A0A060YDN5_ONCMY Loading...

Spondin-2

AlphaFold DB , UniProt , Accession A0A060YDN5, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene spon2b, Length 339 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35	Very low	34.9	Very low	220 Å²	220	141.3 Å²	141.3	100%	1.084	77%	0.767	S	S	*	*				0	112.5	0	-163.9	165.5	176.8	0	0	105.7
2	E	36.7	Very low	35	Very low	132 Å²	132	138.2 Å²	138.2	62%	0.617	76%	0.764	S	S	*	*			trans	69.1	134.7	166.4	-62.5	171.7	105.5	0	0	117.4
3	R	35.7	Very low	35.3	Very low	212 Å²	212	137.6 Å²	137.6	80%	0.8	77%	0.766	S	S	*	*			cis	-161.2	150.8	0.2	-132.8	-179.4	-81.9	162.6	-5.6	109.1
4	D	32.9	Very low	35.5	Very low	138 Å²	138	136.4 Å²	136.4	74%	0.738	76%	0.763	S	S	*	*			trans	-66.6	168.4	-178.5	-63.8	-73.2	0	0	0	117.6
5	M	37.2	Very low	35.3	Very low	162 Å²	162	139.1 Å²	139.1	80%	0.798	77%	0.767	S	S	*	*			trans	77.5	143	135.5	-88.2	166	66.7	0	0	119.9
6	N	33.3	Very low	35.3	Very low	126 Å²	126	145.9 Å²	145.9	67%	0.674	78%	0.778	S	S	*	*			cis	-167.8	144	-1.5	-143.2	16.3	0	0	0	110.4
7	V	36.8	Very low	35.5	Very low	119 Å²	119	147.7 Å²	147.7	72%	0.721	79%	0.786	S	S	*	*			trans	52	122.1	132.2	176.3	0	0	0	0	122.8
8	S	32.4	Very low	35.6	Very low	104 Å²	104	144.8 Å²	144.8	73%	0.727	79%	0.786	S	S	*	*				176.5	125	104.7	50.4	0	0	0	0	111.3
9	S	34	Very low	35.6	Very low	103 Å²	103	143.3 Å²	143.3	72%	0.72	79%	0.788	S	S	*	*				67.9	126.1	111.5	-157.3	0	0	0	0	114.2
10	T	36.3	Very low	36.3	Very low	125 Å²	125	144.7 Å²	144.7	77%	0.767	79%	0.793	S	S	*	*			cis	-173.5	144.6	18.1	6.5	0	0	0	0	108.2
11	S	33.6	Very low	36.9	Very low	113 Å²	113	143.9 Å²	143.9	79%	0.79	79%	0.793	S	S	*	*			trans	64.4	121.4	143	-155.2	0	0	0	0	122.5
12	S	35.8	Very low	37	Very low	104 Å²	104	141.1 Å²	141.1	73%	0.727	78%	0.782	S	S	*	*			trans	74.5	103.8	142.7	-162.3	0	0	0	0	118
13	V	39.2	Very low	37.3	Very low	131 Å²	131	139.8 Å²	139.8	79%	0.794	78%	0.782	S	S	*	*				171.9	88	118.2	174.8	0	0	0	0	106.3
14	V	37.7	Very low	37.7	Very low	120 Å²	120	138.5 Å²	138.5	73%	0.727	79%	0.79	S	S	*	*			trans	-143.6	131.4	162.1	-170.7	0	0	0	0	107.2
15	H	33.1	Very low	38.3	Very low	178 Å²	178	139.4 Å²	139.4	82%	0.824	79%	0.794	S	S	*	*			trans	137.5	68.3	155.7	-67.1	-50.1	0	0	0	111.8
16	W	35	Very low	38.6	Very low	248 Å²	248	134.4 Å²	134.4	94%	0.939	79%	0.785	S	S	*	*			trans	-109.5	107.5	150.2	-84.6	98	0	0	0	107.5
17	L	39.2	Very low	39.3	Very low	176 Å²	176	132.9 Å²	132.9	92%	0.921	78%	0.784	S	S	*	*			trans	160	91.3	149.1	-88.4	163.2	0	0	0	108.8
18	A	36.5	Very low	39.7	Very low	95 Å²	95	133.7 Å²	133.7	79%	0.785	79%	0.789	S	S	*	*			trans	180	139.5	141.2	0	0	0	0	0	110.5
19	S	37.1	Very low	40.7	Very low	116 Å²	116	135.7 Å²	135.7	81%	0.811	79%	0.786	S	S	*	*			trans	104.8	69.9	161.3	-43.4	0	0	0	0	115.9	T21	S19-T21 PolarHBondContact O-N 3.32Å
20	L	48.4	Very low	41.4	Very low	172 Å²	172	136.4 Å²	136.4	90%	0.901	79%	0.788	S	S	*	*			trans	-59.2	105	144.9	-176.5	81.2	0	0	0	108.6
21	T	48.8	Very low	41.8	Very low	127 Å²	127	138.7 Å²	138.7	78%	0.779	79%	0.793	S	S	*	*			trans	159.6	97.5	145.8	45.3	0	0	0	0	108.9	S19	S19-T21 PolarHBondContact O-N 3.32Å
22	L	37.9	Very low	42.3	Very low	163 Å²	163	138.8 Å²	138.8	85%	0.853	79%	0.79	S	S	*	*			trans	-149.8	109.1	163.6	-146.4	72.6	0	0	0	111
23	T	42.2	Very low	42.6	Very low	103 Å²	103	139.5 Å²	139.5	63%	0.632	79%	0.79	S	S	*	*			trans	54.4	89.3	143.7	60	0	0	0	0	119.2	L25	T23-L25 PolarHBondContact O-N 3.27Å
24	L	44.1	Very low	42.6	Very low	185 Å²	185	139.1 Å²	139.1	97%	0.969	79%	0.788	S	S	*	*			trans	-81.5	72.6	142.4	-88.4	157.1	0	0	0	108.6
25	L	46.3	Very low	43.3	Very low	157 Å²	157	139.5 Å²	139.5	82%	0.822	79%	0.785	S	S	*	*			trans	-101.4	76.7	154.3	-85.8	162.9	0	0	0	105.9	T23 S27	T23-L25 PolarHBondContact O-N 3.27Å; L25-S27 PolarHBondContact O-N 3.15Å; L25-S27 VanDerWaalsContact O-N 3.15Å
26	G	42.1	Very low	44.4	Very low	58 Å²	58	137.4 Å²	137.4	60%	0.598	78%	0.78	S	S	*	*			trans	-59.8	115.2	160.6	0	0	0	0	0	106.8	V28	G26-V28 VanDerWaalsContact C-N 3.34Å; G26-V28 PolarHBondContact O-N 2.85Å
27	S	48.4	Very low	45.8	Very low	93 Å²	93	130.4 Å²	130.4	65%	0.65	77%	0.767	S	S	*	*			trans	-54.7	97.5	170.6	47.8	0	0	0	0	109	L25 H29	L25-S27 PolarHBondContact O-N 3.15Å; L25-S27 VanDerWaalsContact O-N 3.15Å; S27-H29 PolarHBondContact O-N 3.45Å; S27-H29 PolarHBondContact O-ND1 2.91Å
28	V	46.6	Very low	47.8	Very low	137 Å²	137	126.8 Å²	126.8	83%	0.83	75%	0.752	S	S	*	*			trans	-67.5	92.8	163.7	-160.4	0	0	0	0	104.6	G26 P30	G26-V28 VanDerWaalsContact C-N 3.34Å; G26-V28 PolarHBondContact O-N 2.85Å; V28-P30 WeakPolarHBondContact O-CD 3.35Å
29	H	51.9	Low	50.3	Low	145 Å²	145	123 Å²	123	67%	0.671	72%	0.719	S	S	*	*			trans	-62.1	121.7	164.2	-77.8	67.1	0	0	0	105.1	S27 M31	S27-H29 PolarHBondContact O-N 3.45Å; S27-H29 PolarHBondContact O-ND1 2.91Å; H29-M31 PolarHBondContact O-N 2.92Å
30	P	49.2	Very low	52.7	Low	118 Å²	118	121.4 Å²	121.4	77%	0.766	70%	0.704	S	S	*	*			trans	-57.7	113.4	168.6	23.4	-28.8	0	0	0	105.6	V28	V28-P30 WeakPolarHBondContact O-CD 3.35Å
31	M	44.1	Very low	54.6	Low	173 Å²	173	113.5 Å²	113.5	85%	0.852	66%	0.664	S	S	*	*			trans	-55.8	127.5	165	-69.5	-163.2	179.9	0	0	105.2	H29 V33	H29-M31 PolarHBondContact O-N 2.92Å; M31-V33 PolarHBondContact O-N 2.91Å
32	P	45.1	Very low	56	Low	115 Å²	115	115 Å²	115	75%	0.747	67%	0.668	S	S	*	*			trans	-56.9	115.4	171.6	23.8	-30.1	0	0	0	105.5	T34	P32-T34 VanDerWaalsContact C-N 3.3Å; P32-T34 PolarHBondContact O-N 2.01Å
33	V	41.7	Very low	58.3	Low	120 Å²	120	111.8 Å²	111.8	73%	0.727	65%	0.654	S	S	*	*			trans	-56.1	109.5	161.6	-178.7	0	0	0	0	103	M31 I35	M31-V33 PolarHBondContact O-N 2.91Å; V33-I35 HydrophobicContact CB-CG1 4.34Å; V33-I35 HydrophobicContact CG1-CG1 3.99Å; V33-I35 PolarHBondContact O-N 3.11Å
34	T	39.8	Very low	60.5	Low	122 Å²	122	109 Å²	109	75%	0.748	64%	0.638	S	S	*	*			trans	-65.9	84.1	165.6	45.5	0	0	0	0	104.6	P32 D36	P32-T34 VanDerWaalsContact C-N 3.3Å; P32-T34 PolarHBondContact O-N 2.01Å; T34-D36 PolarHBondContact O-N 2.97Å; T34-D36 VanDerWaalsContact O-N 3.07Å
35	I	51.6	Low	62.8	Low	128 Å²	128	100.4 Å²	100.4	66%	0.656	59%	0.593	S	S	*	*			trans	-61.4	109.2	163.6	-60.1	170	0	0	0	102.1	V33 V38	V33-I35 HydrophobicContact CB-CG1 4.34Å; V33-I35 HydrophobicContact CG1-CG1 3.99Å; V33-I35 PolarHBondContact O-N 3.11Å; I35-V38 HydrophobicContact CG2-CG2 3.92Å
36	D	56.8	Low	65.1	Low	134 Å²	134	97.2 Å²	97.2	72%	0.717	57%	0.573	S	S	*	*			trans	-44	132.7	169.1	-72.8	-45.7	0	0	0	107.1	T34 V38	T34-D36 PolarHBondContact O-N 2.97Å; T34-D36 VanDerWaalsContact O-N 3.07Å; D36-V38 VanDerWaalsContact C-N 3.3Å; D36-V38 WeakPolarHBondContact O-CG2 2.84Å; D36-V38 PolarHBondContact O-N 3.49Å
37	P	64.3	Low	67.7	Low	102 Å²	102	94.4 Å²	94.4	66%	0.662	54%	0.544	S	S	*	.			trans	-58.8	98.2	-171.6	22.8	-31.7	0	0	0	108.7	C39	P37-C39 PolarHBondContact O-N 3.27Å
38	V	81.3	Confident	70.1	Confident	100 Å²	100	91.2 Å²	91.2	61%	0.606	52%	0.521	S	S	*	.			trans	-65.4	126	-178	177.3	0	0	0	0	106.1	I35 D36 T40	I35-V38 HydrophobicContact CG2-CG2 3.92Å; D36-V38 VanDerWaalsContact C-N 3.3Å; D36-V38 WeakPolarHBondContact O-CG2 2.84Å; D36-V38 PolarHBondContact O-N 3.49Å; V38-T40 PolarHBondContact O-N 3.45Å
39	C	87.8	Confident	72.5	Confident	14 Å²	14	84.7 Å²	84.7	10%	0.095	48%	0.482	C	S	.	.			trans	-61.2	120	174.5	-179.4	0	0	0	0	109.8	P37 A148 C175	P37-C39 PolarHBondContact O-N 3.27Å; C39-A148 WeakPolarHBondContact CB-O 3.48Å; C39-C175 VanDerWaalsContact CA-SG 3.51Å; C39-C175 HydrophobicContact CB-CB 3.53Å; C39-C175 WeakPolarHBondContact CB-SG 3.26Å; C39-C175 WeakPolarHBondContact SG-CB 3.39Å; C39-C175 CovalentContact SG-SG 2.02Å; C39-C175 PolarHBondContact SG-SG 3Å
40	T	89.5	Confident	74.8	Confident	83 Å²	83	79 Å²	79	51%	0.509	46%	0.457	S	S	.	.			trans	-112.1	23.3	179	59	0	0	0	0	112.1	V38 D42 G177	V38-T40 PolarHBondContact O-N 3.45Å; T40-D42 PolarHBondContact O-N 3.11Å; T40-G177 PolarHBondContact N-O 3.27Å; T40-G177 PolarHBondContact OG1-O 2.8Å
41	A	87.6	Confident	77.1	Confident	7 Å²	7	73.4 Å²	73.4	6%	0.058	42%	0.421	C	S	.	.			trans	-66	125	-180	0	0	0	0	0	111.6	T43 A148 W180	A41-T43 VanDerWaalsContact C-N 3.29Å; A41-T43 PolarHBondContact O-N 3.35Å; A41-A148 WeakPolarHBondContact O-CB 3.45Å; A41-W180 HydrophobicContact CB-CD2 4.35Å; A41-W180 HydrophobicContact CB-CZ2 3.84Å
42	D	77.8	Confident	79.7	Confident	159 Å²	159	66.4 Å²	66.4	85%	0.85	39%	0.388	S	S	*	.	S	Bend	trans	-75	-15.1	-173.1	-70.3	-31.7	0	0	0	114.4	T40	T40-D42 PolarHBondContact O-N 3.11Å
43	T	85.4	Confident	82.3	Confident	94 Å²	94	61.1 Å²	61.1	58%	0.577	35%	0.354	S	S	*	.	S	Bend	trans	-132.1	152.8	-172.7	59.2	0	0	0	0	112	A41 W180	A41-T43 VanDerWaalsContact C-N 3.29Å; A41-T43 PolarHBondContact O-N 3.35Å; T43-W180 PolarHBondContact O-NE1 2.77Å
44	T	89.3	Confident	85	Confident	46 Å²	46	59 Å²	59	28%	0.282	34%	0.337	S	S	.	.			trans	-64.4	142.4	168.5	51.1	0	0	0	0	110.6	V146 F147	T44-V146 WeakPolarHBondContact CA-O 3.44Å; T44-F147 HydrophobicContact CG2-CD2 3.32Å; T44-F147 HydrophobicContact CG2-CE2 3.58Å
45	A	92	Very high	87.7	Confident	4 Å²	4	53.1 Å²	53.1	3%	0.033	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	139.3	168.4	0	0	0	0	0	111.5	Y47 E145 V146 W180 K247	A45-Y47 HydrophobicContact CB-CD2 4.18Å; A45-Y47 HydrophobicContact CB-CE2 3.64Å; A45-E145 WeakPolarHBondContact O-CA 3.22Å; A45-V146 HydrophobicContact CB-CG2 3.94Å; A45-V146 PolarHBondContact N-O 2.86Å; A45-V146 VanDerWaalsContact N-O 3.16Å; A45-V146 PolarHBondContact O-N 2.8Å; A45-W180 HydrophobicContact CB-CB 4.06Å; A45-W180 HydrophobicContact CB-CD2 3.73Å; A45-W180 HydrophobicContact CB-CE3 4.45Å; A45-W180 HydrophobicContact CB-CG 3.51Å; A45-K247 HydrophobicContact CB-CG 4.49Å
46	K	95.4	Very high	89.9	Confident	89 Å²	89	48.6 Å²	48.6	39%	0.387	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	136.8	168.6	-71.9	-166.8	165.2	-166.7	0	109.2	E145 K247 T248	K46-E145 WeakPolarHBondContact CE-OE1 3.29Å; K46-E145 HydrophobicContact CG-CG 4Å; K46-E145 IonicContact NZ-OE1 3.81Å; K46-K247 CarbonylContact O-C 3.38Å; K46-K247 WeakPolarHBondContact O-CA 3.43Å; K46-T248 PolarHBondContact O-N 3.28Å
47	Y	96.9	Very high	91.7	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	145.6	175.8	-79.6	-95.4	0	0	0	111	A45 E143 F144 V146 L174 W180 K181 L245 T246 K247	A45-Y47 HydrophobicContact CB-CD2 4.18Å; A45-Y47 HydrophobicContact CB-CE2 3.64Å; Y47-E143 VanDerWaalsContact O-CA 3.29Å; Y47-E143 WeakPolarHBondContact O-CA 3.35Å; Y47-F144 HydrophobicContact CD2-CE2 4.29Å; Y47-F144 HydrophobicContact CD2-CZ 4.48Å; Y47-F144 HydrophobicContact CG-CE2 4.21Å; Y47-F144 AromaticContact CG-CZ 3.97Å; Y47-F144 HydrophobicContact CG-CZ 3.97Å; Y47-F144 PolarHBondContact N-O 2.91Å; Y47-F144 PolarHBondContact O-N 2.76Å; Y47-V146 HydrophobicContact CD2-CG2 3.78Å; Y47-V146 HydrophobicContact CE2-CG2 3.6Å; Y47-L174 HydrophobicContact CD1-CD2 4.38Å; Y47-L174 HydrophobicContact CD2-CD1 4.46Å; Y47-L174 HydrophobicContact CE1-CD2 3.93Å; Y47-L174 HydrophobicContact CE2-CD1 4.47Å; Y47-W180 HydrophobicContact CE2-CE3 4.44Å; Y47-W180 WeakPolarHBondContact OH-CB 3.39Å; Y47-K181 WeakPolarHBondContact CE1-O 3.12Å; Y47-K181 VanDerWaalsContact CZ-O 3.29Å; Y47-K181 PolarHBondContact OH-N 2.83Å; Y47-K181 PolarHBondContact OH-O 2.74Å; Y47-L245 HydrophobicContact CD1-CB 4.36Å; Y47-T246 CarbonylContact C-O 3.43Å; Y47-T246 WeakPolarHBondContact CA-O 2.87Å; Y47-K247 HydrophobicContact CD1-CB 4.16Å; Y47-K247 HydrophobicContact CE1-CB 3.71Å; Y47-K247 HydrophobicContact CE1-CG 4.45Å; Y47-K247 HydrophobicContact CE2-CG 4.46Å
48	S	97.8	Very high	93.2	Very high	25 Å²	25	49 Å²	49	18%	0.175	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	124	161.8	-172.7	0	0	0	0	109	T141 L245 T246	S48-T141 WeakPolarHBondContact OG-CG2 3.37Å; S48-L245 WeakPolarHBondContact O-CA 3.47Å; S48-T246 PolarHBondContact N-O 3.02Å; S48-T246 PolarHBondContact O-N 3.34Å
49	L	98.3	Very high	93.7	Very high	0 Å²	0	46 Å²	46	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	122.9	170.2	-171.4	145.8	0	0	0	108.9	F51 L76 F128 T141 S142 F144 L153 F155 V243 L245	L49-F51 HydrophobicContact CD2-CB 4.18Å; L49-L76 HydrophobicContact CD2-CD1 3.65Å; L49-F128 HydrophobicContact CD1-CE2 3.96Å; L49-F128 HydrophobicContact CD1-CZ 3.94Å; L49-T141 CarbonylContact O-C 3.59Å; L49-T141 WeakPolarHBondContact O-CA 3.49Å; L49-T141 WeakPolarHBondContact O-CG2 3.3Å; L49-S142 PolarHBondContact N-O 3.07Å; L49-S142 PolarHBondContact O-N 2.67Å; L49-F144 HydrophobicContact CB-CD1 4.19Å; L49-F144 HydrophobicContact CB-CE1 3.88Å; L49-F144 HydrophobicContact CD1-CE1 4.35Å; L49-L153 HydrophobicContact CD1-CD2 4.21Å; L49-F155 HydrophobicContact CD1-CD1 4.18Å; L49-F155 HydrophobicContact CD1-CE1 4.45Å; L49-V243 HydrophobicContact CD1-CG2 3.98Å; L49-V243 HydrophobicContact CD2-CG2 3.92Å; L49-V243 HydrophobicContact CG-CG2 3.65Å; L49-L245 HydrophobicContact CB-CD2 4.01Å; L49-L245 HydrophobicContact CD1-CD2 3.66Å; L49-L245 HydrophobicContact CG-CD2 3.7Å
50	T	98.5	Very high	94.2	Very high	26 Å²	26	45.4 Å²	45.4	16%	0.16	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	108.4	170	-54.1	0	0	0	0	109.5	Q139 V243 T244	T50-Q139 HydrophobicContact CG2-CB 4.41Å; T50-Q139 HydrophobicContact CG2-CG 4.49Å; T50-V243 WeakPolarHBondContact O-CA 3.44Å; T50-T244 PolarHBondContact N-O 2.93Å; T50-T244 PolarHBondContact O-N 2.88Å
51	F	98.8	Very high	94.4	Very high	0 Å²	0	45 Å²	45	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	129.3	169.2	171.9	-86.7	0	0	0	109	L49 W73 L76 Q139 M140 V157 L167 L188 K242	L49-F51 HydrophobicContact CD2-CB 4.18Å; F51-W73 HydrophobicContact CE1-CD2 4.02Å; F51-W73 HydrophobicContact CE1-CE3 4.48Å; F51-W73 HydrophobicContact CE1-CG 4.12Å; F51-W73 AromaticContact CZ-CD2 3.91Å; F51-W73 HydrophobicContact CZ-CD2 3.91Å; F51-W73 AromaticContact CZ-CE3 3.95Å; F51-W73 HydrophobicContact CZ-CE3 3.95Å; F51-W73 HydrophobicContact CZ-CG 4.46Å; F51-W73 HydrophobicContact CZ-CH2 4.38Å; F51-W73 HydrophobicContact CZ-CZ2 4.32Å; F51-W73 HydrophobicContact CZ-CZ3 4.2Å; F51-L76 HydrophobicContact CB-CD1 4.08Å; F51-Q139 CarbonylContact O-C 3.56Å; F51-Q139 WeakPolarHBondContact O-CA 3.43Å; F51-M140 HydrophobicContact CB-CG 3.7Å; F51-M140 HydrophobicContact CB-SD 4.35Å; F51-M140 HydrophobicContact CD1-CE 4.06Å; F51-M140 HydrophobicContact CD1-CG 3.87Å; F51-M140 HydrophobicContact CD1-SD 4.12Å; F51-M140 HydrophobicContact CE1-CE 4.36Å; F51-M140 HydrophobicContact CG-CG 4.17Å; F51-M140 HydrophobicContact CG-SD 4.43Å; F51-M140 PolarHBondContact N-O 3.02Å; F51-M140 PolarHBondContact O-N 2.9Å; F51-V157 HydrophobicContact CD2-CG2 4.42Å; F51-V157 HydrophobicContact CE2-CG2 4.34Å; F51-L167 HydrophobicContact CE2-CD1 4.01Å; F51-L167 HydrophobicContact CZ-CD1 4.07Å; F51-L188 HydrophobicContact CD2-CD1 3.75Å; F51-L188 HydrophobicContact CE2-CD1 3.61Å; F51-K242 CarbonylContact C-O 3.55Å
52	T	98.7	Very high	94.5	Very high	27 Å²	27	47.2 Å²	47.2	17%	0.166	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	112.4	174.8	-54.1	0	0	0	0	109	M54 G138 Q139 G241 K242	T52-M54 HydrophobicContact CG2-CG 4.21Å; T52-G138 CarbonylContact C-O 3.07Å; T52-G138 WeakPolarHBondContact CA-O 3.37Å; T52-Q139 HydrophobicContact CG2-CG 4.08Å; T52-G241 CarbonylContact O-C 3.37Å; T52-G241 WeakPolarHBondContact O-CA 3.46Å; T52-K242 PolarHBondContact N-O 3.16Å; T52-K242 PolarHBondContact O-N 3.03Å
53	G	98.4	Very high	95.3	Very high	3 Å²	3	43.8 Å²	43.8	3%	0.031	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	129.9	170	0	0	0	0	0	110.2	G136 T137 G138	G53-G136 CarbonylContact C-O 3.58Å; G53-T137 VanDerWaalsContact O-CA 3.31Å; G53-T137 WeakPolarHBondContact O-CA 3.5Å; G53-G138 PolarHBondContact N-O 3.28Å; G53-G138 PolarHBondContact O-N 3.07Å
54	M	98.4	Very high	95.9	Very high	75 Å²	75	41.4 Å²	41.4	37%	0.369	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	18.3	180	-61.2	178.5	60.6	0	0	111.8	T52 S56 S59 M240 K242	T52-M54 HydrophobicContact CG2-CG 4.21Å; M54-S56 PolarHBondContact O-N 3.02Å; M54-S59 PolarHBondContact O-OG 3.22Å; M54-S59 VanDerWaalsContact O-OG 3.1Å; M54-M240 CarbonylContact C-O 3.56Å; M54-M240 VanDerWaalsContact C-O 3.32Å; M54-M240 WeakPolarHBondContact CA-O 3.3Å; M54-M240 WeakPolarHBondContact CB-O 3.49Å; M54-M240 PolarHBondContact N-O 2.73Å; M54-K242 HydrophobicContact SD-CB 3.92Å
55	W	98.3	Very high	96.2	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.217	C	C	.	.			trans	-81.3	99	176.6	-175.8	26.9	0	0	0	109.2	F60 Y64 P65 A71 W73 G136 I159 V160 F201 M240	W55-F60 AromaticContact CD1-CD2 3.75Å; W55-F60 AromaticContact CD1-CG 3.96Å; W55-Y64 AromaticContact CD1-CD2 3.91Å; W55-Y64 AromaticContact CD1-CE2 3.66Å; W55-Y64 HydrophobicContact CD2-CE2 4.17Å; W55-Y64 AromaticContact CE2-CE2 3.99Å; W55-Y64 AromaticContact CG-CE2 3.98Å; W55-Y64 HydrophobicContact CG-CE2 3.98Å; W55-Y64 AromaticContact NE1-CD2 3.53Å; W55-Y64 AromaticContact NE1-CE2 3.63Å; W55-Y64 PolarHBondContact O-OH 3.26Å; W55-P65 HydrophobicContact CH2-CG 3.87Å; W55-P65 HydrophobicContact CZ2-CG 3.86Å; W55-A71 HydrophobicContact CD2-CB 3.94Å; W55-A71 HydrophobicContact CE3-CB 3.67Å; W55-A71 HydrophobicContact CH2-CB 3.69Å; W55-A71 HydrophobicContact CZ2-CB 3.96Å; W55-A71 HydrophobicContact CZ3-CB 3.53Å; W55-W73 HydrophobicContact CB-CH2 4.32Å; W55-W73 HydrophobicContact CB-CZ2 3.61Å; W55-W73 HydrophobicContact CE3-CZ2 4.43Å; W55-G136 PolarHBondContact N-O 3.28Å; W55-G136 CarbonylContact O-C 3.5Å; W55-G136 WeakPolarHBondContact O-CA 3.3Å; W55-I159 HydrophobicContact CE3-CG2 4.25Å; W55-I159 HydrophobicContact CH2-CG2 3.78Å; W55-I159 HydrophobicContact CZ2-CG2 4.46Å; W55-I159 HydrophobicContact CZ3-CG2 3.66Å; W55-V160 VanDerWaalsContact CZ3-O 3.3Å; W55-V160 WeakPolarHBondContact CZ3-O 3.42Å; W55-F201 AromaticContact CE2-CZ 3.98Å; W55-F201 AromaticContact CH2-CD1 3.86Å; W55-F201 HydrophobicContact CH2-CD1 3.86Å; W55-F201 AromaticContact CH2-CE1 3.88Å; W55-F201 HydrophobicContact CH2-CE1 3.88Å; W55-F201 HydrophobicContact CH2-CG 4.42Å; W55-F201 HydrophobicContact CH2-CZ 4.41Å; W55-F201 AromaticContact CZ2-CD1 3.7Å; W55-F201 HydrophobicContact CZ2-CD1 3.7Å; W55-F201 HydrophobicContact CZ2-CD2 4.19Å; W55-F201 AromaticContact CZ2-CE1 3.37Å; W55-F201 HydrophobicContact CZ2-CE1 3.37Å; W55-F201 AromaticContact CZ2-CE2 3.86Å; W55-F201 HydrophobicContact CZ2-CE2 3.86Å; W55-F201 HydrophobicContact CZ2-CG 4.13Å; W55-F201 AromaticContact CZ2-CZ 3.46Å; W55-F201 HydrophobicContact CZ2-CZ 3.46Å; W55-F201 VanDerWaalsContact CZ2-CZ 3.46Å; W55-M240 HydrophobicContact CB-CE 3.77Å; W55-M240 HydrophobicContact CB-CG 3.99Å; W55-M240 HydrophobicContact CD2-CE 3.26Å; W55-M240 HydrophobicContact CE3-CE 3.68Å; W55-M240 HydrophobicContact CG-CE 3.31Å; W55-M240 HydrophobicContact CG-CG 4.35Å; W55-M240 HydrophobicContact CZ2-CE 4.3Å; W55-M240 HydrophobicContact CZ3-CE 4.34Å; W55-M240 PolarHBondContact N-O 2.79Å
56	S	97.1	Very high	96.3	Very high	32 Å²	32	45.3 Å²	45.3	22%	0.224	24%	0.243	C	C	.	.			trans	-122	157.6	178.9	76.1	0	0	0	0	110.4	M54 T58 S59 F60	M54-S56 PolarHBondContact O-N 3.02Å; S56-T58 PolarHBondContact O-N 2.98Å; S56-T58 PolarHBondContact OG-N 3.16Å; S56-S59 PolarHBondContact N-OG 3.08Å; S56-S59 PolarHBondContact O-N 3.03Å; S56-S59 PolarHBondContact O-OG 2.74Å; S56-S59 PolarHBondContact OG-N 3.34Å; S56-S59 VanDerWaalsContact OG-N 3.09Å; S56-S59 PolarHBondContact OG-OG 3.18Å; S56-F60 PolarHBondContact O-N 2.01Å
57	Q	95	Very high	96.1	Very high	112 Å²	112	48.7 Å²	48.7	52%	0.523	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-26.1	174	-169.9	175.3	7.7	0	0	112.2	P61 Y64	Q57-P61 WeakPolarHBondContact O-CA 3.43Å; Q57-P61 VanDerWaalsContact O-CB 3.25Å; Q57-P61 WeakPolarHBondContact O-CB 3.44Å; Q57-Y64 HydrophobicContact CB-CD1 3.93Å; Q57-Y64 HydrophobicContact CB-CD2 4.29Å; Q57-Y64 HydrophobicContact CB-CE1 4.29Å; Q57-Y64 HydrophobicContact CB-CG 3.92Å; Q57-Y64 HydrophobicContact CG-CD1 4.31Å; Q57-Y64 HydrophobicContact CG-CG 4.21Å
58	T	94.1	Very high	95.7	Very high	134 Å²	134	58 Å²	58	82%	0.822	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-44.1	177.5	-52.2	0	0	0	0	111.9	S56	S56-T58 PolarHBondContact O-N 2.98Å; S56-T58 PolarHBondContact OG-N 3.16Å
59	S	93.4	Very high	95.6	Very high	36 Å²	36	59.3 Å²	59.3	25%	0.252	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-33.7	179.9	48	0	0	0	0	112.7	M54 S56	M54-S59 PolarHBondContact O-OG 3.22Å; M54-S59 VanDerWaalsContact O-OG 3.1Å; S56-S59 PolarHBondContact N-OG 3.08Å; S56-S59 PolarHBondContact O-N 3.03Å; S56-S59 PolarHBondContact O-OG 2.74Å; S56-S59 PolarHBondContact OG-N 3.34Å; S56-S59 VanDerWaalsContact OG-N 3.09Å; S56-S59 PolarHBondContact OG-OG 3.18Å
60	F	96.7	Very high	95.5	Very high	1 Å²	1	62.1 Å²	62.1	0%	0.004	32%	0.316	C	S	.	.			trans	-132.3	73.2	-179.7	-59.6	-89	0	0	0	110.8	W55 S56 K62 F229 Y231 L237 P238 M240	W55-F60 AromaticContact CD1-CD2 3.75Å; W55-F60 AromaticContact CD1-CG 3.96Å; S56-F60 PolarHBondContact O-N 2.01Å; F60-K62 VanDerWaalsContact C-N 3.34Å; F60-K62 PolarHBondContact O-N 3.45Å; F60-F229 HydrophobicContact CD1-CD1 4.02Å; F60-F229 AromaticContact CD1-CE1 3.86Å; F60-F229 HydrophobicContact CD1-CE1 3.86Å; F60-F229 HydrophobicContact CE1-CD1 4.13Å; F60-F229 AromaticContact CE1-CE1 3.99Å; F60-F229 HydrophobicContact CE1-CE1 3.99Å; F60-Y231 WeakPolarHBondContact CA-OH 3.42Å; F60-Y231 HydrophobicContact CD1-CE2 4.38Å; F60-L237 HydrophobicContact CE1-CB 4.44Å; F60-L237 HydrophobicContact CE1-CD2 4.32Å; F60-P238 HydrophobicContact CE1-CG 4.07Å; F60-P238 HydrophobicContact CE2-CG 4.08Å; F60-P238 HydrophobicContact CZ-CG 3.72Å; F60-P238 WeakPolarHBondContact CZ-O 3.36Å; F60-M240 HydrophobicContact CD2-CG 4.48Å; F60-M240 HydrophobicContact CE2-CB 4.02Å; F60-M240 HydrophobicContact CE2-CG 3.83Å; F60-M240 HydrophobicContact CZ-CB 3.76Å; F60-M240 HydrophobicContact CZ-CG 3.87Å
61	P	93.5	Very high	95.5	Very high	76 Å²	76	61 Å²	61	49%	0.494	31%	0.31	S	S	.	.			trans	-72.3	-23.8	-174.3	26.4	-34.6	0	0	0	114.2	Q57 Q63 Y231	Q57-P61 WeakPolarHBondContact O-CA 3.43Å; Q57-P61 VanDerWaalsContact O-CB 3.25Å; Q57-P61 WeakPolarHBondContact O-CB 3.44Å; P61-Q63 PolarHBondContact O-N 2.79Å; P61-Y231 HydrophobicContact CG-CE1 4.31Å
62	K	91.1	Very high	95.4	Very high	52 Å²	52	63.4 Å²	63.4	23%	0.226	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	116.7	-175.7	-167.9	-178.8	-177	-172.1	0	109.6	F60 Y64 P225 N227 Y230 Y231	F60-K62 VanDerWaalsContact C-N 3.34Å; F60-K62 PolarHBondContact O-N 3.45Å; K62-Y64 PolarHBondContact O-N 3.36Å; K62-Y64 VanDerWaalsContact O-N 3.11Å; K62-P225 WeakPolarHBondContact CE-O 3.36Å; K62-P225 PolarHBondContact NZ-O 3.42Å; K62-N227 WeakPolarHBondContact CE-O 3.37Å; K62-N227 PolarHBondContact NZ-O 2.76Å; K62-Y230 PolarHBondContact NZ-O 2.75Å; K62-Y231 HydrophobicContact CB-CE1 3.71Å; K62-Y231 HydrophobicContact CB-CE2 4.42Å; K62-Y231 WeakPolarHBondContact CB-OH 3Å; K62-Y231 PolarHBondContact N-OH 2.76Å
