A0A087YS89_POEFO Loading...

Potassium inwardly rectifying channel subfamily J member 15

AlphaFold DB , UniProt , Accession A0A087YS89, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 334 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	K	34.9	Very low	28.6	Very low	247 Å²	247	158.5 Å²	158.5	100%	1.074	78%	0.783	S	S	*	*				0	69.7	0	-74.4	179.5	173.9	179	0	106.4
2	I	29.1	Very low	28.6	Very low	135 Å²	135	159.6 Å²	159.6	69%	0.692	79%	0.785	S	S	*	*				69.1	116.2	86.9	-44.9	156.6	0	0	0	108.7
3	F	27.7	Very low	28.4	Very low	180 Å²	180	158.4 Å²	158.4	79%	0.789	79%	0.793	S	S	*	*				-163.1	131.1	69.4	-103.9	-95.1	0	0	0	109.7
4	N	29.8	Very low	28.8	Very low	119 Å²	119	155.6 Å²	155.6	64%	0.636	80%	0.796	S	S	*	*				58.4	109.7	80.9	-90.9	1.9	0	0	0	114.3
5	I	33.8	Very low	28.8	Very low	140 Å²	140	158.6 Å²	158.6	72%	0.718	80%	0.801	S	S	*	*				63.5	114	100.1	-62.6	171.3	0	0	0	112.8
6	L	28.9	Very low	29	Very low	139 Å²	139	156.9 Å²	156.9	73%	0.728	80%	0.804	S	S	*	*				-174.6	112.6	127.2	-100.2	152.4	0	0	0	110.8	F8	L6-F8 HydrophobicContact CB-CD2 4.42Å; L6-F8 HydrophobicContact CD2-CD2 4.26Å; L6-F8 HydrophobicContact CD2-CE2 3.95Å
7	C	25.2	Very low	29	Very low	124 Å²	124	154.6 Å²	154.6	84%	0.838	81%	0.805	S	S	*	*			trans	-58.8	132.3	150.2	-75.9	0	0	0	0	108.6
8	F	28.2	Very low	28.9	Very low	180 Å²	180	156.2 Å²	156.2	79%	0.789	81%	0.808	S	S	*	*			trans	-123.9	115.7	155.1	-101.3	-85.6	0	0	0	108.3	L6	L6-F8 HydrophobicContact CB-CD2 4.42Å; L6-F8 HydrophobicContact CD2-CD2 4.26Å; L6-F8 HydrophobicContact CD2-CE2 3.95Å
9	Y	24.2	Very low	28.9	Very low	212 Å²	212	158.7 Å²	158.7	83%	0.831	81%	0.812	S	S	*	*			trans	-67.1	130.4	159.8	-122.8	-102.6	0	0	0	107.5
10	S	25.3	Very low	28.9	Very low	118 Å²	118	158.1 Å²	158.1	83%	0.825	81%	0.809	S	S	*	*			trans	-143.6	108.9	157.2	-173.8	0	0	0	0	107.6
11	E	27.1	Very low	28.9	Very low	149 Å²	149	157.9 Å²	157.9	70%	0.696	81%	0.807	S	S	*	*			trans	-68.7	151.6	167	-84	172.8	146.5	0	0	111.4
12	E	28.8	Very low	28.7	Very low	172 Å²	172	153.2 Å²	153.2	80%	0.804	79%	0.793	S	S	*	*			trans	54.1	119.7	153.6	-67.8	-175.2	154.7	0	0	120.4
13	T	26.7	Very low	28.8	Very low	144 Å²	144	155 Å²	155	88%	0.883	80%	0.799	S	S	*	*				-170.2	123.6	109	23.2	0	0	0	0	110.5
14	S	34.3	Very low	29.1	Very low	119 Å²	119	155.5 Å²	155.5	83%	0.832	80%	0.801	S	S	*	*			trans	-71.9	123.7	174.3	42.4	0	0	0	0	111.2
15	K	28.5	Very low	29.5	Very low	201 Å²	201	154.3 Å²	154.3	87%	0.874	80%	0.801	S	S	*	*			trans	-147.9	143.7	153	-96.2	-176.4	-173.5	174.9	0	110.8
16	P	31.1	Very low	30.1	Very low	131 Å²	131	156.6 Å²	156.6	85%	0.851	81%	0.809	S	S	*	*			trans	-83.8	132.7	-162.8	34	-31.7	0	0	0	110.6
17	S	28.9	Very low	31.4	Very low	118 Å²	118	156 Å²	156	83%	0.825	81%	0.811	S	S	*	*			trans	-114.4	136.5	166.7	49.2	0	0	0	0	109.7
18	E	28.8	Very low	33.2	Very low	183 Å²	183	152.4 Å²	152.4	86%	0.855	78%	0.782	S	S	*	*			trans	-47.1	133.4	-171.2	-71.2	156.5	129.7	0	0	113.6	I20	E18-I20 VanDerWaalsContact C-N 3.33Å; E18-I20 PolarHBondContact O-N 2.91Å
19	K	27.8	Very low	35.2	Very low	204 Å²	204	155.3 Å²	155.3	89%	0.887	79%	0.788	S	S	*	*			trans	-63.4	95.4	163.5	-79.8	-178.9	174.9	177.9	0	108.7	M21	K19-M21 VanDerWaalsContact C-N 3.34Å; K19-M21 PolarHBondContact O-N 3.11Å; K19-M21 VanDerWaalsContact O-N 3.11Å
20	I	30.1	Very low	38.1	Very low	147 Å²	147	148.1 Å²	148.1	75%	0.754	76%	0.759	S	S	*	*			trans	-68.5	102.2	152.3	-62	174	0	0	0	105.2	E18 D22	E18-I20 VanDerWaalsContact C-N 3.33Å; E18-I20 PolarHBondContact O-N 2.91Å; I20-D22 PolarHBondContact O-N 2.89Å
21	M	28.9	Very low	41	Very low	153 Å²	153	144.6 Å²	144.6	75%	0.754	73%	0.73	S	S	*	*			trans	-62.4	91.4	164.9	-94.7	170.2	49.9	0	0	107.6	K19 Q23	K19-M21 VanDerWaalsContact C-N 3.34Å; K19-M21 PolarHBondContact O-N 3.11Å; K19-M21 VanDerWaalsContact O-N 3.11Å; M21-Q23 PolarHBondContact O-N 2.89Å
22	D	29.8	Very low	44	Very low	149 Å²	149	137.8 Å²	137.8	80%	0.797	70%	0.699	S	S	*	*			trans	-62.1	93.3	155.5	-104.8	-18.1	0	0	0	106.6	I20 K24	I20-D22 PolarHBondContact O-N 2.89Å; D22-K24 PolarHBondContact O-N 2.79Å
23	Q	31.9	Very low	47	Very low	172 Å²	172	130.4 Å²	130.4	80%	0.804	67%	0.667	S	S	*	*			trans	-70	73	166	-137.7	176.9	2.6	0	0	106.6	M21 S25	M21-Q23 PolarHBondContact O-N 2.89Å; Q23-S25 VanDerWaalsContact C-N 3.27Å; Q23-S25 PolarHBondContact O-N 2.87Å
24	K	33.1	Very low	50	Low	192 Å²	192	125.2 Å²	125.2	84%	0.835	63%	0.632	S	S	*	*			trans	-64.4	96.2	170.7	-160.7	177.2	-168.8	175.4	0	105.2	D22 E26	D22-K24 PolarHBondContact O-N 2.79Å; K24-E26 PolarHBondContact O-N 3Å
25	S	38.6	Very low	52.4	Low	93 Å²	93	126.1 Å²	126.1	65%	0.65	63%	0.627	S	S	*	*			trans	-42.8	116.9	170.3	55.1	0	0	0	0	107.1	Q23 V27	Q23-S25 VanDerWaalsContact C-N 3.27Å; Q23-S25 PolarHBondContact O-N 2.87Å; S25-V27 PolarHBondContact O-N 3.16Å
26	E	45.6	Very low	55.1	Low	188 Å²	188	116.9 Å²	116.9	88%	0.879	59%	0.589	S	S	*	*			trans	-52.1	107.4	172.5	-89.2	-174.9	137.7	0	0	106.6	K24 Q28	K24-E26 PolarHBondContact O-N 3Å; E26-Q28 PolarHBondContact O-N 2.77Å
27	V	56.3	Low	57.7	Low	128 Å²	128	116.2 Å²	116.2	78%	0.776	57%	0.574	S	S	*	*			trans	-67.5	95.5	177.1	177.7	0	0	0	0	105	S25 R29	S25-V27 PolarHBondContact O-N 3.16Å; V27-R29 PolarHBondContact O-N 2.76Å
28	Q	63	Low	60.4	Low	47 Å²	47	115.3 Å²	115.3	22%	0.22	56%	0.561	C	S	.	*			trans	-56.6	118.5	-179.4	-170.1	147.1	6.7	0	0	107.8	E26 R30 N277 I302	E26-Q28 PolarHBondContact O-N 2.77Å; Q28-R30 PolarHBondContact O-N 2.81Å; Q28-R30 VanDerWaalsContact O-N 3.16Å; Q28-N277 PolarHBondContact NE2-OD1 3.36Å; Q28-I302 HydrophobicContact CB-CD1 4.4Å
29	R	70.4	Confident	63	Low	241 Å²	241	111.1 Å²	111.1	91%	0.909	54%	0.544	S	S	*	.			trans	-61.3	120.1	-178	-67.5	-179	-178.7	174.7	0.5	107.9	V27	V27-R29 PolarHBondContact O-N 2.76Å
30	R	84.9	Confident	65.5	Low	61 Å²	61	105.9 Å²	105.9	23%	0.23	53%	0.529	C	S	.	.			trans	-106.5	137.6	177	64.7	-177.7	63.6	-160.4	2.1	110.9	Q28 V32 N39 E279 I302 E305	Q28-R30 PolarHBondContact O-N 2.81Å; Q28-R30 VanDerWaalsContact O-N 3.16Å; R30-V32 VanDerWaalsContact CD-O 3.31Å; R30-V32 WeakPolarHBondContact CD-O 3.14Å; R30-V32 WeakPolarHBondContact CG-O 3.3Å; R30-N39 VanDerWaalsContact O-CB 3.29Å; R30-N39 WeakPolarHBondContact O-CB 3.49Å; R30-N39 PolarHBondContact O-ND2 3.38Å; R30-E279 WeakPolarHBondContact CA-OE2 3.24Å; R30-I302 VanDerWaalsContact NH2-CD1 3.33Å; R30-E305 IonicContact CZ-OE1 3.54Å; R30-E305 IonicContact NH1-OE1 2.63Å; R30-E305 PolarHBondContact NH1-OE1 3Å; R30-E305 IonicContact NH1-OE2 2.89Å; R30-E305 IonicContact NH2-OE1 3.33Å; R30-E305 PolarHBondContact NH2-OE1 2.95Å
31	I	86.9	Confident	67.6	Low	44 Å²	44	107 Å²	107	23%	0.226	53%	0.531	C	S	.	.	S	Bend	trans	-73	-39.3	177.9	-60.4	171.5	0	0	0	109.8	N39 V40 F218 I231 E279	I31-N39 PolarHBondContact O-N 2.99Å; I31-V40 HydrophobicContact CG2-CG2 3.8Å; I31-F218 HydrophobicContact CD1-CB 4.09Å; I31-F218 HydrophobicContact CD1-CD2 3.79Å; I31-F218 HydrophobicContact CD1-CE2 4.46Å; I31-F218 HydrophobicContact CD1-CG 4.07Å; I31-I231 HydrophobicContact CD1-CD1 3.56Å; I31-I231 HydrophobicContact CD1-CG1 4.41Å; I31-I231 HydrophobicContact CD1-CG2 4.09Å; I31-I231 HydrophobicContact CG1-CD1 4.37Å; I31-E279 WeakPolarHBondContact CB-OE2 3.4Å; I31-E279 PolarHBondContact N-OE1 3.29Å; I31-E279 PolarHBondContact N-OE2 3.2Å
32	V	90.4	Very high	69.8	Low	6 Å²	6	105.9 Å²	105.9	4%	0.036	53%	0.526	C	S	.	.	B	Isolated β-bridge	trans	-121.8	135.6	177.4	-175.6	0	0	0	0	108.5	R30 H37 E279 L281 S300	R30-V32 VanDerWaalsContact CD-O 3.31Å; R30-V32 WeakPolarHBondContact CD-O 3.14Å; R30-V32 WeakPolarHBondContact CG-O 3.3Å; V32-H37 WeakPolarHBondContact CA-O 3.46Å; V32-E279 PolarHBondContact N-OE1 3.34Å; V32-L281 HydrophobicContact CB-CD1 4.04Å; V32-L281 HydrophobicContact CG1-CD1 3.93Å; V32-L281 HydrophobicContact CG2-CD1 3.87Å; V32-S300 WeakPolarHBondContact O-CB 3.3Å; V32-S300 PolarHBondContact O-OG 3.32Å
33	S	90.1	Very high	71.8	Confident	18 Å²	18	104.4 Å²	104.4	13%	0.126	52%	0.519	C	S	.	.			trans	-75	164.5	173.3	59	0	0	0	0	111.6	D35 G36 H37	S33-D35 PolarHBondContact O-N 3.22Å; S33-G36 PolarHBondContact O-N 3.22Å; S33-H37 PolarHBondContact N-O 3.41Å; S33-H37 WeakPolarHBondContact OG-CA 3.31Å; S33-H37 VanDerWaalsContact OG-CB 3.3Å; S33-H37 WeakPolarHBondContact OG-CB 3.43Å; S33-H37 PolarHBondContact OG-N 3.23Å; S33-H37 PolarHBondContact OG-O 3.32Å
34	K	89.9	Confident	73.4	Confident	35 Å²	35	103.1 Å²	103.1	15%	0.152	52%	0.517	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-30.8	173.3	-79.2	-72.7	177.7	-174.5	0	113.2	G36 Q183 T299 S300 E305	K34-G36 PolarHBondContact O-N 2.98Å; K34-Q183 PolarHBondContact NZ-O 3.08Å; K34-T299 PolarHBondContact O-OG1 2.88Å; K34-T299 VanDerWaalsContact O-OG1 3.1Å; K34-S300 WeakPolarHBondContact CD-O 3.49Å; K34-S300 WeakPolarHBondContact CE-O 3.07Å; K34-S300 PolarHBondContact NZ-O 3.16Å; K34-E305 WeakPolarHBondContact CE-OE1 3.27Å; K34-E305 WeakPolarHBondContact CE-OE2 3.44Å; K34-E305 VanDerWaalsContact NZ-CD 3.26Å; K34-E305 IonicContact NZ-OE1 3.07Å; K34-E305 IonicContact NZ-OE2 2.75Å; K34-E305 PolarHBondContact NZ-OE2 2.78Å
