-N 3.3Å; E26-F28 PolarHBondContact O-N 3.18Å; E26-R30 PolarHBondContact O-N 3.17Å
27	A	51	Low	59.8	Low	60 Å²	60	98.1 Å²	98.1	50%	0.496	53%	0.53	S	S	.	.	H	α-helix	trans	-69.1	-30.4	176.8	0	0	0	0	0	112.4	S25	S25-A27 PolarHBondContact O-N 2.78Å
28	F	47.3	Very low	62.5	Low	135 Å²	135	90.2 Å²	90.2	59%	0.592	50%	0.499	S	S	*	.	H	α-helix	trans	-75	-40.4	176.9	-174.3	-96.5	0	0	0	112.2	N24 S25 E26 R30 R31 V32	N24-F28 WeakPolarHBondContact O-CB 3.09Å; N24-F28 PolarHBondContact O-N 2.97Å; N24-F28 VanDerWaalsContact O-N 3.09Å; S25-F28 PolarHBondContact O-N 3.46Å; E26-F28 VanDerWaalsContact C-N 3.3Å; E26-F28 PolarHBondContact O-N 3.18Å; F28-R30 PolarHBondContact O-N 3.16Å; F28-R30 VanDerWaalsContact O-N 3.16Å; F28-R31 PolarHBondContact O-N 3.33Å; F28-V32 HydrophobicContact CE1-CG2 4.07Å; F28-V32 HydrophobicContact CZ-CG2 4.28Å
29	L	53.1	Low	65.5	Low	79 Å²	79	83.3 Å²	83.3	41%	0.414	46%	0.458	S	S	.	.	H	α-helix	trans	-55.9	-32.7	174.8	-73.6	170.6	0	0	0	112.1	S25 R31 H151	S25-L29 WeakPolarHBondContact O-CG 3.23Å; S25-L29 PolarHBondContact O-N 3.26Å; L29-R31 VanDerWaalsContact C-N 3.26Å; L29-R31 PolarHBondContact O-N 3.37Å; L29-H151 PolarHBondContact O-NE2 2.97Å
30	R	58.3	Low	68.5	Low	216 Å²	216	81.5 Å²	81.5	82%	0.815	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-14.2	175.9	-74.4	-173.4	176.2	-164.8	-0.4	115.4	E26 F28	E26-R30 PolarHBondContact O-N 3.17Å; F28-R30 PolarHBondContact O-N 3.16Å; F28-R30 VanDerWaalsContact O-N 3.16Å
31	R	73.9	Confident	71.6	Confident	216 Å²	216	78.1 Å²	78.1	82%	0.815	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-25.3	-178.9	-74.1	-173	177.4	179.2	0.6	113.7	F28 L29	F28-R31 PolarHBondContact O-N 3.33Å; L29-R31 VanDerWaalsContact C-N 3.26Å; L29-R31 PolarHBondContact O-N 3.37Å
32	V	88.2	Confident	74.5	Confident	22 Å²	22	74.4 Å²	74.4	13%	0.133	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-92.4	126.8	-179.1	-177.2	0	0	0	0	108.4	F28 L34 H151 E306	F28-V32 HydrophobicContact CE1-CG2 4.07Å; F28-V32 HydrophobicContact CZ-CG2 4.28Å; V32-L34 HydrophobicContact CG1-CD2 4.49Å; V32-H151 PolarHBondContact O-NE2 3.05Å; V32-E306 HydrophobicContact CG1-CB 3.93Å; V32-E306 HydrophobicContact CG1-CG 3.76Å
33	R	94.3	Very high	77.1	Confident	58 Å²	58	70 Å²	70	22%	0.219	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-99.5	135.3	171.8	-56.2	-178.6	69.8	-173.3	19.9	107.9	D71 R148 N149 E307	R33-D71 IonicContact CZ-OD1 2.74Å; R33-D71 IonicContact NH1-OD1 3.66Å; R33-D71 PolarHBondContact NH1-OD1 2.75Å; R33-D71 PolarHBondContact NH2-O 2.88Å; R33-D71 IonicContact NH2-OD1 2.61Å; R33-D71 PolarHBondContact NH2-OD1 3.33Å; R33-D71 IonicContact NH2-OD2 3.2Å; R33-D71 PolarHBondContact NH2-OD2 3.35Å; R33-R148 CarbonylContact C-O 3.55Å; R33-R148 WeakPolarHBondContact CA-O 3.42Å; R33-R148 HydrophobicContact CB-CB 4.49Å; R33-N149 WeakPolarHBondContact CG-OD1 3.38Å; R33-N149 PolarHBondContact NE-OD1 2.82Å; R33-N149 VanDerWaalsContact NE-OD1 3.16Å; R33-E307 HydrophobicContact CB-CB 4.13Å; R33-E307 WeakPolarHBondContact CB-OE2 3.28Å; R33-E307 VanDerWaalsContact CD-OE2 3.3Å; R33-E307 WeakPolarHBondContact CD-OE2 3.39Å; R33-E307 IonicContact NE-OE2 3.89Å; R33-E307 IonicContact NH1-OE2 3.74Å; R33-E307 VanDerWaalsContact O-CB 3.27Å; R33-E307 WeakPolarHBondContact O-CB 3.25Å; R33-E307 PolarHBondContact O-N 3.02Å
34	L	95.8	Very high	79.4	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	154.1	172.7	-59	-174.5	0	0	0	110.9	V32 L146 R148 H151 V214 P216 V304 I305 E306	V32-L34 HydrophobicContact CG1-CD2 4.49Å; L34-L146 HydrophobicContact CB-CD2 4.12Å; L34-R148 PolarHBondContact N-O 3.44Å; L34-R148 WeakPolarHBondContact O-CB 3.03Å; L34-R148 WeakPolarHBondContact O-CG 3.31Å; L34-R148 PolarHBondContact O-NE 2.93Å; L34-R148 VanDerWaalsContact O-NE 3.14Å; L34-H151 HydrophobicContact CD1-CB 3.66Å; L34-H151 HydrophobicContact CG-CB 4.43Å; L34-V214 HydrophobicContact CD1-CG2 3.99Å; L34-P216 HydrophobicContact CD2-CG 3.87Å; L34-V304 HydrophobicContact CB-CG1 4.32Å; L34-V304 HydrophobicContact CD1-CG1 3.75Å; L34-V304 HydrophobicContact CD2-CG1 4.38Å; L34-V304 HydrophobicContact CG-CG1 4.38Å; L34-I305 CarbonylContact C-O 3.56Å; L34-I305 WeakPolarHBondContact CA-O 3.43Å; L34-E306 HydrophobicContact CD2-CG 4.35Å
35	C	95.7	Very high	81.3	Confident	9 Å²	9	60.8 Å²	60.8	6%	0.061	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	162.9	174.8	-72	0	0	0	0	110	Y74 R148 I305	C35-Y74 HydrophobicContact CB-CE2 3.93Å; C35-Y74 WeakPolarHBondContact CB-OH 3.45Å; C35-Y74 PolarHBondContact SG-OH 3.5Å; C35-Y74 VanDerWaalsContact SG-OH 3.33Å; C35-R148 PolarHBondContact SG-NH2 3.43Å; C35-I305 HydrophobicContact CB-CD1 4.39Å; C35-I305 HydrophobicContact CB-CG1 3.85Å; C35-I305 PolarHBondContact N-O 3.12Å; C35-I305 PolarHBondContact O-N 2.95Å
36	L	95.5	Very high	82.5	Confident	10 Å²	10	61.9 Å²	61.9	5%	0.052	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	122.5	169	-63.8	179.9	0	0	0	110.5	T38 Y74 L76 L146 I220 L303 V304	L36-T38 HydrophobicContact CB-CG2 3.73Å; L36-Y74 HydrophobicContact CB-CD1 3.76Å; L36-Y74 HydrophobicContact CB-CE1 4.23Å; L36-Y74 HydrophobicContact CB-CG 4.09Å; L36-Y74 HydrophobicContact CD1-CG 4.31Å; L36-Y74 HydrophobicContact CG-CD1 4.31Å; L36-Y74 HydrophobicContact CG-CG 4.13Å; L36-Y74 WeakPolarHBondContact O-CE1 3.2Å; L36-L76 HydrophobicContact CD1-CD1 3.88Å; L36-L76 HydrophobicContact CD1-CD2 4.4Å; L36-L76 HydrophobicContact CD1-CG 4.22Å; L36-L146 HydrophobicContact CD1-CB 4.19Å; L36-L146 HydrophobicContact CD1-CD2 4.3Å; L36-L146 HydrophobicContact CD2-CD2 3.72Å; L36-L146 HydrophobicContact CG-CB 4.42Å; L36-L146 HydrophobicContact CG-CD2 3.61Å; L36-I220 HydrophobicContact CD1-CD1 4.23Å; L36-I220 HydrophobicContact CD2-CD1 3.84Å; L36-L303 WeakPolarHBondContact CA-O 3.15Å; L36-V304 HydrophobicContact CD2-CB 4.42Å; L36-V304 HydrophobicContact CD2-CG2 3.74Å
37	L	94.4	Very high	83.5	Confident	42 Å²	42	59.9 Å²	59.9	22%	0.22	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	122.3	156.7	-175.7	66.6	0	0	0	107.2	I251 L254 G302 L303 I305	L37-I251 HydrophobicContact CD1-CB 4.13Å; L37-I251 HydrophobicContact CD1-CD1 3.87Å; L37-I251 HydrophobicContact CD1-CG1 3.88Å; L37-I251 HydrophobicContact CD2-CB 4.35Å; L37-I251 HydrophobicContact CG-CG1 4.31Å; L37-L254 HydrophobicContact CG-CD2 4.2Å; L37-L254 WeakPolarHBondContact O-CD2 3.35Å; L37-G302 CarbonylContact O-C 3.54Å; L37-G302 WeakPolarHBondContact O-CA 3.42Å; L37-L303 HydrophobicContact CB-CB 4.34Å; L37-L303 PolarHBondContact N-O 3.49Å; L37-L303 PolarHBondContact O-N 3.02Å; L37-I305 HydrophobicContact CB-CD1 4.38Å
38	T	95.5	Very high	84.1	Confident	45 Å²	45	61.2 Å²	61.2	28%	0.276	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	147.2	-170.5	53.6	0	0	0	0	113.1	L36 L67 L76 L301	L36-T38 HydrophobicContact CB-CG2 3.73Å; T38-L67 HydrophobicContact CG2-CD2 3.94Å; T38-L76 HydrophobicContact CG2-CD2 3.97Å; T38-L301 CarbonylContact C-O 3.57Å; T38-L301 WeakPolarHBondContact CA-O 3.16Å
39	A	95.7	Very high	84.4	Confident	6 Å²	6	63.3 Å²	63.3	5%	0.05	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	146.9	169.9	0	0	0	0	0	109.9	L254 K255 A258 I300 L301	A39-L254 HydrophobicContact CB-CB 4.18Å; A39-L254 HydrophobicContact CB-CD2 3.91Å; A39-L254 HydrophobicContact CB-CG 3.73Å; A39-K255 HydrophobicContact CB-CB 4.4Å; A39-K255 HydrophobicContact CB-CG 3.89Å; A39-A258 HydrophobicContact CB-CB 4.26Å; A39-I300 CarbonylContact O-C 3.6Å; A39-I300 WeakPolarHBondContact O-CA 3.23Å; A39-L301 PolarHBondContact N-O 3.04Å; A39-L301 PolarHBondContact O-N 3.28Å
40	V	96.9	Very high	84.2	Confident	35 Å²	35	68 Å²	68	21%	0.212	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	133.7	-179.8	-173.1	0	0	0	0	108.4	W58 Y60 L67 V299 I300	V40-W58 HydrophobicContact CG2-CZ2 4.37Å; V40-Y60 HydrophobicContact CG1-CE2 4.15Å; V40-L67 HydrophobicContact CG2-CD1 3.54Å; V40-L67 HydrophobicContact CG2-CD2 4.04Å; V40-V299 WeakPolarHBondContact CA-O 3.49Å; V40-I300 HydrophobicContact CG1-CG1 4.31Å; V40-I300 HydrophobicContact CG2-CG1 4.21Å; V40-I300 HydrophobicContact CG2-CG2 4.33Å
41	A	96.8	Very high	83.7	Confident	8 Å²	8	63.8 Å²	63.8	7%	0.066	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	155.7	170.8	0	0	0	0	0	109.5	A258 V262 V299	A41-A258 VanDerWaalsContact CB-C 3.46Å; A41-A258 HydrophobicContact CB-CB 3.76Å; A41-A258 WeakPolarHBondContact CB-O 3.32Å; A41-V262 HydrophobicContact CB-CG2 3.74Å; A41-V299 PolarHBondContact N-O 3.17Å; A41-V299 PolarHBondContact O-N 2.65Å
42	G	96.4	Very high	82.1	Confident	24 Å²	24	59.2 Å²	59.2	25%	0.247	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167	169.7	173.1	0	0	0	0	0	113.2	Y60 I297	G42-Y60 VanDerWaalsContact C-CD1 3.41Å; G42-I297 CarbonylContact C-O 3.59Å; G42-I297 WeakPolarHBondContact CA-O 3.36Å
43	Y	95.1	Very high	80.5	Confident	28 Å²	28	68.9 Å²	68.9	11%	0.11	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	125	-177.5	172.4	-107.3	0	0	0	109.8	N45 T48 R266 D296 I297	Y43-N45 HydrophobicContact CD1-CB 4.26Å; Y43-N45 HydrophobicContact CE1-CB 3.7Å; Y43-T48 HydrophobicContact CE2-CG2 4.4Å; Y43-T48 WeakPolarHBondContact OH-CG2 3.45Å; Y43-R266 HydrophobicContact CD1-CG 4.35Å; Y43-R266 HydrophobicContact CE1-CG 4.14Å; Y43-D296 WeakPolarHBondContact O-CA 3.13Å; Y43-I297 HydrophobicContact CD1-CD1 4.23Å; Y43-I297 HydrophobicContact CD1-CG1 4.43Å; Y43-I297 PolarHBondContact N-O 3.2Å; Y43-I297 PolarHBondContact O-N 2.75Å
44	D	93	Very high	78.9	Confident	46 Å²	46	74.2 Å²	74.2	25%	0.246	38%	0.377	C	S	.	.			trans	-92.4	110.6	172.3	-177.1	-29.2	0	0	0	108.8	K46 H47 T48 G61	D44-K46 VanDerWaalsContact C-N 3.34Å; D44-K46 PolarHBondContact OD1-N 3.35Å; D44-H47 IonicContact OD1-CG 3.74Å; D44-H47 PolarHBondContact OD1-N 3.2Å; D44-H47 IonicContact OD1-ND1 2.81Å; D44-H47 PolarHBondContact OD1-ND1 3.03Å; D44-H47 VanDerWaalsContact OD1-ND1 3.16Å; D44-H47 IonicContact OD2-CE1 2.68Å; D44-H47 IonicContact OD2-CG 2.74Å; D44-H47 IonicContact OD2-ND1 3.92Å; D44-H47 PolarHBondContact OD2-ND1 2.98Å; D44-T48 WeakPolarHBondContact O-CG2 3.27Å; D44-G61 WeakPolarHBondContact OD2-CA 3.3Å; D44-G61 PolarHBondContact OD2-N 3.1Å; D44-G61 VanDerWaalsContact OD2-N 3.08Å
45	N	88.5	Confident	77.2	Confident	39 Å²	39	78.3 Å²	78.3	21%	0.209	41%	0.406	C	S	.	.	S	Bend	trans	-79.2	-20.2	-178	-172.5	46	0	0	0	112.8	Y43 T48 G295 D296	Y43-N45 HydrophobicContact CD1-CB 4.26Å; Y43-N45 HydrophobicContact CE1-CB 3.7Å; N45-T48 WeakPolarHBondContact O-CG2 3.4Å; N45-G295 VanDerWaalsContact CB-O 3.3Å; N45-G295 WeakPolarHBondContact CB-O 3.42Å; N45-D296 PolarHBondContact N-OD1 2.93Å
46	K	77.7	Confident	76.3	Confident	81 Å²	81	81.6 Å²	81.6	35%	0.352	43%	0.427	S	S	.	.	S	Bend	trans	-97.5	-35.4	-166.8	-60	-173.9	-179.4	107.5	0	112.4	D44 D62 R86 D296	D44-K46 VanDerWaalsContact C-N 3.34Å; D44-K46 PolarHBondContact OD1-N 3.35Å; K46-D62 IonicContact NZ-OD2 3.4Å; K46-D62 PolarHBondContact NZ-OD2 3.17Å; K46-R86 VanDerWaalsContact CE-CZ 3.43Å; K46-D296 IonicContact NZ-OD2 2.75Å; K46-D296 PolarHBondContact NZ-OD2 2.6Å
47	H	70.8	Confident	75.8	Confident	99 Å²	99	88.6 Å²	88.6	46%	0.458	46%	0.457	S	S	.	.			trans	-99.4	25.5	-178.2	-52	98.5	0	0	0	113.4	D44 K49 Y50	D44-H47 IonicContact OD1-CG 3.74Å; D44-H47 PolarHBondContact OD1-N 3.2Å; D44-H47 IonicContact OD1-ND1 2.81Å; D44-H47 PolarHBondContact OD1-ND1 3.03Å; D44-H47 VanDerWaalsContact OD1-ND1 3.16Å; D44-H47 IonicContact OD2-CE1 2.68Å; D44-H47 IonicContact OD2-CG 2.74Å; D44-H47 IonicContact OD2-ND1 3.92Å; D44-H47 PolarHBondContact OD2-ND1 2.98Å; H47-K49 PolarHBondContact O-N 3.13Å; H47-Y50 PolarHBondContact O-N 3.26Å; H47-Y50 VanDerWaalsContact O-N 3.13Å
48	T	63	Low	75.6	Confident	87 Å²	87	89.4 Å²	89.4	53%	0.534	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-20.9	-178.8	54.6	0	0	0	0	114.6	Y43 D44 N45	Y43-T48 HydrophobicContact CE2-CG2 4.4Å; Y43-T48 WeakPolarHBondContact OH-CG2 3.45Å; D44-T48 WeakPolarHBondContact O-CG2 3.27Å; N45-T48 WeakPolarHBondContact O-CG2 3.4Å
49	K	54.8	Low	75.6	Confident	180 Å²	180	88.3 Å²	88.3	78%	0.783	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.8	-7.2	-178.3	-64.7	-175.1	179.8	-179.6	0	115.2	H47	H47-K49 PolarHBondContact O-N 3.13Å
50	Y	47.9	Very low	75.6	Confident	178 Å²	178	90.1 Å²	90.1	70%	0.698	46%	0.456	S	S	*	.			trans	-127.8	79.5	-175	-64.6	-76.9	0	0	0	111.1	H47 T52	H47-Y50 PolarHBondContact O-N 3.26Å; H47-Y50 VanDerWaalsContact O-N 3.13Å; Y50-T52 PolarHBondContact O-N 3.09Å
51	S	48.2	Very low	75.4	Confident	126 Å²	126	88.6 Å²	88.6	88%	0.881	45%	0.447	S	S	*	.			trans	-81	42.5	174.2	-161.3	0	0	0	0	112.3
52	T	40.9	Very low	75.4	Confident	120 Å²	120	88.2 Å²	88.2	74%	0.736	44%	0.444	S	S	*	.			trans	-105	16.2	-172	54.8	0	0	0	0	114.7	Y50	Y50-T52 PolarHBondContact O-N 3.09Å
53	R	54.6	Low	75.4	Confident	225 Å²	225	87.1 Å²	87.1	85%	0.849	43%	0.433	S	S	*	.	S	Bend	trans	-140.4	139.4	168.4	-68.3	-173.2	-179	-174.5	0.3	109.8	S55	R53-S55 PolarHBondContact O-N 3.33Å
54	I	59.1	Low	75.6	Confident	170 Å²	170	86 Å²	86	87%	0.872	43%	0.429	S	S	*	.			trans	-50.4	113.6	162.6	-62.6	170.1	0	0	0	105.6
55	S	61.6	Low	75.8	Confident	87 Å²	87	84.2 Å²	84.2	61%	0.608	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-60.4	132.3	178.4	48	0	0	0	0	107.8	R53 K57	R53-S55 PolarHBondContact O-N 3.33Å; S55-K57 PolarHBondContact O-N 3.44Å
56	P	76.3	Confident	76.3	Confident	77 Å²	77	82.5 Å²	82.5	50%	0.5	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-55.5	138.8	173.5	7.1	-6.2	0	0	0	108	W58 V59	P56-W58 PolarHBondContact O-N 3.1Å; P56-V59 HydrophobicContact CB-CB 4.2Å; P56-V59 HydrophobicContact CB-CG2 3.82Å; P56-V59 HydrophobicContact CG-CB 3.8Å; P56-V59 HydrophobicContact CG-CG1 4.14Å; P56-V59 HydrophobicContact CG-CG2 3.82Å; P56-V59 PolarHBondContact O-N 3.06Å
57	K	85.4	Confident	77.2	Confident	157 Å²	157	79.6 Å²	79.6	68%	0.683	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	121.3	177.3	179.6	-178.8	174.2	-167.7	0	108	S55	S55-K57 PolarHBondContact O-N 3.44Å
58	W	90.3	Very high	78.4	Confident	60 Å²	60	75.2 Å²	75.2	23%	0.227	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.5	37.8	170.8	-56.9	-2	0	0	0	114.4	V40 P56 A64 C65 L67	V40-W58 HydrophobicContact CG2-CZ2 4.37Å; P56-W58 PolarHBondContact O-N 3.1Å; W58-A64 WeakPolarHBondContact O-CA 3.34Å; W58-C65 WeakPolarHBondContact CB-O 3.45Å; W58-C65 VanDerWaalsContact CB-SG 3.59Å; W58-C65 PolarHBondContact O-N 2.9Å; W58-L67 HydrophobicContact CD2-CD1 4Å; W58-L67 HydrophobicContact CE3-CB 4.46Å; W58-L67 HydrophobicContact CE3-CD1 3.44Å; W58-L67 VanDerWaalsContact CE3-CD1 3.44Å; W58-L67 HydrophobicContact CE3-CG 4.48Å; W58-L67 HydrophobicContact CH2-CB 3.5Å; W58-L67 VanDerWaalsContact CH2-CB 3.5Å; W58-L67 HydrophobicContact CH2-CD1 3.42Å; W58-L67 VanDerWaalsContact CH2-CD1 3.42Å; W58-L67 HydrophobicContact CH2-CD2 4.09Å; W58-L67 HydrophobicContact CH2-CG 3.82Å; W58-L67 HydrophobicContact CZ2-CD1 3.93Å; W58-L67 HydrophobicContact CZ3-CB 3.41Å; W58-L67 VanDerWaalsContact CZ3-CB 3.41Å; W58-L67 HydrophobicContact CZ3-CD1 3.18Å; W58-L67 HydrophobicContact CZ3-CG 3.78Å
59	V	94.8	Very high	80	Confident	22 Å²	22	74.2 Å²	74.2	13%	0.133	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	130.4	171.3	177.9	0	0	0	0	108.7	P56 D63 R97	P56-V59 HydrophobicContact CB-CB 4.2Å; P56-V59 HydrophobicContact CB-CG2 3.82Å; P56-V59 HydrophobicContact CG-CB 3.8Å; P56-V59 HydrophobicContact CG-CG1 4.14Å; P56-V59 HydrophobicContact CG-CG2 3.82Å; P56-V59 PolarHBondContact O-N 3.06Å; V59-D63 WeakPolarHBondContact CA-O 3.32Å; V59-R97 HydrophobicContact CG1-CG 4.25Å; V59-R97 HydrophobicContact CG2-CG 3.86Å
60	Y	94.8	Very high	81.9	Confident	44 Å²	44	67 Å²	67	17%	0.173	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	94.7	-179.4	-54.2	-79.3	0	0	0	108.5	V40 G42 D62 D63 D296 T298	V40-Y60 HydrophobicContact CG1-CE2 4.15Å; G42-Y60 VanDerWaalsContact C-CD1 3.41Å; Y60-D62 PolarHBondContact O-N 3.45Å; Y60-D63 PolarHBondContact N-O 3.45Å; Y60-D63 WeakPolarHBondContact O-CB 3.33Å; Y60-D63 PolarHBondContact O-N 2.96Å; Y60-D296 WeakPolarHBondContact O-CB 3.43Å; Y60-T298 HydrophobicContact CD2-CG2 3.96Å; Y60-T298 WeakPolarHBondContact CD2-OG1 3.4Å; Y60-T298 HydrophobicContact CE2-CG2 4.13Å
61	G	93.9	Very high	84.1	Confident	3 Å²	3	64 Å²	64	3%	0.031	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.5	-117.6	-171.9	0	0	0	0	0	112.2	D44	D44-G61 WeakPolarHBondContact OD2-CA 3.3Å; D44-G61 PolarHBondContact OD2-N 3.1Å; D44-G61 VanDerWaalsContact OD2-N 3.08Å
62	D	95.8	Very high	86.2	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-10.5	172.8	-67.6	-28.3	0	0	0	114.1	K46 Y60 G81 R86 P92 G93 S96 D296	K46-D62 IonicContact NZ-OD2 3.4Å; K46-D62 PolarHBondContact NZ-OD2 3.17Å; Y60-D62 PolarHBondContact O-N 3.45Å; D62-G81 PolarHBondContact O-N 3.18Å; D62-R86 IonicContact OD1-CZ 2.64Å; D62-R86 IonicContact OD1-NH1 4Å; D62-R86 IonicContact OD1-NH2 3.54Å; D62-R86 PolarHBondContact OD1-NH2 3.36Å; D62-R86 IonicContact OD2-CZ 3.12Å; D62-R86 IonicContact OD2-NH1 3.49Å; D62-R86 PolarHBondContact OD2-NH1 3.23Å; D62-R86 IonicContact OD2-NH2 2.74Å; D62-R86 PolarHBondContact OD2-NH2 3.46Å; D62-P92 HydrophobicContact CB-CB 4.35Å; D62-G93 PolarHBondContact OD1-N 2.94Å; D62-S96 WeakPolarHBondContact O-CB 3.36Å; D62-S96 PolarHBondContact O-OG 3.25Å; D62-D296 PolarHBondContact N-OD2 3.46Å
63	D	97.8	Very high	88.9	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	144.5	175.3	-69.5	-3.2	0	0	0	110.6	V59 Y60 A79 D80 T224 T298	V59-D63 WeakPolarHBondContact CA-O 3.32Å; Y60-D63 PolarHBondContact N-O 3.45Å; Y60-D63 WeakPolarHBondContact O-CB 3.33Å; Y60-D63 PolarHBondContact O-N 2.96Å; D63-A79 WeakPolarHBondContact CA-O 3.39Å; D63-D80 WeakPolarHBondContact OD1-CA 3.38Å; D63-D80 WeakPolarHBondContact OD1-CB 3.43Å; D63-T224 HydrophobicContact CB-CG2 4.43Å; D63-T224 WeakPolarHBondContact OD2-CG2 3.2Å; D63-T224 PolarHBondContact OD2-OG1 3.01Å; D63-T298 WeakPolarHBondContact CB-OG1 3.29Å; D63-T298 VanDerWaalsContact CG-OG1 3.31Å; D63-T298 VanDerWaalsContact OD2-CB 3.32Å; D63-T298 WeakPolarHBondContact OD2-CB 3.43Å; D63-T298 PolarHBondContact OD2-N 2.94Å; D63-T298 PolarHBondContact OD2-OG1 3.44Å
64	A	97.9	Very high	91	Very high	3 Å²	3	45.3 Å²	45.3	3%	0.025	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	149.1	167.2	0	0	0	0	0	109.8	W58 V78 A79 R97 M100	W58-A64 WeakPolarHBondContact O-CA 3.34Å; A64-V78 CarbonylContact O-C 3.57Å; A64-V78 WeakPolarHBondContact O-CA 3.45Å; A64-A79 PolarHBondContact N-O 2.82Å; A64-A79 PolarHBondContact O-N 2.96Å; A64-R97 HydrophobicContact CB-CB 4.34Å; A64-R97 HydrophobicContact CB-CG 3.82Å; A64-M100 HydrophobicContact CB-CB 4.19Å; A64-M100 HydrophobicContact CB-CG 3.84Å; A64-M100 WeakPolarHBondContact O-CG 3.35Å
65	C	98.1	Very high	92.8	Very high	9 Å²	9	37.2 Å²	37.2	6%	0.061	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	159.6	172	75.8	0	0	0	0	112.8	W58 G77 V78 T298 I300	W58-C65 WeakPolarHBondContact CB-O 3.45Å; W58-C65 VanDerWaalsContact CB-SG 3.59Å; W58-C65 PolarHBondContact O-N 2.9Å; C65-G77 CarbonylContact C-O 3.35Å; C65-G77 WeakPolarHBondContact CA-O 3.34Å; C65-G77 WeakPolarHBondContact CB-O 3.4Å; C65-V78 HydrophobicContact CB-CB 4.4Å; C65-V78 HydrophobicContact CB-CG1 3.84Å; C65-T298 HydrophobicContact CB-CG2 3.97Å; C65-I300 HydrophobicContact CB-CD1 3.92Å; C65-I300 HydrophobicContact CB-CG1 4.5Å
66	F	97.7	Very high	94.6	Very high	3 Å²	3	33.2 Å²	33.2	1%	0.013	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	154.9	174.3	84.9	-81.1	0	0	0	111.1	V75 G77 M100 C103 E104 V107 I143	F66-V75 HydrophobicContact CE2-CB 4.23Å; F66-V75 HydrophobicContact CE2-CG1 3.86Å; F66-V75 HydrophobicContact CZ-CG1 3.74Å; F66-G77 PolarHBondContact N-O 2.9Å; F66-G77 PolarHBondContact O-N 2.8Å; F66-M100 HydrophobicContact CB-CB 4.46Å; F66-M100 HydrophobicContact CD1-CB 4.16Å; F66-M100 HydrophobicContact CD1-CE 4.45Å; F66-M100 HydrophobicContact CD1-CG 4.47Å; F66-M100 HydrophobicContact CD1-SD 3.58Å; F66-M100 VanDerWaalsContact CD1-SD 3.58Å; F66-M100 HydrophobicContact CE1-CE 4.39Å; F66-M100 HydrophobicContact CE1-SD 4Å; F66-C103 HydrophobicContact CD1-CB 3.96Å; F66-C103 HydrophobicContact CE1-CB 3.38Å; F66-C103 HydrophobicContact CE2-CB 4.26Å; F66-C103 HydrophobicContact CZ-CB 3.56Å; F66-E104 HydrophobicContact CB-CB 4.13Å; F66-E104 HydrophobicContact CD2-CB 3.86Å; F66-E104 HydrophobicContact CD2-CG 4.4Å; F66-E104 HydrophobicContact CG-CB 4.13Å; F66-V107 HydrophobicContact CE2-CG2 4.25Å; F66-I143 HydrophobicContact CZ-CG2 4.4Å
67	L	97.5	Very high	95.6	Very high	21 Å²	21	29.6 Å²	29.6	11%	0.11	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	127.5	173.5	-62.9	75.6	0	0	0	106.8	T38 V40 W58 V75 L76 I300	T38-L67 HydrophobicContact CG2-CD2 3.94Å; V40-L67 HydrophobicContact CG2-CD1 3.54Å; V40-L67 HydrophobicContact CG2-CD2 4.04Å; W58-L67 HydrophobicContact CD2-CD1 4Å; W58-L67 HydrophobicContact CE3-CB 4.46Å; W58-L67 HydrophobicContact CE3-CD1 3.44Å; W58-L67 VanDerWaalsContact CE3-CD1 3.44Å; W58-L67 HydrophobicContact CE3-CG 4.48Å; W58-L67 HydrophobicContact CH2-CB 3.5Å; W58-L67 VanDerWaalsContact CH2-CB 3.5Å; W58-L67 HydrophobicContact CH2-CD1 3.42Å; W58-L67 VanDerWaalsContact CH2-CD1 3.42Å; W58-L67 HydrophobicContact CH2-CD2 4.09Å; W58-L67 HydrophobicContact CH2-CG 3.82Å; W58-L67 HydrophobicContact CZ2-CD1 3.93Å; W58-L67 HydrophobicContact CZ3-CB 3.41Å; W58-L67 VanDerWaalsContact CZ3-CB 3.41Å; W58-L67 HydrophobicContact CZ3-CD1 3.18Å; W58-L67 HydrophobicContact CZ3-CG 3.78Å; L67-V75 CarbonylContact C-O 3.52Å; L67-V75 VanDerWaalsContact CA-O 3.29Å; L67-V75 WeakPolarHBondContact CA-O 3.29Å; L67-L76 HydrophobicContact CB-CD2 4.05Å; L67-L76 HydrophobicContact CD2-CD2 3.71Å; L67-L76 HydrophobicContact CG-CD2 3.61Å; L67-I300 HydrophobicContact CD1-CD1 3.74Å; L67-I300 HydrophobicContact CD1-CG1 4.21Å; L67-I300 HydrophobicContact CD1-CG2 4.34Å; L67-I300 HydrophobicContact CD2-CG2 4.03Å; L67-I300 HydrophobicContact CG-CD1 4.32Å; L67-I300 HydrophobicContact CG-CG2 4.32Å
68	S	97.1	Very high	96.3	Very high	6 Å²	6	22.1 Å²	22.1	4%	0.042	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	141.4	-178.1	-166.8	0	0	0	0	110	V75 V107 N108	S68-V75 PolarHBondContact N-O 3.33Å; S68-V75 PolarHBondContact O-N 3.37Å; S68-V107 WeakPolarHBondContact OG-CG1 3.37Å; S68-N108 VanDerWaalsContact OG-CG 3.26Å; S68-N108 PolarHBondContact OG-ND2 3.41Å; S68-N108 VanDerWaalsContact OG-ND2 3.09Å; S68-N108 PolarHBondContact OG-OD1 3.39Å
69	V	96.2	Very high	96.7	Very high	66 Å²	66	19.2 Å²	19.2	40%	0.4	11%	0.106	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	122.4	179	-172.3	0	0	0	0	108.3	Y74	V69-Y74 HydrophobicContact CB-CD1 4.45Å; V69-Y74 HydrophobicContact CB-CE1 4.39Å; V69-Y74 HydrophobicContact CG1-CD1 4.17Å; V69-Y74 HydrophobicContact CG1-CD2 4.31Å; V69-Y74 HydrophobicContact CG1-CE1 3.86Å; V69-Y74 HydrophobicContact CG1-CE2 3.99Å; V69-Y74 HydrophobicContact CG1-CG 4.37Å; V69-Y74 HydrophobicContact CG2-CD1 3.58Å; V69-Y74 HydrophobicContact CG2-CE1 3.57Å; V69-Y74 HydrophobicContact CG2-CG 4.35Å
70	T	94.9	Very high	96.8	Very high	30 Å²	30	19.2 Å²	19.2	18%	0.184	11%	0.105	C	C	.	.			trans	-107.7	174.8	170.9	72.2	0	0	0	0	109.2	S72 S73 V107 F112	T70-S72 VanDerWaalsContact C-N 3.29Å; T70-S72 PolarHBondContact O-N 3.49Å; T70-S72 PolarHBondContact OG1-N 3.49Å; T70-S72 PolarHBondContact OG1-OG 2.81Å; T70-S73 PolarHBondContact N-O 3.33Å; T70-S73 PolarHBondContact OG1-N 2.84Å; T70-S73 PolarHBondContact OG1-O 3.22Å; T70-V107 HydrophobicContact CG2-CG1 3.56Å; T70-F112 HydrophobicContact CG2-CD1 4.43Å
71	D	92.6	Very high	97	Very high	115 Å²	115	17.1 Å²	17.1	62%	0.615	10%	0.097	S	C	*	.	S	Bend	trans	-60.9	-41.2	172.5	-177.8	57.7	0	0	0	111	R33 R148	R33-D71 IonicContact CZ-OD1 2.74Å; R33-D71 IonicContact NH1-OD1 3.66Å; R33-D71 PolarHBondContact NH1-OD1 2.75Å; R33-D71 PolarHBondContact NH2-O 2.88Å; R33-D71 IonicContact NH2-OD1 2.61Å; R33-D71 PolarHBondContact NH2-OD1 3.33Å; R33-D71 IonicContact NH2-OD2 3.2Å; R33-D71 PolarHBondContact NH2-OD2 3.35Å; D71-R148 VanDerWaalsContact O-CD 3.29Å; D71-R148 WeakPolarHBondContact O-CD 3.45Å; D71-R148 PolarHBondContact O-NH1 3.04Å; D71-R148 IonicContact OD1-NH1 3.07Å
72	S	93.6	Very high	97	Very high	39 Å²	39	18.4 Å²	18.4	27%	0.273	11%	0.105	S	C	.	.	S	Bend	trans	-84.8	-21.5	-177.5	52.9	0	0	0	0	114.9	T70 R148	T70-S72 VanDerWaalsContact C-N 3.29Å; T70-S72 PolarHBondContact O-N 3.49Å; T70-S72 PolarHBondContact OG1-N 3.49Å; T70-S72 PolarHBondContact OG1-OG 2.81Å; S72-R148 WeakPolarHBondContact O-CB 3.41Å; S72-R148 VanDerWaalsContact O-CG 3.28Å; S72-R148 WeakPolarHBondContact O-CG 3.33Å; S72-R148 PolarHBondContact O-N 3.24Å