63	Q	93.8	Very high	95.4	Very high	88 Å²	88	62.1 Å²	62.1	41%	0.411	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	27.4	175.5	-60.2	165.9	-29.8	0	0	114.1	P61 P65 F201 A226 S228	P61-Q63 PolarHBondContact O-N 2.79Å; Q63-P65 WeakPolarHBondContact O-CD 2.93Å; Q63-P65 VanDerWaalsContact O-N 3.12Å; Q63-F201 HydrophobicContact CB-CD2 4.32Å; Q63-F201 WeakPolarHBondContact O-CD2 3.47Å; Q63-A226 PolarHBondContact NE2-O 2.87Å; Q63-A226 PolarHBondContact OE1-O 3.39Å; Q63-S228 PolarHBondContact OE1-OG 2.95Å
64	Y	97.6	Very high	95.4	Very high	44 Å²	44	62.3 Å²	62.3	17%	0.173	31%	0.314	C	S	.	.			trans	-53.1	119.2	179.4	-172.6	-93.4	0	0	0	110.7	W55 Q57 K62 I66 A71	W55-Y64 AromaticContact CD1-CD2 3.91Å; W55-Y64 AromaticContact CD1-CE2 3.66Å; W55-Y64 HydrophobicContact CD2-CE2 4.17Å; W55-Y64 AromaticContact CE2-CE2 3.99Å; W55-Y64 AromaticContact CG-CE2 3.98Å; W55-Y64 HydrophobicContact CG-CE2 3.98Å; W55-Y64 AromaticContact NE1-CD2 3.53Å; W55-Y64 AromaticContact NE1-CE2 3.63Å; W55-Y64 PolarHBondContact O-OH 3.26Å; Q57-Y64 HydrophobicContact CB-CD1 3.93Å; Q57-Y64 HydrophobicContact CB-CD2 4.29Å; Q57-Y64 HydrophobicContact CB-CE1 4.29Å; Q57-Y64 HydrophobicContact CB-CG 3.92Å; Q57-Y64 HydrophobicContact CG-CD1 4.31Å; Q57-Y64 HydrophobicContact CG-CG 4.21Å; K62-Y64 PolarHBondContact O-N 3.36Å; K62-Y64 VanDerWaalsContact O-N 3.11Å; Y64-I66 HydrophobicContact CD1-CG1 4.08Å; Y64-I66 PolarHBondContact O-N 2.71Å; Y64-A71 HydrophobicContact CE1-CB 3.88Å; Y64-A71 HydrophobicContact CE2-CB 3.83Å; Y64-A71 VanDerWaalsContact CZ-CB 3.46Å; Y64-A71 WeakPolarHBondContact OH-CB 3.38Å
65	P	96.6	Very high	95.4	Very high	15 Å²	15	60.6 Å²	60.6	10%	0.097	31%	0.308	C	S	.	.			trans	-69.4	117	-176.1	-23.9	36.2	0	0	0	112.1	W55 Q63 A71 P161 F201	W55-P65 HydrophobicContact CH2-CG 3.87Å; W55-P65 HydrophobicContact CZ2-CG 3.86Å; Q63-P65 WeakPolarHBondContact O-CD 2.93Å; Q63-P65 VanDerWaalsContact O-N 3.12Å; P65-A71 HydrophobicContact CB-CB 4.41Å; P65-A71 WeakPolarHBondContact O-CB 3.11Å; P65-A71 PolarHBondContact O-N 3.28Å; P65-P161 HydrophobicContact CB-CG 3.97Å; P65-P161 HydrophobicContact CG-CG 4Å; P65-F201 HydrophobicContact CG-CB 3.63Å; P65-F201 HydrophobicContact CG-CD1 4.48Å; P65-F201 HydrophobicContact CG-CD2 3.8Å; P65-F201 HydrophobicContact CG-CG 3.74Å
66	I	94.7	Very high	95.4	Very high	116 Å²	116	60.6 Å²	60.6	60%	0.595	31%	0.308	S	S	*	.			trans	-103.8	-22.8	-179.8	-60.3	167.8	0	0	0	111.4	Y64	Y64-I66 HydrophobicContact CD1-CG1 4.08Å; Y64-I66 PolarHBondContact O-N 2.71Å
67	Y	90.3	Very high	95.4	Very high	161 Å²	161	59.2 Å²	59.2	63%	0.631	30%	0.298	S	S	*	.	S	Bend	trans	-152.8	145.9	-173.6	-176.3	-118.3	0	0	0	112.6	P69	Y67-P69 CarbonylContact C-O 3.59Å
68	R	89	Confident	95.5	Very high	195 Å²	195	53.9 Å²	53.9	74%	0.736	27%	0.273	S	S	*	.	S	Bend	trans	47.3	72.8	176.6	-73.3	-170.8	-62	-141.7	1.7	116.1
69	P	94.5	Very high	95.7	Very high	52 Å²	52	47.5 Å²	47.5	34%	0.338	23%	0.234	S	C	.	.	S	Bend	cis	-85.7	161	-19.6	32.8	-31.4	0	0	0	111.7	Y67 V160 P161	Y67-P69 CarbonylContact C-O 3.59Å; P69-V160 HydrophobicContact CG-CG1 4.09Å; P69-P161 HydrophobicContact CG-CB 3.91Å; P69-P161 HydrophobicContact CG-CG 4.06Å
70	P	96.7	Very high	95.8	Very high	59 Å²	59	45.8 Å²	45.8	38%	0.383	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-63.8	158.5	167.2	29.7	-34.5	0	0	0	111.3	Q72	P70-Q72 PolarHBondContact O-N 3.12Å
71	A	98	Very high	95.7	Very high	3 Å²	3	45.8 Å²	45.8	3%	0.025	22%	0.222	C	C	.	.	S	Bend	trans	-53.9	122.6	174.1	0	0	0	0	0	110.7	W55 Y64 P65 G135 G136 V160	W55-A71 HydrophobicContact CD2-CB 3.94Å; W55-A71 HydrophobicContact CE3-CB 3.67Å; W55-A71 HydrophobicContact CH2-CB 3.69Å; W55-A71 HydrophobicContact CZ2-CB 3.96Å; W55-A71 HydrophobicContact CZ3-CB 3.53Å; Y64-A71 HydrophobicContact CE1-CB 3.88Å; Y64-A71 HydrophobicContact CE2-CB 3.83Å; Y64-A71 VanDerWaalsContact CZ-CB 3.46Å; Y64-A71 WeakPolarHBondContact OH-CB 3.38Å; P65-A71 HydrophobicContact CB-CB 4.41Å; P65-A71 WeakPolarHBondContact O-CB 3.11Å; P65-A71 PolarHBondContact O-N 3.28Å; A71-G135 CarbonylContact O-C 3.57Å; A71-G135 WeakPolarHBondContact O-CA 3.37Å; A71-G136 PolarHBondContact O-N 3.38Å; A71-V160 WeakPolarHBondContact CA-O 3.49Å
72	Q	98.2	Very high	95.7	Very high	51 Å²	51	42.7 Å²	42.7	24%	0.238	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	-177.9	-176.6	68.8	-174.3	56.5	0	0	110.7	P70 L133 V160	P70-Q72 PolarHBondContact O-N 3.12Å; Q72-L133 WeakPolarHBondContact CB-O 3.5Å; Q72-V160 HydrophobicContact CG-CB 3.61Å; Q72-V160 HydrophobicContact CG-CG1 3.59Å; Q72-V160 PolarHBondContact N-O 2.9Å; Q72-V160 PolarHBondContact O-N 3.06Å
73	W	98.6	Very high	95.9	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	143.8	-179.4	-54.2	89.6	0	0	0	110.7	F51 W55 L133 G135 G136 M140 V157 I159 L167 M240	F51-W73 HydrophobicContact CE1-CD2 4.02Å; F51-W73 HydrophobicContact CE1-CE3 4.48Å; F51-W73 HydrophobicContact CE1-CG 4.12Å; F51-W73 AromaticContact CZ-CD2 3.91Å; F51-W73 HydrophobicContact CZ-CD2 3.91Å; F51-W73 AromaticContact CZ-CE3 3.95Å; F51-W73 HydrophobicContact CZ-CE3 3.95Å; F51-W73 HydrophobicContact CZ-CG 4.46Å; F51-W73 HydrophobicContact CZ-CH2 4.38Å; F51-W73 HydrophobicContact CZ-CZ2 4.32Å; F51-W73 HydrophobicContact CZ-CZ3 4.2Å; W55-W73 HydrophobicContact CB-CH2 4.32Å; W55-W73 HydrophobicContact CB-CZ2 3.61Å; W55-W73 HydrophobicContact CE3-CZ2 4.43Å; W73-L133 HydrophobicContact CB-CB 4.14Å; W73-L133 HydrophobicContact CG-CB 4.41Å; W73-L133 PolarHBondContact N-O 3.22Å; W73-L133 PolarHBondContact O-N 3.02Å; W73-G135 VanDerWaalsContact CD1-O 3.31Å; W73-G136 PolarHBondContact NE1-O 3.03Å; W73-M140 HydrophobicContact CB-CE 4.13Å; W73-V157 HydrophobicContact CB-CG1 3.99Å; W73-V157 HydrophobicContact CE3-CG1 4.01Å; W73-I159 HydrophobicContact CE3-CG1 4.37Å; W73-I159 HydrophobicContact CH2-CG1 4.27Å; W73-I159 HydrophobicContact CZ3-CG1 3.6Å; W73-L167 HydrophobicContact CE3-CD1 4.38Å; W73-L167 HydrophobicContact CH2-CD1 3.3Å; W73-L167 HydrophobicContact CH2-CG 3.99Å; W73-L167 HydrophobicContact CZ2-CD1 4.32Å; W73-L167 HydrophobicContact CZ3-CD1 3.34Å; W73-L167 HydrophobicContact CZ3-CG 3.63Å; W73-M240 HydrophobicContact CH2-CE 3.8Å; W73-M240 HydrophobicContact CH2-CG 3.86Å; W73-M240 HydrophobicContact CH2-SD 4Å; W73-M240 HydrophobicContact CZ2-CE 4.38Å; W73-M240 HydrophobicContact CZ2-CG 4.37Å
74	S	98.3	Very high	95.8	Very high	6 Å²	6	44.9 Å²	44.9	4%	0.042	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-64.5	172.8	168.3	73.6	0	0	0	0	111.1	F101 R158	S74-F101 WeakPolarHBondContact OG-CZ 3.25Å; S74-R158 PolarHBondContact N-O 2.92Å; S74-R158 VanDerWaalsContact N-O 3.16Å; S74-R158 PolarHBondContact OG-N 3.09Å
75	P	97.8	Very high	95.7	Very high	39 Å²	39	43.9 Å²	43.9	25%	0.253	22%	0.221	S	C	.	.	P	Polyproline II helix	trans	-52.6	149.5	160	-22.6	34.5	0	0	0	110.6	F101 A130 A132	P75-F101 WeakPolarHBondContact O-CZ 3.45Å; P75-A130 VanDerWaalsContact CA-O 3.31Å; P75-A130 WeakPolarHBondContact CA-O 3.29Å; P75-A130 WeakPolarHBondContact CB-O 3.34Å; P75-A132 HydrophobicContact CG-CB 4.01Å
76	L	98.2	Very high	95.7	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	132.1	170.4	178.3	154.4	0	0	0	108.6	L49 F51 F128 S129 A130 M140 F155 V157	L49-L76 HydrophobicContact CD2-CD1 3.65Å; F51-L76 HydrophobicContact CB-CD1 4.08Å; L76-F128 HydrophobicContact CD2-CD2 4.39Å; L76-F128 HydrophobicContact CD2-CE2 3.8Å; L76-S129 CarbonylContact O-C 3.55Å; L76-S129 WeakPolarHBondContact O-CA 3.44Å; L76-S129 PolarHBondContact O-OG 3.25Å; L76-A130 HydrophobicContact CB-CB 3.94Å; L76-A130 PolarHBondContact N-O 3.47Å; L76-A130 PolarHBondContact O-N 3.48Å; L76-M140 HydrophobicContact CB-SD 3.58Å; L76-M140 VanDerWaalsContact CB-SD 3.58Å; L76-M140 HydrophobicContact CD1-SD 4.43Å; L76-F155 HydrophobicContact CD1-CD2 3.7Å; L76-F155 HydrophobicContact CD1-CE2 4.09Å; L76-F155 HydrophobicContact CD1-CG 4.18Å; L76-F155 HydrophobicContact CD2-CB 4.02Å; L76-F155 HydrophobicContact CD2-CG 4.46Å; L76-F155 HydrophobicContact CG-CB 4.27Å; L76-F155 HydrophobicContact CG-CD2 4.01Å; L76-F155 HydrophobicContact CG-CG 4.37Å; L76-V157 HydrophobicContact CB-CG2 3.69Å; L76-V157 HydrophobicContact CD1-CG2 3.68Å; L76-V157 HydrophobicContact CG-CG2 3.65Å
77	I	98.2	Very high	95.7	Very high	3 Å²	3	40.9 Å²	40.9	2%	0.015	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	121	172	-54.4	-59.9	0	0	0	107.9	F101 A107 L110 L127 F155 I156	I77-F101 HydrophobicContact CG1-CD2 4.29Å; I77-F101 HydrophobicContact CG1-CE2 3.58Å; I77-F101 HydrophobicContact CG1-CZ 3.92Å; I77-A107 HydrophobicContact CD1-CB 3.89Å; I77-A107 HydrophobicContact CG1-CB 3.98Å; I77-L110 HydrophobicContact CB-CD2 4.45Å; I77-L110 HydrophobicContact CG2-CD2 4.22Å; I77-L127 HydrophobicContact CG2-CD1 3.84Å; I77-F155 CarbonylContact O-C 3.53Å; I77-F155 WeakPolarHBondContact O-CA 2.77Å; I77-F155 VanDerWaalsContact O-CB 3.32Å; I77-F155 WeakPolarHBondContact O-CB 3.26Å; I77-I156 HydrophobicContact CB-CG2 4.21Å; I77-I156 PolarHBondContact N-O 3.29Å; I77-I156 PolarHBondContact O-N 3.42Å
78	G	97.3	Very high	96.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	148.8	-176.4	0	0	0	0	0	112.2	F128 S154	G78-F128 VanDerWaalsContact C-CE1 3.42Å; G78-F128 PolarHBondContact N-O 3.02Å; G78-F128 WeakPolarHBondContact O-CD1 3.48Å; G78-F128 PolarHBondContact O-N 3.22Å; G78-S154 CarbonylContact C-O 3.56Å; G78-S154 WeakPolarHBondContact CA-O 3.45Å
79	V	97	Very high	96.5	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	137.6	-177.6	-173.7	0	0	0	0	109.5	H81 Y85 I87 V114 V124 G126 L127 S154	V79-H81 HydrophobicContact CG1-CB 4.31Å; V79-H81 PolarHBondContact O-CD2 3.39Å; V79-Y85 HydrophobicContact CG1-CD1 4.5Å; V79-Y85 HydrophobicContact CG1-CE1 4.16Å; V79-I87 HydrophobicContact CB-CD1 3.71Å; V79-I87 HydrophobicContact CB-CG1 4.16Å; V79-I87 HydrophobicContact CG2-CD1 3.42Å; V79-I87 VanDerWaalsContact CG2-CD1 3.42Å; V79-I87 HydrophobicContact CG2-CG1 3.92Å; V79-V114 HydrophobicContact CB-CG1 4.48Å; V79-V114 HydrophobicContact CG1-CG1 3.82Å; V79-V114 HydrophobicContact CG2-CB 4.45Å; V79-V114 HydrophobicContact CG2-CG1 3.71Å; V79-V114 HydrophobicContact CG2-CG2 3.79Å; V79-V124 HydrophobicContact CG1-CB 4.31Å; V79-V124 HydrophobicContact CG1-CG1 3.42Å; V79-V124 VanDerWaalsContact CG1-CG1 3.42Å; V79-V124 HydrophobicContact CG1-CG2 4.02Å; V79-G126 CarbonylContact C-O 3.57Å; V79-G126 VanDerWaalsContact CA-O 3.29Å; V79-G126 WeakPolarHBondContact CA-O 3.46Å; V79-G126 WeakPolarHBondContact CG1-O 3.42Å; V79-L127 HydrophobicContact CG2-CD1 3.9Å; V79-S154 PolarHBondContact N-O 3.02Å; V79-S154 PolarHBondContact O-N 3.02Å
80	T	96.1	Very high	96.7	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.006	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	127.8	166.1	54	0	0	0	0	110	Y125 G126 F128 F144 E145 V146 F152 L153	T80-Y125 PolarHBondContact O-N 2.89Å; T80-G126 PolarHBondContact N-O 2.87Å; T80-G126 PolarHBondContact O-N 2.91Å; T80-G126 PolarHBondContact OG1-N 3.17Å; T80-F128 HydrophobicContact CG2-CE1 4.44Å; T80-F144 HydrophobicContact CG2-CD2 3.42Å; T80-F144 VanDerWaalsContact CG2-CD2 3.42Å; T80-F144 HydrophobicContact CG2-CE2 3.92Å; T80-F144 HydrophobicContact CG2-CG 4.28Å; T80-E145 WeakPolarHBondContact CG2-O 3.49Å; T80-E145 PolarHBondContact OG1-O 2.66Å; T80-V146 HydrophobicContact CG2-CG1 3.59Å; T80-F152 WeakPolarHBondContact CA-O 3.15Å; T80-L153 HydrophobicContact CG2-CD1 4.41Å
81	H	95.4	Very high	96.7	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	169.9	-165.6	63.4	90.1	0	0	0	113.1	V79 Y85 S123 V124 H150 F152 S154 S171	V79-H81 HydrophobicContact CG1-CB 4.31Å; V79-H81 PolarHBondContact O-CD2 3.39Å; H81-Y85 HydrophobicContact CB-CD1 3.83Å; H81-Y85 HydrophobicContact CB-CG 4.46Å; H81-Y85 PolarHBondContact CE1-O 2.78Å; H81-Y85 AromaticContact CG-CD1 3.88Å; H81-Y85 PolarHBondContact ND1-O 3.36Å; H81-S123 CarbonylContact C-O 3.58Å; H81-S123 WeakPolarHBondContact CA-O 3.39Å; H81-S123 WeakPolarHBondContact CB-O 3.13Å; H81-V124 HydrophobicContact CB-CG2 4.26Å; H81-H150 CarbonylContact O-C 3.21Å; H81-H150 WeakPolarHBondContact O-CA 2.99Å; H81-F152 PolarHBondContact N-O 3.24Å; H81-F152 WeakPolarHBondContact O-CB 3.4Å; H81-F152 PolarHBondContact O-N 3.19Å; H81-F152 VanDerWaalsContact O-N 3.12Å; H81-S154 PolarHBondContact CE1-OG 3.24Å; H81-S154 VanDerWaalsContact NE2-CB 3.29Å; H81-S154 WeakPolarHBondContact NE2-CB 3.48Å; H81-S154 PolarHBondContact NE2-N 2.75Å; H81-S154 PolarHBondContact NE2-OG 3.28Å; H81-S171 PolarHBondContact CE1-OG 2.82Å
82	S	93.4	Very high	96.8	Very high	12 Å²	12	35.9 Å²	35.9	8%	0.084	18%	0.182	C	C	.	.			trans	-84.7	173.2	169	75.1	0	0	0	0	110.3	D84 Y85 S123 R149	S82-D84 PolarHBondContact O-N 3.36Å; S82-D84 VanDerWaalsContact O-N 3.07Å; S82-D84 PolarHBondContact OG-N 3.35Å; S82-D84 PolarHBondContact OG-OD2 3.03Å; S82-Y85 PolarHBondContact O-N 2.9Å; S82-S123 PolarHBondContact N-O 2.87Å; S82-S123 WeakPolarHBondContact OG-CA 3.17Å; S82-S123 WeakPolarHBondContact OG-CB 3.45Å; S82-R149 VanDerWaalsContact CB-O 3.3Å; S82-R149 WeakPolarHBondContact CB-O 3.35Å
83	S	93.4	Very high	96.8	Very high	71 Å²	71	39 Å²	39	50%	0.497	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-11.3	173.9	52.2	0	0	0	0	114.6	Y85 H86	S83-Y85 VanDerWaalsContact C-N 3.29Å; S83-H86 PolarHBondContact O-NE2 3.17Å
84	D	92.7	Very high	96.8	Very high	114 Å²	114	39.4 Å²	39.4	61%	0.61	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85	-3.6	-177	-48.8	-60.3	0	0	0	113.2	S82	S82-D84 PolarHBondContact O-N 3.36Å; S82-D84 VanDerWaalsContact O-N 3.07Å; S82-D84 PolarHBondContact OG-N 3.35Å; S82-D84 PolarHBondContact OG-OD2 3.03Å
85	Y	94.7	Very high	96.8	Very high	24 Å²	24	41.1 Å²	41.1	9%	0.094	21%	0.209	C	C	.	.			trans	-129.2	142.2	-178.5	-179.8	-103.7	0	0	0	111.3	V79 H81 S82 S83 I87 V114 A117 V124	V79-Y85 HydrophobicContact CG1-CD1 4.5Å; V79-Y85 HydrophobicContact CG1-CE1 4.16Å; H81-Y85 HydrophobicContact CB-CD1 3.83Å; H81-Y85 HydrophobicContact CB-CG 4.46Å; H81-Y85 PolarHBondContact CE1-O 2.78Å; H81-Y85 AromaticContact CG-CD1 3.88Å; H81-Y85 PolarHBondContact ND1-O 3.36Å; S82-Y85 PolarHBondContact O-N 2.9Å; S83-Y85 VanDerWaalsContact C-N 3.29Å; Y85-I87 HydrophobicContact CE1-CG1 3.74Å; Y85-V114 WeakPolarHBondContact OH-CG2 3.47Å; Y85-A117 HydrophobicContact CD2-CB 3.46Å; Y85-A117 VanDerWaalsContact CD2-CB 3.46Å; Y85-A117 HydrophobicContact CE2-CB 3.52Å; Y85-A117 HydrophobicContact CG-CB 4.33Å; Y85-V124 HydrophobicContact CD1-CG2 3.56Å; Y85-V124 HydrophobicContact CD2-CG2 4.22Å; Y85-V124 HydrophobicContact CE1-CG2 3.86Å; Y85-V124 HydrophobicContact CG-CG2 3.76Å
86	H	96.3	Very high	96.8	Very high	61 Å²	61	44.4 Å²	44.4	28%	0.282	23%	0.225	S	C	.	.			trans	-138.2	130	173.4	-63.3	-83.4	0	0	0	108.8	S83 Q89 D170 S171	S83-H86 PolarHBondContact O-NE2 3.17Å; H86-Q89 HydrophobicContact CB-CG 3.4Å; H86-Q89 VanDerWaalsContact CB-CG 3.4Å; H86-Q89 VanDerWaalsContact CD2-CD 3.41Å; H86-Q89 PolarHBondContact CD2-NE2 2.84Å; H86-Q89 VanDerWaalsContact CD2-NE2 3.25Å; H86-Q89 PolarHBondContact CE1-NE2 3.43Å; H86-Q89 VanDerWaalsContact CG-CG 3.46Å; H86-Q89 PolarHBondContact ND1-NE2 3.32Å; H86-Q89 PolarHBondContact NE2-NE2 2.91Å; H86-Q89 VanDerWaalsContact NE2-NE2 3.12Å; H86-D170 IonicContact CE1-OD1 3.84Å; H86-D170 IonicContact CG-OD1 3.66Å; H86-D170 IonicContact ND1-OD1 2.91Å; H86-D170 PolarHBondContact ND1-OD1 3.12Å; H86-D170 IonicContact ND1-OD2 3.86Å; H86-S171 PolarHBondContact CE1-OG 2.88Å; H86-S171 PolarHBondContact ND1-OG 3.12Å
87	I	96.1	Very high	96.8	Very high	6 Å²	6	44.4 Å²	44.4	3%	0.031	23%	0.225	C	C	.	.	S	Bend	trans	-67.2	-45.2	170.7	-57	177.2	0	0	0	108.9	V79 Y85 V98 L110 S154 I156	V79-I87 HydrophobicContact CB-CD1 3.71Å; V79-I87 HydrophobicContact CB-CG1 4.16Å; V79-I87 HydrophobicContact CG2-CD1 3.42Å; V79-I87 VanDerWaalsContact CG2-CD1 3.42Å; V79-I87 HydrophobicContact CG2-CG1 3.92Å; Y85-I87 HydrophobicContact CE1-CG1 3.74Å; I87-V98 HydrophobicContact CG2-CG2 4.36Å; I87-V98 WeakPolarHBondContact O-CG2 3.5Å; I87-L110 HydrophobicContact CG2-CD1 3.93Å; I87-L110 HydrophobicContact CG2-CD2 4.37Å; I87-S154 WeakPolarHBondContact CD1-O 3.16Å; I87-I156 HydrophobicContact CG2-CG2 4.37Å
88	W	98.4	Very high	96.8	Very high	13 Å²	13	44.2 Å²	44.2	5%	0.049	22%	0.224	C	C	.	.			trans	-155	155.6	178.1	64.5	-87.2	0	0	0	108.2	V98 F155 F166 G168 D170 Y191 V214	W88-V98 HydrophobicContact CB-CG1 4.48Å; W88-V98 HydrophobicContact CB-CG2 4.25Å; W88-F155 PolarHBondContact NE1-O 3.32Å; W88-F166 AromaticContact CD2-CE2 3.65Å; W88-F166 HydrophobicContact CD2-CE2 3.65Å; W88-F166 AromaticContact CD2-CZ 3.96Å; W88-F166 HydrophobicContact CD2-CZ 3.96Å; W88-F166 AromaticContact CE2-CE2 3.75Å; W88-F166 AromaticContact CE3-CE2 3.86Å; W88-F166 HydrophobicContact CE3-CE2 3.86Å; W88-F166 AromaticContact CE3-CZ 3.88Å; W88-F166 HydrophobicContact CE3-CZ 3.88Å; W88-F166 HydrophobicContact CG-CE2 4.11Å; W88-F166 HydrophobicContact CG-CZ 4.3Å; W88-F166 HydrophobicContact CH2-CE2 4.26Å; W88-F166 HydrophobicContact CZ2-CE2 4.08Å; W88-F166 HydrophobicContact CZ3-CE2 4.15Å; W88-F166 HydrophobicContact CZ3-CZ 4.36Å; W88-G168 VanDerWaalsContact CZ2-C 3.46Å; W88-D170 HydrophobicContact CD2-CB 4.41Å; W88-D170 HydrophobicContact CH2-CB 4.26Å; W88-D170 HydrophobicContact CZ2-CB 4.06Å; W88-D170 HydrophobicContact CZ3-CB 4.5Å; W88-D170 WeakPolarHBondContact O-CB 3.21Å; W88-Y191 HydrophobicContact CH2-CD1 4.49Å; W88-Y191 HydrophobicContact CH2-CD2 4.09Å; W88-Y191 HydrophobicContact CH2-CE1 4.23Å; W88-Y191 AromaticContact CH2-CE2 3.79Å; W88-Y191 HydrophobicContact CH2-CE2 3.79Å; W88-Y191 HydrophobicContact CH2-CG 4.41Å; W88-Y191 AromaticContact CH2-CZ 3.85Å; W88-Y191 HydrophobicContact CZ3-CD1 4.05Å; W88-Y191 HydrophobicContact CZ3-CD2 4.4Å; W88-Y191 AromaticContact CZ3-CE1 3.95Å; W88-Y191 HydrophobicContact CZ3-CE1 3.95Å; W88-Y191 HydrophobicContact CZ3-CE2 4.29Å; W88-Y191 HydrophobicContact CZ3-CG 4.27Å; W88-V214 HydrophobicContact CE3-CG1 4.02Å; W88-V214 HydrophobicContact CZ3-CG1 4.27Å
89	Q	97.8	Very high	96.8	Very high	66 Å²	66	47.4 Å²	47.4	31%	0.308	24%	0.236	S	C	.	.			trans	-140.8	146	175.3	-53.8	-172.8	-83.5	0	0	110.8	H86 N91 E92 D170 V214	H86-Q89 HydrophobicContact CB-CG 3.4Å; H86-Q89 VanDerWaalsContact CB-CG 3.4Å; H86-Q89 VanDerWaalsContact CD2-CD 3.41Å; H86-Q89 PolarHBondContact CD2-NE2 2.84Å; H86-Q89 VanDerWaalsContact CD2-NE2 3.25Å; H86-Q89 PolarHBondContact CE1-NE2 3.43Å; H86-Q89 VanDerWaalsContact CG-CG 3.46Å; H86-Q89 PolarHBondContact ND1-NE2 3.32Å; H86-Q89 PolarHBondContact NE2-NE2 2.91Å; H86-Q89 VanDerWaalsContact NE2-NE2 3.12Å; Q89-N91 PolarHBondContact O-N 3.35Å; Q89-E92 HydrophobicContact CB-CB 4.09Å; Q89-E92 HydrophobicContact CB-CG 4.11Å; Q89-E92 PolarHBondContact O-N 3.18Å; Q89-D170 WeakPolarHBondContact CG-OD2 3.12Å; Q89-V214 WeakPolarHBondContact O-CB 3.14Å
90	R	97.7	Very high	96.9	Very high	110 Å²	110	50.8 Å²	50.8	42%	0.415	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	137.6	173	-175.9	-169.8	-67	-146.4	-5.8	109.8	E92 Y191 Q216	R90-E92 PolarHBondContact O-N 3.24Å; R90-Y191 HydrophobicContact CB-CE1 4.41Å; R90-Y191 HydrophobicContact CG-CE1 4.34Å; R90-Y191 PolarHBondContact NH2-OH 3.06Å; R90-Q216 VanDerWaalsContact NH2-CD 3.27Å
91	N	97.9	Very high	97	Very high	91 Å²	91	50.8 Å²	50.8	49%	0.487	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.7	17.4	-178.3	-52.3	-44.8	0	0	0	114.2	Q89 K213 V214	Q89-N91 PolarHBondContact O-N 3.35Å; N91-K213 WeakPolarHBondContact O-CD 3.44Å; N91-K213 WeakPolarHBondContact O-CE 3.24Å; N91-K213 WeakPolarHBondContact O-CG 3.45Å; N91-K213 PolarHBondContact O-NZ 3.08Å; N91-V214 PolarHBondContact N-O 3.39Å
92	E	98.4	Very high	97.2	Very high	86 Å²	86	50.8 Å²	50.8	40%	0.402	25%	0.252	S	S	.	.	S	Bend	trans	-116.3	164.3	168.4	-68.6	-55.7	144.2	0	0	111	Q89 R90 K213 V214	Q89-E92 HydrophobicContact CB-CB 4.09Å; Q89-E92 HydrophobicContact CB-CG 4.11Å; Q89-E92 PolarHBondContact O-N 3.18Å; R90-E92 PolarHBondContact O-N 3.24Å; E92-K213 CarbonylContact O-C 3.03Å; E92-K213 WeakPolarHBondContact O-CA 3.19Å; E92-K213 IonicContact OE1-NZ 3.68Å; E92-K213 IonicContact OE2-NZ 3.74Å; E92-V214 WeakPolarHBondContact O-CG2 3.48Å; E92-V214 PolarHBondContact O-N 3.04Å
93	F	98.6	Very high	97.4	Very high	117 Å²	117	51.1 Å²	51.1	51%	0.513	25%	0.252	S	S	.	.	B	Isolated β-bridge	trans	-75	137.6	179	-62.9	-74.3	0	0	0	110.7	Q211 K213	F93-Q211 HydrophobicContact CD1-CG 4.29Å; F93-Q211 VanDerWaalsContact CE1-O 3.32Å; F93-Q211 WeakPolarHBondContact CE1-O 3.49Å; F93-K213 HydrophobicContact CD1-CG 4.01Å; F93-K213 HydrophobicContact CD2-CG 4.47Å; F93-K213 HydrophobicContact CE1-CG 3.82Å; F93-K213 HydrophobicContact CE2-CG 4.31Å; F93-K213 HydrophobicContact CG-CG 4.34Å; F93-K213 HydrophobicContact CZ-CD 4.46Å; F93-K213 HydrophobicContact CZ-CG 3.99Å
94	A	98.4	Very high	97.5	Very high	8 Å²	8	53.9 Å²	53.9	7%	0.066	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-62.7	136.6	169.6	0	0	0	0	0	110.6	V98 A193 T195 Q211 V214	A94-V98 HydrophobicContact CB-CB 4Å; A94-V98 HydrophobicContact CB-CG1 3.71Å; A94-A193 HydrophobicContact CB-CB 4.4Å; A94-T195 HydrophobicContact CB-CG2 4.29Å; A94-Q211 PolarHBondContact O-NE2 2.81Å; A94-V214 HydrophobicContact CB-CG2 4.31Å
95	S	98.3	Very high	97.4	Very high	41 Å²	41	49.6 Å²	49.6	29%	0.287	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-65.8	170.4	168.9	74.4	0	0	0	0	111	G97 V98 R99 E113	S95-G97 VanDerWaalsContact C-N 3.28Å; S95-G97 PolarHBondContact O-N 3.06Å; S95-G97 PolarHBondContact OG-N 3.48Å; S95-V98 PolarHBondContact O-N 2.66Å; S95-V98 WeakPolarHBondContact OG-CG2 3.48Å; S95-V98 PolarHBondContact OG-N 3.4Å; S95-R99 WeakPolarHBondContact O-CB 3.5Å; S95-R99 PolarHBondContact O-N 2.92Å; S95-E113 VanDerWaalsContact CB-OE2 3.24Å; S95-E113 WeakPolarHBondContact CB-OE2 3.48Å; S95-E113 PolarHBondContact OG-OE2 2.92Å
96	N	98.1	Very high	97.3	Very high	108 Å²	108	54 Å²	54	58%	0.578	26%	0.259	S	S	*	.	H	α-helix	trans	-62.3	-39.1	174.2	-69.5	-30.1	0	0	0	111.2	R99 E100 T109	N96-R99 WeakPolarHBondContact O-CB 3.4Å; N96-R99 PolarHBondContact O-N 2.77Å; N96-E100 WeakPolarHBondContact O-CG 3.17Å; N96-E100 PolarHBondContact O-N 3.42Å; N96-T109 HydrophobicContact CB-CG2 4.49Å
97	G	97.9	Very high	97.1	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.1	-45.9	173.7	0	0	0	0	0	113.1	S95 R99 E100 F101 E113	S95-G97 VanDerWaalsContact C-N 3.28Å; S95-G97 PolarHBondContact O-N 3.06Å; S95-G97 PolarHBondContact OG-N 3.48Å; G97-R99 VanDerWaalsContact C-N 3.35Å; G97-E100 PolarHBondContact O-N 2.85Å; G97-F101 VanDerWaalsContact O-CB 3.29Å; G97-F101 WeakPolarHBondContact O-CB 3.34Å; G97-F101 PolarHBondContact O-N 3.4Å; G97-E113 PolarHBondContact N-OE1 3.04Å; G97-E113 PolarHBondContact N-OE2 3.46Å