35	D	85.8	Confident	75.2	Confident	138 Å²	138	97.2 Å²	97.2	74%	0.738	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	2.3	177.9	-54.5	-45.8	0	0	0	113	S33 H37	S33-D35 PolarHBondContact O-N 3.22Å; D35-H37 PolarHBondContact O-N 2.91Å
36	G	85.1	Confident	76.5	Confident	7 Å²	7	101.9 Å²	101.9	7%	0.072	51%	0.509	C	S	.	.	S	Bend	trans	82.1	7.3	175.9	0	0	0	0	0	115.4	S33 K34 R298	S33-G36 PolarHBondContact O-N 3.22Å; K34-G36 PolarHBondContact O-N 2.98Å; G36-R298 WeakPolarHBondContact CA-O 3.3Å; G36-R298 PolarHBondContact N-O 3.13Å; G36-R298 PolarHBondContact O-NH2 2.93Å
37	H	85.5	Confident	77.5	Confident	116 Å²	116	95.1 Å²	95.1	54%	0.537	49%	0.49	S	S	.	.			trans	-74	139.5	169.9	-66.8	-68.7	0	0	0	111.2	V32 S33 D35	V32-H37 WeakPolarHBondContact CA-O 3.46Å; S33-H37 PolarHBondContact N-O 3.41Å; S33-H37 WeakPolarHBondContact OG-CA 3.31Å; S33-H37 VanDerWaalsContact OG-CB 3.3Å; S33-H37 WeakPolarHBondContact OG-CB 3.43Å; S33-H37 PolarHBondContact OG-N 3.23Å; S33-H37 PolarHBondContact OG-O 3.32Å; D35-H37 PolarHBondContact O-N 2.91Å
38	N	85.3	Confident	78.1	Confident	100 Å²	100	92 Å²	92	54%	0.535	47%	0.468	S	S	.	.	B	Isolated β-bridge	trans	-80.7	128.8	176.4	-58.7	-9.7	0	0	0	109.6	V40 R298	N38-V40 VanDerWaalsContact C-N 3.32Å; N38-R298 PolarHBondContact OD1-NH2 3.35Å
39	N	83	Confident	78.5	Confident	95 Å²	95	94.9 Å²	94.9	51%	0.508	49%	0.488	S	S	.	.			trans	-97.6	27.1	177.2	-71.8	-14.5	0	0	0	112.4	R30 I31	R30-N39 VanDerWaalsContact O-CB 3.29Å; R30-N39 WeakPolarHBondContact O-CB 3.49Å; R30-N39 PolarHBondContact O-ND2 3.38Å; I31-N39 PolarHBondContact O-N 2.99Å
40	V	80.9	Confident	78.7	Confident	93 Å²	93	91.5 Å²	91.5	56%	0.564	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-103	120.6	179.6	-177.7	0	0	0	0	108.7	I31 N38	I31-V40 HydrophobicContact CG2-CG2 3.8Å; N38-V40 VanDerWaalsContact C-N 3.32Å
41	Q	75.1	Confident	78.3	Confident	170 Å²	170	94 Å²	94	79%	0.794	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-88.7	123.9	169.6	-173.4	172.4	2.9	0	0	108.6
42	I	75.2	Confident	77.9	Confident	130 Å²	130	98 Å²	98	67%	0.667	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-89.3	122.5	171.5	-59.5	173.6	0	0	0	106.4	V45	I42-V45 HydrophobicContact CG2-CG2 3.41Å; I42-V45 VanDerWaalsContact CG2-CG2 3.41Å
43	D	70.4	Confident	77.2	Confident	119 Å²	119	103.3 Å²	103.3	64%	0.636	54%	0.538	S	S	*	.			trans	-125.2	156.1	-180	-161.7	12.4	0	0	0	110.4	V45	D43-V45 PolarHBondContact O-N 2.83Å
44	N	65	Low	77	Confident	145 Å²	145	110.7 Å²	110.7	78%	0.775	57%	0.57	S	S	*	*			trans	52.8	45.9	177.1	-67	-33.4	0	0	0	116.3	E46	N44-E46 PolarHBondContact O-N 2.94Å
45	V	70.9	Confident	76.7	Confident	67 Å²	67	112.4 Å²	112.4	41%	0.406	58%	0.581	S	S	.	*			trans	-90.5	102	167.8	-176.8	0	0	0	0	108.8	I42 D43 G47 M48	I42-V45 HydrophobicContact CG2-CG2 3.41Å; I42-V45 VanDerWaalsContact CG2-CG2 3.41Å; D43-V45 PolarHBondContact O-N 2.83Å; V45-G47 PolarHBondContact O-N 2.83Å; V45-M48 HydrophobicContact CB-CG 3.39Å; V45-M48 HydrophobicContact CB-SD 3.9Å; V45-M48 HydrophobicContact CG1-CG 3.48Å; V45-M48 VanDerWaalsContact CG1-CG 3.48Å; V45-M48 HydrophobicContact CG1-SD 3.59Å; V45-M48 VanDerWaalsContact CG1-SD 3.59Å; V45-M48 HydrophobicContact CG2-CG 4.48Å; V45-M48 VanDerWaalsContact O-CG 3.29Å; V45-M48 WeakPolarHBondContact O-CG 3.26Å; V45-M48 PolarHBondContact O-N 3.07Å
46	E	67.3	Low	76.7	Confident	191 Å²	191	110.2 Å²	110.2	89%	0.893	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.4	133.5	174.3	-68.7	-173.7	173.5	0	0	110.5	N44 M48	N44-E46 PolarHBondContact O-N 2.94Å; E46-M48 PolarHBondContact O-N 2.85Å
47	G	65.4	Low	76.8	Confident	47 Å²	47	115.3 Å²	115.3	49%	0.485	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	77.9	12.9	176.4	0	0	0	0	0	116.2	V45 V49 K50 L51	V45-G47 PolarHBondContact O-N 2.83Å; G47-V49 VanDerWaalsContact C-N 3.26Å; G47-V49 PolarHBondContact O-N 3.18Å; G47-K50 WeakPolarHBondContact O-CA 3.39Å; G47-K50 WeakPolarHBondContact O-CB 3.4Å; G47-K50 PolarHBondContact O-N 3.08Å; G47-L51 PolarHBondContact O-N 3.16Å
48	M	68.8	Low	76.8	Confident	63 Å²	63	112 Å²	112	31%	0.31	57%	0.574	S	S	.	*	H	α-helix	trans	-50.5	-43.8	175.3	-82.4	-69.2	-93.8	0	0	113.6	V45 E46 K50 L51 Y52	V45-M48 HydrophobicContact CB-CG 3.39Å; V45-M48 HydrophobicContact CB-SD 3.9Å; V45-M48 HydrophobicContact CG1-CG 3.48Å; V45-M48 VanDerWaalsContact CG1-CG 3.48Å; V45-M48 HydrophobicContact CG1-SD 3.59Å; V45-M48 VanDerWaalsContact CG1-SD 3.59Å; V45-M48 HydrophobicContact CG2-CG 4.48Å; V45-M48 VanDerWaalsContact O-CG 3.29Å; V45-M48 WeakPolarHBondContact O-CG 3.26Å; V45-M48 PolarHBondContact O-N 3.07Å; E46-M48 PolarHBondContact O-N 2.85Å; M48-K50 VanDerWaalsContact C-N 3.27Å; M48-K50 PolarHBondContact O-N 2.75Å; M48-L51 PolarHBondContact O-N 3.07Å; M48-L51 HydrophobicContact SD-CD1 4.47Å; M48-Y52 HydrophobicContact CB-CD2 4.45Å; M48-Y52 HydrophobicContact CB-CE2 4.33Å; M48-Y52 HydrophobicContact CE-CE2 3.59Å; M48-Y52 WeakPolarHBondContact CE-OH 3.29Å; M48-Y52 WeakPolarHBondContact O-CD2 3.35Å; M48-Y52 PolarHBondContact O-N 3.06Å; M48-Y52 HydrophobicContact SD-CE2 4.2Å
49	V	72.1	Confident	76.9	Confident	107 Å²	107	109.2 Å²	109.2	65%	0.648	56%	0.56	S	S	*	*	H	α-helix	trans	-61.2	-39	178.6	-179	0	0	0	0	111	G47 Y52 L53	G47-V49 VanDerWaalsContact C-N 3.26Å; G47-V49 PolarHBondContact O-N 3.18Å; V49-Y52 PolarHBondContact O-N 3.29Å; V49-L53 HydrophobicContact CG1-CD1 3.9Å; V49-L53 HydrophobicContact CG1-CG 4.35Å; V49-L53 WeakPolarHBondContact O-CB 3.29Å; V49-L53 WeakPolarHBondContact O-CG 3.32Å; V49-L53 PolarHBondContact O-N 2.83Å
50	K	74.8	Confident	77.1	Confident	170 Å²	170	105.7 Å²	105.7	74%	0.739	54%	0.542	S	S	*	.	H	α-helix	trans	-67.5	-37.8	177.4	-170.4	179.5	179	-178.1	0	111.6	G47 M48 L53 H54	G47-K50 WeakPolarHBondContact O-CA 3.39Å; G47-K50 WeakPolarHBondContact O-CB 3.4Å; G47-K50 PolarHBondContact O-N 3.08Å; M48-K50 VanDerWaalsContact C-N 3.27Å; M48-K50 PolarHBondContact O-N 2.75Å; K50-L53 PolarHBondContact O-N 3.4Å; K50-H54 WeakPolarHBondContact O-CB 3.5Å; K50-H54 PolarHBondContact O-N 3.34Å
51	L	76.4	Confident	77.5	Confident	112 Å²	112	101.4 Å²	101.4	59%	0.586	52%	0.516	S	S	*	.	H	α-helix	trans	-64.8	-47.6	174.9	-72.3	164.1	0	0	0	111.6	G47 M48 L53 H54 D55	G47-L51 PolarHBondContact O-N 3.16Å; M48-L51 PolarHBondContact O-N 3.07Å; M48-L51 HydrophobicContact SD-CD1 4.47Å; L51-L53 VanDerWaalsContact C-N 3.33Å; L51-L53 PolarHBondContact O-N 3.29Å; L51-H54 PolarHBondContact O-N 2.95Å; L51-D55 PolarHBondContact O-N 3.06Å
52	Y	77.8	Confident	78	Confident	128 Å²	128	97.4 Å²	97.4	50%	0.502	50%	0.5	S	S	.	.	H	α-helix	trans	-63.5	-36.5	176.4	-74.3	-65.4	0	0	0	112.8	M48 V49 D55 T59	M48-Y52 HydrophobicContact CB-CD2 4.45Å; M48-Y52 HydrophobicContact CB-CE2 4.33Å; M48-Y52 HydrophobicContact CE-CE2 3.59Å; M48-Y52 WeakPolarHBondContact CE-OH 3.29Å; M48-Y52 WeakPolarHBondContact O-CD2 3.35Å; M48-Y52 PolarHBondContact O-N 3.06Å; M48-Y52 HydrophobicContact SD-CE2 4.2Å; V49-Y52 PolarHBondContact O-N 3.29Å; Y52-D55 CarbonylContact O-C 3.25Å; Y52-D55 VanDerWaalsContact O-C 3.25Å; Y52-D55 PolarHBondContact O-N 3.35Å; Y52-T59 HydrophobicContact CD1-CG2 4.47Å; Y52-T59 PolarHBondContact O-OG1 2.74Å
53	L	77.5	Confident	78.5	Confident	119 Å²	119	93.9 Å²	93.9	62%	0.623	48%	0.481	S	S	*	.	H	α-helix	trans	-74.1	-25.6	176.5	-71.8	174.3	0	0	0	113.4	V49 K50 L51 D55 I56	V49-L53 HydrophobicContact CG1-CD1 3.9Å; V49-L53 HydrophobicContact CG1-CG 4.35Å; V49-L53 WeakPolarHBondContact O-CB 3.29Å; V49-L53 WeakPolarHBondContact O-CG 3.32Å; V49-L53 PolarHBondContact O-N 2.83Å; K50-L53 PolarHBondContact O-N 3.4Å; L51-L53 VanDerWaalsContact C-N 3.33Å; L51-L53 PolarHBondContact O-N 3.29Å; L53-D55 VanDerWaalsContact C-N 3.33Å; L53-I56 WeakPolarHBondContact O-CG1 3.4Å
54	H	83.9	Confident	79.4	Confident	173 Å²	173	95.5 Å²	95.5	80%	0.801	48%	0.483	S	S	*	.	H	α-helix	trans	-75.2	-28.6	173.4	-167.9	-81.6	0	0	0	111.4	K50 L51	K50-H54 WeakPolarHBondContact O-CB 3.5Å; K50-H54 PolarHBondContact O-N 3.34Å; L51-H54 PolarHBondContact O-N 2.95Å
55	D	85.4	Confident	80.6	Confident	70 Å²	70	93.5 Å²	93.5	37%	0.374	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.7	63.3	176.2	-165.1	-1.3	0	0	0	111.8	L51 Y52 L53 W57 T58 T59	L51-D55 PolarHBondContact O-N 3.06Å; Y52-D55 CarbonylContact O-C 3.25Å; Y52-D55 VanDerWaalsContact O-C 3.25Å; Y52-D55 PolarHBondContact O-N 3.35Å; L53-D55 VanDerWaalsContact C-N 3.33Å; D55-W57 PolarHBondContact O-N 2.95Å; D55-T58 PolarHBondContact O-N 3.25Å; D55-T58 PolarHBondContact O-OG1 2.88Å; D55-T58 VanDerWaalsContact OD1-CG2 3.31Å; D55-T58 WeakPolarHBondContact OD1-CG2 3.26Å; D55-T58 PolarHBondContact OD1-N 3.11Å; D55-T58 PolarHBondContact OD1-OG1 3.3Å; D55-T58 VanDerWaalsContact OD1-OG1 3.1Å; D55-T58 WeakPolarHBondContact OD2-CB 3.45Å; D55-T58 WeakPolarHBondContact OD2-CG2 2.98Å; D55-T58 PolarHBondContact OD2-OG1 3.17Å; D55-T59 WeakPolarHBondContact O-CB 2.99Å; D55-T59 PolarHBondContact O-N 2.77Å; D55-T59 VanDerWaalsContact O-N 3.1Å; D55-T59 PolarHBondContact O-OG1 3.09Å