73	S	96.8	Very high	96.9	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	154.2	-163.8	-63.7	0	0	0	0	116.5	T70 P114 L146	T70-S73 PolarHBondContact N-O 3.33Å; T70-S73 PolarHBondContact OG1-N 2.84Å; T70-S73 PolarHBondContact OG1-O 3.22Å; S73-P114 VanDerWaalsContact OG-CB 3.24Å; S73-P114 WeakPolarHBondContact OG-CB 3.49Å; S73-P114 WeakPolarHBondContact OG-CG 3.48Å; S73-L146 CarbonylContact C-O 3.46Å; S73-L146 WeakPolarHBondContact CA-O 3.26Å; S73-L146 VanDerWaalsContact CB-O 3.32Å; S73-L146 WeakPolarHBondContact CB-O 3.4Å; S73-L146 PolarHBondContact OG-O 3.06Å
74	Y	98.1	Very high	96.6	Very high	39 Å²	39	20.8 Å²	20.8	15%	0.153	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	128.8	159.7	-72.8	-110.4	0	0	0	108.5	C35 L36 V69 S145 L146 R148	C35-Y74 HydrophobicContact CB-CE2 3.93Å; C35-Y74 WeakPolarHBondContact CB-OH 3.45Å; C35-Y74 PolarHBondContact SG-OH 3.5Å; C35-Y74 VanDerWaalsContact SG-OH 3.33Å; L36-Y74 HydrophobicContact CB-CD1 3.76Å; L36-Y74 HydrophobicContact CB-CE1 4.23Å; L36-Y74 HydrophobicContact CB-CG 4.09Å; L36-Y74 HydrophobicContact CD1-CG 4.31Å; L36-Y74 HydrophobicContact CG-CD1 4.31Å; L36-Y74 HydrophobicContact CG-CG 4.13Å; L36-Y74 WeakPolarHBondContact O-CE1 3.2Å; V69-Y74 HydrophobicContact CB-CD1 4.45Å; V69-Y74 HydrophobicContact CB-CE1 4.39Å; V69-Y74 HydrophobicContact CG1-CD1 4.17Å; V69-Y74 HydrophobicContact CG1-CD2 4.31Å; V69-Y74 HydrophobicContact CG1-CE1 3.86Å; V69-Y74 HydrophobicContact CG1-CE2 3.99Å; V69-Y74 HydrophobicContact CG1-CG 4.37Å; V69-Y74 HydrophobicContact CG2-CD1 3.58Å; V69-Y74 HydrophobicContact CG2-CE1 3.57Å; V69-Y74 HydrophobicContact CG2-CG 4.35Å; Y74-S145 CarbonylContact O-C 3.58Å; Y74-S145 WeakPolarHBondContact O-CA 3.21Å; Y74-L146 HydrophobicContact CD2-CD2 4.48Å; Y74-L146 PolarHBondContact N-O 2.88Å; Y74-L146 PolarHBondContact O-N 2.84Å; Y74-R148 HydrophobicContact CD2-CG 4Å; Y74-R148 HydrophobicContact CE2-CG 4.23Å
75	V	98.5	Very high	96.3	Very high	0 Å²	0	21 Å²	21	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	122.8	-179.2	-168.4	0	0	0	0	109.1	F66 L67 S68 V107 F112 I143 V144	F66-V75 HydrophobicContact CE2-CB 4.23Å; F66-V75 HydrophobicContact CE2-CG1 3.86Å; F66-V75 HydrophobicContact CZ-CG1 3.74Å; L67-V75 CarbonylContact C-O 3.52Å; L67-V75 VanDerWaalsContact CA-O 3.29Å; L67-V75 WeakPolarHBondContact CA-O 3.29Å; S68-V75 PolarHBondContact N-O 3.33Å; S68-V75 PolarHBondContact O-N 3.37Å; V75-V107 HydrophobicContact CB-CG1 4.27Å; V75-V107 HydrophobicContact CB-CG2 4.31Å; V75-V107 HydrophobicContact CG1-CG2 4.13Å; V75-V107 HydrophobicContact CG2-CG1 3.78Å; V75-V107 HydrophobicContact CG2-CG2 4.19Å; V75-F112 HydrophobicContact CG1-CZ 4.4Å; V75-F112 HydrophobicContact CG2-CD1 4.14Å; V75-F112 HydrophobicContact CG2-CE1 3.33Å; V75-F112 HydrophobicContact CG2-CE2 4.28Å; V75-F112 HydrophobicContact CG2-CZ 3.4Å; V75-F112 VanDerWaalsContact CG2-CZ 3.4Å; V75-I143 HydrophobicContact CG1-CG2 3.77Å; V75-V144 CarbonylContact C-O 3.56Å; V75-V144 WeakPolarHBondContact CA-O 3.26Å
76	L	98.4	Very high	96	Very high	3 Å²	3	25 Å²	25	2%	0.016	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	138.2	177.4	-45	179	0	0	0	107.6	L36 T38 L67 I143 V144 V222 I300	L36-L76 HydrophobicContact CD1-CD1 3.88Å; L36-L76 HydrophobicContact CD1-CD2 4.4Å; L36-L76 HydrophobicContact CD1-CG 4.22Å; T38-L76 HydrophobicContact CG2-CD2 3.97Å; L67-L76 HydrophobicContact CB-CD2 4.05Å; L67-L76 HydrophobicContact CD2-CD2 3.71Å; L67-L76 HydrophobicContact CG-CD2 3.61Å; L76-I143 CarbonylContact O-C 3.44Å; L76-I143 WeakPolarHBondContact O-CA 3.44Å; L76-V144 PolarHBondContact N-O 3.01Å; L76-V144 PolarHBondContact O-N 2.9Å; L76-V222 HydrophobicContact CB-CG2 4.21Å; L76-V222 HydrophobicContact CD1-CG2 4.19Å; L76-I300 HydrophobicContact CB-CD1 4.31Å; L76-I300 HydrophobicContact CB-CG2 4.47Å; L76-I300 HydrophobicContact CD1-CG2 3.93Å; L76-I300 HydrophobicContact CD2-CG2 4.32Å; L76-I300 HydrophobicContact CG-CG2 4.47Å
77	G	98.5	Very high	95.7	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	146	175.1	0	0	0	0	0	113	C65 F66 C142	C65-G77 CarbonylContact C-O 3.35Å; C65-G77 WeakPolarHBondContact CA-O 3.34Å; C65-G77 WeakPolarHBondContact CB-O 3.4Å; F66-G77 PolarHBondContact N-O 2.9Å; F66-G77 PolarHBondContact O-N 2.8Å; G77-C142 CarbonylContact C-O 3.54Å; G77-C142 WeakPolarHBondContact CA-O 3.41Å
78	V	98.7	Very high	95.4	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	150.5	173.6	-60	0	0	0	0	109.2	A64 C65 L141 C142 V222 T224 T298 I300	A64-V78 CarbonylContact O-C 3.57Å; A64-V78 WeakPolarHBondContact O-CA 3.45Å; C65-V78 HydrophobicContact CB-CB 4.4Å; C65-V78 HydrophobicContact CB-CG1 3.84Å; V78-L141 VanDerWaalsContact O-CA 3.29Å; V78-L141 WeakPolarHBondContact O-CA 3.39Å; V78-C142 HydrophobicContact CG2-CB 3.97Å; V78-C142 PolarHBondContact N-O 3.41Å; V78-C142 PolarHBondContact O-N 3.49Å; V78-V222 HydrophobicContact CG1-CG1 4.01Å; V78-V222 HydrophobicContact CG2-CG1 3.85Å; V78-T224 HydrophobicContact CB-CG2 4.11Å; V78-T224 HydrophobicContact CG2-CG2 4.23Å; V78-T298 HydrophobicContact CG1-CG2 4.08Å; V78-I300 HydrophobicContact CG1-CD1 3.81Å; V78-I300 HydrophobicContact CG1-CG1 4.19Å
79	A	98.6	Very high	95.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	134.9	167.4	0	0	0	0	0	110.2	D63 A64 M100 A139 T140 L141	D63-A79 WeakPolarHBondContact CA-O 3.39Å; A64-A79 PolarHBondContact N-O 2.82Å; A64-A79 PolarHBondContact O-N 2.96Å; A79-M100 HydrophobicContact CB-CE 3.68Å; A79-M100 HydrophobicContact CB-CG 3.85Å; A79-M100 HydrophobicContact CB-SD 3.94Å; A79-A139 HydrophobicContact CB-CB 4.32Å; A79-T140 WeakPolarHBondContact CA-O 3.22Å; A79-T140 VanDerWaalsContact CB-O 3.27Å; A79-T140 WeakPolarHBondContact CB-O 3.37Å; A79-L141 HydrophobicContact CB-CB 4.19Å
80	D	98.2	Very high	94.9	Very high	21 Å²	21	34.5 Å²	34.5	11%	0.112	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	123.1	173.6	163.4	33.4	0	0	0	109.3	D63 A139 T140 T224	D63-D80 WeakPolarHBondContact OD1-CA 3.38Å; D63-D80 WeakPolarHBondContact OD1-CB 3.43Å; D80-A139 CarbonylContact O-C 3.31Å; D80-A139 WeakPolarHBondContact O-CA 3.38Å; D80-A139 WeakPolarHBondContact O-CB 3.38Å; D80-T140 PolarHBondContact N-O 2.94Å; D80-T140 PolarHBondContact O-N 3.27Å; D80-T224 HydrophobicContact CB-CG2 3.91Å
81	G	97.5	Very high	94.9	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	120	178.5	0	0	0	0	0	111.9	D62 G83 P92 S138	D62-G81 PolarHBondContact O-N 3.18Å; G81-G83 PolarHBondContact O-N 2.82Å; G81-G83 VanDerWaalsContact O-N 3.08Å; G81-P92 WeakPolarHBondContact O-CB 3.46Å; G81-S138 WeakPolarHBondContact CA-O 3.2Å
82	V	95.5	Very high	95	Very high	31 Å²	31	30.7 Å²	30.7	19%	0.188	19%	0.187	C	C	.	.			trans	-62.8	114.7	-171.2	179	0	0	0	0	112	G84 W85 P92 S138 Q187	V82-G84 PolarHBondContact O-N 3.27Å; V82-W85 PolarHBondContact O-N 2.86Å; V82-P92 WeakPolarHBondContact O-CB 3.3Å; V82-S138 VanDerWaalsContact CB-OG 3.3Å; V82-S138 WeakPolarHBondContact CB-OG 3.4Å; V82-S138 WeakPolarHBondContact CG2-OG 3.42Å; V82-S138 PolarHBondContact N-O 2.83Å; V82-Q187 HydrophobicContact CG2-CB 4.42Å
83	G	92.8	Very high	95.1	Very high	33 Å²	33	28.8 Å²	28.8	34%	0.34	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-57.8	-24.7	-170.9	0	0	0	0	0	116	G81 W85 R86	G81-G83 PolarHBondContact O-N 2.82Å; G81-G83 VanDerWaalsContact O-N 3.08Å; G83-W85 PolarHBondContact O-N 2.77Å; G83-W85 VanDerWaalsContact O-N 3.17Å; G83-R86 WeakPolarHBondContact O-CB 3.49Å; G83-R86 PolarHBondContact O-N 2.95Å; G83-R86 VanDerWaalsContact O-N 3.16Å
84	G	90.9	Very high	95.1	Very high	17 Å²	17	34 Å²	34	18%	0.175	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-57.2	-27.6	-179.5	0	0	0	0	0	114.1	V82 R86 S87	V82-G84 PolarHBondContact O-N 3.27Å; G84-R86 PolarHBondContact O-N 2.88Å; G84-S87 PolarHBondContact O-N 3.16Å; G84-S87 VanDerWaalsContact O-N 3.12Å; G84-S87 PolarHBondContact O-OG 2.96Å
85	W	92.6	Very high	95	Very high	8 Å²	8	32.1 Å²	32.1	3%	0.03	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-58.3	-23.8	177.3	-77.4	101.9	0	0	0	114.3	V82 G83 S87 Y88 V90 P92 G137 S138 P191 F199	V82-W85 PolarHBondContact O-N 2.86Å; G83-W85 PolarHBondContact O-N 2.77Å; G83-W85 VanDerWaalsContact O-N 3.17Å; W85-S87 VanDerWaalsContact C-N 3.27Å; W85-S87 PolarHBondContact O-N 3.5Å; W85-Y88 WeakPolarHBondContact O-CB 3.18Å; W85-Y88 PolarHBondContact O-N 2.94Å; W85-V90 CarbonylContact C-O 3.48Å; W85-V90 VanDerWaalsContact C-O 3.31Å; W85-V90 HydrophobicContact CB-CB 4.01Å; W85-V90 HydrophobicContact CB-CG1 4.06Å; W85-V90 HydrophobicContact CD2-CG1 4.47Å; W85-V90 HydrophobicContact CE3-CB 4.07Å; W85-V90 HydrophobicContact CE3-CG1 4.16Å; W85-V90 HydrophobicContact CE3-CG2 4.08Å; W85-V90 HydrophobicContact CG-CG1 4.45Å; W85-V90 PolarHBondContact O-N 3.48Å; W85-P92 HydrophobicContact CB-CB 4.39Å; W85-P92 HydrophobicContact CB-CG 4.03Å; W85-G137 VanDerWaalsContact CE2-C 3.44Å; W85-G137 VanDerWaalsContact CE2-CA 3.45Å; W85-G137 VanDerWaalsContact NE1-C 3.27Å; W85-S138 PolarHBondContact NE1-OG 2.86Å; W85-P191 HydrophobicContact CH2-CB 4.05Å; W85-F199 AromaticContact CH2-CD1 3.7Å; W85-F199 HydrophobicContact CH2-CD1 3.7Å; W85-F199 HydrophobicContact CH2-CD2 4.19Å; W85-F199 AromaticContact CH2-CE1 3.67Å; W85-F199 HydrophobicContact CH2-CE1 3.67Å; W85-F199 HydrophobicContact CH2-CE2 4.16Å; W85-F199 AromaticContact CH2-CG 3.96Å; W85-F199 HydrophobicContact CH2-CG 3.96Å; W85-F199 AromaticContact CH2-CZ 3.9Å; W85-F199 HydrophobicContact CH2-CZ 3.9Å; W85-F199 AromaticContact CZ2-CD1 3.79Å; W85-F199 HydrophobicContact CZ2-CD1 3.79Å; W85-F199 HydrophobicContact CZ2-CE1 4.11Å; W85-F199 HydrophobicContact CZ2-CG 4.17Å; W85-F199 HydrophobicContact CZ3-CD1 4.42Å; W85-F199 AromaticContact CZ3-CE1 3.94Å; W85-F199 HydrophobicContact CZ3-CE1 3.94Å; W85-F199 HydrophobicContact CZ3-CZ 4.01Å
86	R	92.4	Very high	95	Very high	94 Å²	94	32.1 Å²	32.1	36%	0.355	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-59.9	-33.1	176.3	-76	-169.4	179.5	70.8	13.7	113.8	K46 D62 G83 G84 Y88 G89 V90 P92	K46-R86 VanDerWaalsContact CE-CZ 3.43Å; D62-R86 IonicContact OD1-CZ 2.64Å; D62-R86 IonicContact OD1-NH1 4Å; D62-R86 IonicContact OD1-NH2 3.54Å; D62-R86 PolarHBondContact OD1-NH2 3.36Å; D62-R86 IonicContact OD2-CZ 3.12Å; D62-R86 IonicContact OD2-NH1 3.49Å; D62-R86 PolarHBondContact OD2-NH1 3.23Å; D62-R86 IonicContact OD2-NH2 2.74Å; D62-R86 PolarHBondContact OD2-NH2 3.46Å; G83-R86 WeakPolarHBondContact O-CB 3.49Å; G83-R86 PolarHBondContact O-N 2.95Å; G83-R86 VanDerWaalsContact O-N 3.16Å; G84-R86 PolarHBondContact O-N 2.88Å; R86-Y88 PolarHBondContact O-N 3.01Å; R86-Y88 VanDerWaalsContact O-N 3.16Å; R86-G89 PolarHBondContact O-N 3.48Å; R86-V90 WeakPolarHBondContact CA-O 3.29Å; R86-V90 PolarHBondContact N-O 3.26Å; R86-P92 HydrophobicContact CG-CG 3.9Å
87	S	91.2	Very high	94.9	Very high	87 Å²	87	35.5 Å²	35.5	61%	0.608	20%	0.199	S	C	*	.	G	3₁₀ helix	trans	-66	-16.4	178	60.7	0	0	0	0	112.7	G84 W85	G84-S87 PolarHBondContact O-N 3.16Å; G84-S87 VanDerWaalsContact O-N 3.12Å; G84-S87 PolarHBondContact O-OG 2.96Å; W85-S87 VanDerWaalsContact C-N 3.27Å; W85-S87 PolarHBondContact O-N 3.5Å
88	Y	89.6	Confident	94.8	Very high	112 Å²	112	36.2 Å²	36.2	44%	0.439	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-99.8	8.5	175.2	-56.6	-84.6	0	0	0	112.8	W85 R86 V90 F199	W85-Y88 WeakPolarHBondContact O-CB 3.18Å; W85-Y88 PolarHBondContact O-N 2.94Å; R86-Y88 PolarHBondContact O-N 3.01Å; R86-Y88 VanDerWaalsContact O-N 3.16Å; Y88-V90 VanDerWaalsContact C-N 3.25Å; Y88-V90 PolarHBondContact O-N 3.09Å; Y88-F199 HydrophobicContact CD2-CE1 4.34Å; Y88-F199 HydrophobicContact CE1-CZ 4.14Å; Y88-F199 AromaticContact CE2-CE1 3.81Å; Y88-F199 HydrophobicContact CE2-CE1 3.81Å; Y88-F199 HydrophobicContact CE2-CZ 4.24Å; Y88-F199 AromaticContact CZ-CE1 3.9Å; Y88-F199 AromaticContact CZ-CZ 3.99Å
89	G	91.9	Very high	94.8	Very high	74 Å²	74	36.2 Å²	36.2	76%	0.763	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.4	16.3	-176.8	0	0	0	0	0	114.1	R86	R86-G89 PolarHBondContact O-N 3.48Å
90	V	92.7	Very high	94.8	Very high	22 Å²	22	36.4 Å²	36.4	13%	0.133	21%	0.206	C	C	.	.			trans	-98.6	131.9	178.3	175.1	0	0	0	0	109.2	W85 R86 Y88 P92 L136	W85-V90 CarbonylContact C-O 3.48Å; W85-V90 VanDerWaalsContact C-O 3.31Å; W85-V90 HydrophobicContact CB-CB 4.01Å; W85-V90 HydrophobicContact CB-CG1 4.06Å; W85-V90 HydrophobicContact CD2-CG1 4.47Å; W85-V90 HydrophobicContact CE3-CB 4.07Å; W85-V90 HydrophobicContact CE3-CG1 4.16Å; W85-V90 HydrophobicContact CE3-CG2 4.08Å; W85-V90 HydrophobicContact CG-CG1 4.45Å; W85-V90 PolarHBondContact O-N 3.48Å; R86-V90 WeakPolarHBondContact CA-O 3.29Å; R86-V90 PolarHBondContact N-O 3.26Å; Y88-V90 VanDerWaalsContact C-N 3.25Å; Y88-V90 PolarHBondContact O-N 3.09Å; V90-P92 VanDerWaalsContact O-CD 3.25Å; V90-P92 WeakPolarHBondContact O-CD 3.41Å; V90-L136 HydrophobicContact CG1-CB 3.82Å; V90-L136 VanDerWaalsContact CG1-O 3.3Å; V90-L136 WeakPolarHBondContact CG1-O 3.33Å; V90-L136 HydrophobicContact CG2-CB 3.96Å; V90-L136 HydrophobicContact CG2-CD1 3.99Å
91	D	94.3	Very high	94.7	Very high	64 Å²	64	42.6 Å²	42.6	34%	0.342	23%	0.231	S	C	.	.			trans	-76.2	108.5	172.1	171.8	20.7	0	0	0	109.7	G93 R94 R97	D91-G93 VanDerWaalsContact C-N 3.25Å; D91-G93 PolarHBondContact O-N 3.1Å; D91-G93 PolarHBondContact OD1-N 3.45Å; D91-R94 HydrophobicContact CB-CG 3.97Å; D91-R94 WeakPolarHBondContact O-CB 3.37Å; D91-R94 PolarHBondContact O-N 3.26Å; D91-R94 VanDerWaalsContact O-N 3.07Å; D91-R94 WeakPolarHBondContact OD2-CG 3.37Å; D91-R97 IonicContact OD2-CZ 3.89Å; D91-R97 IonicContact OD2-NH1 3.87Å; D91-R97 IonicContact OD2-NH2 3.81Å; D91-R97 PolarHBondContact OD2-NH2 2.89Å
92	P	95	Very high	94.7	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-34.8	-175.4	-18	30.8	0	0	0	112.6	D62 G81 V82 W85 R86 V90 R94 F95	D62-P92 HydrophobicContact CB-CB 4.35Å; G81-P92 WeakPolarHBondContact O-CB 3.46Å; V82-P92 WeakPolarHBondContact O-CB 3.3Å; W85-P92 HydrophobicContact CB-CB 4.39Å; W85-P92 HydrophobicContact CB-CG 4.03Å; R86-P92 HydrophobicContact CG-CG 3.9Å; V90-P92 VanDerWaalsContact O-CD 3.25Å; V90-P92 WeakPolarHBondContact O-CD 3.41Å; P92-R94 PolarHBondContact O-N 2.87Å; P92-R94 VanDerWaalsContact O-N 3.09Å; P92-F95 PolarHBondContact O-N 2.86Å; P92-F95 VanDerWaalsContact O-N 3.1Å
93	G	95.3	Very high	94.8	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.5	-18.7	177.7	0	0	0	0	0	113.7	D62 D91 F95 S96 R97	D62-G93 PolarHBondContact OD1-N 2.94Å; D91-G93 VanDerWaalsContact C-N 3.25Å; D91-G93 PolarHBondContact O-N 3.1Å; D91-G93 PolarHBondContact OD1-N 3.45Å; G93-F95 VanDerWaalsContact C-N 3.29Å; G93-F95 PolarHBondContact O-N 3.23Å; G93-S96 WeakPolarHBondContact CA-OG 3.44Å; G93-S96 PolarHBondContact O-OG 3.44Å; G93-S96 VanDerWaalsContact O-OG 3.13Å; G93-R97 VanDerWaalsContact C-NH1 3.33Å; G93-R97 WeakPolarHBondContact O-CB 3.39Å; G93-R97 WeakPolarHBondContact O-CG 3.37Å; G93-R97 PolarHBondContact O-N 2.97Å; G93-R97 VanDerWaalsContact O-N 3.12Å; G93-R97 PolarHBondContact O-NE 2.87Å; G93-R97 VanDerWaalsContact O-NE 3.1Å; G93-R97 PolarHBondContact O-NH1 3.49Å
94	R	95.5	Very high	95	Very high	109 Å²	109	44.1 Å²	44.1	41%	0.411	23%	0.229	S	C	.	.	H	α-helix	trans	-63.1	-39.2	174.9	-71.2	-169.9	78.6	-175.6	3.3	111.5	D91 P92 A98 E133 I135	D91-R94 HydrophobicContact CB-CG 3.97Å; D91-R94 WeakPolarHBondContact O-CB 3.37Å; D91-R94 PolarHBondContact O-N 3.26Å; D91-R94 VanDerWaalsContact O-N 3.07Å; D91-R94 WeakPolarHBondContact OD2-CG 3.37Å; P92-R94 PolarHBondContact O-N 2.87Å; P92-R94 VanDerWaalsContact O-N 3.09Å; R94-A98 WeakPolarHBondContact O-CB 3.43Å; R94-A98 PolarHBondContact O-N 3.48Å; R94-A98 VanDerWaalsContact O-N 3.13Å; R94-E133 IonicContact NH2-OE2 3.9Å; R94-E133 PolarHBondContact NH2-OE2 3.28Å; R94-I135 HydrophobicContact CB-CG2 4.45Å
95	F	97.1	Very high	95.3	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-72.9	-51.9	-176.5	-168.2	-83.2	0	0	0	111.2	P92 G93 R97 A98 V99 Y125 V128 I135 G137 S138 A139 L188 C190	P92-F95 PolarHBondContact O-N 2.86Å; P92-F95 VanDerWaalsContact O-N 3.1Å; G93-F95 VanDerWaalsContact C-N 3.29Å; G93-F95 PolarHBondContact O-N 3.23Å; F95-R97 VanDerWaalsContact C-N 3.34Å; F95-R97 PolarHBondContact O-N 2.8Å; F95-A98 WeakPolarHBondContact O-CB 3.44Å; F95-A98 PolarHBondContact O-N 3.34Å; F95-A98 VanDerWaalsContact O-N 3.09Å; F95-V99 HydrophobicContact CD1-CG2 3.82Å; F95-V99 HydrophobicContact CE1-CG2 3.54Å; F95-V99 HydrophobicContact CZ-CG2 4.22Å; F95-V99 WeakPolarHBondContact O-CG2 3.41Å; F95-V99 PolarHBondContact O-N 3.38Å; F95-Y125 HydrophobicContact CZ-CD2 4.3Å; F95-Y125 HydrophobicContact CZ-CE2 4.13Å; F95-V128 HydrophobicContact CD2-CG1 4.15Å; F95-V128 HydrophobicContact CE2-CG1 3.74Å; F95-V128 HydrophobicContact CZ-CG1 4.33Å; F95-I135 HydrophobicContact CB-CG2 4.36Å; F95-I135 HydrophobicContact CD2-CG2 4.18Å; F95-G137 VanDerWaalsContact CD2-C 3.48Å; F95-G137 WeakPolarHBondContact CD2-O 3.21Å; F95-S138 VanDerWaalsContact CD1-C 3.47Å; F95-A139 HydrophobicContact CD1-CB 3.67Å; F95-A139 HydrophobicContact CE1-CB 4.14Å; F95-L188 HydrophobicContact CE1-CB 3.92Å; F95-L188 VanDerWaalsContact CE1-O 3.29Å; F95-L188 WeakPolarHBondContact CE1-O 3.35Å; F95-L188 HydrophobicContact CZ-CB 4.02Å; F95-L188 WeakPolarHBondContact CZ-O 3.28Å; F95-C190 HydrophobicContact CD2-CB 4.24Å; F95-C190 HydrophobicContact CE2-CB 3.66Å
96	S	97.7	Very high	95.5	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-55.9	-45.9	176.9	58.2	0	0	0	0	112.1	D62 G93 A98 V99 M100	D62-S96 WeakPolarHBondContact O-CB 3.36Å; D62-S96 PolarHBondContact O-OG 3.25Å; G93-S96 WeakPolarHBondContact CA-OG 3.44Å; G93-S96 PolarHBondContact O-OG 3.44Å; G93-S96 VanDerWaalsContact O-OG 3.13Å; S96-A98 VanDerWaalsContact C-N 3.34Å; S96-A98 PolarHBondContact O-N 3.23Å; S96-V99 PolarHBondContact O-N 2.71Å; S96-M100 WeakPolarHBondContact O-CG 3.26Å; S96-M100 PolarHBondContact O-N 2.95Å
97	R	97.2	Very high	95.7	Very high	73 Å²	73	44.2 Å²	44.2	28%	0.275	22%	0.224	S	C	.	.	H	α-helix	trans	-60.1	-41.2	175.7	-72	-175.8	-60.1	-99.3	5.6	112.5	V59 A64 D91 G93 F95 K101	V59-R97 HydrophobicContact CG1-CG 4.25Å; V59-R97 HydrophobicContact CG2-CG 3.86Å; A64-R97 HydrophobicContact CB-CB 4.34Å; A64-R97 HydrophobicContact CB-CG 3.82Å; D91-R97 IonicContact OD2-CZ 3.89Å; D91-R97 IonicContact OD2-NH1 3.87Å; D91-R97 IonicContact OD2-NH2 3.81Å; D91-R97 PolarHBondContact OD2-NH2 2.89Å; G93-R97 VanDerWaalsContact C-NH1 3.33Å; G93-R97 WeakPolarHBondContact O-CB 3.39Å; G93-R97 WeakPolarHBondContact O-CG 3.37Å; G93-R97 PolarHBondContact O-N 2.97Å; G93-R97 VanDerWaalsContact O-N 3.12Å; G93-R97 PolarHBondContact O-NE 2.87Å; G93-R97 VanDerWaalsContact O-NE 3.1Å; G93-R97 PolarHBondContact O-NH1 3.49Å; F95-R97 VanDerWaalsContact C-N 3.34Å; F95-R97 PolarHBondContact O-N 2.8Å; R97-K101 WeakPolarHBondContact O-CB 3.26Å; R97-K101 PolarHBondContact O-N 2.89Å
98	A	97.1	Very high	95.9	Very high	15 Å²	15	43.4 Å²	43.4	12%	0.124	21%	0.213	C	C	.	.	H	α-helix	trans	-67.2	-44.2	179.3	0	0	0	0	0	111.9	R94 F95 S96 K101 N102 V128 I135	R94-A98 WeakPolarHBondContact O-CB 3.43Å; R94-A98 PolarHBondContact O-N 3.48Å; R94-A98 VanDerWaalsContact O-N 3.13Å; F95-A98 WeakPolarHBondContact O-CB 3.44Å; F95-A98 PolarHBondContact O-N 3.34Å; F95-A98 VanDerWaalsContact O-N 3.09Å; S96-A98 VanDerWaalsContact C-N 3.34Å; S96-A98 PolarHBondContact O-N 3.23Å; A98-K101 PolarHBondContact O-N 3.14Å; A98-N102 WeakPolarHBondContact O-CB 3.47Å; A98-N102 PolarHBondContact O-N 2.85Å; A98-V128 HydrophobicContact CB-CG2 3.99Å; A98-I135 HydrophobicContact CB-CD1 3.75Å; A98-I135 HydrophobicContact CB-CG2 4.03Å
99	V	97.6	Very high	96.2	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-58.4	-53.2	176.3	175.5	0	0	0	0	110.2	F95 S96 K101 N102 C103 V128 L141	F95-V99 HydrophobicContact CD1-CG2 3.82Å; F95-V99 HydrophobicContact CE1-CG2 3.54Å; F95-V99 HydrophobicContact CZ-CG2 4.22Å; F95-V99 WeakPolarHBondContact O-CG2 3.41Å; F95-V99 PolarHBondContact O-N 3.38Å; S96-V99 PolarHBondContact O-N 2.71Å; V99-K101 PolarHBondContact O-N 2.79Å; V99-N102 PolarHBondContact O-N 2.64Å; V99-C103 PolarHBondContact O-N 2.9Å; V99-C103 PolarHBondContact O-SG 2.88Å; V99-C103 VanDerWaalsContact O-SG 3.36Å; V99-V128 HydrophobicContact CG2-CG2 4.03Å; V99-L141 HydrophobicContact CG1-CD2 4.28Å
100	M	97.8	Very high	96.2	Very high	4 Å²	4	40.7 Å²	40.7	2%	0.02	21%	0.211	C	C	.	.	H	α-helix	trans	-63.3	-40.6	-178.6	-65.2	-63.4	93.2	0	0	112.8	A64 F66 A79 S96 N102 C103 E104 L141	A64-M100 HydrophobicContact CB-CB 4.19Å; A64-M100 HydrophobicContact CB-CG 3.84Å; A64-M100 WeakPolarHBondContact O-CG 3.35Å; F66-M100 HydrophobicContact CB-CB 4.46Å; F66-M100 HydrophobicContact CD1-CB 4.16Å; F66-M100 HydrophobicContact CD1-CE 4.45Å; F66-M100 HydrophobicContact CD1-CG 4.47Å; F66-M100 HydrophobicContact CD1-SD 3.58Å; F66-M100 VanDerWaalsContact CD1-SD 3.58Å; F66-M100 HydrophobicContact CE1-CE 4.39Å; F66-M100 HydrophobicContact CE1-SD 4Å; A79-M100 HydrophobicContact CB-CE 3.68Å; A79-M100 HydrophobicContact CB-CG 3.85Å; A79-M100 HydrophobicContact CB-SD 3.94Å; S96-M100 WeakPolarHBondContact O-CG 3.26Å; S96-M100 PolarHBondContact O-N 2.95Å; M100-N102 VanDerWaalsContact C-N 3.35Å; M100-N102 PolarHBondContact O-N 2.82Å; M100-C103 WeakPolarHBondContact O-CB 3.33Å; M100-C103 PolarHBondContact O-N 2.93Å; M100-E104 PolarHBondContact O-N 3.19Å; M100-L141 HydrophobicContact CE-CB 4.45Å
101	K	97	Very high	96.1	Very high	151 Å²	151	45.7 Å²	45.7	66%	0.657	23%	0.227	S	C	*	.	H	α-helix	trans	-64.3	-38.7	175.4	-174.5	179.4	-179.3	-178.2	0	112.2	R97 A98 V99 R105	R97-K101 WeakPolarHBondContact O-CB 3.26Å; R97-K101 PolarHBondContact O-N 2.89Å; A98-K101 PolarHBondContact O-N 3.14Å; V99-K101 PolarHBondContact O-N 2.79Å; K101-R105 WeakPolarHBondContact O-CB 3.46Å; K101-R105 PolarHBondContact O-N 3.24Å
102	N	97.1	Very high	96.2	Very high	22 Å²	22	43.7 Å²	43.7	12%	0.118	22%	0.216	C	C	.	.	H	α-helix	trans	-68.4	-41.7	175.5	-79.4	-19.5	0	0	0	111.4	A98 V99 M100 R105 V106 C124 D127 V128	A98-N102 WeakPolarHBondContact O-CB 3.47Å; A98-N102 PolarHBondContact O-N 2.85Å; V99-N102 PolarHBondContact O-N 2.64Å; M100-N102 VanDerWaalsContact C-N 3.35Å; M100-N102 PolarHBondContact O-N 2.82Å; N102-R105 PolarHBondContact O-N 3.46Å; N102-R105 PolarHBondContact OD1-NH2 2.77Å; N102-R105 VanDerWaalsContact OD1-NH2 3.08Å; N102-V106 WeakPolarHBondContact O-CG2 3.32Å; N102-V106 PolarHBondContact O-N 2.81Å; N102-C124 HydrophobicContact CB-CB 3.82Å; N102-C124 PolarHBondContact ND2-O 3.16Å; N102-D127 HydrophobicContact CB-CB 4.34Å; N102-D127 VanDerWaalsContact ND2-CB 3.33Å; N102-D127 WeakPolarHBondContact ND2-CB 3.27Å; N102-V128 WeakPolarHBondContact ND2-CG2 3.48Å; N102-V128 PolarHBondContact ND2-N 2.88Å
103	C	97.5	Very high	96.2	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-56	-52.4	172.3	-71.2	0	0	0	0	111.4	F66 V99 M100 R105 V106 V107 L120 C124	F66-C103 HydrophobicContact CD1-CB 3.96Å; F66-C103 HydrophobicContact CE1-CB 3.38Å; F66-C103 HydrophobicContact CE2-CB 4.26Å; F66-C103 HydrophobicContact CZ-CB 3.56Å; V99-C103 PolarHBondContact O-N 2.9Å; V99-C103 PolarHBondContact O-SG 2.88Å; V99-C103 VanDerWaalsContact O-SG 3.36Å; M100-C103 WeakPolarHBondContact O-CB 3.33Å; M100-C103 PolarHBondContact O-N 2.93Å; C103-R105 VanDerWaalsContact C-N 3.27Å; C103-R105 PolarHBondContact O-N 3.5Å; C103-V106 PolarHBondContact O-N 3.44Å; C103-V106 VanDerWaalsContact O-N 3.16Å; C103-V107 VanDerWaalsContact O-CG2 3.31Å; C103-V107 WeakPolarHBondContact O-CG2 3.46Å; C103-V107 PolarHBondContact O-N 2.84Å; C103-L120 HydrophobicContact CB-CD1 4.47Å; C103-C124 VanDerWaalsContact SG-CB 3.59Å; C103-C124 PolarHBondContact SG-SG 3.44Å
104	E	97.4	Very high	96	Very high	75 Å²	75	48.3 Å²	48.3	35%	0.35	24%	0.24	S	C	.	.	H	α-helix	trans	-55.9	-42.4	177.7	-175.6	-178.7	-155.4	0	0	111.6	F66 M100 N108	F66-E104 HydrophobicContact CB-CB 4.13Å; F66-E104 HydrophobicContact CD2-CB 3.86Å; F66-E104 HydrophobicContact CD2-CG 4.4Å; F66-E104 HydrophobicContact CG-CB 4.13Å; M100-E104 PolarHBondContact O-N 3.19Å; E104-N108 WeakPolarHBondContact CG-ND2 3.36Å; E104-N108 VanDerWaalsContact O-CB 3.31Å; E104-N108 WeakPolarHBondContact O-CB 2.94Å; E104-N108 PolarHBondContact O-N 3.21Å; E104-N108 PolarHBondContact O-ND2 2.88Å