98	V	98.6	Very high	97	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64.9	-40.7	176.5	174	0	0	0	0	110.9	I87 W88 A94 S95 F101 S102 L110 I156	I87-V98 HydrophobicContact CG2-CG2 4.36Å; I87-V98 WeakPolarHBondContact O-CG2 3.5Å; W88-V98 HydrophobicContact CB-CG1 4.48Å; W88-V98 HydrophobicContact CB-CG2 4.25Å; A94-V98 HydrophobicContact CB-CB 4Å; A94-V98 HydrophobicContact CB-CG1 3.71Å; S95-V98 PolarHBondContact O-N 2.66Å; S95-V98 WeakPolarHBondContact OG-CG2 3.48Å; S95-V98 PolarHBondContact OG-N 3.4Å; V98-F101 PolarHBondContact O-N 3.36Å; V98-S102 WeakPolarHBondContact O-CB 3.44Å; V98-S102 PolarHBondContact O-N 2.87Å; V98-S102 PolarHBondContact O-OG 2.81Å; V98-L110 HydrophobicContact CG2-CD1 3.88Å; V98-I156 HydrophobicContact CG1-CD1 3.96Å
99	R	98.5	Very high	96.8	Very high	67 Å²	67	59 Å²	59	25%	0.253	28%	0.281	S	S	.	.	H	α-helix	trans	-57.3	-54.5	175.5	176.3	173.1	179	-177.5	-5.4	111.8	S95 N96 G97 F101 S102 E103 T195 E207	S95-R99 WeakPolarHBondContact O-CB 3.5Å; S95-R99 PolarHBondContact O-N 2.92Å; N96-R99 WeakPolarHBondContact O-CB 3.4Å; N96-R99 PolarHBondContact O-N 2.77Å; G97-R99 VanDerWaalsContact C-N 3.35Å; R99-F101 VanDerWaalsContact C-N 3.33Å; R99-F101 PolarHBondContact O-N 2.85Å; R99-S102 PolarHBondContact O-N 2.89Å; R99-E103 VanDerWaalsContact CG-OE1 3.29Å; R99-E103 WeakPolarHBondContact CG-OE1 3.4Å; R99-E103 IonicContact CZ-OE1 2.63Å; R99-E103 IonicContact NE-OE1 2.71Å; R99-E103 PolarHBondContact NE-OE1 3.06Å; R99-E103 IonicContact NH2-OE1 2.98Å; R99-E103 WeakPolarHBondContact O-CB 3.09Å; R99-E103 WeakPolarHBondContact O-CG 3.3Å; R99-E103 PolarHBondContact O-N 2.63Å; R99-T195 HydrophobicContact CB-CG2 3.98Å; R99-T195 HydrophobicContact CG-CG2 3.76Å; R99-E207 IonicContact CZ-OE1 3.76Å; R99-E207 VanDerWaalsContact CZ-OE1 3.29Å; R99-E207 IonicContact NH1-OE1 3.27Å; R99-E207 PolarHBondContact NH1-OE1 3.47Å; R99-E207 VanDerWaalsContact NH2-CD 3.33Å; R99-E207 IonicContact NH2-OE1 4Å; R99-E207 PolarHBondContact NH2-OE1 3.37Å
100	E	98.1	Very high	96.7	Very high	71 Å²	71	55.8 Å²	55.8	33%	0.332	27%	0.267	S	S	.	.	H	α-helix	trans	-62.9	-41	-178.7	-72.8	-175.7	172.9	0	0	112.2	N96 G97 K104 T109	N96-E100 WeakPolarHBondContact O-CG 3.17Å; N96-E100 PolarHBondContact O-N 3.42Å; G97-E100 PolarHBondContact O-N 2.85Å; E100-K104 WeakPolarHBondContact O-CB 3.22Å; E100-K104 PolarHBondContact O-N 3.48Å; E100-T109 WeakPolarHBondContact OE2-CB 3.34Å; E100-T109 PolarHBondContact OE2-OG1 3.37Å
101	F	98.5	Very high	96.4	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-66.2	-46.9	177.1	-177.1	-96.7	0	0	0	111.7	S74 P75 I77 G97 V98 R99 E103 G105 E106 A107 L110 I156 R158	S74-F101 WeakPolarHBondContact OG-CZ 3.25Å; P75-F101 WeakPolarHBondContact O-CZ 3.45Å; I77-F101 HydrophobicContact CG1-CD2 4.29Å; I77-F101 HydrophobicContact CG1-CE2 3.58Å; I77-F101 HydrophobicContact CG1-CZ 3.92Å; G97-F101 VanDerWaalsContact O-CB 3.29Å; G97-F101 WeakPolarHBondContact O-CB 3.34Å; G97-F101 PolarHBondContact O-N 3.4Å; V98-F101 PolarHBondContact O-N 3.36Å; R99-F101 VanDerWaalsContact C-N 3.33Å; R99-F101 PolarHBondContact O-N 2.85Å; F101-E103 VanDerWaalsContact C-N 3.35Å; F101-E103 PolarHBondContact O-N 3.25Å; F101-G105 WeakPolarHBondContact O-CA 3.23Å; F101-G105 PolarHBondContact O-N 2.87Å; F101-E106 WeakPolarHBondContact CA-O 3.49Å; F101-E106 PolarHBondContact N-O 2.9Å; F101-A107 HydrophobicContact CD2-CB 3.88Å; F101-A107 HydrophobicContact CE2-CB 4.11Å; F101-L110 HydrophobicContact CB-CD2 4.18Å; F101-L110 HydrophobicContact CG-CD2 4.16Å; F101-I156 HydrophobicContact CD1-CD1 3.98Å; F101-I156 HydrophobicContact CD1-CG1 3.98Å; F101-I156 HydrophobicContact CD1-CG2 3.85Å; F101-I156 HydrophobicContact CE1-CB 4.19Å; F101-I156 HydrophobicContact CE1-CD1 4.37Å; F101-I156 HydrophobicContact CE1-CG1 3.85Å; F101-I156 HydrophobicContact CE1-CG2 3.64Å; F101-I156 HydrophobicContact CZ-CG2 4.29Å; F101-R158 HydrophobicContact CE1-CB 4.24Å; F101-R158 WeakPolarHBondContact O-CD 3.43Å
102	S	98.5	Very high	96.1	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-70.1	-27.1	-177.9	-68.6	0	0	0	0	113.1	V98 R99 R158 D164 F166	V98-S102 WeakPolarHBondContact O-CB 3.44Å; V98-S102 PolarHBondContact O-N 2.87Å; V98-S102 PolarHBondContact O-OG 2.81Å; R99-S102 PolarHBondContact O-N 2.89Å; S102-R158 VanDerWaalsContact O-CD 3.24Å; S102-R158 WeakPolarHBondContact O-CD 3.2Å; S102-R158 PolarHBondContact O-NH1 3.39Å; S102-D164 CarbonylContact O-C 3.19Å; S102-D164 WeakPolarHBondContact O-CA 3.46Å; S102-F166 WeakPolarHBondContact OG-CD1 3.36Å
103	E	98.4	Very high	95.9	Very high	19 Å²	19	49.3 Å²	49.3	9%	0.089	24%	0.237	C	C	.	.	H	α-helix	trans	-91.1	-35.9	177	-71.2	176.6	-160.3	0	0	113.6	R99 F101 R158 P163 D164 T195	R99-E103 VanDerWaalsContact CG-OE1 3.29Å; R99-E103 WeakPolarHBondContact CG-OE1 3.4Å; R99-E103 IonicContact CZ-OE1 2.63Å; R99-E103 IonicContact NE-OE1 2.71Å; R99-E103 PolarHBondContact NE-OE1 3.06Å; R99-E103 IonicContact NH2-OE1 2.98Å; R99-E103 WeakPolarHBondContact O-CB 3.09Å; R99-E103 WeakPolarHBondContact O-CG 3.3Å; R99-E103 PolarHBondContact O-N 2.63Å; F101-E103 VanDerWaalsContact C-N 3.35Å; F101-E103 PolarHBondContact O-N 3.25Å; E103-R158 PolarHBondContact O-NE 3.47Å; E103-R158 PolarHBondContact O-NH1 2.92Å; E103-R158 PolarHBondContact O-NH2 3.28Å; E103-P163 WeakPolarHBondContact CA-O 3.45Å; E103-D164 HydrophobicContact CG-CB 4Å; E103-T195 VanDerWaalsContact OE1-CB 3.28Å; E103-T195 WeakPolarHBondContact OE1-CB 3.21Å; E103-T195 PolarHBondContact OE1-OG1 2.92Å
104	K	94.6	Very high	95.6	Very high	129 Å²	129	43.9 Å²	43.9	56%	0.561	21%	0.213	S	C	*	.	H	α-helix	trans	-124.4	-16	-167.7	-59.6	172.6	-170.7	165.4	0	113.9	E100 E106	E100-K104 WeakPolarHBondContact O-CB 3.22Å; E100-K104 PolarHBondContact O-N 3.48Å; K104-E106 VanDerWaalsContact C-N 3.25Å; K104-E106 HydrophobicContact CB-CB 4.44Å; K104-E106 HydrophobicContact CB-CG 3.92Å
105	G	92.4	Very high	95	Very high	24 Å²	24	44.9 Å²	44.9	25%	0.247	22%	0.216	C	C	.	.			trans	78	10.9	-171.2	0	0	0	0	0	113.5	F101 A107	F101-G105 WeakPolarHBondContact O-CA 3.23Å; F101-G105 PolarHBondContact O-N 2.87Å; G105-A107 PolarHBondContact O-N 3.42Å
106	E	91.9	Very high	94.5	Very high	117 Å²	117	44.2 Å²	44.2	55%	0.547	21%	0.214	S	C	.	.			trans	-81.6	108.6	178.9	-67.6	-65.6	170.9	0	0	110.1	F101 K104	F101-E106 WeakPolarHBondContact CA-O 3.49Å; F101-E106 PolarHBondContact N-O 2.9Å; K104-E106 VanDerWaalsContact C-N 3.25Å; K104-E106 HydrophobicContact CB-CB 4.44Å; K104-E106 HydrophobicContact CB-CG 3.92Å
107	A	92.8	Very high	94	Very high	8 Å²	8	39.5 Å²	39.5	7%	0.066	19%	0.189	C	C	.	.			trans	-88.9	-12	-173.3	0	0	0	0	0	114.3	I77 F101 G105 T109 L110 M111	I77-A107 HydrophobicContact CD1-CB 3.89Å; I77-A107 HydrophobicContact CG1-CB 3.98Å; F101-A107 HydrophobicContact CD2-CB 3.88Å; F101-A107 HydrophobicContact CE2-CB 4.11Å; G105-A107 PolarHBondContact O-N 3.42Å; A107-T109 PolarHBondContact O-N 3.29Å; A107-L110 WeakPolarHBondContact O-CB 3.45Å; A107-L110 PolarHBondContact O-N 3.43Å; A107-M111 HydrophobicContact CB-CG 4.46Å; A107-M111 HydrophobicContact CB-SD 4.25Å; A107-M111 VanDerWaalsContact O-CG 3.26Å; A107-M111 WeakPolarHBondContact O-CG 3.32Å; A107-M111 PolarHBondContact O-N 2.95Å
108	W	92.3	Very high	93.4	Very high	138 Å²	138	40.2 Å²	40.2	52%	0.523	20%	0.197	S	C	.	.	H	α-helix	trans	-57.3	-50.9	-169.2	176.4	-100.2	0	0	0	113.4	L110 M111 K112 A290	W108-L110 VanDerWaalsContact C-N 3.34Å; W108-L110 PolarHBondContact O-N 2.94Å; W108-M111 PolarHBondContact O-N 2.85Å; W108-K112 HydrophobicContact CZ2-CD 4.37Å; W108-K112 HydrophobicContact CZ2-CG 4.49Å; W108-K112 WeakPolarHBondContact O-CG 3.49Å; W108-K112 PolarHBondContact O-N 3.09Å; W108-A290 HydrophobicContact CH2-CB 4.43Å; W108-A290 HydrophobicContact CZ3-CB 4.05Å
109	T	94.8	Very high	92.6	Very high	38 Å²	38	47.1 Å²	47.1	23%	0.233	23%	0.229	C	C	.	.	H	α-helix	trans	-63.7	-41.7	-179.5	-56.8	0	0	0	0	111.2	N96 E100 A107 M111 K112 E113	N96-T109 HydrophobicContact CB-CG2 4.49Å; E100-T109 WeakPolarHBondContact OE2-CB 3.34Å; E100-T109 PolarHBondContact OE2-OG1 3.37Å; A107-T109 PolarHBondContact O-N 3.29Å; T109-M111 PolarHBondContact O-N 2.81Å; T109-K112 PolarHBondContact O-N 3.46Å; T109-E113 WeakPolarHBondContact O-CG 3.43Å; T109-E113 PolarHBondContact O-N 3Å
110	L	95.5	Very high	91.5	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-59.4	-46.6	175.2	-177.2	60.7	0	0	0	111.7	I77 I87 V98 F101 A107 W108 K112 E113 V114 I156	I77-L110 HydrophobicContact CB-CD2 4.45Å; I77-L110 HydrophobicContact CG2-CD2 4.22Å; I87-L110 HydrophobicContact CG2-CD1 3.93Å; I87-L110 HydrophobicContact CG2-CD2 4.37Å; V98-L110 HydrophobicContact CG2-CD1 3.88Å; F101-L110 HydrophobicContact CB-CD2 4.18Å; F101-L110 HydrophobicContact CG-CD2 4.16Å; A107-L110 WeakPolarHBondContact O-CB 3.45Å; A107-L110 PolarHBondContact O-N 3.43Å; W108-L110 VanDerWaalsContact C-N 3.34Å; W108-L110 PolarHBondContact O-N 2.94Å; L110-K112 VanDerWaalsContact C-N 3.3Å; L110-K112 PolarHBondContact O-N 2.75Å; L110-E113 WeakPolarHBondContact O-CB 3.45Å; L110-E113 PolarHBondContact O-N 2.67Å; L110-V114 VanDerWaalsContact O-CG2 3.32Å; L110-V114 WeakPolarHBondContact O-CG2 3.08Å; L110-V114 PolarHBondContact O-N 2.75Å; L110-I156 HydrophobicContact CD2-CG2 3.84Å
111	M	92.2	Very high	90.3	Very high	13 Å²	13	55.4 Å²	55.4	6%	0.064	26%	0.264	C	S	.	.	H	α-helix	trans	-60.9	-41	177.5	-66.9	172.9	69.9	0	0	111.3	A107 W108 T109 E113 V114 E115 L127 Y312	A107-M111 HydrophobicContact CB-CG 4.46Å; A107-M111 HydrophobicContact CB-SD 4.25Å; A107-M111 VanDerWaalsContact O-CG 3.26Å; A107-M111 WeakPolarHBondContact O-CG 3.32Å; A107-M111 PolarHBondContact O-N 2.95Å; W108-M111 PolarHBondContact O-N 2.85Å; T109-M111 PolarHBondContact O-N 2.81Å; M111-E113 VanDerWaalsContact C-N 3.31Å; M111-E113 PolarHBondContact O-N 3.46Å; M111-V114 WeakPolarHBondContact O-CB 3.46Å; M111-V114 PolarHBondContact O-N 2.98Å; M111-E115 WeakPolarHBondContact O-CB 3.14Å; M111-E115 WeakPolarHBondContact O-CG 3.48Å; M111-E115 PolarHBondContact O-N 2.02Å; M111-L127 HydrophobicContact CB-CD2 4.17Å; M111-L127 HydrophobicContact CE-CD2 3.62Å; M111-L127 HydrophobicContact CG-CD2 3.98Å; M111-Y312 HydrophobicContact CE-CD1 4.25Å; M111-Y312 HydrophobicContact CE-CE1 3.68Å; M111-Y312 HydrophobicContact SD-CE1 3.63Å
112	K	91.8	Very high	89.6	Confident	82 Å²	82	61.1 Å²	61.1	36%	0.357	29%	0.291	S	S	.	.	H	α-helix	trans	-63	-35.6	176.3	-69.7	-71.9	158.4	-143.4	0	113.2	W108 T109 L110 E115 A116	W108-K112 HydrophobicContact CZ2-CD 4.37Å; W108-K112 HydrophobicContact CZ2-CG 4.49Å; W108-K112 WeakPolarHBondContact O-CG 3.49Å; W108-K112 PolarHBondContact O-N 3.09Å; T109-K112 PolarHBondContact O-N 3.46Å; L110-K112 VanDerWaalsContact C-N 3.3Å; L110-K112 PolarHBondContact O-N 2.75Å; K112-E115 IonicContact NZ-OE1 2.87Å; K112-E115 PolarHBondContact NZ-OE1 2.71Å; K112-E115 IonicContact NZ-OE2 3.89Å; K112-E115 PolarHBondContact NZ-OE2 2.58Å; K112-A116 WeakPolarHBondContact O-CB 3.43Å; K112-A116 PolarHBondContact O-N 3.32Å
113	E	94	Very high	89	Confident	56 Å²	56	61.1 Å²	61.1	26%	0.262	29%	0.291	S	S	.	.	H	α-helix	trans	-66.2	-44.3	174.2	-69.6	173.5	173.1	0	0	111.6	S95 G97 T109 L110 M111 A116 A117	S95-E113 VanDerWaalsContact CB-OE2 3.24Å; S95-E113 WeakPolarHBondContact CB-OE2 3.48Å; S95-E113 PolarHBondContact OG-OE2 2.92Å; G97-E113 PolarHBondContact N-OE1 3.04Å; G97-E113 PolarHBondContact N-OE2 3.46Å; T109-E113 WeakPolarHBondContact O-CG 3.43Å; T109-E113 PolarHBondContact O-N 3Å; L110-E113 WeakPolarHBondContact O-CB 3.45Å; L110-E113 PolarHBondContact O-N 2.67Å; M111-E113 VanDerWaalsContact C-N 3.31Å; M111-E113 PolarHBondContact O-N 3.46Å; E113-A116 PolarHBondContact O-N 3.46Å; E113-A117 PolarHBondContact O-N 3.06Å; E113-A117 VanDerWaalsContact O-N 3.08Å
114	V	92.1	Very high	88.5	Confident	2 Å²	2	60.8 Å²	60.8	1%	0.012	29%	0.29	C	S	.	.	H	α-helix	trans	-59.7	-46.7	176	176.1	0	0	0	0	110.9	V79 Y85 L110 M111 A116 A117 G118 V124 L127	V79-V114 HydrophobicContact CB-CG1 4.48Å; V79-V114 HydrophobicContact CG1-CG1 3.82Å; V79-V114 HydrophobicContact CG2-CB 4.45Å; V79-V114 HydrophobicContact CG2-CG1 3.71Å; V79-V114 HydrophobicContact CG2-CG2 3.79Å; Y85-V114 WeakPolarHBondContact OH-CG2 3.47Å; L110-V114 VanDerWaalsContact O-CG2 3.32Å; L110-V114 WeakPolarHBondContact O-CG2 3.08Å; L110-V114 PolarHBondContact O-N 2.75Å; M111-V114 WeakPolarHBondContact O-CB 3.46Å; M111-V114 PolarHBondContact O-N 2.98Å; V114-A116 PolarHBondContact O-N 3.41Å; V114-A117 WeakPolarHBondContact O-CB 3.43Å; V114-A117 PolarHBondContact O-N 3.28Å; V114-G118 PolarHBondContact O-N 3.42Å; V114-V124 HydrophobicContact CG1-CG1 3.8Å; V114-V124 HydrophobicContact CG1-CG2 4.28Å; V114-L127 HydrophobicContact CG1-CB 4.47Å; V114-L127 HydrophobicContact CG1-CD1 4.33Å
115	E	85.9	Confident	88.2	Confident	29 Å²	29	56.6 Å²	56.6	14%	0.136	27%	0.271	C	S	.	.	H	α-helix	trans	-59.2	-46.7	178	-70.6	171.1	-163.9	0	0	111.6	M111 K112 A117 G118 E119 P293	M111-E115 WeakPolarHBondContact O-CB 3.14Å; M111-E115 WeakPolarHBondContact O-CG 3.48Å; M111-E115 PolarHBondContact O-N 2.02Å; K112-E115 IonicContact NZ-OE1 2.87Å; K112-E115 PolarHBondContact NZ-OE1 2.71Å; K112-E115 IonicContact NZ-OE2 3.89Å; K112-E115 PolarHBondContact NZ-OE2 2.58Å; E115-A117 VanDerWaalsContact C-N 3.26Å; E115-A117 PolarHBondContact O-N 3.39Å; E115-G118 PolarHBondContact O-N 2.91Å; E115-G118 VanDerWaalsContact O-N 3.16Å; E115-E119 PolarHBondContact O-N 3.22Å; E115-P293 HydrophobicContact CB-CG 4Å; E115-P293 VanDerWaalsContact CG-CD 3.41Å; E115-P293 HydrophobicContact CG-CG 3.45Å; E115-P293 VanDerWaalsContact CG-CG 3.45Å; E115-P293 WeakPolarHBondContact OE1-CD 3.34Å; E115-P293 WeakPolarHBondContact OE2-CG 3.47Å
116	A	87.4	Confident	87.7	Confident	28 Å²	28	56.5 Å²	56.5	23%	0.231	27%	0.27	C	S	.	.	H	α-helix	trans	-62.5	-34.2	178.6	0	0	0	0	0	112.4	K112 E113 V114 R120	K112-A116 WeakPolarHBondContact O-CB 3.43Å; K112-A116 PolarHBondContact O-N 3.32Å; E113-A116 PolarHBondContact O-N 3.46Å; V114-A116 PolarHBondContact O-N 3.41Å; A116-R120 WeakPolarHBondContact O-CB 3.35Å; A116-R120 VanDerWaalsContact O-CG 3.26Å; A116-R120 WeakPolarHBondContact O-CG 3.2Å; A116-R120 PolarHBondContact O-N 3.21Å
117	A	87.5	Confident	87.7	Confident	8 Å²	8	52.3 Å²	52.3	7%	0.066	25%	0.251	C	S	.	.	H	α-helix	trans	-68.6	-41	174.4	0	0	0	0	0	112.1	Y85 E113 V114 E115 I121 Q122 V124	Y85-A117 HydrophobicContact CD2-CB 3.46Å; Y85-A117 VanDerWaalsContact CD2-CB 3.46Å; Y85-A117 HydrophobicContact CE2-CB 3.52Å; Y85-A117 HydrophobicContact CG-CB 4.33Å; E113-A117 PolarHBondContact O-N 3.06Å; E113-A117 VanDerWaalsContact O-N 3.08Å; V114-A117 WeakPolarHBondContact O-CB 3.43Å; V114-A117 PolarHBondContact O-N 3.28Å; E115-A117 VanDerWaalsContact C-N 3.26Å; E115-A117 PolarHBondContact O-N 3.39Å; A117-I121 WeakPolarHBondContact O-CA 3.44Å; A117-I121 WeakPolarHBondContact O-CB 3.42Å; A117-I121 PolarHBondContact O-N 3.16Å; A117-Q122 PolarHBondContact O-N 2.86Å; A117-V124 HydrophobicContact CB-CG2 4.01Å
118	G	84.8	Confident	87.7	Confident	15 Å²	15	52.6 Å²	52.6	16%	0.155	25%	0.251	C	S	.	.	H	α-helix	trans	-60.6	-45.7	174.1	0	0	0	0	0	113.2	V114 E115 Q122	V114-G118 PolarHBondContact O-N 3.42Å; E115-G118 PolarHBondContact O-N 2.91Å; E115-G118 VanDerWaalsContact O-N 3.16Å; G118-Q122 VanDerWaalsContact O-CA 3.3Å; G118-Q122 WeakPolarHBondContact O-CA 2.93Å; G118-Q122 PolarHBondContact O-N 2.57Å
119	E	82.2	Confident	87.9	Confident	146 Å²	146	47.4 Å²	47.4	68%	0.682	24%	0.236	S	C	*	.	H	α-helix	trans	-73.7	-39.9	-178.8	-69.7	-176.6	170	0	0	113.4	E115	E115-E119 PolarHBondContact O-N 3.22Å
120	R	76.9	Confident	87.8	Confident	209 Å²	209	45.6 Å²	45.6	79%	0.789	23%	0.225	S	C	*	.	H	α-helix	trans	-89.1	-38.5	-172	-65.8	177.4	179.8	166.2	1.9	113.7	A116	A116-R120 WeakPolarHBondContact O-CB 3.35Å; A116-R120 VanDerWaalsContact O-CG 3.26Å; A116-R120 WeakPolarHBondContact O-CG 3.2Å; A116-R120 PolarHBondContact O-N 3.21Å
121	I	72.8	Confident	87.8	Confident	103 Å²	103	48.6 Å²	48.6	53%	0.528	25%	0.245	S	C	.	.	H	α-helix	trans	-111.7	-12.9	-169.4	-48.2	175.2	0	0	0	110.3	A117 S123	A117-I121 WeakPolarHBondContact O-CA 3.44Å; A117-I121 WeakPolarHBondContact O-CB 3.42Å; A117-I121 PolarHBondContact O-N 3.16Å; I121-S123 PolarHBondContact O-N 2.94Å; I121-S123 VanDerWaalsContact O-N 3.11Å
122	Q	83.4	Confident	87.9	Confident	119 Å²	119	50.5 Å²	50.5	56%	0.556	26%	0.262	S	S	*	.			trans	56.4	21.7	-174.3	-54.8	-178.2	-37.3	0	0	112.7	A117 G118 H150	A117-Q122 PolarHBondContact O-N 2.86Å; G118-Q122 VanDerWaalsContact O-CA 3.3Å; G118-Q122 WeakPolarHBondContact O-CA 2.93Å; G118-Q122 PolarHBondContact O-N 2.57Å; Q122-H150 PolarHBondContact O-NE2 2.98Å
123	S	84.9	Confident	88	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.007	25%	0.25	C	S	.	.			trans	-89.4	-7.8	-175.9	54.9	0	0	0	0	113	H81 S82 I121 H150	H81-S123 CarbonylContact C-O 3.58Å; H81-S123 WeakPolarHBondContact CA-O 3.39Å; H81-S123 WeakPolarHBondContact CB-O 3.13Å; S82-S123 PolarHBondContact N-O 2.87Å; S82-S123 WeakPolarHBondContact OG-CA 3.17Å; S82-S123 WeakPolarHBondContact OG-CB 3.45Å; I121-S123 PolarHBondContact O-N 2.94Å; I121-S123 VanDerWaalsContact O-N 3.11Å; S123-H150 PolarHBondContact O-CD2 3.47Å
124	V	88.5	Confident	88	Confident	12 Å²	12	50.8 Å²	50.8	7%	0.073	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	132.9	177.3	174.3	0	0	0	0	110	V79 H81 Y85 V114 A117	V79-V124 HydrophobicContact CG1-CB 4.31Å; V79-V124 HydrophobicContact CG1-CG1 3.42Å; V79-V124 VanDerWaalsContact CG1-CG1 3.42Å; V79-V124 HydrophobicContact CG1-CG2 4.02Å; H81-V124 HydrophobicContact CB-CG2 4.26Å; Y85-V124 HydrophobicContact CD1-CG2 3.56Å; Y85-V124 HydrophobicContact CD2-CG2 4.22Å; Y85-V124 HydrophobicContact CE1-CG2 3.86Å; Y85-V124 HydrophobicContact CG-CG2 3.76Å; V114-V124 HydrophobicContact CG1-CG1 3.8Å; V114-V124 HydrophobicContact CG1-CG2 4.28Å; A117-V124 HydrophobicContact CB-CG2 4.01Å
125	Y	87.3	Confident	88.1	Confident	40 Å²	40	51.9 Å²	51.9	16%	0.157	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-50.9	176	178.7	-110.2	0	0	0	112.5	T80 E145 H150 L296	T80-Y125 PolarHBondContact O-N 2.89Å; Y125-E145 WeakPolarHBondContact CD1-O 3.46Å; Y125-E145 HydrophobicContact CE1-CB 3.78Å; Y125-E145 PolarHBondContact OH-OE2 3.28Å; Y125-H150 HydrophobicContact CG-CB 4.42Å; Y125-L296 HydrophobicContact CD2-CD1 4.37Å
126	G	82.8	Confident	88.5	Confident	23 Å²	23	50.5 Å²	50.5	24%	0.237	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	144.4	-173.9	0	0	0	0	0	112.8	V79 T80	V79-G126 CarbonylContact C-O 3.57Å; V79-G126 VanDerWaalsContact CA-O 3.29Å; V79-G126 WeakPolarHBondContact CA-O 3.46Å; V79-G126 WeakPolarHBondContact CG1-O 3.42Å; T80-G126 PolarHBondContact N-O 2.87Å; T80-G126 PolarHBondContact O-N 2.91Å; T80-G126 PolarHBondContact OG1-N 3.17Å
127	L	91.9	Very high	89.1	Confident	28 Å²	28	53 Å²	53	15%	0.147	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	131.1	170	172.2	70.6	0	0	0	107.7	I77 V79 M111 V114 T310	I77-L127 HydrophobicContact CG2-CD1 3.84Å; V79-L127 HydrophobicContact CG2-CD1 3.9Å; M111-L127 HydrophobicContact CB-CD2 4.17Å; M111-L127 HydrophobicContact CE-CD2 3.62Å; M111-L127 HydrophobicContact CG-CD2 3.98Å; V114-L127 HydrophobicContact CG1-CB 4.47Å; V114-L127 HydrophobicContact CG1-CD1 4.33Å; L127-T310 PolarHBondContact O-OG1 3.39Å
128	F	93.8	Very high	89.5	Confident	15 Å²	15	54 Å²	54	7%	0.066	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	161.6	177.3	68.6	-89.2	0	0	0	110.7	L49 L76 G78 T80 F144 L153	L49-F128 HydrophobicContact CD1-CE2 3.96Å; L49-F128 HydrophobicContact CD1-CZ 3.94Å; L76-F128 HydrophobicContact CD2-CD2 4.39Å; L76-F128 HydrophobicContact CD2-CE2 3.8Å; G78-F128 VanDerWaalsContact C-CE1 3.42Å; G78-F128 PolarHBondContact N-O 3.02Å; G78-F128 WeakPolarHBondContact O-CD1 3.48Å; G78-F128 PolarHBondContact O-N 3.22Å; T80-F128 HydrophobicContact CG2-CE1 4.44Å; F128-F144 HydrophobicContact CB-CB 4.41Å; F128-F144 HydrophobicContact CD1-CB 3.5Å; F128-F144 HydrophobicContact CD1-CD1 4.49Å; F128-F144 HydrophobicContact CD1-CG 4.08Å; F128-F144 HydrophobicContact CD2-CB 4.46Å; F128-F144 HydrophobicContact CE1-CB 3.74Å; F128-F144 AromaticContact CE1-CD1 3.97Å; F128-F144 HydrophobicContact CE1-CD1 3.97Å; F128-F144 HydrophobicContact CE1-CD2 4.35Å; F128-F144 AromaticContact CE1-CG 3.76Å; F128-F144 HydrophobicContact CE1-CG 3.76Å; F128-F144 HydrophobicContact CE2-CD1 4.14Å; F128-F144 HydrophobicContact CG-CB 3.88Å; F128-F144 HydrophobicContact CZ-CB 4.31Å; F128-F144 AromaticContact CZ-CD1 3.76Å; F128-F144 HydrophobicContact CZ-CD1 3.76Å; F128-F144 HydrophobicContact CZ-CE1 4.31Å; F128-F144 HydrophobicContact CZ-CG 4.06Å; F128-L153 HydrophobicContact CE1-CD1 3.61Å; F128-L153 HydrophobicContact CZ-CD1 3.57Å
129	S	94.9	Very high	90.1	Very high	28 Å²	28	59.4 Å²	59.4	20%	0.196	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	150.3	-179.6	176.1	0	0	0	0	111	L76 S142	L76-S129 CarbonylContact O-C 3.55Å; L76-S129 WeakPolarHBondContact O-CA 3.44Å; L76-S129 PolarHBondContact O-OG 3.25Å; S129-S142 WeakPolarHBondContact O-CB 3.47Å; S129-S142 PolarHBondContact O-OG 3.42Å
130	A	94.3	Very high	90.8	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	145.4	167.4	0	0	0	0	0	109.2	P75 L76 M140	P75-A130 VanDerWaalsContact CA-O 3.31Å; P75-A130 WeakPolarHBondContact CA-O 3.29Å; P75-A130 WeakPolarHBondContact CB-O 3.34Å; L76-A130 HydrophobicContact CB-CB 3.94Å; L76-A130 PolarHBondContact N-O 3.47Å; L76-A130 PolarHBondContact O-N 3.48Å; A130-M140 HydrophobicContact CB-CB 4.1Å; A130-M140 HydrophobicContact CB-CG 3.89Å; A130-M140 HydrophobicContact CB-SD 3.79Å
131	P	93.6	Very high	91.7	Very high	64 Å²	64	46.2 Å²	46.2	42%	0.416	28%	0.275	S	S	.	.			trans	-61.3	151.9	-178.6	26.7	-35	0	0	0	111.7	M140	P131-M140 WeakPolarHBondContact O-CE 3.24Å
132	A	94.8	Very high	92.8	Very high	52 Å²	52	42.2 Å²	42.2	43%	0.43	26%	0.257	S	S	.	.			trans	-56.7	146.4	174.5	0	0	0	0	0	111.5	P75	P75-A132 HydrophobicContact CG-CB 4.01Å
133	L	95.3	Very high	93.4	Very high	21 Å²	21	42.2 Å²	42.2	11%	0.11	26%	0.257	C	S	.	.	B	Isolated β-bridge	trans	-104.5	114.4	177.2	177.9	64.9	0	0	0	109.8	Q72 W73 G135 G138 M140	Q72-L133 WeakPolarHBondContact CB-O 3.5Å; W73-L133 HydrophobicContact CB-CB 4.14Å; W73-L133 HydrophobicContact CG-CB 4.41Å; W73-L133 PolarHBondContact N-O 3.22Å; W73-L133 PolarHBondContact O-N 3.02Å; L133-G135 PolarHBondContact O-N 3.42Å; L133-G138 VanDerWaalsContact CD2-C 3.42Å; L133-M140 HydrophobicContact CB-CE 3.5Å; L133-M140 VanDerWaalsContact CB-CE 3.5Å
134	V	93.3	Very high	93.9	Very high	124 Å²	124	42.8 Å²	42.8	75%	0.752	26%	0.259	S	S	*	.	S	Bend	trans	-75.3	116.5	172.6	-176.6	0	0	0	0	108.4