56	I	84.8	Confident	81.5	Confident	92 Å²	92	100.6 Å²	100.6	47%	0.472	48%	0.484	S	S	.	.	H	α-helix	trans	-59.5	-39.3	-179.2	-56.8	-176.3	0	0	0	110.6	L53 T59 V60	L53-I56 WeakPolarHBondContact O-CG1 3.4Å; I56-T59 PolarHBondContact O-N 3.41Å; I56-V60 HydrophobicContact CG2-CG2 4.05Å; I56-V60 WeakPolarHBondContact O-CB 3.28Å; I56-V60 VanDerWaalsContact O-CG2 3.27Å; I56-V60 WeakPolarHBondContact O-CG2 3.47Å; I56-V60 PolarHBondContact O-N 3Å
57	W	86.8	Confident	82.6	Confident	114 Å²	114	98.3 Å²	98.3	43%	0.432	47%	0.468	S	S	.	.	H	α-helix	trans	-60.7	-56.6	-179	172.5	-104.8	0	0	0	111.1	D55 T59 V60 V61 F160 A164 A167	D55-W57 PolarHBondContact O-N 2.95Å; W57-T59 VanDerWaalsContact C-N 3.27Å; W57-T59 PolarHBondContact O-N 2.91Å; W57-V60 PolarHBondContact O-N 3.44Å; W57-V61 HydrophobicContact CD2-CG2 4Å; W57-V61 HydrophobicContact CE3-CG2 4.41Å; W57-V61 HydrophobicContact CG-CG2 4.48Å; W57-V61 HydrophobicContact CH2-CG2 4.37Å; W57-V61 HydrophobicContact CZ2-CG2 3.92Å; W57-V61 VanDerWaalsContact O-CG2 3.25Å; W57-V61 WeakPolarHBondContact O-CG2 3.22Å; W57-V61 PolarHBondContact O-N 2.87Å; W57-F160 HydrophobicContact CE3-CD2 4.37Å; W57-F160 AromaticContact CE3-CE2 3.72Å; W57-F160 HydrophobicContact CE3-CE2 3.72Å; W57-F160 HydrophobicContact CE3-CZ 4.06Å; W57-F160 HydrophobicContact CZ3-CD2 4.46Å; W57-F160 HydrophobicContact CZ3-CE2 4.23Å; W57-A164 HydrophobicContact CE3-CB 4.43Å; W57-A164 HydrophobicContact CH2-CB 4.31Å; W57-A164 HydrophobicContact CZ3-CB 3.84Å; W57-A167 HydrophobicContact CH2-CB 4.15Å; W57-A167 HydrophobicContact CZ2-CB 3.86Å
58	T	86.1	Confident	83.8	Confident	48 Å²	48	96.5 Å²	96.5	29%	0.294	45%	0.447	S	S	.	.	H	α-helix	trans	-63	-38.9	-178.9	65.6	0	0	0	0	111.1	D55 V60 V61 D62	D55-T58 PolarHBondContact O-N 3.25Å; D55-T58 PolarHBondContact O-OG1 2.88Å; D55-T58 VanDerWaalsContact OD1-CG2 3.31Å; D55-T58 WeakPolarHBondContact OD1-CG2 3.26Å; D55-T58 PolarHBondContact OD1-N 3.11Å; D55-T58 PolarHBondContact OD1-OG1 3.3Å; D55-T58 VanDerWaalsContact OD1-OG1 3.1Å; D55-T58 WeakPolarHBondContact OD2-CB 3.45Å; D55-T58 WeakPolarHBondContact OD2-CG2 2.98Å; D55-T58 PolarHBondContact OD2-OG1 3.17Å; T58-V60 PolarHBondContact O-N 2.78Å; T58-V61 PolarHBondContact O-N 2.74Å; T58-D62 WeakPolarHBondContact O-CB 3.48Å; T58-D62 PolarHBondContact O-N 3.43Å
59	T	87.8	Confident	84.8	Confident	41 Å²	41	98 Å²	98	25%	0.252	46%	0.456	S	S	.	.	H	α-helix	trans	-55.7	-52.7	176.2	-59.7	0	0	0	0	111.4	Y52 D55 I56 W57 V61 D62 M63	Y52-T59 HydrophobicContact CD1-CG2 4.47Å; Y52-T59 PolarHBondContact O-OG1 2.74Å; D55-T59 WeakPolarHBondContact O-CB 2.99Å; D55-T59 PolarHBondContact O-N 2.77Å; D55-T59 VanDerWaalsContact O-N 3.1Å; D55-T59 PolarHBondContact O-OG1 3.09Å; I56-T59 PolarHBondContact O-N 3.41Å; W57-T59 VanDerWaalsContact C-N 3.27Å; W57-T59 PolarHBondContact O-N 2.91Å; T59-V61 VanDerWaalsContact C-N 3.33Å; T59-V61 PolarHBondContact O-N 3.31Å; T59-D62 PolarHBondContact O-N 2.88Å; T59-M63 VanDerWaalsContact O-CG 3.31Å; T59-M63 WeakPolarHBondContact O-CG 3.47Å; T59-M63 PolarHBondContact O-N 3.03Å
60	V	87.2	Confident	85.7	Confident	20 Å²	20	97.4 Å²	97.4	12%	0.121	45%	0.452	C	S	.	.	H	α-helix	trans	-64.9	-36.5	178.5	175.4	0	0	0	0	111.5	I56 W57 T58 K68 L71 A164	I56-V60 HydrophobicContact CG2-CG2 4.05Å; I56-V60 WeakPolarHBondContact O-CB 3.28Å; I56-V60 VanDerWaalsContact O-CG2 3.27Å; I56-V60 WeakPolarHBondContact O-CG2 3.47Å; I56-V60 PolarHBondContact O-N 3Å; W57-V60 PolarHBondContact O-N 3.44Å; T58-V60 PolarHBondContact O-N 2.78Å; V60-K68 WeakPolarHBondContact O-CE 3.25Å; V60-K68 PolarHBondContact O-NZ 3.17Å; V60-L71 HydrophobicContact CG1-CD2 4.21Å; V60-L71 HydrophobicContact CG2-CD2 4.44Å; V60-A164 HydrophobicContact CG1-CB 3.81Å
61	V	88.1	Confident	86.4	Confident	3 Å²	3	92.7 Å²	92.7	2%	0.018	44%	0.435	C	S	.	.	H	α-helix	trans	-66.2	-39.4	175.7	-175.8	0	0	0	0	111.2	W57 T58 T59 K68 A164 A167 K168	W57-V61 HydrophobicContact CD2-CG2 4Å; W57-V61 HydrophobicContact CE3-CG2 4.41Å; W57-V61 HydrophobicContact CG-CG2 4.48Å; W57-V61 HydrophobicContact CH2-CG2 4.37Å; W57-V61 HydrophobicContact CZ2-CG2 3.92Å; W57-V61 VanDerWaalsContact O-CG2 3.25Å; W57-V61 WeakPolarHBondContact O-CG2 3.22Å; W57-V61 PolarHBondContact O-N 2.87Å; T58-V61 PolarHBondContact O-N 2.74Å; T59-V61 VanDerWaalsContact C-N 3.33Å; T59-V61 PolarHBondContact O-N 3.31Å; V61-K68 PolarHBondContact O-NZ 2.74Å; V61-A164 HydrophobicContact CG2-CB 4.37Å; V61-A167 HydrophobicContact CG1-CB 4.25Å; V61-A167 HydrophobicContact CG2-CB 4.21Å; V61-K168 HydrophobicContact CG1-CB 4.2Å; V61-K168 WeakPolarHBondContact O-CD 3.37Å; V61-K168 WeakPolarHBondContact O-CG 3.48Å; V61-K168 PolarHBondContact O-NZ 3.43Å
62	D	86.2	Confident	87	Confident	87 Å²	87	90.6 Å²	90.6	47%	0.465	42%	0.421	S	S	.	.	H	α-helix	trans	-82.7	-20.5	-175.1	-82.8	-50.5	0	0	0	115.3	T58 T59 K168 R171	T58-D62 WeakPolarHBondContact O-CB 3.48Å; T58-D62 PolarHBondContact O-N 3.43Å; T59-D62 PolarHBondContact O-N 2.88Å; D62-K168 PolarHBondContact O-NZ 3.49Å; D62-K168 VanDerWaalsContact O-NZ 3.16Å; D62-R171 VanDerWaalsContact CG-NH2 3.31Å; D62-R171 IonicContact OD1-CZ 3.98Å; D62-R171 IonicContact OD1-NH1 2.74Å; D62-R171 PolarHBondContact OD1-NH1 2.89Å; D62-R171 IonicContact OD1-NH2 3.69Å; D62-R171 PolarHBondContact OD1-NH2 3.13Å; D62-R171 IonicContact OD2-CZ 3.76Å; D62-R171 IonicContact OD2-NH1 2.77Å; D62-R171 PolarHBondContact OD2-NH1 3.42Å; D62-R171 IonicContact OD2-NH2 3.19Å; D62-R171 PolarHBondContact OD2-NH2 3.39Å
63	M	87	Confident	87.6	Confident	56 Å²	56	87 Å²	87	28%	0.276	42%	0.418	S	S	.	.	S	Bend	trans	-46.7	140.6	173.3	-81.2	172.1	77	0	0	113.3	T59 Y67 L71 K168	T59-M63 VanDerWaalsContact O-CG 3.31Å; T59-M63 WeakPolarHBondContact O-CG 3.47Å; T59-M63 PolarHBondContact O-N 3.03Å; M63-Y67 VanDerWaalsContact CE-CB 3.49Å; M63-L71 HydrophobicContact CE-CD2 4.34Å; M63-L71 HydrophobicContact SD-CD2 4.32Å; M63-K168 WeakPolarHBondContact O-CE 3.32Å; M63-K168 PolarHBondContact O-NZ 2.74Å
64	K	89.1	Confident	88.3	Confident	153 Å²	153	84.2 Å²	84.2	67%	0.665	41%	0.409	S	S	*	.			trans	-59.5	151.1	176.4	-59.5	-178.3	-177.9	172.5	0	110.5	R66 Y67 K68	K64-R66 VanDerWaalsContact C-N 3.26Å; K64-R66 PolarHBondContact O-N 3.31Å; K64-Y67 HydrophobicContact CB-CD2 3.87Å; K64-Y67 HydrophobicContact CB-CE2 4.29Å; K64-Y67 HydrophobicContact CD-CE2 4.12Å; K64-Y67 HydrophobicContact CG-CD2 4.39Å; K64-Y67 HydrophobicContact CG-CE2 4.46Å; K64-Y67 PolarHBondContact O-N 2.98Å; K64-Y67 VanDerWaalsContact O-N 3.11Å; K64-K68 PolarHBondContact O-N 2.99Å
65	W	89.1	Confident	88.5	Confident	102 Å²	102	78.1 Å²	78.1	39%	0.386	38%	0.384	S	S	.	.	H	α-helix	trans	-51.5	-41.5	-178.8	-81.4	115.3	0	0	0	113.9	Y67 K68 L69 F165 K168 L169	W65-Y67 PolarHBondContact O-N 2.79Å; W65-K68 HydrophobicContact CE3-CD 4.38Å; W65-K68 HydrophobicContact CZ3-CD 4.13Å; W65-K68 PolarHBondContact O-N 2.86Å; W65-L69 WeakPolarHBondContact O-CB 3.21Å; W65-L69 WeakPolarHBondContact O-CG 3.24Å; W65-L69 PolarHBondContact O-N 2.61Å; W65-F165 HydrophobicContact CE3-CE2 4.35Å; W65-F165 HydrophobicContact CH2-CE2 4.29Å; W65-F165 HydrophobicContact CH2-CZ 4.23Å; W65-F165 AromaticContact CZ3-CD2 3.92Å; W65-F165 HydrophobicContact CZ3-CD2 3.92Å; W65-F165 HydrophobicContact CZ3-CE1 4.43Å; W65-F165 AromaticContact CZ3-CE2 3.47Å; W65-F165 HydrophobicContact CZ3-CE2 3.47Å; W65-F165 VanDerWaalsContact CZ3-CE2 3.47Å; W65-F165 AromaticContact CZ3-CZ 3.74Å; W65-F165 HydrophobicContact CZ3-CZ 3.74Å; W65-K168 HydrophobicContact CD2-CD 4.24Å; W65-K168 HydrophobicContact CE3-CD 4.49Å; W65-K168 HydrophobicContact CH2-CB 4.49Å; W65-K168 HydrophobicContact CH2-CD 4.18Å; W65-K168 HydrophobicContact CH2-CG 4.42Å; W65-K168 HydrophobicContact CZ2-CD 3.93Å; W65-K168 HydrophobicContact CZ2-CG 4.09Å; W65-K168 HydrophobicContact CZ3-CD 4.45Å; W65-L169 HydrophobicContact CH2-CD2 3.5Å; W65-L169 HydrophobicContact CH2-CG 3.81Å; W65-L169 HydrophobicContact CZ2-CD2 3.66Å; W65-L169 HydrophobicContact CZ2-CG 4.31Å
66	R	90.9	Very high	88.8	Confident	217 Å²	217	76.5 Å²	76.5	82%	0.819	37%	0.373	S	S	*	.	H	α-helix	trans	-56.9	-53.2	178	-64.5	-176.9	-177.2	174.2	-0.2	111.4	K64 K68 L69 T70	K64-R66 VanDerWaalsContact C-N 3.26Å; K64-R66 PolarHBondContact O-N 3.31Å; R66-K68 VanDerWaalsContact C-N 3.34Å; R66-K68 PolarHBondContact O-N 3.45Å; R66-L69 PolarHBondContact O-N 2.84Å; R66-T70 PolarHBondContact O-N 2.87Å; R66-T70 PolarHBondContact O-OG1 3.25Å
67	Y	90.2	Very high	89.2	Confident	142 Å²	142	75.6 Å²	75.6	56%	0.557	37%	0.372	S	S	*	.	H	α-helix	trans	-67.5	-33.5	178.9	-54.9	-63	0	0	0	112.9	M63 K64 W65 T70 L71	M63-Y67 VanDerWaalsContact CE-CB 3.49Å; K64-Y67 HydrophobicContact CB-CD2 3.87Å; K64-Y67 HydrophobicContact CB-CE2 4.29Å; K64-Y67 HydrophobicContact CD-CE2 4.12Å; K64-Y67 HydrophobicContact CG-CD2 4.39Å; K64-Y67 HydrophobicContact CG-CE2 4.46Å; K64-Y67 PolarHBondContact O-N 2.98Å; K64-Y67 VanDerWaalsContact O-N 3.11Å; W65-Y67 PolarHBondContact O-N 2.79Å; Y67-T70 PolarHBondContact O-N 3.44Å; Y67-L71 WeakPolarHBondContact O-CB 3.21Å; Y67-L71 PolarHBondContact O-N 3.13Å