105	R	96.8	Very high	96	Very high	112 Å²	112	46.8 Å²	46.8	42%	0.423	24%	0.241	S	C	.	.	H	α-helix	trans	-64.6	-44.2	177.8	-178.7	174.9	55.1	75.9	6	112.5	K101 N102 C103 N108 S109 D127	K101-R105 WeakPolarHBondContact O-CB 3.46Å; K101-R105 PolarHBondContact O-N 3.24Å; N102-R105 PolarHBondContact O-N 3.46Å; N102-R105 PolarHBondContact OD1-NH2 2.77Å; N102-R105 VanDerWaalsContact OD1-NH2 3.08Å; C103-R105 VanDerWaalsContact C-N 3.27Å; C103-R105 PolarHBondContact O-N 3.5Å; R105-N108 PolarHBondContact O-N 2.85Å; R105-S109 WeakPolarHBondContact O-CB 3.39Å; R105-S109 PolarHBondContact O-N 2.78Å; R105-D127 IonicContact CZ-OD2 3.34Å; R105-D127 IonicContact NH1-OD2 3.01Å; R105-D127 IonicContact NH2-OD1 3.85Å; R105-D127 IonicContact NH2-OD2 2.91Å; R105-D127 PolarHBondContact NH2-OD2 3.25Å
106	V	96.8	Very high	96	Very high	7 Å²	7	51.4 Å²	51.4	4%	0.042	26%	0.261	C	S	.	.	H	α-helix	trans	-66.5	-42.5	179.4	174.4	0	0	0	0	110.7	N102 C103 N108 S109 L120 Q123	N102-V106 WeakPolarHBondContact O-CG2 3.32Å; N102-V106 PolarHBondContact O-N 2.81Å; C103-V106 PolarHBondContact O-N 3.44Å; C103-V106 VanDerWaalsContact O-N 3.16Å; V106-N108 VanDerWaalsContact C-N 3.33Å; V106-N108 PolarHBondContact O-N 3.23Å; V106-S109 PolarHBondContact O-N 3.44Å; V106-S109 PolarHBondContact O-OG 3.19Å; V106-S109 VanDerWaalsContact O-OG 3.08Å; V106-L120 HydrophobicContact CB-CD1 3.64Å; V106-L120 HydrophobicContact CG1-CD1 3.53Å; V106-Q123 HydrophobicContact CG1-CG 4.39Å; V106-Q123 HydrophobicContact CG2-CB 4.4Å; V106-Q123 HydrophobicContact CG2-CG 3.75Å
107	V	97.3	Very high	96	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.006	26%	0.261	C	S	.	.	H	α-helix	trans	-58.4	-46.5	174.9	177.9	0	0	0	0	111.1	F66 S68 T70 V75 C103 S109 F112 L120	F66-V107 HydrophobicContact CE2-CG2 4.25Å; S68-V107 WeakPolarHBondContact OG-CG1 3.37Å; T70-V107 HydrophobicContact CG2-CG1 3.56Å; V75-V107 HydrophobicContact CB-CG1 4.27Å; V75-V107 HydrophobicContact CB-CG2 4.31Å; V75-V107 HydrophobicContact CG1-CG2 4.13Å; V75-V107 HydrophobicContact CG2-CG1 3.78Å; V75-V107 HydrophobicContact CG2-CG2 4.19Å; C103-V107 VanDerWaalsContact O-CG2 3.31Å; C103-V107 WeakPolarHBondContact O-CG2 3.46Å; C103-V107 PolarHBondContact O-N 2.84Å; V107-S109 VanDerWaalsContact C-N 3.27Å; V107-S109 PolarHBondContact O-N 3.34Å; V107-F112 HydrophobicContact CB-CB 4.46Å; V107-F112 HydrophobicContact CB-CG 4.42Å; V107-F112 HydrophobicContact CG1-CD1 4.11Å; V107-F112 HydrophobicContact CG1-CG 4.26Å; V107-F112 HydrophobicContact CG2-CB 4.45Å; V107-F112 HydrophobicContact CG2-CD2 3.94Å; V107-F112 HydrophobicContact CG2-CE2 4.3Å; V107-F112 HydrophobicContact CG2-CG 4.05Å; V107-L120 HydrophobicContact CG2-CD1 4.04Å; V107-L120 HydrophobicContact CG2-CD2 3.89Å
108	N	96.3	Very high	95.9	Very high	70 Å²	70	51.6 Å²	51.6	37%	0.374	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-3.3	-179.4	-72	-50.6	0	0	0	114.8	S68 E104 R105 V106 G110	S68-N108 VanDerWaalsContact OG-CG 3.26Å; S68-N108 PolarHBondContact OG-ND2 3.41Å; S68-N108 VanDerWaalsContact OG-ND2 3.09Å; S68-N108 PolarHBondContact OG-OD1 3.39Å; E104-N108 WeakPolarHBondContact CG-ND2 3.36Å; E104-N108 VanDerWaalsContact O-CB 3.31Å; E104-N108 WeakPolarHBondContact O-CB 2.94Å; E104-N108 PolarHBondContact O-N 3.21Å; E104-N108 PolarHBondContact O-ND2 2.88Å; R105-N108 PolarHBondContact O-N 2.85Å; V106-N108 VanDerWaalsContact C-N 3.33Å; V106-N108 PolarHBondContact O-N 3.23Å; N108-G110 VanDerWaalsContact C-N 3.33Å
109	S	95.4	Very high	95.9	Very high	56 Å²	56	54.4 Å²	54.4	39%	0.392	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-1.9	179.2	86.4	0	0	0	0	113.6	R105 V106 V107 R111	R105-S109 WeakPolarHBondContact O-CB 3.39Å; R105-S109 PolarHBondContact O-N 2.78Å; V106-S109 PolarHBondContact O-N 3.44Å; V106-S109 PolarHBondContact O-OG 3.19Å; V106-S109 VanDerWaalsContact O-OG 3.08Å; V107-S109 VanDerWaalsContact C-N 3.27Å; V107-S109 PolarHBondContact O-N 3.34Å; S109-R111 PolarHBondContact O-N 3.44Å; S109-R111 WeakPolarHBondContact OG-CB 3.37Å; S109-R111 WeakPolarHBondContact OG-CG 3.29Å; S109-R111 PolarHBondContact OG-NE 2.93Å
110	G	91	Very high	95.9	Very high	74 Å²	74	54.6 Å²	54.6	76%	0.763	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.2	7.1	-174.7	0	0	0	0	0	114.6	N108	N108-G110 VanDerWaalsContact C-N 3.33Å
111	R	91	Very high	95.9	Very high	127 Å²	127	54.4 Å²	54.4	48%	0.479	28%	0.28	S	S	.	.			trans	-93.9	-4.3	176.7	-64.7	-176.4	-63.6	149.1	1.1	112.9	S109	S109-R111 PolarHBondContact O-N 3.44Å; S109-R111 WeakPolarHBondContact OG-CB 3.37Å; S109-R111 WeakPolarHBondContact OG-CG 3.29Å; S109-R111 PolarHBondContact OG-NE 2.93Å
112	F	95.4	Very high	95.9	Very high	22 Å²	22	49.2 Å²	49.2	10%	0.096	27%	0.265	C	S	.	.			trans	-75.6	133.5	-174.4	169.8	-110.3	0	0	0	112.3	T70 V75 V107 P114 L117 L120	T70-F112 HydrophobicContact CG2-CD1 4.43Å; V75-F112 HydrophobicContact CG1-CZ 4.4Å; V75-F112 HydrophobicContact CG2-CD1 4.14Å; V75-F112 HydrophobicContact CG2-CE1 3.33Å; V75-F112 HydrophobicContact CG2-CE2 4.28Å; V75-F112 HydrophobicContact CG2-CZ 3.4Å; V75-F112 VanDerWaalsContact CG2-CZ 3.4Å; V107-F112 HydrophobicContact CB-CB 4.46Å; V107-F112 HydrophobicContact CB-CG 4.42Å; V107-F112 HydrophobicContact CG1-CD1 4.11Å; V107-F112 HydrophobicContact CG1-CG 4.26Å; V107-F112 HydrophobicContact CG2-CB 4.45Å; V107-F112 HydrophobicContact CG2-CD2 3.94Å; V107-F112 HydrophobicContact CG2-CE2 4.3Å; V107-F112 HydrophobicContact CG2-CG 4.05Å; F112-P114 HydrophobicContact CD1-CG 4.41Å; F112-P114 HydrophobicContact CE1-CB 4.18Å; F112-P114 HydrophobicContact CE1-CG 3.99Å; F112-P114 HydrophobicContact CZ-CB 4.43Å; F112-L117 HydrophobicContact CE2-CD2 3.98Å; F112-L117 HydrophobicContact CZ-CD2 4.24Å; F112-L120 HydrophobicContact CD2-CB 4.47Å; F112-L120 HydrophobicContact CD2-CD1 4.49Å; F112-L120 HydrophobicContact CD2-CD2 4.1Å; F112-L120 HydrophobicContact CE2-CD2 3.83Å
113	I	95.2	Very high	95.9	Very high	76 Å²	76	50.6 Å²	50.6	39%	0.39	27%	0.271	S	S	.	.			trans	-113.7	111.5	178.7	-61.5	172.2	0	0	0	107.2	D115 K116	I113-D115 VanDerWaalsContact C-N 3.29Å; I113-D115 WeakPolarHBondContact CG2-OD1 3.1Å; I113-D115 PolarHBondContact O-N 2.89Å; I113-K116 HydrophobicContact CB-CB 4.11Å; I113-K116 HydrophobicContact CB-CD 4.49Å; I113-K116 HydrophobicContact CB-CG 4.43Å; I113-K116 HydrophobicContact CD1-CD 4.27Å; I113-K116 HydrophobicContact CG2-CB 3.91Å; I113-K116 HydrophobicContact CG2-CD 3.88Å; I113-K116 HydrophobicContact CG2-CG 3.74Å; I113-K116 PolarHBondContact O-N 2.78Å; I113-K116 VanDerWaalsContact O-N 3.08Å
114	P	92.8	Very high	95.8	Very high	20 Å²	20	50.6 Å²	50.6	13%	0.13	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-32.4	-167.4	-31.7	38.5	0	0	0	117.1	S73 F112 S145 Q147	S73-P114 VanDerWaalsContact OG-CB 3.24Å; S73-P114 WeakPolarHBondContact OG-CB 3.49Å; S73-P114 WeakPolarHBondContact OG-CG 3.48Å; F112-P114 HydrophobicContact CD1-CG 4.41Å; F112-P114 HydrophobicContact CE1-CB 4.18Å; F112-P114 HydrophobicContact CE1-CG 3.99Å; F112-P114 HydrophobicContact CZ-CB 4.43Å; P114-S145 WeakPolarHBondContact O-CB 3.5Å; P114-S145 PolarHBondContact O-OG 2.84Å; P114-S145 VanDerWaalsContact O-OG 3.12Å; P114-Q147 HydrophobicContact CB-CB 4.46Å; P114-Q147 HydrophobicContact CB-CG 4.03Å; P114-Q147 HydrophobicContact CG-CG 4.49Å
115	D	95.3	Very high	95.8	Very high	77 Å²	77	48.4 Å²	48.4	41%	0.412	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-0.3	-177.5	65.5	-31.8	0	0	0	113.3	I113 Y154	I113-D115 VanDerWaalsContact C-N 3.29Å; I113-D115 WeakPolarHBondContact CG2-OD1 3.1Å; I113-D115 PolarHBondContact O-N 2.89Å; D115-Y154 HydrophobicContact CB-CD1 3.86Å; D115-Y154 HydrophobicContact CB-CD2 4.28Å; D115-Y154 HydrophobicContact CB-CE1 3.44Å; D115-Y154 VanDerWaalsContact CB-CE1 3.44Å; D115-Y154 HydrophobicContact CB-CE2 3.93Å; D115-Y154 HydrophobicContact CB-CG 4.25Å; D115-Y154 VanDerWaalsContact CB-CZ 3.47Å
116	K	96.4	Very high	95.8	Very high	98 Å²	98	47.7 Å²	47.7	43%	0.426	26%	0.261	S	S	.	.			trans	-117.5	60.4	-179.1	-63.2	-170.4	-178.6	-177.5	0	112	I113 E118 V119 L120	I113-K116 HydrophobicContact CB-CB 4.11Å; I113-K116 HydrophobicContact CB-CD 4.49Å; I113-K116 HydrophobicContact CB-CG 4.43Å; I113-K116 HydrophobicContact CD1-CD 4.27Å; I113-K116 HydrophobicContact CG2-CB 3.91Å; I113-K116 HydrophobicContact CG2-CD 3.88Å; I113-K116 HydrophobicContact CG2-CG 3.74Å; I113-K116 PolarHBondContact O-N 2.78Å; I113-K116 VanDerWaalsContact O-N 3.08Å; K116-E118 VanDerWaalsContact C-N 3.26Å; K116-E118 PolarHBondContact O-N 2.81Å; K116-V119 HydrophobicContact CB-CB 4.28Å; K116-V119 HydrophobicContact CB-CG2 3.97Å; K116-V119 HydrophobicContact CD-CG2 4.39Å; K116-V119 WeakPolarHBondContact O-CB 3.3Å; K116-V119 PolarHBondContact O-N 3.22Å; K116-V119 VanDerWaalsContact O-N 3.11Å; K116-L120 PolarHBondContact O-N 3.44Å
117	L	97.3	Very high	95.8	Very high	1 Å²	1	49 Å²	49	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-63.2	-31	-179.6	-68.3	-179.1	0	0	0	113.1	F112 V119 L120 I121 I143 Y154 A156	F112-L117 HydrophobicContact CE2-CD2 3.98Å; F112-L117 HydrophobicContact CZ-CD2 4.24Å; L117-V119 PolarHBondContact O-N 3.02Å; L117-L120 HydrophobicContact CD2-CD2 4.33Å; L117-L120 WeakPolarHBondContact O-CB 3.32Å; L117-L120 PolarHBondContact O-N 3.38Å; L117-L120 VanDerWaalsContact O-N 3.15Å; L117-I121 WeakPolarHBondContact O-CG1 3.12Å; L117-I121 PolarHBondContact O-N 3.39Å; L117-I143 WeakPolarHBondContact CD1-O 3.45Å; L117-I143 HydrophobicContact CD2-CG2 3.9Å; L117-Y154 WeakPolarHBondContact CD1-O 3.41Å; L117-A156 HydrophobicContact CB-CB 3.55Å; L117-A156 HydrophobicContact CD1-CB 3.84Å; L117-A156 HydrophobicContact CG-CB 4.36Å
118	E	96	Very high	95.7	Very high	75 Å²	75	49.1 Å²	49.1	35%	0.35	27%	0.269	S	S	.	.	H	α-helix	trans	-56.9	-36.3	172.6	67.1	-175.4	-167.1	0	0	112.9	K116 I121 A122 Q209	K116-E118 VanDerWaalsContact C-N 3.26Å; K116-E118 PolarHBondContact O-N 2.81Å; E118-I121 PolarHBondContact O-N 3.42Å; E118-A122 WeakPolarHBondContact O-CB 3.33Å; E118-A122 PolarHBondContact O-N 2.83Å; E118-Q209 PolarHBondContact OE2-NE2 3.24Å
119	V	96.8	Very high	95.6	Very high	74 Å²	74	49.7 Å²	49.7	45%	0.448	27%	0.271	S	S	.	.	H	α-helix	trans	-72.3	-37.8	179.5	179.2	0	0	0	0	110.1	K116 L117 A122 Q123	K116-V119 HydrophobicContact CB-CB 4.28Å; K116-V119 HydrophobicContact CB-CG2 3.97Å; K116-V119 HydrophobicContact CD-CG2 4.39Å; K116-V119 WeakPolarHBondContact O-CB 3.3Å; K116-V119 PolarHBondContact O-N 3.22Å; K116-V119 VanDerWaalsContact O-N 3.11Å; L117-V119 PolarHBondContact O-N 3.02Å; V119-A122 PolarHBondContact O-N 2.87Å; V119-Q123 WeakPolarHBondContact O-CB 3.03Å; V119-Q123 PolarHBondContact O-N 3.07Å
120	L	97.8	Very high	95.6	Very high	5 Å²	5	52.7 Å²	52.7	3%	0.026	28%	0.283	C	S	.	.	H	α-helix	trans	-60.9	-47.7	172.7	174.6	63	0	0	0	110.9	C103 V106 V107 F112 K116 L117 Q123 C124 I143	C103-L120 HydrophobicContact CB-CD1 4.47Å; V106-L120 HydrophobicContact CB-CD1 3.64Å; V106-L120 HydrophobicContact CG1-CD1 3.53Å; V107-L120 HydrophobicContact CG2-CD1 4.04Å; V107-L120 HydrophobicContact CG2-CD2 3.89Å; F112-L120 HydrophobicContact CD2-CB 4.47Å; F112-L120 HydrophobicContact CD2-CD1 4.49Å; F112-L120 HydrophobicContact CD2-CD2 4.1Å; F112-L120 HydrophobicContact CE2-CD2 3.83Å; K116-L120 PolarHBondContact O-N 3.44Å; L117-L120 HydrophobicContact CD2-CD2 4.33Å; L117-L120 WeakPolarHBondContact O-CB 3.32Å; L117-L120 PolarHBondContact O-N 3.38Å; L117-L120 VanDerWaalsContact O-N 3.15Å; L120-Q123 PolarHBondContact O-N 3.26Å; L120-C124 WeakPolarHBondContact O-CB 3.38Å; L120-C124 PolarHBondContact O-N 3.15Å; L120-I143 HydrophobicContact CD2-CD1 4.09Å; L120-I143 HydrophobicContact CD2-CG2 4.16Å; L120-I143 HydrophobicContact CG-CD1 4.47Å
121	I	97.8	Very high	95.8	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-63.3	-42.7	178.8	-62.6	163.2	0	0	0	110.4	L117 E118 C124 Y125 L141 I143 A156 L188 P204 A207	L117-I121 WeakPolarHBondContact O-CG1 3.12Å; L117-I121 PolarHBondContact O-N 3.39Å; E118-I121 PolarHBondContact O-N 3.42Å; I121-C124 PolarHBondContact O-N 2.82Å; I121-C124 PolarHBondContact O-SG 2.79Å; I121-Y125 VanDerWaalsContact O-CB 3.25Å; I121-Y125 WeakPolarHBondContact O-CB 3.24Å; I121-Y125 PolarHBondContact O-N 3.35Å; I121-L141 HydrophobicContact CD1-CD1 3.68Å; I121-L141 HydrophobicContact CG1-CD1 3.94Å; I121-L141 HydrophobicContact CG2-CD1 4.42Å; I121-L141 HydrophobicContact CG2-CD2 4.08Å; I121-I143 HydrophobicContact CD1-CD1 4.5Å; I121-I143 HydrophobicContact CG1-CD1 3.8Å; I121-A156 HydrophobicContact CD1-CB 3.78Å; I121-L188 HydrophobicContact CG2-CD1 3.94Å; I121-P204 HydrophobicContact CB-CB 4.3Å; I121-P204 HydrophobicContact CG2-CB 3.81Å; I121-P204 HydrophobicContact CG2-CG 4.28Å; I121-A207 HydrophobicContact CD1-CB 4.02Å
122	A	97.5	Very high	95.9	Very high	41 Å²	41	55.9 Å²	55.9	34%	0.339	29%	0.285	S	S	.	.	H	α-helix	trans	-62.1	-47.9	178.2	0	0	0	0	0	112.2	E118 V119 Y125 E126 P204	E118-A122 WeakPolarHBondContact O-CB 3.33Å; E118-A122 PolarHBondContact O-N 2.83Å; V119-A122 PolarHBondContact O-N 2.87Å; A122-Y125 PolarHBondContact O-N 2.79Å; A122-E126 WeakPolarHBondContact O-CB 3.36Å; A122-E126 PolarHBondContact O-N 2.81Å; A122-P204 HydrophobicContact CB-CB 3.88Å; A122-P204 HydrophobicContact CB-CG 4.19Å
123	Q	96.9	Very high	95.8	Very high	51 Å²	51	61 Å²	61	24%	0.238	31%	0.309	C	S	.	.	H	α-helix	trans	-64.4	-42.4	178.4	-174.4	68.6	70.9	0	0	111.7	V106 V119 L120 Y125 E126 D127	V106-Q123 HydrophobicContact CG1-CG 4.39Å; V106-Q123 HydrophobicContact CG2-CB 4.4Å; V106-Q123 HydrophobicContact CG2-CG 3.75Å; V119-Q123 WeakPolarHBondContact O-CB 3.03Å; V119-Q123 PolarHBondContact O-N 3.07Å; L120-Q123 PolarHBondContact O-N 3.26Å; Q123-Y125 VanDerWaalsContact C-N 3.29Å; Q123-Y125 PolarHBondContact O-N 2.89Å; Q123-E126 PolarHBondContact O-N 3.02Å; Q123-D127 PolarHBondContact NE2-OD1 3.04Å; Q123-D127 WeakPolarHBondContact O-CB 3.44Å; Q123-D127 PolarHBondContact O-N 2.95Å
124	C	95.6	Very high	95.7	Very high	0 Å²	0	63 Å²	63	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-65.9	-37.3	-179.5	80.9	0	0	0	0	111.5	N102 C103 L120 I121 D127 V128	N102-C124 HydrophobicContact CB-CB 3.82Å; N102-C124 PolarHBondContact ND2-O 3.16Å; C103-C124 VanDerWaalsContact SG-CB 3.59Å; C103-C124 PolarHBondContact SG-SG 3.44Å; L120-C124 WeakPolarHBondContact O-CB 3.38Å; L120-C124 PolarHBondContact O-N 3.15Å; I121-C124 PolarHBondContact O-N 2.82Å; I121-C124 PolarHBondContact O-SG 2.79Å; C124-D127 PolarHBondContact O-N 3.44Å; C124-V128 WeakPolarHBondContact O-CG2 3.25Å; C124-V128 PolarHBondContact O-N 2.78Å; C124-V128 VanDerWaalsContact O-N 3.1Å
125	Y	97	Very high	95.8	Very high	29 Å²	29	63 Å²	63	11%	0.114	32%	0.319	C	S	.	.	H	α-helix	trans	-69.1	-45.5	177.9	-178.2	-134.7	0	0	0	111.5	F95 I121 A122 Q123 D127 V128 L129 L188 S189 P204	F95-Y125 HydrophobicContact CZ-CD2 4.3Å; F95-Y125 HydrophobicContact CZ-CE2 4.13Å; I121-Y125 VanDerWaalsContact O-CB 3.25Å; I121-Y125 WeakPolarHBondContact O-CB 3.24Å; I121-Y125 PolarHBondContact O-N 3.35Å; A122-Y125 PolarHBondContact O-N 2.79Å; Q123-Y125 VanDerWaalsContact C-N 3.29Å; Q123-Y125 PolarHBondContact O-N 2.89Å; Y125-D127 VanDerWaalsContact C-N 3.25Å; Y125-D127 PolarHBondContact O-N 3.34Å; Y125-V128 WeakPolarHBondContact O-CA 3.32Å; Y125-V128 WeakPolarHBondContact O-CB 3.44Å; Y125-V128 PolarHBondContact O-N 2.81Å; Y125-L129 HydrophobicContact CD1-CD1 4.2Å; Y125-L129 HydrophobicContact CD2-CD1 4.48Å; Y125-L129 HydrophobicContact CD2-CG 4.23Å; Y125-L129 HydrophobicContact CE1-CD1 3.84Å; Y125-L129 HydrophobicContact CE2-CD1 4.11Å; Y125-L129 HydrophobicContact CE2-CD2 3.87Å; Y125-L129 HydrophobicContact CE2-CG 3.94Å; Y125-L129 WeakPolarHBondContact O-CG 3.34Å; Y125-L129 PolarHBondContact O-N 2.83Å; Y125-L188 HydrophobicContact CD1-CD2 4.11Å; Y125-L188 HydrophobicContact CD2-CB 4.08Å; Y125-L188 HydrophobicContact CD2-CD1 4.01Å; Y125-L188 HydrophobicContact CD2-CD2 4.34Å; Y125-L188 HydrophobicContact CD2-CG 4.39Å; Y125-L188 HydrophobicContact CE1-CD2 4.29Å; Y125-L188 HydrophobicContact CE2-CB 4.09Å; Y125-L188 HydrophobicContact CG-CD1 4.01Å; Y125-L188 HydrophobicContact CG-CD2 4.12Å; Y125-S189 PolarHBondContact OH-O 2.75Å; Y125-P204 HydrophobicContact CD1-CG 3.65Å; Y125-P204 HydrophobicContact CE1-CG 4.46Å; Y125-P204 HydrophobicContact CG-CG 4.3Å
126	E	96.6	Very high	95.8	Very high	98 Å²	98	61.2 Å²	61.2	46%	0.458	31%	0.309	S	S	.	.	H	α-helix	trans	-56.5	-41.6	172.6	-176.9	177.7	-160.1	0	0	111.5	A122 Q123 V128 L129 N130	A122-E126 WeakPolarHBondContact O-CB 3.36Å; A122-E126 PolarHBondContact O-N 2.81Å; Q123-E126 PolarHBondContact O-N 3.02Å; E126-V128 VanDerWaalsContact C-N 3.29Å; E126-V128 PolarHBondContact O-N 3.44Å; E126-L129 PolarHBondContact O-N 3.47Å; E126-N130 VanDerWaalsContact CG-ND2 3.25Å; E126-N130 WeakPolarHBondContact CG-ND2 3.4Å; E126-N130 WeakPolarHBondContact O-CB 3.44Å; E126-N130 PolarHBondContact O-N 2.95Å; E126-N130 PolarHBondContact O-ND2 3.34Å; E126-N130 VanDerWaalsContact O-ND2 3.15Å
127	D	96.2	Very high	95.8	Very high	35 Å²	35	56.5 Å²	56.5	19%	0.187	29%	0.289	C	S	.	.	H	α-helix	trans	-66.5	-28	176.7	-68.4	-23.9	0	0	0	112.8	N102 R105 Q123 C124 Y125 S131	N102-D127 HydrophobicContact CB-CB 4.34Å; N102-D127 VanDerWaalsContact ND2-CB 3.33Å; N102-D127 WeakPolarHBondContact ND2-CB 3.27Å; R105-D127 IonicContact CZ-OD2 3.34Å; R105-D127 IonicContact NH1-OD2 3.01Å; R105-D127 IonicContact NH2-OD1 3.85Å; R105-D127 IonicContact NH2-OD2 2.91Å; R105-D127 PolarHBondContact NH2-OD2 3.25Å; Q123-D127 PolarHBondContact NE2-OD1 3.04Å; Q123-D127 WeakPolarHBondContact O-CB 3.44Å; Q123-D127 PolarHBondContact O-N 2.95Å; C124-D127 PolarHBondContact O-N 3.44Å; Y125-D127 VanDerWaalsContact C-N 3.25Å; Y125-D127 PolarHBondContact O-N 3.34Å; D127-S131 PolarHBondContact O-N 3.16Å
128	V	96.1	Very high	95.8	Very high	2 Å²	2	56.5 Å²	56.5	1%	0.012	29%	0.289	C	S	.	.	H	α-helix	trans	-72	-48	171	171.9	0	0	0	0	110.3	F95 A98 V99 N102 C124 Y125 E126 N130 S131 I135	F95-V128 HydrophobicContact CD2-CG1 4.15Å; F95-V128 HydrophobicContact CE2-CG1 3.74Å; F95-V128 HydrophobicContact CZ-CG1 4.33Å; A98-V128 HydrophobicContact CB-CG2 3.99Å; V99-V128 HydrophobicContact CG2-CG2 4.03Å; N102-V128 WeakPolarHBondContact ND2-CG2 3.48Å; N102-V128 PolarHBondContact ND2-N 2.88Å; C124-V128 WeakPolarHBondContact O-CG2 3.25Å; C124-V128 PolarHBondContact O-N 2.78Å; C124-V128 VanDerWaalsContact O-N 3.1Å; Y125-V128 WeakPolarHBondContact O-CA 3.32Å; Y125-V128 WeakPolarHBondContact O-CB 3.44Å; Y125-V128 PolarHBondContact O-N 2.81Å; E126-V128 VanDerWaalsContact C-N 3.29Å; E126-V128 PolarHBondContact O-N 3.44Å; V128-N130 VanDerWaalsContact C-N 3.28Å; V128-N130 PolarHBondContact O-N 3.18Å; V128-S131 VanDerWaalsContact O-CB 3.29Å; V128-S131 WeakPolarHBondContact O-CB 3.01Å; V128-S131 PolarHBondContact O-N 2.82Å; V128-I135 HydrophobicContact CG1-CB 4.11Å; V128-I135 HydrophobicContact CG1-CD1 4.34Å; V128-I135 HydrophobicContact CG1-CG2 4.23Å
129	L	94.6	Very high	95.9	Very high	82 Å²	82	53 Å²	53	43%	0.429	27%	0.272	S	S	.	.	H	α-helix	trans	-63	-34	-178.6	-65.4	179.7	0	0	0	112.7	Y125 E126 C190	Y125-L129 HydrophobicContact CD1-CD1 4.2Å; Y125-L129 HydrophobicContact CD2-CD1 4.48Å; Y125-L129 HydrophobicContact CD2-CG 4.23Å; Y125-L129 HydrophobicContact CE1-CD1 3.84Å; Y125-L129 HydrophobicContact CE2-CD1 4.11Å; Y125-L129 HydrophobicContact CE2-CD2 3.87Å; Y125-L129 HydrophobicContact CE2-CG 3.94Å; Y125-L129 WeakPolarHBondContact O-CG 3.34Å; Y125-L129 PolarHBondContact O-N 2.83Å; E126-L129 PolarHBondContact O-N 3.47Å; L129-C190 HydrophobicContact CD2-CB 3.95Å
130	N	95.2	Very high	96	Very high	119 Å²	119	49.4 Å²	49.4	64%	0.636	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	11.2	-179.9	-66.4	-46.6	0	0	0	113.8	E126 V128	E126-N130 VanDerWaalsContact CG-ND2 3.25Å; E126-N130 WeakPolarHBondContact CG-ND2 3.4Å; E126-N130 WeakPolarHBondContact O-CB 3.44Å; E126-N130 PolarHBondContact O-N 2.95Å; E126-N130 PolarHBondContact O-ND2 3.34Å; E126-N130 VanDerWaalsContact O-ND2 3.15Å; V128-N130 VanDerWaalsContact C-N 3.28Å; V128-N130 PolarHBondContact O-N 3.18Å
131	S	94.4	Very high	96	Very high	47 Å²	47	49.2 Å²	49.2	33%	0.329	25%	0.25	S	C	.	.			trans	-60.9	142.5	176.4	170.8	0	0	0	0	111.3	D127 V128 E133	D127-S131 PolarHBondContact O-N 3.16Å; V128-S131 VanDerWaalsContact O-CB 3.29Å; V128-S131 WeakPolarHBondContact O-CB 3.01Å; V128-S131 PolarHBondContact O-N 2.82Å; S131-E133 VanDerWaalsContact CB-O 3.24Å; S131-E133 WeakPolarHBondContact CB-O 3.18Å; S131-E133 PolarHBondContact O-N 3.29Å; S131-E133 PolarHBondContact OG-N 2.74Å; S131-E133 PolarHBondContact OG-O 3.19Å
132	K	93.1	Very high	96	Very high	221 Å²	221	49.2 Å²	49.2	96%	0.961	25%	0.25	S	C	*	.	S	Bend	trans	-60.7	-35.8	175.4	-67.6	-174.5	179.1	-176.9	0	112.2
133	E	92.8	Very high	96.1	Very high	130 Å²	130	47.3 Å²	47.3	61%	0.607	23%	0.234	S	C	*	.	S	Bend	trans	-95	133.6	170.7	-67.3	-177.2	-168.1	0	0	109.1	R94 S131 I135	R94-E133 IonicContact NH2-OE2 3.9Å; R94-E133 PolarHBondContact NH2-OE2 3.28Å; S131-E133 VanDerWaalsContact CB-O 3.24Å; S131-E133 WeakPolarHBondContact CB-O 3.18Å; S131-E133 PolarHBondContact O-N 3.29Å; S131-E133 PolarHBondContact OG-N 2.74Å; S131-E133 PolarHBondContact OG-O 3.19Å; E133-I135 PolarHBondContact O-N 3.19Å
134	L	93.1	Very high	96.2	Very high	119 Å²	119	45 Å²	45	62%	0.623	22%	0.223	S	C	*	.			trans	-66.2	121.9	175.4	-177.3	65.9	0	0	0	110.4	L136	L134-L136 HydrophobicContact CD1-CD2 4.13Å; L134-L136 HydrophobicContact CD2-CD1 4.22Å; L134-L136 HydrophobicContact CD2-CD2 3.83Å; L134-L136 HydrophobicContact CD2-CG 3.89Å; L134-L136 HydrophobicContact CG-CD2 3.93Å; L134-L136 HydrophobicContact CG-CG 3.95Å
135	I	95.5	Very high	96.3	Very high	19 Å²	19	45 Å²	45	10%	0.097	22%	0.223	C	C	.	.			trans	-110.3	83.1	179.2	-58.4	160.9	0	0	0	107.8	R94 F95 A98 V128 E133 C190	R94-I135 HydrophobicContact CB-CG2 4.45Å; F95-I135 HydrophobicContact CB-CG2 4.36Å; F95-I135 HydrophobicContact CD2-CG2 4.18Å; A98-I135 HydrophobicContact CB-CD1 3.75Å; A98-I135 HydrophobicContact CB-CG2 4.03Å; V128-I135 HydrophobicContact CG1-CB 4.11Å; V128-I135 HydrophobicContact CG1-CD1 4.34Å; V128-I135 HydrophobicContact CG1-CG2 4.23Å; E133-I135 PolarHBondContact O-N 3.19Å; I135-C190 VanDerWaalsContact O-CB 3.28Å; I135-C190 WeakPolarHBondContact O-CB 3.4Å
136	L	95.1	Very high	96.4	Very high	39 Å²	39	43.6 Å²	43.6	20%	0.204	22%	0.218	C	C	.	.			trans	-69.1	146.3	173.1	-63.1	176.9	0	0	0	110.2	V90 L134 C190 P192	V90-L136 HydrophobicContact CG1-CB 3.82Å; V90-L136 VanDerWaalsContact CG1-O 3.3Å; V90-L136 WeakPolarHBondContact CG1-O 3.33Å; V90-L136 HydrophobicContact CG2-CB 3.96Å; V90-L136 HydrophobicContact CG2-CD1 3.99Å; L134-L136 HydrophobicContact CD1-CD2 4.13Å; L134-L136 HydrophobicContact CD2-CD1 4.22Å; L134-L136 HydrophobicContact CD2-CD2 3.83Å; L134-L136 HydrophobicContact CD2-CG 3.89Å; L134-L136 HydrophobicContact CG-CD2 3.93Å; L134-L136 HydrophobicContact CG-CG 3.95Å; L136-C190 WeakPolarHBondContact CA-O 3.47Å; L136-C190 WeakPolarHBondContact CD2-O 3.42Å; L136-P192 HydrophobicContact CD1-CG 4.22Å; L136-P192 HydrophobicContact CD2-CG 4.06Å
137	G	96	Very high	96.4	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	140.1	-173.1	176.9	0	0	0	0	0	112.3	W85 F95 S189 C190	W85-G137 VanDerWaalsContact CE2-C 3.44Å; W85-G137 VanDerWaalsContact CE2-CA 3.45Å; W85-G137 VanDerWaalsContact NE1-C 3.27Å; F95-G137 VanDerWaalsContact CD2-C 3.48Å; F95-G137 WeakPolarHBondContact CD2-O 3.21Å; G137-S189 CarbonylContact O-C 3.57Å; G137-S189 WeakPolarHBondContact O-CA 3.46Å; G137-C190 PolarHBondContact N-O 2.86Å; G137-C190 PolarHBondContact O-N 2.82Å
138	S	97.5	Very high	96.4	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	160.9	171	62.7	0	0	0	0	110.1	G81 V82 W85 F95 Q187 L188 S189	G81-S138 WeakPolarHBondContact CA-O 3.2Å; V82-S138 VanDerWaalsContact CB-OG 3.3Å; V82-S138 WeakPolarHBondContact CB-OG 3.4Å; V82-S138 WeakPolarHBondContact CG2-OG 3.42Å; V82-S138 PolarHBondContact N-O 2.83Å; W85-S138 PolarHBondContact NE1-OG 2.86Å; F95-S138 VanDerWaalsContact CD1-C 3.47Å; S138-Q187 PolarHBondContact OG-OE1 2.91Å; S138-L188 CarbonylContact C-O 3.59Å; S138-L188 WeakPolarHBondContact CA-O 3.32Å; S138-L188 WeakPolarHBondContact CB-O 3.2Å; S138-S189 WeakPolarHBondContact CB-OG 3.33Å
139	A	98.1	Very high	96.3	Very high	1 Å²	1	42 Å²	42	1%	0.008	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	148.1	175.8	0	0	0	0	0	112.4	A79 D80 F95 Q187 L188	A79-A139 HydrophobicContact CB-CB 4.32Å; D80-A139 CarbonylContact O-C 3.31Å; D80-A139 WeakPolarHBondContact O-CA 3.38Å; D80-A139 WeakPolarHBondContact O-CB 3.38Å; F95-A139 HydrophobicContact CD1-CB 3.67Å; F95-A139 HydrophobicContact CE1-CB 4.14Å; A139-Q187 WeakPolarHBondContact O-CA 3.21Å; A139-L188 PolarHBondContact N-O 3.48Å; A139-L188 PolarHBondContact O-N 2.9Å; A139-L188 VanDerWaalsContact O-N 3.08Å