135	G	94.4	Very high	94	Very high	24 Å²	24	44.3 Å²	44.3	25%	0.247	27%	0.265	C	S	.	.	S	Bend	trans	100.9	149.5	-174.9	0	0	0	0	0	113.4	A71 W73 L133 T137	A71-G135 CarbonylContact O-C 3.57Å; A71-G135 WeakPolarHBondContact O-CA 3.37Å; W73-G135 VanDerWaalsContact CD1-O 3.31Å; L133-G135 PolarHBondContact O-N 3.42Å; G135-T137 PolarHBondContact O-N 2.87Å
136	G	95.1	Very high	94.2	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.01	26%	0.258	C	S	.	.	S	Bend	trans	-70.8	-20	-178.3	0	0	0	0	0	113.7	G53 W55 A71 W73	G53-G136 CarbonylContact C-O 3.58Å; W55-G136 PolarHBondContact N-O 3.28Å; W55-G136 CarbonylContact O-C 3.5Å; W55-G136 WeakPolarHBondContact O-CA 3.3Å; A71-G136 PolarHBondContact O-N 3.38Å; W73-G136 PolarHBondContact NE1-O 3.03Å
137	T	97.9	Very high	94.5	Very high	81 Å²	81	45.2 Å²	45.2	50%	0.497	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	139.5	175.8	60.9	0	0	0	0	112	G53 G135	G53-T137 VanDerWaalsContact O-CA 3.31Å; G53-T137 WeakPolarHBondContact O-CA 3.5Å; G135-T137 PolarHBondContact O-N 2.87Å
138	G	96.7	Very high	94.4	Very high	28 Å²	28	44.9 Å²	44.9	29%	0.289	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	151	-167	179.9	0	0	0	0	0	110.8	T52 G53 L133	T52-G138 CarbonylContact C-O 3.07Å; T52-G138 WeakPolarHBondContact CA-O 3.37Å; G53-G138 PolarHBondContact N-O 3.28Å; G53-G138 PolarHBondContact O-N 3.07Å; L133-G138 VanDerWaalsContact CD2-C 3.42Å
139	Q	97.6	Very high	94.1	Very high	129 Å²	129	52.2 Å²	52.2	60%	0.603	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.2	145.6	-178.3	-64.3	178.7	30	0	0	111.3	T50 F51 T52	T50-Q139 HydrophobicContact CG2-CB 4.41Å; T50-Q139 HydrophobicContact CG2-CG 4.49Å; F51-Q139 CarbonylContact O-C 3.56Å; F51-Q139 WeakPolarHBondContact O-CA 3.43Å; T52-Q139 HydrophobicContact CG2-CG 4.08Å
140	M	96.7	Very high	94	Very high	7 Å²	7	51.6 Å²	51.6	3%	0.034	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	146.5	164.9	65.5	179.1	68.2	0	0	108.5	F51 W73 L76 A130 P131 L133	F51-M140 HydrophobicContact CB-CG 3.7Å; F51-M140 HydrophobicContact CB-SD 4.35Å; F51-M140 HydrophobicContact CD1-CE 4.06Å; F51-M140 HydrophobicContact CD1-CG 3.87Å; F51-M140 HydrophobicContact CD1-SD 4.12Å; F51-M140 HydrophobicContact CE1-CE 4.36Å; F51-M140 HydrophobicContact CG-CG 4.17Å; F51-M140 HydrophobicContact CG-SD 4.43Å; F51-M140 PolarHBondContact N-O 3.02Å; F51-M140 PolarHBondContact O-N 2.9Å; W73-M140 HydrophobicContact CB-CE 4.13Å; L76-M140 HydrophobicContact CB-SD 3.58Å; L76-M140 VanDerWaalsContact CB-SD 3.58Å; L76-M140 HydrophobicContact CD1-SD 4.43Å; A130-M140 HydrophobicContact CB-CB 4.1Å; A130-M140 HydrophobicContact CB-CG 3.89Å; A130-M140 HydrophobicContact CB-SD 3.79Å; P131-M140 WeakPolarHBondContact O-CE 3.24Å; L133-M140 HydrophobicContact CB-CE 3.5Å; L133-M140 VanDerWaalsContact CB-CE 3.5Å
141	T	96.8	Very high	94	Very high	70 Å²	70	51.8 Å²	51.8	43%	0.429	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	146	-176.7	-58.3	0	0	0	0	110.2	S48 L49	S48-T141 WeakPolarHBondContact OG-CG2 3.37Å; L49-T141 CarbonylContact O-C 3.59Å; L49-T141 WeakPolarHBondContact O-CA 3.49Å; L49-T141 WeakPolarHBondContact O-CG2 3.3Å
142	S	95.6	Very high	94.2	Very high	19 Å²	19	51 Å²	51	13%	0.133	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	161.2	169.6	-166.5	0	0	0	0	109.9	L49 S129	L49-S142 PolarHBondContact N-O 3.07Å; L49-S142 PolarHBondContact O-N 2.67Å; S129-S142 WeakPolarHBondContact O-CB 3.47Å; S129-S142 PolarHBondContact O-OG 3.42Å
143	E	95.6	Very high	94.3	Very high	119 Å²	119	48.6 Å²	48.6	56%	0.556	26%	0.257	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.1	147.5	176	-62.7	-168	159.5	0	0	110.2	Y47	Y47-E143 VanDerWaalsContact O-CA 3.29Å; Y47-E143 WeakPolarHBondContact O-CA 3.35Å
144	F	94.4	Very high	94.5	Very high	13 Å²	13	47.6 Å²	47.6	6%	0.057	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	159.6	178.1	66.6	-88.1	0	0	0	111.7	Y47 L49 T80 F128 V146 L153 L174 L245	Y47-F144 HydrophobicContact CD2-CE2 4.29Å; Y47-F144 HydrophobicContact CD2-CZ 4.48Å; Y47-F144 HydrophobicContact CG-CE2 4.21Å; Y47-F144 AromaticContact CG-CZ 3.97Å; Y47-F144 HydrophobicContact CG-CZ 3.97Å; Y47-F144 PolarHBondContact N-O 2.91Å; Y47-F144 PolarHBondContact O-N 2.76Å; L49-F144 HydrophobicContact CB-CD1 4.19Å; L49-F144 HydrophobicContact CB-CE1 3.88Å; L49-F144 HydrophobicContact CD1-CE1 4.35Å; T80-F144 HydrophobicContact CG2-CD2 3.42Å; T80-F144 VanDerWaalsContact CG2-CD2 3.42Å; T80-F144 HydrophobicContact CG2-CE2 3.92Å; T80-F144 HydrophobicContact CG2-CG 4.28Å; F128-F144 HydrophobicContact CB-CB 4.41Å; F128-F144 HydrophobicContact CD1-CB 3.5Å; F128-F144 HydrophobicContact CD1-CD1 4.49Å; F128-F144 HydrophobicContact CD1-CG 4.08Å; F128-F144 HydrophobicContact CD2-CB 4.46Å; F128-F144 HydrophobicContact CE1-CB 3.74Å; F128-F144 AromaticContact CE1-CD1 3.97Å; F128-F144 HydrophobicContact CE1-CD1 3.97Å; F128-F144 HydrophobicContact CE1-CD2 4.35Å; F128-F144 AromaticContact CE1-CG 3.76Å; F128-F144 HydrophobicContact CE1-CG 3.76Å; F128-F144 HydrophobicContact CE2-CD1 4.14Å; F128-F144 HydrophobicContact CG-CB 3.88Å; F128-F144 HydrophobicContact CZ-CB 4.31Å; F128-F144 AromaticContact CZ-CD1 3.76Å; F128-F144 HydrophobicContact CZ-CD1 3.76Å; F128-F144 HydrophobicContact CZ-CE1 4.31Å; F128-F144 HydrophobicContact CZ-CG 4.06Å; F144-V146 HydrophobicContact CD2-CG1 3.92Å; F144-V146 HydrophobicContact CE2-CG1 3.65Å; F144-L153 HydrophobicContact CE1-CD2 4.36Å; F144-L153 HydrophobicContact CE2-CD1 4.31Å; F144-L153 HydrophobicContact CZ-CD1 4.25Å; F144-L153 HydrophobicContact CZ-CD2 3.86Å; F144-L174 HydrophobicContact CE2-CD1 3.58Å; F144-L174 HydrophobicContact CZ-CD1 3.74Å; F144-L245 HydrophobicContact CE1-CD2 4.13Å; F144-L245 HydrophobicContact CZ-CD2 4.24Å
145	E	91.8	Very high	94.7	Very high	44 Å²	44	41.7 Å²	41.7	21%	0.206	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	141.9	175.5	-67.6	-157.8	163.3	0	0	110.5	A45 K46 T80 Y125 K298	A45-E145 WeakPolarHBondContact O-CA 3.22Å; K46-E145 WeakPolarHBondContact CE-OE1 3.29Å; K46-E145 HydrophobicContact CG-CG 4Å; K46-E145 IonicContact NZ-OE1 3.81Å; T80-E145 WeakPolarHBondContact CG2-O 3.49Å; T80-E145 PolarHBondContact OG1-O 2.66Å; Y125-E145 WeakPolarHBondContact CD1-O 3.46Å; Y125-E145 HydrophobicContact CE1-CB 3.78Å; Y125-E145 PolarHBondContact OH-OE2 3.28Å; E145-K298 IonicContact OE1-NZ 2.78Å; E145-K298 IonicContact OE2-NZ 2.71Å; E145-K298 PolarHBondContact OE2-NZ 2.83Å
146	V	91.5	Very high	94.9	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	150	171.1	-70.3	0	0	0	0	111.3	T44 A45 Y47 T80 F144 L174 W180	T44-V146 WeakPolarHBondContact CA-O 3.44Å; A45-V146 HydrophobicContact CB-CG2 3.94Å; A45-V146 PolarHBondContact N-O 2.86Å; A45-V146 VanDerWaalsContact N-O 3.16Å; A45-V146 PolarHBondContact O-N 2.8Å; Y47-V146 HydrophobicContact CD2-CG2 3.78Å; Y47-V146 HydrophobicContact CE2-CG2 3.6Å; T80-V146 HydrophobicContact CG2-CG1 3.59Å; F144-V146 HydrophobicContact CD2-CG1 3.92Å; F144-V146 HydrophobicContact CE2-CG1 3.65Å; V146-L174 HydrophobicContact CG1-CD1 3.85Å; V146-W180 HydrophobicContact CB-CH2 3.92Å; V146-W180 HydrophobicContact CB-CZ3 3.92Å; V146-W180 HydrophobicContact CG2-CD2 4.22Å; V146-W180 HydrophobicContact CG2-CE3 3.71Å; V146-W180 HydrophobicContact CG2-CH2 3.68Å; V146-W180 HydrophobicContact CG2-CZ2 4.16Å; V146-W180 HydrophobicContact CG2-CZ3 3.42Å; V146-W180 VanDerWaalsContact CG2-CZ3 3.42Å
147	F	89.7	Confident	95.1	Very high	83 Å²	83	40.5 Å²	40.5	36%	0.364	20%	0.204	S	C	.	.	B	Isolated β-bridge	trans	-127.4	158.2	178.8	-156	-94.2	0	0	0	110	T44 R149 H150 S151 W180	T44-F147 HydrophobicContact CG2-CD2 3.32Å; T44-F147 HydrophobicContact CG2-CE2 3.58Å; F147-R149 PolarHBondContact O-N 2.84Å; F147-R149 VanDerWaalsContact O-N 3.17Å; F147-H150 CarbonylContact O-C 3.55Å; F147-H150 WeakPolarHBondContact O-CA 3.45Å; F147-H150 PolarHBondContact O-N 3.27Å; F147-S151 PolarHBondContact O-N 2.71Å; F147-S151 VanDerWaalsContact O-N 3.12Å; F147-W180 WeakPolarHBondContact O-CH2 3.47Å
148	A	89	Confident	95.1	Very high	20 Å²	20	37.8 Å²	37.8	17%	0.165	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-35.2	-176.6	0	0	0	0	0	114.1	C39 A41 H150	C39-A148 WeakPolarHBondContact CB-O 3.48Å; A41-A148 WeakPolarHBondContact O-CB 3.45Å; A148-H150 VanDerWaalsContact C-N 3.32Å
149	R	86.7	Confident	95.2	Very high	170 Å²	170	36.5 Å²	36.5	64%	0.642	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-15.5	175.8	-67	-171.2	179.2	-175.5	2.4	114	S82 F147	S82-R149 VanDerWaalsContact CB-O 3.3Å; S82-R149 WeakPolarHBondContact CB-O 3.35Å; F147-R149 PolarHBondContact O-N 2.84Å; F147-R149 VanDerWaalsContact O-N 3.17Å
150	H	92.8	Very high	95.3	Very high	14 Å²	14	31.4 Å²	31.4	7%	0.065	15%	0.149	C	C	.	.	B	Isolated β-bridge	trans	-133.1	54.2	-175.3	-56.1	93.7	0	0	0	109.7	H81 Q122 S123 Y125 F147 A148 F152	H81-H150 CarbonylContact O-C 3.21Å; H81-H150 WeakPolarHBondContact O-CA 2.99Å; Q122-H150 PolarHBondContact O-NE2 2.98Å; S123-H150 PolarHBondContact O-CD2 3.47Å; Y125-H150 HydrophobicContact CG-CB 4.42Å; F147-H150 CarbonylContact O-C 3.55Å; F147-H150 WeakPolarHBondContact O-CA 3.45Å; F147-H150 PolarHBondContact O-N 3.27Å; A148-H150 VanDerWaalsContact C-N 3.32Å; H150-F152 VanDerWaalsContact C-N 3.31Å
151	S	95.1	Very high	95.4	Very high	5 Å²	5	31.8 Å²	31.8	4%	0.035	15%	0.152	C	C	.	.			trans	-82.6	-9.3	-174.9	65.3	0	0	0	0	113.3	F147 D173 L174	F147-S151 PolarHBondContact O-N 2.71Å; F147-S151 VanDerWaalsContact O-N 3.12Å; S151-D173 WeakPolarHBondContact CB-OD1 3.29Å; S151-D173 PolarHBondContact OG-OD1 2.92Å; S151-L174 PolarHBondContact O-N 2.89Å
152	F	96.9	Very high	95.5	Very high	47 Å²	47	28.8 Å²	28.8	21%	0.206	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	140.1	-179.8	-63	-85.4	0	0	0	111.4	T80 H81 H150 S171 F172 D173	T80-F152 WeakPolarHBondContact CA-O 3.15Å; H81-F152 PolarHBondContact N-O 3.24Å; H81-F152 WeakPolarHBondContact O-CB 3.4Å; H81-F152 PolarHBondContact O-N 3.19Å; H81-F152 VanDerWaalsContact O-N 3.12Å; H150-F152 VanDerWaalsContact C-N 3.31Å; F152-S171 WeakPolarHBondContact CD1-O 3.44Å; F152-F172 WeakPolarHBondContact CA-O 3.4Å; F152-D173 HydrophobicContact CD1-CB 3.9Å; F152-D173 HydrophobicContact CE1-CB 3.68Å; F152-D173 HydrophobicContact CZ-CB 4.35Å
153	L	97.9	Very high	95.6	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.005	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	128.9	172.7	171.7	67.9	0	0	0	109.8	L49 T80 F128 F144 S171 F172 L174 L245	L49-L153 HydrophobicContact CD1-CD2 4.21Å; T80-L153 HydrophobicContact CG2-CD1 4.41Å; F128-L153 HydrophobicContact CE1-CD1 3.61Å; F128-L153 HydrophobicContact CZ-CD1 3.57Å; F144-L153 HydrophobicContact CE1-CD2 4.36Å; F144-L153 HydrophobicContact CE2-CD1 4.31Å; F144-L153 HydrophobicContact CZ-CD1 4.25Å; F144-L153 HydrophobicContact CZ-CD2 3.86Å; L153-S171 PolarHBondContact O-N 2.91Å; L153-F172 PolarHBondContact N-O 2.99Å; L153-F172 PolarHBondContact O-N 3.49Å; L153-L174 HydrophobicContact CB-CD1 3.98Å; L153-L174 HydrophobicContact CD2-CD1 4.39Å; L153-L245 HydrophobicContact CD2-CD1 3.57Å; L153-L245 HydrophobicContact CD2-CD2 3.64Å; L153-L245 HydrophobicContact CD2-CG 4.28Å
154	S	98.5	Very high	95.8	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	147.9	164.2	-65.4	0	0	0	0	110.7	G78 V79 H81 I87 V169 S171	G78-S154 CarbonylContact C-O 3.56Å; G78-S154 WeakPolarHBondContact CA-O 3.45Å; V79-S154 PolarHBondContact N-O 3.02Å; V79-S154 PolarHBondContact O-N 3.02Å; H81-S154 PolarHBondContact CE1-OG 3.24Å; H81-S154 VanDerWaalsContact NE2-CB 3.29Å; H81-S154 WeakPolarHBondContact NE2-CB 3.48Å; H81-S154 PolarHBondContact NE2-N 2.75Å; H81-S154 PolarHBondContact NE2-OG 3.28Å; I87-S154 WeakPolarHBondContact CD1-O 3.16Å; S154-V169 CarbonylContact C-O 3.53Å; S154-V169 WeakPolarHBondContact CA-O 3.11Å; S154-V169 WeakPolarHBondContact CB-O 3.32Å; S154-S171 PolarHBondContact OG-N 2.83Å
155	F	98.6	Very high	96	Very high	1 Å²	1	22.3 Å²	22.3	0%	0.004	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	164.4	169.5	70.6	-95.2	0	0	0	112	L49 L76 I77 W88 V157 G168 V169 L188 V243	L49-F155 HydrophobicContact CD1-CD1 4.18Å; L49-F155 HydrophobicContact CD1-CE1 4.45Å; L76-F155 HydrophobicContact CD1-CD2 3.7Å; L76-F155 HydrophobicContact CD1-CE2 4.09Å; L76-F155 HydrophobicContact CD1-CG 4.18Å; L76-F155 HydrophobicContact CD2-CB 4.02Å; L76-F155 HydrophobicContact CD2-CG 4.46Å; L76-F155 HydrophobicContact CG-CB 4.27Å; L76-F155 HydrophobicContact CG-CD2 4.01Å; L76-F155 HydrophobicContact CG-CG 4.37Å; I77-F155 CarbonylContact O-C 3.53Å; I77-F155 WeakPolarHBondContact O-CA 2.77Å; I77-F155 VanDerWaalsContact O-CB 3.32Å; I77-F155 WeakPolarHBondContact O-CB 3.26Å; W88-F155 PolarHBondContact NE1-O 3.32Å; F155-V157 HydrophobicContact CD2-CG2 4.07Å; F155-V157 HydrophobicContact CE2-CG2 4.25Å; F155-G168 WeakPolarHBondContact O-CA 3.3Å; F155-V169 HydrophobicContact CD1-CB 3.92Å; F155-V169 HydrophobicContact CD1-CG2 4.26Å; F155-V169 HydrophobicContact CE1-CB 3.53Å; F155-V169 HydrophobicContact CE1-CG2 3.37Å; F155-V169 HydrophobicContact CZ-CB 4.11Å; F155-V169 HydrophobicContact CZ-CG2 3.6Å; F155-V169 PolarHBondContact N-O 3.47Å; F155-V169 PolarHBondContact O-N 3.38Å; F155-V169 VanDerWaalsContact O-N 3.13Å; F155-L188 HydrophobicContact CE2-CD1 4.09Å; F155-L188 HydrophobicContact CZ-CD1 3.87Å; F155-L188 HydrophobicContact CZ-CD2 4.08Å; F155-V243 HydrophobicContact CE1-CB 4.26Å; F155-V243 HydrophobicContact CE1-CG1 3.96Å; F155-V243 HydrophobicContact CE1-CG2 4.09Å; F155-V243 HydrophobicContact CZ-CB 3.98Å; F155-V243 HydrophobicContact CZ-CG1 3.86Å; F155-V243 HydrophobicContact CZ-CG2 4.18Å
156	I	98.8	Very high	96.3	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	142.2	178.6	-168.2	168.9	0	0	0	111	I77 I87 V98 F101 L110 F166 L167	I77-I156 HydrophobicContact CB-CG2 4.21Å; I77-I156 PolarHBondContact N-O 3.29Å; I77-I156 PolarHBondContact O-N 3.42Å; I87-I156 HydrophobicContact CG2-CG2 4.37Å; V98-I156 HydrophobicContact CG1-CD1 3.96Å; F101-I156 HydrophobicContact CD1-CD1 3.98Å; F101-I156 HydrophobicContact CD1-CG1 3.98Å; F101-I156 HydrophobicContact CD1-CG2 3.85Å; F101-I156 HydrophobicContact CE1-CB 4.19Å; F101-I156 HydrophobicContact CE1-CD1 4.37Å; F101-I156 HydrophobicContact CE1-CG1 3.85Å; F101-I156 HydrophobicContact CE1-CG2 3.64Å; F101-I156 HydrophobicContact CZ-CG2 4.29Å; L110-I156 HydrophobicContact CD2-CG2 3.84Å; I156-F166 HydrophobicContact CD1-CB 4.32Å; I156-F166 HydrophobicContact CD1-CD1 4.27Å; I156-F166 HydrophobicContact CD1-CD2 3.71Å; I156-F166 HydrophobicContact CD1-CE2 3.99Å; I156-F166 HydrophobicContact CD1-CG 3.85Å; I156-F166 HydrophobicContact CD1-CZ 4.37Å; I156-F166 HydrophobicContact CG1-CB 4.01Å; I156-F166 HydrophobicContact CG1-CD2 3.54Å; I156-F166 HydrophobicContact CG1-CE2 4.16Å; I156-F166 HydrophobicContact CG1-CG 3.88Å; I156-L167 CarbonylContact C-O 3.59Å; I156-L167 WeakPolarHBondContact CA-O 3.18Å
157	V	98.8	Very high	96.7	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	117.9	177.1	-170.2	0	0	0	0	108.8	F51 W73 L76 F155 F166 L167	F51-V157 HydrophobicContact CD2-CG2 4.42Å; F51-V157 HydrophobicContact CE2-CG2 4.34Å; W73-V157 HydrophobicContact CB-CG1 3.99Å; W73-V157 HydrophobicContact CE3-CG1 4.01Å; L76-V157 HydrophobicContact CB-CG2 3.69Å; L76-V157 HydrophobicContact CD1-CG2 3.68Å; L76-V157 HydrophobicContact CG-CG2 3.65Å; F155-V157 HydrophobicContact CD2-CG2 4.07Å; F155-V157 HydrophobicContact CE2-CG2 4.25Å; V157-F166 CarbonylContact O-C 3.48Å; V157-F166 VanDerWaalsContact O-CA 3.26Å; V157-F166 WeakPolarHBondContact O-CA 3.43Å; V157-F166 WeakPolarHBondContact O-CB 3.28Å; V157-L167 PolarHBondContact N-O 2.79Å; V157-L167 PolarHBondContact O-N 3Å
158	R	98.8	Very high	97.1	Very high	24 Å²	24	16.6 Å²	16.6	9%	0.091	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	139.8	177.3	168.9	179.1	165.3	67.1	-5.6	111	S74 F101 S102 E103 V160 S162 P163	S74-R158 PolarHBondContact N-O 2.92Å; S74-R158 VanDerWaalsContact N-O 3.16Å; S74-R158 PolarHBondContact OG-N 3.09Å; F101-R158 HydrophobicContact CE1-CB 4.24Å; F101-R158 WeakPolarHBondContact O-CD 3.43Å; S102-R158 VanDerWaalsContact O-CD 3.24Å; S102-R158 WeakPolarHBondContact O-CD 3.2Å; S102-R158 PolarHBondContact O-NH1 3.39Å; E103-R158 PolarHBondContact O-NE 3.47Å; E103-R158 PolarHBondContact O-NH1 2.92Å; E103-R158 PolarHBondContact O-NH2 3.28Å; R158-V160 HydrophobicContact CG-CG2 3.97Å; R158-S162 VanDerWaalsContact CZ-O 3.27Å; R158-S162 PolarHBondContact NH1-O 2.78Å; R158-S162 PolarHBondContact NH1-OG 3.07Å; R158-S162 PolarHBondContact NH2-O 2.78Å; R158-P163 PolarHBondContact NH1-O 2.78Å
159	I	98.8	Very high	97.5	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	124.7	168.7	-65.7	163.9	0	0	0	107.7	W55 W73 P161 S162 W165 L167 P190 F201 F229 M240	W55-I159 HydrophobicContact CE3-CG2 4.25Å; W55-I159 HydrophobicContact CH2-CG2 3.78Å; W55-I159 HydrophobicContact CZ2-CG2 4.46Å; W55-I159 HydrophobicContact CZ3-CG2 3.66Å; W73-I159 HydrophobicContact CE3-CG1 4.37Å; W73-I159 HydrophobicContact CH2-CG1 4.27Å; W73-I159 HydrophobicContact CZ3-CG1 3.6Å; I159-P161 CarbonylContact O-C 3.36Å; I159-S162 VanDerWaalsContact O-CB 3.29Å; I159-S162 WeakPolarHBondContact O-CB 3.27Å; I159-S162 PolarHBondContact O-N 3.13Å; I159-S162 PolarHBondContact O-OG 3.04Å; I159-W165 HydrophobicContact CB-CB 4.34Å; I159-W165 HydrophobicContact CD1-CB 3.92Å; I159-W165 PolarHBondContact N-O 3.43Å; I159-L167 HydrophobicContact CD1-CD2 4.46Å; I159-P190 HydrophobicContact CD1-CB 3.84Å; I159-F201 HydrophobicContact CG2-CD1 4.31Å; I159-F201 HydrophobicContact CG2-CE1 4.14Å; I159-F229 HydrophobicContact CD1-CZ 4.42Å; I159-M240 HydrophobicContact CD1-CE 3.96Å; I159-M240 HydrophobicContact CD1-SD 3.74Å; I159-M240 HydrophobicContact CG1-CE 4.05Å; I159-M240 HydrophobicContact CG1-SD 4.29Å; I159-M240 HydrophobicContact CG2-CE 3.87Å
160	V	98.6	Very high	98.1	Very high	22 Å²	22	10.5 Å²	10.5	13%	0.133	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	125.1	-175.2	-179.5	0	0	0	0	110.9	W55 P69 A71 Q72 R158	W55-V160 VanDerWaalsContact CZ3-O 3.3Å; W55-V160 WeakPolarHBondContact CZ3-O 3.42Å; P69-V160 HydrophobicContact CG-CG1 4.09Å; A71-V160 WeakPolarHBondContact CA-O 3.49Å; Q72-V160 HydrophobicContact CG-CB 3.61Å; Q72-V160 HydrophobicContact CG-CG1 3.59Å; Q72-V160 PolarHBondContact N-O 2.9Å; Q72-V160 PolarHBondContact O-N 3.06Å; R158-V160 HydrophobicContact CG-CG2 3.97Å
161	P	98.5	Very high	98.3	Very high	15 Å²	15	11.2 Å²	11.2	10%	0.097	6%	0.062	C	C	.	.	S	Bend	cis	-78.1	152.3	-9.2	34.1	-33.4	0	0	0	111.6	P65 P69 I159 F201	P65-P161 HydrophobicContact CB-CG 3.97Å; P65-P161 HydrophobicContact CG-CG 4Å; P69-P161 HydrophobicContact CG-CB 3.91Å; P69-P161 HydrophobicContact CG-CG 4.06Å; I159-P161 CarbonylContact O-C 3.36Å; P161-F201 CarbonylContact C-O 3.32Å; P161-F201 WeakPolarHBondContact CB-O 3.34Å; P161-F201 HydrophobicContact CG-CB 4.3Å; P161-F201 WeakPolarHBondContact O-CB 3.14Å; P161-F201 WeakPolarHBondContact O-CD1 3.24Å
162	S	98.7	Very high	98.4	Very high	7 Å²	7	13 Å²	13	5%	0.049	7%	0.07	C	C	.	.			trans	-158.6	164.5	166.9	66.7	0	0	0	0	110.5	R158 I159 W165 F201	R158-S162 VanDerWaalsContact CZ-O 3.27Å; R158-S162 PolarHBondContact NH1-O 2.78Å; R158-S162 PolarHBondContact NH1-OG 3.07Å; R158-S162 PolarHBondContact NH2-O 2.78Å; I159-S162 VanDerWaalsContact O-CB 3.29Å; I159-S162 WeakPolarHBondContact O-CB 3.27Å; I159-S162 PolarHBondContact O-N 3.13Å; I159-S162 PolarHBondContact O-OG 3.04Å; S162-W165 PolarHBondContact OG-N 2.94Å; S162-W165 VanDerWaalsContact OG-N 3.15Å; S162-W165 PolarHBondContact OG-O 3.36Å; S162-F201 VanDerWaalsContact CA-O 3.32Å; S162-F201 WeakPolarHBondContact CA-O 3.43Å; S162-F201 PolarHBondContact N-O 2.59Å
163	P	98.5	Very high	98.4	Very high	6 Å²	6	12.6 Å²	12.6	4%	0.039	7%	0.07	C	C	.	.	S	Bend	trans	-57	-70	169.6	-21.1	33.2	0	0	0	110.6	E103 R158 W165 D196 G198 T200	E103-P163 WeakPolarHBondContact CA-O 3.45Å; R158-P163 PolarHBondContact NH1-O 2.78Å; P163-W165 HydrophobicContact CG-CH2 4.37Å; P163-W165 HydrophobicContact CG-CZ2 3.81Å; P163-D196 HydrophobicContact CB-CB 3.93Å; P163-G198 VanDerWaalsContact CG-O 3.31Å; P163-G198 WeakPolarHBondContact CG-O 3.48Å; P163-T200 WeakPolarHBondContact CD-O 3.28Å; P163-T200 WeakPolarHBondContact CG-O 3.47Å
164	D	98.7	Very high	98.3	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.069	C	C	.	.	S	Bend	trans	-147.6	29.6	-177	65.6	-11.4	0	0	0	112	S102 E103 A193 G194 T195 D196	S102-D164 CarbonylContact O-C 3.19Å; S102-D164 WeakPolarHBondContact O-CA 3.46Å; E103-D164 HydrophobicContact CG-CB 4Å; D164-A193 HydrophobicContact CB-CB 4Å; D164-A193 WeakPolarHBondContact O-CB 3.19Å; D164-A193 PolarHBondContact O-N 3.15Å; D164-G194 PolarHBondContact OD2-N 2.8Å; D164-G194 VanDerWaalsContact OD2-N 3.07Å; D164-T195 PolarHBondContact OD2-N 2.79Å; D164-D196 HydrophobicContact CB-CB 4Å; D164-D196 PolarHBondContact OD2-N 2.92Å
165	W	98.9	Very high	98.1	Very high	9 Å²	9	12.8 Å²	12.8	3%	0.034	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	142.2	-170.9	-50.5	-24.4	0	0	0	113	I159 S162 P163 Y191 D192 F201 I217 F229	I159-W165 HydrophobicContact CB-CB 4.34Å; I159-W165 HydrophobicContact CD1-CB 3.92Å; I159-W165 PolarHBondContact N-O 3.43Å; S162-W165 PolarHBondContact OG-N 2.94Å; S162-W165 VanDerWaalsContact OG-N 3.15Å; S162-W165 PolarHBondContact OG-O 3.36Å; P163-W165 HydrophobicContact CG-CH2 4.37Å; P163-W165 HydrophobicContact CG-CZ2 3.81Å; W165-Y191 CarbonylContact C-O 3.57Å; W165-Y191 VanDerWaalsContact CA-O 3.23Å; W165-Y191 WeakPolarHBondContact CA-O 3.34Å; W165-D192 PolarHBondContact NE1-OD2 2.9Å; W165-F201 AromaticContact CE3-CD1 3.79Å; W165-F201 HydrophobicContact CE3-CD1 3.79Å; W165-F201 AromaticContact CE3-CE1 3.87Å; W165-F201 HydrophobicContact CE3-CE1 3.87Å; W165-F201 AromaticContact CZ3-CD1 3.39Å; W165-F201 HydrophobicContact CZ3-CD1 3.39Å; W165-F201 AromaticContact CZ3-CE1 3.59Å; W165-F201 HydrophobicContact CZ3-CE1 3.59Å; W165-F201 HydrophobicContact CZ3-CG 4Å; W165-F201 HydrophobicContact CZ3-CZ 4.37Å; W165-I217 HydrophobicContact CB-CD1 4.34Å; W165-I217 HydrophobicContact CD2-CD1 4.03Å; W165-I217 HydrophobicContact CG-CD1 3.75Å; W165-F229 HydrophobicContact CD2-CE2 4.28Å; W165-F229 HydrophobicContact CE3-CD2 4.18Å; W165-F229 AromaticContact CE3-CE2 3.57Å; W165-F229 HydrophobicContact CE3-CE2 3.57Å; W165-F229 HydrophobicContact CZ3-CD2 4.11Å; W165-F229 AromaticContact CZ3-CE2 3.8Å; W165-F229 HydrophobicContact CZ3-CE2 3.8Å