68	K	89.2	Confident	89.6	Confident	10 Å²	10	74.8 Å²	74.8	4%	0.043	37%	0.374	C	S	.	.	H	α-helix	trans	-64.7	-44.9	175.7	179	165.8	-66.2	-154	0	112.3	V60 V61 K64 W65 R66 L71 F72 A164 F165 K168	V60-K68 WeakPolarHBondContact O-CE 3.25Å; V60-K68 PolarHBondContact O-NZ 3.17Å; V61-K68 PolarHBondContact O-NZ 2.74Å; K64-K68 PolarHBondContact O-N 2.99Å; W65-K68 HydrophobicContact CE3-CD 4.38Å; W65-K68 HydrophobicContact CZ3-CD 4.13Å; W65-K68 PolarHBondContact O-N 2.86Å; R66-K68 VanDerWaalsContact C-N 3.34Å; R66-K68 PolarHBondContact O-N 3.45Å; K68-L71 PolarHBondContact O-N 2.74Å; K68-F72 WeakPolarHBondContact O-CB 3.48Å; K68-F72 PolarHBondContact O-N 2.84Å; K68-A164 PolarHBondContact NZ-O 3.43Å; K68-F165 HydrophobicContact CD-CD2 4.15Å; K68-F165 HydrophobicContact CG-CD2 4.41Å; K68-K168 HydrophobicContact CD-CD 3.97Å
69	L	90.9	Very high	90	Very high	94 Å²	94	73.7 Å²	73.7	49%	0.492	37%	0.368	S	S	.	.	H	α-helix	trans	-66.4	-41	176.9	-70.9	171.1	0	0	0	111.4	W65 R66 F72 A73 F165	W65-L69 WeakPolarHBondContact O-CB 3.21Å; W65-L69 WeakPolarHBondContact O-CG 3.24Å; W65-L69 PolarHBondContact O-N 2.61Å; R66-L69 PolarHBondContact O-N 2.84Å; L69-F72 PolarHBondContact O-N 2.87Å; L69-A73 WeakPolarHBondContact O-CB 3.34Å; L69-A73 PolarHBondContact O-N 2.78Å; L69-F165 HydrophobicContact CD2-CE2 4.03Å
70	T	91	Very high	90.4	Very high	95 Å²	95	74 Å²	74	58%	0.583	36%	0.364	S	S	*	.	H	α-helix	trans	-63	-44.8	174	-55.9	0	0	0	0	111.6	R66 Y67 A73 S74	R66-T70 PolarHBondContact O-N 2.87Å; R66-T70 PolarHBondContact O-OG1 3.25Å; Y67-T70 PolarHBondContact O-N 3.44Å; T70-A73 PolarHBondContact O-N 2.71Å; T70-S74 WeakPolarHBondContact O-CB 2.86Å; T70-S74 PolarHBondContact O-N 3.12Å
71	L	88.4	Confident	90.9	Very high	70 Å²	70	77.5 Å²	77.5	37%	0.366	38%	0.378	S	S	.	.	H	α-helix	trans	-60.4	-45.8	176.1	-178.9	68.3	0	0	0	111	V60 M63 Y67 K68 S74 T75	V60-L71 HydrophobicContact CG1-CD2 4.21Å; V60-L71 HydrophobicContact CG2-CD2 4.44Å; M63-L71 HydrophobicContact CE-CD2 4.34Å; M63-L71 HydrophobicContact SD-CD2 4.32Å; Y67-L71 WeakPolarHBondContact O-CB 3.21Å; Y67-L71 PolarHBondContact O-N 3.13Å; K68-L71 PolarHBondContact O-N 2.74Å; L71-S74 PolarHBondContact O-N 3.24Å; L71-T75 PolarHBondContact O-N 3.36Å; L71-T75 PolarHBondContact O-OG1 2.92Å
72	F	88.9	Confident	91.4	Very high	68 Å²	68	81 Å²	81	30%	0.298	40%	0.395	S	S	.	.	H	α-helix	trans	-54.9	-59.9	175.6	-175.7	-86.4	0	0	0	110.7	K68 L69 S74 T75 F76 V161	K68-F72 WeakPolarHBondContact O-CB 3.48Å; K68-F72 PolarHBondContact O-N 2.84Å; L69-F72 PolarHBondContact O-N 2.87Å; F72-S74 VanDerWaalsContact C-N 3.31Å; F72-S74 PolarHBondContact O-N 3.27Å; F72-T75 PolarHBondContact O-N 2.9Å; F72-F76 AromaticContact CD1-CD2 3.94Å; F72-F76 HydrophobicContact CD1-CD2 3.94Å; F72-F76 AromaticContact CD1-CE2 3.84Å; F72-F76 HydrophobicContact CD1-CE2 3.84Å; F72-F76 HydrophobicContact CD2-CE2 4.12Å; F72-F76 AromaticContact CE1-CD2 3.75Å; F72-F76 HydrophobicContact CE1-CD2 3.75Å; F72-F76 AromaticContact CE1-CE2 3.35Å; F72-F76 HydrophobicContact CE1-CE2 3.35Å; F72-F76 HydrophobicContact CE1-CZ 4.24Å; F72-F76 AromaticContact CE2-CE2 3.63Å; F72-F76 HydrophobicContact CE2-CE2 3.63Å; F72-F76 HydrophobicContact CE2-CZ 4.31Å; F72-F76 HydrophobicContact CG-CD2 4.47Å; F72-F76 HydrophobicContact CG-CE2 4.19Å; F72-F76 HydrophobicContact CZ-CD2 4.1Å; F72-F76 AromaticContact CZ-CE2 3.22Å; F72-F76 HydrophobicContact CZ-CE2 3.22Å; F72-F76 AromaticContact CZ-CZ 3.82Å; F72-F76 HydrophobicContact CZ-CZ 3.82Å; F72-F76 VanDerWaalsContact O-CD2 3.26Å; F72-F76 WeakPolarHBondContact O-CD2 3.42Å; F72-F76 PolarHBondContact O-N 3.4Å; F72-V161 HydrophobicContact CB-CG1 4.42Å; F72-V161 HydrophobicContact CD2-CG1 3.18Å; F72-V161 HydrophobicContact CE2-CG1 3.68Å; F72-V161 HydrophobicContact CG-CG1 4.14Å
73	A	91.3	Very high	91.9	Very high	53 Å²	53	77.6 Å²	77.6	44%	0.438	38%	0.377	S	S	.	.	H	α-helix	trans	-59.7	-40.7	-178.2	0	0	0	0	0	112.5	L69 T70 T75 F76 V77	L69-A73 WeakPolarHBondContact O-CB 3.34Å; L69-A73 PolarHBondContact O-N 2.78Å; T70-A73 PolarHBondContact O-N 2.71Å; A73-T75 PolarHBondContact O-N 2.99Å; A73-F76 PolarHBondContact O-N 3.37Å; A73-V77 WeakPolarHBondContact O-CG2 3.3Å; A73-V77 PolarHBondContact O-N 2.96Å; A73-V77 VanDerWaalsContact O-N 3.12Å
74	S	91.3	Very high	92.4	Very high	61 Å²	61	75 Å²	75	43%	0.427	36%	0.364	S	S	.	.	H	α-helix	trans	-62.5	-41.7	178.1	-171.6	0	0	0	0	112	T70 L71 F72 F76 V77 M78	T70-S74 WeakPolarHBondContact O-CB 2.86Å; T70-S74 PolarHBondContact O-N 3.12Å; L71-S74 PolarHBondContact O-N 3.24Å; F72-S74 VanDerWaalsContact C-N 3.31Å; F72-S74 PolarHBondContact O-N 3.27Å; S74-F76 VanDerWaalsContact C-N 3.35Å; S74-F76 PolarHBondContact O-N 2.89Å; S74-V77 PolarHBondContact O-N 2.95Å; S74-M78 VanDerWaalsContact O-CB 3.25Å; S74-M78 WeakPolarHBondContact O-CB 3.11Å; S74-M78 WeakPolarHBondContact O-CG 3.04Å; S74-M78 PolarHBondContact O-N 2.99Å
75	T	90	Very high	92.8	Very high	45 Å²	45	69.2 Å²	69.2	28%	0.276	34%	0.341	S	S	.	.	H	α-helix	trans	-62	-41.9	179.5	-60.2	0	0	0	0	111.6	L71 F72 A73 T79	L71-T75 PolarHBondContact O-N 3.36Å; L71-T75 PolarHBondContact O-OG1 2.92Å; F72-T75 PolarHBondContact O-N 2.9Å; A73-T75 PolarHBondContact O-N 2.99Å; T75-T79 WeakPolarHBondContact O-CB 3.35Å; T75-T79 WeakPolarHBondContact O-CG2 3.44Å; T75-T79 PolarHBondContact O-N 2.94Å; T75-T79 PolarHBondContact O-OG1 3.09Å
76	F	90.9	Very high	93.2	Very high	35 Å²	35	69.3 Å²	69.3	15%	0.154	35%	0.345	C	S	.	.	H	α-helix	trans	-63.9	-53	176.4	-78	-82.1	0	0	0	112	F72 A73 S74 M78 T79 W80 E158	F72-F76 AromaticContact CD1-CD2 3.94Å; F72-F76 HydrophobicContact CD1-CD2 3.94Å; F72-F76 AromaticContact CD1-CE2 3.84Å; F72-F76 HydrophobicContact CD1-CE2 3.84Å; F72-F76 HydrophobicContact CD2-CE2 4.12Å; F72-F76 AromaticContact CE1-CD2 3.75Å; F72-F76 HydrophobicContact CE1-CD2 3.75Å; F72-F76 AromaticContact CE1-CE2 3.35Å; F72-F76 HydrophobicContact CE1-CE2 3.35Å; F72-F76 HydrophobicContact CE1-CZ 4.24Å; F72-F76 AromaticContact CE2-CE2 3.63Å; F72-F76 HydrophobicContact CE2-CE2 3.63Å; F72-F76 HydrophobicContact CE2-CZ 4.31Å; F72-F76 HydrophobicContact CG-CD2 4.47Å; F72-F76 HydrophobicContact CG-CE2 4.19Å; F72-F76 HydrophobicContact CZ-CD2 4.1Å; F72-F76 AromaticContact CZ-CE2 3.22Å; F72-F76 HydrophobicContact CZ-CE2 3.22Å; F72-F76 AromaticContact CZ-CZ 3.82Å; F72-F76 HydrophobicContact CZ-CZ 3.82Å; F72-F76 VanDerWaalsContact O-CD2 3.26Å; F72-F76 WeakPolarHBondContact O-CD2 3.42Å; F72-F76 PolarHBondContact O-N 3.4Å; A73-F76 PolarHBondContact O-N 3.37Å; S74-F76 VanDerWaalsContact C-N 3.35Å; S74-F76 PolarHBondContact O-N 2.89Å; F76-M78 VanDerWaalsContact C-N 3.31Å; F76-M78 PolarHBondContact O-N 2.91Å; F76-T79 PolarHBondContact O-N 3.44Å; F76-T79 PolarHBondContact O-OG1 3.03Å; F76-W80 HydrophobicContact CB-CH2 4.12Å; F76-W80 HydrophobicContact CB-CZ2 3.81Å; F76-W80 AromaticContact CD1-CZ2 3.92Å; F76-W80 HydrophobicContact CD1-CZ2 3.92Å; F76-W80 HydrophobicContact CG-CZ2 4.24Å; F76-W80 VanDerWaalsContact O-CD2 3.28Å; F76-W80 PolarHBondContact O-N 3.07Å; F76-E158 HydrophobicContact CE1-CG 3.78Å; F76-E158 WeakPolarHBondContact CE1-OE1 3.33Å; F76-E158 HydrophobicContact CZ-CG 3.77Å
77	V	94	Very high	93.5	Very high	74 Å²	74	59.2 Å²	59.2	45%	0.448	31%	0.307	S	S	.	.	H	α-helix	trans	-61.2	-40.8	-178.6	175.8	0	0	0	0	111.7	A73 S74 W80 F81	A73-V77 WeakPolarHBondContact O-CG2 3.3Å; A73-V77 PolarHBondContact O-N 2.96Å; A73-V77 VanDerWaalsContact O-N 3.12Å; S74-V77 PolarHBondContact O-N 2.95Å; V77-W80 HydrophobicContact CG2-CE3 4.34Å; V77-W80 HydrophobicContact CG2-CZ3 4.22Å; V77-F81 WeakPolarHBondContact O-CB 3.22Å; V77-F81 PolarHBondContact O-N 3.12Å
78	M	94.3	Very high	93.8	Very high	96 Å²	96	54.5 Å²	54.5	47%	0.473	29%	0.289	S	S	.	.	H	α-helix	trans	-67.9	-39.9	179	-69.7	-58.5	-64.8	0	0	112.3	S74 F76 F81 I82	S74-M78 VanDerWaalsContact O-CB 3.25Å; S74-M78 WeakPolarHBondContact O-CB 3.11Å; S74-M78 WeakPolarHBondContact O-CG 3.04Å; S74-M78 PolarHBondContact O-N 2.99Å; F76-M78 VanDerWaalsContact C-N 3.31Å; F76-M78 PolarHBondContact O-N 2.91Å; M78-F81 PolarHBondContact O-N 3.19Å; M78-I82 WeakPolarHBondContact O-CB 3.34Å; M78-I82 WeakPolarHBondContact O-CD1 3.31Å; M78-I82 WeakPolarHBondContact O-CG1 3.45Å; M78-I82 PolarHBondContact O-N 3.2Å
79	T	95	Very high	94.1	Very high	26 Å²	26	59.9 Å²	59.9	16%	0.16	31%	0.313	C	S	.	.	H	α-helix	trans	-67.4	-44.3	177.7	46.6	0	0	0	0	111.8	T75 F76 F81 I82 F83 Q126 T154	T75-T79 WeakPolarHBondContact O-CB 3.35Å; T75-T79 WeakPolarHBondContact O-CG2 3.44Å; T75-T79 PolarHBondContact O-N 2.94Å; T75-T79 PolarHBondContact O-OG1 3.09Å; F76-T79 PolarHBondContact O-N 3.44Å; F76-T79 PolarHBondContact O-OG1 3.03Å; T79-F81 VanDerWaalsContact C-N 3.27Å; T79-F81 PolarHBondContact O-N 2.94Å; T79-I82 PolarHBondContact O-N 2.87Å; T79-F83 WeakPolarHBondContact O-CD2 3.2Å; T79-F83 PolarHBondContact O-N 2.87Å; T79-Q126 PolarHBondContact OG1-NE2 3.28Å; T79-Q126 VanDerWaalsContact OG1-NE2 3.12Å; T79-Q126 PolarHBondContact OG1-OE1 3.39Å; T79-T154 HydrophobicContact CG2-CG2 4.19Å