140	T	98.3	Very high	96.3	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	160.4	158.6	77.2	0	0	0	0	108.6	A79 D80 L158 D160 S161 P185	A79-T140 WeakPolarHBondContact CA-O 3.22Å; A79-T140 VanDerWaalsContact CB-O 3.27Å; A79-T140 WeakPolarHBondContact CB-O 3.37Å; D80-T140 PolarHBondContact N-O 2.94Å; D80-T140 PolarHBondContact O-N 3.27Å; T140-L158 CarbonylContact C-O 3.47Å; T140-L158 WeakPolarHBondContact CA-O 3.37Å; T140-L158 WeakPolarHBondContact CB-O 3.37Å; T140-D160 WeakPolarHBondContact CG2-OD1 3.48Å; T140-S161 PolarHBondContact OG1-OG 2.99Å; T140-P185 HydrophobicContact CG2-CB 3.69Å; T140-P185 HydrophobicContact CG2-CG 3.63Å
141	L	98.4	Very high	96.3	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	152.2	177.7	63.4	93.3	0	0	0	112.6	V78 A79 V99 M100 I121 I143 S157 L158 L188	V78-L141 VanDerWaalsContact O-CA 3.29Å; V78-L141 WeakPolarHBondContact O-CA 3.39Å; A79-L141 HydrophobicContact CB-CB 4.19Å; V99-L141 HydrophobicContact CG1-CD2 4.28Å; M100-L141 HydrophobicContact CE-CB 4.45Å; I121-L141 HydrophobicContact CD1-CD1 3.68Å; I121-L141 HydrophobicContact CG1-CD1 3.94Å; I121-L141 HydrophobicContact CG2-CD1 4.42Å; I121-L141 HydrophobicContact CG2-CD2 4.08Å; L141-I143 HydrophobicContact CD1-CD1 4.39Å; L141-I143 HydrophobicContact CD1-CG1 4.26Å; L141-S157 CarbonylContact O-C 3.42Å; L141-S157 WeakPolarHBondContact O-CA 3.31Å; L141-L158 HydrophobicContact CD1-CB 4.34Å; L141-L158 HydrophobicContact CG-CB 4.12Å; L141-L158 PolarHBondContact N-O 2.95Å; L141-L158 PolarHBondContact O-N 3.24Å; L141-L188 HydrophobicContact CD2-CD1 3.47Å; L141-L188 VanDerWaalsContact CD2-CD1 3.47Å; L141-L188 HydrophobicContact CD2-CG 3.96Å
142	C	98.7	Very high	96.5	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	129.5	165.8	-177.3	0	0	0	0	109.3	G77 V78 A156 G162 V222	G77-C142 CarbonylContact C-O 3.54Å; G77-C142 WeakPolarHBondContact CA-O 3.41Å; V78-C142 HydrophobicContact CG2-CB 3.97Å; V78-C142 PolarHBondContact N-O 3.41Å; V78-C142 PolarHBondContact O-N 3.49Å; C142-A156 CarbonylContact C-O 3.28Å; C142-A156 WeakPolarHBondContact CA-O 3.18Å; C142-G162 VanDerWaalsContact SG-C 3.57Å; C142-V222 HydrophobicContact CB-CG1 4.36Å
143	I	98.6	Very high	96.8	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	135.3	177.2	-55.3	177.9	0	0	0	108.7	F66 V75 L76 L117 L120 I121 L141 G155 A156	F66-I143 HydrophobicContact CZ-CG2 4.4Å; V75-I143 HydrophobicContact CG1-CG2 3.77Å; L76-I143 CarbonylContact O-C 3.44Å; L76-I143 WeakPolarHBondContact O-CA 3.44Å; L117-I143 WeakPolarHBondContact CD1-O 3.45Å; L117-I143 HydrophobicContact CD2-CG2 3.9Å; L120-I143 HydrophobicContact CD2-CD1 4.09Å; L120-I143 HydrophobicContact CD2-CG2 4.16Å; L120-I143 HydrophobicContact CG-CD1 4.47Å; I121-I143 HydrophobicContact CD1-CD1 4.5Å; I121-I143 HydrophobicContact CG1-CD1 3.8Å; L141-I143 HydrophobicContact CD1-CD1 4.39Å; L141-I143 HydrophobicContact CD1-CG1 4.26Å; I143-G155 CarbonylContact O-C 3.53Å; I143-G155 WeakPolarHBondContact O-CA 3.33Å; I143-A156 PolarHBondContact N-O 3.11Å; I143-A156 PolarHBondContact O-N 2.9Å
144	V	98.6	Very high	97	Very high	2 Å²	2	24.6 Å²	24.6	1%	0.012	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	134.3	177.3	178.9	0	0	0	0	109.3	V75 L76 V153 Y154 Y163 I220 V222	V75-V144 CarbonylContact C-O 3.56Å; V75-V144 WeakPolarHBondContact CA-O 3.26Å; L76-V144 PolarHBondContact N-O 3.01Å; L76-V144 PolarHBondContact O-N 2.9Å; V144-V153 HydrophobicContact CG1-CG1 3.27Å; V144-Y154 CarbonylContact C-O 3.48Å; V144-Y154 WeakPolarHBondContact CA-O 3.39Å; V144-Y163 HydrophobicContact CG2-CD1 3.76Å; V144-Y163 HydrophobicContact CG2-CD2 3.95Å; V144-Y163 HydrophobicContact CG2-CE1 4.36Å; V144-Y163 HydrophobicContact CG2-CE2 4.49Å; V144-Y163 HydrophobicContact CG2-CG 3.54Å; V144-I220 HydrophobicContact CG1-CG2 4.21Å; V144-V222 HydrophobicContact CB-CG2 4.08Å; V144-V222 HydrophobicContact CG2-CG2 3.74Å
145	S	98.5	Very high	97.3	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	113	178.5	171	0	0	0	0	110.1	Y74 P114 V153 Y154	Y74-S145 CarbonylContact O-C 3.58Å; Y74-S145 WeakPolarHBondContact O-CA 3.21Å; P114-S145 WeakPolarHBondContact O-CB 3.5Å; P114-S145 PolarHBondContact O-OG 2.84Å; P114-S145 VanDerWaalsContact O-OG 3.12Å; S145-V153 CarbonylContact O-C 3.58Å; S145-V153 WeakPolarHBondContact O-CA 3.39Å; S145-Y154 PolarHBondContact N-O 2.81Å; S145-Y154 PolarHBondContact O-N 3.49Å
146	L	98.5	Very high	97.4	Very high	1 Å²	1	18 Å²	18	1%	0.005	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	114.8	166.8	173.9	67.8	0	0	0	108.8	L34 L36 S73 Y74 V153 V214	L34-L146 HydrophobicContact CB-CD2 4.12Å; L36-L146 HydrophobicContact CD1-CB 4.19Å; L36-L146 HydrophobicContact CD1-CD2 4.3Å; L36-L146 HydrophobicContact CD2-CD2 3.72Å; L36-L146 HydrophobicContact CG-CB 4.42Å; L36-L146 HydrophobicContact CG-CD2 3.61Å; S73-L146 CarbonylContact C-O 3.46Å; S73-L146 WeakPolarHBondContact CA-O 3.26Å; S73-L146 VanDerWaalsContact CB-O 3.32Å; S73-L146 WeakPolarHBondContact CB-O 3.4Å; S73-L146 PolarHBondContact OG-O 3.06Å; Y74-L146 HydrophobicContact CD2-CD2 4.48Å; Y74-L146 PolarHBondContact N-O 2.88Å; Y74-L146 PolarHBondContact O-N 2.84Å; L146-V153 HydrophobicContact CB-CG2 4.33Å; L146-V153 HydrophobicContact CD1-CG2 3.76Å; L146-V214 HydrophobicContact CD1-CG2 3.51Å
147	Q	97.1	Very high	97.6	Very high	20 Å²	20	16.2 Å²	16.2	9%	0.093	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	115.2	166.7	-152.2	-72	22.1	0	0	108.2	P114 N149 E150 H151 R152 Y154	P114-Q147 HydrophobicContact CB-CB 4.46Å; P114-Q147 HydrophobicContact CB-CG 4.03Å; P114-Q147 HydrophobicContact CG-CG 4.49Å; Q147-N149 PolarHBondContact O-N 2.72Å; Q147-E150 HydrophobicContact CB-CB 4.21Å; Q147-E150 VanDerWaalsContact CD-CD 3.44Å; Q147-E150 HydrophobicContact CG-CB 4.13Å; Q147-E150 HydrophobicContact CG-CG 4.29Å; Q147-E150 VanDerWaalsContact NE2-CG 3.26Å; Q147-E150 PolarHBondContact NE2-OE1 3.45Å; Q147-H151 PolarHBondContact O-N 3.16Å; Q147-R152 PolarHBondContact N-O 3.41Å; Q147-R152 PolarHBondContact O-N 3.47Å; Q147-Y154 HydrophobicContact CB-CD2 4.41Å; Q147-Y154 HydrophobicContact CB-CE2 3.99Å; Q147-Y154 HydrophobicContact CG-CE2 4.5Å
148	R	95.9	Very high	97.7	Very high	10 Å²	10	16.2 Å²	16.2	4%	0.038	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-32.1	-167.1	-61.8	175.2	63.7	-158.3	2.6	114.5	R33 L34 C35 D71 S72 Y74 H151 E307	R33-R148 CarbonylContact C-O 3.55Å; R33-R148 WeakPolarHBondContact CA-O 3.42Å; R33-R148 HydrophobicContact CB-CB 4.49Å; L34-R148 PolarHBondContact N-O 3.44Å; L34-R148 WeakPolarHBondContact O-CB 3.03Å; L34-R148 WeakPolarHBondContact O-CG 3.31Å; L34-R148 PolarHBondContact O-NE 2.93Å; L34-R148 VanDerWaalsContact O-NE 3.14Å; C35-R148 PolarHBondContact SG-NH2 3.43Å; D71-R148 VanDerWaalsContact O-CD 3.29Å; D71-R148 WeakPolarHBondContact O-CD 3.45Å; D71-R148 PolarHBondContact O-NH1 3.04Å; D71-R148 IonicContact OD1-NH1 3.07Å; S72-R148 WeakPolarHBondContact O-CB 3.41Å; S72-R148 VanDerWaalsContact O-CG 3.28Å; S72-R148 WeakPolarHBondContact O-CG 3.33Å; S72-R148 PolarHBondContact O-N 3.24Å; Y74-R148 HydrophobicContact CD2-CG 4Å; Y74-R148 HydrophobicContact CE2-CG 4.23Å; R148-H151 PolarHBondContact O-CD2 2.98Å; R148-E307 IonicContact CZ-OE1 2.79Å; R148-E307 IonicContact CZ-OE2 2.79Å; R148-E307 IonicContact NH2-OE1 3.51Å; R148-E307 PolarHBondContact NH2-OE1 3.4Å; R148-E307 IonicContact NH2-OE2 3.35Å; R148-E307 PolarHBondContact NH2-OE2 2.91Å
149	N	94	Very high	97.7	Very high	72 Å²	72	16.2 Å²	16.2	39%	0.385	7%	0.074	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-25.7	-174.8	-58.1	-17.5	0	0	0	112.8	R33 Q147	R33-N149 WeakPolarHBondContact CG-OD1 3.38Å; R33-N149 PolarHBondContact NE-OD1 2.82Å; R33-N149 VanDerWaalsContact NE-OD1 3.16Å; Q147-N149 PolarHBondContact O-N 2.72Å
150	E	94.5	Very high	97.6	Very high	105 Å²	105	16.2 Å²	16.2	49%	0.491	7%	0.074	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-7.1	177.1	-74.7	167.1	-149.3	0	0	112.4	Q147 R152 Y154	Q147-E150 HydrophobicContact CB-CB 4.21Å; Q147-E150 VanDerWaalsContact CD-CD 3.44Å; Q147-E150 HydrophobicContact CG-CB 4.13Å; Q147-E150 HydrophobicContact CG-CG 4.29Å; Q147-E150 VanDerWaalsContact NE2-CG 3.26Å; Q147-E150 PolarHBondContact NE2-OE1 3.45Å; E150-R152 HydrophobicContact CB-CB 4.25Å; E150-R152 PolarHBondContact O-N 3.35Å; E150-Y154 PolarHBondContact OE2-OH 3.43Å; E150-Y154 VanDerWaalsContact OE2-OH 3.06Å
151	H	96.4	Very high	97.6	Very high	16 Å²	16	16.2 Å²	16.2	7%	0.074	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	39.1	179.8	-60.8	-168.4	0	0	0	111.1	L29 V32 L34 Q147 R148 E213 V214	L29-H151 PolarHBondContact O-NE2 2.97Å; V32-H151 PolarHBondContact O-NE2 3.05Å; L34-H151 HydrophobicContact CD1-CB 3.66Å; L34-H151 HydrophobicContact CG-CB 4.43Å; Q147-H151 PolarHBondContact O-N 3.16Å; R148-H151 PolarHBondContact O-CD2 2.98Å; H151-E213 CarbonylContact O-C 3.54Å; H151-E213 WeakPolarHBondContact O-CA 3.43Å; H151-V214 PolarHBondContact O-N 2.8Å
152	R	97.9	Very high	97.6	Very high	77 Å²	77	16.2 Å²	16.2	29%	0.291	7%	0.074	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	134.8	-171.4	-164.9	169.6	-178.2	81.3	1.3	110.7	Q147 E150 Y154 S211 V212	Q147-R152 PolarHBondContact N-O 3.41Å; Q147-R152 PolarHBondContact O-N 3.47Å; E150-R152 HydrophobicContact CB-CB 4.25Å; E150-R152 PolarHBondContact O-N 3.35Å; R152-Y154 HydrophobicContact CB-CE2 4.11Å; R152-Y154 HydrophobicContact CG-CE2 4.07Å; R152-S211 VanDerWaalsContact NE-CB 3.34Å; R152-S211 PolarHBondContact NE-OG 2.87Å; R152-S211 PolarHBondContact NH2-O 2.94Å; R152-S211 PolarHBondContact NH2-OG 3.21Å; R152-V212 WeakPolarHBondContact CA-O 3.3Å; R152-V212 WeakPolarHBondContact CG-O 3.47Å
153	V	98.5	Very high	97.6	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	125	171.3	171.4	0	0	0	0	108.4	V144 S145 L146 Y163 S211 V212 V214 I220	V144-V153 HydrophobicContact CG1-CG1 3.27Å; S145-V153 CarbonylContact O-C 3.58Å; S145-V153 WeakPolarHBondContact O-CA 3.39Å; L146-V153 HydrophobicContact CB-CG2 4.33Å; L146-V153 HydrophobicContact CD1-CG2 3.76Å; V153-Y163 HydrophobicContact CG1-CE2 4.48Å; V153-S211 CarbonylContact O-C 3.53Å; V153-S211 WeakPolarHBondContact O-CA 3.37Å; V153-V212 HydrophobicContact CB-CG1 4.14Å; V153-V212 PolarHBondContact N-O 3.33Å; V153-V212 PolarHBondContact O-N 2.9Å; V153-V214 HydrophobicContact CB-CG1 4.07Å; V153-V214 HydrophobicContact CG2-CB 4.32Å; V153-V214 HydrophobicContact CG2-CG1 3.49Å; V153-V214 VanDerWaalsContact CG2-CG1 3.49Å; V153-V214 HydrophobicContact CG2-CG2 3.87Å; V153-I220 HydrophobicContact CG2-CD1 3.58Å
154	Y	98.5	Very high	97.6	Very high	34 Å²	34	16.2 Å²	16.2	13%	0.133	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	134.8	168.4	-62.4	-90.2	0	0	0	108.4	D115 L117 V144 S145 Q147 E150 R152	D115-Y154 HydrophobicContact CB-CD1 3.86Å; D115-Y154 HydrophobicContact CB-CD2 4.28Å; D115-Y154 HydrophobicContact CB-CE1 3.44Å; D115-Y154 VanDerWaalsContact CB-CE1 3.44Å; D115-Y154 HydrophobicContact CB-CE2 3.93Å; D115-Y154 HydrophobicContact CB-CG 4.25Å; D115-Y154 VanDerWaalsContact CB-CZ 3.47Å; L117-Y154 WeakPolarHBondContact CD1-O 3.41Å; V144-Y154 CarbonylContact C-O 3.48Å; V144-Y154 WeakPolarHBondContact CA-O 3.39Å; S145-Y154 PolarHBondContact N-O 2.81Å; S145-Y154 PolarHBondContact O-N 3.49Å; Q147-Y154 HydrophobicContact CB-CD2 4.41Å; Q147-Y154 HydrophobicContact CB-CE2 3.99Å; Q147-Y154 HydrophobicContact CG-CE2 4.5Å; E150-Y154 PolarHBondContact OE2-OH 3.43Å; E150-Y154 VanDerWaalsContact OE2-OH 3.06Å; R152-Y154 HydrophobicContact CB-CE2 4.11Å; R152-Y154 HydrophobicContact CG-CE2 4.07Å
155	G	98.4	Very high	97.6	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.01	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	141.3	178.1	0	0	0	0	0	111.2	I143 Q209 T210	I143-G155 CarbonylContact O-C 3.53Å; I143-G155 WeakPolarHBondContact O-CA 3.33Å; G155-Q209 CarbonylContact O-C 3.43Å; G155-Q209 VanDerWaalsContact O-CA 3.32Å; G155-Q209 WeakPolarHBondContact O-CA 3.01Å; G155-T210 PolarHBondContact N-O 3.07Å; G155-T210 PolarHBondContact O-N 3.32Å; G155-T210 PolarHBondContact O-OG1 3.1Å
156	A	98.4	Very high	97.6	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	122.4	170.8	0	0	0	0	0	109.7	L117 I121 C142 I143 A208 Q209	L117-A156 HydrophobicContact CB-CB 3.55Å; L117-A156 HydrophobicContact CD1-CB 3.84Å; L117-A156 HydrophobicContact CG-CB 4.36Å; I121-A156 HydrophobicContact CD1-CB 3.78Å; C142-A156 CarbonylContact C-O 3.28Å; C142-A156 WeakPolarHBondContact CA-O 3.18Å; I143-A156 PolarHBondContact N-O 3.11Å; I143-A156 PolarHBondContact O-N 2.9Å; A156-A208 VanDerWaalsContact CA-O 3.3Å; A156-A208 WeakPolarHBondContact CA-O 3.16Å; A156-Q209 HydrophobicContact CB-CG 4.18Å
157	S	98.1	Very high	97.5	Very high	1 Å²	1	18.9 Å²	18.9	1%	0.007	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	139.6	175.3	52.1	0	0	0	0	111	L141 V176 Q178 A207 A208	L141-S157 CarbonylContact O-C 3.42Å; L141-S157 WeakPolarHBondContact O-CA 3.31Å; S157-V176 PolarHBondContact OG-O 2.97Å; S157-Q178 PolarHBondContact O-OE1 3.28Å; S157-A207 CarbonylContact O-C 3.59Å; S157-A207 VanDerWaalsContact O-CA 3.29Å; S157-A207 WeakPolarHBondContact O-CA 3.14Å; S157-A208 PolarHBondContact N-O 3.4Å; S157-A208 PolarHBondContact O-N 3.16Å
158	L	97.9	Very high	97.3	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	112.2	169.2	-172.8	81.4	0	0	0	107.5	T140 L141 F186 L188 D202 Q206 A207	T140-L158 CarbonylContact C-O 3.47Å; T140-L158 WeakPolarHBondContact CA-O 3.37Å; T140-L158 WeakPolarHBondContact CB-O 3.37Å; L141-L158 HydrophobicContact CD1-CB 4.34Å; L141-L158 HydrophobicContact CG-CB 4.12Å; L141-L158 PolarHBondContact N-O 2.95Å; L141-L158 PolarHBondContact O-N 3.24Å; L158-F186 HydrophobicContact CD1-CB 4.01Å; L158-F186 HydrophobicContact CD1-CD1 4.19Å; L158-F186 HydrophobicContact CG-CB 4.06Å; L158-L188 HydrophobicContact CD2-CD2 3.66Å; L158-L188 HydrophobicContact CD2-CG 3.66Å; L158-D202 HydrophobicContact CD1-CB 4.36Å; L158-D202 HydrophobicContact CD2-CB 4.44Å; L158-Q206 HydrophobicContact CD1-CB 4.24Å; L158-A207 HydrophobicContact CB-CB 4.2Å; L158-A207 HydrophobicContact CD1-CB 4.35Å
159	G	97.9	Very high	97.2	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.128	C	C	.	.	S	Bend	trans	99.2	-146.6	-172.9	0	0	0	0	0	112.8	H177 Q178 F186	G159-H177 CarbonylContact O-C 3.41Å; G159-H177 WeakPolarHBondContact O-CA 3.26Å; G159-Q178 CarbonylContact C-O 3.54Å; G159-Q178 WeakPolarHBondContact CA-O 3.39Å; G159-Q178 PolarHBondContact O-N 3.21Å; G159-F186 WeakPolarHBondContact CA-O 3.19Å; G159-F186 PolarHBondContact N-O 3.12Å
160	D	97.3	Very high	97.4	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.005	14%	0.139	C	C	.	.	S	Bend	trans	-113.3	4.9	-174.4	48.2	8.7	0	0	0	114.6	T140 H177 K179 P185 D225	T140-D160 WeakPolarHBondContact CG2-OD1 3.48Å; D160-H177 HydrophobicContact CB-CB 4.34Å; D160-H177 PolarHBondContact O-CE1 3.13Å; D160-H177 VanDerWaalsContact O-CE1 3.26Å; D160-H177 PolarHBondContact O-ND1 3.05Å; D160-K179 WeakPolarHBondContact OD2-CE 3.04Å; D160-P185 HydrophobicContact CB-CB 4.47Å; D160-P185 WeakPolarHBondContact OD1-CB 3.46Å; D160-P185 WeakPolarHBondContact OD2-CB 3.32Å; D160-D225 HydrophobicContact CB-CB 4.46Å
161	S	98.1	Very high	97.5	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.126	C	C	.	.			trans	-63.4	145.5	152.1	-71.8	0	0	0	0	110.1	T140	T140-S161 PolarHBondContact OG1-OG 2.99Å
162	G	98.3	Very high	97.6	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	-179.4	-170.9	0	0	0	0	0	115.8	C142 S175 G223 F228	C142-G162 VanDerWaalsContact SG-C 3.57Å; G162-S175 WeakPolarHBondContact CA-OG 3.47Å; G162-G223 PolarHBondContact N-O 3.28Å; G162-G223 PolarHBondContact O-N 3.24Å; G162-F228 WeakPolarHBondContact O-CE2 3.44Å
163	Y	98.8	Very high	97.6	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	156.9	175	82.6	-85.5	0	0	0	113	V144 V153 V165 Q173 S175 T210 I221	V144-Y163 HydrophobicContact CG2-CD1 3.76Å; V144-Y163 HydrophobicContact CG2-CD2 3.95Å; V144-Y163 HydrophobicContact CG2-CE1 4.36Å; V144-Y163 HydrophobicContact CG2-CE2 4.49Å; V144-Y163 HydrophobicContact CG2-CG 3.54Å; V153-Y163 HydrophobicContact CG1-CE2 4.48Å; Y163-V165 HydrophobicContact CD2-CG2 4.07Å; Y163-V165 HydrophobicContact CE2-CG2 3.77Å; Y163-Q173 HydrophobicContact CE2-CG 3.84Å; Y163-Q173 WeakPolarHBondContact OH-CG 3.33Å; Y163-S175 PolarHBondContact N-OG 3.33Å; Y163-S175 PolarHBondContact O-N 3.23Å; Y163-S175 PolarHBondContact O-OG 3.03Å; Y163-T210 PolarHBondContact OH-OG1 3.02Å; Y163-I221 CarbonylContact C-O 3.58Å; Y163-I221 WeakPolarHBondContact CA-O 3.4Å; Y163-I221 WeakPolarHBondContact CB-O 3.33Å
164	L	98.6	Very high	97.6	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	146.5	172	-57.6	176.6	0	0	0	109.9	I166 V171 Q173 R174 I220 I221 F228 I236	L164-I166 HydrophobicContact CB-CG1 4.47Å; L164-V171 HydrophobicContact CD1-CG2 4.48Å; L164-V171 HydrophobicContact CD2-CG1 4.01Å; L164-Q173 CarbonylContact C-O 3.6Å; L164-Q173 WeakPolarHBondContact CA-O 3.32Å; L164-R174 HydrophobicContact CD2-CB 3.72Å; L164-R174 HydrophobicContact CD2-CG 3.6Å; L164-I220 WeakPolarHBondContact O-CA 3.14Å; L164-I221 HydrophobicContact CB-CB 4.34Å; L164-I221 PolarHBondContact N-O 3.43Å; L164-I221 PolarHBondContact O-N 3.05Å; L164-F228 HydrophobicContact CD1-CE1 4.01Å; L164-F228 HydrophobicContact CG-CE1 3.98Å; L164-F228 HydrophobicContact CG-CZ 4.43Å; L164-I236 HydrophobicContact CD1-CD1 4.14Å; L164-I236 HydrophobicContact CD1-CG2 4.1Å
165	V	98.6	Very high	97.6	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	123.8	162.5	-173.8	0	0	0	0	107.9	Y163 V171 I172 Q173 V212 V214 D218 I219 I220	Y163-V165 HydrophobicContact CD2-CG2 4.07Å; Y163-V165 HydrophobicContact CE2-CG2 3.77Å; V165-V171 CarbonylContact O-C 3.59Å; V165-V171 WeakPolarHBondContact O-CA 3.37Å; V165-I172 HydrophobicContact CB-CD1 4.43Å; V165-I172 HydrophobicContact CB-CG1 3.93Å; V165-I172 HydrophobicContact CG1-CD1 3.78Å; V165-I172 HydrophobicContact CG1-CG1 3.77Å; V165-I172 WeakPolarHBondContact O-CG1 3.4Å; V165-I172 PolarHBondContact O-N 2.82Å; V165-Q173 HydrophobicContact CB-CB 4.02Å; V165-Q173 HydrophobicContact CG2-CB 4.06Å; V165-Q173 PolarHBondContact N-O 2.97Å; V165-Q173 PolarHBondContact O-N 2.79Å; V165-V212 HydrophobicContact CB-CG1 4.47Å; V165-V212 HydrophobicContact CG2-CG1 3.92Å; V165-V214 HydrophobicContact CG1-CG1 3.94Å; V165-D218 HydrophobicContact CG1-CB 4.45Å; V165-I219 CarbonylContact C-O 3.59Å; V165-I219 WeakPolarHBondContact CA-O 3.27Å; V165-I220 HydrophobicContact CG2-CG1 4.48Å
166	I	98.2	Very high	97.4	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.021	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	126.9	-175.1	-60.7	163.4	0	0	0	108.3	L164 H170 V171 D218 I219 I221 L237 V240	L164-I166 HydrophobicContact CB-CG1 4.47Å; I166-H170 CarbonylContact C-O 3.55Å; I166-H170 VanDerWaalsContact CA-O 3.27Å; I166-H170 WeakPolarHBondContact CA-O 3.22Å; I166-V171 HydrophobicContact CG1-CG2 4.17Å; I166-D218 WeakPolarHBondContact O-CA 3.35Å; I166-I219 HydrophobicContact CB-CB 4.38Å; I166-I219 PolarHBondContact N-O 3.16Å; I166-I219 PolarHBondContact O-N 2.93Å; I166-I221 HydrophobicContact CD1-CD1 3.61Å; I166-I221 HydrophobicContact CD1-CG1 4.09Å; I166-L237 HydrophobicContact CD1-CD2 3.9Å; I166-L237 HydrophobicContact CG1-CD2 3.95Å; I166-L237 HydrophobicContact CG2-CD2 3.81Å; I166-V240 HydrophobicContact CD1-CB 4.29Å; I166-V240 HydrophobicContact CD1-CG1 4.01Å; I166-V240 HydrophobicContact CD1-CG2 3.82Å; I166-V240 HydrophobicContact CG2-CG1 4.31Å
167	R	96.3	Very high	97.2	Very high	54 Å²	54	36 Å²	36	20%	0.204	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	127.8	173.8	178.7	174.1	-63.4	154.7	5.2	108.8	G169 H170 I172 E213 D218	R167-G169 PolarHBondContact O-N 3.09Å; R167-H170 PolarHBondContact N-O 3.08Å; R167-H170 PolarHBondContact O-N 2.9Å; R167-I172 HydrophobicContact CB-CD1 4.08Å; R167-I172 HydrophobicContact CB-CG1 4.39Å; R167-I172 HydrophobicContact CB-CG2 3.75Å; R167-E213 PolarHBondContact NH2-O 3Å; R167-D218 VanDerWaalsContact CB-OD1 3.26Å; R167-D218 WeakPolarHBondContact CB-OD1 3.38Å; R167-D218 WeakPolarHBondContact CG-OD1 3.5Å; R167-D218 IonicContact CZ-OD1 3.8Å; R167-D218 IonicContact CZ-OD2 3.16Å; R167-D218 IonicContact NE-OD1 2.65Å; R167-D218 PolarHBondContact NE-OD1 3.46Å; R167-D218 IonicContact NE-OD2 3.98Å; R167-D218 PolarHBondContact NE-OD2 3.48Å; R167-D218 IonicContact NH2-OD1 2.7Å; R167-D218 IonicContact NH2-OD2 3.76Å; R167-D218 PolarHBondContact NH2-OD2 3.33Å
168	E	93.4	Very high	97.1	Very high	175 Å²	175	37.7 Å²	37.7	82%	0.818	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.9	40.1	174.7	-62.3	173.7	-179.4	0	0	112.6	H170	E168-H170 VanDerWaalsContact C-N 3.35Å; E168-H170 PolarHBondContact O-CE1 2.82Å; E168-H170 PolarHBondContact O-N 2.92Å; E168-H170 PolarHBondContact O-ND1 2.95Å
169	G	93.1	Very high	96.9	Very high	24 Å²	24	39.5 Å²	39.5	25%	0.247	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.9	9.5	179.4	0	0	0	0	0	116.1	R167	R167-G169 PolarHBondContact O-N 3.09Å
170	H	97.1	Very high	96.8	Very high	132 Å²	132	43.2 Å²	43.2	61%	0.611	21%	0.211	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-121.4	141.3	178.3	-57.1	85.4	0	0	0	111	I166 R167 E168 I172	I166-H170 CarbonylContact C-O 3.55Å; I166-H170 VanDerWaalsContact CA-O 3.27Å; I166-H170 WeakPolarHBondContact CA-O 3.22Å; R167-H170 PolarHBondContact N-O 3.08Å; R167-H170 PolarHBondContact O-N 2.9Å; E168-H170 VanDerWaalsContact C-N 3.35Å; E168-H170 PolarHBondContact O-CE1 2.82Å; E168-H170 PolarHBondContact O-N 2.92Å; E168-H170 PolarHBondContact O-ND1 2.95Å; H170-I172 PolarHBondContact O-N 3.32Å
171	V	98.1	Very high	96.6	Very high	35 Å²	35	46 Å²	46	21%	0.212	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	115.7	171.3	178.3	0	0	0	0	109	L164 V165 I166 Q173 R174 E233 L237	L164-V171 HydrophobicContact CD1-CG2 4.48Å; L164-V171 HydrophobicContact CD2-CG1 4.01Å; V165-V171 CarbonylContact O-C 3.59Å; V165-V171 WeakPolarHBondContact O-CA 3.37Å; I166-V171 HydrophobicContact CG1-CG2 4.17Å; V171-Q173 VanDerWaalsContact CG1-O 3.31Å; V171-Q173 WeakPolarHBondContact CG1-O 3.44Å; V171-R174 HydrophobicContact CG1-CB 4.18Å; V171-E233 VanDerWaalsContact CG2-CD 3.44Å; V171-E233 HydrophobicContact CG2-CG 3.66Å; V171-E233 WeakPolarHBondContact CG2-OE1 3.29Å; V171-L237 HydrophobicContact CG2-CD1 4.35Å; V171-L237 HydrophobicContact CG2-CD2 3.99Å; V171-L237 HydrophobicContact CG2-CG 4.35Å
172	I	98.1	Very high	96.3	Very high	60 Å²	60	47.4 Å²	47.4	31%	0.308	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-19.5	176.4	62.9	165.8	0	0	0	112.7	V165 R167 H170 V212	V165-I172 HydrophobicContact CB-CD1 4.43Å; V165-I172 HydrophobicContact CB-CG1 3.93Å; V165-I172 HydrophobicContact CG1-CD1 3.78Å; V165-I172 HydrophobicContact CG1-CG1 3.77Å; V165-I172 WeakPolarHBondContact O-CG1 3.4Å; V165-I172 PolarHBondContact O-N 2.82Å; R167-I172 HydrophobicContact CB-CD1 4.08Å; R167-I172 HydrophobicContact CB-CG1 4.39Å; R167-I172 HydrophobicContact CB-CG2 3.75Å; H170-I172 PolarHBondContact O-N 3.32Å; I172-V212 HydrophobicContact CD1-CG2 4.1Å
173	Q	98.3	Very high	96.1	Very high	41 Å²	41	50 Å²	50	19%	0.192	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	137.3	175.1	178.8	65.9	56.4	0	0	109.4	Y163 L164 V165 V171 V212	Y163-Q173 HydrophobicContact CE2-CG 3.84Å; Y163-Q173 WeakPolarHBondContact OH-CG 3.33Å; L164-Q173 CarbonylContact C-O 3.6Å; L164-Q173 WeakPolarHBondContact CA-O 3.32Å; V165-Q173 HydrophobicContact CB-CB 4.02Å; V165-Q173 HydrophobicContact CG2-CB 4.06Å; V165-Q173 PolarHBondContact N-O 2.97Å; V165-Q173 PolarHBondContact O-N 2.79Å; V171-Q173 VanDerWaalsContact CG1-O 3.31Å; V171-Q173 WeakPolarHBondContact CG1-O 3.44Å; Q173-V212 HydrophobicContact CB-CB 4.14Å; Q173-V212 HydrophobicContact CB-CG1 3.87Å; Q173-V212 HydrophobicContact CB-CG2 4.25Å; Q173-V212 HydrophobicContact CG-CB 4.29Å; Q173-V212 HydrophobicContact CG-CG1 4Å
174	R	97.9	Very high	95.9	Very high	86 Å²	86	50.6 Å²	50.6	33%	0.325	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	138.4	170.9	174.9	172.2	-173.9	102.9	15.3	109.2	L164 V171 H177 E233	L164-R174 HydrophobicContact CD2-CB 3.72Å; L164-R174 HydrophobicContact CD2-CG 3.6Å; V171-R174 HydrophobicContact CG1-CB 4.18Å; R174-H177 PolarHBondContact NH2-NE2 2.87Å; R174-E233 IonicContact NH1-OE2 3.91Å