166	F	98.9	Very high	97.8	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	164.8	-179	67.2	-89	0	0	0	113.1	W88 S102 I156 V157 Y191 A193 V214	W88-F166 AromaticContact CD2-CE2 3.65Å; W88-F166 HydrophobicContact CD2-CE2 3.65Å; W88-F166 AromaticContact CD2-CZ 3.96Å; W88-F166 HydrophobicContact CD2-CZ 3.96Å; W88-F166 AromaticContact CE2-CE2 3.75Å; W88-F166 AromaticContact CE3-CE2 3.86Å; W88-F166 HydrophobicContact CE3-CE2 3.86Å; W88-F166 AromaticContact CE3-CZ 3.88Å; W88-F166 HydrophobicContact CE3-CZ 3.88Å; W88-F166 HydrophobicContact CG-CE2 4.11Å; W88-F166 HydrophobicContact CG-CZ 4.3Å; W88-F166 HydrophobicContact CH2-CE2 4.26Å; W88-F166 HydrophobicContact CZ2-CE2 4.08Å; W88-F166 HydrophobicContact CZ3-CE2 4.15Å; W88-F166 HydrophobicContact CZ3-CZ 4.36Å; S102-F166 WeakPolarHBondContact OG-CD1 3.36Å; I156-F166 HydrophobicContact CD1-CB 4.32Å; I156-F166 HydrophobicContact CD1-CD1 4.27Å; I156-F166 HydrophobicContact CD1-CD2 3.71Å; I156-F166 HydrophobicContact CD1-CE2 3.99Å; I156-F166 HydrophobicContact CD1-CG 3.85Å; I156-F166 HydrophobicContact CD1-CZ 4.37Å; I156-F166 HydrophobicContact CG1-CB 4.01Å; I156-F166 HydrophobicContact CG1-CD2 3.54Å; I156-F166 HydrophobicContact CG1-CE2 4.16Å; I156-F166 HydrophobicContact CG1-CG 3.88Å; V157-F166 CarbonylContact O-C 3.48Å; V157-F166 VanDerWaalsContact O-CA 3.26Å; V157-F166 WeakPolarHBondContact O-CA 3.43Å; V157-F166 WeakPolarHBondContact O-CB 3.28Å; F166-Y191 HydrophobicContact CE2-CG 4.35Å; F166-Y191 HydrophobicContact CZ-CG 4.41Å; F166-Y191 PolarHBondContact N-O 2.98Å; F166-Y191 PolarHBondContact O-N 3.2Å; F166-A193 HydrophobicContact CD1-CB 4.33Å; F166-A193 HydrophobicContact CE1-CB 4Å; F166-V214 HydrophobicContact CE1-CG1 4.28Å; F166-V214 HydrophobicContact CZ-CG1 3.79Å
167	L	98.8	Very high	97.4	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	154.3	161.9	-61.4	-174.1	0	0	0	109.2	F51 W73 I156 V157 I159 L188 Y189 P190 M240	F51-L167 HydrophobicContact CE2-CD1 4.01Å; F51-L167 HydrophobicContact CZ-CD1 4.07Å; W73-L167 HydrophobicContact CE3-CD1 4.38Å; W73-L167 HydrophobicContact CH2-CD1 3.3Å; W73-L167 HydrophobicContact CH2-CG 3.99Å; W73-L167 HydrophobicContact CZ2-CD1 4.32Å; W73-L167 HydrophobicContact CZ3-CD1 3.34Å; W73-L167 HydrophobicContact CZ3-CG 3.63Å; I156-L167 CarbonylContact C-O 3.59Å; I156-L167 WeakPolarHBondContact CA-O 3.18Å; V157-L167 PolarHBondContact N-O 2.79Å; V157-L167 PolarHBondContact O-N 3Å; I159-L167 HydrophobicContact CD1-CD2 4.46Å; L167-L188 HydrophobicContact CB-CB 4.39Å; L167-L188 HydrophobicContact CD1-CB 3.99Å; L167-L188 HydrophobicContact CD1-CD1 4.46Å; L167-L188 HydrophobicContact CD2-CB 4.35Å; L167-Y189 WeakPolarHBondContact CD2-O 3.29Å; L167-P190 HydrophobicContact CD2-CB 4.41Å; L167-P190 VanDerWaalsContact CD2-N 3.35Å; L167-M240 HydrophobicContact CD1-CB 4.36Å; L167-M240 HydrophobicContact CD2-CB 4.34Å; L167-M240 HydrophobicContact CD2-SD 4.48Å
168	G	98.2	Very high	97	Very high	7 Å²	7	26 Å²	26	7%	0.072	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.2	176.3	175.5	0	0	0	0	0	112.7	W88 F155	W88-G168 VanDerWaalsContact CZ2-C 3.46Å; F155-G168 WeakPolarHBondContact O-CA 3.3Å
169	V	98.4	Very high	96.7	Very high	16 Å²	16	31.1 Å²	31.1	10%	0.097	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	138.6	164.6	173.9	0	0	0	0	107.5	S154 F155 F172 L186 L188 V243	S154-V169 CarbonylContact C-O 3.53Å; S154-V169 WeakPolarHBondContact CA-O 3.11Å; S154-V169 WeakPolarHBondContact CB-O 3.32Å; F155-V169 HydrophobicContact CD1-CB 3.92Å; F155-V169 HydrophobicContact CD1-CG2 4.26Å; F155-V169 HydrophobicContact CE1-CB 3.53Å; F155-V169 HydrophobicContact CE1-CG2 3.37Å; F155-V169 HydrophobicContact CZ-CB 4.11Å; F155-V169 HydrophobicContact CZ-CG2 3.6Å; F155-V169 PolarHBondContact N-O 3.47Å; F155-V169 PolarHBondContact O-N 3.38Å; F155-V169 VanDerWaalsContact O-N 3.13Å; V169-F172 HydrophobicContact CG1-CB 3.46Å; V169-F172 VanDerWaalsContact CG1-CB 3.46Å; V169-F172 HydrophobicContact CG1-CG 4.41Å; V169-L186 HydrophobicContact CG1-CD1 4.2Å; V169-L186 HydrophobicContact CG2-CD1 3.9Å; V169-L188 HydrophobicContact CG2-CD2 3.64Å; V169-V243 HydrophobicContact CG2-CG1 4.32Å
170	D	98.1	Very high	96.5	Very high	47 Å²	47	31.8 Å²	31.8	25%	0.251	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	126.7	172.3	168.6	30.1	0	0	0	108.4	H86 W88 Q89 F172	H86-D170 IonicContact CE1-OD1 3.84Å; H86-D170 IonicContact CG-OD1 3.66Å; H86-D170 IonicContact ND1-OD1 2.91Å; H86-D170 PolarHBondContact ND1-OD1 3.12Å; H86-D170 IonicContact ND1-OD2 3.86Å; W88-D170 HydrophobicContact CD2-CB 4.41Å; W88-D170 HydrophobicContact CH2-CB 4.26Å; W88-D170 HydrophobicContact CZ2-CB 4.06Å; W88-D170 HydrophobicContact CZ3-CB 4.5Å; W88-D170 WeakPolarHBondContact O-CB 3.21Å; Q89-D170 WeakPolarHBondContact CG-OD2 3.12Å; D170-F172 PolarHBondContact O-N 3.43Å
171	S	97.1	Very high	96.4	Very high	28 Å²	28	33.3 Å²	33.3	20%	0.196	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	50.1	51.1	167.9	-55.1	0	0	0	0	114.6	H81 H86 F152 L153 S154 D173	H81-S171 PolarHBondContact CE1-OG 2.82Å; H86-S171 PolarHBondContact CE1-OG 2.88Å; H86-S171 PolarHBondContact ND1-OG 3.12Å; F152-S171 WeakPolarHBondContact CD1-O 3.44Å; L153-S171 PolarHBondContact O-N 2.91Å; S154-S171 PolarHBondContact OG-N 2.83Å; S171-D173 PolarHBondContact O-N 2.87Å
172	F	97.6	Very high	96.3	Very high	44 Å²	44	37.6 Å²	37.6	19%	0.193	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	115.2	172.9	-175.6	-92.7	0	0	0	110.9	F152 L153 V169 D170 L174 K181 V184 L186 L245	F152-F172 WeakPolarHBondContact CA-O 3.4Å; L153-F172 PolarHBondContact N-O 2.99Å; L153-F172 PolarHBondContact O-N 3.49Å; V169-F172 HydrophobicContact CG1-CB 3.46Å; V169-F172 VanDerWaalsContact CG1-CB 3.46Å; V169-F172 HydrophobicContact CG1-CG 4.41Å; D170-F172 PolarHBondContact O-N 3.43Å; F172-L174 HydrophobicContact CD1-CD2 4.2Å; F172-L174 HydrophobicContact CD1-CG 4.22Å; F172-L174 HydrophobicContact CE1-CD2 4Å; F172-L174 HydrophobicContact CE1-CG 4.42Å; F172-L174 PolarHBondContact O-N 3.25Å; F172-K181 HydrophobicContact CE1-CD 4.4Å; F172-K181 HydrophobicContact CZ-CD 4.43Å; F172-V184 HydrophobicContact CE1-CB 4.31Å; F172-V184 HydrophobicContact CE1-CG1 3.81Å; F172-V184 HydrophobicContact CE1-CG2 4.07Å; F172-V184 HydrophobicContact CE2-CG1 4.26Å; F172-V184 HydrophobicContact CZ-CB 4.33Å; F172-V184 HydrophobicContact CZ-CG1 3.45Å; F172-V184 VanDerWaalsContact CZ-CG1 3.45Å; F172-V184 HydrophobicContact CZ-CG2 4.13Å; F172-L186 HydrophobicContact CD1-CD1 4.49Å; F172-L186 HydrophobicContact CD2-CD1 3.78Å; F172-L186 HydrophobicContact CD2-CD2 4.3Å; F172-L186 HydrophobicContact CE2-CD1 4.07Å; F172-L186 HydrophobicContact CE2-CD2 3.87Å; F172-L186 HydrophobicContact CG-CD1 4.02Å; F172-L186 HydrophobicContact CZ-CD2 4.43Å; F172-L245 HydrophobicContact CD1-CD1 4.17Å; F172-L245 HydrophobicContact CE1-CD1 4.37Å
173	D	97	Very high	96.2	Very high	37 Å²	37	40.9 Å²	40.9	20%	0.198	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	120.4	178	-164.5	-2.4	0	0	0	111.5	S151 F152 S171 C175 K181	S151-D173 WeakPolarHBondContact CB-OD1 3.29Å; S151-D173 PolarHBondContact OG-OD1 2.92Å; F152-D173 HydrophobicContact CD1-CB 3.9Å; F152-D173 HydrophobicContact CE1-CB 3.68Å; F152-D173 HydrophobicContact CZ-CB 4.35Å; S171-D173 PolarHBondContact O-N 2.87Å; D173-C175 WeakPolarHBondContact OD1-CB 3.41Å; D173-C175 PolarHBondContact OD1-N 2.92Å; D173-K181 PolarHBondContact O-NZ 3.25Å
174	L	96.2	Very high	96.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.223	C	C	.	.			trans	-88.1	-10.3	176.3	-76.9	164.1	0	0	0	113.4	Y47 F144 V146 S151 L153 F172 W180 K181 L245	Y47-L174 HydrophobicContact CD1-CD2 4.38Å; Y47-L174 HydrophobicContact CD2-CD1 4.46Å; Y47-L174 HydrophobicContact CE1-CD2 3.93Å; Y47-L174 HydrophobicContact CE2-CD1 4.47Å; F144-L174 HydrophobicContact CE2-CD1 3.58Å; F144-L174 HydrophobicContact CZ-CD1 3.74Å; V146-L174 HydrophobicContact CG1-CD1 3.85Å; S151-L174 PolarHBondContact O-N 2.89Å; L153-L174 HydrophobicContact CB-CD1 3.98Å; L153-L174 HydrophobicContact CD2-CD1 4.39Å; F172-L174 HydrophobicContact CD1-CD2 4.2Å; F172-L174 HydrophobicContact CD1-CG 4.22Å; F172-L174 HydrophobicContact CE1-CD2 4Å; F172-L174 HydrophobicContact CE1-CG 4.42Å; F172-L174 PolarHBondContact O-N 3.25Å; L174-W180 HydrophobicContact CB-CE3 4.22Å; L174-W180 HydrophobicContact CB-CZ3 4.2Å; L174-K181 WeakPolarHBondContact O-CG 3.32Å; L174-K181 PolarHBondContact O-N 2.8Å; L174-L245 HydrophobicContact CD2-CB 4.42Å; L174-L245 HydrophobicContact CD2-CD1 3.83Å
175	C	95.1	Very high	96.1	Very high	5 Å²	5	45.4 Å²	45.4	3%	0.034	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	148.8	177.2	-164.9	0	0	0	0	111.1	C39 D173 G177 W180	C39-C175 VanDerWaalsContact CA-SG 3.51Å; C39-C175 HydrophobicContact CB-CB 3.53Å; C39-C175 WeakPolarHBondContact CB-SG 3.26Å; C39-C175 WeakPolarHBondContact SG-CB 3.39Å; C39-C175 CovalentContact SG-SG 2.02Å; C39-C175 PolarHBondContact SG-SG 3Å; D173-C175 WeakPolarHBondContact OD1-CB 3.41Å; D173-C175 PolarHBondContact OD1-N 2.92Å; C175-G177 PolarHBondContact SG-O 3.45Å; C175-G177 VanDerWaalsContact SG-O 3.36Å; C175-W180 HydrophobicContact CB-CE3 4.08Å; C175-W180 HydrophobicContact CB-CH2 4.31Å; C175-W180 HydrophobicContact CB-CZ3 3.75Å
176	E	92.3	Very high	96.1	Very high	139 Å²	139	47 Å²	47	65%	0.65	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.2	94.6	173.2	-171.3	168.1	-171.1	0	0	107.9	D178 Q179	E176-D178 PolarHBondContact O-N 3.3Å; E176-Q179 PolarHBondContact N-O 2.77Å; E176-Q179 PolarHBondContact O-N 2.82Å; E176-Q179 VanDerWaalsContact O-N 3.09Å
177	G	89.2	Confident	96.1	Very high	31 Å²	31	52.5 Å²	52.5	32%	0.32	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.1	-112.5	-173.1	0	0	0	0	0	111.8	T40 C175	T40-G177 PolarHBondContact N-O 3.27Å; T40-G177 PolarHBondContact OG1-O 2.8Å; C175-G177 PolarHBondContact SG-O 3.45Å; C175-G177 VanDerWaalsContact SG-O 3.36Å
178	D	90.5	Very high	96.1	Very high	108 Å²	108	52.8 Å²	52.8	58%	0.578	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	-0.2	178.2	65.2	-26.7	0	0	0	113.4	E176	E176-D178 PolarHBondContact O-N 3.3Å
179	Q	92.4	Very high	96.1	Very high	133 Å²	133	55.7 Å²	55.7	62%	0.621	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.6	147.3	-174.6	-60.5	-167.3	-9.1	0	0	113.3	E176	E176-Q179 PolarHBondContact N-O 2.77Å; E176-Q179 PolarHBondContact O-N 2.82Å; E176-Q179 VanDerWaalsContact O-N 3.09Å
180	W	94.9	Very high	96.1	Very high	13 Å²	13	54.9 Å²	54.9	5%	0.049	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	130.2	171.1	-68.9	112.5	0	0	0	110.2	A41 T43 A45 Y47 V146 F147 L174 C175 E182 K247	A41-W180 HydrophobicContact CB-CD2 4.35Å; A41-W180 HydrophobicContact CB-CZ2 3.84Å; T43-W180 PolarHBondContact O-NE1 2.77Å; A45-W180 HydrophobicContact CB-CB 4.06Å; A45-W180 HydrophobicContact CB-CD2 3.73Å; A45-W180 HydrophobicContact CB-CE3 4.45Å; A45-W180 HydrophobicContact CB-CG 3.51Å; Y47-W180 HydrophobicContact CE2-CE3 4.44Å; Y47-W180 WeakPolarHBondContact OH-CB 3.39Å; V146-W180 HydrophobicContact CB-CH2 3.92Å; V146-W180 HydrophobicContact CB-CZ3 3.92Å; V146-W180 HydrophobicContact CG2-CD2 4.22Å; V146-W180 HydrophobicContact CG2-CE3 3.71Å; V146-W180 HydrophobicContact CG2-CH2 3.68Å; V146-W180 HydrophobicContact CG2-CZ2 4.16Å; V146-W180 HydrophobicContact CG2-CZ3 3.42Å; V146-W180 VanDerWaalsContact CG2-CZ3 3.42Å; F147-W180 WeakPolarHBondContact O-CH2 3.47Å; L174-W180 HydrophobicContact CB-CE3 4.22Å; L174-W180 HydrophobicContact CB-CZ3 4.2Å; C175-W180 HydrophobicContact CB-CE3 4.08Å; C175-W180 HydrophobicContact CB-CH2 4.31Å; C175-W180 HydrophobicContact CB-CZ3 3.75Å; W180-E182 PolarHBondContact O-N 2.8Å; W180-K247 HydrophobicContact CB-CD 4Å
181	K	96	Very high	96.1	Very high	54 Å²	54	54 Å²	54	24%	0.235	28%	0.28	C	S	.	.			trans	-58.2	124.1	178.6	-68.2	174.6	-176.4	167.7	0	111	Y47 F172 D173 L174 V184	Y47-K181 WeakPolarHBondContact CE1-O 3.12Å; Y47-K181 VanDerWaalsContact CZ-O 3.29Å; Y47-K181 PolarHBondContact OH-N 2.83Å; Y47-K181 PolarHBondContact OH-O 2.74Å; F172-K181 HydrophobicContact CE1-CD 4.4Å; F172-K181 HydrophobicContact CZ-CD 4.43Å; D173-K181 PolarHBondContact O-NZ 3.25Å; L174-K181 WeakPolarHBondContact O-CG 3.32Å; L174-K181 PolarHBondContact O-N 2.8Å; K181-V184 HydrophobicContact CB-CG2 3.82Å; K181-V184 HydrophobicContact CD-CG2 3.8Å; K181-V184 HydrophobicContact CG-CG2 4.38Å
182	E	95.8	Very high	96.2	Very high	106 Å²	106	54 Å²	54	50%	0.495	28%	0.278	S	S	.	.	S	Bend	trans	-68.9	-42.2	-175	-71.3	-64.8	138.8	0	0	113	W180 K247	W180-E182 PolarHBondContact O-N 2.8Å; E182-K247 WeakPolarHBondContact O-CB 3.5Å; E182-K247 PolarHBondContact O-N 3.33Å; E182-K247 WeakPolarHBondContact OE1-CD 3.31Å; E182-K247 IonicContact OE1-NZ 3.29Å; E182-K247 PolarHBondContact OE1-NZ 3.35Å
183	S	96.9	Very high	96.3	Very high	75 Å²	75	52 Å²	52	52%	0.524	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	139.2	174.3	-172.6	0	0	0	0	111.1	L245	S183-L245 CarbonylContact C-O 3.59Å; S183-L245 VanDerWaalsContact CA-O 3.24Å; S183-L245 WeakPolarHBondContact CA-O 3.17Å; S183-L245 PolarHBondContact OG-O 2.98Å
184	V	97.5	Very high	96.3	Very high	22 Å²	22	50.2 Å²	50.2	13%	0.133	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	141.1	178.4	-179.7	0	0	0	0	108.8	F172 K181 L186 T244 L245	F172-V184 HydrophobicContact CE1-CB 4.31Å; F172-V184 HydrophobicContact CE1-CG1 3.81Å; F172-V184 HydrophobicContact CE1-CG2 4.07Å; F172-V184 HydrophobicContact CE2-CG1 4.26Å; F172-V184 HydrophobicContact CZ-CB 4.33Å; F172-V184 HydrophobicContact CZ-CG1 3.45Å; F172-V184 VanDerWaalsContact CZ-CG1 3.45Å; F172-V184 HydrophobicContact CZ-CG2 4.13Å; K181-V184 HydrophobicContact CB-CG2 3.82Å; K181-V184 HydrophobicContact CD-CG2 3.8Å; K181-V184 HydrophobicContact CG-CG2 4.38Å; V184-L186 HydrophobicContact CG1-CD2 3.94Å; V184-L186 HydrophobicContact CG1-CG 4.02Å; V184-T244 CarbonylContact O-C 3.51Å; V184-T244 WeakPolarHBondContact O-CA 3.35Å; V184-L245 HydrophobicContact CB-CB 4.38Å; V184-L245 PolarHBondContact N-O 2.88Å; V184-L245 PolarHBondContact O-N 2.83Å
185	T	98.4	Very high	96.4	Very high	79 Å²	79	50.4 Å²	50.4	49%	0.485	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	128.7	171.4	-63.6	0	0	0	0	109.7	K242 V243 T244	T185-K242 HydrophobicContact CG2-CD 3.51Å; T185-K242 HydrophobicContact CG2-CG 3.6Å; T185-V243 CarbonylContact C-O 3.56Å; T185-V243 WeakPolarHBondContact CA-O 3.37Å; T185-T244 PolarHBondContact OG1-OG1 2.83Å
186	L	98.4	Very high	96.6	Very high	42 Å²	42	50.3 Å²	50.3	22%	0.22	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	134.7	179.1	-53.1	171.5	0	0	0	110	V169 F172 V184 K242 V243	V169-L186 HydrophobicContact CG1-CD1 4.2Å; V169-L186 HydrophobicContact CG2-CD1 3.9Å; F172-L186 HydrophobicContact CD1-CD1 4.49Å; F172-L186 HydrophobicContact CD2-CD1 3.78Å; F172-L186 HydrophobicContact CD2-CD2 4.3Å; F172-L186 HydrophobicContact CE2-CD1 4.07Å; F172-L186 HydrophobicContact CE2-CD2 3.87Å; F172-L186 HydrophobicContact CG-CD1 4.02Å; F172-L186 HydrophobicContact CZ-CD2 4.43Å; V184-L186 HydrophobicContact CG1-CD2 3.94Å; V184-L186 HydrophobicContact CG1-CG 4.02Å; L186-K242 CarbonylContact O-C 3.54Å; L186-K242 WeakPolarHBondContact O-CA 3.47Å; L186-K242 WeakPolarHBondContact O-CG 3.32Å; L186-V243 HydrophobicContact CB-CG1 3.74Å; L186-V243 HydrophobicContact CD1-CG1 4.21Å; L186-V243 HydrophobicContact CG-CG1 4.3Å; L186-V243 PolarHBondContact N-O 2.82Å; L186-V243 PolarHBondContact O-N 2.88Å
187	E	98.6	Very high	96.8	Very high	117 Å²	117	45.7 Å²	45.7	55%	0.547	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	137.9	171.3	-65.3	-174.3	159	0	0	109.9	Y189 P239	E187-Y189 HydrophobicContact CB-CE2 4.21Å; E187-Y189 PolarHBondContact OE2-OH 3.39Å; E187-P239 HydrophobicContact CB-CB 4.07Å; E187-P239 HydrophobicContact CB-CG 4.01Å; E187-P239 VanDerWaalsContact CD-CG 3.45Å; E187-P239 HydrophobicContact CG-CB 4.32Å; E187-P239 HydrophobicContact CG-CG 3.98Å; E187-P239 WeakPolarHBondContact OE2-CG 3.43Å
188	L	98.6	Very high	97	Very high	5 Å²	5	44.7 Å²	44.7	3%	0.026	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	140.9	-173.7	-54.8	176.5	0	0	0	111.2	F51 F155 L167 V169 M240 G241 V243	F51-L188 HydrophobicContact CD2-CD1 3.75Å; F51-L188 HydrophobicContact CE2-CD1 3.61Å; F155-L188 HydrophobicContact CE2-CD1 4.09Å; F155-L188 HydrophobicContact CZ-CD1 3.87Å; F155-L188 HydrophobicContact CZ-CD2 4.08Å; L167-L188 HydrophobicContact CB-CB 4.39Å; L167-L188 HydrophobicContact CD1-CB 3.99Å; L167-L188 HydrophobicContact CD1-CD1 4.46Å; L167-L188 HydrophobicContact CD2-CB 4.35Å; V169-L188 HydrophobicContact CG2-CD2 3.64Å; L188-M240 PolarHBondContact O-N 2.73Å; L188-G241 WeakPolarHBondContact CB-O 3.34Å; L188-G241 PolarHBondContact N-O 2.65Å; L188-G241 PolarHBondContact O-N 2.89Å; L188-V243 HydrophobicContact CD1-CB 4.27Å; L188-V243 HydrophobicContact CD1-CG1 4.39Å; L188-V243 HydrophobicContact CD2-CG1 4.12Å; L188-V243 HydrophobicContact CG-CG1 4.45Å
189	Y	98.6	Very high	96.8	Very high	68 Å²	68	44.5 Å²	44.5	27%	0.267	23%	0.227	S	C	.	.			trans	-131.1	149.8	-177.5	-60.8	-80.6	0	0	0	110.6	L167 E187 Y191 L237 P239	L167-Y189 WeakPolarHBondContact CD2-O 3.29Å; E187-Y189 HydrophobicContact CB-CE2 4.21Å; E187-Y189 PolarHBondContact OE2-OH 3.39Å; Y189-Y191 VanDerWaalsContact O-CD2 3.28Å; Y189-Y191 WeakPolarHBondContact O-CD2 3.37Å; Y189-L237 WeakPolarHBondContact CE1-O 3.41Å; Y189-P239 HydrophobicContact CE1-CG 4.36Å
190	P	98.7	Very high	96.9	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.204	C	C	.	.			trans	-64.4	139.6	-176.7	25.8	-34	0	0	0	112.4	I159 L167 I217 F229 L237 M240	I159-P190 HydrophobicContact CD1-CB 3.84Å; L167-P190 HydrophobicContact CD2-CB 4.41Å; L167-P190 VanDerWaalsContact CD2-N 3.35Å; P190-I217 HydrophobicContact CB-CB 4.07Å; P190-I217 HydrophobicContact CB-CD1 4.23Å; P190-I217 HydrophobicContact CG-CB 3.95Å; P190-I217 HydrophobicContact CG-CG2 4.23Å; P190-I217 PolarHBondContact O-N 3.43Å; P190-F229 HydrophobicContact CB-CD2 4.49Å; P190-F229 HydrophobicContact CB-CE2 4.04Å; P190-F229 HydrophobicContact CB-CZ 4.14Å; P190-F229 HydrophobicContact CG-CD1 4.3Å; P190-F229 HydrophobicContact CG-CD2 4.37Å; P190-F229 HydrophobicContact CG-CE1 4.21Å; P190-F229 HydrophobicContact CG-CE2 4.24Å; P190-F229 HydrophobicContact CG-CG 4.38Å; P190-F229 HydrophobicContact CG-CZ 4.16Å; P190-L237 HydrophobicContact CG-CD1 3.91Å; P190-M240 HydrophobicContact CB-SD 4.36Å; P190-M240 HydrophobicContact CG-SD 4.49Å
191	Y	98.9	Very high	97	Very high	29 Å²	29	38.9 Å²	38.9	11%	0.114	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	151	168.5	-74	-95.3	0	0	0	109.9	W88 R90 W165 F166 Y189 V214 T215 Q216	W88-Y191 HydrophobicContact CH2-CD1 4.49Å; W88-Y191 HydrophobicContact CH2-CD2 4.09Å; W88-Y191 HydrophobicContact CH2-CE1 4.23Å; W88-Y191 AromaticContact CH2-CE2 3.79Å; W88-Y191 HydrophobicContact CH2-CE2 3.79Å; W88-Y191 HydrophobicContact CH2-CG 4.41Å; W88-Y191 AromaticContact CH2-CZ 3.85Å; W88-Y191 HydrophobicContact CZ3-CD1 4.05Å; W88-Y191 HydrophobicContact CZ3-CD2 4.4Å; W88-Y191 AromaticContact CZ3-CE1 3.95Å; W88-Y191 HydrophobicContact CZ3-CE1 3.95Å; W88-Y191 HydrophobicContact CZ3-CE2 4.29Å; W88-Y191 HydrophobicContact CZ3-CG 4.27Å; R90-Y191 HydrophobicContact CB-CE1 4.41Å; R90-Y191 HydrophobicContact CG-CE1 4.34Å; R90-Y191 PolarHBondContact NH2-OH 3.06Å; W165-Y191 CarbonylContact C-O 3.57Å; W165-Y191 VanDerWaalsContact CA-O 3.23Å; W165-Y191 WeakPolarHBondContact CA-O 3.34Å; F166-Y191 HydrophobicContact CE2-CG 4.35Å; F166-Y191 HydrophobicContact CZ-CG 4.41Å; F166-Y191 PolarHBondContact N-O 2.98Å; F166-Y191 PolarHBondContact O-N 3.2Å; Y189-Y191 VanDerWaalsContact O-CD2 3.28Å; Y189-Y191 WeakPolarHBondContact O-CD2 3.37Å; Y191-V214 HydrophobicContact CD1-CG1 3.97Å; Y191-T215 CarbonylContact C-O 3.58Å; Y191-T215 VanDerWaalsContact CA-O 3.29Å; Y191-T215 WeakPolarHBondContact CA-O 3.29Å; Y191-T215 WeakPolarHBondContact CD1-O 3.22Å; Y191-Q216 HydrophobicContact CD1-CB 3.97Å; Y191-Q216 HydrophobicContact CD1-CG 4.5Å; Y191-Q216 HydrophobicContact CE1-CB 3.68Å; Y191-Q216 HydrophobicContact CE1-CG 4.15Å
192	D	98.8	Very high	96.9	Very high	28 Å²	28	40.9 Å²	40.9	15%	0.15	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	131	172.1	-168.4	-68.4	0	0	0	107.9	W165 G194 V214 T215 I217	W165-D192 PolarHBondContact NE1-OD2 2.9Å; D192-G194 VanDerWaalsContact C-N 3.3Å; D192-G194 WeakPolarHBondContact OD1-CA 3.35Å; D192-G194 PolarHBondContact OD1-N 3.28Å; D192-V214 VanDerWaalsContact O-CA 3.27Å; D192-V214 WeakPolarHBondContact O-CA 3.19Å; D192-T215 PolarHBondContact N-O 2.95Å; D192-T215 PolarHBondContact O-N 3.45Å; D192-I217 HydrophobicContact CB-CD1 3.95Å; D192-I217 HydrophobicContact CB-CG1 3.87Å
193	A	98.7	Very high	96.7	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.21	C	C	.	.			trans	-78.6	-15.7	-177.5	0	0	0	0	0	113.2	A94 D164 F166 T195	A94-A193 HydrophobicContact CB-CB 4.4Å; D164-A193 HydrophobicContact CB-CB 4Å; D164-A193 WeakPolarHBondContact O-CB 3.19Å; D164-A193 PolarHBondContact O-N 3.15Å; F166-A193 HydrophobicContact CD1-CB 4.33Å; F166-A193 HydrophobicContact CE1-CB 4Å; A193-T195 HydrophobicContact CB-CG2 4.48Å
194	G	98.4	Very high	96.5	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.01	22%	0.219	C	C	.	.	S	Bend	trans	77.4	22.3	-178.1	0	0	0	0	0	113.8	D164 D192 T208 Q211 D212	D164-G194 PolarHBondContact OD2-N 2.8Å; D164-G194 VanDerWaalsContact OD2-N 3.07Å; D192-G194 VanDerWaalsContact C-N 3.3Å; D192-G194 WeakPolarHBondContact OD1-CA 3.35Å; D192-G194 PolarHBondContact OD1-N 3.28Å; G194-T208 WeakPolarHBondContact O-CB 3.46Å; G194-Q211 WeakPolarHBondContact O-CG 3.48Å; G194-D212 PolarHBondContact O-N 3.42Å
195	T	98.4	Very high	96.2	Very high	3 Å²	3	43.8 Å²	43.8	2%	0.018	24%	0.244	C	C	.	.	S	Bend	trans	-116.2	-22.3	-175.1	66.9	0	0	0	0	113.7	A94 R99 E103 D164 A193 T208 Q211	A94-T195 HydrophobicContact CB-CG2 4.29Å; R99-T195 HydrophobicContact CB-CG2 3.98Å; R99-T195 HydrophobicContact CG-CG2 3.76Å; E103-T195 VanDerWaalsContact OE1-CB 3.28Å; E103-T195 WeakPolarHBondContact OE1-CB 3.21Å; E103-T195 PolarHBondContact OE1-OG1 2.92Å; D164-T195 PolarHBondContact OD2-N 2.79Å; A193-T195 HydrophobicContact CB-CG2 4.48Å; T195-T208 PolarHBondContact O-N 3.41Å; T195-Q211 HydrophobicContact CG2-CG 4.04Å
196	D	98.2	Very high	95.9	Very high	3 Å²	3	46.5 Å²	46.5	2%	0.016	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-131.5	126.5	173.1	-164.1	-64.5	0	0	0	111.6	P163 D164 G198 N205 F206 T208	P163-D196 HydrophobicContact CB-CB 3.93Å; D164-D196 HydrophobicContact CB-CB 4Å; D164-D196 PolarHBondContact OD2-N 2.92Å; D196-G198 VanDerWaalsContact C-N 3.29Å; D196-G198 PolarHBondContact O-N 2.86Å; D196-G198 PolarHBondContact OD1-N 3.37Å; D196-N205 WeakPolarHBondContact OD2-CA 3.23Å; D196-F206 CarbonylContact C-O 3.53Å; D196-F206 WeakPolarHBondContact CA-O 3.37Å; D196-F206 PolarHBondContact OD1-N 3.44Å; D196-F206 PolarHBondContact OD2-N 2.84Å; D196-T208 WeakPolarHBondContact CA-OG1 3.33Å; D196-T208 PolarHBondContact N-OG1 3.02Å