80	W	96.3	Very high	94.3	Very high	46 Å²	46	56.4 Å²	56.4	17%	0.174	30%	0.295	C	S	.	.	H	α-helix	trans	-58	-40.7	172.7	-57.7	-23.3	0	0	0	112.2	F76 V77 G84 F119 S122 L123 Q126 T127	F76-W80 HydrophobicContact CB-CH2 4.12Å; F76-W80 HydrophobicContact CB-CZ2 3.81Å; F76-W80 AromaticContact CD1-CZ2 3.92Å; F76-W80 HydrophobicContact CD1-CZ2 3.92Å; F76-W80 HydrophobicContact CG-CZ2 4.24Å; F76-W80 VanDerWaalsContact O-CD2 3.28Å; F76-W80 PolarHBondContact O-N 3.07Å; V77-W80 HydrophobicContact CG2-CE3 4.34Å; V77-W80 HydrophobicContact CG2-CZ3 4.22Å; W80-G84 PolarHBondContact O-N 2.85Å; W80-F119 HydrophobicContact CB-CD2 4.11Å; W80-F119 HydrophobicContact CB-CE2 3.6Å; W80-F119 HydrophobicContact CB-CZ 4.32Å; W80-F119 HydrophobicContact CE3-CE2 4.39Å; W80-F119 HydrophobicContact CE3-CZ 4.07Å; W80-S122 WeakPolarHBondContact O-CB 3.5Å; W80-S122 PolarHBondContact O-OG 2.84Å; W80-L123 HydrophobicContact CB-CB 4.44Å; W80-L123 HydrophobicContact CD2-CB 4.19Å; W80-L123 HydrophobicContact CD2-CD1 4.07Å; W80-L123 HydrophobicContact CD2-CG 3.97Å; W80-L123 HydrophobicContact CE3-CD1 3.67Å; W80-L123 HydrophobicContact CE3-CG 4.1Å; W80-L123 HydrophobicContact CG-CB 4.12Å; W80-L123 HydrophobicContact CG-CG 4.42Å; W80-L123 HydrophobicContact CH2-CD1 4.25Å; W80-L123 HydrophobicContact CH2-CG 4.48Å; W80-L123 HydrophobicContact CZ2-CG 4.38Å; W80-L123 HydrophobicContact CZ3-CD1 3.76Å; W80-L123 HydrophobicContact CZ3-CG 4.35Å; W80-Q126 VanDerWaalsContact CD1-CD 3.45Å; W80-T127 HydrophobicContact CZ2-CG2 3.74Å
81	F	97.4	Very high	94.4	Very high	95 Å²	95	52 Å²	52	42%	0.417	27%	0.268	S	S	.	.	H	α-helix	trans	-69.5	-47.1	178.8	-174	-102	0	0	0	112.4	V77 M78 T79 F83 G84 V85 L115 F119	V77-F81 WeakPolarHBondContact O-CB 3.22Å; V77-F81 PolarHBondContact O-N 3.12Å; M78-F81 PolarHBondContact O-N 3.19Å; T79-F81 VanDerWaalsContact C-N 3.27Å; T79-F81 PolarHBondContact O-N 2.94Å; F81-F83 PolarHBondContact O-N 3.36Å; F81-G84 PolarHBondContact O-N 2.81Å; F81-V85 HydrophobicContact CD1-CG2 4.19Å; F81-V85 HydrophobicContact CE1-CG2 3.79Å; F81-V85 HydrophobicContact CE2-CG2 4.26Å; F81-V85 HydrophobicContact CZ-CG2 3.83Å; F81-V85 VanDerWaalsContact O-CG2 3.31Å; F81-V85 WeakPolarHBondContact O-CG2 3.47Å; F81-V85 PolarHBondContact O-N 2.93Å; F81-L115 HydrophobicContact CE2-CD2 4.41Å; F81-F119 HydrophobicContact CB-CD2 4.43Å; F81-F119 HydrophobicContact CD2-CD2 4.47Å
82	I	97.1	Very high	94.6	Very high	75 Å²	75	53.5 Å²	53.5	39%	0.385	27%	0.274	S	S	.	.	H	α-helix	trans	-60.4	-48	-179.3	-71.4	164.8	0	0	0	111	M78 T79 V85 F86	M78-I82 WeakPolarHBondContact O-CB 3.34Å; M78-I82 WeakPolarHBondContact O-CD1 3.31Å; M78-I82 WeakPolarHBondContact O-CG1 3.45Å; M78-I82 PolarHBondContact O-N 3.2Å; T79-I82 PolarHBondContact O-N 2.87Å; I82-V85 WeakPolarHBondContact O-CB 3.29Å; I82-V85 PolarHBondContact O-N 3.41Å; I82-F86 HydrophobicContact CG2-CD2 4.15Å; I82-F86 HydrophobicContact CG2-CE2 3.57Å; I82-F86 HydrophobicContact CG2-CZ 4.03Å; I82-F86 WeakPolarHBondContact O-CD2 3.17Å; I82-F86 PolarHBondContact O-N 3Å
83	F	97.4	Very high	94.7	Very high	17 Å²	17	53.7 Å²	53.7	8%	0.075	30%	0.296	C	S	.	.	H	α-helix	trans	-71.6	-34.3	178.1	-80	-78.9	0	0	0	112.3	T79 F81 V85 F86 F87 S122 T146 Q150 I153 T154	T79-F83 WeakPolarHBondContact O-CD2 3.2Å; T79-F83 PolarHBondContact O-N 2.87Å; F81-F83 PolarHBondContact O-N 3.36Å; F83-V85 VanDerWaalsContact C-N 3.28Å; F83-V85 PolarHBondContact O-N 3.1Å; F83-F86 AromaticContact CD1-CD2 3.89Å; F83-F86 HydrophobicContact CD1-CD2 3.89Å; F83-F86 HydrophobicContact CE1-CD2 4.2Å; F83-F86 HydrophobicContact CG-CD2 4.39Å; F83-F86 PolarHBondContact O-N 3.42Å; F83-F86 VanDerWaalsContact O-N 3.13Å; F83-F87 HydrophobicContact CB-CE2 4.5Å; F83-F87 WeakPolarHBondContact O-CD2 3.47Å; F83-F87 PolarHBondContact O-N 2.85Å; F83-S122 WeakPolarHBondContact CB-OG 3.31Å; F83-T146 HydrophobicContact CD1-CG2 4.06Å; F83-T146 HydrophobicContact CE1-CG2 4.43Å; F83-Q150 HydrophobicContact CB-CG 4.08Å; F83-Q150 HydrophobicContact CD1-CB 3.53Å; F83-Q150 HydrophobicContact CD1-CG 3.78Å; F83-Q150 HydrophobicContact CD2-CB 4.27Å; F83-Q150 HydrophobicContact CD2-CG 3.73Å; F83-Q150 VanDerWaalsContact CE1-CA 3.43Å; F83-Q150 HydrophobicContact CE1-CB 3.55Å; F83-Q150 HydrophobicContact CE1-CG 4.11Å; F83-Q150 HydrophobicContact CE2-CB 4.29Å; F83-Q150 HydrophobicContact CE2-CG 4.07Å; F83-Q150 HydrophobicContact CG-CB 3.91Å; F83-Q150 HydrophobicContact CG-CG 3.58Å; F83-Q150 VanDerWaalsContact CZ-CA 3.45Å; F83-Q150 HydrophobicContact CZ-CB 3.96Å; F83-Q150 HydrophobicContact CZ-CG 4.26Å; F83-I153 HydrophobicContact CZ-CD1 4.43Å; F83-T154 HydrophobicContact CD2-CG2 4.22Å; F83-T154 HydrophobicContact CE2-CG2 3.85Å
84	G	97.6	Very high	94.6	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-58	-40.9	169.8	0	0	0	0	0	112.5	W80 F81 F87 F88 A118 S122	W80-G84 PolarHBondContact O-N 2.85Å; F81-G84 PolarHBondContact O-N 2.81Å; G84-F87 PolarHBondContact O-N 2.95Å; G84-F88 WeakPolarHBondContact O-CB 3.43Å; G84-F88 PolarHBondContact O-N 2.94Å; G84-A118 WeakPolarHBondContact CA-O 3.43Å; G84-A118 VanDerWaalsContact O-CB 3.24Å; G84-A118 WeakPolarHBondContact O-CB 3.39Å; G84-S122 PolarHBondContact N-OG 2.87Å
85	V	97.9	Very high	94.5	Very high	33 Å²	33	52.1 Å²	52.1	20%	0.2	28%	0.28	C	S	.	.	H	α-helix	trans	-64.4	-41.5	173.5	168.7	0	0	0	0	111.2	F81 I82 F83 F88 F89 L115	F81-V85 HydrophobicContact CD1-CG2 4.19Å; F81-V85 HydrophobicContact CE1-CG2 3.79Å; F81-V85 HydrophobicContact CE2-CG2 4.26Å; F81-V85 HydrophobicContact CZ-CG2 3.83Å; F81-V85 VanDerWaalsContact O-CG2 3.31Å; F81-V85 WeakPolarHBondContact O-CG2 3.47Å; F81-V85 PolarHBondContact O-N 2.93Å; I82-V85 WeakPolarHBondContact O-CB 3.29Å; I82-V85 PolarHBondContact O-N 3.41Å; F83-V85 VanDerWaalsContact C-N 3.28Å; F83-V85 PolarHBondContact O-N 3.1Å; V85-F88 PolarHBondContact O-N 2.75Å; V85-F89 HydrophobicContact CG1-CD2 3.53Å; V85-F89 HydrophobicContact CG1-CE2 3.35Å; V85-F89 WeakPolarHBondContact O-CD2 3.38Å; V85-F89 PolarHBondContact O-N 2.86Å; V85-L115 HydrophobicContact CG2-CD1 4.06Å
86	F	97.4	Very high	94.4	Very high	104 Å²	104	50.6 Å²	50.6	46%	0.456	27%	0.27	S	S	.	.	H	α-helix	trans	-61.6	-47.2	174.9	-68.1	-39.5	0	0	0	112.5	I82 F83 F88 F89 I90 T146	I82-F86 HydrophobicContact CG2-CD2 4.15Å; I82-F86 HydrophobicContact CG2-CE2 3.57Å; I82-F86 HydrophobicContact CG2-CZ 4.03Å; I82-F86 WeakPolarHBondContact O-CD2 3.17Å; I82-F86 PolarHBondContact O-N 3Å; F83-F86 AromaticContact CD1-CD2 3.89Å; F83-F86 HydrophobicContact CD1-CD2 3.89Å; F83-F86 HydrophobicContact CE1-CD2 4.2Å; F83-F86 HydrophobicContact CG-CD2 4.39Å; F83-F86 PolarHBondContact O-N 3.42Å; F83-F86 VanDerWaalsContact O-N 3.13Å; F86-F88 VanDerWaalsContact C-N 3.3Å; F86-F88 PolarHBondContact O-N 3.16Å; F86-F89 PolarHBondContact O-N 2.95Å; F86-I90 VanDerWaalsContact O-CG1 3.25Å; F86-I90 WeakPolarHBondContact O-CG1 3.45Å; F86-I90 PolarHBondContact O-N 2.82Å; F86-T146 HydrophobicContact CB-CG2 4.1Å
87	F	97.1	Very high	94.1	Very high	4 Å²	4	51.6 Å²	51.6	2%	0.018	28%	0.275	C	S	.	.	H	α-helix	trans	-63.3	-36.7	176	-72.2	-63.7	0	0	0	112.6	F83 G84 I90 G91 V109 F121 T146 L147 Q150	F83-F87 HydrophobicContact CB-CE2 4.5Å; F83-F87 WeakPolarHBondContact O-CD2 3.47Å; F83-F87 PolarHBondContact O-N 2.85Å; G84-F87 PolarHBondContact O-N 2.95Å; F87-I90 HydrophobicContact CD1-CD1 4.41Å; F87-I90 PolarHBondContact O-N 2.85Å; F87-G91 PolarHBondContact O-N 2.81Å; F87-V109 HydrophobicContact CD1-CG2 4.14Å; F87-F121 HydrophobicContact CB-CD1 4.44Å; F87-F121 HydrophobicContact CD1-CD1 4.26Å; F87-F121 AromaticContact CD1-CE1 3.82Å; F87-F121 HydrophobicContact CD1-CE1 3.82Å; F87-F121 AromaticContact CD2-CD1 3.76Å; F87-F121 HydrophobicContact CD2-CD1 3.76Å; F87-F121 AromaticContact CD2-CE1 3.88Å; F87-F121 HydrophobicContact CD2-CE1 3.88Å; F87-F121 HydrophobicContact CE1-CD1 4.49Å; F87-F121 AromaticContact CE1-CE1 3.7Å; F87-F121 HydrophobicContact CE1-CE1 3.7Å; F87-F121 HydrophobicContact CE2-CD1 4.01Å; F87-F121 AromaticContact CE2-CE1 3.76Å; F87-F121 HydrophobicContact CE2-CE1 3.76Å; F87-F121 AromaticContact CG-CD1 3.9Å; F87-F121 HydrophobicContact CG-CD1 3.9Å; F87-F121 AromaticContact CG-CE1 3.92Å; F87-F121 HydrophobicContact CG-CE1 3.92Å; F87-F121 HydrophobicContact CZ-CD1 4.37Å; F87-F121 AromaticContact CZ-CE1 3.67Å; F87-F121 HydrophobicContact CZ-CE1 3.67Å; F87-T146 HydrophobicContact CD1-CG2 4.41Å; F87-T146 HydrophobicContact CE1-CG2 3.91Å; F87-T146 HydrophobicContact CE2-CG2 4.24Å; F87-T146 HydrophobicContact CZ-CG2 3.81Å; F87-L147 HydrophobicContact CZ-CB 4.15Å; F87-Q150 VanDerWaalsContact CE2-OE1 3.3Å
88	F	96.5	Very high	93.4	Very high	43 Å²	43	53.3 Å²	53.3	19%	0.189	28%	0.281	C	S	.	.	H	α-helix	trans	-62.2	-45.2	174.3	-173.9	-102.8	0	0	0	111.4	G84 V85 F86 I90 G91 M92 F97 L115 A118	G84-F88 WeakPolarHBondContact O-CB 3.43Å; G84-F88 PolarHBondContact O-N 2.94Å; V85-F88 PolarHBondContact O-N 2.75Å; F86-F88 VanDerWaalsContact C-N 3.3Å; F86-F88 PolarHBondContact O-N 3.16Å; F88-I90 PolarHBondContact O-N 2.8Å; F88-G91 PolarHBondContact O-N 2.79Å; F88-M92 HydrophobicContact CD1-CE 4.35Å; F88-M92 HydrophobicContact CE1-CE 3.52Å; F88-M92 HydrophobicContact CZ-CE 3.97Å; F88-M92 WeakPolarHBondContact O-CB 3.31Å; F88-M92 PolarHBondContact O-N 2.82Å; F88-F97 HydrophobicContact CD2-CE1 4.11Å; F88-F97 AromaticContact CD2-CE2 3.86Å; F88-F97 HydrophobicContact CD2-CE2 3.86Å; F88-F97 AromaticContact CD2-CZ 3.39Å; F88-F97 HydrophobicContact CD2-CZ 3.39Å; F88-F97 HydrophobicContact CE2-CD2 4.41Å; F88-F97 AromaticContact CE2-CE1 3.88Å; F88-F97 HydrophobicContact CE2-CE1 3.88Å; F88-F97 AromaticContact CE2-CE2 3.72Å; F88-F97 HydrophobicContact CE2-CE2 3.72Å; F88-F97 AromaticContact CE2-CZ 3.44Å; F88-F97 HydrophobicContact CE2-CZ 3.44Å; F88-F97 VanDerWaalsContact CE2-CZ 3.44Å; F88-F97 HydrophobicContact CG-CE2 4.42Å; F88-F97 HydrophobicContact CG-CZ 4.25Å; F88-F97 HydrophobicContact CZ-CE2 4.19Å; F88-F97 HydrophobicContact CZ-CZ 4.35Å; F88-F97 WeakPolarHBondContact O-CE2 3.12Å; F88-L115 HydrophobicContact CB-CD1 3.89Å; F88-L115 HydrophobicContact CD1-CD1 4.2Å; F88-L115 HydrophobicContact CD2-CB 4.19Å; F88-L115 HydrophobicContact CD2-CD1 4.37Å; F88-L115 HydrophobicContact CE2-CB 4.28Å; F88-L115 HydrophobicContact CG-CB 4.47Å; F88-L115 HydrophobicContact CG-CD1 3.89Å; F88-A118 HydrophobicContact CB-CB 3.85Å; F88-A118 HydrophobicContact CD2-CB 4.42Å