175	S	97.8	Very high	95.8	Very high	5 Å²	5	51.3 Å²	51.3	4%	0.035	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-68.4	150.6	172	55.8	0	0	0	0	112	G162 Y163	G162-S175 WeakPolarHBondContact CA-OG 3.47Å; Y163-S175 PolarHBondContact N-OG 3.33Å; Y163-S175 PolarHBondContact O-N 3.23Å; Y163-S175 PolarHBondContact O-OG 3.03Å
176	V	95.7	Very high	95.8	Very high	86 Å²	86	53 Å²	53	52%	0.521	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-79.8	130.3	170.5	-178.9	0	0	0	0	108.8	S157 A208	S157-V176 PolarHBondContact OG-O 2.97Å; V176-A208 HydrophobicContact CB-CB 4.2Å
177	H	94.2	Very high	95.7	Very high	51 Å²	51	53.6 Å²	53.6	24%	0.236	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-87.1	129.8	170	-66.5	-148.7	0	0	0	108	G159 D160 R174 F228	G159-H177 CarbonylContact O-C 3.41Å; G159-H177 WeakPolarHBondContact O-CA 3.26Å; D160-H177 HydrophobicContact CB-CB 4.34Å; D160-H177 PolarHBondContact O-CE1 3.13Å; D160-H177 VanDerWaalsContact O-CE1 3.26Å; D160-H177 PolarHBondContact O-ND1 3.05Å; R174-H177 PolarHBondContact NH2-NE2 2.87Å; H177-F228 AromaticContact CE1-CG 3.94Å
178	Q	95.5	Very high	95.7	Very high	36 Å²	36	51 Å²	51	17%	0.168	26%	0.26	C	S	.	.			trans	-112	124.7	-175.4	-61.3	176.6	-60.3	0	0	110.3	S157 G159 F186 Q206 A208	S157-Q178 PolarHBondContact O-OE1 3.28Å; G159-Q178 CarbonylContact C-O 3.54Å; G159-Q178 WeakPolarHBondContact CA-O 3.39Å; G159-Q178 PolarHBondContact O-N 3.21Å; Q178-F186 HydrophobicContact CB-CB 4.02Å; Q178-F186 HydrophobicContact CB-CD1 4.45Å; Q178-F186 HydrophobicContact CB-CD2 3.76Å; Q178-F186 HydrophobicContact CB-CE2 4.34Å; Q178-F186 HydrophobicContact CB-CG 3.83Å; Q178-F186 PolarHBondContact O-N 2.79Å; Q178-Q206 PolarHBondContact NE2-O 3.44Å; Q178-Q206 PolarHBondContact OE1-O 3.03Å; Q178-A208 HydrophobicContact CG-CB 4.32Å
179	K	94.4	Very high	95.8	Very high	38 Å²	38	42.8 Å²	42.8	17%	0.165	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	143.9	-178.7	-58.3	-178.6	179.6	-179.7	0	110.6	D160 S181 T184 E281	D160-K179 WeakPolarHBondContact OD2-CE 3.04Å; K179-S181 WeakPolarHBondContact CB-O 3.42Å; K179-T184 CarbonylContact C-O 3.55Å; K179-T184 WeakPolarHBondContact CA-O 3.4Å; K179-E281 WeakPolarHBondContact CD-OE1 3.43Å; K179-E281 VanDerWaalsContact NZ-CD 3.31Å; K179-E281 IonicContact NZ-OE1 3.25Å; K179-E281 PolarHBondContact NZ-OE1 2.71Å; K179-E281 VanDerWaalsContact NZ-OE1 3.12Å; K179-E281 IonicContact NZ-OE2 2.71Å; K179-E281 PolarHBondContact NZ-OE2 2.86Å
180	H	94.1	Very high	95.9	Very high	79 Å²	79	42.2 Å²	42.2	37%	0.366	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	-36.2	171.8	-67.7	-70.7	0	0	0	111.4	T184 F186 H200 D202	H180-T184 HydrophobicContact CB-CG2 4.14Å; H180-T184 PolarHBondContact N-O 2.79Å; H180-F186 AromaticContact CD2-CD2 3.92Å; H180-F186 AromaticContact CE1-CD2 3.93Å; H180-F186 AromaticContact CE1-CE2 3.6Å; H180-F186 AromaticContact CE1-CZ 3.65Å; H180-F186 AromaticContact ND1-CE2 3.71Å; H180-F186 AromaticContact ND1-CZ 3.98Å; H180-F186 AromaticContact NE2-CD2 3.72Å; H180-F186 AromaticContact NE2-CE2 3.88Å; H180-F186 AromaticContact NE2-CG 3.94Å; H180-H200 AromaticContact CD2-CE1 3.93Å; H180-H200 AromaticContact CD2-CG 3.93Å; H180-H200 AromaticContact CD2-ND1 3.4Å; H180-H200 PolarHBondContact CD2-ND1 2.84Å; H180-H200 AromaticContact CG-CE1 3.9Å; H180-H200 AromaticContact CG-ND1 3.74Å; H180-H200 AromaticContact NE2-ND1 3.7Å; H180-D202 IonicContact CD2-OD2 3.99Å; H180-D202 IonicContact CE1-OD1 3.08Å; H180-D202 PolarHBondContact CE1-OD1 3.27Å; H180-D202 IonicContact CE1-OD2 3.83Å; H180-D202 VanDerWaalsContact NE2-CG 3.34Å; H180-D202 IonicContact NE2-OD1 3.24Å; H180-D202 PolarHBondContact NE2-OD1 2.89Å; H180-D202 IonicContact NE2-OD2 2.89Å; H180-D202 PolarHBondContact NE2-OD2 3.31Å
181	S	93.1	Very high	95.5	Very high	59 Å²	59	37 Å²	37	41%	0.413	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	179.7	173.8	71.7	0	0	0	0	109.1	K179 N183 T184	K179-S181 WeakPolarHBondContact CB-O 3.42Å; S181-N183 PolarHBondContact O-N 3.26Å; S181-T184 PolarHBondContact O-N 2.77Å; S181-T184 VanDerWaalsContact O-N 3.07Å; S181-T184 WeakPolarHBondContact OG-CB 3.45Å; S181-T184 PolarHBondContact OG-OG1 2.83Å
182	F	93.8	Very high	94.8	Very high	29 Å²	29	37.3 Å²	37.3	13%	0.127	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53	129.6	176.3	-179.6	-110.5	0	0	0	111	T184 F278 E281 A282 Y285 I287	F182-T184 PolarHBondContact O-N 2.89Å; F182-T184 PolarHBondContact O-OG1 2.84Å; F182-F278 HydrophobicContact CE1-CE1 4.16Å; F182-F278 HydrophobicContact CE1-CE2 4.24Å; F182-F278 AromaticContact CE1-CZ 3.72Å; F182-F278 HydrophobicContact CE1-CZ 3.72Å; F182-F278 HydrophobicContact CE2-CD2 4.3Å; F182-F278 HydrophobicContact CE2-CE2 4.06Å; F182-F278 HydrophobicContact CE2-CZ 4.26Å; F182-F278 HydrophobicContact CZ-CD1 4.1Å; F182-F278 HydrophobicContact CZ-CD2 4.05Å; F182-F278 AromaticContact CZ-CE1 3.6Å; F182-F278 HydrophobicContact CZ-CE1 3.6Å; F182-F278 AromaticContact CZ-CE2 3.54Å; F182-F278 HydrophobicContact CZ-CE2 3.54Å; F182-F278 HydrophobicContact CZ-CG 4.32Å; F182-F278 AromaticContact CZ-CZ 3.3Å; F182-F278 HydrophobicContact CZ-CZ 3.3Å; F182-E281 HydrophobicContact CD2-CG 3.94Å; F182-E281 HydrophobicContact CE2-CB 4.06Å; F182-E281 HydrophobicContact CE2-CG 3.98Å; F182-A282 HydrophobicContact CE1-CB 3.84Å; F182-A282 VanDerWaalsContact CE2-CA 3.44Å; F182-A282 HydrophobicContact CE2-CB 3.75Å; F182-A282 HydrophobicContact CZ-CB 3.3Å; F182-Y285 HydrophobicContact CB-CD1 3.96Å; F182-Y285 HydrophobicContact CB-CD2 3.72Å; F182-Y285 HydrophobicContact CB-CE1 4.2Å; F182-Y285 HydrophobicContact CB-CE2 3.97Å; F182-Y285 HydrophobicContact CB-CG 3.72Å; F182-Y285 AromaticContact CD2-CD2 3.79Å; F182-Y285 HydrophobicContact CD2-CD2 3.79Å; F182-Y285 HydrophobicContact CD2-CE2 4.09Å; F182-Y285 HydrophobicContact CD2-CG 4.5Å; F182-Y285 HydrophobicContact CG-CD2 4.02Å; F182-Y285 HydrophobicContact CG-CE2 4.47Å; F182-Y285 HydrophobicContact CG-CG 4.29Å; F182-I287 HydrophobicContact CD1-CD1 3.55Å; F182-I287 HydrophobicContact CE1-CD1 3.96Å; F182-I287 HydrophobicContact CG-CD1 4.33Å
183	N	92.9	Very high	93.9	Very high	54 Å²	54	40.7 Å²	40.7	29%	0.289	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	29.1	-179.7	-162.3	41.5	0	0	0	114.7	S181 F278	S181-N183 PolarHBondContact O-N 3.26Å; N183-F278 HydrophobicContact CB-CE2 4.03Å; N183-F278 HydrophobicContact CB-CZ 4.24Å
184	T	94.3	Very high	92.5	Very high	14 Å²	14	46.1 Å²	46.1	9%	0.086	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	79.2	176.8	-52	0	0	0	0	109.5	K179 H180 S181 F182	K179-T184 CarbonylContact C-O 3.55Å; K179-T184 WeakPolarHBondContact CA-O 3.4Å; H180-T184 HydrophobicContact CB-CG2 4.14Å; H180-T184 PolarHBondContact N-O 2.79Å; S181-T184 PolarHBondContact O-N 2.77Å; S181-T184 VanDerWaalsContact O-N 3.07Å; S181-T184 WeakPolarHBondContact OG-CB 3.45Å; S181-T184 PolarHBondContact OG-OG1 2.83Å; F182-T184 PolarHBondContact O-N 2.89Å; F182-T184 PolarHBondContact O-OG1 2.84Å
185	P	97	Very high	91	Very high	15 Å²	15	46.1 Å²	46.1	10%	0.097	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	156.8	-174.7	28.1	-34.2	0	0	0	112.8	T140 D160 Q187	T140-P185 HydrophobicContact CG2-CB 3.69Å; T140-P185 HydrophobicContact CG2-CG 3.63Å; D160-P185 HydrophobicContact CB-CB 4.47Å; D160-P185 WeakPolarHBondContact OD1-CB 3.46Å; D160-P185 WeakPolarHBondContact OD2-CB 3.32Å; P185-Q187 PolarHBondContact O-NE2 3.25Å; P185-Q187 VanDerWaalsContact O-NE2 3.09Å
186	F	97.7	Very high	89.5	Confident	37 Å²	37	48.4 Å²	48.4	16%	0.162	27%	0.266	C	S	.	.			trans	-62.3	140.7	163.7	-81.9	-125.9	0	0	0	109.5	L158 G159 Q178 H180 D202	L158-F186 HydrophobicContact CD1-CB 4.01Å; L158-F186 HydrophobicContact CD1-CD1 4.19Å; L158-F186 HydrophobicContact CG-CB 4.06Å; G159-F186 WeakPolarHBondContact CA-O 3.19Å; G159-F186 PolarHBondContact N-O 3.12Å; Q178-F186 HydrophobicContact CB-CB 4.02Å; Q178-F186 HydrophobicContact CB-CD1 4.45Å; Q178-F186 HydrophobicContact CB-CD2 3.76Å; Q178-F186 HydrophobicContact CB-CE2 4.34Å; Q178-F186 HydrophobicContact CB-CG 3.83Å; Q178-F186 PolarHBondContact O-N 2.79Å; H180-F186 AromaticContact CD2-CD2 3.92Å; H180-F186 AromaticContact CE1-CD2 3.93Å; H180-F186 AromaticContact CE1-CE2 3.6Å; H180-F186 AromaticContact CE1-CZ 3.65Å; H180-F186 AromaticContact ND1-CE2 3.71Å; H180-F186 AromaticContact ND1-CZ 3.98Å; H180-F186 AromaticContact NE2-CD2 3.72Å; H180-F186 AromaticContact NE2-CE2 3.88Å; H180-F186 AromaticContact NE2-CG 3.94Å; F186-D202 WeakPolarHBondContact CA-OD2 3.34Å; F186-D202 HydrophobicContact CB-CB 4.46Å; F186-D202 HydrophobicContact CD1-CB 4.01Å; F186-D202 WeakPolarHBondContact CD1-OD1 3.47Å
187	Q	97.4	Very high	88.3	Confident	16 Å²	16	56.4 Å²	56.4	8%	0.075	29%	0.287	C	S	.	.			trans	-155	141.6	-171.7	60.4	-164.9	-81.6	0	0	112.5	V82 S138 A139 P185 H200 D202	V82-Q187 HydrophobicContact CG2-CB 4.42Å; S138-Q187 PolarHBondContact OG-OE1 2.91Å; A139-Q187 WeakPolarHBondContact O-CA 3.21Å; P185-Q187 PolarHBondContact O-NE2 3.25Å; P185-Q187 VanDerWaalsContact O-NE2 3.09Å; Q187-H200 HydrophobicContact CG-CB 4.22Å; Q187-D202 PolarHBondContact N-OD2 3Å; Q187-D202 WeakPolarHBondContact O-CB 3.21Å; Q187-D202 PolarHBondContact O-N 3.13Å
188	L	96.9	Very high	87.5	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	140	164.1	-65.2	-176.5	0	0	0	108.6	F95 I121 Y125 S138 A139 L141 L158 P204	F95-L188 HydrophobicContact CE1-CB 3.92Å; F95-L188 VanDerWaalsContact CE1-O 3.29Å; F95-L188 WeakPolarHBondContact CE1-O 3.35Å; F95-L188 HydrophobicContact CZ-CB 4.02Å; F95-L188 WeakPolarHBondContact CZ-O 3.28Å; I121-L188 HydrophobicContact CG2-CD1 3.94Å; Y125-L188 HydrophobicContact CD1-CD2 4.11Å; Y125-L188 HydrophobicContact CD2-CB 4.08Å; Y125-L188 HydrophobicContact CD2-CD1 4.01Å; Y125-L188 HydrophobicContact CD2-CD2 4.34Å; Y125-L188 HydrophobicContact CD2-CG 4.39Å; Y125-L188 HydrophobicContact CE1-CD2 4.29Å; Y125-L188 HydrophobicContact CE2-CB 4.09Å; Y125-L188 HydrophobicContact CG-CD1 4.01Å; Y125-L188 HydrophobicContact CG-CD2 4.12Å; S138-L188 CarbonylContact C-O 3.59Å; S138-L188 WeakPolarHBondContact CA-O 3.32Å; S138-L188 WeakPolarHBondContact CB-O 3.2Å; A139-L188 PolarHBondContact N-O 3.48Å; A139-L188 PolarHBondContact O-N 2.9Å; A139-L188 VanDerWaalsContact O-N 3.08Å; L141-L188 HydrophobicContact CD2-CD1 3.47Å; L141-L188 VanDerWaalsContact CD2-CD1 3.47Å; L141-L188 HydrophobicContact CD2-CG 3.96Å; L158-L188 HydrophobicContact CD2-CD2 3.66Å; L158-L188 HydrophobicContact CD2-CG 3.66Å; L188-P204 HydrophobicContact CD2-CG 4Å
189	S	95.5	Very high	86.9	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.007	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	138.2	-172.2	-60.9	0	0	0	0	112.7	Y125 G137 S138 P191 H200	Y125-S189 PolarHBondContact OH-O 2.75Å; G137-S189 CarbonylContact O-C 3.57Å; G137-S189 WeakPolarHBondContact O-CA 3.46Å; S138-S189 WeakPolarHBondContact CB-OG 3.33Å; S189-P191 WeakPolarHBondContact O-CD 3.1Å; S189-H200 WeakPolarHBondContact CB-O 3.32Å; S189-H200 PolarHBondContact OG-O 2.91Å
190	C	93.9	Very high	86.5	Confident	12 Å²	12	63.3 Å²	63.3	8%	0.081	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	87.1	164.6	-175.1	0	0	0	0	108.7	F95 L129 I135 L136 G137	F95-C190 HydrophobicContact CD2-CB 4.24Å; F95-C190 HydrophobicContact CE2-CB 3.66Å; L129-C190 HydrophobicContact CD2-CB 3.95Å; I135-C190 VanDerWaalsContact O-CB 3.28Å; I135-C190 WeakPolarHBondContact O-CB 3.4Å; L136-C190 WeakPolarHBondContact CA-O 3.47Å; L136-C190 WeakPolarHBondContact CD2-O 3.42Å; G137-C190 PolarHBondContact N-O 2.86Å; G137-C190 PolarHBondContact O-N 2.82Å
191	P	89	Confident	86.3	Confident	23 Å²	23	62.1 Å²	62.1	15%	0.149	31%	0.313	C	S	.	.			trans	-80.1	159.1	178.9	33.7	-36.9	0	0	0	112.5	W85 S189 F199	W85-P191 HydrophobicContact CH2-CB 4.05Å; S189-P191 WeakPolarHBondContact O-CD 3.1Å; P191-F199 HydrophobicContact CB-CB 4.15Å; P191-F199 HydrophobicContact CB-CD2 3.53Å; P191-F199 HydrophobicContact CB-CE2 4.21Å; P191-F199 HydrophobicContact CB-CG 4.04Å
192	P	84.3	Confident	86.4	Confident	42 Å²	42	59.8 Å²	59.8	27%	0.273	30%	0.295	S	S	.	.			trans	-59.4	138	168.8	-19.9	31.1	0	0	0	111.2	L136 L194 H195 S196	L136-P192 HydrophobicContact CD1-CG 4.22Å; L136-P192 HydrophobicContact CD2-CG 4.06Å; P192-L194 PolarHBondContact O-N 3.35Å; P192-L194 VanDerWaalsContact O-N 3.07Å; P192-H195 PolarHBondContact O-N 3.26Å; P192-S196 PolarHBondContact O-N 2.67Å; P192-S196 PolarHBondContact O-OG 2.96Å
193	T	77.3	Confident	86.4	Confident	131 Å²	131	62.7 Å²	62.7	80%	0.804	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-33.6	-175.7	50.8	0	0	0	0	114.5	H195	T193-H195 VanDerWaalsContact C-N 3.33Å; T193-H195 PolarHBondContact O-N 2.86Å
194	L	69.8	Low	86.6	Confident	154 Å²	154	60.9 Å²	60.9	81%	0.806	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-15.4	-179.5	-80.2	132.9	0	0	0	114.2	P192	P192-L194 PolarHBondContact O-N 3.35Å; P192-L194 VanDerWaalsContact O-N 3.07Å
195	H	66.4	Low	86.6	Confident	86 Å²	86	65.5 Å²	65.5	40%	0.398	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.6	12	-167.6	-63.1	100.2	0	0	0	114.3	P192 T193 R197 R198 F199	P192-H195 PolarHBondContact O-N 3.26Å; T193-H195 VanDerWaalsContact C-N 3.33Å; T193-H195 PolarHBondContact O-N 2.86Å; H195-R197 PolarHBondContact O-N 2.85Å; H195-R198 PolarHBondContact O-N 2.88Å; H195-F199 HydrophobicContact CB-CE2 3.78Å; H195-F199 VanDerWaalsContact O-CD2 3.28Å; H195-F199 WeakPolarHBondContact O-CD2 3.22Å
196	S	65.8	Low	86.6	Confident	53 Å²	53	68.3 Å²	68.3	37%	0.371	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-54.2	-30.4	-171.7	-47.2	0	0	0	0	114.8	P192 R198 F199	P192-S196 PolarHBondContact O-N 2.67Å; P192-S196 PolarHBondContact O-OG 2.96Å; S196-R198 PolarHBondContact O-N 3.06Å; S196-F199 PolarHBondContact O-N 2.73Å
197	R	70.4	Confident	86.6	Confident	255 Å²	255	66.9 Å²	66.9	96%	0.962	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-69.7	-12.6	179.5	-64.8	-169.5	-175.6	-155.6	1.5	114.7	H195	H195-R197 PolarHBondContact O-N 2.85Å
198	R	78.4	Confident	86.6	Confident	169 Å²	169	67 Å²	67	64%	0.638	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-90.5	-10.4	179.4	-66.5	-173	178.9	172.6	0.3	113.2	H195 S196	H195-R198 PolarHBondContact O-N 2.88Å; S196-R198 PolarHBondContact O-N 3.06Å
199	F	82.2	Confident	86.6	Confident	28 Å²	28	71 Å²	71	12%	0.123	36%	0.357	C	S	.	.	S	Bend	trans	-115.3	137.7	-173.2	-58.5	-78.7	0	0	0	110.4	W85 Y88 P191 H195 S196 C201	W85-F199 AromaticContact CH2-CD1 3.7Å; W85-F199 HydrophobicContact CH2-CD1 3.7Å; W85-F199 HydrophobicContact CH2-CD2 4.19Å; W85-F199 AromaticContact CH2-CE1 3.67Å; W85-F199 HydrophobicContact CH2-CE1 3.67Å; W85-F199 HydrophobicContact CH2-CE2 4.16Å; W85-F199 AromaticContact CH2-CG 3.96Å; W85-F199 HydrophobicContact CH2-CG 3.96Å; W85-F199 AromaticContact CH2-CZ 3.9Å; W85-F199 HydrophobicContact CH2-CZ 3.9Å; W85-F199 AromaticContact CZ2-CD1 3.79Å; W85-F199 HydrophobicContact CZ2-CD1 3.79Å; W85-F199 HydrophobicContact CZ2-CE1 4.11Å; W85-F199 HydrophobicContact CZ2-CG 4.17Å; W85-F199 HydrophobicContact CZ3-CD1 4.42Å; W85-F199 AromaticContact CZ3-CE1 3.94Å; W85-F199 HydrophobicContact CZ3-CE1 3.94Å; W85-F199 HydrophobicContact CZ3-CZ 4.01Å; Y88-F199 HydrophobicContact CD2-CE1 4.34Å; Y88-F199 HydrophobicContact CE1-CZ 4.14Å; Y88-F199 AromaticContact CE2-CE1 3.81Å; Y88-F199 HydrophobicContact CE2-CE1 3.81Å; Y88-F199 HydrophobicContact CE2-CZ 4.24Å; Y88-F199 AromaticContact CZ-CE1 3.9Å; Y88-F199 AromaticContact CZ-CZ 3.99Å; P191-F199 HydrophobicContact CB-CB 4.15Å; P191-F199 HydrophobicContact CB-CD2 3.53Å; P191-F199 HydrophobicContact CB-CE2 4.21Å; P191-F199 HydrophobicContact CB-CG 4.04Å; H195-F199 HydrophobicContact CB-CE2 3.78Å; H195-F199 VanDerWaalsContact O-CD2 3.28Å; H195-F199 WeakPolarHBondContact O-CD2 3.22Å; S196-F199 PolarHBondContact O-N 2.73Å; F199-C201 PolarHBondContact O-N 3.49Å; F199-C201 PolarHBondContact O-SG 2.88Å; F199-C201 VanDerWaalsContact O-SG 3.34Å
200	H	86.3	Confident	86.7	Confident	72 Å²	72	72.6 Å²	72.6	33%	0.333	37%	0.366	S	S	.	.			trans	-62.1	128.1	167.6	-71.5	-79.4	0	0	0	109.5	H180 Q187 S189	H180-H200 AromaticContact CD2-CE1 3.93Å; H180-H200 AromaticContact CD2-CG 3.93Å; H180-H200 AromaticContact CD2-ND1 3.4Å; H180-H200 PolarHBondContact CD2-ND1 2.84Å; H180-H200 AromaticContact CG-CE1 3.9Å; H180-H200 AromaticContact CG-ND1 3.74Å; H180-H200 AromaticContact NE2-ND1 3.7Å; Q187-H200 HydrophobicContact CG-CB 4.22Å; S189-H200 WeakPolarHBondContact CB-O 3.32Å; S189-H200 PolarHBondContact OG-O 2.91Å
201	C	89.1	Confident	86.9	Confident	55 Å²	55	74.2 Å²	74.2	37%	0.372	38%	0.377	S	S	.	.			trans	-136.6	86.9	-177.9	-61.3	0	0	0	0	108.5	F199	F199-C201 PolarHBondContact O-N 3.49Å; F199-C201 PolarHBondContact O-SG 2.88Å; F199-C201 VanDerWaalsContact O-SG 3.34Å
202	D	95.6	Very high	87.4	Confident	9 Å²	9	74.1 Å²	74.1	5%	0.048	38%	0.376	C	S	.	.			trans	-84.7	156.5	178.7	-59.2	-69.8	0	0	0	111.2	L158 H180 F186 Q187	L158-D202 HydrophobicContact CD1-CB 4.36Å; L158-D202 HydrophobicContact CD2-CB 4.44Å; H180-D202 IonicContact CD2-OD2 3.99Å; H180-D202 IonicContact CE1-OD1 3.08Å; H180-D202 PolarHBondContact CE1-OD1 3.27Å; H180-D202 IonicContact CE1-OD2 3.83Å; H180-D202 VanDerWaalsContact NE2-CG 3.34Å; H180-D202 IonicContact NE2-OD1 3.24Å; H180-D202 PolarHBondContact NE2-OD1 2.89Å; H180-D202 IonicContact NE2-OD2 2.89Å; H180-D202 PolarHBondContact NE2-OD2 3.31Å; F186-D202 WeakPolarHBondContact CA-OD2 3.34Å; F186-D202 HydrophobicContact CB-CB 4.46Å; F186-D202 HydrophobicContact CD1-CB 4.01Å; F186-D202 WeakPolarHBondContact CD1-OD1 3.47Å; Q187-D202 PolarHBondContact N-OD2 3Å; Q187-D202 WeakPolarHBondContact O-CB 3.21Å; Q187-D202 PolarHBondContact O-N 3.13Å
203	L	95.1	Very high	88	Confident	90 Å²	90	76.8 Å²	76.8	47%	0.471	39%	0.385	S	S	.	.			trans	-96.4	147.9	-176.6	-61.9	177.2	0	0	0	111.3	N205 Q206	L203-N205 WeakPolarHBondContact CB-OD1 3.48Å; L203-N205 PolarHBondContact O-N 3.16Å; L203-N205 VanDerWaalsContact O-N 3.12Å; L203-Q206 HydrophobicContact CB-CG 4.26Å; L203-Q206 WeakPolarHBondContact O-CB 3.42Å; L203-Q206 PolarHBondContact O-N 2.93Å
204	P	95.3	Very high	89	Confident	16 Å²	16	70.6 Å²	70.6	10%	0.104	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-50.6	-36	174.6	-31.7	36.6	0	0	0	115.1	I121 A122 Y125 L188 Q206 A207	I121-P204 HydrophobicContact CB-CB 4.3Å; I121-P204 HydrophobicContact CG2-CB 3.81Å; I121-P204 HydrophobicContact CG2-CG 4.28Å; A122-P204 HydrophobicContact CB-CB 3.88Å; A122-P204 HydrophobicContact CB-CG 4.19Å; Y125-P204 HydrophobicContact CD1-CG 3.65Å; Y125-P204 HydrophobicContact CE1-CG 4.46Å; Y125-P204 HydrophobicContact CG-CG 4.3Å; L188-P204 HydrophobicContact CD2-CG 4Å; P204-Q206 PolarHBondContact O-N 3.36Å; P204-A207 WeakPolarHBondContact O-CB 3.4Å; P204-A207 PolarHBondContact O-N 3.29Å
205	N	94.9	Very high	90.2	Very high	112 Å²	112	68.5 Å²	68.5	60%	0.599	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-74.2	-6.4	179.7	68.1	-10.1	0	0	0	113.9	L203	L203-N205 WeakPolarHBondContact CB-OD1 3.48Å; L203-N205 PolarHBondContact O-N 3.16Å; L203-N205 VanDerWaalsContact O-N 3.12Å
206	Q	97	Very high	91.6	Very high	74 Å²	74	66.9 Å²	66.9	35%	0.346	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-87.8	-6.3	173.2	-62.8	176.5	-92	0	0	112.3	L158 Q178 L203 P204 A208	L158-Q206 HydrophobicContact CD1-CB 4.24Å; Q178-Q206 PolarHBondContact NE2-O 3.44Å; Q178-Q206 PolarHBondContact OE1-O 3.03Å; L203-Q206 HydrophobicContact CB-CG 4.26Å; L203-Q206 WeakPolarHBondContact O-CB 3.42Å; L203-Q206 PolarHBondContact O-N 2.93Å; P204-Q206 PolarHBondContact O-N 3.36Å; Q206-A208 PolarHBondContact O-N 2.85Å
207	A	97.5	Very high	92.9	Very high	6 Å²	6	65.7 Å²	65.7	5%	0.05	33%	0.325	C	S	.	.	S	Bend	trans	-60.1	130.6	176.2	0	0	0	0	0	110.8	I121 S157 L158 P204 Q209	I121-A207 HydrophobicContact CD1-CB 4.02Å; S157-A207 CarbonylContact O-C 3.59Å; S157-A207 VanDerWaalsContact O-CA 3.29Å; S157-A207 WeakPolarHBondContact O-CA 3.14Å; L158-A207 HydrophobicContact CB-CB 4.2Å; L158-A207 HydrophobicContact CD1-CB 4.35Å; P204-A207 WeakPolarHBondContact O-CB 3.4Å; P204-A207 PolarHBondContact O-N 3.29Å; A207-Q209 PolarHBondContact O-N 3.16Å
208	A	97.9	Very high	94.2	Very high	19 Å²	19	53.7 Å²	53.7	16%	0.157	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	120.2	174.9	0	0	0	0	0	110	A156 S157 V176 Q178 Q206	A156-A208 VanDerWaalsContact CA-O 3.3Å; A156-A208 WeakPolarHBondContact CA-O 3.16Å; S157-A208 PolarHBondContact N-O 3.4Å; S157-A208 PolarHBondContact O-N 3.16Å; V176-A208 HydrophobicContact CB-CB 4.2Å; Q178-A208 HydrophobicContact CG-CB 4.32Å; Q206-A208 PolarHBondContact O-N 2.85Å
209	Q	97.7	Very high	95.1	Very high	85 Å²	85	46 Å²	46	40%	0.397	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	138.9	-179	-70.2	178.4	88.5	0	0	111.5	E118 G155 A156 A207	E118-Q209 PolarHBondContact OE2-NE2 3.24Å; G155-Q209 CarbonylContact O-C 3.43Å; G155-Q209 VanDerWaalsContact O-CA 3.32Å; G155-Q209 WeakPolarHBondContact O-CA 3.01Å; A156-Q209 HydrophobicContact CB-CG 4.18Å; A207-Q209 PolarHBondContact O-N 3.16Å
210	T	97.8	Very high	95.8	Very high	33 Å²	33	44.7 Å²	44.7	20%	0.202	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	157.8	-177.5	44.8	0	0	0	0	109.8	G155 Y163	G155-T210 PolarHBondContact N-O 3.07Å; G155-T210 PolarHBondContact O-N 3.32Å; G155-T210 PolarHBondContact O-OG1 3.1Å; Y163-T210 PolarHBondContact OH-OG1 3.02Å
211	S	97.8	Very high	96.4	Very high	46 Å²	46	41.3 Å²	41.3	32%	0.322	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	140.3	173.4	54.3	0	0	0	0	112.6	R152 V153	R152-S211 VanDerWaalsContact NE-CB 3.34Å; R152-S211 PolarHBondContact NE-OG 2.87Å; R152-S211 PolarHBondContact NH2-O 2.94Å; R152-S211 PolarHBondContact NH2-OG 3.21Å; V153-S211 CarbonylContact O-C 3.53Å; V153-S211 WeakPolarHBondContact O-CA 3.37Å
212	V	98.3	Very high	96.9	Very high	21 Å²	21	38.7 Å²	38.7	13%	0.127	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	141	-172.9	64.2	0	0	0	0	110.5	R152 V153 V165 I172 Q173 V214	R152-V212 WeakPolarHBondContact CA-O 3.3Å; R152-V212 WeakPolarHBondContact CG-O 3.47Å; V153-V212 HydrophobicContact CB-CG1 4.14Å; V153-V212 PolarHBondContact N-O 3.33Å; V153-V212 PolarHBondContact O-N 2.9Å; V165-V212 HydrophobicContact CB-CG1 4.47Å; V165-V212 HydrophobicContact CG2-CG1 3.92Å; I172-V212 HydrophobicContact CD1-CG2 4.1Å; Q173-V212 HydrophobicContact CB-CB 4.14Å; Q173-V212 HydrophobicContact CB-CG1 3.87Å; Q173-V212 HydrophobicContact CB-CG2 4.25Å; Q173-V212 HydrophobicContact CG-CB 4.29Å; Q173-V212 HydrophobicContact CG-CG1 4Å; V212-V214 HydrophobicContact CG1-CG1 4.42Å
213	E	98	Very high	97	Very high	98 Å²	98	38.2 Å²	38.2	46%	0.458	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	134.8	173.6	-171.1	-172.5	151.8	0	0	110.3	H151 R167	H151-E213 CarbonylContact O-C 3.54Å; H151-E213 WeakPolarHBondContact O-CA 3.43Å; R167-E213 PolarHBondContact NH2-O 3Å
214	V	97.8	Very high	97.2	Very high	1 Å²	1	34 Å²	34	1%	0.006	19%	0.187	C	C	.	.			trans	-119.8	155.4	-178.1	-63	0	0	0	0	112.1	L34 L146 H151 V153 V165 V212 D218 V304	L34-V214 HydrophobicContact CD1-CG2 3.99Å; L146-V214 HydrophobicContact CD1-CG2 3.51Å; H151-V214 PolarHBondContact O-N 2.8Å; V153-V214 HydrophobicContact CB-CG1 4.07Å; V153-V214 HydrophobicContact CG2-CB 4.32Å; V153-V214 HydrophobicContact CG2-CG1 3.49Å; V153-V214 VanDerWaalsContact CG2-CG1 3.49Å; V153-V214 HydrophobicContact CG2-CG2 3.87Å; V165-V214 HydrophobicContact CG1-CG1 3.94Å; V212-V214 HydrophobicContact CG1-CG1 4.42Å; V214-D218 WeakPolarHBondContact CA-OD2 3.29Å; V214-D218 HydrophobicContact CB-CB 4.45Å; V214-D218 WeakPolarHBondContact CB-OD2 3.42Å; V214-V304 HydrophobicContact CB-CG2 4.32Å; V214-V304 HydrophobicContact CG2-CG1 4.26Å; V214-V304 HydrophobicContact CG2-CG2 4.29Å
215	K	95.5	Very high	97.3	Very high	110 Å²	110	34.4 Å²	34.4	48%	0.478	19%	0.189	S	C	.	.			trans	-127.2	156.6	-179.9	-64	179.4	-177.6	-179.5	0	110.1	G217 D218 V304	K215-G217 PolarHBondContact O-N 3.04Å; K215-D218 PolarHBondContact N-OD2 2.91Å; K215-D218 VanDerWaalsContact O-CB 3.29Å; K215-D218 WeakPolarHBondContact O-CB 3.36Å; K215-D218 VanDerWaalsContact O-CG 3.3Å; K215-D218 PolarHBondContact O-N 3.42Å; K215-V304 WeakPolarHBondContact O-CB 3.43Å; K215-V304 WeakPolarHBondContact O-CG1 3.38Å