197	S	96.3	Very high	95.8	Very high	42 Å²	42	49 Å²	49	29%	0.294	26%	0.26	S	S	.	.			trans	-89.3	16	-174.9	-76.2	0	0	0	0	113.4	F199 F206 T208	S197-F199 WeakPolarHBondContact O-CD1 3.37Å; S197-F199 WeakPolarHBondContact O-CE1 3.23Å; S197-F206 VanDerWaalsContact CB-CD1 3.43Å; S197-F206 PolarHBondContact N-O 2.97Å; S197-T208 PolarHBondContact N-OG1 3.14Å; S197-T208 VanDerWaalsContact N-OG1 3.09Å; S197-T208 PolarHBondContact OG-OG1 3.33Å
198	G	93.6	Very high	95.6	Very high	10 Å²	10	44 Å²	44	10%	0.103	24%	0.238	C	C	.	.			trans	-57.3	137.8	172	0	0	0	0	0	112.5	P163 D196	P163-G198 VanDerWaalsContact CG-O 3.31Å; P163-G198 WeakPolarHBondContact CG-O 3.48Å; D196-G198 VanDerWaalsContact C-N 3.29Å; D196-G198 PolarHBondContact O-N 2.86Å; D196-G198 PolarHBondContact OD1-N 3.37Å
199	F	87.3	Confident	95.5	Very high	104 Å²	104	50.3 Å²	50.3	46%	0.456	27%	0.27	S	S	.	.			trans	-89.2	-24.8	-175.9	-61.8	-26.3	0	0	0	113.8	S197 S203 N227 S228	S197-F199 WeakPolarHBondContact O-CD1 3.37Å; S197-F199 WeakPolarHBondContact O-CE1 3.23Å; F199-S203 PolarHBondContact N-OG 3.46Å; F199-N227 WeakPolarHBondContact CB-OD1 3.38Å; F199-N227 VanDerWaalsContact O-CA 3.3Å; F199-N227 WeakPolarHBondContact O-CA 3.41Å; F199-S228 PolarHBondContact O-N 2.86Å
200	T	94.9	Very high	95.4	Very high	24 Å²	24	52.2 Å²	52.2	15%	0.147	29%	0.29	C	S	.	.	S	Bend	trans	-125.7	159.4	-171.7	71.8	0	0	0	0	111.7	P163 S202 S203 A226 S228	P163-T200 WeakPolarHBondContact CD-O 3.28Å; P163-T200 WeakPolarHBondContact CG-O 3.47Å; T200-S202 PolarHBondContact O-N 3.42Å; T200-S203 PolarHBondContact N-OG 2.86Å; T200-S203 WeakPolarHBondContact O-CB 3.36Å; T200-S203 PolarHBondContact O-N 2.94Å; T200-S203 PolarHBondContact O-OG 3.05Å; T200-S203 PolarHBondContact OG1-N 2.58Å; T200-S203 PolarHBondContact OG1-OG 2.79Å; T200-A226 WeakPolarHBondContact CG2-O 3.46Å; T200-S228 WeakPolarHBondContact CA-OG 3.29Å
201	F	95.9	Very high	95.4	Very high	5 Å²	5	55.2 Å²	55.2	2%	0.022	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46.3	-36	175.3	-64.9	-63.1	0	0	0	114.1	W55 Q63 P65 I159 P161 S162 W165 S228 F229	W55-F201 AromaticContact CE2-CZ 3.98Å; W55-F201 AromaticContact CH2-CD1 3.86Å; W55-F201 HydrophobicContact CH2-CD1 3.86Å; W55-F201 AromaticContact CH2-CE1 3.88Å; W55-F201 HydrophobicContact CH2-CE1 3.88Å; W55-F201 HydrophobicContact CH2-CG 4.42Å; W55-F201 HydrophobicContact CH2-CZ 4.41Å; W55-F201 AromaticContact CZ2-CD1 3.7Å; W55-F201 HydrophobicContact CZ2-CD1 3.7Å; W55-F201 HydrophobicContact CZ2-CD2 4.19Å; W55-F201 AromaticContact CZ2-CE1 3.37Å; W55-F201 HydrophobicContact CZ2-CE1 3.37Å; W55-F201 AromaticContact CZ2-CE2 3.86Å; W55-F201 HydrophobicContact CZ2-CE2 3.86Å; W55-F201 HydrophobicContact CZ2-CG 4.13Å; W55-F201 AromaticContact CZ2-CZ 3.46Å; W55-F201 HydrophobicContact CZ2-CZ 3.46Å; W55-F201 VanDerWaalsContact CZ2-CZ 3.46Å; Q63-F201 HydrophobicContact CB-CD2 4.32Å; Q63-F201 WeakPolarHBondContact O-CD2 3.47Å; P65-F201 HydrophobicContact CG-CB 3.63Å; P65-F201 HydrophobicContact CG-CD1 4.48Å; P65-F201 HydrophobicContact CG-CD2 3.8Å; P65-F201 HydrophobicContact CG-CG 3.74Å; I159-F201 HydrophobicContact CG2-CD1 4.31Å; I159-F201 HydrophobicContact CG2-CE1 4.14Å; P161-F201 CarbonylContact C-O 3.32Å; P161-F201 WeakPolarHBondContact CB-O 3.34Å; P161-F201 HydrophobicContact CG-CB 4.3Å; P161-F201 WeakPolarHBondContact O-CB 3.14Å; P161-F201 WeakPolarHBondContact O-CD1 3.24Å; S162-F201 VanDerWaalsContact CA-O 3.32Å; S162-F201 WeakPolarHBondContact CA-O 3.43Å; S162-F201 PolarHBondContact N-O 2.59Å; W165-F201 AromaticContact CE3-CD1 3.79Å; W165-F201 HydrophobicContact CE3-CD1 3.79Å; W165-F201 AromaticContact CE3-CE1 3.87Å; W165-F201 HydrophobicContact CE3-CE1 3.87Å; W165-F201 AromaticContact CZ3-CD1 3.39Å; W165-F201 HydrophobicContact CZ3-CD1 3.39Å; W165-F201 AromaticContact CZ3-CE1 3.59Å; W165-F201 HydrophobicContact CZ3-CE1 3.59Å; W165-F201 HydrophobicContact CZ3-CG 4Å; W165-F201 HydrophobicContact CZ3-CZ 4.37Å; F201-S228 WeakPolarHBondContact CD2-OG 3.29Å; F201-S228 VanDerWaalsContact CE2-CB 3.42Å; F201-S228 PolarHBondContact N-OG 2.82Å; F201-S228 VanDerWaalsContact N-OG 3.16Å; F201-F229 HydrophobicContact CE1-CE1 4.37Å; F201-F229 AromaticContact CE1-CE2 3.73Å; F201-F229 HydrophobicContact CE1-CE2 3.73Å; F201-F229 AromaticContact CE1-CZ 3.54Å; F201-F229 HydrophobicContact CE1-CZ 3.54Å; F201-F229 AromaticContact CZ-CE1 3.99Å; F201-F229 HydrophobicContact CZ-CE1 3.99Å; F201-F229 AromaticContact CZ-CE2 4Å; F201-F229 HydrophobicContact CZ-CE2 4Å; F201-F229 AromaticContact CZ-CZ 3.61Å; F201-F229 HydrophobicContact CZ-CZ 3.61Å
202	S	93.7	Very high	95.3	Very high	95 Å²	95	58.3 Å²	58.3	66%	0.664	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.6	23.5	-175.9	70.6	0	0	0	0	113	T200	T200-S202 PolarHBondContact O-N 3.42Å
203	S	92.9	Very high	95.3	Very high	30 Å²	30	60.9 Å²	60.9	21%	0.21	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-64.2	144	174.6	-71.2	0	0	0	0	110.5	F199 T200	F199-S203 PolarHBondContact N-OG 3.46Å; T200-S203 PolarHBondContact N-OG 2.86Å; T200-S203 WeakPolarHBondContact O-CB 3.36Å; T200-S203 PolarHBondContact O-N 2.94Å; T200-S203 PolarHBondContact O-OG 3.05Å; T200-S203 PolarHBondContact OG1-N 2.58Å; T200-S203 PolarHBondContact OG1-OG 2.79Å
204	P	91.7	Very high	95.3	Very high	110 Å²	110	61 Å²	61	71%	0.714	33%	0.333	S	S	*	.	P	Polyproline II helix	trans	-64.3	152.9	169.2	30.7	-34.8	0	0	0	109.6	F206	P204-F206 PolarHBondContact O-N 3.35Å
205	N	91.2	Very high	95.3	Very high	124 Å²	124	64 Å²	64	66%	0.663	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-57.2	131.1	179.7	-61.9	26.8	0	0	0	111	D196	D196-N205 WeakPolarHBondContact OD2-CA 3.23Å
206	F	93.1	Very high	95.3	Very high	136 Å²	136	66.6 Å²	66.6	60%	0.596	36%	0.364	S	S	*	.			trans	-143.4	93.1	178.6	-175.9	-121.8	0	0	0	109.4	D196 S197 P204 T208	D196-F206 CarbonylContact C-O 3.53Å; D196-F206 WeakPolarHBondContact CA-O 3.37Å; D196-F206 PolarHBondContact OD1-N 3.44Å; D196-F206 PolarHBondContact OD2-N 2.84Å; S197-F206 VanDerWaalsContact CB-CD1 3.43Å; S197-F206 PolarHBondContact N-O 2.97Å; P204-F206 PolarHBondContact O-N 3.35Å; F206-T208 PolarHBondContact O-N 2.85Å
207	E	95.3	Very high	95.3	Very high	96 Å²	96	66.8 Å²	66.8	45%	0.449	37%	0.365	S	S	.	.	B	Isolated β-bridge	trans	-55.5	132	-173.9	-172.3	172.1	-153.7	0	0	112.9	R99 I209	R99-E207 IonicContact CZ-OE1 3.76Å; R99-E207 VanDerWaalsContact CZ-OE1 3.29Å; R99-E207 IonicContact NH1-OE1 3.27Å; R99-E207 PolarHBondContact NH1-OE1 3.47Å; R99-E207 VanDerWaalsContact NH2-CD 3.33Å; R99-E207 IonicContact NH2-OE1 4Å; R99-E207 PolarHBondContact NH2-OE1 3.37Å; E207-I209 HydrophobicContact CB-CD1 4.41Å; E207-I209 HydrophobicContact CB-CG1 4.34Å; E207-I209 HydrophobicContact CG-CD1 4.13Å; E207-I209 HydrophobicContact CG-CG1 3.82Å; E207-I209 PolarHBondContact O-N 3.03Å
208	T	95.4	Very high	95.4	Very high	12 Å²	12	66.9 Å²	66.9	7%	0.074	36%	0.363	C	S	.	.			trans	-78.8	112.8	175.2	-57	0	0	0	0	109.6	G194 T195 D196 S197 F206 P210 Q211 D212	G194-T208 WeakPolarHBondContact O-CB 3.46Å; T195-T208 PolarHBondContact O-N 3.41Å; D196-T208 WeakPolarHBondContact CA-OG1 3.33Å; D196-T208 PolarHBondContact N-OG1 3.02Å; S197-T208 PolarHBondContact N-OG1 3.14Å; S197-T208 VanDerWaalsContact N-OG1 3.09Å; S197-T208 PolarHBondContact OG-OG1 3.33Å; F206-T208 PolarHBondContact O-N 2.85Å; T208-P210 CarbonylContact C-O 3.41Å; T208-P210 WeakPolarHBondContact CG2-O 3.26Å; T208-P210 CarbonylContact O-C 3.58Å; T208-Q211 PolarHBondContact O-N 2.74Å; T208-D212 HydrophobicContact CG2-CB 4.12Å
209	I	94.7	Very high	95.5	Very high	136 Å²	136	66.4 Å²	66.4	70%	0.697	36%	0.359	S	S	*	.	S	Bend	trans	-129.2	118.6	-177.4	-56	178.2	0	0	0	110.1	E207	E207-I209 HydrophobicContact CB-CD1 4.41Å; E207-I209 HydrophobicContact CB-CG1 4.34Å; E207-I209 HydrophobicContact CG-CD1 4.13Å; E207-I209 HydrophobicContact CG-CG1 3.82Å; E207-I209 PolarHBondContact O-N 3.03Å
210	P	97	Very high	95.6	Very high	108 Å²	108	65 Å²	65	70%	0.701	36%	0.361	S	S	*	.	S	Bend	cis	-65.9	158	-6.6	31.8	-36	0	0	0	111.5	T208 D212	T208-P210 CarbonylContact C-O 3.41Å; T208-P210 WeakPolarHBondContact CG2-O 3.26Å; T208-P210 CarbonylContact O-C 3.58Å; P210-D212 PolarHBondContact O-N 2.89Å
211	Q	98	Very high	95.6	Very high	64 Å²	64	67 Å²	67	30%	0.299	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-54.4	135.6	174.6	-176.5	-178	-10.7	0	0	110	F93 A94 G194 T195 T208	F93-Q211 HydrophobicContact CD1-CG 4.29Å; F93-Q211 VanDerWaalsContact CE1-O 3.32Å; F93-Q211 WeakPolarHBondContact CE1-O 3.49Å; A94-Q211 PolarHBondContact O-NE2 2.81Å; G194-Q211 WeakPolarHBondContact O-CG 3.48Å; T195-Q211 HydrophobicContact CG2-CG 4.04Å; T208-Q211 PolarHBondContact O-N 2.74Å
212	D	98.1	Very high	95.4	Very high	94 Å²	94	69.6 Å²	69.6	50%	0.503	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-92.5	166.4	174.8	-80.2	-34.6	0	0	0	111.2	G194 T208 P210	G194-D212 PolarHBondContact O-N 3.42Å; T208-D212 HydrophobicContact CG2-CB 4.12Å; P210-D212 PolarHBondContact O-N 2.89Å
213	K	98.6	Very high	95.1	Very high	82 Å²	82	69 Å²	69	36%	0.357	39%	0.39	S	S	.	.	B	Isolated β-bridge	trans	-79.1	155	175.5	-75	162.3	165.3	-108	0	110.3	N91 E92 F93 T215	N91-K213 WeakPolarHBondContact O-CD 3.44Å; N91-K213 WeakPolarHBondContact O-CE 3.24Å; N91-K213 WeakPolarHBondContact O-CG 3.45Å; N91-K213 PolarHBondContact O-NZ 3.08Å; E92-K213 CarbonylContact O-C 3.03Å; E92-K213 WeakPolarHBondContact O-CA 3.19Å; E92-K213 IonicContact OE1-NZ 3.68Å; E92-K213 IonicContact OE2-NZ 3.74Å; F93-K213 HydrophobicContact CD1-CG 4.01Å; F93-K213 HydrophobicContact CD2-CG 4.47Å; F93-K213 HydrophobicContact CE1-CG 3.82Å; F93-K213 HydrophobicContact CE2-CG 4.31Å; F93-K213 HydrophobicContact CG-CG 4.34Å; F93-K213 HydrophobicContact CZ-CD 4.46Å; F93-K213 HydrophobicContact CZ-CG 3.99Å; K213-T215 WeakPolarHBondContact O-CG2 3.34Å; K213-T215 PolarHBondContact O-N 2.74Å
214	V	98.8	Very high	94.8	Very high	1 Å²	1	71.9 Å²	71.9	1%	0.006	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-59.2	123.2	173.6	174.7	0	0	0	0	109.9	W88 Q89 N91 E92 A94 F166 Y191 D192	W88-V214 HydrophobicContact CE3-CG1 4.02Å; W88-V214 HydrophobicContact CZ3-CG1 4.27Å; Q89-V214 WeakPolarHBondContact O-CB 3.14Å; N91-V214 PolarHBondContact N-O 3.39Å; E92-V214 WeakPolarHBondContact O-CG2 3.48Å; E92-V214 PolarHBondContact O-N 3.04Å; A94-V214 HydrophobicContact CB-CG2 4.31Å; F166-V214 HydrophobicContact CE1-CG1 4.28Å; F166-V214 HydrophobicContact CZ-CG1 3.79Å; Y191-V214 HydrophobicContact CD1-CG1 3.97Å; D192-V214 VanDerWaalsContact O-CA 3.27Å; D192-V214 WeakPolarHBondContact O-CA 3.19Å
215	T	98.4	Very high	94.4	Very high	65 Å²	65	71.1 Å²	71.1	40%	0.399	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	147.3	-179.6	58.5	0	0	0	0	112.1	Y191 D192 K213	Y191-T215 CarbonylContact C-O 3.58Å; Y191-T215 VanDerWaalsContact CA-O 3.29Å; Y191-T215 WeakPolarHBondContact CA-O 3.29Å; Y191-T215 WeakPolarHBondContact CD1-O 3.22Å; D192-T215 PolarHBondContact N-O 2.95Å; D192-T215 PolarHBondContact O-N 3.45Å; K213-T215 WeakPolarHBondContact O-CG2 3.34Å; K213-T215 PolarHBondContact O-N 2.74Å
216	Q	98.4	Very high	94.1	Very high	58 Å²	58	66.9 Å²	66.9	27%	0.271	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	127.3	174.1	-171.8	179.1	18.2	0	0	109.6	R90 Y191	R90-Q216 VanDerWaalsContact NH2-CD 3.27Å; Y191-Q216 HydrophobicContact CD1-CB 3.97Å; Y191-Q216 HydrophobicContact CD1-CG 4.5Å; Y191-Q216 HydrophobicContact CE1-CB 3.68Å; Y191-Q216 HydrophobicContact CE1-CG 4.15Å
217	I	98.5	Very high	94	Very high	6 Å²	6	60.9 Å²	60.9	3%	0.031	35%	0.351	C	S	.	.			trans	-78.8	132.2	172.6	-60.4	171.2	0	0	0	108.7	W165 P190 D192 F229	W165-I217 HydrophobicContact CB-CD1 4.34Å; W165-I217 HydrophobicContact CD2-CD1 4.03Å; W165-I217 HydrophobicContact CG-CD1 3.75Å; P190-I217 HydrophobicContact CB-CB 4.07Å; P190-I217 HydrophobicContact CB-CD1 4.23Å; P190-I217 HydrophobicContact CG-CB 3.95Å; P190-I217 HydrophobicContact CG-CG2 4.23Å; P190-I217 PolarHBondContact O-N 3.43Å; D192-I217 HydrophobicContact CB-CD1 3.95Å; D192-I217 HydrophobicContact CB-CG1 3.87Å; I217-F229 HydrophobicContact CD1-CD2 4.29Å; I217-F229 HydrophobicContact CG2-CB 3.45Å; I217-F229 VanDerWaalsContact CG2-CB 3.45Å; I217-F229 HydrophobicContact CG2-CD2 3.71Å; I217-F229 HydrophobicContact CG2-CG 3.82Å
218	T	97.9	Very high	94	Very high	44 Å²	44	56.3 Å²	56.3	27%	0.27	33%	0.33	S	S	.	.			trans	-126.4	175	-178.1	68.5	0	0	0	0	110.8	S220 S221	T218-S220 PolarHBondContact O-N 2.88Å; T218-S220 PolarHBondContact OG1-N 3.38Å; T218-S221 PolarHBondContact N-O 3.23Å; T218-S221 PolarHBondContact OG1-N 2.85Å; T218-S221 PolarHBondContact OG1-O 3.23Å; T218-S221 VanDerWaalsContact OG1-O 3.12Å
219	S	94.9	Very high	94	Very high	1 Å²	1	56 Å²	56	1%	0.007	33%	0.328	C	S	.	.	S	Bend	trans	-67.4	-18.2	177.7	57.4	0	0	0	0	113.3	F229 Y231 L234 K235	S219-F229 WeakPolarHBondContact CA-O 3.24Å; S219-Y231 CarbonylContact O-C 3.51Å; S219-Y231 PolarHBondContact O-N 3.12Å; S219-L234 WeakPolarHBondContact CB-O 3.44Å; S219-L234 PolarHBondContact OG-O 3.26Å; S219-K235 PolarHBondContact OG-O 3.17Å
220	S	91.4	Very high	93.9	Very high	73 Å²	73	52.2 Å²	52.2	51%	0.51	31%	0.305	S	S	.	.	S	Bend	trans	-117.3	-15.7	-174.5	59.1	0	0	0	0	114.2	T218 S223	T218-S220 PolarHBondContact O-N 2.88Å; T218-S220 PolarHBondContact OG1-N 3.38Å; S220-S223 WeakPolarHBondContact O-CA 3.35Å; S220-S223 VanDerWaalsContact O-CB 3.28Å; S220-S223 WeakPolarHBondContact O-CB 3.44Å
221	S	93.1	Very high	93.7	Very high	67 Å²	67	48.6 Å²	48.6	47%	0.469	28%	0.277	S	S	.	.	S	Bend	trans	-138.7	128.8	179.5	-172.6	0	0	0	0	110.7	T218	T218-S221 PolarHBondContact N-O 3.23Å; T218-S221 PolarHBondContact OG1-N 2.85Å; T218-S221 PolarHBondContact OG1-O 3.23Å; T218-S221 VanDerWaalsContact OG1-O 3.12Å
222	P	92.6	Very high	93.1	Very high	59 Å²	59	49.8 Å²	49.8	38%	0.383	29%	0.291	S	S	.	.	S	Bend	cis	-71.6	142.7	1.9	27.2	-32.3	0	0	0	112.8	H224 N227	P222-H224 PolarHBondContact O-N 3.25Å; P222-N227 WeakPolarHBondContact CB-ND2 3.19Å; P222-N227 HydrophobicContact CG-CB 4.49Å; P222-N227 VanDerWaalsContact CG-ND2 3.29Å; P222-N227 WeakPolarHBondContact CG-ND2 3.28Å; P222-N227 PolarHBondContact O-ND2 2.92Å
223	S	87.3	Confident	92.8	Very high	82 Å²	82	57 Å²	57	57%	0.573	31%	0.311	S	S	*	.			trans	-90.9	11.2	-163.7	67.8	0	0	0	0	115.9	S220	S220-S223 WeakPolarHBondContact O-CA 3.35Å; S220-S223 VanDerWaalsContact O-CB 3.28Å; S220-S223 WeakPolarHBondContact O-CB 3.44Å
224	H	86.3	Confident	92.3	Very high	91 Å²	91	56.7 Å²	56.7	42%	0.421	31%	0.313	S	S	.	.			trans	-73.8	135.9	-179.7	-172.6	-95.4	0	0	0	110.5	P222 A226 N227	P222-H224 PolarHBondContact O-N 3.25Å; H224-A226 VanDerWaalsContact ND1-CB 3.34Å; H224-A226 WeakPolarHBondContact ND1-CB 3.14Å; H224-A226 PolarHBondContact ND1-N 2.94Å; H224-A226 PolarHBondContact O-N 2.89Å; H224-A226 VanDerWaalsContact O-N 3.08Å; H224-N227 WeakPolarHBondContact CB-ND2 3.46Å; H224-N227 PolarHBondContact N-ND2 3.27Å; H224-N227 VanDerWaalsContact N-ND2 3.17Å; H224-N227 VanDerWaalsContact O-CB 3.32Å; H224-N227 WeakPolarHBondContact O-CB 3.31Å; H224-N227 PolarHBondContact O-N 2.85Å
225	P	82.6	Confident	92	Very high	94 Å²	94	65.6 Å²	65.6	61%	0.61	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-30.6	-176.9	-29.2	36.3	0	0	0	114.9	K62 N227	K62-P225 WeakPolarHBondContact CE-O 3.36Å; K62-P225 PolarHBondContact NZ-O 3.42Å; P225-N227 VanDerWaalsContact C-N 3.32Å
226	A	85.8	Confident	91.8	Very high	35 Å²	35	68.1 Å²	68.1	29%	0.289	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-19	178.6	0	0	0	0	0	113.7	Q63 T200 H224 S228	Q63-A226 PolarHBondContact NE2-O 2.87Å; Q63-A226 PolarHBondContact OE1-O 3.39Å; T200-A226 WeakPolarHBondContact CG2-O 3.46Å; H224-A226 VanDerWaalsContact ND1-CB 3.34Å; H224-A226 WeakPolarHBondContact ND1-CB 3.14Å; H224-A226 PolarHBondContact ND1-N 2.94Å; H224-A226 PolarHBondContact O-N 2.89Å; H224-A226 VanDerWaalsContact O-N 3.08Å; A226-S228 PolarHBondContact O-N 3.3Å
227	N	91.3	Very high	91.6	Very high	11 Å²	11	65.9 Å²	65.9	6%	0.059	35%	0.352	C	S	.	.			trans	-60.5	130.7	-173.8	-70.6	-20.1	0	0	0	111.5	K62 F199 P222 H224 P225 F229 Y230	K62-N227 WeakPolarHBondContact CE-O 3.37Å; K62-N227 PolarHBondContact NZ-O 2.76Å; F199-N227 WeakPolarHBondContact CB-OD1 3.38Å; F199-N227 VanDerWaalsContact O-CA 3.3Å; F199-N227 WeakPolarHBondContact O-CA 3.41Å; P222-N227 WeakPolarHBondContact CB-ND2 3.19Å; P222-N227 HydrophobicContact CG-CB 4.49Å; P222-N227 VanDerWaalsContact CG-ND2 3.29Å; P222-N227 WeakPolarHBondContact CG-ND2 3.28Å; P222-N227 PolarHBondContact O-ND2 2.92Å; H224-N227 WeakPolarHBondContact CB-ND2 3.46Å; H224-N227 PolarHBondContact N-ND2 3.27Å; H224-N227 VanDerWaalsContact N-ND2 3.17Å; H224-N227 VanDerWaalsContact O-CB 3.32Å; H224-N227 WeakPolarHBondContact O-CB 3.31Å; H224-N227 PolarHBondContact O-N 2.85Å; P225-N227 VanDerWaalsContact C-N 3.32Å; N227-F229 PolarHBondContact O-N 3.01Å; N227-Y230 WeakPolarHBondContact O-CB 3.49Å; N227-Y230 PolarHBondContact O-N 2.99Å
228	S	94.3	Very high	91.6	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-31.6	-173.1	-67.4	0	0	0	0	113.7	Q63 F199 T200 F201 A226	Q63-S228 PolarHBondContact OE1-OG 2.95Å; F199-S228 PolarHBondContact O-N 2.86Å; T200-S228 WeakPolarHBondContact CA-OG 3.29Å; F201-S228 WeakPolarHBondContact CD2-OG 3.29Å; F201-S228 VanDerWaalsContact CE2-CB 3.42Å; F201-S228 PolarHBondContact N-OG 2.82Å; F201-S228 VanDerWaalsContact N-OG 3.16Å; A226-S228 PolarHBondContact O-N 3.3Å
229	F	95.9	Very high	91.6	Very high	5 Å²	5	66.9 Å²	66.9	2%	0.022	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	7.4	177.8	-65.6	-69.3	0	0	0	114.7	F60 I159 W165 P190 F201 I217 S219 N227 Y231 L237 M240	F60-F229 HydrophobicContact CD1-CD1 4.02Å; F60-F229 AromaticContact CD1-CE1 3.86Å; F60-F229 HydrophobicContact CD1-CE1 3.86Å; F60-F229 HydrophobicContact CE1-CD1 4.13Å; F60-F229 AromaticContact CE1-CE1 3.99Å; F60-F229 HydrophobicContact CE1-CE1 3.99Å; I159-F229 HydrophobicContact CD1-CZ 4.42Å; W165-F229 HydrophobicContact CD2-CE2 4.28Å; W165-F229 HydrophobicContact CE3-CD2 4.18Å; W165-F229 AromaticContact CE3-CE2 3.57Å; W165-F229 HydrophobicContact CE3-CE2 3.57Å; W165-F229 HydrophobicContact CZ3-CD2 4.11Å; W165-F229 AromaticContact CZ3-CE2 3.8Å; W165-F229 HydrophobicContact CZ3-CE2 3.8Å; P190-F229 HydrophobicContact CB-CD2 4.49Å; P190-F229 HydrophobicContact CB-CE2 4.04Å; P190-F229 HydrophobicContact CB-CZ 4.14Å; P190-F229 HydrophobicContact CG-CD1 4.3Å; P190-F229 HydrophobicContact CG-CD2 4.37Å; P190-F229 HydrophobicContact CG-CE1 4.21Å; P190-F229 HydrophobicContact CG-CE2 4.24Å; P190-F229 HydrophobicContact CG-CG 4.38Å; P190-F229 HydrophobicContact CG-CZ 4.16Å; F201-F229 HydrophobicContact CE1-CE1 4.37Å; F201-F229 AromaticContact CE1-CE2 3.73Å; F201-F229 HydrophobicContact CE1-CE2 3.73Å; F201-F229 AromaticContact CE1-CZ 3.54Å; F201-F229 HydrophobicContact CE1-CZ 3.54Å; F201-F229 AromaticContact CZ-CE1 3.99Å; F201-F229 HydrophobicContact CZ-CE1 3.99Å; F201-F229 AromaticContact CZ-CE2 4Å; F201-F229 HydrophobicContact CZ-CE2 4Å; F201-F229 AromaticContact CZ-CZ 3.61Å; F201-F229 HydrophobicContact CZ-CZ 3.61Å; I217-F229 HydrophobicContact CD1-CD2 4.29Å; I217-F229 HydrophobicContact CG2-CB 3.45Å; I217-F229 VanDerWaalsContact CG2-CB 3.45Å; I217-F229 HydrophobicContact CG2-CD2 3.71Å; I217-F229 HydrophobicContact CG2-CG 3.82Å; S219-F229 WeakPolarHBondContact CA-O 3.24Å; N227-F229 PolarHBondContact O-N 3.01Å; F229-Y231 VanDerWaalsContact O-CD2 3.27Å; F229-Y231 WeakPolarHBondContact O-CD2 3.41Å; F229-Y231 PolarHBondContact O-N 2.93Å; F229-L237 HydrophobicContact CB-CD1 4.14Å; F229-L237 HydrophobicContact CD1-CD1 4.14Å; F229-L237 HydrophobicContact CG-CD1 4.38Å; F229-M240 HydrophobicContact CE1-CE 4.2Å; F229-M240 HydrophobicContact CE1-SD 3.86Å; F229-M240 HydrophobicContact CZ-CE 3.79Å; F229-M240 HydrophobicContact CZ-SD 3.65Å
230	Y	93.8	Very high	91.8	Very high	57 Å²	57	66.8 Å²	66.8	22%	0.224	36%	0.36	C	S	.	.			trans	-80.8	102.9	176.3	-176.7	-112.3	0	0	0	111.5	K62 N227 P232	K62-Y230 PolarHBondContact NZ-O 2.75Å; N227-Y230 WeakPolarHBondContact O-CB 3.49Å; N227-Y230 PolarHBondContact O-N 2.99Å; Y230-P232 HydrophobicContact CD1-CG 4.44Å; Y230-P232 HydrophobicContact CE1-CB 4.16Å; Y230-P232 HydrophobicContact CE1-CG 3.86Å; Y230-P232 HydrophobicContact CE2-CB 4.34Å
231	Y	91.4	Very high	92.1	Very high	31 Å²	31	63.3 Å²	63.3	12%	0.122	34%	0.335	C	S	.	.			trans	-123.4	79.7	178.5	-66.4	-90	0	0	0	109.6	F60 P61 K62 S219 F229 R233 L234 L237	F60-Y231 WeakPolarHBondContact CA-OH 3.42Å; F60-Y231 HydrophobicContact CD1-CE2 4.38Å; P61-Y231 HydrophobicContact CG-CE1 4.31Å; K62-Y231 HydrophobicContact CB-CE1 3.71Å; K62-Y231 HydrophobicContact CB-CE2 4.42Å; K62-Y231 WeakPolarHBondContact CB-OH 3Å; K62-Y231 PolarHBondContact N-OH 2.76Å; S219-Y231 CarbonylContact O-C 3.51Å; S219-Y231 PolarHBondContact O-N 3.12Å; F229-Y231 VanDerWaalsContact O-CD2 3.27Å; F229-Y231 WeakPolarHBondContact O-CD2 3.41Å; F229-Y231 PolarHBondContact O-N 2.93Å; Y231-R233 PolarHBondContact O-N 2.84Å; Y231-L234 HydrophobicContact CD1-CD1 4.28Å; Y231-L234 HydrophobicContact CG-CD1 3.99Å; Y231-L234 PolarHBondContact O-N 2.88Å; Y231-L237 HydrophobicContact CD2-CD2 3.68Å; Y231-L237 HydrophobicContact CE2-CD2 4.21Å
232	P	87	Confident	92.3	Very high	89 Å²	89	63.6 Å²	63.6	58%	0.578	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-15.4	-170.5	24.5	-35.1	0	0	0	114.6	Y230	Y230-P232 HydrophobicContact CD1-CG 4.44Å; Y230-P232 HydrophobicContact CE1-CB 4.16Å; Y230-P232 HydrophobicContact CE1-CG 3.86Å; Y230-P232 HydrophobicContact CE2-CB 4.34Å
233	R	89.9	Confident	92.6	Very high	245 Å²	245	60.8 Å²	60.8	93%	0.925	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-13.3	176.1	-61.8	-177.4	-176.8	170.5	0.9	113.2	Y231	Y231-R233 PolarHBondContact O-N 2.84Å
234	L	89.4	Confident	93.2	Very high	77 Å²	77	58.3 Å²	58.3	40%	0.403	29%	0.291	S	S	.	.			trans	-96.2	132.1	178.1	-64.6	-177.4	0	0	0	110	S219 Y231	S219-L234 WeakPolarHBondContact CB-O 3.44Å; S219-L234 PolarHBondContact OG-O 3.26Å; Y231-L234 HydrophobicContact CD1-CD1 4.28Å; Y231-L234 HydrophobicContact CG-CD1 3.99Å; Y231-L234 PolarHBondContact O-N 2.88Å
235	K	91.8	Very high	93.7	Very high	188 Å²	188	54 Å²	54	82%	0.817	27%	0.271	S	S	*	.	S	Bend	trans	-64.1	-44.4	173.9	-173.7	179.2	179.7	-177.2	0	111.4	S219	S219-K235 PolarHBondContact OG-O 3.17Å
236	N	93.4	Very high	94.5	Very high	117 Å²	117	52.4 Å²	52.4	63%	0.626	26%	0.26	S	S	*	.	S	Bend	trans	-139.7	155.7	176.9	-61.7	-47.7	0	0	0	108.9