89	F	96	Very high	91.7	Very high	123 Å²	123	54.1 Å²	54.1	54%	0.539	30%	0.296	S	S	.	.	H	α-helix	trans	-67.5	-34.1	176.2	-79	-60.6	0	0	0	113.4	V85 F86 M92 G93	V85-F89 HydrophobicContact CG1-CD2 3.53Å; V85-F89 HydrophobicContact CG1-CE2 3.35Å; V85-F89 WeakPolarHBondContact O-CD2 3.38Å; V85-F89 PolarHBondContact O-N 2.86Å; F86-F89 PolarHBondContact O-N 2.95Å; F89-M92 HydrophobicContact CD1-SD 4.37Å; F89-M92 PolarHBondContact O-N 2.9Å; F89-G93 PolarHBondContact O-N 2.75Å
90	I	95.1	Very high	89.9	Confident	22 Å²	22	64.2 Å²	64.2	11%	0.113	33%	0.332	C	S	.	.	H	α-helix	trans	-63.2	-47.5	174.3	-68.6	164.9	0	0	0	110.3	F86 F87 F88 M92 G93 N94 C108 L142 A143 T146	F86-I90 VanDerWaalsContact O-CG1 3.25Å; F86-I90 WeakPolarHBondContact O-CG1 3.45Å; F86-I90 PolarHBondContact O-N 2.82Å; F87-I90 HydrophobicContact CD1-CD1 4.41Å; F87-I90 PolarHBondContact O-N 2.85Å; F88-I90 PolarHBondContact O-N 2.8Å; I90-M92 VanDerWaalsContact C-N 3.29Å; I90-M92 PolarHBondContact O-N 3.26Å; I90-G93 PolarHBondContact O-N 2.88Å; I90-N94 PolarHBondContact O-N 3.04Å; I90-C108 HydrophobicContact CG2-CB 4.21Å; I90-L142 HydrophobicContact CD1-CD2 4.46Å; I90-L142 HydrophobicContact CD1-CG 4.11Å; I90-L142 HydrophobicContact CG1-CD2 3.99Å; I90-L142 HydrophobicContact CG1-CG 4.19Å; I90-A143 HydrophobicContact CG2-CB 4.11Å; I90-T146 HydrophobicContact CD1-CG2 4.17Å; I90-T146 WeakPolarHBondContact CD1-OG1 3.46Å
91	G	93	Very high	88	Confident	3 Å²	3	67.6 Å²	67.6	3%	0.031	35%	0.349	C	S	.	.	H	α-helix	trans	-62	-37.8	175.8	0	0	0	0	0	112.4	F87 F88 N94 G95 D96	F87-G91 PolarHBondContact O-N 2.81Å; F88-G91 PolarHBondContact O-N 2.79Å; G91-N94 PolarHBondContact O-N 3.33Å; G91-G95 PolarHBondContact O-N 3.2Å; G91-D96 VanDerWaalsContact CA-OD2 3.3Å; G91-D96 WeakPolarHBondContact CA-OD2 3.42Å; G91-D96 WeakPolarHBondContact O-CB 3.44Å; G91-D96 PolarHBondContact O-N 2.85Å
92	M	92.1	Very high	86.1	Confident	100 Å²	100	69.2 Å²	69.2	49%	0.493	36%	0.362	S	S	.	.	H	α-helix	trans	-65.2	-41.8	175.7	-176	178.1	-70.8	0	0	111.9	F88 F89 I90 N94 G95 F97	F88-M92 HydrophobicContact CD1-CE 4.35Å; F88-M92 HydrophobicContact CE1-CE 3.52Å; F88-M92 HydrophobicContact CZ-CE 3.97Å; F88-M92 WeakPolarHBondContact O-CB 3.31Å; F88-M92 PolarHBondContact O-N 2.82Å; F89-M92 HydrophobicContact CD1-SD 4.37Å; F89-M92 PolarHBondContact O-N 2.9Å; I90-M92 VanDerWaalsContact C-N 3.29Å; I90-M92 PolarHBondContact O-N 3.26Å; M92-N94 VanDerWaalsContact C-N 3.28Å; M92-N94 PolarHBondContact O-N 3.31Å; M92-G95 PolarHBondContact O-N 2.88Å; M92-F97 HydrophobicContact CB-CD2 4.04Å; M92-F97 HydrophobicContact CB-CE2 3.94Å; M92-F97 VanDerWaalsContact N-CE2 3.28Å
93	G	91.3	Very high	84.5	Confident	73 Å²	73	72 Å²	72	75%	0.753	39%	0.388	S	S	*	.	H	α-helix	trans	-66.4	-29.4	175.8	0	0	0	0	0	113.5	F89 I90	F89-G93 PolarHBondContact O-N 2.75Å; I90-G93 PolarHBondContact O-N 2.88Å
94	N	89.7	Confident	83.5	Confident	61 Å²	61	77 Å²	77	33%	0.326	42%	0.42	S	S	.	.	H	α-helix	trans	-86.2	-9	177.3	-164.5	62.2	0	0	0	114	I90 G91 M92 D96 H105 C108	I90-N94 PolarHBondContact O-N 3.04Å; G91-N94 PolarHBondContact O-N 3.33Å; M92-N94 VanDerWaalsContact C-N 3.28Å; M92-N94 PolarHBondContact O-N 3.31Å; N94-D96 PolarHBondContact ND2-OD1 3.15Å; N94-H105 PolarHBondContact ND2-NE2 3.09Å; N94-H105 PolarHBondContact O-NE2 3.29Å; N94-C108 WeakPolarHBondContact CB-SG 3.49Å; N94-C108 PolarHBondContact ND2-SG 3.22Å
95	G	88.9	Confident	82.8	Confident	20 Å²	20	80.1 Å²	80.1	21%	0.206	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.1	20.1	-176.1	0	0	0	0	0	114.4	G91 M92 F97 D98	G91-G95 PolarHBondContact O-N 3.2Å; M92-G95 PolarHBondContact O-N 2.88Å; G95-F97 PolarHBondContact O-N 3.11Å; G95-F97 VanDerWaalsContact O-N 3.1Å; G95-D98 PolarHBondContact O-N 3.01Å
96	D	87.3	Confident	82.3	Confident	12 Å²	12	81.5 Å²	81.5	6%	0.064	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-21.3	-177.6	-67.6	-1.4	0	0	0	113.2	G91 N94 H105 P107 C108	G91-D96 VanDerWaalsContact CA-OD2 3.3Å; G91-D96 WeakPolarHBondContact CA-OD2 3.42Å; G91-D96 WeakPolarHBondContact O-CB 3.44Å; G91-D96 PolarHBondContact O-N 2.85Å; N94-D96 PolarHBondContact ND2-OD1 3.15Å; D96-H105 IonicContact OD1-CE1 2.82Å; D96-H105 PolarHBondContact OD1-CE1 3.45Å; D96-H105 VanDerWaalsContact OD1-CE1 3.26Å; D96-H105 IonicContact OD1-NE2 2.75Å; D96-P107 HydrophobicContact CB-CB 4.26Å; D96-P107 WeakPolarHBondContact OD1-CA 3.07Å; D96-C108 PolarHBondContact OD1-N 3.02Å; D96-C108 PolarHBondContact OD2-N 3.47Å
97	F	84.1	Confident	82.1	Confident	57 Å²	57	78.4 Å²	78.4	25%	0.25	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-5.9	-176.6	-53.1	-63.3	0	0	0	114.3	F88 M92 G95 S99 V112 N113	F88-F97 HydrophobicContact CD2-CE1 4.11Å; F88-F97 AromaticContact CD2-CE2 3.86Å; F88-F97 HydrophobicContact CD2-CE2 3.86Å; F88-F97 AromaticContact CD2-CZ 3.39Å; F88-F97 HydrophobicContact CD2-CZ 3.39Å; F88-F97 HydrophobicContact CE2-CD2 4.41Å; F88-F97 AromaticContact CE2-CE1 3.88Å; F88-F97 HydrophobicContact CE2-CE1 3.88Å; F88-F97 AromaticContact CE2-CE2 3.72Å; F88-F97 HydrophobicContact CE2-CE2 3.72Å; F88-F97 AromaticContact CE2-CZ 3.44Å; F88-F97 HydrophobicContact CE2-CZ 3.44Å; F88-F97 VanDerWaalsContact CE2-CZ 3.44Å; F88-F97 HydrophobicContact CG-CE2 4.42Å; F88-F97 HydrophobicContact CG-CZ 4.25Å; F88-F97 HydrophobicContact CZ-CE2 4.19Å; F88-F97 HydrophobicContact CZ-CZ 4.35Å; F88-F97 WeakPolarHBondContact O-CE2 3.12Å; M92-F97 HydrophobicContact CB-CD2 4.04Å; M92-F97 HydrophobicContact CB-CE2 3.94Å; M92-F97 VanDerWaalsContact N-CE2 3.28Å; G95-F97 PolarHBondContact O-N 3.11Å; G95-F97 VanDerWaalsContact O-N 3.1Å; F97-S99 PolarHBondContact O-N 2.87Å; F97-V112 WeakPolarHBondContact CE1-O 3.39Å; F97-N113 WeakPolarHBondContact CD1-O 3.17Å
98	D	80.8	Confident	81.9	Confident	110 Å²	110	78.2 Å²	78.2	59%	0.588	43%	0.433	S	S	*	.			trans	-79.2	115.7	-175.6	-76.1	-26.7	0	0	0	111.1	G95 W100 H101	G95-D98 PolarHBondContact O-N 3.01Å; D98-W100 PolarHBondContact O-N 3.33Å; D98-H101 PolarHBondContact O-ND1 2.82Å; D98-H101 VanDerWaalsContact O-ND1 3.09Å
99	S	58.3	Low	81.8	Confident	113 Å²	113	76.4 Å²	76.4	79%	0.79	43%	0.425	S	S	*	.	S	Bend	trans	-60	-4.7	-178.2	57	0	0	0	0	116.3	F97 H101	F97-S99 PolarHBondContact O-N 2.87Å; S99-H101 VanDerWaalsContact C-N 3.33Å; S99-H101 PolarHBondContact O-N 2.81Å
100	W	57.2	Low	81.6	Confident	238 Å²	238	71.9 Å²	71.9	90%	0.902	41%	0.408	S	S	*	.			trans	-92.7	60.9	176.1	-73.5	83.8	0	0	0	110.7	D98 N102	D98-W100 PolarHBondContact O-N 3.33Å; W100-N102 PolarHBondContact O-N 2.83Å
101	H	55.8	Low	81.5	Confident	116 Å²	116	74.1 Å²	74.1	54%	0.537	42%	0.42	S	S	.	.			trans	-69.7	106.7	176.8	-82.6	7.3	0	0	0	111.1	D98 S99	D98-H101 PolarHBondContact O-ND1 2.82Å; D98-H101 VanDerWaalsContact O-ND1 3.09Å; S99-H101 VanDerWaalsContact C-N 3.33Å; S99-H101 PolarHBondContact O-N 2.81Å
102	N	58.5	Low	81.5	Confident	130 Å²	130	74.2 Å²	74.2	70%	0.695	42%	0.42	S	S	*	.			trans	-59.1	137.1	144.7	-82.7	-25.1	0	0	0	107.7	W100 T104 H105	W100-N102 PolarHBondContact O-N 2.83Å; N102-T104 PolarHBondContact O-N 2.86Å; N102-H105 PolarHBondContact O-N 3.39Å
103	S	62.8	Low	81.3	Confident	133 Å²	133	75.1 Å²	75.1	93%	0.93	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	9.4	-176.3	-45.5	0	0	0	0	115.6
104	T	75.8	Confident	81.4	Confident	122 Å²	122	75.3 Å²	75.3	75%	0.748	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.5	-0.7	-172.7	59.5	0	0	0	0	113.9	N102	N102-T104 PolarHBondContact O-N 2.86Å
105	H	84	Confident	81.7	Confident	66 Å²	66	75.7 Å²	75.7	31%	0.306	42%	0.415	S	S	.	.			trans	-83.2	130.2	178.1	-178.2	-94.3	0	0	0	110.9	N94 D96 N102	N94-H105 PolarHBondContact ND2-NE2 3.09Å; N94-H105 PolarHBondContact O-NE2 3.29Å; D96-H105 IonicContact OD1-CE1 2.82Å; D96-H105 PolarHBondContact OD1-CE1 3.45Å; D96-H105 VanDerWaalsContact OD1-CE1 3.26Å; D96-H105 IonicContact OD1-NE2 2.75Å; N102-H105 PolarHBondContact O-N 3.39Å
106	T	87.5	Confident	82.1	Confident	62 Å²	62	79.2 Å²	79.2	38%	0.38	43%	0.433	S	S	.	.			trans	-110.1	117.3	177.6	39	0	0	0	0	108.7	E139	T106-E139 WeakPolarHBondContact OG1-CG 3.47Å; T106-E139 PolarHBondContact OG1-OE1 3.23Å