216	P	94.3	Very high	97.4	Very high	53 Å²	53	29.2 Å²	29.2	34%	0.344	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.8	132.5	168.9	-25	34.3	0	0	0	111.2	L34 V304 E306	L34-P216 HydrophobicContact CD2-CG 3.87Å; P216-V304 CarbonylContact C-O 3.59Å; P216-V304 WeakPolarHBondContact CA-O 3.37Å; P216-E306 HydrophobicContact CB-CG 3.99Å; P216-E306 HydrophobicContact CG-CG 3.33Å
217	G	93.9	Very high	97.5	Very high	27 Å²	27	25.7 Å²	25.7	28%	0.278	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.8	-14.6	-174	0	0	0	0	0	114.7	K215 V304	K215-G217 PolarHBondContact O-N 3.04Å; G217-V304 PolarHBondContact N-O 3.09Å
218	D	96.9	Very high	97.5	Very high	4 Å²	4	25.7 Å²	25.7	2%	0.021	14%	0.144	C	C	.	.			trans	-67	145.4	171.9	-70	-10.8	0	0	0	110.7	V165 I166 R167 V214 K215 V304	V165-D218 HydrophobicContact CG1-CB 4.45Å; I166-D218 WeakPolarHBondContact O-CA 3.35Å; R167-D218 VanDerWaalsContact CB-OD1 3.26Å; R167-D218 WeakPolarHBondContact CB-OD1 3.38Å; R167-D218 WeakPolarHBondContact CG-OD1 3.5Å; R167-D218 IonicContact CZ-OD1 3.8Å; R167-D218 IonicContact CZ-OD2 3.16Å; R167-D218 IonicContact NE-OD1 2.65Å; R167-D218 PolarHBondContact NE-OD1 3.46Å; R167-D218 IonicContact NE-OD2 3.98Å; R167-D218 PolarHBondContact NE-OD2 3.48Å; R167-D218 IonicContact NH2-OD1 2.7Å; R167-D218 IonicContact NH2-OD2 3.76Å; R167-D218 PolarHBondContact NH2-OD2 3.33Å; V214-D218 WeakPolarHBondContact CA-OD2 3.29Å; V214-D218 HydrophobicContact CB-CB 4.45Å; V214-D218 WeakPolarHBondContact CB-OD2 3.42Å; K215-D218 PolarHBondContact N-OD2 2.91Å; K215-D218 VanDerWaalsContact O-CB 3.29Å; K215-D218 WeakPolarHBondContact O-CB 3.36Å; K215-D218 VanDerWaalsContact O-CG 3.3Å; K215-D218 PolarHBondContact O-N 3.42Å; D218-V304 HydrophobicContact CB-CB 4.25Å; D218-V304 HydrophobicContact CB-CG2 4.01Å; D218-V304 WeakPolarHBondContact O-CB 3.42Å; D218-V304 WeakPolarHBondContact O-CG2 3.31Å; D218-V304 PolarHBondContact O-N 2.83Å
219	I	97.4	Very high	97.5	Very high	8 Å²	8	25 Å²	25	4%	0.041	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	127.1	179.2	-63.5	170.8	0	0	0	109.1	V165 I166 I221 V240 I243 L245 L303	V165-I219 CarbonylContact C-O 3.59Å; V165-I219 WeakPolarHBondContact CA-O 3.27Å; I166-I219 HydrophobicContact CB-CB 4.38Å; I166-I219 PolarHBondContact N-O 3.16Å; I166-I219 PolarHBondContact O-N 2.93Å; I219-I221 HydrophobicContact CG2-CG1 4.28Å; I219-V240 HydrophobicContact CB-CG1 4.44Å; I219-V240 HydrophobicContact CD1-CG1 3.47Å; I219-V240 VanDerWaalsContact CD1-CG1 3.47Å; I219-V240 HydrophobicContact CG2-CG1 4.3Å; I219-I243 HydrophobicContact CD1-CD1 3.79Å; I219-L245 HydrophobicContact CD1-CD2 4.13Å; I219-L303 HydrophobicContact CG1-CD1 3.83Å
220	I	98.4	Very high	97.5	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	129.2	174.3	-53.2	174.6	0	0	0	107.8	L36 V144 V153 L164 V165 V222 L301 G302 V304	L36-I220 HydrophobicContact CD1-CD1 4.23Å; L36-I220 HydrophobicContact CD2-CD1 3.84Å; V144-I220 HydrophobicContact CG1-CG2 4.21Å; V153-I220 HydrophobicContact CG2-CD1 3.58Å; L164-I220 WeakPolarHBondContact O-CA 3.14Å; V165-I220 HydrophobicContact CG2-CG1 4.48Å; I220-V222 HydrophobicContact CG2-CG2 4.08Å; I220-L301 CarbonylContact O-C 3.58Å; I220-L301 WeakPolarHBondContact O-CA 3.34Å; I220-G302 PolarHBondContact N-O 2.56Å; I220-G302 PolarHBondContact O-N 2.63Å; I220-V304 HydrophobicContact CD1-CG2 4.12Å; I220-V304 HydrophobicContact CG1-CG2 4.28Å
221	I	98.6	Very high	97.6	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	125.4	171	-49.5	-169.4	0	0	0	107.3	Y163 L164 I166 I219 L227 I236 V240 L261 V299 I300 L301	Y163-I221 CarbonylContact C-O 3.58Å; Y163-I221 WeakPolarHBondContact CA-O 3.4Å; Y163-I221 WeakPolarHBondContact CB-O 3.33Å; L164-I221 HydrophobicContact CB-CB 4.34Å; L164-I221 PolarHBondContact N-O 3.43Å; L164-I221 PolarHBondContact O-N 3.05Å; I166-I221 HydrophobicContact CD1-CD1 3.61Å; I166-I221 HydrophobicContact CD1-CG1 4.09Å; I219-I221 HydrophobicContact CG2-CG1 4.28Å; I221-L227 HydrophobicContact CG2-CD2 4.01Å; I221-I236 HydrophobicContact CD1-CG2 3.45Å; I221-I236 VanDerWaalsContact CD1-CG2 3.45Å; I221-V240 HydrophobicContact CD1-CG2 3.62Å; I221-L261 HydrophobicContact CD1-CD1 4.36Å; I221-V299 HydrophobicContact CG2-CG1 4.03Å; I221-I300 CarbonylContact C-O 3.54Å; I221-I300 WeakPolarHBondContact CA-O 3.43Å; I221-L301 HydrophobicContact CB-CD2 4.11Å; I221-L301 HydrophobicContact CD1-CD2 3.96Å; I221-L301 HydrophobicContact CG1-CD2 3.55Å; I221-L301 HydrophobicContact CG2-CD2 4Å
222	V	98.8	Very high	97.5	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	130.9	170.3	-169.2	0	0	0	0	107.3	L76 V78 C142 V144 I220 I300	L76-V222 HydrophobicContact CB-CG2 4.21Å; L76-V222 HydrophobicContact CD1-CG2 4.19Å; V78-V222 HydrophobicContact CG1-CG1 4.01Å; V78-V222 HydrophobicContact CG2-CG1 3.85Å; C142-V222 HydrophobicContact CB-CG1 4.36Å; V144-V222 HydrophobicContact CB-CG2 4.08Å; V144-V222 HydrophobicContact CG2-CG2 3.74Å; I220-V222 HydrophobicContact CG2-CG2 4.08Å; V222-I300 HydrophobicContact CB-CB 4.29Å; V222-I300 PolarHBondContact N-O 2.77Å; V222-I300 PolarHBondContact O-N 2.89Å
223	G	98.6	Very high	97.5	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	165.6	-176.8	0	0	0	0	0	114.3	G162 F228 T298	G162-G223 PolarHBondContact N-O 3.28Å; G162-G223 PolarHBondContact O-N 3.24Å; G223-F228 WeakPolarHBondContact O-CE2 3.39Å; G223-T298 WeakPolarHBondContact CA-O 3.43Å
224	T	98.6	Very high	97.5	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	13%	0.125	C	C	.	.			trans	-83.1	171.2	173.2	50.9	0	0	0	0	111.1	D63 V78 D80 G226 L227 F228 T298	D63-T224 HydrophobicContact CB-CG2 4.43Å; D63-T224 WeakPolarHBondContact OD2-CG2 3.2Å; D63-T224 PolarHBondContact OD2-OG1 3.01Å; V78-T224 HydrophobicContact CB-CG2 4.11Å; V78-T224 HydrophobicContact CG2-CG2 4.23Å; D80-T224 HydrophobicContact CB-CG2 3.91Å; T224-G226 PolarHBondContact O-N 3.08Å; T224-L227 PolarHBondContact O-N 3.19Å; T224-L227 VanDerWaalsContact O-N 3.11Å; T224-F228 WeakPolarHBondContact O-CD2 3.47Å; T224-T298 PolarHBondContact N-O 3.37Å; T224-T298 VanDerWaalsContact N-O 3.16Å; T224-T298 PolarHBondContact OG1-N 2.98Å
225	D	97.6	Very high	97.4	Very high	26 Å²	26	23.5 Å²	23.5	14%	0.139	14%	0.135	C	C	.	.	H	α-helix	trans	-53.5	-35.2	174.9	67.7	-28.2	0	0	0	111.7	D160 L227 F228 D229	D160-D225 HydrophobicContact CB-CB 4.46Å; D225-L227 CarbonylContact O-C 3.58Å; D225-L227 PolarHBondContact O-N 3.44Å; D225-F228 PolarHBondContact O-N 2.84Å; D225-D229 VanDerWaalsContact O-CB 3.26Å; D225-D229 WeakPolarHBondContact O-CB 3.46Å; D225-D229 PolarHBondContact O-N 3Å
226	G	97.8	Very high	97.6	Very high	3 Å²	3	18.3 Å²	18.3	3%	0.031	11%	0.112	C	C	.	.	H	α-helix	trans	-52.4	-27	176.3	0	0	0	0	0	114.7	T224 N230 D296	T224-G226 PolarHBondContact O-N 3.08Å; G226-N230 PolarHBondContact O-ND2 2.97Å; G226-D296 WeakPolarHBondContact CA-O 3Å
227	L	98.5	Very high	97.8	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-80.2	-57	167.9	177.1	69.2	0	0	0	111.5	I221 T224 D225 D229 N230 L231 I236 L261 A265 I297 V299	I221-L227 HydrophobicContact CG2-CD2 4.01Å; T224-L227 PolarHBondContact O-N 3.19Å; T224-L227 VanDerWaalsContact O-N 3.11Å; D225-L227 CarbonylContact O-C 3.58Å; D225-L227 PolarHBondContact O-N 3.44Å; L227-D229 PolarHBondContact O-N 3.31Å; L227-N230 PolarHBondContact O-N 2.7Å; L227-L231 HydrophobicContact CD1-CD1 3.7Å; L227-L231 HydrophobicContact CD1-CG 4.29Å; L227-L231 PolarHBondContact O-N 2.65Å; L227-I236 HydrophobicContact CD2-CD1 4.45Å; L227-I236 HydrophobicContact CG-CD1 4.4Å; L227-L261 HydrophobicContact CD1-CB 4.39Å; L227-A265 HydrophobicContact CD1-CB 4.2Å; L227-I297 HydrophobicContact CB-CG2 4.47Å; L227-V299 HydrophobicContact CB-CG2 4.27Å; L227-V299 HydrophobicContact CD1-CG2 4.05Å; L227-V299 HydrophobicContact CD2-CG2 3.96Å; L227-V299 HydrophobicContact CG-CG2 4.31Å
228	F	98.1	Very high	97.9	Very high	6 Å²	6	21.7 Å²	21.7	3%	0.026	12%	0.117	C	C	.	.	H	α-helix	trans	-75.6	-23.2	-166.5	-65.4	-62.3	0	0	0	114.5	G162 L164 H177 G223 T224 D225 N230 I236 P277	G162-F228 WeakPolarHBondContact O-CE2 3.44Å; L164-F228 HydrophobicContact CD1-CE1 4.01Å; L164-F228 HydrophobicContact CG-CE1 3.98Å; L164-F228 HydrophobicContact CG-CZ 4.43Å; H177-F228 AromaticContact CE1-CG 3.94Å; G223-F228 WeakPolarHBondContact O-CE2 3.39Å; T224-F228 WeakPolarHBondContact O-CD2 3.47Å; D225-F228 PolarHBondContact O-N 2.84Å; F228-N230 VanDerWaalsContact C-N 3.33Å; F228-I236 HydrophobicContact CD1-CD1 4.13Å; F228-I236 HydrophobicContact CE1-CD1 4.17Å; F228-P277 WeakPolarHBondContact O-CB 3.08Å; F228-P277 WeakPolarHBondContact O-CG 3.46Å
229	D	97.6	Very high	97.8	Very high	5 Å²	5	22 Å²	22	3%	0.027	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-23	174.3	-83.7	3	0	0	0	111.9	D225 L227 S276 P277 F278	D225-D229 VanDerWaalsContact O-CB 3.26Å; D225-D229 WeakPolarHBondContact O-CB 3.46Å; D225-D229 PolarHBondContact O-N 3Å; L227-D229 PolarHBondContact O-N 3.31Å; D229-S276 WeakPolarHBondContact O-CB 3.29Å; D229-P277 WeakPolarHBondContact O-CD 3.38Å; D229-F278 HydrophobicContact CB-CB 3.93Å; D229-F278 PolarHBondContact O-N 2.74Å; D229-F278 WeakPolarHBondContact OD2-CD2 3.3Å
230	N	98.3	Very high	97.7	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	-24.1	-174	-70.7	-53.5	0	0	0	113.9	G226 L227 F228 A265 A268 A269 F274 G292 V293	G226-N230 PolarHBondContact O-ND2 2.97Å; L227-N230 PolarHBondContact O-N 2.7Å; F228-N230 VanDerWaalsContact C-N 3.33Å; N230-A265 HydrophobicContact CB-CB 4.31Å; N230-A265 WeakPolarHBondContact CB-O 3.45Å; N230-A268 HydrophobicContact CB-CB 4.25Å; N230-A268 WeakPolarHBondContact O-CB 3.33Å; N230-A269 WeakPolarHBondContact OD1-CA 3.09Å; N230-F274 WeakPolarHBondContact O-CE1 3.44Å; N230-G292 VanDerWaalsContact OD1-CA 3.25Å; N230-G292 WeakPolarHBondContact OD1-CA 3.47Å; N230-V293 PolarHBondContact ND2-O 3.43Å; N230-V293 PolarHBondContact OD1-N 2.61Å
231	L	98.2	Very high	97.5	Very high	3 Å²	3	29 Å²	29	2%	0.016	15%	0.149	C	C	.	.	S	Bend	trans	-117.7	130.3	178.4	-61.7	-170.8	0	0	0	112.3	L227 M235 I236 L261 Q264 A265 A268 P277	L227-L231 HydrophobicContact CD1-CD1 3.7Å; L227-L231 HydrophobicContact CD1-CG 4.29Å; L227-L231 PolarHBondContact O-N 2.65Å; L231-M235 HydrophobicContact CB-CB 4.45Å; L231-M235 HydrophobicContact CD2-CB 4.48Å; L231-M235 HydrophobicContact CD2-CE 3.53Å; L231-M235 HydrophobicContact CD2-SD 4.22Å; L231-I236 HydrophobicContact CB-CD1 4.25Å; L231-I236 HydrophobicContact CB-CG1 3.84Å; L231-I236 HydrophobicContact CD1-CG1 4.25Å; L231-L261 HydrophobicContact CD1-CD2 4.25Å; L231-Q264 HydrophobicContact CD1-CB 4.14Å; L231-Q264 HydrophobicContact CD2-CB 4.06Å; L231-A265 HydrophobicContact CD1-CB 4Å; L231-A265 HydrophobicContact CD2-CB 4.42Å; L231-A265 HydrophobicContact CG-CB 3.86Å; L231-A268 HydrophobicContact CD2-CB 4.22Å; L231-P277 VanDerWaalsContact C-CG 3.47Å; L231-P277 WeakPolarHBondContact O-CG 3.49Å
232	T	97.3	Very high	97	Very high	50 Å²	50	32.2 Å²	32.2	31%	0.307	17%	0.168	S	C	.	.			trans	-69.4	156.7	169.1	67.3	0	0	0	0	110.5	S234 M235 I236 P277	T232-S234 PolarHBondContact O-N 3.06Å; T232-M235 HydrophobicContact CG2-SD 4.22Å; T232-M235 WeakPolarHBondContact O-CB 3.43Å; T232-M235 PolarHBondContact O-N 3.36Å; T232-M235 VanDerWaalsContact OG1-CG 3.26Å; T232-M235 WeakPolarHBondContact OG1-CG 3.4Å; T232-M235 PolarHBondContact OG1-N 2.57Å; T232-M235 PolarHBondContact OG1-SD 3.48Å; T232-I236 PolarHBondContact O-N 2.68Å; T232-P277 HydrophobicContact CG2-CG 4.17Å
233	E	97.2	Very high	96.5	Very high	76 Å²	76	32.7 Å²	32.7	36%	0.355	17%	0.171	S	C	.	.	H	α-helix	trans	-55.1	-40.1	176.2	-172.8	171.2	119.2	0	0	112.2	V171 R174 M235 I236 L237	V171-E233 VanDerWaalsContact CG2-CD 3.44Å; V171-E233 HydrophobicContact CG2-CG 3.66Å; V171-E233 WeakPolarHBondContact CG2-OE1 3.29Å; R174-E233 IonicContact NH1-OE2 3.91Å; E233-M235 VanDerWaalsContact C-N 3.33Å; E233-M235 PolarHBondContact O-N 2.89Å; E233-I236 PolarHBondContact O-N 3.36Å; E233-L237 HydrophobicContact CG-CD1 4.22Å; E233-L237 HydrophobicContact CG-CG 4.42Å; E233-L237 WeakPolarHBondContact O-CB 3.46Å; E233-L237 WeakPolarHBondContact O-CG 3.4Å; E233-L237 PolarHBondContact O-N 2.89Å
234	S	97.4	Very high	95.5	Very high	78 Å²	78	38 Å²	38	55%	0.545	20%	0.196	S	C	.	.	H	α-helix	trans	-60.3	-39.5	176.1	-58.1	0	0	0	0	113	T232 L237 Q238	T232-S234 PolarHBondContact O-N 3.06Å; S234-L237 PolarHBondContact O-N 3.18Å; S234-Q238 VanDerWaalsContact O-CG 3.26Å; S234-Q238 WeakPolarHBondContact O-CG 3.47Å; S234-Q238 PolarHBondContact O-N 2.95Å
235	M	97.7	Very high	94.3	Very high	45 Å²	45	42.2 Å²	42.2	22%	0.222	22%	0.218	C	C	.	.	H	α-helix	trans	-67.7	-43.7	177	-66.7	164.1	81.9	0	0	110.9	L231 T232 E233 L237 Q238 E239 F274	L231-M235 HydrophobicContact CB-CB 4.45Å; L231-M235 HydrophobicContact CD2-CB 4.48Å; L231-M235 HydrophobicContact CD2-CE 3.53Å; L231-M235 HydrophobicContact CD2-SD 4.22Å; T232-M235 HydrophobicContact CG2-SD 4.22Å; T232-M235 WeakPolarHBondContact O-CB 3.43Å; T232-M235 PolarHBondContact O-N 3.36Å; T232-M235 VanDerWaalsContact OG1-CG 3.26Å; T232-M235 WeakPolarHBondContact OG1-CG 3.4Å; T232-M235 PolarHBondContact OG1-N 2.57Å; T232-M235 PolarHBondContact OG1-SD 3.48Å; E233-M235 VanDerWaalsContact C-N 3.33Å; E233-M235 PolarHBondContact O-N 2.89Å; M235-L237 VanDerWaalsContact C-N 3.34Å; M235-L237 PolarHBondContact O-N 3.29Å; M235-Q238 WeakPolarHBondContact O-CB 3.47Å; M235-Q238 PolarHBondContact O-N 3.02Å; M235-E239 PolarHBondContact O-N 3.34Å; M235-E239 VanDerWaalsContact O-N 3.1Å; M235-F274 HydrophobicContact CE-CE2 4.42Å; M235-F274 HydrophobicContact CE-CZ 4.06Å; M235-F274 HydrophobicContact SD-CE2 4.32Å; M235-F274 HydrophobicContact SD-CZ 3.82Å
236	I	98.3	Very high	92.7	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-59.4	-46.5	175.3	-63.8	171.6	0	0	0	110.3	L164 I221 L227 F228 L231 T232 E233 Q238 E239 V240 L261	L164-I236 HydrophobicContact CD1-CD1 4.14Å; L164-I236 HydrophobicContact CD1-CG2 4.1Å; I221-I236 HydrophobicContact CD1-CG2 3.45Å; I221-I236 VanDerWaalsContact CD1-CG2 3.45Å; L227-I236 HydrophobicContact CD2-CD1 4.45Å; L227-I236 HydrophobicContact CG-CD1 4.4Å; F228-I236 HydrophobicContact CD1-CD1 4.13Å; F228-I236 HydrophobicContact CE1-CD1 4.17Å; L231-I236 HydrophobicContact CB-CD1 4.25Å; L231-I236 HydrophobicContact CB-CG1 3.84Å; L231-I236 HydrophobicContact CD1-CG1 4.25Å; T232-I236 PolarHBondContact O-N 2.68Å; E233-I236 PolarHBondContact O-N 3.36Å; I236-Q238 VanDerWaalsContact C-N 3.34Å; I236-Q238 PolarHBondContact O-N 2.97Å; I236-E239 PolarHBondContact O-N 3.15Å; I236-V240 HydrophobicContact CG2-CG2 4.25Å; I236-V240 WeakPolarHBondContact O-CG2 3.41Å; I236-V240 PolarHBondContact O-N 3.11Å; I236-L261 HydrophobicContact CB-CD2 4.43Å; I236-L261 HydrophobicContact CG1-CD2 4.39Å; I236-L261 HydrophobicContact CG2-CD2 4.19Å
237	L	97.8	Very high	91.1	Very high	24 Å²	24	51 Å²	51	13%	0.126	27%	0.27	C	S	.	.	H	α-helix	trans	-63.9	-36.7	178.4	-71.8	175.9	0	0	0	112.8	I166 V171 E233 S234 M235 E239 K241	I166-L237 HydrophobicContact CD1-CD2 3.9Å; I166-L237 HydrophobicContact CG1-CD2 3.95Å; I166-L237 HydrophobicContact CG2-CD2 3.81Å; V171-L237 HydrophobicContact CG2-CD1 4.35Å; V171-L237 HydrophobicContact CG2-CD2 3.99Å; V171-L237 HydrophobicContact CG2-CG 4.35Å; E233-L237 HydrophobicContact CG-CD1 4.22Å; E233-L237 HydrophobicContact CG-CG 4.42Å; E233-L237 WeakPolarHBondContact O-CB 3.46Å; E233-L237 WeakPolarHBondContact O-CG 3.4Å; E233-L237 PolarHBondContact O-N 2.89Å; S234-L237 PolarHBondContact O-N 3.18Å; M235-L237 VanDerWaalsContact C-N 3.34Å; M235-L237 PolarHBondContact O-N 3.29Å; L237-E239 VanDerWaalsContact C-N 3.32Å; L237-K241 VanDerWaalsContact O-CG 3.23Å; L237-K241 WeakPolarHBondContact O-CG 3.43Å; L237-K241 PolarHBondContact O-N 3.43Å; L237-K241 VanDerWaalsContact O-N 3.1Å
238	Q	96.8	Very high	89.6	Confident	127 Å²	127	56.5 Å²	56.5	59%	0.593	30%	0.299	S	S	*	.	H	α-helix	trans	-61.7	-42.6	174.5	-78.4	171.3	-6.8	0	0	111.5	S234 M235 I236	S234-Q238 VanDerWaalsContact O-CG 3.26Å; S234-Q238 WeakPolarHBondContact O-CG 3.47Å; S234-Q238 PolarHBondContact O-N 2.95Å; M235-Q238 WeakPolarHBondContact O-CB 3.47Å; M235-Q238 PolarHBondContact O-N 3.02Å; I236-Q238 VanDerWaalsContact C-N 3.34Å; I236-Q238 PolarHBondContact O-N 2.97Å
239	E	95.9	Very high	88.1	Confident	10 Å²	10	57.1 Å²	57.1	5%	0.047	30%	0.304	C	S	.	.	H	α-helix	trans	-69.1	-44.2	179.2	-172.2	47.5	-124.3	0	0	111.4	M235 I236 L237 K241 T242 R260 L261 Q264	M235-E239 PolarHBondContact O-N 3.34Å; M235-E239 VanDerWaalsContact O-N 3.1Å; I236-E239 PolarHBondContact O-N 3.15Å; L237-E239 VanDerWaalsContact C-N 3.32Å; E239-K241 VanDerWaalsContact C-N 3.26Å; E239-K241 PolarHBondContact O-N 3.29Å; E239-T242 WeakPolarHBondContact O-CB 3.27Å; E239-T242 WeakPolarHBondContact O-CG2 3.43Å; E239-T242 PolarHBondContact O-N 3.35Å; E239-T242 PolarHBondContact O-OG1 3.18Å; E239-T242 PolarHBondContact OE1-OG1 3.47Å; E239-R260 VanDerWaalsContact CD-CB 3.43Å; E239-R260 HydrophobicContact CG-CB 4.14Å; E239-R260 WeakPolarHBondContact OE1-CB 3.25Å; E239-R260 IonicContact OE1-CZ 3.37Å; E239-R260 IonicContact OE1-NE 3.79Å; E239-R260 PolarHBondContact OE1-NE 3.08Å; E239-R260 IonicContact OE1-NH2 2.65Å; E239-R260 PolarHBondContact OE1-NH2 3.4Å; E239-R260 IonicContact OE2-NE 3.34Å; E239-L261 HydrophobicContact CB-CD2 3.7Å; E239-L261 HydrophobicContact CB-CG 4.28Å; E239-L261 HydrophobicContact CG-CD2 3.66Å; E239-L261 HydrophobicContact CG-CG 3.69Å; E239-Q264 PolarHBondContact OE2-NE2 3.08Å
240	V	95	Very high	87	Confident	8 Å²	8	60 Å²	60	5%	0.048	32%	0.322	C	S	.	.	H	α-helix	trans	-62	-31.9	178.5	171	0	0	0	0	112.7	I166 I219 I221 I236 T242 I243	I166-V240 HydrophobicContact CD1-CB 4.29Å; I166-V240 HydrophobicContact CD1-CG1 4.01Å; I166-V240 HydrophobicContact CD1-CG2 3.82Å; I166-V240 HydrophobicContact CG2-CG1 4.31Å; I219-V240 HydrophobicContact CB-CG1 4.44Å; I219-V240 HydrophobicContact CD1-CG1 3.47Å; I219-V240 VanDerWaalsContact CD1-CG1 3.47Å; I219-V240 HydrophobicContact CG2-CG1 4.3Å; I221-V240 HydrophobicContact CD1-CG2 3.62Å; I236-V240 HydrophobicContact CG2-CG2 4.25Å; I236-V240 WeakPolarHBondContact O-CG2 3.41Å; I236-V240 PolarHBondContact O-N 3.11Å; V240-T242 PolarHBondContact O-N 3.08Å; V240-T242 VanDerWaalsContact O-N 3.13Å; V240-I243 HydrophobicContact CG1-CD1 4.32Å; V240-I243 WeakPolarHBondContact O-CB 3.45Å; V240-I243 PolarHBondContact O-N 2.92Å; V240-I243 VanDerWaalsContact O-N 3.09Å
241	K	92.7	Very high	86.5	Confident	147 Å²	147	62.1 Å²	62.1	64%	0.639	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-18.3	175	-78.4	169.9	-176.4	-178.2	0	113.7	L237 E239 I243	L237-K241 VanDerWaalsContact O-CG 3.23Å; L237-K241 WeakPolarHBondContact O-CG 3.43Å; L237-K241 PolarHBondContact O-N 3.43Å; L237-K241 VanDerWaalsContact O-N 3.1Å; E239-K241 VanDerWaalsContact C-N 3.26Å; E239-K241 PolarHBondContact O-N 3.29Å; K241-I243 VanDerWaalsContact C-N 3.28Å
242	T	89.6	Confident	86	Confident	67 Å²	67	65.9 Å²	65.9	41%	0.411	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-8.2	177.7	71.1	0	0	0	0	113.4	E239 V240 E244 R260	E239-T242 WeakPolarHBondContact O-CB 3.27Å; E239-T242 WeakPolarHBondContact O-CG2 3.43Å; E239-T242 PolarHBondContact O-N 3.35Å; E239-T242 PolarHBondContact O-OG1 3.18Å; E239-T242 PolarHBondContact OE1-OG1 3.47Å; V240-T242 PolarHBondContact O-N 3.08Å; V240-T242 VanDerWaalsContact O-N 3.13Å; T242-E244 PolarHBondContact O-N 2.84Å; T242-R260 PolarHBondContact OG1-NH2 3.29Å
243	I	87.5	Confident	85.8	Confident	10 Å²	10	63.9 Å²	63.9	5%	0.051	34%	0.341	C	S	.	.	S	Bend	trans	-70.9	122.8	176.1	-65.1	166.5	0	0	0	108.5	I219 V240 K241 L245 L254 C257 L301	I219-I243 HydrophobicContact CD1-CD1 3.79Å; V240-I243 HydrophobicContact CG1-CD1 4.32Å; V240-I243 WeakPolarHBondContact O-CB 3.45Å; V240-I243 PolarHBondContact O-N 2.92Å; V240-I243 VanDerWaalsContact O-N 3.09Å; K241-I243 VanDerWaalsContact C-N 3.28Å; I243-L245 HydrophobicContact CG2-CD2 4.29Å; I243-L245 PolarHBondContact O-N 2.88Å; I243-L245 VanDerWaalsContact O-N 3.16Å; I243-L254 HydrophobicContact CD1-CD1 3.95Å; I243-C257 HydrophobicContact CD1-CB 3.81Å; I243-C257 VanDerWaalsContact CD1-SG 3.58Å; I243-C257 HydrophobicContact CG1-CB 3.51Å; I243-L301 HydrophobicContact CD1-CD1 4.4Å
244	E	77.3	Confident	85.6	Confident	111 Å²	111	60.3 Å²	60.3	52%	0.519	33%	0.325	S	S	.	.			trans	-67.4	114.1	169.4	-66.9	-179.7	177.4	0	0	107.7	T242 C249 S253	T242-E244 PolarHBondContact O-N 2.84Å; E244-C249 WeakPolarHBondContact O-CA 3.34Å; E244-C249 WeakPolarHBondContact O-CB 3.34Å; E244-C249 PolarHBondContact O-SG 3.01Å; E244-S253 PolarHBondContact N-OG 2.96Å; E244-S253 VanDerWaalsContact N-OG 3.1Å
245	L	74.1	Confident	85.5	Confident	90 Å²	90	61 Å²	61	47%	0.471	32%	0.318	S	S	.	.			trans	-81.4	169.8	178.8	-64.9	175.5	0	0	0	111.2	I219 I243 N248 C249 L303	I219-L245 HydrophobicContact CD1-CD2 4.13Å; I243-L245 HydrophobicContact CG2-CD2 4.29Å; I243-L245 PolarHBondContact O-N 2.88Å; I243-L245 VanDerWaalsContact O-N 3.16Å; L245-N248 PolarHBondContact O-N 2.74Å; L245-C249 PolarHBondContact O-N 2.82Å; L245-L303 HydrophobicContact CD2-CD1 4.06Å
246	L	63.4	Low	85.3	Confident	97 Å²	97	63.9 Å²	63.9	51%	0.508	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	143.7	-178.8	-70.1	172.6	0	0	0	112.3	C249 I305	L246-C249 HydrophobicContact CD2-CB 4.1Å; L246-C249 HydrophobicContact CG-CB 4.44Å; L246-I305 HydrophobicContact CD1-CB 4.45Å; L246-I305 HydrophobicContact CD1-CG2 3.92Å
247	P	65.3	Low	85.2	Confident	117 Å²	117	63.9 Å²	63.9	76%	0.76	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	cis	-85	-6.2	7.7	34.3	-35.8	0	0	0	114.7	C249	P247-C249 VanDerWaalsContact C-N 3.31Å; P247-C249 PolarHBondContact O-N 3Å
248	N	65.5	Low	85.2	Confident	114 Å²	114	62.7 Å²	62.7	61%	0.61	33%	0.325	S	S	*	.	S	Bend	trans	-85.1	-4.7	-171.7	-63.7	-18.7	0	0	0	113.5	L245 T250	L245-N248 PolarHBondContact O-N 2.74Å; N248-T250 PolarHBondContact O-N 3.12Å
249	C	68.2	Low	85.2	Confident	19 Å²	19	59.6 Å²	59.6	13%	0.128	32%	0.315	C	S	.	.			trans	-57.6	112	-179.6	-166.5	0	0	0	0	111.7	E244 L245 L246 P247 L303	E244-C249 WeakPolarHBondContact O-CA 3.34Å; E244-C249 WeakPolarHBondContact O-CB 3.34Å; E244-C249 PolarHBondContact O-SG 3.01Å; L245-C249 PolarHBondContact O-N 2.82Å; L246-C249 HydrophobicContact CD2-CB 4.1Å; L246-C249 HydrophobicContact CG-CB 4.44Å; P247-C249 VanDerWaalsContact C-N 3.31Å; P247-C249 PolarHBondContact O-N 3Å; C249-L303 HydrophobicContact CB-CD2 4.01Å; C249-L303 WeakPolarHBondContact SG-CD2 3.41Å
250	T	73.2	Confident	85.3	Confident	66 Å²	66	62.3 Å²	62.3	41%	0.405	32%	0.324	S	S	.	.			trans	-93.2	145.8	167.4	60	0	0	0	0	108.9	N248 D252 S253 L254	N248-T250 PolarHBondContact O-N 3.12Å; T250-D252 PolarHBondContact O-N 3.39Å; T250-S253 PolarHBondContact O-N 3.48Å; T250-S253 PolarHBondContact OG1-N 2.79Å; T250-L254 PolarHBondContact O-N 3.49Å
251	I	87.2	Confident	85.5	Confident	44 Å²	44	61.9 Å²	61.9	23%	0.226	32%	0.322	C	S	.	.	H	α-helix	trans	-54	-25.8	169.8	-165.3	169.9	0	0	0	111.7	L37 L254 K255	L37-I251 HydrophobicContact CD1-CB 4.13Å; L37-I251 HydrophobicContact CD1-CD1 3.87Å; L37-I251 HydrophobicContact CD1-CG1 3.88Å; L37-I251 HydrophobicContact CD2-CB 4.35Å; L37-I251 HydrophobicContact CG-CG1 4.31Å; I251-L254 PolarHBondContact O-N 3.35Å; I251-K255 VanDerWaalsContact O-CG 3.32Å; I251-K255 WeakPolarHBondContact O-CG 3.5Å; I251-K255 PolarHBondContact O-N 3.31Å
252	D	89.3	Confident	85.7	Confident	82 Å²	82	55.4 Å²	55.4	44%	0.439	29%	0.294	S	S	.	.	H	α-helix	trans	-73.1	-35.7	178.3	-61.8	-32.9	0	0	0	112.7	T250 L254 K255 Q256	T250-D252 PolarHBondContact O-N 3.39Å; D252-L254 VanDerWaalsContact C-N 3.34Å; D252-L254 PolarHBondContact O-N 3.04Å; D252-K255 PolarHBondContact O-N 3.32Å; D252-K255 IonicContact OD1-NZ 3.55Å; D252-K255 PolarHBondContact OD1-NZ 3.27Å; D252-Q256 WeakPolarHBondContact O-CB 3.43Å; D252-Q256 VanDerWaalsContact O-CG 3.23Å; D252-Q256 WeakPolarHBondContact O-CG 3.33Å; D252-Q256 PolarHBondContact O-N 3.15Å
253	S	92.1	Very high	86.1	Confident	9 Å²	9	57.3 Å²	57.3	6%	0.063	30%	0.299	C	S	.	.	H	α-helix	trans	-61.4	-43.4	171.5	-178.3	0	0	0	0	111.2	E244 T250 Q256 C257	E244-S253 PolarHBondContact N-OG 2.96Å; E244-S253 VanDerWaalsContact N-OG 3.1Å; T250-S253 PolarHBondContact O-N 3.48Å; T250-S253 PolarHBondContact OG1-N 2.79Å; S253-Q256 PolarHBondContact O-N 2.74Å; S253-C257 PolarHBondContact O-N 2.99Å