237	L	95.9	Very high	94.9	Very high	11 Å²	11	53.4 Å²	53.4	6%	0.058	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-66.1	146.3	168.3	-64.7	174.2	0	0	0	109.8	F60 Y189 P190 F229 Y231	F60-L237 HydrophobicContact CE1-CB 4.44Å; F60-L237 HydrophobicContact CE1-CD2 4.32Å; Y189-L237 WeakPolarHBondContact CE1-O 3.41Å; P190-L237 HydrophobicContact CG-CD1 3.91Å; F229-L237 HydrophobicContact CB-CD1 4.14Å; F229-L237 HydrophobicContact CD1-CD1 4.14Å; F229-L237 HydrophobicContact CG-CD1 4.38Å; Y231-L237 HydrophobicContact CD2-CD2 3.68Å; Y231-L237 HydrophobicContact CE2-CD2 4.21Å
238	P	97.4	Very high	95	Very high	44 Å²	44	55.2 Å²	55.2	29%	0.286	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-63.5	158.7	162.3	29.2	-32	0	0	0	109.8	F60 M240	F60-P238 HydrophobicContact CE1-CG 4.07Å; F60-P238 HydrophobicContact CE2-CG 4.08Å; F60-P238 HydrophobicContact CZ-CG 3.72Å; F60-P238 WeakPolarHBondContact CZ-O 3.36Å; P238-M240 PolarHBondContact O-N 3.34Å
239	P	98.2	Very high	94.6	Very high	27 Å²	27	63.3 Å²	63.3	18%	0.175	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-56.5	133.5	171.3	-24.3	34.7	0	0	0	111	E187 Y189	E187-P239 HydrophobicContact CB-CB 4.07Å; E187-P239 HydrophobicContact CB-CG 4.01Å; E187-P239 VanDerWaalsContact CD-CG 3.45Å; E187-P239 HydrophobicContact CG-CB 4.32Å; E187-P239 HydrophobicContact CG-CG 3.98Å; E187-P239 WeakPolarHBondContact OE2-CG 3.43Å; Y189-P239 HydrophobicContact CE1-CG 4.36Å
240	M	98.2	Very high	92.9	Very high	0 Å²	0	69.2 Å²	69.2	0%	0	34%	0.336	C	S	.	.	S	Bend	trans	-93	-20.5	178.5	-161.4	-175.6	174.3	0	0	111.9	M54 W55 F60 W73 I159 L167 L188 P190 F229 P238	M54-M240 CarbonylContact C-O 3.56Å; M54-M240 VanDerWaalsContact C-O 3.32Å; M54-M240 WeakPolarHBondContact CA-O 3.3Å; M54-M240 WeakPolarHBondContact CB-O 3.49Å; M54-M240 PolarHBondContact N-O 2.73Å; W55-M240 HydrophobicContact CB-CE 3.77Å; W55-M240 HydrophobicContact CB-CG 3.99Å; W55-M240 HydrophobicContact CD2-CE 3.26Å; W55-M240 HydrophobicContact CE3-CE 3.68Å; W55-M240 HydrophobicContact CG-CE 3.31Å; W55-M240 HydrophobicContact CG-CG 4.35Å; W55-M240 HydrophobicContact CZ2-CE 4.3Å; W55-M240 HydrophobicContact CZ3-CE 4.34Å; W55-M240 PolarHBondContact N-O 2.79Å; F60-M240 HydrophobicContact CD2-CG 4.48Å; F60-M240 HydrophobicContact CE2-CB 4.02Å; F60-M240 HydrophobicContact CE2-CG 3.83Å; F60-M240 HydrophobicContact CZ-CB 3.76Å; F60-M240 HydrophobicContact CZ-CG 3.87Å; W73-M240 HydrophobicContact CH2-CE 3.8Å; W73-M240 HydrophobicContact CH2-CG 3.86Å; W73-M240 HydrophobicContact CH2-SD 4Å; W73-M240 HydrophobicContact CZ2-CE 4.38Å; W73-M240 HydrophobicContact CZ2-CG 4.37Å; I159-M240 HydrophobicContact CD1-CE 3.96Å; I159-M240 HydrophobicContact CD1-SD 3.74Å; I159-M240 HydrophobicContact CG1-CE 4.05Å; I159-M240 HydrophobicContact CG1-SD 4.29Å; I159-M240 HydrophobicContact CG2-CE 3.87Å; L167-M240 HydrophobicContact CD1-CB 4.36Å; L167-M240 HydrophobicContact CD2-CB 4.34Å; L167-M240 HydrophobicContact CD2-SD 4.48Å; L188-M240 PolarHBondContact O-N 2.73Å; P190-M240 HydrophobicContact CB-SD 4.36Å; P190-M240 HydrophobicContact CG-SD 4.49Å; F229-M240 HydrophobicContact CE1-CE 4.2Å; F229-M240 HydrophobicContact CE1-SD 3.86Å; F229-M240 HydrophobicContact CZ-CE 3.79Å; F229-M240 HydrophobicContact CZ-SD 3.65Å; P238-M240 PolarHBondContact O-N 3.34Å
241	G	98.3	Very high	90.8	Very high	0 Å²	0	72.7 Å²	72.7	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	175.1	169.4	0	0	0	0	0	110.7	T52 L188	T52-G241 CarbonylContact O-C 3.37Å; T52-G241 WeakPolarHBondContact O-CA 3.46Å; L188-G241 WeakPolarHBondContact CB-O 3.34Å; L188-G241 PolarHBondContact N-O 2.65Å; L188-G241 PolarHBondContact O-N 2.89Å
242	K	98.4	Very high	88.4	Confident	73 Å²	73	80 Å²	80	32%	0.317	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	140	175.6	-174.1	-177.5	75.8	177.7	0	108.6	F51 T52 M54 T185 L186	F51-K242 CarbonylContact C-O 3.55Å; T52-K242 PolarHBondContact N-O 3.16Å; T52-K242 PolarHBondContact O-N 3.03Å; M54-K242 HydrophobicContact SD-CB 3.92Å; T185-K242 HydrophobicContact CG2-CD 3.51Å; T185-K242 HydrophobicContact CG2-CG 3.6Å; L186-K242 CarbonylContact O-C 3.54Å; L186-K242 WeakPolarHBondContact O-CA 3.47Å; L186-K242 WeakPolarHBondContact O-CG 3.32Å
243	V	98.6	Very high	86.1	Confident	0 Å²	0	81.8 Å²	81.8	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	132.7	170.5	63.2	0	0	0	0	109.5	L49 T50 F155 V169 T185 L186 L188 L245	L49-V243 HydrophobicContact CD1-CG2 3.98Å; L49-V243 HydrophobicContact CD2-CG2 3.92Å; L49-V243 HydrophobicContact CG-CG2 3.65Å; T50-V243 WeakPolarHBondContact O-CA 3.44Å; F155-V243 HydrophobicContact CE1-CB 4.26Å; F155-V243 HydrophobicContact CE1-CG1 3.96Å; F155-V243 HydrophobicContact CE1-CG2 4.09Å; F155-V243 HydrophobicContact CZ-CB 3.98Å; F155-V243 HydrophobicContact CZ-CG1 3.86Å; F155-V243 HydrophobicContact CZ-CG2 4.18Å; V169-V243 HydrophobicContact CG2-CG1 4.32Å; T185-V243 CarbonylContact C-O 3.56Å; T185-V243 WeakPolarHBondContact CA-O 3.37Å; L186-V243 HydrophobicContact CB-CG1 3.74Å; L186-V243 HydrophobicContact CD1-CG1 4.21Å; L186-V243 HydrophobicContact CG-CG1 4.3Å; L186-V243 PolarHBondContact N-O 2.82Å; L186-V243 PolarHBondContact O-N 2.88Å; L188-V243 HydrophobicContact CD1-CB 4.27Å; L188-V243 HydrophobicContact CD1-CG1 4.39Å; L188-V243 HydrophobicContact CD2-CG1 4.12Å; L188-V243 HydrophobicContact CG-CG1 4.45Å; V243-L245 HydrophobicContact CG2-CD2 3.9Å; V243-L245 HydrophobicContact CG2-CG 4.4Å
244	T	98.6	Very high	83.6	Confident	29 Å²	29	79.2 Å²	79.2	18%	0.178	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	124.5	170.8	-61.5	0	0	0	0	108.3	T50 V184 T185	T50-T244 PolarHBondContact N-O 2.93Å; T50-T244 PolarHBondContact O-N 2.88Å; V184-T244 CarbonylContact O-C 3.51Å; V184-T244 WeakPolarHBondContact O-CA 3.35Å; T185-T244 PolarHBondContact OG1-OG1 2.83Å
245	L	98.3	Very high	80.9	Confident	1 Å²	1	81.1 Å²	81.1	1%	0.005	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	121.9	175.6	-53.1	172.5	0	0	0	106.8	Y47 S48 L49 F144 L153 F172 L174 S183 V184 V243	Y47-L245 HydrophobicContact CD1-CB 4.36Å; S48-L245 WeakPolarHBondContact O-CA 3.47Å; L49-L245 HydrophobicContact CB-CD2 4.01Å; L49-L245 HydrophobicContact CD1-CD2 3.66Å; L49-L245 HydrophobicContact CG-CD2 3.7Å; F144-L245 HydrophobicContact CE1-CD2 4.13Å; F144-L245 HydrophobicContact CZ-CD2 4.24Å; L153-L245 HydrophobicContact CD2-CD1 3.57Å; L153-L245 HydrophobicContact CD2-CD2 3.64Å; L153-L245 HydrophobicContact CD2-CG 4.28Å; F172-L245 HydrophobicContact CD1-CD1 4.17Å; F172-L245 HydrophobicContact CE1-CD1 4.37Å; L174-L245 HydrophobicContact CD2-CB 4.42Å; L174-L245 HydrophobicContact CD2-CD1 3.83Å; S183-L245 CarbonylContact C-O 3.59Å; S183-L245 VanDerWaalsContact CA-O 3.24Å; S183-L245 WeakPolarHBondContact CA-O 3.17Å; S183-L245 PolarHBondContact OG-O 2.98Å; V184-L245 HydrophobicContact CB-CB 4.38Å; V184-L245 PolarHBondContact N-O 2.88Å; V184-L245 PolarHBondContact O-N 2.83Å; V243-L245 HydrophobicContact CG2-CD2 3.9Å; V243-L245 HydrophobicContact CG2-CG 4.4Å
246	T	97.8	Very high	78	Confident	60 Å²	60	79.3 Å²	79.3	37%	0.368	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	125.3	-179.7	-53.4	0	0	0	0	109.4	Y47 S48 T248	Y47-T246 CarbonylContact C-O 3.43Å; Y47-T246 WeakPolarHBondContact CA-O 2.87Å; S48-T246 PolarHBondContact N-O 3.02Å; S48-T246 PolarHBondContact O-N 3.34Å; T246-T248 PolarHBondContact O-N 3.13Å
247	K	95.9	Very high	75.3	Confident	56 Å²	56	79.6 Å²	79.6	24%	0.243	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	124.2	175.9	-173.2	178.9	170.1	-167	0	109.5	A45 K46 Y47 W180 E182	A45-K247 HydrophobicContact CB-CG 4.49Å; K46-K247 CarbonylContact O-C 3.38Å; K46-K247 WeakPolarHBondContact O-CA 3.43Å; Y47-K247 HydrophobicContact CD1-CB 4.16Å; Y47-K247 HydrophobicContact CE1-CB 3.71Å; Y47-K247 HydrophobicContact CE1-CG 4.45Å; Y47-K247 HydrophobicContact CE2-CG 4.46Å; W180-K247 HydrophobicContact CB-CD 4Å; E182-K247 WeakPolarHBondContact O-CB 3.5Å; E182-K247 PolarHBondContact O-N 3.33Å; E182-K247 WeakPolarHBondContact OE1-CD 3.31Å; E182-K247 IonicContact OE1-NZ 3.29Å; E182-K247 PolarHBondContact OE1-NZ 3.35Å
248	T	92.8	Very high	72.3	Confident	49 Å²	49	88 Å²	88	30%	0.301	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-75.3	128.8	-179.9	-53.4	0	0	0	0	109.2	K46 T246 N250	K46-T248 PolarHBondContact O-N 3.28Å; T246-T248 PolarHBondContact O-N 3.13Å; T248-N250 PolarHBondContact O-N 2.02Å
249	K	84.8	Confident	69.1	Low	170 Å²	170	94.3 Å²	94.3	74%	0.739	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-76.7	122.3	171.6	-65.6	-177.8	-179.7	179.4	0	108.4	N251	K249-N251 VanDerWaalsContact C-N 3.28Å; K249-N251 PolarHBondContact O-N 3.37Å
250	N	61.9	Low	66.1	Low	130 Å²	130	98.9 Å²	98.9	70%	0.695	52%	0.515	S	S	*	.			trans	-66.6	87	173.3	-82.8	-5.7	0	0	0	110	T248 Q252	T248-N250 PolarHBondContact O-N 2.02Å; N250-Q252 PolarHBondContact O-N 2.93Å
251	N	48.2	Very low	62.8	Low	130 Å²	130	105.2 Å²	105.2	70%	0.695	55%	0.554	S	S	*	*			trans	-81.7	103.4	160.5	-92.9	6.3	0	0	0	107.3	K249 I253	K249-N251 VanDerWaalsContact C-N 3.28Å; K249-N251 PolarHBondContact O-N 3.37Å; N251-I253 VanDerWaalsContact C-N 3.26Å; N251-I253 HydrophobicContact CB-CD1 4.11Å; N251-I253 HydrophobicContact CB-CG1 4.16Å; N251-I253 PolarHBondContact O-N 2.8Å
252	Q	41.4	Very low	59.8	Low	183 Å²	183	113.6 Å²	113.6	86%	0.855	59%	0.593	S	S	*	*			trans	-64.9	93	161.2	-72.2	-160.6	-19.1	0	0	108.2	N250	N250-Q252 PolarHBondContact O-N 2.93Å
253	I	37.8	Very low	56.5	Low	128 Å²	128	119.3 Å²	119.3	66%	0.656	62%	0.619	S	S	*	*			trans	-118.2	108.4	167.5	-63.1	173.2	0	0	0	106.4	N251 S255	N251-I253 VanDerWaalsContact C-N 3.26Å; N251-I253 HydrophobicContact CB-CD1 4.11Å; N251-I253 HydrophobicContact CB-CG1 4.16Å; N251-I253 PolarHBondContact O-N 2.8Å; I253-S255 PolarHBondContact O-N 2.87Å; I253-S255 VanDerWaalsContact O-N 3.08Å
254	F	39.3	Very low	53.5	Low	190 Å²	190	125.7 Å²	125.7	83%	0.833	65%	0.653	S	S	*	*			trans	-58.5	106	168	-78	-96	0	0	0	109	I256	F254-I256 PolarHBondContact O-N 3.39Å
255	S	32.3	Very low	50.8	Low	117 Å²	117	133.3 Å²	133.3	82%	0.818	69%	0.686	S	S	*	*			trans	-82.4	109.6	170.1	43.7	0	0	0	0	109.8	I253	I253-S255 PolarHBondContact O-N 2.87Å; I253-S255 VanDerWaalsContact O-N 3.08Å
256	I	31.2	Very low	48	Very low	151 Å²	151	140.1 Å²	140.1	77%	0.774	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-72.6	141.2	165.9	-59.4	170.8	0	0	0	108	F254 M258	F254-I256 PolarHBondContact O-N 3.39Å; I256-M258 PolarHBondContact O-N 2.82Å
257	P	36.1	Very low	45	Very low	122 Å²	122	141.2 Å²	141.2	79%	0.792	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-69.8	122.8	176.4	-10.9	26.1	0	0	0	110.8
258	M	32.2	Very low	42.3	Very low	187 Å²	187	146 Å²	146	92%	0.921	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-89.9	125.4	163.9	-93.5	-177.6	68.1	0	0	109.6	I256	I256-M258 PolarHBondContact O-N 2.82Å
259	E	30.6	Very low	40.1	Very low	177 Å²	177	152.3 Å²	152.3	83%	0.827	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-73	148.5	175.4	-160.4	175	-158.8	0	0	111
260	P	34.5	Very low	38.4	Very low	123 Å²	123	152.1 Å²	152.1	80%	0.799	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-82.4	124.9	-177.6	1.6	16.3	0	0	0	111.4
261	T	29.8	Very low	37.4	Very low	134 Å²	134	149.4 Å²	149.4	82%	0.822	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-75.6	128.9	168	29	0	0	0	0	111.3
262	Q	35.4	Very low	37.4	Very low	175 Å²	175	150.6 Å²	150.6	82%	0.818	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-63.4	135.2	170.5	-71.9	173.5	-15.6	0	0	111.4
263	F	29.5	Very low	37.7	Very low	194 Å²	194	150.9 Å²	150.9	85%	0.851	82%	0.821	S	S	*	*			trans	-123.6	107.5	159.9	-113.2	-90.7	0	0	0	109.1
264	N	35.5	Very low	38.4	Very low	134 Å²	134	152.7 Å²	152.7	72%	0.717	83%	0.831	S	S	*	*			trans	-83.4	137.6	160.3	-72.5	-28.2	0	0	0	107.9
265	Q	41.7	Very low	39	Very low	189 Å²	189	149.8 Å²	149.8	88%	0.883	82%	0.82	S	S	*	*			trans	-169.1	138.7	131.9	-103.4	158.5	45.9	0	0	113.4
266	T	39.4	Very low	39.8	Very low	144 Å²	144	150.6 Å²	150.6	88%	0.883	82%	0.815	S	S	*	*			trans	-72.6	151.7	-177.5	41.3	0	0	0	0	114.5
267	G	35.4	Very low	40.8	Very low	83 Å²	83	146.7 Å²	146.7	86%	0.856	80%	0.801	S	S	*	*			trans	-165.1	119.7	159.9	0	0	0	0	0	110.7
268	N	38.5	Very low	41.6	Very low	155 Å²	155	146 Å²	146	83%	0.829	79%	0.79	S	S	*	*			trans	-113	131.5	-179.7	-165	23.1	0	0	0	107.1
269	E	46.4	Very low	42.5	Very low	183 Å²	183	143.1 Å²	143.1	86%	0.855	78%	0.777	S	S	*	*			trans	167.9	101.7	141.8	-92.2	177.3	-162.3	0	0	113.6
270	I	49.5	Very low	43.6	Very low	165 Å²	165	140.2 Å²	140.2	85%	0.846	77%	0.767	S	S	*	*			trans	23.9	121.7	138	-45.9	175.7	0	0	0	120.9
271	G	41.5	Very low	44.8	Very low	73 Å²	73	137.9 Å²	137.9	75%	0.753	75%	0.754	S	S	*	*			trans	173.6	91.4	155.3	0	0	0	0	0	111.8
272	N	46.9	Very low	46.8	Very low	156 Å²	156	135.8 Å²	135.8	83%	0.834	74%	0.741	S	S	*	*			trans	-73.1	132.7	-176.1	-66.5	-28.3	0	0	0	112.4
273	E	47.5	Very low	48.9	Very low	188 Å²	188	131.3 Å²	131.3	88%	0.879	73%	0.727	S	S	*	*			trans	-164.2	116.9	132.4	-108.1	168	-155.8	0	0	112
274	I	53.5	Low	51.4	Low	167 Å²	167	125.5 Å²	125.5	86%	0.856	70%	0.704	S	S	*	*	S	Bend	trans	77	112.2	172.4	-41.4	-178.5	0	0	0	116	D276	I274-D276 PolarHBondContact O-N 2.96Å
275	E	51	Low	53.8	Low	129 Å²	129	123.2 Å²	123.2	60%	0.603	69%	0.692	S	S	*	*			trans	-74.7	85.9	-162.2	-158.7	171.6	-173.9	0	0	113.5	S277 L278	E275-S277 WeakPolarHBondContact CG-OG 3.39Å; E275-S277 PolarHBondContact O-N 2.9Å; E275-L278 HydrophobicContact CG-CD1 4.35Å; E275-L278 HydrophobicContact CG-CG 4.03Å
276	D	48.9	Very low	56	Low	133 Å²	133	115.2 Å²	115.2	71%	0.711	66%	0.657	S	S	*	*	G	3₁₀ helix	trans	-66.4	-8.8	165.7	-160.1	29	0	0	0	112.4	I274 L278	I274-D276 PolarHBondContact O-N 2.96Å; D276-L278 PolarHBondContact O-N 3.3Å
277	S	53.2	Low	58.1	Low	70 Å²	70	114 Å²	114	49%	0.49	64%	0.641	S	S	.	*	G	3₁₀ helix	trans	-80.2	-7.6	-178.7	51.2	0	0	0	0	115.3	E275 S281	E275-S277 WeakPolarHBondContact CG-OG 3.39Å; E275-S277 PolarHBondContact O-N 2.9Å; S277-S281 WeakPolarHBondContact O-CB 3.29Å; S277-S281 PolarHBondContact O-OG 3.08Å
278	L	51.9	Low	60.4	Low	107 Å²	107	111.5 Å²	111.5	56%	0.56	61%	0.61	S	S	*	*	G	3₁₀ helix	trans	-87.3	-15.8	175	-67.1	175.7	0	0	0	113.4	E275 D276 S281	E275-L278 HydrophobicContact CG-CD1 4.35Å; E275-L278 HydrophobicContact CG-CG 4.03Å; D276-L278 PolarHBondContact O-N 3.3Å; L278-S281 PolarHBondContact O-OG 3.21Å
279	I	52.3	Low	62	Low	127 Å²	127	104.6 Å²	104.6	65%	0.651	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-26.9	176.7	-55.9	178.9	0	0	0	110.8	N319	I279-N319 PolarHBondContact O-ND2 3.43Å
280	N	53.6	Low	63.5	Low	116 Å²	116	98.7 Å²	98.7	62%	0.62	56%	0.556	S	S	*	*	S	Bend	trans	-93	1.3	-177.9	-137.4	13	0	0	0	114	N319	N280-N319 PolarHBondContact OD1-OD1 2.78Å
281	S	59.7	Low	64.9	Low	73 Å²	73	93.8 Å²	93.8	51%	0.51	53%	0.526	S	S	.	.	S	Bend	trans	-102.1	-1	-173.8	65.1	0	0	0	0	114.6	S277 L278 P283	S277-S281 WeakPolarHBondContact O-CB 3.29Å; S277-S281 PolarHBondContact O-OG 3.08Å; L278-S281 PolarHBondContact O-OG 3.21Å; S281-P283 WeakPolarHBondContact O-CD 3.42Å
282	T	71.8	Confident	65.9	Low	90 Å²	90	90.8 Å²	90.8	55%	0.552	49%	0.494	S	S	*	.	S	Bend	trans	-105.4	102.6	173.9	51.8	0	0	0	0	108.9	L284 N319	T282-L284 PolarHBondContact O-N 2.79Å; T282-N319 VanDerWaalsContact O-CB 3.25Å; T282-N319 WeakPolarHBondContact O-CB 3.32Å; T282-N319 PolarHBondContact O-ND2 2.86Å
283	P	79.7	Confident	66.9	Low	82 Å²	82	85.3 Å²	85.3	53%	0.532	47%	0.467	S	S	.	.			trans	-56	127.3	171.6	-22.4	33	0	0	0	109.3	S281 N319	S281-P283 WeakPolarHBondContact O-CD 3.42Å; P283-N319 WeakPolarHBondContact CA-O 3.21Å
284	L	82.1	Confident	68.5	Low	71 Å²	71	79.1 Å²	79.1	37%	0.372	44%	0.436	S	S	.	.	B	Isolated β-bridge	trans	-106.2	105.4	175.5	-167.6	64.2	0	0	0	107.9	T282 L315 P317 A318 G321	T282-L284 PolarHBondContact O-N 2.79Å; L284-L315 HydrophobicContact CD1-CD2 3.62Å; L284-L315 HydrophobicContact CD2-CD1 4.04Å; L284-L315 HydrophobicContact CD2-CD2 3.85Å; L284-L315 HydrophobicContact CD2-CG 3.99Å; L284-L315 HydrophobicContact CG-CD2 3.67Å; L284-L315 HydrophobicContact CG-CG 4.18Å; L284-P317 CarbonylContact O-C 3.07Å; L284-P317 WeakPolarHBondContact O-CA 3.18Å; L284-A318 HydrophobicContact CB-CB 4.04Å; L284-A318 HydrophobicContact CD2-CB 4.29Å; L284-A318 PolarHBondContact N-O 3.11Å; L284-A318 PolarHBondContact O-N 2.76Å; L284-G321 WeakPolarHBondContact O-CA 3.49Å
285	D	84.6	Confident	69.4	Low	87 Å²	87	72.6 Å²	72.6	47%	0.465	41%	0.41	S	S	.	.			trans	-71.8	149.2	179.7	-65.9	-18.7	0	0	0	110.7	E287 G321 V322	D285-E287 PolarHBondContact O-N 2.88Å; D285-G321 WeakPolarHBondContact OD1-CA 3.19Å; D285-V322 HydrophobicContact CB-CB 4.23Å; D285-V322 WeakPolarHBondContact OD1-CG2 3.44Å; D285-V322 PolarHBondContact OD1-N 3.1Å
286	C	87.5	Confident	70.7	Confident	21 Å²	21	70 Å²	70	14%	0.142	40%	0.399	C	S	.	.			trans	-66.5	127.2	172.3	-178.1	0	0	0	0	111	L315 P317 V322 C324	C286-L315 VanDerWaalsContact CA-O 3.29Å; C286-L315 WeakPolarHBondContact CA-O 3.21Å; C286-L315 PolarHBondContact SG-O 3.23Å; C286-L315 VanDerWaalsContact SG-O 3.33Å; C286-P317 HydrophobicContact CB-CB 4.1Å; C286-P317 HydrophobicContact CB-CG 4.2Å; C286-V322 WeakPolarHBondContact CB-O 3.34Å; C286-V322 PolarHBondContact N-O 2.94Å; C286-C324 VanDerWaalsContact CB-CA 3.5Å; C286-C324 HydrophobicContact CB-CB 3.82Å; C286-C324 WeakPolarHBondContact CB-SG 3.11Å; C286-C324 WeakPolarHBondContact SG-CA 3.32Å; C286-C324 WeakPolarHBondContact SG-CB 3.29Å; C286-C324 CovalentContact SG-SG 2.02Å; C286-C324 PolarHBondContact SG-SG 3.19Å
287	E	84.4	Confident	72.4	Confident	117 Å²	117	65.3 Å²	65.3	55%	0.547	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	129.9	170.4	-167.8	174.3	-178.7	0	0	108.6	D285 I313 H314 L315	D285-E287 PolarHBondContact O-N 2.88Å; E287-I313 CarbonylContact O-C 3.56Å; E287-H314 HydrophobicContact CB-CB 4.23Å; E287-H314 HydrophobicContact CG-CB 4.23Å; E287-H314 WeakPolarHBondContact O-CA 3.42Å; E287-H314 PolarHBondContact O-N 3.32Å; E287-L315 HydrophobicContact CB-CB 3.82Å; E287-L315 PolarHBondContact N-O 3.28Å; E287-L315 VanDerWaalsContact N-O 3.13Å; E287-L315 PolarHBondContact O-N 2.97Å
288	V	84.3	Confident	73.6	Confident	32 Å²	32	65.4 Å²	65.4	19%	0.194	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	153.8	179.3	-64.1	0	0	0	0	110.5	Y312 I313 H314 C324 P325 L327	V288-Y312 CarbonylContact C-O 3.55Å; V288-Y312 WeakPolarHBondContact CA-O 3.47Å; V288-Y312 WeakPolarHBondContact CB-O 3.33Å; V288-I313 HydrophobicContact CG1-CG1 4.18Å; V288-H314 VanDerWaalsContact C-CD2 3.42Å; V288-C324 HydrophobicContact CG1-CB 4.45Å; V288-P325 HydrophobicContact CG1-CG 4.14Å; V288-P325 HydrophobicContact CG2-CG 3.91Å; V288-L327 HydrophobicContact CG1-CD2 3.91Å
289	S	72.1	Confident	75	Confident	10 Å²	10	62.6 Å²	62.6	7%	0.07	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-65.1	167.2	175.2	76.4	0	0	0	0	111.9	R311 Y312 H314	S289-R311 WeakPolarHBondContact OG-CB 3.34Å; S289-Y312 PolarHBondContact N-O 3.02Å; S289-Y312 WeakPolarHBondContact OG-CD1 3.42Å; S289-Y312 WeakPolarHBondContact OG-CE1 3.22Å; S289-Y312 PolarHBondContact OG-N 2.97Å; S289-H314 VanDerWaalsContact CA-CD2 3.41Å; S289-H314 WeakPolarHBondContact CA-CD2 2.98Å; S289-H314 WeakPolarHBondContact CA-NE2 3.14Å; S289-H314 VanDerWaalsContact CB-NE2 3.35Å; S289-H314 WeakPolarHBondContact CB-NE2 3.39Å; S289-H314 PolarHBondContact N-CD2 3.39Å; S289-H314 VanDerWaalsContact N-CD2 3.27Å
290	A	78.2	Confident	76.3	Confident	58 Å²	58	64.2 Å²	64.2	48%	0.479	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-57.3	153.8	159.5	0	0	0	0	0	110.1	W108	W108-A290 HydrophobicContact CH2-CB 4.43Å; W108-A290 HydrophobicContact CZ3-CB 4.05Å
291	W	78.9	Confident	77.5	Confident	62 Å²	62	62.4 Å²	62.4	24%	0.235	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-60.9	138.8	170.1	-70.5	109.5	0	0	0	110.8	R309 R311 S326 L327 E329	W291-R309 HydrophobicContact CD2-CG 4.35Å; W291-R309 HydrophobicContact CE3-CG 3.84Å; W291-R309 HydrophobicContact CZ3-CG 4.39Å; W291-R311 HydrophobicContact CD2-CB 4.18Å; W291-R311 HydrophobicContact CD2-CG 4.07Å; W291-R311 HydrophobicContact CE3-CB 3.79Å; W291-R311 HydrophobicContact CE3-CG 3.71Å; W291-R311 HydrophobicContact CH2-CG 3.95Å; W291-R311 HydrophobicContact CZ2-CG 4.3Å; W291-R311 HydrophobicContact CZ3-CB 4.18Å; W291-R311 HydrophobicContact CZ3-CG 3.65Å; W291-S326 VanDerWaalsContact CH2-O 3.23Å; W291-S326 WeakPolarHBondContact CH2-O 3.11Å; W291-L327 WeakPolarHBondContact CZ3-O 3.35Å; W291-E329 HydrophobicContact CE3-CB 4.35Å; W291-E329 HydrophobicContact CH2-CB 3.67Å; W291-E329 HydrophobicContact CZ2-CB 4.11Å; W291-E329 HydrophobicContact CZ3-CB 3.79Å
292	S	61.4	Low	78.3	Confident	11 Å²	11	62 Å²	62	8%	0.077	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-60.6	160	158.4	56.5	0	0	0	0	110.1	R309 T310	S292-R309 WeakPolarHBondContact O-CB 3.36Å; S292-R309 WeakPolarHBondContact O-CD 3.31Å; S292-T310 VanDerWaalsContact CB-O 3.3Å; S292-T310 WeakPolarHBondContact CB-O 3.01Å; S292-T310 PolarHBondContact N-O 3.35Å; S292-T310 PolarHBondContact OG-N 3.37Å; S292-T310 PolarHBondContact OG-O 3.36Å; S292-T310 PolarHBondContact OG-OG1 3.41Å
293	P	68.1	Low	78.9	Confident	40 Å²	40	62.2 Å²	62.2	26%	0.26	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-57.9	164.5	165.7	-26.7	36.9	0	0	0	111.5	E115 G295 R309	E115-P293 HydrophobicContact CB-CG 4Å; E115-P293 VanDerWaalsContact CG-CD 3.41Å; E115-P293 HydrophobicContact CG-CG 3.45Å; E115-P293 VanDerWaalsContact CG-CG 3.45Å; E115-P293 WeakPolarHBondContact OE1-CD 3.34Å; E115-P293 WeakPolarHBondContact OE2-CG 3.47Å; P293-G295 PolarHBondContact O-N 3.18Å; P293-R309 WeakPolarHBondContact O-CB 3.48Å
294	W	81.3	Confident	79.2	Confident	59 Å²	59	62.9 Å²	62.9	22%	0.223	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-67.2	128.3	171.9	-67.7	103.5	0	0	0	110.6	R307 R309 E329 N331	W294-R307 HydrophobicContact CB-CB 4.42Å; W294-R307 HydrophobicContact CB-CG 4.19Å; W294-R307 VanDerWaalsContact CD1-CZ 3.48Å; W294-R307 HydrophobicContact CD2-CG 3.94Å; W294-R307 HydrophobicContact CE3-CB 4.14Å; W294-R307 HydrophobicContact CE3-CG 3.59Å; W294-R307 HydrophobicContact CG-CG 4.22Å; W294-R307 HydrophobicContact CZ3-CG 4.28Å; W294-R307 VanDerWaalsContact CZ3-O 3.23Å; W294-R307 WeakPolarHBondContact CZ3-O 3.47Å; W294-R309 HydrophobicContact CD2-CB 4.28Å; W294-R309 HydrophobicContact CD2-CG 4.19Å; W294-R309 HydrophobicContact CE3-CB 3.92Å; W294-R309 HydrophobicContact CE3-CG 3.86Å; W294-R309 HydrophobicContact CH2-CG 3.83Å; W294-R309 HydrophobicContact CZ2-CG 4.17Å; W294-R309 HydrophobicContact CZ3-CB 4.19Å; W294-R309 HydrophobicContact CZ3-CG 3.7Å; W294-E329 HydrophobicContact CH2-CB 4.19Å; W294-E329 HydrophobicContact CH2-CG 3.85Å; W294-E329 WeakPolarHBondContact CZ3-O 3.32Å; W294-N331 HydrophobicContact CD2-CB 4.48Å; W294-N331 HydrophobicContact CE3-CB 4.21Å; W294-N331 HydrophobicContact CH2-CB 3.21Å; W294-N331 HydrophobicContact CZ2-CB 3.51Å; W294-N331 HydrophobicContact CZ3-CB 3.58Å