107	P	91.3	Very high	82.4	Confident	38 Å²	38	78.9 Å²	78.9	25%	0.247	43%	0.432	C	S	.	.			trans	-72.2	152.7	-175.5	28.8	-34.9	0	0	0	111.4	D96 V109 V110 S137	D96-P107 HydrophobicContact CB-CB 4.26Å; D96-P107 WeakPolarHBondContact OD1-CA 3.07Å; P107-V109 VanDerWaalsContact C-N 3.35Å; P107-V110 HydrophobicContact CG-CG2 4.2Å; P107-S137 VanDerWaalsContact O-CB 3.29Å; P107-S137 WeakPolarHBondContact O-CB 3.44Å; P107-S137 PolarHBondContact O-OG 2.98Å
108	C	92.9	Very high	83.1	Confident	1 Å²	1	76.2 Å²	76.2	1%	0.007	42%	0.42	C	S	.	.	S	Bend	trans	-65.3	-40.4	176.8	-64.5	0	0	0	0	111.9	I90 N94 D96 S137 C140 A143	I90-C108 HydrophobicContact CG2-CB 4.21Å; N94-C108 WeakPolarHBondContact CB-SG 3.49Å; N94-C108 PolarHBondContact ND2-SG 3.22Å; D96-C108 PolarHBondContact OD1-N 3.02Å; D96-C108 PolarHBondContact OD2-N 3.47Å; C108-S137 PolarHBondContact O-N 3.5Å; C108-S137 PolarHBondContact O-OG 3.44Å; C108-C140 WeakPolarHBondContact CA-SG 3.4Å; C108-C140 HydrophobicContact CB-CB 3.58Å; C108-C140 WeakPolarHBondContact CB-SG 3.26Å; C108-C140 WeakPolarHBondContact SG-CB 3.49Å; C108-C140 CovalentContact SG-SG 2.03Å; C108-C140 PolarHBondContact SG-SG 3.11Å; C108-A143 HydrophobicContact CB-CB 4.26Å
109	V	94.4	Very high	83.9	Confident	5 Å²	5	73.4 Å²	73.4	3%	0.03	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	116.8	174.4	-171.3	0	0	0	0	108.8	F87 P107 V112 F121 Y135	F87-V109 HydrophobicContact CD1-CG2 4.14Å; P107-V109 VanDerWaalsContact C-N 3.35Å; V109-V112 HydrophobicContact CB-CB 4.27Å; V109-V112 HydrophobicContact CB-CG2 4Å; V109-V112 HydrophobicContact CG1-CB 4.28Å; V109-V112 HydrophobicContact CG1-CG2 3.48Å; V109-V112 VanDerWaalsContact CG1-CG2 3.48Å; V109-F121 HydrophobicContact CG1-CD1 3.88Å; V109-F121 HydrophobicContact CG1-CD2 3.77Å; V109-F121 HydrophobicContact CG1-CE1 3.89Å; V109-F121 HydrophobicContact CG1-CE2 3.79Å; V109-F121 HydrophobicContact CG1-CG 3.8Å; V109-F121 HydrophobicContact CG1-CZ 3.85Å; V109-F121 HydrophobicContact CG2-CD1 4.39Å; V109-F121 HydrophobicContact CG2-CE1 3.98Å; V109-F121 HydrophobicContact CG2-CZ 4.32Å; V109-Y135 WeakPolarHBondContact CA-O 3.36Å
110	V	93.1	Very high	85.7	Confident	27 Å²	27	71 Å²	71	16%	0.164	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	140.3	-175.7	-172.6	0	0	0	0	110	P107 V112 R134 Y135	P107-V110 HydrophobicContact CG-CG2 4.2Å; V110-V112 VanDerWaalsContact C-N 3.27Å; V110-V112 PolarHBondContact O-N 3.32Å; V110-R134 WeakPolarHBondContact O-CA 3.24Å; V110-Y135 HydrophobicContact CB-CD1 4.15Å; V110-Y135 HydrophobicContact CB-CE1 3.81Å; V110-Y135 HydrophobicContact CB-CE2 4.22Å; V110-Y135 HydrophobicContact CB-CG 4.49Å; V110-Y135 HydrophobicContact CG1-CE1 3.92Å; V110-Y135 HydrophobicContact CG2-CD2 4.09Å; V110-Y135 HydrophobicContact CG2-CE1 4.05Å; V110-Y135 HydrophobicContact CG2-CE2 3.56Å; V110-Y135 PolarHBondContact N-O 3.49Å
111	N	91.6	Very high	87.6	Confident	69 Å²	69	59.9 Å²	59.9	37%	0.369	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.1	26.5	179.4	-61.2	-47.5	0	0	0	115.2	F133 R134	N111-F133 HydrophobicContact CB-CD1 4.13Å; N111-F133 HydrophobicContact CB-CE1 3.67Å; N111-F133 HydrophobicContact CB-CZ 4.02Å; N111-F133 PolarHBondContact ND2-O 2.92Å; N111-R134 HydrophobicContact CB-CG 4.27Å
112	V	93.3	Very high	89.6	Confident	5 Å²	5	54.4 Å²	54.4	3%	0.03	31%	0.314	C	S	.	.			trans	-107.8	94	169.9	174.8	0	0	0	0	108.7	F97 V109 V110 A118 F121 R134	F97-V112 WeakPolarHBondContact CE1-O 3.39Å; V109-V112 HydrophobicContact CB-CB 4.27Å; V109-V112 HydrophobicContact CB-CG2 4Å; V109-V112 HydrophobicContact CG1-CB 4.28Å; V109-V112 HydrophobicContact CG1-CG2 3.48Å; V109-V112 VanDerWaalsContact CG1-CG2 3.48Å; V110-V112 VanDerWaalsContact C-N 3.27Å; V110-V112 PolarHBondContact O-N 3.32Å; V112-A118 HydrophobicContact CG1-CB 3.64Å; V112-F121 HydrophobicContact CG2-CB 4.05Å; V112-F121 HydrophobicContact CG2-CG 4.5Å; V112-R134 HydrophobicContact CG2-CG 4.32Å
113	N	88.5	Confident	91.4	Very high	119 Å²	119	49.7 Å²	49.7	64%	0.636	29%	0.288	S	S	*	.			trans	-108.7	-8.2	-178	-58.1	-16.4	0	0	0	113.1	F97	F97-N113 WeakPolarHBondContact CD1-O 3.17Å
114	T	94.3	Very high	93	Very high	78 Å²	78	43.6 Å²	43.6	48%	0.479	25%	0.245	S	C	.	.	S	Bend	trans	-142.6	161	-175.8	61.1	0	0	0	0	110.3	T116 G117 A118	T114-T116 PolarHBondContact O-N 2.86Å; T114-G117 WeakPolarHBondContact O-CA 3.44Å; T114-G117 PolarHBondContact O-N 2.62Å; T114-G117 PolarHBondContact OG1-N 2.87Å; T114-G117 VanDerWaalsContact OG1-N 3.08Å; T114-A118 PolarHBondContact O-N 2.86Å
115	L	95.6	Very high	93.9	Very high	69 Å²	69	38.8 Å²	38.8	36%	0.361	22%	0.217	S	C	.	.	H	α-helix	trans	-56.9	-36.9	173.1	-178.3	63	0	0	0	111.8	F81 V85 F88 G117 A118 F119	F81-L115 HydrophobicContact CE2-CD2 4.41Å; V85-L115 HydrophobicContact CG2-CD1 4.06Å; F88-L115 HydrophobicContact CB-CD1 3.89Å; F88-L115 HydrophobicContact CD1-CD1 4.2Å; F88-L115 HydrophobicContact CD2-CB 4.19Å; F88-L115 HydrophobicContact CD2-CD1 4.37Å; F88-L115 HydrophobicContact CE2-CB 4.28Å; F88-L115 HydrophobicContact CG-CB 4.47Å; F88-L115 HydrophobicContact CG-CD1 3.89Å; L115-G117 VanDerWaalsContact C-N 3.34Å; L115-A118 PolarHBondContact O-N 3.37Å; L115-F119 WeakPolarHBondContact O-CB 3.27Å; L115-F119 PolarHBondContact O-N 3.47Å
116	T	96.2	Very high	94.5	Very high	94 Å²	94	36.1 Å²	36.1	58%	0.577	20%	0.204	S	C	*	.	H	α-helix	trans	-63.7	-40.3	173.8	-51	0	0	0	0	111.7	T114 A118 F119 L120	T114-T116 PolarHBondContact O-N 2.86Å; T116-A118 VanDerWaalsContact C-N 3.33Å; T116-A118 PolarHBondContact O-N 3.23Å; T116-F119 PolarHBondContact O-N 3.49Å; T116-L120 WeakPolarHBondContact O-CG 3.3Å; T116-L120 PolarHBondContact O-N 2.82Å
117	G	95.2	Very high	94.8	Very high	5 Å²	5	35.3 Å²	35.3	5%	0.052	20%	0.199	C	C	.	.	H	α-helix	trans	-61.2	-41.1	173	0	0	0	0	0	112.5	T114 L115 L120 F121	T114-G117 WeakPolarHBondContact O-CA 3.44Å; T114-G117 PolarHBondContact O-N 2.62Å; T114-G117 PolarHBondContact OG1-N 2.87Å; T114-G117 VanDerWaalsContact OG1-N 3.08Å; L115-G117 VanDerWaalsContact C-N 3.34Å; G117-L120 PolarHBondContact O-N 3.34Å; G117-F121 PolarHBondContact O-N 3.24Å
118	A	96.9	Very high	94.9	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-69.5	-38.4	178.2	0	0	0	0	0	112.1	G84 F88 V112 T114 L115 T116 F121 S122	G84-A118 WeakPolarHBondContact CA-O 3.43Å; G84-A118 VanDerWaalsContact O-CB 3.24Å; G84-A118 WeakPolarHBondContact O-CB 3.39Å; F88-A118 HydrophobicContact CB-CB 3.85Å; F88-A118 HydrophobicContact CD2-CB 4.42Å; V112-A118 HydrophobicContact CG1-CB 3.64Å; T114-A118 PolarHBondContact O-N 2.86Å; L115-A118 PolarHBondContact O-N 3.37Å; T116-A118 VanDerWaalsContact C-N 3.33Å; T116-A118 PolarHBondContact O-N 3.23Å; A118-F121 PolarHBondContact O-N 2.92Å; A118-S122 WeakPolarHBondContact O-CB 3.26Å; A118-S122 PolarHBondContact O-N 2.9Å
119	F	97.6	Very high	95.1	Very high	52 Å²	52	43 Å²	43	23%	0.228	24%	0.242	C	C	.	.	H	α-helix	trans	-60.1	-47	171	170.3	-97.1	0	0	0	111.9	W80 F81 L115 T116 F121 S122 L123	W80-F119 HydrophobicContact CB-CD2 4.11Å; W80-F119 HydrophobicContact CB-CE2 3.6Å; W80-F119 HydrophobicContact CB-CZ 4.32Å; W80-F119 HydrophobicContact CE3-CE2 4.39Å; W80-F119 HydrophobicContact CE3-CZ 4.07Å; F81-F119 HydrophobicContact CB-CD2 4.43Å; F81-F119 HydrophobicContact CD2-CD2 4.47Å; L115-F119 WeakPolarHBondContact O-CB 3.27Å; L115-F119 PolarHBondContact O-N 3.47Å; T116-F119 PolarHBondContact O-N 3.49Å; F119-F121 PolarHBondContact O-N 2.96Å; F119-S122 PolarHBondContact O-N 2.88Å; F119-L123 HydrophobicContact CE1-CD1 4.19Å; F119-L123 HydrophobicContact CZ-CD1 4.27Å; F119-L123 WeakPolarHBondContact O-CB 3.34Å; F119-L123 PolarHBondContact O-N 3.2Å
120	L	97.1	Very high	95	Very high	61 Å²	61	45.1 Å²	45.1	32%	0.319	27%	0.265	S	S	.	.	H	α-helix	trans	-62.7	-42.6	177.6	-71.5	173.9	0	0	0	111.4	T116 G117 L123 E124	T116-L120 WeakPolarHBondContact O-CG 3.3Å; T116-L120 PolarHBondContact O-N 2.82Å; G117-L120 PolarHBondContact O-N 3.34Å; L120-L123 PolarHBondContact O-N 3.41Å; L120-E124 WeakPolarHBondContact O-CB 3.43Å; L120-E124 WeakPolarHBondContact O-CG 3.48Å; L120-E124 PolarHBondContact O-N 3.42Å
121	F	97.4	Very high	95	Very high	6 Å²	6	51.7 Å²	51.7	3%	0.026	29%	0.288	C	S	.	.	H	α-helix	trans	-58.8	-49.5	173.5	175.9	-110	0	0	0	111.8	F87 V109 V112 G117 A118 F119 L123 E124 S125 R134 I136	F87-F121 HydrophobicContact CB-CD1 4.44Å; F87-F121 HydrophobicContact CD1-CD1 4.26Å; F87-F121 AromaticContact CD1-CE1 3.82Å; F87-F121 HydrophobicContact CD1-CE1 3.82Å; F87-F121 AromaticContact CD2-CD1 3.76Å; F87-F121 HydrophobicContact CD2-CD1 3.76Å; F87-F121 AromaticContact CD2-CE1 3.88Å; F87-F121 HydrophobicContact CD2-CE1 3.88Å; F87-F121 HydrophobicContact CE1-CD1 4.49Å; F87-F121 AromaticContact CE1-CE1 3.7Å; F87-F121 HydrophobicContact CE1-CE1 3.7Å; F87-F121 HydrophobicContact CE2-CD1 4.01Å; F87-F121 AromaticContact CE2-CE1 3.76Å; F87-F121 HydrophobicContact CE2-CE1 3.76Å; F87-F121 AromaticContact CG-CD1 3.9Å; F87-F121 HydrophobicContact CG-CD1 3.9Å; F87-F121 AromaticContact CG-CE1 3.92Å; F87-F121 HydrophobicContact CG-CE1 3.92Å; F87-F121 HydrophobicContact CZ-CD1 4.37Å; F87-F121 AromaticContact CZ-CE1 3.67Å; F87-F121 HydrophobicContact CZ-CE1 3.67Å; V109-F121 HydrophobicContact CG1-CD1 3.88Å; V109-F121 HydrophobicContact CG1-CD2 3.77Å; V109-F121 HydrophobicContact CG1-CE1 3.89Å; V109-F121 HydrophobicContact CG1-CE2 3.79Å; V109-F121 HydrophobicContact CG1-CG 3.8Å; V109-F121 HydrophobicContact CG1-CZ 3.85Å; V109-F121 HydrophobicContact CG2-CD1 4.39Å; V109-F121 HydrophobicContact CG2-CE1 3.98Å; V109-F121 HydrophobicContact CG2-CZ 4.32Å; V112-F121 HydrophobicContact CG2-CB 4.05Å; V112-F121 HydrophobicContact CG2-CG 4.5Å; G117-F121 PolarHBondContact O-N 3.24Å; A118-F121 PolarHBondContact O-N 2.92Å; F119-F121 PolarHBondContact O-N 2.96Å; F121-L123 VanDerWaalsContact C-N 3.32Å; F121-L123 PolarHBondContact O-N 2.82Å; F121-E124 PolarHBondContact O-N 2.86Å; F121-S125 WeakPolarHBondContact O-CB 3.4Å; F121-S125 PolarHBondContact O-N 2.9Å; F121-S125 PolarHBondContact O-OG 3.39Å; F121-S125 VanDerWaalsContact O-OG 3.1Å; F121-R134 HydrophobicContact CB-CB 4.28Å; F121-R134 HydrophobicContact CD2-CB 3.76Å; F121-R134 HydrophobicContact CG-CB 4.44Å; F121-I136 HydrophobicContact CZ-CB 4.38Å