254	L	93.9	Very high	86.6	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-63.5	-43.7	176.1	-165.6	69.5	0	0	0	112	L37 A39 I243 T250 I251 D252 C257 A258 L301 L303	L37-L254 HydrophobicContact CG-CD2 4.2Å; L37-L254 WeakPolarHBondContact O-CD2 3.35Å; A39-L254 HydrophobicContact CB-CB 4.18Å; A39-L254 HydrophobicContact CB-CD2 3.91Å; A39-L254 HydrophobicContact CB-CG 3.73Å; I243-L254 HydrophobicContact CD1-CD1 3.95Å; T250-L254 PolarHBondContact O-N 3.49Å; I251-L254 PolarHBondContact O-N 3.35Å; D252-L254 VanDerWaalsContact C-N 3.34Å; D252-L254 PolarHBondContact O-N 3.04Å; L254-C257 PolarHBondContact O-N 3.23Å; L254-A258 PolarHBondContact O-N 3.07Å; L254-L301 HydrophobicContact CD1-CB 3.75Å; L254-L301 HydrophobicContact CD1-CD1 3.95Å; L254-L301 HydrophobicContact CD2-CB 4.39Å; L254-L301 HydrophobicContact CG-CB 3.97Å; L254-L301 HydrophobicContact CG-CD1 4.37Å; L254-L303 HydrophobicContact CD1-CB 4.41Å; L254-L303 HydrophobicContact CD2-CB 4.49Å
255	K	94.3	Very high	87.6	Confident	92 Å²	92	54.8 Å²	54.8	40%	0.4	29%	0.287	S	S	.	.	H	α-helix	trans	-61.1	-45.8	175.1	-73.9	170.2	-174.3	164.4	0	112.2	A39 I251 D252 C257 A258 T259	A39-K255 HydrophobicContact CB-CB 4.4Å; A39-K255 HydrophobicContact CB-CG 3.89Å; I251-K255 VanDerWaalsContact O-CG 3.32Å; I251-K255 WeakPolarHBondContact O-CG 3.5Å; I251-K255 PolarHBondContact O-N 3.31Å; D252-K255 PolarHBondContact O-N 3.32Å; D252-K255 IonicContact OD1-NZ 3.55Å; D252-K255 PolarHBondContact OD1-NZ 3.27Å; K255-C257 VanDerWaalsContact C-N 3.33Å; K255-C257 PolarHBondContact O-N 2.89Å; K255-A258 PolarHBondContact O-N 3.19Å; K255-T259 PolarHBondContact O-N 3.35Å; K255-T259 PolarHBondContact O-OG1 3.45Å
256	Q	94.7	Very high	88.7	Confident	107 Å²	107	56 Å²	56	50%	0.5	29%	0.285	S	S	.	.	H	α-helix	trans	-62.3	-41.5	179	-73.3	175.7	42.6	0	0	111.7	D252 S253 T259 R260	D252-Q256 WeakPolarHBondContact O-CB 3.43Å; D252-Q256 VanDerWaalsContact O-CG 3.23Å; D252-Q256 WeakPolarHBondContact O-CG 3.33Å; D252-Q256 PolarHBondContact O-N 3.15Å; S253-Q256 PolarHBondContact O-N 2.74Å; Q256-T259 PolarHBondContact O-N 3.13Å; Q256-R260 WeakPolarHBondContact O-CG 3.39Å; Q256-R260 PolarHBondContact O-N 3.12Å
257	C	96.4	Very high	90.3	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-61.8	-45.3	174.1	178	0	0	0	0	111.6	I243 S253 L254 K255 T259 R260 L261 L301	I243-C257 HydrophobicContact CD1-CB 3.81Å; I243-C257 VanDerWaalsContact CD1-SG 3.58Å; I243-C257 HydrophobicContact CG1-CB 3.51Å; S253-C257 PolarHBondContact O-N 2.99Å; L254-C257 PolarHBondContact O-N 3.23Å; K255-C257 VanDerWaalsContact C-N 3.33Å; K255-C257 PolarHBondContact O-N 2.89Å; C257-T259 VanDerWaalsContact C-N 3.31Å; C257-T259 PolarHBondContact O-N 3.09Å; C257-R260 PolarHBondContact O-N 3.13Å; C257-L261 WeakPolarHBondContact O-CG 3.34Å; C257-L261 PolarHBondContact O-N 3.29Å; C257-L301 HydrophobicContact CB-CD1 3.92Å
258	A	97.2	Very high	91.8	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-58.1	-43.9	176.3	0	0	0	0	0	111.6	A39 A41 L254 K255 L261 V262 L301	A39-A258 HydrophobicContact CB-CB 4.26Å; A41-A258 VanDerWaalsContact CB-C 3.46Å; A41-A258 HydrophobicContact CB-CB 3.76Å; A41-A258 WeakPolarHBondContact CB-O 3.32Å; L254-A258 PolarHBondContact O-N 3.07Å; K255-A258 PolarHBondContact O-N 3.19Å; A258-L261 PolarHBondContact O-N 3.19Å; A258-V262 WeakPolarHBondContact O-CG2 3.3Å; A258-V262 PolarHBondContact O-N 3.1Å; A258-L301 HydrophobicContact CB-CD1 3.76Å; A258-L301 HydrophobicContact CB-CG 4Å
259	T	97.1	Very high	93.3	Very high	62 Å²	62	45 Å²	45	38%	0.38	23%	0.229	S	C	.	.	H	α-helix	trans	-62.3	-46.6	175.6	-62	0	0	0	0	112	K255 Q256 C257 L261 V262 E263	K255-T259 PolarHBondContact O-N 3.35Å; K255-T259 PolarHBondContact O-OG1 3.45Å; Q256-T259 PolarHBondContact O-N 3.13Å; C257-T259 VanDerWaalsContact C-N 3.31Å; C257-T259 PolarHBondContact O-N 3.09Å; T259-L261 PolarHBondContact O-N 2.64Å; T259-V262 PolarHBondContact O-N 2.96Å; T259-E263 HydrophobicContact CG2-CG 4.32Å; T259-E263 WeakPolarHBondContact CG2-OE1 3.48Å; T259-E263 WeakPolarHBondContact O-CG 3.06Å; T259-E263 PolarHBondContact O-N 3.44Å
260	R	97.6	Very high	94.5	Very high	66 Å²	66	49.4 Å²	49.4	25%	0.249	25%	0.246	C	C	.	.	H	α-helix	trans	-65.5	-36.4	179.6	-73.4	-169.2	-59.8	-96.9	-5.7	112.8	E239 T242 Q256 C257 V262 E263 Q264	E239-R260 VanDerWaalsContact CD-CB 3.43Å; E239-R260 HydrophobicContact CG-CB 4.14Å; E239-R260 WeakPolarHBondContact OE1-CB 3.25Å; E239-R260 IonicContact OE1-CZ 3.37Å; E239-R260 IonicContact OE1-NE 3.79Å; E239-R260 PolarHBondContact OE1-NE 3.08Å; E239-R260 IonicContact OE1-NH2 2.65Å; E239-R260 PolarHBondContact OE1-NH2 3.4Å; E239-R260 IonicContact OE2-NE 3.34Å; T242-R260 PolarHBondContact OG1-NH2 3.29Å; Q256-R260 WeakPolarHBondContact O-CG 3.39Å; Q256-R260 PolarHBondContact O-N 3.12Å; C257-R260 PolarHBondContact O-N 3.13Å; R260-V262 VanDerWaalsContact C-N 3.34Å; R260-V262 PolarHBondContact O-N 2.92Å; R260-E263 PolarHBondContact O-N 3.09Å; R260-Q264 WeakPolarHBondContact O-CB 3.33Å; R260-Q264 VanDerWaalsContact O-CG 3.32Å; R260-Q264 WeakPolarHBondContact O-CG 3.45Å; R260-Q264 PolarHBondContact O-N 3.4Å
261	L	98.4	Very high	95.6	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-58.4	-46.8	171.8	-76.4	171.1	0	0	0	111.3	I221 L227 L231 I236 E239 C257 A258 T259 A265 V299 L301	I221-L261 HydrophobicContact CD1-CD1 4.36Å; L227-L261 HydrophobicContact CD1-CB 4.39Å; L231-L261 HydrophobicContact CD1-CD2 4.25Å; I236-L261 HydrophobicContact CB-CD2 4.43Å; I236-L261 HydrophobicContact CG1-CD2 4.39Å; I236-L261 HydrophobicContact CG2-CD2 4.19Å; E239-L261 HydrophobicContact CB-CD2 3.7Å; E239-L261 HydrophobicContact CB-CG 4.28Å; E239-L261 HydrophobicContact CG-CD2 3.66Å; E239-L261 HydrophobicContact CG-CG 3.69Å; C257-L261 WeakPolarHBondContact O-CG 3.34Å; C257-L261 PolarHBondContact O-N 3.29Å; A258-L261 PolarHBondContact O-N 3.19Å; T259-L261 PolarHBondContact O-N 2.64Å; L261-A265 VanDerWaalsContact O-CB 3.26Å; L261-A265 WeakPolarHBondContact O-CB 3.44Å; L261-A265 PolarHBondContact O-N 3.28Å; L261-V299 HydrophobicContact CD1-CG1 4.09Å; L261-L301 HydrophobicContact CD1-CD1 4.28Å; L261-L301 HydrophobicContact CD1-CD2 3.89Å; L261-L301 HydrophobicContact CD1-CG 4.46Å
262	V	98.2	Very high	95.8	Very high	10 Å²	10	50.4 Å²	50.4	6%	0.061	26%	0.259	C	S	.	.	H	α-helix	trans	-64.4	-43.2	177.2	171.9	0	0	0	0	111.5	A41 A258 T259 R260 A265 R266 I297 V299	A41-V262 HydrophobicContact CB-CG2 3.74Å; A258-V262 WeakPolarHBondContact O-CG2 3.3Å; A258-V262 PolarHBondContact O-N 3.1Å; T259-V262 PolarHBondContact O-N 2.96Å; R260-V262 VanDerWaalsContact C-N 3.34Å; R260-V262 PolarHBondContact O-N 2.92Å; V262-A265 PolarHBondContact O-N 3.06Å; V262-R266 VanDerWaalsContact O-CB 3.3Å; V262-R266 WeakPolarHBondContact O-CB 3.43Å; V262-R266 PolarHBondContact O-N 2.94Å; V262-I297 HydrophobicContact CG1-CB 4.43Å; V262-I297 HydrophobicContact CG1-CG2 4.34Å; V262-I297 HydrophobicContact CG2-CG2 4.17Å; V262-V299 HydrophobicContact CG2-CB 4.16Å; V262-V299 HydrophobicContact CG2-CG2 3.74Å
263	E	97.6	Very high	95.8	Very high	107 Å²	107	53.1 Å²	53.1	50%	0.5	27%	0.274	S	S	.	.	H	α-helix	trans	-65.5	-41.1	179	-72.9	173.5	169	0	0	112.7	T259 R260 S267	T259-E263 HydrophobicContact CG2-CG 4.32Å; T259-E263 WeakPolarHBondContact CG2-OE1 3.48Å; T259-E263 WeakPolarHBondContact O-CG 3.06Å; T259-E263 PolarHBondContact O-N 3.44Å; R260-E263 PolarHBondContact O-N 3.09Å; E263-S267 WeakPolarHBondContact O-CB 3.17Å; E263-S267 PolarHBondContact O-N 3.44Å; E263-S267 PolarHBondContact O-OG 3Å
264	Q	97.8	Very high	95.9	Very high	69 Å²	69	55.1 Å²	55.1	32%	0.322	28%	0.282	S	S	.	.	H	α-helix	trans	-66.3	-45.7	174.9	-75.5	179.4	4.9	0	0	111.1	L231 E239 R260 R266 S267 A268	L231-Q264 HydrophobicContact CD1-CB 4.14Å; L231-Q264 HydrophobicContact CD2-CB 4.06Å; E239-Q264 PolarHBondContact OE2-NE2 3.08Å; R260-Q264 WeakPolarHBondContact O-CB 3.33Å; R260-Q264 VanDerWaalsContact O-CG 3.32Å; R260-Q264 WeakPolarHBondContact O-CG 3.45Å; R260-Q264 PolarHBondContact O-N 3.4Å; Q264-R266 VanDerWaalsContact C-N 3.32Å; Q264-R266 PolarHBondContact O-N 3.17Å; Q264-S267 PolarHBondContact O-N 2.96Å; Q264-A268 WeakPolarHBondContact O-CB 3.35Å; Q264-A268 PolarHBondContact O-N 3.44Å
265	A	98.2	Very high	95.9	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-59.6	-44.6	176.9	0	0	0	0	0	111.1	L227 N230 L231 L261 V262 A268 A269 I297	L227-A265 HydrophobicContact CD1-CB 4.2Å; N230-A265 HydrophobicContact CB-CB 4.31Å; N230-A265 WeakPolarHBondContact CB-O 3.45Å; L231-A265 HydrophobicContact CD1-CB 4Å; L231-A265 HydrophobicContact CD2-CB 4.42Å; L231-A265 HydrophobicContact CG-CB 3.86Å; L261-A265 VanDerWaalsContact O-CB 3.26Å; L261-A265 WeakPolarHBondContact O-CB 3.44Å; L261-A265 PolarHBondContact O-N 3.28Å; V262-A265 PolarHBondContact O-N 3.06Å; A265-A268 PolarHBondContact O-N 2.87Å; A265-A269 WeakPolarHBondContact O-CB 3.36Å; A265-A269 PolarHBondContact O-N 2.96Å; A265-I297 HydrophobicContact CB-CD1 3.92Å; A265-I297 HydrophobicContact CB-CG2 4.23Å
266	R	96.9	Very high	96	Very high	114 Å²	114	53.8 Å²	53.8	43%	0.43	28%	0.281	S	S	.	.	H	α-helix	trans	-60.8	-46.4	173.7	-179.9	-175.9	169.3	-179.6	-2	111.8	Y43 V262 Q264 A268 A269 F270 I297	Y43-R266 HydrophobicContact CD1-CG 4.35Å; Y43-R266 HydrophobicContact CE1-CG 4.14Å; V262-R266 VanDerWaalsContact O-CB 3.3Å; V262-R266 WeakPolarHBondContact O-CB 3.43Å; V262-R266 PolarHBondContact O-N 2.94Å; Q264-R266 VanDerWaalsContact C-N 3.32Å; Q264-R266 PolarHBondContact O-N 3.17Å; R266-A268 VanDerWaalsContact C-N 3.31Å; R266-A268 PolarHBondContact O-N 3.42Å; R266-A269 WeakPolarHBondContact O-CB 3.25Å; R266-A269 PolarHBondContact O-N 3Å; R266-F270 HydrophobicContact CG-CD2 4.14Å; R266-F270 HydrophobicContact CG-CE2 4.1Å; R266-F270 VanDerWaalsContact O-CD2 3.3Å; R266-F270 WeakPolarHBondContact O-CD2 3.37Å; R266-F270 PolarHBondContact O-N 3.11Å; R266-I297 HydrophobicContact CB-CD1 3.92Å
267	S	97	Very high	96.1	Very high	83 Å²	83	50.1 Å²	50.1	58%	0.58	27%	0.266	S	S	*	.	H	α-helix	trans	-62.2	-41.8	-179.4	-59.9	0	0	0	0	111.2	E263 Q264 F270 A271	E263-S267 WeakPolarHBondContact O-CB 3.17Å; E263-S267 PolarHBondContact O-N 3.44Å; E263-S267 PolarHBondContact O-OG 3Å; Q264-S267 PolarHBondContact O-N 2.96Å; S267-F270 PolarHBondContact O-N 2.97Å; S267-A271 PolarHBondContact O-N 3.08Å
268	A	97.2	Very high	96.1	Very high	9 Å²	9	51.1 Å²	51.1	7%	0.074	27%	0.271	C	S	.	.	H	α-helix	trans	-64.8	-38	174	0	0	0	0	0	112.6	N230 L231 Q264 A265 R266 F270 A271 F274 G292	N230-A268 HydrophobicContact CB-CB 4.25Å; N230-A268 WeakPolarHBondContact O-CB 3.33Å; L231-A268 HydrophobicContact CD2-CB 4.22Å; Q264-A268 WeakPolarHBondContact O-CB 3.35Å; Q264-A268 PolarHBondContact O-N 3.44Å; A265-A268 PolarHBondContact O-N 2.87Å; R266-A268 VanDerWaalsContact C-N 3.31Å; R266-A268 PolarHBondContact O-N 3.42Å; A268-F270 PolarHBondContact O-N 3.26Å; A268-A271 PolarHBondContact O-N 3.37Å; A268-F274 HydrophobicContact CB-CD1 3.84Å; A268-F274 HydrophobicContact CB-CE1 3.72Å; A268-F274 HydrophobicContact CB-CZ 4.47Å; A268-G292 PolarHBondContact O-N 3.33Å
269	A	96.4	Very high	96.1	Very high	5 Å²	5	51.1 Å²	51.1	4%	0.041	27%	0.271	C	S	.	.	H	α-helix	trans	-58	-34.9	177	0	0	0	0	0	113.3	N230 A265 R266 G292 V293	N230-A269 WeakPolarHBondContact OD1-CA 3.09Å; A265-A269 WeakPolarHBondContact O-CB 3.36Å; A265-A269 PolarHBondContact O-N 2.96Å; R266-A269 WeakPolarHBondContact O-CB 3.25Å; R266-A269 PolarHBondContact O-N 3Å; A269-G292 CarbonylContact O-C 3.54Å; A269-V293 WeakPolarHBondContact CB-O 3.35Å
270	F	94.8	Very high	96.1	Very high	112 Å²	112	50.3 Å²	50.3	49%	0.491	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	0.9	180	-70.1	-78.6	0	0	0	114.1	R266 S267 A268 P272 P294	R266-F270 HydrophobicContact CG-CD2 4.14Å; R266-F270 HydrophobicContact CG-CE2 4.1Å; R266-F270 VanDerWaalsContact O-CD2 3.3Å; R266-F270 WeakPolarHBondContact O-CD2 3.37Å; R266-F270 PolarHBondContact O-N 3.11Å; S267-F270 PolarHBondContact O-N 2.97Å; A268-F270 PolarHBondContact O-N 3.26Å; F270-P272 WeakPolarHBondContact O-CD 3.37Å; F270-P294 HydrophobicContact CD1-CG 4.23Å; F270-P294 HydrophobicContact CE1-CB 3.97Å; F270-P294 HydrophobicContact CE1-CG 4.03Å; F270-P294 HydrophobicContact CZ-CB 3.94Å; F270-P294 HydrophobicContact CZ-CG 4.43Å
271	A	95.3	Very high	96	Very high	34 Å²	34	49.1 Å²	49.1	28%	0.281	27%	0.265	S	S	.	.			trans	-81.7	113.4	178.3	0	0	0	0	0	110.1	S267 A268 D273 F274 G291	S267-A271 PolarHBondContact O-N 3.08Å; A268-A271 PolarHBondContact O-N 3.37Å; A271-D273 PolarHBondContact O-N 3.25Å; A271-F274 HydrophobicContact CB-CB 3.66Å; A271-F274 PolarHBondContact O-N 2.89Å; A271-G291 WeakPolarHBondContact O-CA 3.33Å
272	P	90.7	Very high	95.8	Very high	97 Å²	97	49.1 Å²	49.1	63%	0.63	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-34.2	-168.2	25.1	-34.4	0	0	0	114.3	F270 A290 G291	F270-P272 WeakPolarHBondContact O-CD 3.37Å; P272-A290 CarbonylContact O-C 3.58Å; P272-G291 WeakPolarHBondContact O-CA 3.18Å; P272-G291 PolarHBondContact O-N 3.29Å; P272-G291 VanDerWaalsContact O-N 3.16Å
273	D	90.9	Very high	95.7	Very high	139 Å²	139	53.6 Å²	53.6	74%	0.743	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	4.3	-175.5	-57.6	-47.3	0	0	0	112.9	A271 V275	A271-D273 PolarHBondContact O-N 3.25Å; D273-V275 PolarHBondContact O-N 3.07Å
274	F	92.8	Very high	95.5	Very high	52 Å²	52	58.8 Å²	58.8	23%	0.228	30%	0.296	C	S	.	.			trans	-70.9	128.9	-178.7	177.3	-118.1	0	0	0	110.7	N230 M235 A268 A271 S276 G291	N230-F274 WeakPolarHBondContact O-CE1 3.44Å; M235-F274 HydrophobicContact CE-CE2 4.42Å; M235-F274 HydrophobicContact CE-CZ 4.06Å; M235-F274 HydrophobicContact SD-CE2 4.32Å; M235-F274 HydrophobicContact SD-CZ 3.82Å; A268-F274 HydrophobicContact CB-CD1 3.84Å; A268-F274 HydrophobicContact CB-CE1 3.72Å; A268-F274 HydrophobicContact CB-CZ 4.47Å; A271-F274 HydrophobicContact CB-CB 3.66Å; A271-F274 PolarHBondContact O-N 2.89Å; F274-S276 VanDerWaalsContact CE1-CA 3.41Å; F274-S276 PolarHBondContact O-N 2.74Å; F274-G291 CarbonylContact O-C 3.51Å; F274-G291 WeakPolarHBondContact O-CA 3.04Å; F274-G291 PolarHBondContact O-N 3.2Å
275	V	93.7	Very high	95.3	Very high	63 Å²	63	61.7 Å²	61.7	38%	0.382	31%	0.305	S	S	.	.			trans	-82.3	78.7	174.2	-172.8	0	0	0	0	108.4	D273 S280	D273-V275 PolarHBondContact O-N 3.07Å; V275-S280 WeakPolarHBondContact CG1-OG 3.3Å
276	S	96.8	Very high	95.2	Very high	0 Å²	0	65 Å²	65	0%	0	34%	0.339	C	S	.	.			trans	-63.5	158.6	178.3	68.3	0	0	0	0	112.1	D229 F274 F278 A279 S280 G291	D229-S276 WeakPolarHBondContact O-CB 3.29Å; F274-S276 VanDerWaalsContact CE1-CA 3.41Å; F274-S276 PolarHBondContact O-N 2.74Å; S276-F278 PolarHBondContact O-N 3.24Å; S276-A279 PolarHBondContact O-N 3.03Å; S276-A279 WeakPolarHBondContact OG-CB 3.39Å; S276-A279 PolarHBondContact OG-N 2.83Å; S276-S280 WeakPolarHBondContact O-CB 3.49Å; S276-S280 PolarHBondContact O-N 2.81Å; S276-S280 PolarHBondContact O-OG 3.49Å; S276-G291 WeakPolarHBondContact CB-O 3.24Å; S276-G291 PolarHBondContact OG-O 3.39Å
277	P	97.2	Very high	95	Very high	31 Å²	31	63 Å²	63	20%	0.201	34%	0.336	C	S	.	.	H	α-helix	trans	-47.6	-44.5	165.9	-27.7	31.4	0	0	0	113	F228 D229 L231 T232 S280 E281	F228-P277 WeakPolarHBondContact O-CB 3.08Å; F228-P277 WeakPolarHBondContact O-CG 3.46Å; D229-P277 WeakPolarHBondContact O-CD 3.38Å; L231-P277 VanDerWaalsContact C-CG 3.47Å; L231-P277 WeakPolarHBondContact O-CG 3.49Å; T232-P277 HydrophobicContact CG2-CG 4.17Å; P277-S280 WeakPolarHBondContact O-CB 3.43Å; P277-S280 PolarHBondContact O-N 2.75Å; P277-E281 PolarHBondContact O-N 3.36Å
278	F	96.9	Very high	94.8	Very high	20 Å²	20	65.8 Å²	65.8	9%	0.088	34%	0.344	C	S	.	.	H	α-helix	trans	-61.2	-48.9	176.3	-179	-94.2	0	0	0	112.7	F182 N183 D229 S276 S280 E281 A282 I289 V293	F182-F278 HydrophobicContact CE1-CE1 4.16Å; F182-F278 HydrophobicContact CE1-CE2 4.24Å; F182-F278 AromaticContact CE1-CZ 3.72Å; F182-F278 HydrophobicContact CE1-CZ 3.72Å; F182-F278 HydrophobicContact CE2-CD2 4.3Å; F182-F278 HydrophobicContact CE2-CE2 4.06Å; F182-F278 HydrophobicContact CE2-CZ 4.26Å; F182-F278 HydrophobicContact CZ-CD1 4.1Å; F182-F278 HydrophobicContact CZ-CD2 4.05Å; F182-F278 AromaticContact CZ-CE1 3.6Å; F182-F278 HydrophobicContact CZ-CE1 3.6Å; F182-F278 AromaticContact CZ-CE2 3.54Å; F182-F278 HydrophobicContact CZ-CE2 3.54Å; F182-F278 HydrophobicContact CZ-CG 4.32Å; F182-F278 AromaticContact CZ-CZ 3.3Å; F182-F278 HydrophobicContact CZ-CZ 3.3Å; N183-F278 HydrophobicContact CB-CE2 4.03Å; N183-F278 HydrophobicContact CB-CZ 4.24Å; D229-F278 HydrophobicContact CB-CB 3.93Å; D229-F278 PolarHBondContact O-N 2.74Å; D229-F278 WeakPolarHBondContact OD2-CD2 3.3Å; S276-F278 PolarHBondContact O-N 3.24Å; F278-S280 VanDerWaalsContact C-N 3.27Å; F278-S280 PolarHBondContact O-N 3.23Å; F278-E281 PolarHBondContact O-N 3.39Å; F278-E281 VanDerWaalsContact O-N 3.16Å; F278-A282 WeakPolarHBondContact O-CB 3.5Å; F278-A282 PolarHBondContact O-N 3.03Å; F278-I289 HydrophobicContact CD1-CD1 3.79Å; F278-I289 HydrophobicContact CE1-CD1 3.51Å; F278-V293 HydrophobicContact CB-CG2 3.66Å; F278-V293 HydrophobicContact CD1-CG2 3.24Å; F278-V293 HydrophobicContact CD2-CG2 3.69Å; F278-V293 HydrophobicContact CE1-CG2 3.66Å; F278-V293 HydrophobicContact CE2-CG2 4.07Å; F278-V293 HydrophobicContact CG-CG2 3.25Å; F278-V293 HydrophobicContact CZ-CG2 4.05Å
279	A	96.5	Very high	94.5	Very high	0 Å²	0	67.9 Å²	67.9	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-62.6	-36.1	177.7	0	0	0	0	0	111.9	S276 A282 R283 I289	S276-A279 PolarHBondContact O-N 3.03Å; S276-A279 WeakPolarHBondContact OG-CB 3.39Å; S276-A279 PolarHBondContact OG-N 2.83Å; A279-A282 PolarHBondContact O-N 3.34Å; A279-R283 WeakPolarHBondContact O-CG 3.5Å; A279-R283 PolarHBondContact O-N 3.31Å; A279-R283 VanDerWaalsContact O-N 3.16Å; A279-I289 HydrophobicContact CB-CG1 4.2Å
280	S	96.4	Very high	94.2	Very high	45 Å²	45	69.5 Å²	69.5	32%	0.315	37%	0.367	S	S	.	.	H	α-helix	trans	-64.8	-40.6	174.7	-59.1	0	0	0	0	111.9	V275 S276 P277 F278	V275-S280 WeakPolarHBondContact CG1-OG 3.3Å; S276-S280 WeakPolarHBondContact O-CB 3.49Å; S276-S280 PolarHBondContact O-N 2.81Å; S276-S280 PolarHBondContact O-OG 3.49Å; P277-S280 WeakPolarHBondContact O-CB 3.43Å; P277-S280 PolarHBondContact O-N 2.75Å; F278-S280 VanDerWaalsContact C-N 3.27Å; F278-S280 PolarHBondContact O-N 3.23Å
281	E	95.6	Very high	94	Very high	41 Å²	41	64.5 Å²	64.5	19%	0.192	35%	0.347	C	S	.	.	H	α-helix	trans	-65.8	-47.4	173.8	-172.3	-175.4	160.7	0	0	111.1	K179 F182 P277 F278 R283 R284 Y285	K179-E281 WeakPolarHBondContact CD-OE1 3.43Å; K179-E281 VanDerWaalsContact NZ-CD 3.31Å; K179-E281 IonicContact NZ-OE1 3.25Å; K179-E281 PolarHBondContact NZ-OE1 2.71Å; K179-E281 VanDerWaalsContact NZ-OE1 3.12Å; K179-E281 IonicContact NZ-OE2 2.71Å; K179-E281 PolarHBondContact NZ-OE2 2.86Å; F182-E281 HydrophobicContact CD2-CG 3.94Å; F182-E281 HydrophobicContact CE2-CB 4.06Å; F182-E281 HydrophobicContact CE2-CG 3.98Å; P277-E281 PolarHBondContact O-N 3.36Å; F278-E281 PolarHBondContact O-N 3.39Å; F278-E281 VanDerWaalsContact O-N 3.16Å; E281-R283 PolarHBondContact O-N 3.38Å; E281-R284 WeakPolarHBondContact O-CA 3.41Å; E281-R284 VanDerWaalsContact O-CB 3.27Å; E281-R284 WeakPolarHBondContact O-CB 3.28Å; E281-R284 PolarHBondContact O-N 3.18Å; E281-Y285 HydrophobicContact CG-CD2 4.4Å; E281-Y285 HydrophobicContact CG-CE2 4.06Å; E281-Y285 WeakPolarHBondContact O-CD2 3.35Å; E281-Y285 PolarHBondContact O-N 3.28Å
282	A	95.6	Very high	93.9	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-52.6	-42.5	179.2	0	0	0	0	0	112.5	F182 F278 A279 R284 Y285 G286 I287 I289	F182-A282 HydrophobicContact CE1-CB 3.84Å; F182-A282 VanDerWaalsContact CE2-CA 3.44Å; F182-A282 HydrophobicContact CE2-CB 3.75Å; F182-A282 HydrophobicContact CZ-CB 3.3Å; F278-A282 WeakPolarHBondContact O-CB 3.5Å; F278-A282 PolarHBondContact O-N 3.03Å; A279-A282 PolarHBondContact O-N 3.34Å; A282-R284 VanDerWaalsContact C-N 3.26Å; A282-R284 PolarHBondContact O-N 3.42Å; A282-Y285 CarbonylContact O-C 3.57Å; A282-Y285 WeakPolarHBondContact O-CA 3.41Å; A282-Y285 WeakPolarHBondContact O-CB 3.49Å; A282-Y285 PolarHBondContact O-N 3.12Å; A282-G286 PolarHBondContact O-N 3.22Å; A282-I287 CarbonylContact C-O 3.36Å; A282-I287 VanDerWaalsContact C-O 3.28Å; A282-I287 HydrophobicContact CB-CB 4.13Å; A282-I287 HydrophobicContact CB-CG2 4.41Å; A282-I287 WeakPolarHBondContact O-CB 3.41Å; A282-I287 PolarHBondContact O-N 3.05Å; A282-I289 HydrophobicContact CB-CD1 3.5Å; A282-I289 HydrophobicContact CB-CG1 3.54Å
283	R	95.3	Very high	94	Very high	105 Å²	105	60.8 Å²	60.8	40%	0.396	32%	0.322	S	S	.	.	H	α-helix	trans	-62.1	-31.7	177.6	-72.2	172.8	-169.2	178.3	3.5	112.8	A279 E281 Y285 G286 I287 I289	A279-R283 WeakPolarHBondContact O-CG 3.5Å; A279-R283 PolarHBondContact O-N 3.31Å; A279-R283 VanDerWaalsContact O-N 3.16Å; E281-R283 PolarHBondContact O-N 3.38Å; R283-Y285 PolarHBondContact O-N 2.99Å; R283-G286 PolarHBondContact O-N 3.16Å; R283-I287 WeakPolarHBondContact CA-O 3.09Å; R283-I287 PolarHBondContact N-O 3.01Å; R283-I289 PolarHBondContact NE-O 3.01Å; R283-I289 PolarHBondContact NH2-O 3.1Å; R283-I289 VanDerWaalsContact NH2-O 3.13Å
284	R	94.4	Very high	94.2	Very high	215 Å²	215	57.2 Å²	57.2	81%	0.811	31%	0.307	S	S	*	.	H	α-helix	trans	-67.3	-23	174.3	-60.9	176.3	178.4	176.2	-0.8	112.4	E281 A282	E281-R284 WeakPolarHBondContact O-CA 3.41Å; E281-R284 VanDerWaalsContact O-CB 3.27Å; E281-R284 WeakPolarHBondContact O-CB 3.28Å; E281-R284 PolarHBondContact O-N 3.18Å; A282-R284 VanDerWaalsContact C-N 3.26Å; A282-R284 PolarHBondContact O-N 3.42Å
285	Y	93.6	Very high	94.2	Very high	131 Å²	131	55.8 Å²	55.8	51%	0.514	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	10.2	172.2	-70.2	-91.9	0	0	0	113.1	F182 E281 A282 R283 I287	F182-Y285 HydrophobicContact CB-CD1 3.96Å; F182-Y285 HydrophobicContact CB-CD2 3.72Å; F182-Y285 HydrophobicContact CB-CE1 4.2Å; F182-Y285 HydrophobicContact CB-CE2 3.97Å; F182-Y285 HydrophobicContact CB-CG 3.72Å; F182-Y285 AromaticContact CD2-CD2 3.79Å; F182-Y285 HydrophobicContact CD2-CD2 3.79Å; F182-Y285 HydrophobicContact CD2-CE2 4.09Å; F182-Y285 HydrophobicContact CD2-CG 4.5Å; F182-Y285 HydrophobicContact CG-CD2 4.02Å; F182-Y285 HydrophobicContact CG-CE2 4.47Å; F182-Y285 HydrophobicContact CG-CG 4.29Å; E281-Y285 HydrophobicContact CG-CD2 4.4Å; E281-Y285 HydrophobicContact CG-CE2 4.06Å; E281-Y285 WeakPolarHBondContact O-CD2 3.35Å; E281-Y285 PolarHBondContact O-N 3.28Å; A282-Y285 CarbonylContact O-C 3.57Å; A282-Y285 WeakPolarHBondContact O-CA 3.41Å; A282-Y285 WeakPolarHBondContact O-CB 3.49Å; A282-Y285 PolarHBondContact O-N 3.12Å; R283-Y285 PolarHBondContact O-N 2.99Å; Y285-I287 VanDerWaalsContact C-N 3.31Å; Y285-I287 PolarHBondContact O-N 3.16Å
286	G	95.3	Very high	94.4	Very high	70 Å²	70	53 Å²	53	72%	0.722	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.9	11.5	-179.6	0	0	0	0	0	114.5	A282 R283	A282-G286 PolarHBondContact O-N 3.22Å; R283-G286 PolarHBondContact O-N 3.16Å
287	I	93.5	Very high	94.4	Very high	71 Å²	71	53.1 Å²	53.1	36%	0.364	29%	0.29	S	S	.	.			trans	-96.4	108.7	179.5	-54.4	169.8	0	0	0	108.5	F182 A282 R283 Y285 I289	F182-I287 HydrophobicContact CD1-CD1 3.55Å; F182-I287 HydrophobicContact CE1-CD1 3.96Å; F182-I287 HydrophobicContact CG-CD1 4.33Å; A282-I287 CarbonylContact C-O 3.36Å; A282-I287 VanDerWaalsContact C-O 3.28Å; A282-I287 HydrophobicContact CB-CB 4.13Å; A282-I287 HydrophobicContact CB-CG2 4.41Å; A282-I287 WeakPolarHBondContact O-CB 3.41Å; A282-I287 PolarHBondContact O-N 3.05Å; R283-I287 WeakPolarHBondContact CA-O 3.09Å; R283-I287 PolarHBondContact N-O 3.01Å; Y285-I287 VanDerWaalsContact C-N 3.31Å; Y285-I287 PolarHBondContact O-N 3.16Å; I287-I289 HydrophobicContact CG2-CG2 3.84Å; I287-I289 PolarHBondContact O-N 3.35Å; I287-I289 VanDerWaalsContact O-N 3.15Å
288	N	92.2	Very high	94.5	Very high	142 Å²	142	51.6 Å²	51.6	76%	0.759	28%	0.28	S	S	*	.			trans	-85.5	87.8	-179.4	-169.6	26	0	0	0	111.4
289	I	90.9	Very high	94.5	Very high	52 Å²	52	50.7 Å²	50.7	27%	0.267	28%	0.276	S	S	.	.			trans	-117.5	159.2	172.9	59.6	172.9	0	0	0	111.2	F278 A279 A282 R283 I287	F278-I289 HydrophobicContact CD1-CD1 3.79Å; F278-I289 HydrophobicContact CE1-CD1 3.51Å; A279-I289 HydrophobicContact CB-CG1 4.2Å; A282-I289 HydrophobicContact CB-CD1 3.5Å; A282-I289 HydrophobicContact CB-CG1 3.54Å; R283-I289 PolarHBondContact NE-O 3.01Å; R283-I289 PolarHBondContact NH2-O 3.1Å; R283-I289 VanDerWaalsContact NH2-O 3.13Å; I287-I289 HydrophobicContact CG2-CG2 3.84Å; I287-I289 PolarHBondContact O-N 3.35Å; I287-I289 VanDerWaalsContact O-N 3.15Å
290	A	89.6	Confident	94.6	Very high	40 Å²	40	50.7 Å²	50.7	33%	0.331	28%	0.276	S	S	.	.			trans	-130.8	162.1	167.1	0	0	0	0	0	108.4	P272	P272-A290 CarbonylContact O-C 3.58Å