295	G	71.6	Confident	79.5	Confident	30 Å²	30	59.7 Å²	59.7	31%	0.309	36%	0.359	S	S	.	.			trans	-63	174.7	165.8	0	0	0	0	0	112.1	P293 R307 H308	P293-G295 PolarHBondContact O-N 3.18Å; G295-R307 WeakPolarHBondContact O-CB 3.49Å; G295-H308 PolarHBondContact N-O 2.93Å
296	L	80	Confident	79.6	Confident	74 Å²	74	57.3 Å²	57.3	39%	0.387	35%	0.347	S	S	.	.			trans	-58.4	147	-179.4	-63.7	177.9	0	0	0	111.8	Y125 K298	Y125-L296 HydrophobicContact CD2-CD1 4.37Å; L296-K298 PolarHBondContact O-N 3.28Å
297	C	83.3	Confident	79.3	Confident	34 Å²	34	60.1 Å²	60.1	23%	0.23	36%	0.355	C	S	.	.			trans	-71	111.9	177.3	-168.2	0	0	0	0	110.9	C333 I334 P335	C297-C333 WeakPolarHBondContact CA-SG 3.27Å; C297-C333 HydrophobicContact CB-CB 3.81Å; C297-C333 WeakPolarHBondContact CB-SG 3.47Å; C297-C333 WeakPolarHBondContact SG-CB 3.34Å; C297-C333 CovalentContact SG-SG 2.01Å; C297-C333 PolarHBondContact SG-SG 2.73Å; C297-I334 VanDerWaalsContact SG-C 3.55Å; C297-P335 HydrophobicContact CB-CB 4.46Å; C297-P335 HydrophobicContact CB-CG 4.34Å
298	K	78.9	Confident	79.4	Confident	73 Å²	73	58 Å²	58	32%	0.317	35%	0.345	S	S	.	.	B	Isolated β-bridge	trans	-86.4	116.2	177.2	-169.2	176.5	-173	168.5	0	109.7	E145 L296 G305 V306	E145-K298 IonicContact OE1-NZ 2.78Å; E145-K298 IonicContact OE2-NZ 2.71Å; E145-K298 PolarHBondContact OE2-NZ 2.83Å; L296-K298 PolarHBondContact O-N 3.28Å; K298-G305 CarbonylContact O-C 3.45Å; K298-G305 WeakPolarHBondContact O-CA 3.42Å; K298-V306 WeakPolarHBondContact CA-O 3.42Å; K298-V306 VanDerWaalsContact CB-O 3.25Å; K298-V306 WeakPolarHBondContact CB-O 3.35Å; K298-V306 PolarHBondContact N-O 3.16Å; K298-V306 PolarHBondContact O-N 3.07Å
299	G	80.3	Confident	79.2	Confident	47 Å²	47	59.2 Å²	59.2	49%	0.485	35%	0.346	S	S	.	.	S	Bend	trans	172.6	172.4	179.3	0	0	0	0	0	112.4
300	K	79.4	Confident	79.5	Confident	161 Å²	161	61 Å²	61	70%	0.7	36%	0.356	S	S	*	.			trans	-73.1	142.6	169.9	-71.8	-175.8	-180	-179.3	0	109.4	G302 D303	K300-G302 PolarHBondContact O-N 2.88Å; K300-D303 HydrophobicContact CB-CB 4.22Å; K300-D303 PolarHBondContact O-N 3.38Å; K300-D303 VanDerWaalsContact O-N 3.11Å
301	C	80.6	Confident	79.6	Confident	79 Å²	79	60.6 Å²	60.6	53%	0.534	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	131.5	177.9	-159.9	0	0	0	0	111.4	D303 C338	C301-D303 VanDerWaalsContact C-N 3.26Å; C301-D303 PolarHBondContact O-N 2.88Å; C301-C338 WeakPolarHBondContact CA-SG 3.41Å; C301-C338 HydrophobicContact CB-CB 3.3Å; C301-C338 WeakPolarHBondContact CB-SG 3Å; C301-C338 WeakPolarHBondContact SG-CB 3.22Å; C301-C338 CovalentContact SG-SG 2.01Å; C301-C338 PolarHBondContact SG-SG 3.28Å
302	G	75.8	Confident	79.1	Confident	65 Å²	65	59.4 Å²	59.4	67%	0.67	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.1	-7.4	-178.3	0	0	0	0	0	115.1	K300	K300-G302 PolarHBondContact O-N 2.88Å
303	D	84.6	Confident	80	Confident	93 Å²	93	60.6 Å²	60.6	50%	0.497	34%	0.343	S	S	.	.	S	Bend	trans	-103.4	168	173.1	-70.5	-35.3	0	0	0	111.2	K300 C301 G305 P335	K300-D303 HydrophobicContact CB-CB 4.22Å; K300-D303 PolarHBondContact O-N 3.38Å; K300-D303 VanDerWaalsContact O-N 3.11Å; C301-D303 VanDerWaalsContact C-N 3.26Å; C301-D303 PolarHBondContact O-N 2.88Å; D303-G305 PolarHBondContact O-N 3.35Å; D303-P335 WeakPolarHBondContact O-CD 3.07Å
304	S	85.8	Confident	79.8	Confident	97 Å²	97	63.5 Å²	63.5	68%	0.678	35%	0.353	S	S	*	.			trans	-67	120.5	170.8	62	0	0	0	0	110.5
305	G	87.8	Confident	79.2	Confident	3 Å²	3	63.7 Å²	63.7	3%	0.031	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	-174.1	171.1	0	0	0	0	0	113	K298 D303 K332 C333	K298-G305 CarbonylContact O-C 3.45Å; K298-G305 WeakPolarHBondContact O-CA 3.42Å; D303-G305 PolarHBondContact O-N 3.35Å; G305-K332 WeakPolarHBondContact O-CA 3.39Å; G305-C333 CarbonylContact C-O 3.49Å; G305-C333 VanDerWaalsContact C-SG 3.59Å; G305-C333 WeakPolarHBondContact CA-O 3.25Å; G305-C333 PolarHBondContact N-O 3.39Å; G305-C333 PolarHBondContact O-N 3.22Å
306	V	87.2	Confident	79.6	Confident	38 Å²	38	67.2 Å²	67.2	23%	0.23	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	133.1	-174.9	171.9	0	0	0	0	109.1	K298 H308 E330 N331 C333	K298-V306 WeakPolarHBondContact CA-O 3.42Å; K298-V306 VanDerWaalsContact CB-O 3.25Å; K298-V306 WeakPolarHBondContact CB-O 3.35Å; K298-V306 PolarHBondContact N-O 3.16Å; K298-V306 PolarHBondContact O-N 3.07Å; V306-H308 WeakPolarHBondContact CG1-NE2 3.32Å; V306-E330 HydrophobicContact CB-CG 4.48Å; V306-E330 HydrophobicContact CG1-CG 3.11Å; V306-E330 WeakPolarHBondContact CG1-OE1 3.36Å; V306-E330 WeakPolarHBondContact CG2-OE1 3.25Å; V306-N331 WeakPolarHBondContact CA-O 3.33Å; V306-C333 PolarHBondContact N-SG 3.47Å
307	R	82	Confident	80	Confident	79 Å²	79	65.8 Å²	65.8	30%	0.298	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	147.4	171.7	55.1	-174.7	-167.2	170.7	-2.9	109.2	W294 G295 E330 N331 C333	W294-R307 HydrophobicContact CB-CB 4.42Å; W294-R307 HydrophobicContact CB-CG 4.19Å; W294-R307 VanDerWaalsContact CD1-CZ 3.48Å; W294-R307 HydrophobicContact CD2-CG 3.94Å; W294-R307 HydrophobicContact CE3-CB 4.14Å; W294-R307 HydrophobicContact CE3-CG 3.59Å; W294-R307 HydrophobicContact CG-CG 4.22Å; W294-R307 HydrophobicContact CZ3-CG 4.28Å; W294-R307 VanDerWaalsContact CZ3-O 3.23Å; W294-R307 WeakPolarHBondContact CZ3-O 3.47Å; G295-R307 WeakPolarHBondContact O-CB 3.49Å; R307-E330 WeakPolarHBondContact O-CA 3.43Å; R307-N331 HydrophobicContact CG-CB 4.39Å; R307-N331 WeakPolarHBondContact CG-O 3.21Å; R307-N331 PolarHBondContact N-O 3.42Å; R307-N331 PolarHBondContact O-N 3.28Å; R307-C333 HydrophobicContact CB-CB 4.48Å; R307-C333 HydrophobicContact CG-CB 3.95Å; R307-C333 PolarHBondContact N-SG 3.42Å; R307-C333 VanDerWaalsContact N-SG 3.36Å
308	H	86.1	Confident	80	Confident	72 Å²	72	66.1 Å²	66.1	33%	0.333	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	149.7	-178.7	-62.1	-89.9	0	0	0	110.2	G295 V306 E329 E330	G295-H308 PolarHBondContact N-O 2.93Å; V306-H308 WeakPolarHBondContact CG1-NE2 3.32Å; H308-E329 CarbonylContact C-O 3.45Å; H308-E329 VanDerWaalsContact CA-O 3.3Å; H308-E329 WeakPolarHBondContact CA-O 3.47Å; H308-E330 IonicContact CE1-OE2 3.9Å; H308-E330 PolarHBondContact CE1-OE2 3.09Å; H308-E330 VanDerWaalsContact CE1-OE2 3.27Å; H308-E330 IonicContact ND1-OE2 3.04Å
309	R	79.9	Confident	80.2	Confident	58 Å²	58	65.2 Å²	65.2	22%	0.219	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	153	165	66.1	-178.7	-175.3	-178.9	-6.3	109.4	W291 S292 P293 W294 E329	W291-R309 HydrophobicContact CD2-CG 4.35Å; W291-R309 HydrophobicContact CE3-CG 3.84Å; W291-R309 HydrophobicContact CZ3-CG 4.39Å; S292-R309 WeakPolarHBondContact O-CB 3.36Å; S292-R309 WeakPolarHBondContact O-CD 3.31Å; P293-R309 WeakPolarHBondContact O-CB 3.48Å; W294-R309 HydrophobicContact CD2-CB 4.28Å; W294-R309 HydrophobicContact CD2-CG 4.19Å; W294-R309 HydrophobicContact CE3-CB 3.92Å; W294-R309 HydrophobicContact CE3-CG 3.86Å; W294-R309 HydrophobicContact CH2-CG 3.83Å; W294-R309 HydrophobicContact CZ2-CG 4.17Å; W294-R309 HydrophobicContact CZ3-CB 4.19Å; W294-R309 HydrophobicContact CZ3-CG 3.7Å; R309-E329 HydrophobicContact CG-CB 3.84Å; R309-E329 IonicContact CZ-OE1 3.4Å; R309-E329 IonicContact CZ-OE2 2.66Å; R309-E329 PolarHBondContact N-O 3.21Å; R309-E329 IonicContact NE-OE1 3.88Å; R309-E329 IonicContact NE-OE2 3.06Å; R309-E329 PolarHBondContact NE-OE2 3.25Å; R309-E329 IonicContact NH2-OE1 3.79Å; R309-E329 PolarHBondContact NH2-OE1 2.84Å; R309-E329 IonicContact NH2-OE2 3.05Å; R309-E329 PolarHBondContact NH2-OE2 3Å; R309-E329 PolarHBondContact O-N 2.95Å
310	T	77.3	Confident	80.5	Confident	47 Å²	47	71 Å²	71	29%	0.288	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	158.2	-177.7	61.7	0	0	0	0	111.3	L127 S292 L327 E328	L127-T310 PolarHBondContact O-OG1 3.39Å; S292-T310 VanDerWaalsContact CB-O 3.3Å; S292-T310 WeakPolarHBondContact CB-O 3.01Å; S292-T310 PolarHBondContact N-O 3.35Å; S292-T310 PolarHBondContact OG-N 3.37Å; S292-T310 PolarHBondContact OG-O 3.36Å; S292-T310 PolarHBondContact OG-OG1 3.41Å; T310-L327 CarbonylContact C-O 3.59Å; T310-L327 WeakPolarHBondContact CA-O 3.34Å; T310-E328 HydrophobicContact CG2-CG 4.16Å
311	R	80.4	Confident	80.6	Confident	50 Å²	50	64 Å²	64	19%	0.189	36%	0.359	C	S	.	.			trans	-139.8	160.1	166.9	63.4	-179.2	171.3	-178.7	-8	108.3	S289 W291 P325 S326 L327	S289-R311 WeakPolarHBondContact OG-CB 3.34Å; W291-R311 HydrophobicContact CD2-CB 4.18Å; W291-R311 HydrophobicContact CD2-CG 4.07Å; W291-R311 HydrophobicContact CE3-CB 3.79Å; W291-R311 HydrophobicContact CE3-CG 3.71Å; W291-R311 HydrophobicContact CH2-CG 3.95Å; W291-R311 HydrophobicContact CZ2-CG 4.3Å; W291-R311 HydrophobicContact CZ3-CB 4.18Å; W291-R311 HydrophobicContact CZ3-CG 3.65Å; R311-P325 VanDerWaalsContact NH2-CB 3.31Å; R311-P325 VanDerWaalsContact NH2-CG 3.34Å; R311-S326 VanDerWaalsContact CZ-O 3.25Å; R311-S326 PolarHBondContact NE-O 3.21Å; R311-S326 PolarHBondContact NH2-O 3.27Å; R311-L327 HydrophobicContact CG-CD2 4.25Å; R311-L327 PolarHBondContact N-O 2.87Å; R311-L327 WeakPolarHBondContact O-CB 3.3Å
312	Y	69.6	Low	81	Confident	38 Å²	38	64.7 Å²	64.7	15%	0.149	36%	0.361	C	S	.	.			trans	-119.9	167.7	-177.1	63.6	-87.5	0	0	0	111.8	M111 V288 S289 H314	M111-Y312 HydrophobicContact CE-CD1 4.25Å; M111-Y312 HydrophobicContact CE-CE1 3.68Å; M111-Y312 HydrophobicContact SD-CE1 3.63Å; V288-Y312 CarbonylContact C-O 3.55Å; V288-Y312 WeakPolarHBondContact CA-O 3.47Å; V288-Y312 WeakPolarHBondContact CB-O 3.33Å; S289-Y312 PolarHBondContact N-O 3.02Å; S289-Y312 WeakPolarHBondContact OG-CD1 3.42Å; S289-Y312 WeakPolarHBondContact OG-CE1 3.22Å; S289-Y312 PolarHBondContact OG-N 2.97Å; Y312-H314 AromaticContact CE2-CE1 3.5Å; Y312-H314 AromaticContact CE2-ND1 3.52Å; Y312-H314 AromaticContact CZ-CE1 3.6Å; Y312-H314 PolarHBondContact OH-CE1 2.89Å; Y312-H314 VanDerWaalsContact OH-CE1 3.25Å
313	I	79.1	Confident	81.9	Confident	35 Å²	35	67 Å²	67	18%	0.179	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	118.7	179	-61.4	166.9	0	0	0	108.4	E287 V288 L315 Q316 C324 L327	E287-I313 CarbonylContact O-C 3.56Å; V288-I313 HydrophobicContact CG1-CG1 4.18Å; I313-L315 WeakPolarHBondContact CG2-O 3.47Å; I313-Q316 HydrophobicContact CG2-CG 4.19Å; I313-C324 HydrophobicContact CD1-CB 3.95Å; I313-C324 WeakPolarHBondContact CD1-SG 3.46Å; I313-C324 HydrophobicContact CG1-CB 4.13Å; I313-C324 VanDerWaalsContact CG1-SG 3.56Å; I313-L327 HydrophobicContact CD1-CD1 3.83Å; I313-L327 HydrophobicContact CD1-CD2 4.42Å; I313-L327 HydrophobicContact CG1-CD1 3.91Å; I313-L327 HydrophobicContact CG1-CD2 3.77Å; I313-L327 HydrophobicContact CG1-CG 4.45Å
314	H	65.4	Low	82	Confident	101 Å²	101	64.1 Å²	64.1	47%	0.468	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	-41.1	166.9	-75.4	-61.4	0	0	0	111	E287 V288 S289 Y312	E287-H314 HydrophobicContact CB-CB 4.23Å; E287-H314 HydrophobicContact CG-CB 4.23Å; E287-H314 WeakPolarHBondContact O-CA 3.42Å; E287-H314 PolarHBondContact O-N 3.32Å; V288-H314 VanDerWaalsContact C-CD2 3.42Å; S289-H314 VanDerWaalsContact CA-CD2 3.41Å; S289-H314 WeakPolarHBondContact CA-CD2 2.98Å; S289-H314 WeakPolarHBondContact CA-NE2 3.14Å; S289-H314 VanDerWaalsContact CB-NE2 3.35Å; S289-H314 WeakPolarHBondContact CB-NE2 3.39Å; S289-H314 PolarHBondContact N-CD2 3.39Å; S289-H314 VanDerWaalsContact N-CD2 3.27Å; Y312-H314 AromaticContact CE2-CE1 3.5Å; Y312-H314 AromaticContact CE2-ND1 3.52Å; Y312-H314 AromaticContact CZ-CE1 3.6Å; Y312-H314 PolarHBondContact OH-CE1 2.89Å; Y312-H314 VanDerWaalsContact OH-CE1 3.25Å
315	L	69.1	Low	82.3	Confident	64 Å²	64	62.2 Å²	62.2	34%	0.335	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	122.5	-177.2	-170.6	62.3	0	0	0	110.8	L284 C286 E287 I313	L284-L315 HydrophobicContact CD1-CD2 3.62Å; L284-L315 HydrophobicContact CD2-CD1 4.04Å; L284-L315 HydrophobicContact CD2-CD2 3.85Å; L284-L315 HydrophobicContact CD2-CG 3.99Å; L284-L315 HydrophobicContact CG-CD2 3.67Å; L284-L315 HydrophobicContact CG-CG 4.18Å; C286-L315 VanDerWaalsContact CA-O 3.29Å; C286-L315 WeakPolarHBondContact CA-O 3.21Å; C286-L315 PolarHBondContact SG-O 3.23Å; C286-L315 VanDerWaalsContact SG-O 3.33Å; E287-L315 HydrophobicContact CB-CB 3.82Å; E287-L315 PolarHBondContact N-O 3.28Å; E287-L315 VanDerWaalsContact N-O 3.13Å; E287-L315 PolarHBondContact O-N 2.97Å; I313-L315 WeakPolarHBondContact CG2-O 3.47Å
316	Q	80	Confident	82.5	Confident	103 Å²	103	66 Å²	66	48%	0.481	36%	0.359	S	S	.	.			trans	-71.7	142.8	175.1	-68.9	-70.7	-13.3	0	0	110.3	I313	I313-Q316 HydrophobicContact CG2-CG 4.19Å
317	P	87.1	Confident	82.5	Confident	44 Å²	44	67 Å²	67	29%	0.286	36%	0.363	S	S	.	.			trans	-69.1	143.5	179.6	29.5	-33.5	0	0	0	111	L284 C286 V322	L284-P317 CarbonylContact O-C 3.07Å; L284-P317 WeakPolarHBondContact O-CA 3.18Å; C286-P317 HydrophobicContact CB-CB 4.1Å; C286-P317 HydrophobicContact CB-CG 4.2Å; P317-V322 WeakPolarHBondContact CB-O 3.48Å
318	A	83.4	Confident	82.7	Confident	42 Å²	42	69.4 Å²	69.4	35%	0.347	38%	0.378	S	S	.	.	B	Isolated β-bridge	trans	-144	165.7	176.7	0	0	0	0	0	111.2	L284 N320 G321	L284-A318 HydrophobicContact CB-CB 4.04Å; L284-A318 HydrophobicContact CD2-CB 4.29Å; L284-A318 PolarHBondContact N-O 3.11Å; L284-A318 PolarHBondContact O-N 2.76Å; A318-N320 VanDerWaalsContact C-N 3.32Å; A318-N320 PolarHBondContact O-N 3.04Å; A318-G321 PolarHBondContact O-N 3.28Å
319	N	84.1	Confident	83	Confident	53 Å²	53	69.1 Å²	69.1	28%	0.283	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	43.1	174.6	-55.5	-17.4	0	0	0	114.2	I279 N280 T282 P283 G321	I279-N319 PolarHBondContact O-ND2 3.43Å; N280-N319 PolarHBondContact OD1-OD1 2.78Å; T282-N319 VanDerWaalsContact O-CB 3.25Å; T282-N319 WeakPolarHBondContact O-CB 3.32Å; T282-N319 PolarHBondContact O-ND2 2.86Å; P283-N319 WeakPolarHBondContact CA-O 3.21Å; N319-G321 VanDerWaalsContact C-N 3.25Å; N319-G321 PolarHBondContact O-N 3.24Å
320	N	84.9	Confident	83.6	Confident	169 Å²	169	72 Å²	72	90%	0.904	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	26.2	-173.9	-67.6	-11	0	0	0	115.2	A318	A318-N320 VanDerWaalsContact C-N 3.32Å; A318-N320 PolarHBondContact O-N 3.04Å
321	G	81.7	Confident	84.3	Confident	13 Å²	13	73 Å²	73	13%	0.134	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-67.4	166.8	167.6	0	0	0	0	0	113.4	L284 D285 A318 N319 V323	L284-G321 WeakPolarHBondContact O-CA 3.49Å; D285-G321 WeakPolarHBondContact OD1-CA 3.19Å; A318-G321 PolarHBondContact O-N 3.28Å; N319-G321 VanDerWaalsContact C-N 3.25Å; N319-G321 PolarHBondContact O-N 3.24Å; G321-V323 PolarHBondContact O-N 3.19Å
322	V	90.7	Very high	84.9	Confident	95 Å²	95	78.5 Å²	78.5	58%	0.576	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-62.7	127.5	-177.3	178.4	0	0	0	0	110.8	D285 C286 P317	D285-V322 HydrophobicContact CB-CB 4.23Å; D285-V322 WeakPolarHBondContact OD1-CG2 3.44Å; D285-V322 PolarHBondContact OD1-N 3.1Å; C286-V322 WeakPolarHBondContact CB-O 3.34Å; C286-V322 PolarHBondContact N-O 2.94Å; P317-V322 WeakPolarHBondContact CB-O 3.48Å
323	V	93.1	Very high	85.7	Confident	113 Å²	113	77.7 Å²	77.7	69%	0.685	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-62.4	152.6	177.7	-62.3	0	0	0	0	112.2	G321	G321-V323 PolarHBondContact O-N 3.19Å
324	C	87.4	Confident	86.1	Confident	33 Å²	33	81.4 Å²	81.4	22%	0.223	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-61.2	135.2	179.8	-57.3	0	0	0	0	112.2	C286 V288 I313	C286-C324 VanDerWaalsContact CB-CA 3.5Å; C286-C324 HydrophobicContact CB-CB 3.82Å; C286-C324 WeakPolarHBondContact CB-SG 3.11Å; C286-C324 WeakPolarHBondContact SG-CA 3.32Å; C286-C324 WeakPolarHBondContact SG-CB 3.29Å; C286-C324 CovalentContact SG-SG 2.02Å; C286-C324 PolarHBondContact SG-SG 3.19Å; V288-C324 HydrophobicContact CG1-CB 4.45Å; I313-C324 HydrophobicContact CD1-CB 3.95Å; I313-C324 WeakPolarHBondContact CD1-SG 3.46Å; I313-C324 HydrophobicContact CG1-CB 4.13Å; I313-C324 VanDerWaalsContact CG1-SG 3.56Å
325	P	92.3	Very high	87	Confident	57 Å²	57	77.3 Å²	77.3	37%	0.37	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-70.7	172.5	172.2	34.8	-38.9	0	0	0	110.8	V288 R311 L327	V288-P325 HydrophobicContact CG1-CG 4.14Å; V288-P325 HydrophobicContact CG2-CG 3.91Å; R311-P325 VanDerWaalsContact NH2-CB 3.31Å; R311-P325 VanDerWaalsContact NH2-CG 3.34Å; P325-L327 PolarHBondContact O-N 2.85Å
326	S	91.3	Very high	87.2	Confident	81 Å²	81	81 Å²	81	57%	0.566	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-52	131.9	-178.7	-170.5	0	0	0	0	111.7	W291 R311 E328	W291-S326 VanDerWaalsContact CH2-O 3.23Å; W291-S326 WeakPolarHBondContact CH2-O 3.11Å; R311-S326 VanDerWaalsContact CZ-O 3.25Å; R311-S326 PolarHBondContact NE-O 3.21Å; R311-S326 PolarHBondContact NH2-O 3.27Å; S326-E328 PolarHBondContact OG-N 2.94Å; S326-E328 PolarHBondContact OG-O 2.98Å
327	L	88.1	Confident	86.3	Confident	60 Å²	60	83.4 Å²	83.4	31%	0.314	46%	0.459	S	S	.	.	S	Bend	trans	-90.1	-10	179	-60.2	-175	0	0	0	112.7	V288 W291 T310 R311 I313 P325	V288-L327 HydrophobicContact CG1-CD2 3.91Å; W291-L327 WeakPolarHBondContact CZ3-O 3.35Å; T310-L327 CarbonylContact C-O 3.59Å; T310-L327 WeakPolarHBondContact CA-O 3.34Å; R311-L327 HydrophobicContact CG-CD2 4.25Å; R311-L327 PolarHBondContact N-O 2.87Å; R311-L327 WeakPolarHBondContact O-CB 3.3Å; I313-L327 HydrophobicContact CD1-CD1 3.83Å; I313-L327 HydrophobicContact CD1-CD2 4.42Å; I313-L327 HydrophobicContact CG1-CD1 3.91Å; I313-L327 HydrophobicContact CG1-CD2 3.77Å; I313-L327 HydrophobicContact CG1-CG 4.45Å; P325-L327 PolarHBondContact O-N 2.85Å
328	E	86.7	Confident	85.3	Confident	130 Å²	130	84 Å²	84	61%	0.607	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.8	144.8	178.2	-56.9	-172.4	172.7	0	0	109.9	T310 S326	T310-E328 HydrophobicContact CG2-CG 4.16Å; S326-E328 PolarHBondContact OG-N 2.94Å; S326-E328 PolarHBondContact OG-O 2.98Å
329	E	91.6	Very high	83.9	Confident	65 Å²	65	92.3 Å²	92.3	30%	0.304	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	143.1	174.3	-164.9	-176.1	159.3	0	0	110	W291 W294 H308 R309	W291-E329 HydrophobicContact CE3-CB 4.35Å; W291-E329 HydrophobicContact CH2-CB 3.67Å; W291-E329 HydrophobicContact CZ2-CB 4.11Å; W291-E329 HydrophobicContact CZ3-CB 3.79Å; W294-E329 HydrophobicContact CH2-CB 4.19Å; W294-E329 HydrophobicContact CH2-CG 3.85Å; W294-E329 WeakPolarHBondContact CZ3-O 3.32Å; H308-E329 CarbonylContact C-O 3.45Å; H308-E329 VanDerWaalsContact CA-O 3.3Å; H308-E329 WeakPolarHBondContact CA-O 3.47Å; R309-E329 HydrophobicContact CG-CB 3.84Å; R309-E329 IonicContact CZ-OE1 3.4Å; R309-E329 IonicContact CZ-OE2 2.66Å; R309-E329 PolarHBondContact N-O 3.21Å; R309-E329 IonicContact NE-OE1 3.88Å; R309-E329 IonicContact NE-OE2 3.06Å; R309-E329 PolarHBondContact NE-OE2 3.25Å; R309-E329 IonicContact NH2-OE1 3.79Å; R309-E329 PolarHBondContact NH2-OE1 2.84Å; R309-E329 IonicContact NH2-OE2 3.05Å; R309-E329 PolarHBondContact NH2-OE2 3Å; R309-E329 PolarHBondContact O-N 2.95Å
330	E	92.4	Very high	83.9	Confident	118 Å²	118	94.3 Å²	94.3	55%	0.551	51%	0.512	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.5	140.3	-178.7	-173	-177.2	134.6	0	0	109.5	V306 R307 H308	V306-E330 HydrophobicContact CB-CG 4.48Å; V306-E330 HydrophobicContact CG1-CG 3.11Å; V306-E330 WeakPolarHBondContact CG1-OE1 3.36Å; V306-E330 WeakPolarHBondContact CG2-OE1 3.25Å; R307-E330 WeakPolarHBondContact O-CA 3.43Å; H308-E330 IonicContact CE1-OE2 3.9Å; H308-E330 PolarHBondContact CE1-OE2 3.09Å; H308-E330 VanDerWaalsContact CE1-OE2 3.27Å; H308-E330 IonicContact ND1-OE2 3.04Å
331	N	91.6	Very high	83.8	Confident	69 Å²	69	90.3 Å²	90.3	37%	0.369	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	150	173.8	-166.5	4.3	0	0	0	111.7	W294 V306 R307	W294-N331 HydrophobicContact CD2-CB 4.48Å; W294-N331 HydrophobicContact CE3-CB 4.21Å; W294-N331 HydrophobicContact CH2-CB 3.21Å; W294-N331 HydrophobicContact CZ2-CB 3.51Å; W294-N331 HydrophobicContact CZ3-CB 3.58Å; V306-N331 WeakPolarHBondContact CA-O 3.33Å; R307-N331 HydrophobicContact CG-CB 4.39Å; R307-N331 WeakPolarHBondContact CG-O 3.21Å; R307-N331 PolarHBondContact N-O 3.42Å; R307-N331 PolarHBondContact O-N 3.28Å
332	K	92.3	Very high	83.9	Confident	165 Å²	165	94.6 Å²	94.6	72%	0.717	51%	0.511	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.5	144.9	176	-67	-176.4	179.9	-178.7	0	110.3	G305	G305-K332 WeakPolarHBondContact O-CA 3.39Å
333	C	87.4	Confident	83.5	Confident	21 Å²	21	94.6 Å²	94.6	14%	0.142	51%	0.507	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	173.2	176.4	54.4	0	0	0	0	110.1	C297 G305 V306 R307	C297-C333 WeakPolarHBondContact CA-SG 3.27Å; C297-C333 HydrophobicContact CB-CB 3.81Å; C297-C333 WeakPolarHBondContact CB-SG 3.47Å; C297-C333 WeakPolarHBondContact SG-CB 3.34Å; C297-C333 CovalentContact SG-SG 2.01Å; C297-C333 PolarHBondContact SG-SG 2.73Å; G305-C333 CarbonylContact C-O 3.49Å; G305-C333 VanDerWaalsContact C-SG 3.59Å; G305-C333 WeakPolarHBondContact CA-O 3.25Å; G305-C333 PolarHBondContact N-O 3.39Å; G305-C333 PolarHBondContact O-N 3.22Å; V306-C333 PolarHBondContact N-SG 3.47Å; R307-C333 HydrophobicContact CB-CB 4.48Å; R307-C333 HydrophobicContact CG-CB 3.95Å; R307-C333 PolarHBondContact N-SG 3.42Å; R307-C333 VanDerWaalsContact N-SG 3.36Å
334	I	87.2	Confident	82.9	Confident	113 Å²	113	93.4 Å²	93.4	58%	0.579	50%	0.496	S	S	*	.			trans	-117.3	126	170.9	-60.8	171.1	0	0	0	105.8	C297 D336	C297-I334 VanDerWaalsContact SG-C 3.55Å; I334-D336 PolarHBondContact O-N 3.28Å
335	P	83.8	Confident	82.7	Confident	16 Å²	16	97.5 Å²	97.5	10%	0.104	51%	0.514	C	S	.	.			trans	-62.3	121.6	177.3	-22.6	33.6	0	0	0	111.3	C297 D303 C338	C297-P335 HydrophobicContact CB-CB 4.46Å; C297-P335 HydrophobicContact CB-CG 4.34Å; D303-P335 WeakPolarHBondContact O-CD 3.07Å; P335-C338 PolarHBondContact O-SG 3.05Å
336	D	73.2	Confident	82	Confident	141 Å²	141	100.4 Å²	100.4	75%	0.754	52%	0.524	S	S	*	.			trans	-93.9	145.2	177	-68.4	-35.3	0	0	0	110.8	I334	I334-D336 PolarHBondContact O-N 3.28Å
337	N	61.3	Low	81.2	Confident	154 Å²	154	101.8 Å²	101.8	82%	0.824	52%	0.521	S	S	*	.	S	Bend	trans	54.4	50.7	176.6	-69.2	-28.8	0	0	0	115.6
338	C	67.9	Low	80.7	Confident	55 Å²	55	105.3 Å²	105.3	37%	0.372	54%	0.538	S	S	.	.			trans	-77.5	133.7	173	-13.2	0	0	0	0	110.9	C301 P335	C301-C338 WeakPolarHBondContact CA-SG 3.41Å; C301-C338 HydrophobicContact CB-CB 3.3Å; C301-C338 WeakPolarHBondContact CB-SG 3Å; C301-C338 WeakPolarHBondContact SG-CB 3.22Å; C301-C338 CovalentContact SG-SG 2.01Å; C301-C338 PolarHBondContact SG-SG 3.28Å; P335-C338 PolarHBondContact O-SG 3.05Å
339	L	52.8	Low	80.1	Confident	217 Å²	217	103.1 Å²	103.1	100%	1.136	53%	0.532	S	S	*	.			trans	-102.9	0	173.4	-73.6	170.8	0	0	0	110.5

Retrieved 339 of 339 residues in 1374 ms (Link to these results)

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