291	G	91.3	Very high	94.7	Very high	7 Å²	7	48.5 Å²	48.5	7%	0.072	26%	0.261	C	S	.	.	S	Bend	trans	99.2	166.7	-178.4	0	0	0	0	0	113.6	A271 P272 F274 S276	A271-G291 WeakPolarHBondContact O-CA 3.33Å; P272-G291 WeakPolarHBondContact O-CA 3.18Å; P272-G291 PolarHBondContact O-N 3.29Å; P272-G291 VanDerWaalsContact O-N 3.16Å; F274-G291 CarbonylContact O-C 3.51Å; F274-G291 WeakPolarHBondContact O-CA 3.04Å; F274-G291 PolarHBondContact O-N 3.2Å; S276-G291 WeakPolarHBondContact CB-O 3.24Å; S276-G291 PolarHBondContact OG-O 3.39Å
292	G	92.2	Very high	94.7	Very high	15 Å²	15	46.6 Å²	46.6	16%	0.155	25%	0.252	C	S	.	.			trans	-84.1	-175.7	170.1	0	0	0	0	0	113	N230 A268 A269	N230-G292 VanDerWaalsContact OD1-CA 3.25Å; N230-G292 WeakPolarHBondContact OD1-CA 3.47Å; A268-G292 PolarHBondContact O-N 3.33Å; A269-G292 CarbonylContact O-C 3.54Å
293	V	93.4	Very high	94.8	Very high	37 Å²	37	46.6 Å²	46.6	22%	0.224	25%	0.252	C	S	.	.			trans	-112.5	107.7	179.6	-175.9	0	0	0	0	108.9	N230 A269 F278 G295	N230-V293 PolarHBondContact ND2-O 3.43Å; N230-V293 PolarHBondContact OD1-N 2.61Å; A269-V293 WeakPolarHBondContact CB-O 3.35Å; F278-V293 HydrophobicContact CB-CG2 3.66Å; F278-V293 HydrophobicContact CD1-CG2 3.24Å; F278-V293 HydrophobicContact CD2-CG2 3.69Å; F278-V293 HydrophobicContact CE1-CG2 3.66Å; F278-V293 HydrophobicContact CE2-CG2 4.07Å; F278-V293 HydrophobicContact CG-CG2 3.25Å; F278-V293 HydrophobicContact CZ-CG2 4.05Å; V293-G295 PolarHBondContact O-N 2.96Å
294	P	94.2	Very high	94.8	Very high	65 Å²	65	41.6 Å²	41.6	42%	0.422	23%	0.233	S	C	.	.			trans	-62.6	120.2	171	-23.4	34.3	0	0	0	111	F270	F270-P294 HydrophobicContact CD1-CG 4.23Å; F270-P294 HydrophobicContact CE1-CB 3.97Å; F270-P294 HydrophobicContact CE1-CG 4.03Å; F270-P294 HydrophobicContact CZ-CB 3.94Å; F270-P294 HydrophobicContact CZ-CG 4.43Å
295	G	93.7	Very high	94.8	Very high	21 Å²	21	33.3 Å²	33.3	22%	0.216	21%	0.205	C	C	.	.			trans	-161.2	175.5	-176.2	0	0	0	0	0	111.4	N45 V293	N45-G295 VanDerWaalsContact CB-O 3.3Å; N45-G295 WeakPolarHBondContact CB-O 3.42Å; V293-G295 PolarHBondContact O-N 2.96Å
296	D	96.9	Very high	94.8	Very high	5 Å²	5	32.1 Å²	32.1	3%	0.027	20%	0.204	C	C	.	.			trans	-67.5	149.4	167.7	-60.3	-40	0	0	0	108.5	Y43 N45 K46 Y60 D62 G226	Y43-D296 WeakPolarHBondContact O-CA 3.13Å; N45-D296 PolarHBondContact N-OD1 2.93Å; K46-D296 IonicContact NZ-OD2 2.75Å; K46-D296 PolarHBondContact NZ-OD2 2.6Å; Y60-D296 WeakPolarHBondContact O-CB 3.43Å; D62-D296 PolarHBondContact N-OD2 3.46Å; G226-D296 WeakPolarHBondContact CA-O 3Å
297	I	98	Very high	94.5	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.01	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	126.5	-176.8	-52.5	171.4	0	0	0	107.6	G42 Y43 L227 V262 A265 R266 V299	G42-I297 CarbonylContact C-O 3.59Å; G42-I297 WeakPolarHBondContact CA-O 3.36Å; Y43-I297 HydrophobicContact CD1-CD1 4.23Å; Y43-I297 HydrophobicContact CD1-CG1 4.43Å; Y43-I297 PolarHBondContact N-O 3.2Å; Y43-I297 PolarHBondContact O-N 2.75Å; L227-I297 HydrophobicContact CB-CG2 4.47Å; V262-I297 HydrophobicContact CG1-CB 4.43Å; V262-I297 HydrophobicContact CG1-CG2 4.34Å; V262-I297 HydrophobicContact CG2-CG2 4.17Å; A265-I297 HydrophobicContact CB-CD1 3.92Å; A265-I297 HydrophobicContact CB-CG2 4.23Å; R266-I297 HydrophobicContact CB-CD1 3.92Å; I297-V299 HydrophobicContact CG2-CG2 4.4Å
298	T	98.3	Very high	93.8	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	133	175.6	-60.5	0	0	0	0	110.7	Y60 D63 C65 V78 G223 T224	Y60-T298 HydrophobicContact CD2-CG2 3.96Å; Y60-T298 WeakPolarHBondContact CD2-OG1 3.4Å; Y60-T298 HydrophobicContact CE2-CG2 4.13Å; D63-T298 WeakPolarHBondContact CB-OG1 3.29Å; D63-T298 VanDerWaalsContact CG-OG1 3.31Å; D63-T298 VanDerWaalsContact OD2-CB 3.32Å; D63-T298 WeakPolarHBondContact OD2-CB 3.43Å; D63-T298 PolarHBondContact OD2-N 2.94Å; D63-T298 PolarHBondContact OD2-OG1 3.44Å; C65-T298 HydrophobicContact CB-CG2 3.97Å; V78-T298 HydrophobicContact CG1-CG2 4.08Å; G223-T298 WeakPolarHBondContact CA-O 3.43Å; T224-T298 PolarHBondContact N-O 3.37Å; T224-T298 VanDerWaalsContact N-O 3.16Å; T224-T298 PolarHBondContact OG1-N 2.98Å
299	V	98.5	Very high	92.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	127.9	179	-175.7	0	0	0	0	109.9	V40 A41 I221 L227 L261 V262 I297 L301	V40-V299 WeakPolarHBondContact CA-O 3.49Å; A41-V299 PolarHBondContact N-O 3.17Å; A41-V299 PolarHBondContact O-N 2.65Å; I221-V299 HydrophobicContact CG2-CG1 4.03Å; L227-V299 HydrophobicContact CB-CG2 4.27Å; L227-V299 HydrophobicContact CD1-CG2 4.05Å; L227-V299 HydrophobicContact CD2-CG2 3.96Å; L227-V299 HydrophobicContact CG-CG2 4.31Å; L261-V299 HydrophobicContact CD1-CG1 4.09Å; V262-V299 HydrophobicContact CG2-CB 4.16Å; V262-V299 HydrophobicContact CG2-CG2 3.74Å; I297-V299 HydrophobicContact CG2-CG2 4.4Å; V299-L301 HydrophobicContact CG1-CD2 4.2Å; V299-L301 HydrophobicContact CG1-CG 4.33Å
300	I	98.4	Very high	90.3	Very high	0 Å²	0	39 Å²	39	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	124.9	165.5	-54.1	171	0	0	0	107.9	A39 V40 C65 L67 L76 V78 I221 V222	A39-I300 CarbonylContact O-C 3.6Å; A39-I300 WeakPolarHBondContact O-CA 3.23Å; V40-I300 HydrophobicContact CG1-CG1 4.31Å; V40-I300 HydrophobicContact CG2-CG1 4.21Å; V40-I300 HydrophobicContact CG2-CG2 4.33Å; C65-I300 HydrophobicContact CB-CD1 3.92Å; C65-I300 HydrophobicContact CB-CG1 4.5Å; L67-I300 HydrophobicContact CD1-CD1 3.74Å; L67-I300 HydrophobicContact CD1-CG1 4.21Å; L67-I300 HydrophobicContact CD1-CG2 4.34Å; L67-I300 HydrophobicContact CD2-CG2 4.03Å; L67-I300 HydrophobicContact CG-CD1 4.32Å; L67-I300 HydrophobicContact CG-CG2 4.32Å; L76-I300 HydrophobicContact CB-CD1 4.31Å; L76-I300 HydrophobicContact CB-CG2 4.47Å; L76-I300 HydrophobicContact CD1-CG2 3.93Å; L76-I300 HydrophobicContact CD2-CG2 4.32Å; L76-I300 HydrophobicContact CG-CG2 4.47Å; V78-I300 HydrophobicContact CG1-CD1 3.81Å; V78-I300 HydrophobicContact CG1-CG1 4.19Å; I221-I300 CarbonylContact C-O 3.54Å; I221-I300 WeakPolarHBondContact CA-O 3.43Å; V222-I300 HydrophobicContact CB-CB 4.29Å; V222-I300 PolarHBondContact N-O 2.77Å; V222-I300 PolarHBondContact O-N 2.89Å
301	L	97.6	Very high	87.9	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	140.1	167.6	-64.1	-176	0	0	0	110.2	T38 A39 I220 I221 I243 L254 C257 A258 L261 V299	T38-L301 CarbonylContact C-O 3.57Å; T38-L301 WeakPolarHBondContact CA-O 3.16Å; A39-L301 PolarHBondContact N-O 3.04Å; A39-L301 PolarHBondContact O-N 3.28Å; I220-L301 CarbonylContact O-C 3.58Å; I220-L301 WeakPolarHBondContact O-CA 3.34Å; I221-L301 HydrophobicContact CB-CD2 4.11Å; I221-L301 HydrophobicContact CD1-CD2 3.96Å; I221-L301 HydrophobicContact CG1-CD2 3.55Å; I221-L301 HydrophobicContact CG2-CD2 4Å; I243-L301 HydrophobicContact CD1-CD1 4.4Å; L254-L301 HydrophobicContact CD1-CB 3.75Å; L254-L301 HydrophobicContact CD1-CD1 3.95Å; L254-L301 HydrophobicContact CD2-CB 4.39Å; L254-L301 HydrophobicContact CG-CB 3.97Å; L254-L301 HydrophobicContact CG-CD1 4.37Å; C257-L301 HydrophobicContact CB-CD1 3.92Å; A258-L301 HydrophobicContact CB-CD1 3.76Å; A258-L301 HydrophobicContact CB-CG 4Å; L261-L301 HydrophobicContact CD1-CD1 4.28Å; L261-L301 HydrophobicContact CD1-CD2 3.89Å; L261-L301 HydrophobicContact CD1-CG 4.46Å; V299-L301 HydrophobicContact CG1-CD2 4.2Å; V299-L301 HydrophobicContact CG1-CG 4.33Å
302	G	96.8	Very high	85.4	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	113	172.3	0	0	0	0	0	110.9	L37 I220	L37-G302 CarbonylContact O-C 3.54Å; L37-G302 WeakPolarHBondContact O-CA 3.42Å; I220-G302 PolarHBondContact N-O 2.56Å; I220-G302 PolarHBondContact O-N 2.63Å
303	L	96.4	Very high	82.6	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.005	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	123.1	170.1	175.9	68.6	0	0	0	109.4	L36 L37 I219 L245 C249 L254 I305	L36-L303 WeakPolarHBondContact CA-O 3.15Å; L37-L303 HydrophobicContact CB-CB 4.34Å; L37-L303 PolarHBondContact N-O 3.49Å; L37-L303 PolarHBondContact O-N 3.02Å; I219-L303 HydrophobicContact CG1-CD1 3.83Å; L245-L303 HydrophobicContact CD2-CD1 4.06Å; C249-L303 HydrophobicContact CB-CD2 4.01Å; C249-L303 WeakPolarHBondContact SG-CD2 3.41Å; L254-L303 HydrophobicContact CD1-CB 4.41Å; L254-L303 HydrophobicContact CD2-CB 4.49Å; L303-I305 HydrophobicContact CD2-CG2 4.04Å; L303-I305 HydrophobicContact CG-CG2 3.94Å; L303-I305 PolarHBondContact O-N 2.92Å
304	V	96.3	Very high	79.7	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	123.7	176.1	-177.3	0	0	0	0	109.4	L34 L36 V214 K215 P216 G217 D218 I220	L34-V304 HydrophobicContact CB-CG1 4.32Å; L34-V304 HydrophobicContact CD1-CG1 3.75Å; L34-V304 HydrophobicContact CD2-CG1 4.38Å; L34-V304 HydrophobicContact CG-CG1 4.38Å; L36-V304 HydrophobicContact CD2-CB 4.42Å; L36-V304 HydrophobicContact CD2-CG2 3.74Å; V214-V304 HydrophobicContact CB-CG2 4.32Å; V214-V304 HydrophobicContact CG2-CG1 4.26Å; V214-V304 HydrophobicContact CG2-CG2 4.29Å; K215-V304 WeakPolarHBondContact O-CB 3.43Å; K215-V304 WeakPolarHBondContact O-CG1 3.38Å; P216-V304 CarbonylContact C-O 3.59Å; P216-V304 WeakPolarHBondContact CA-O 3.37Å; G217-V304 PolarHBondContact N-O 3.09Å; D218-V304 HydrophobicContact CB-CB 4.25Å; D218-V304 HydrophobicContact CB-CG2 4.01Å; D218-V304 WeakPolarHBondContact O-CB 3.42Å; D218-V304 WeakPolarHBondContact O-CG2 3.31Å; D218-V304 PolarHBondContact O-N 2.83Å; I220-V304 HydrophobicContact CD1-CG2 4.12Å; I220-V304 HydrophobicContact CG1-CG2 4.28Å
305	I	94.5	Very high	76.9	Confident	41 Å²	41	62.3 Å²	62.3	21%	0.21	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	159.2	179.4	65.7	175.2	0	0	0	110.5	L34 C35 L37 L246 L303	L34-I305 CarbonylContact C-O 3.56Å; L34-I305 WeakPolarHBondContact CA-O 3.43Å; C35-I305 HydrophobicContact CB-CD1 4.39Å; C35-I305 HydrophobicContact CB-CG1 3.85Å; C35-I305 PolarHBondContact N-O 3.12Å; C35-I305 PolarHBondContact O-N 2.95Å; L37-I305 HydrophobicContact CB-CD1 4.38Å; L246-I305 HydrophobicContact CD1-CB 4.45Å; L246-I305 HydrophobicContact CD1-CG2 3.92Å; L303-I305 HydrophobicContact CD2-CG2 4.04Å; L303-I305 HydrophobicContact CG-CG2 3.94Å; L303-I305 PolarHBondContact O-N 2.92Å
306	E	93.5	Very high	74	Confident	106 Å²	106	68.3 Å²	68.3	50%	0.495	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	137.6	169.9	-59.4	-174.5	164.7	0	0	110.6	V32 L34 P216 K308	V32-E306 HydrophobicContact CG1-CB 3.93Å; V32-E306 HydrophobicContact CG1-CG 3.76Å; L34-E306 HydrophobicContact CD2-CG 4.35Å; P216-E306 HydrophobicContact CB-CG 3.99Å; P216-E306 HydrophobicContact CG-CG 3.33Å; E306-K308 PolarHBondContact O-N 3.01Å
307	E	88.5	Confident	71.1	Confident	80 Å²	80	77 Å²	77	37%	0.374	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-67.4	117.4	167.8	-171.7	172.4	-132.8	0	0	109	R33 R148 S309	R33-E307 HydrophobicContact CB-CB 4.13Å; R33-E307 WeakPolarHBondContact CB-OE2 3.28Å; R33-E307 VanDerWaalsContact CD-OE2 3.3Å; R33-E307 WeakPolarHBondContact CD-OE2 3.39Å; R33-E307 IonicContact NE-OE2 3.89Å; R33-E307 IonicContact NH1-OE2 3.74Å; R33-E307 VanDerWaalsContact O-CB 3.27Å; R33-E307 WeakPolarHBondContact O-CB 3.25Å; R33-E307 PolarHBondContact O-N 3.02Å; R148-E307 IonicContact CZ-OE1 2.79Å; R148-E307 IonicContact CZ-OE2 2.79Å; R148-E307 IonicContact NH2-OE1 3.51Å; R148-E307 PolarHBondContact NH2-OE1 3.4Å; R148-E307 IonicContact NH2-OE2 3.35Å; R148-E307 PolarHBondContact NH2-OE2 2.91Å; E307-S309 PolarHBondContact O-N 3.4Å; E307-S309 VanDerWaalsContact O-N 3.17Å
308	K	79.4	Confident	68	Low	196 Å²	196	84.7 Å²	84.7	85%	0.852	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-63.1	119.6	172	-67.8	-175.9	-179.6	179.7	0	108.6	E306 S310	E306-K308 PolarHBondContact O-N 3.01Å; K308-S310 PolarHBondContact O-N 3.08Å
309	S	60.1	Low	64.8	Low	112 Å²	112	91.3 Å²	91.3	78%	0.783	51%	0.508	S	S	*	.			trans	-60.5	112.4	168.2	55.6	0	0	0	0	108.5	E307	E307-S309 PolarHBondContact O-N 3.4Å; E307-S309 VanDerWaalsContact O-N 3.17Å
310	S	48.5	Very low	61.7	Low	91 Å²	91	103.1 Å²	103.1	64%	0.636	55%	0.552	S	S	*	*			trans	-54.5	130.3	164.3	54.1	0	0	0	0	107.5	K308 T312	K308-S310 PolarHBondContact O-N 3.08Å; S310-T312 PolarHBondContact O-N 3.33Å
311	P	39	Very low	58.7	Low	130 Å²	130	108.1 Å²	108.1	84%	0.844	59%	0.587	S	S	*	*			trans	-60.6	103.8	175.3	22.7	-29.8	0	0	0	108.1	S313	P311-S313 PolarHBondContact O-N 3.35Å
312	T	39.7	Very low	55.7	Low	120 Å²	120	113 Å²	113	74%	0.736	62%	0.622	S	S	*	*			trans	-62.5	127.1	170.5	34.6	0	0	0	0	107.4	S310 S314	S310-T312 PolarHBondContact O-N 3.33Å; T312-S314 VanDerWaalsContact C-N 3.3Å; T312-S314 PolarHBondContact O-N 2.92Å
313	S	32.7	Very low	52.8	Low	119 Å²	119	121.6 Å²	121.6	83%	0.832	67%	0.666	S	S	*	*			trans	-59.1	89.2	176.7	58.2	0	0	0	0	110.6	P311 H315	P311-S313 PolarHBondContact O-N 3.35Å; S313-H315 PolarHBondContact O-N 3.26Å
314	S	32.3	Very low	49.9	Very low	104 Å²	104	128.3 Å²	128.3	73%	0.727	70%	0.702	S	S	*	*			trans	-79.9	69.2	168.7	60.4	0	0	0	0	109.7	T312	T312-S314 VanDerWaalsContact C-N 3.3Å; T312-S314 PolarHBondContact O-N 2.92Å
315	H	35	Very low	47.3	Very low	181 Å²	181	135.8 Å²	135.8	84%	0.838	74%	0.737	S	S	*	*			trans	-157.2	64.5	166	-91	-56.3	0	0	0	111.5	S313	S313-H315 PolarHBondContact O-N 3.26Å
316	V	32.8	Very low	44.6	Very low	147 Å²	147	140.7 Å²	140.7	89%	0.891	76%	0.758	S	S	*	*			trans	-147.4	84.3	146.5	-169.4	0	0	0	0	108.1
317	K	36.5	Very low	42	Very low	186 Å²	186	142.8 Å²	142.8	81%	0.809	77%	0.768	S	S	*	*			trans	-120.7	122.3	155.8	-92.4	-171.4	175.4	-174	0	107.5
318	E	32.5	Very low	39.7	Very low	164 Å²	164	146.5 Å²	146.5	77%	0.766	79%	0.785	S	S	*	*			trans	61.7	97.1	148.6	-66.2	168.8	170.3	0	0	117.7
319	T	32.4	Very low	37.5	Very low	140 Å²	140	147.6 Å²	147.6	86%	0.859	78%	0.784	S	S	*	*				-179.2	112.3	115.6	19.2	0	0	0	0	110
320	R	33.2	Very low	36.2	Very low	247 Å²	247	153 Å²	153	93%	0.932	79%	0.787	S	S	*	*			trans	-178.4	98.2	131.9	-99.2	166.3	-178.7	-165.3	-0.2	109.7
321	S	34.9	Very low	35.6	Very low	106 Å²	106	157.3 Å²	157.3	74%	0.741	80%	0.797	S	S	*	*			trans	-57.4	158.8	157.5	43.9	0	0	0	0	111.5
322	S	34.6	Very low	35.3	Very low	103 Å²	103	160.5 Å²	160.5	72%	0.72	80%	0.8	S	S	*	*			trans	65.1	102.8	159.8	49.9	0	0	0	0	117.6
323	L	35.9	Very low	35.1	Very low	179 Å²	179	162.7 Å²	162.7	94%	0.937	80%	0.801	S	S	*	*				-171	121.4	112.9	-96.1	144	0	0	0	111
324	N	35.6	Very low	35.1	Very low	142 Å²	142	165.9 Å²	165.9	76%	0.759	80%	0.803	S	S	*	*			trans	-63.5	138.8	171.5	-76.6	-35.7	0	0	0	111.6
325	H	40.6	Very low	35	Very low	158 Å²	158	168.5 Å²	168.5	73%	0.731	81%	0.808	S	S	*	*				156	130.3	113	-97.6	-0.7	0	0	0	114
326	H	39.5	Very low	34.8	Very low	143 Å²	143	167.3 Å²	167.3	66%	0.662	81%	0.807	S	S	*	*			trans	73.5	120	138.2	-79.9	59.4	0	0	0	121.6
327	H	38.9	Very low	34.5	Very low	151 Å²	151	170.3 Å²	170.3	70%	0.699	81%	0.808	S	S	*	*			trans	98.4	101.1	132.3	-93.5	35.9	0	0	0	120.3
328	H	39	Very low	34.2	Very low	158 Å²	158	170 Å²	170	73%	0.731	81%	0.81	S	S	*	*				75.7	127.2	121.3	-98.1	-26.7	0	0	0	122.3
329	R	34.8	Very low	34	Very low	219 Å²	219	172.3 Å²	172.3	83%	0.826	81%	0.812	S	S	*	*			trans	95.5	101.4	144.3	-80.2	-178	168.4	178.8	-2.9	118.9
330	R	31.1	Very low	33.9	Very low	226 Å²	226	173.6 Å²	173.6	85%	0.853	81%	0.813	S	S	*	*				37.3	115.9	125.8	-68.8	-177	177	175.7	-1.1	116.8
331	H	36.3	Very low	33.7	Very low	181 Å²	181	173 Å²	173	84%	0.838	81%	0.811	S	S	*	*				-157.6	120.5	125.1	-94.5	-69.7	0	0	0	109.8	H333	H331-H333 PolarHBondContact O-N 3.15Å
332	H	33.4	Very low	33.6	Very low	197 Å²	197	172.4 Å²	172.4	91%	0.912	81%	0.807	S	S	*	*			trans	-67.7	121.5	165.5	-89	-91.6	0	0	0	108.4
333	H	34.3	Very low	33.4	Very low	165 Å²	165	175.3 Å²	175.3	76%	0.764	81%	0.813	S	S	*	*			trans	-125.6	114.8	162.6	-103.9	-83.9	0	0	0	109.5	H331 L335	H331-H333 PolarHBondContact O-N 3.15Å; H333-L335 PolarHBondContact O-N 2.77Å
334	H	32.9	Very low	33.1	Very low	187 Å²	187	171.2 Å²	171.2	87%	0.866	80%	0.8	S	S	*	*			trans	-59.5	109.3	165.1	-120	-79.7	0	0	0	108.4	L336	H334-L336 PolarHBondContact O-N 3.34Å
335	L	30.6	Very low	32.9	Very low	159 Å²	159	169.6 Å²	169.6	83%	0.832	80%	0.798	S	S	*	*			trans	-87.1	100.4	170.8	-93.6	151.1	0	0	0	108.8	H333 F337	H333-L335 PolarHBondContact O-N 2.77Å; L335-F337 PolarHBondContact O-N 3.35Å
336	L	30.3	Very low	32.3	Very low	155 Å²	155	167.2 Å²	167.2	81%	0.812	80%	0.799	S	S	*	*			trans	-58.2	113.2	161.5	-87.6	131.9	0	0	0	108.9	H334 Q338	H334-L336 PolarHBondContact O-N 3.34Å; L336-Q338 PolarHBondContact O-N 3.37Å
337	F	27.1	Very low	31.9	Very low	210 Å²	210	167.9 Å²	167.9	92%	0.921	80%	0.803	S	S	*	*			trans	-63.3	104.8	167.1	-109	-95.6	0	0	0	108.9	L335	L335-F337 PolarHBondContact O-N 3.35Å
338	Q	30.8	Very low	31.5	Very low	181 Å²	181	169.4 Å²	169.4	85%	0.846	82%	0.815	S	S	*	*			trans	-71.2	130	170.7	-86.3	-176.9	-20.7	0	0	110.2	L336	L336-Q338 PolarHBondContact O-N 3.37Å
339	R	28.5	Very low	30.8	Very low	212 Å²	212	168.6 Å²	168.6	80%	0.8	82%	0.816	S	S	*	*			trans	-43.1	125.9	172.5	-86.9	167.1	155.5	153.7	-6.2	113.4	R341	R339-R341 PolarHBondContact O-N 2.97Å; R339-R341 VanDerWaalsContact O-N 3.15Å
340	N	30	Very low	30.6	Very low	166 Å²	166	169.5 Å²	169.5	89%	0.888	82%	0.821	S	S	*	*			trans	-60.5	112.6	155.8	-78.7	-22.5	0	0	0	108.7
341	R	28.5	Very low	30.4	Very low	236 Å²	236	165 Å²	165	89%	0.891	81%	0.814	S	S	*	*			trans	-67.4	140.9	168.9	-76.7	-179.6	169.9	-169.6	-2.7	108.9	R339 L343	R339-R341 PolarHBondContact O-N 2.97Å; R339-R341 VanDerWaalsContact O-N 3.15Å; R341-L343 PolarHBondContact O-N 3Å
342	S	33.6	Very low	30	Very low	93 Å²	93	165.1 Å²	165.1	65%	0.65	81%	0.812	S	S	*	*			trans	-52.9	129.1	163.1	42.7	0	0	0	0	109.6	S344	S342-S344 VanDerWaalsContact C-N 3.29Å; S342-S344 PolarHBondContact O-N 3.4Å
343	L	29.2	Very low	29.8	Very low	163 Å²	163	164.2 Å²	164.2	85%	0.853	81%	0.806	S	S	*	*			trans	-64.1	90.9	171.5	-79	155	0	0	0	108.5	R341	R341-L343 PolarHBondContact O-N 3Å
344	S	31.3	Very low	29.6	Very low	94 Å²	94	163.7 Å²	163.7	66%	0.657	80%	0.803	S	S	*	*			trans	-81.8	124.8	160.4	69.3	0	0	0	0	108.7	S342 S346	S342-S344 VanDerWaalsContact C-N 3.29Å; S342-S344 PolarHBondContact O-N 3.4Å; S344-S346 PolarHBondContact O-N 3.38Å; S344-S346 PolarHBondContact O-OG 2.96Å
345	C	29.6	Very low	29.2	Very low	108 Å²	108	158.7 Å²	158.7	73%	0.73	79%	0.789	S	S	*	*	S	Bend	trans	-30.1	97.8	174.4	-129.4	0	0	0	0	114.1
346	S	28.9	Very low	29.2	Very low	107 Å²	107	159.9 Å²	159.9	75%	0.748	79%	0.788	S	S	*	*			trans	-156.5	0.6	158.5	46.7	0	0	0	0	113.5	S344	S344-S346 PolarHBondContact O-N 3.38Å; S344-S346 PolarHBondContact O-OG 2.96Å
347	E	31	Very low	29	Very low	158 Å²	158	158 Å²	158	74%	0.738	78%	0.783	S	S	*	*			trans	-129.3	60.4	-175.1	-67	-174.2	163.4	0	0	112.6
348	L	30.5	Very low	29.2	Very low	182 Å²	182	154 Å²	154	95%	0.953	78%	0.781	S	S	*	*			trans	-143	89.3	158.7	-77.1	177.6	0	0	0	108.9
349	N	25.3	Very low	28.9	Very low	142 Å²	142	150.9 Å²	150.9	76%	0.759	78%	0.78	S	S	*	*			trans	-106.2	110.1	172.5	-147.6	-1.9	0	0	0	106.9
350	Y	29.7	Very low	29.1	Very low	237 Å²	237	146.1 Å²	146.1	93%	0.929	78%	0.779	S	S	*	*			trans	-141.5	98.1	164.7	-112.7	-85.3	0	0	0	110.2
351	N	26.4	Very low	29.3	Very low	133 Å²	133	142.9 Å²	142.9	71%	0.711	77%	0.769	S	S	*	*			trans	-74.6	157.5	164.8	-92.6	-40.1	0	0	0	111.2
352	K	27.4	Very low	29.4	Very low	182 Å²	182	137.8 Å²	137.8	79%	0.791	76%	0.764	S	S	*	*			trans	83.6	108.9	165.2	-66.8	174.7	172.4	177.1	0	116.5
353	F	30.7	Very low	29.4	Very low	178 Å²	178	141.3 Å²	141.3	78%	0.781	78%	0.775	S	S	*	*				-177	130.6	96.7	-97.3	-68.1	0	0	0	114
354	H	30.5	Very low	29.5	Very low	154 Å²	154	139.3 Å²	139.3	71%	0.713	77%	0.772	S	S	*	*			trans	55.1	106.3	152	-71.5	-52.5	0	0	0	124.8
355	S	23.7	Very low	29.8	Very low	82 Å²	82	140.8 Å²	140.8	57%	0.573	78%	0.777	S	S	*	*				-1.5	135.3	125	56.1	0	0	0	0	120.1
356	F	30	Very low	30	Very low	185 Å²	185	140.6 Å²	140.6	81%	0.811	78%	0.777	S	S	*	*				-176	117.2	114.2	-101.6	-77.1	0	0	0	112.2
357	T	27	Very low	30.3	Very low	114 Å²	114	139.9 Å²	139.9	70%	0.699	77%	0.772	S	S	*	*			trans	33.1	125.4	140.1	58.9	0	0	0	0	121.8
358	S	30.2	Very low	30.6	Very low	126 Å²	126	138.4 Å²	138.4	88%	0.881	77%	0.769	S	S	*	*				169.1	148.1	94.8	50.3	0	0	0	0	112.8
359	S	25.6	Very low	30.9	Very low	116 Å²	116	136.2 Å²	136.2	81%	0.811	76%	0.758	S	S	*	*			trans	-98.9	146	-168.7	43.7	0	0	0	0	113.4
360	S	32.9	Very low	31.3	Very low	112 Å²	112	135 Å²	135	78%	0.783	76%	0.756	S	S	*	*			trans	-169.7	113.6	146.3	46.5	0	0	0	0	111.1
361	S	33	Very low	31.5	Very low	98 Å²	98	129 Å²	129	69%	0.685	75%	0.745	S	S	*	*				77.6	96.5	112.5	68.7	0	0	0	0	115.5
362	T	30.7	Very low	31.8	Very low	129 Å²	129	129 Å²	129	79%	0.791	75%	0.749	S	S	*	*				61.8	114.6	91.2	54.2	0	0	0	0	116.6
363	L	33	Very low	32	Very low	168 Å²	168	123.9 Å²	123.9	88%	0.88	74%	0.741	S	S	*	*				179.1	128.4	129.8	-96.7	155.3	0	0	0	111.4
364	P	31.3	Very low	32.1	Very low	121 Å²	121	121.8 Å²	121.8	79%	0.786	74%	0.743	S	S	*	*			trans	-117.2	152.3	162	36.6	-24.4	0	0	0	112.6
365	T	37.7	Very low	32	Very low	125 Å²	125	119 Å²	119	77%	0.767	74%	0.741	S	S	*	*			trans	-141.7	113.1	166.4	44.2	0	0	0	0	107
366	S	33.8	Very low	32.2	Very low	104 Å²	104	125.1 Å²	125.1	73%	0.727	76%	0.758	S	S	*	*				46.4	125.2	86.7	73.4	0	0	0	0	112.2
367	S	36.7	Very low	32.1	Very low	92 Å²	92	121.7 Å²	121.7	64%	0.643	76%	0.757	S	S	*	*			cis	174.5	171.3	31.7	47	0	0	0	0	109.7
368	N	36.8	Very low	32.1	Very low	126 Å²	126	122.3 Å²	122.3	67%	0.674	77%	0.766	S	S	*	*			trans	89.7	109.5	152.8	-62	-16.2	0	0	0	118.4
369	N	36	Very low	32.1	Very low	136 Å²	136	125.3 Å²	125.3	73%	0.727	76%	0.763	S	S	*	*				84.6	134	94.8	-70.1	-12	0	0	0	110.2
370	T	35.4	Very low	32.2	Very low	116 Å²	116	126.6 Å²	126.6	71%	0.712	76%	0.76	S	S	*	*			cis	-173.4	146.4	26.7	-3.8	0	0	0	0	107.3
371	T	32.3	Very low	32.1	Very low	112 Å²	112	130.6 Å²	130.6	69%	0.687	76%	0.763	S	S	*	*			trans	14.9	133.2	140.5	50.5	0	0	0	0	118.5
372	T	33.6	Very low	31.9	Very low	132 Å²	132	135.5 Å²	135.5	81%	0.81	77%	0.767	S	S	*	*				179.7	146.4	69.5	14.5	0	0	0	0	112.2
373	A	31.1	Very low	32.1	Very low	76 Å²	76	135.3 Å²	135.3	63%	0.628	77%	0.766	S	S	*	*			trans	70.7	123.4	132.3	0	0	0	0	0	123.2
374	T	31.9	Very low	32.1	Very low	134 Å²	134	137.4 Å²	137.4	82%	0.822	76%	0.764	S	S	*	*				64.4	140.5	129.6	57	0	0	0	0	118.8
375	S	29.8	Very low	32	Very low	95 Å²	95	135 Å²	135	66%	0.664	75%	0.749	S	S	*	*			cis	179.3	150.5	2.6	51	0	0	0	0	106.1
376	F	27.8	Very low	31.7	Very low	210 Å²	210	132.7 Å²	132.7	92%	0.921	74%	0.738	S	S	*	*			trans	59.4	112	149.8	-90.1	-100.6	0	0	0	120.4
377	S	27.2	Very low	31.5	Very low	114 Å²	114	134 Å²	134	80%	0.797	74%	0.742	S	S	*	*				146.7	102.9	115.5	-177	0	0	0	0	110.9
378	S	28.3	Very low	31.3	Very low	126 Å²	126	136.2 Å²	136.2	88%	0.881	75%	0.747	S	S	*	*			trans	-133.2	83.1	161.8	64.5	0	0	0	0	109.1
379	K	29.7	Very low	31	Very low	189 Å²	189	136.7 Å²	136.7	82%	0.822	75%	0.751	S	S	*	*			trans	-102.1	143.3	155.1	-86	-178.7	176.9	177.2	0	107.1
380	L	26.6	Very low	30.7	Very low	143 Å²	143	136.7 Å²	136.7	75%	0.749	75%	0.752	S	S	*	*			trans	86	77.7	172.5	-63.6	133	0	0	0	116.5
381	F	30.9	Very low	30.4	Very low	196 Å²	196	137.9 Å²	137.9	86%	0.86	75%	0.754	S	S	*	*			trans	-111.7	93.9	131.9	-95.7	-89.3	0	0	0	107.4	T383	F381-T383 PolarHBondContact O-N 3.23Å
382	R	29.7	Very low	30.3	Very low	201 Å²	201	139.6 Å²	139.6	76%	0.758	76%	0.758	S	S	*	*			trans	-70.3	122	165.4	-112.4	-179.5	176.3	-170.9	-1.3	106.5	Y384	R382-Y384 PolarHBondContact O-N 3.07Å; R382-Y384 VanDerWaalsContact O-N 3.11Å
383	T	34	Very low	30.1	Very low	125 Å²	125	140.1 Å²	140.1	77%	0.767	76%	0.755	S	S	*	*			trans	-42.5	110.4	160.1	39.6	0	0	0	0	110.4	F381 S385	F381-T383 PolarHBondContact O-N 3.23Å; T383-S385 VanDerWaalsContact C-N 3.3Å; T383-S385 PolarHBondContact O-N 3.47Å
384	Y	33.4	Very low	30	Very low	213 Å²	213	144.6 Å²	144.6	84%	0.835	76%	0.764	S	S	*	*			trans	-81.9	86	157.8	-78.2	-85.8	0	0	0	106.9	R382	R382-Y384 PolarHBondContact O-N 3.07Å; R382-Y384 VanDerWaalsContact O-N 3.11Å
385	S	29.2	Very low	29.9	Very low	69 Å²	69	145.5 Å²	145.5	48%	0.483	76%	0.76	S	S	.	*			trans	-82.3	107.7	160.5	-62.7	0	0	0	0	106.5	T383	T383-S385 VanDerWaalsContact C-N 3.3Å; T383-S385 PolarHBondContact O-N 3.47Å
386	C	31.6	Very low	29.9	Very low	78 Å²	78	149.7 Å²	149.7	53%	0.527	77%	0.767	S	S	.	*			trans	-68.7	132.1	168.7	-72.4	0	0	0	0	109.1
387	T	30.6	Very low	30.1	Very low	132 Å²	132	144.2 Å²	144.2	81%	0.81	75%	0.753	S	S	*	*			trans	-57.5	0	161.6	46.1	0	0	0	0	112

Retrieved 387 of 387 residues in 825.1 ms (Link to these results)

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