122	S	97.7	Very high	94.9	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-58.8	-42.5	178.2	176.4	0	0	0	0	112.4	W80 F83 G84 A118 F119 Q126 Q150	W80-S122 WeakPolarHBondContact O-CB 3.5Å; W80-S122 PolarHBondContact O-OG 2.84Å; F83-S122 WeakPolarHBondContact CB-OG 3.31Å; G84-S122 PolarHBondContact N-OG 2.87Å; A118-S122 WeakPolarHBondContact O-CB 3.26Å; A118-S122 PolarHBondContact O-N 2.9Å; F119-S122 PolarHBondContact O-N 2.88Å; S122-Q126 WeakPolarHBondContact O-CB 3.15Å; S122-Q126 PolarHBondContact O-N 2.8Å; S122-Q150 PolarHBondContact O-NE2 3.46Å; S122-Q150 PolarHBondContact OG-NE2 3.47Å
123	L	96.6	Very high	95	Very high	32 Å²	32	56 Å²	56	17%	0.168	32%	0.316	C	S	.	.	H	α-helix	trans	-61.1	-51.4	174	179.7	161.6	0	0	0	111.3	W80 F119 L120 F121 S125 Q126 T127	W80-L123 HydrophobicContact CB-CB 4.44Å; W80-L123 HydrophobicContact CD2-CB 4.19Å; W80-L123 HydrophobicContact CD2-CD1 4.07Å; W80-L123 HydrophobicContact CD2-CG 3.97Å; W80-L123 HydrophobicContact CE3-CD1 3.67Å; W80-L123 HydrophobicContact CE3-CG 4.1Å; W80-L123 HydrophobicContact CG-CB 4.12Å; W80-L123 HydrophobicContact CG-CG 4.42Å; W80-L123 HydrophobicContact CH2-CD1 4.25Å; W80-L123 HydrophobicContact CH2-CG 4.48Å; W80-L123 HydrophobicContact CZ2-CG 4.38Å; W80-L123 HydrophobicContact CZ3-CD1 3.76Å; W80-L123 HydrophobicContact CZ3-CG 4.35Å; F119-L123 HydrophobicContact CE1-CD1 4.19Å; F119-L123 HydrophobicContact CZ-CD1 4.27Å; F119-L123 WeakPolarHBondContact O-CB 3.34Å; F119-L123 PolarHBondContact O-N 3.2Å; L120-L123 PolarHBondContact O-N 3.41Å; F121-L123 VanDerWaalsContact C-N 3.32Å; F121-L123 PolarHBondContact O-N 2.82Å; L123-S125 VanDerWaalsContact C-N 3.29Å; L123-S125 PolarHBondContact O-N 3.47Å; L123-Q126 PolarHBondContact O-N 2.79Å; L123-T127 WeakPolarHBondContact O-CB 3.36Å; L123-T127 WeakPolarHBondContact O-CG2 3.47Å; L123-T127 PolarHBondContact O-N 3.44Å; L123-T127 PolarHBondContact O-OG1 2.91Å
124	E	96.2	Very high	95.3	Very high	4 Å²	4	52.7 Å²	52.7	2%	0.019	30%	0.295	C	S	.	.	H	α-helix	trans	-59.1	-40	-178.8	-73.8	170.7	-140.5	0	0	111.9	L120 F121 T128 I129 G130 Y131 R134	L120-E124 WeakPolarHBondContact O-CB 3.43Å; L120-E124 WeakPolarHBondContact O-CG 3.48Å; L120-E124 PolarHBondContact O-N 3.42Å; F121-E124 PolarHBondContact O-N 2.86Å; E124-T128 PolarHBondContact O-N 2.72Å; E124-I129 PolarHBondContact O-N 3.5Å; E124-I129 VanDerWaalsContact O-N 3.08Å; E124-G130 PolarHBondContact O-N 3.23Å; E124-G130 VanDerWaalsContact O-N 3.13Å; E124-Y131 VanDerWaalsContact CD-CD2 3.41Å; E124-Y131 HydrophobicContact CG-CD2 3.6Å; E124-Y131 HydrophobicContact CG-CE2 3.87Å; E124-R134 IonicContact OE1-CZ 2.94Å; E124-R134 IonicContact OE1-NH1 3.75Å; E124-R134 PolarHBondContact OE1-NH1 3.01Å
125	S	95.5	Very high	95.3	Very high	22 Å²	22	55 Å²	55	15%	0.154	30%	0.296	C	S	.	.	H	α-helix	trans	-70.6	-48.6	176.5	-61.8	0	0	0	0	112.3	F121 L123 T128 L151	F121-S125 WeakPolarHBondContact O-CB 3.4Å; F121-S125 PolarHBondContact O-N 2.9Å; F121-S125 PolarHBondContact O-OG 3.39Å; F121-S125 VanDerWaalsContact O-OG 3.1Å; L123-S125 VanDerWaalsContact C-N 3.29Å; L123-S125 PolarHBondContact O-N 3.47Å; S125-T128 PolarHBondContact O-N 3.17Å; S125-L151 WeakPolarHBondContact O-CD2 3.47Å
126	Q	95.4	Very high	95.2	Very high	9 Å²	9	53.9 Å²	53.9	4%	0.042	29%	0.289	C	S	.	.	H	α-helix	trans	-65.1	-43.6	-177.2	-169.5	173.3	-41.5	0	0	112.4	T79 W80 S122 L123 T128 T154 E158	T79-Q126 PolarHBondContact OG1-NE2 3.28Å; T79-Q126 VanDerWaalsContact OG1-NE2 3.12Å; T79-Q126 PolarHBondContact OG1-OE1 3.39Å; W80-Q126 VanDerWaalsContact CD1-CD 3.45Å; S122-Q126 WeakPolarHBondContact O-CB 3.15Å; S122-Q126 PolarHBondContact O-N 2.8Å; L123-Q126 PolarHBondContact O-N 2.79Å; Q126-T128 PolarHBondContact O-N 3.26Å; Q126-T154 HydrophobicContact CG-CG2 4.22Å; Q126-T154 WeakPolarHBondContact CG-OG1 3.25Å; Q126-E158 PolarHBondContact NE2-OE1 3.42Å; Q126-E158 VanDerWaalsContact NE2-OE1 3.08Å
127	T	93.6	Very high	95	Very high	45 Å²	45	50.3 Å²	50.3	28%	0.276	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-0.5	-179.7	58.3	0	0	0	0	112.9	W80 L123 I129	W80-T127 HydrophobicContact CZ2-CG2 3.74Å; L123-T127 WeakPolarHBondContact O-CB 3.36Å; L123-T127 WeakPolarHBondContact O-CG2 3.47Å; L123-T127 PolarHBondContact O-N 3.44Å; L123-T127 PolarHBondContact O-OG1 2.91Å; T127-I129 PolarHBondContact O-N 2.99Å; T127-I129 VanDerWaalsContact O-N 3.09Å; T127-I129 VanDerWaalsContact OG1-CD1 3.32Å; T127-I129 WeakPolarHBondContact OG1-CD1 3.47Å; T127-I129 WeakPolarHBondContact OG1-CG1 3.44Å
128	T	93.8	Very high	94.9	Very high	118 Å²	118	59 Å²	59	72%	0.724	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	30	-176.7	73.9	0	0	0	0	113.5	E124 S125 Q126	E124-T128 PolarHBondContact O-N 2.72Å; S125-T128 PolarHBondContact O-N 3.17Å; Q126-T128 PolarHBondContact O-N 3.26Å
129	I	96.3	Very high	94.4	Very high	84 Å²	84	64.4 Å²	64.4	43%	0.431	33%	0.333	S	S	.	.			trans	-74	-47.2	172.8	-65.3	170.9	0	0	0	109.1	E124 T127 Y131	E124-I129 PolarHBondContact O-N 3.5Å; E124-I129 VanDerWaalsContact O-N 3.08Å; T127-I129 PolarHBondContact O-N 2.99Å; T127-I129 VanDerWaalsContact O-N 3.09Å; T127-I129 VanDerWaalsContact OG1-CD1 3.32Å; T127-I129 WeakPolarHBondContact OG1-CD1 3.47Å; T127-I129 WeakPolarHBondContact OG1-CG1 3.44Å; I129-Y131 HydrophobicContact CG2-CD1 3.68Å; I129-Y131 HydrophobicContact CG2-CD2 4.39Å; I129-Y131 HydrophobicContact CG2-CE1 3.3Å; I129-Y131 HydrophobicContact CG2-CE2 4.05Å; I129-Y131 HydrophobicContact CG2-CG 4.21Å; I129-Y131 VanDerWaalsContact CG2-CZ 3.49Å
130	G	92.4	Very high	94.2	Very high	49 Å²	49	62.4 Å²	62.4	51%	0.505	33%	0.326	S	S	.	.			trans	47.1	66.6	173.8	0	0	0	0	0	114.5	E124 G132	E124-G130 PolarHBondContact O-N 3.23Å; E124-G130 VanDerWaalsContact O-N 3.13Å; G130-G132 PolarHBondContact O-N 2.93Å
131	Y	93.3	Very high	94.1	Very high	164 Å²	164	64.1 Å²	64.1	64%	0.643	34%	0.34	S	S	*	.			trans	-57.8	-19.2	-178.7	-62.1	-58.4	0	0	0	113.8	E124 I129 F133	E124-Y131 VanDerWaalsContact CD-CD2 3.41Å; E124-Y131 HydrophobicContact CG-CD2 3.6Å; E124-Y131 HydrophobicContact CG-CE2 3.87Å; I129-Y131 HydrophobicContact CG2-CD1 3.68Å; I129-Y131 HydrophobicContact CG2-CD2 4.39Å; I129-Y131 HydrophobicContact CG2-CE1 3.3Å; I129-Y131 HydrophobicContact CG2-CE2 4.05Å; I129-Y131 HydrophobicContact CG2-CG 4.21Å; I129-Y131 VanDerWaalsContact CG2-CZ 3.49Å; Y131-F133 VanDerWaalsContact C-N 3.27Å; Y131-F133 PolarHBondContact O-N 2.75Å
132	G	90.7	Very high	94	Very high	47 Å²	47	69 Å²	69	49%	0.485	37%	0.366	S	S	.	.	S	Bend	trans	85.1	-8.1	176.5	0	0	0	0	0	114.3	G130 R134	G130-G132 PolarHBondContact O-N 2.93Å; G132-R134 VanDerWaalsContact C-N 3.32Å
133	F	94	Very high	93.9	Very high	119 Å²	119	69 Å²	69	52%	0.522	37%	0.366	S	S	.	.	S	Bend	trans	-67.6	-34.6	172	-177.3	-104.2	0	0	0	112	N111 Y131	N111-F133 HydrophobicContact CB-CD1 4.13Å; N111-F133 HydrophobicContact CB-CE1 3.67Å; N111-F133 HydrophobicContact CB-CZ 4.02Å; N111-F133 PolarHBondContact ND2-O 2.92Å; Y131-F133 VanDerWaalsContact C-N 3.27Å; Y131-F133 PolarHBondContact O-N 2.75Å
134	R	94.9	Very high	93.9	Very high	49 Å²	49	70.9 Å²	70.9	19%	0.185	38%	0.375	C	S	.	.	S	Bend	trans	-112.9	125.3	172.5	-62	173.1	-172.7	86.9	9	108.2	V110 N111 V112 F121 E124 G132	V110-R134 WeakPolarHBondContact O-CA 3.24Å; N111-R134 HydrophobicContact CB-CG 4.27Å; V112-R134 HydrophobicContact CG2-CG 4.32Å; F121-R134 HydrophobicContact CB-CB 4.28Å; F121-R134 HydrophobicContact CD2-CB 3.76Å; F121-R134 HydrophobicContact CG-CB 4.44Å; E124-R134 IonicContact OE1-CZ 2.94Å; E124-R134 IonicContact OE1-NH1 3.75Å; E124-R134 PolarHBondContact OE1-NH1 3.01Å; G132-R134 VanDerWaalsContact C-N 3.32Å
135	Y	94.3	Very high	94	Very high	127 Å²	127	77.4 Å²	77.4	50%	0.498	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	155.9	-179.5	64.1	-89	0	0	0	110.4	V109 V110	V109-Y135 WeakPolarHBondContact CA-O 3.36Å; V110-Y135 HydrophobicContact CB-CD1 4.15Å; V110-Y135 HydrophobicContact CB-CE1 3.81Å; V110-Y135 HydrophobicContact CB-CE2 4.22Å; V110-Y135 HydrophobicContact CB-CG 4.49Å; V110-Y135 HydrophobicContact CG1-CE1 3.92Å; V110-Y135 HydrophobicContact CG2-CD2 4.09Å; V110-Y135 HydrophobicContact CG2-CE1 4.05Å; V110-Y135 HydrophobicContact CG2-CE2 3.56Å; V110-Y135 PolarHBondContact N-O 3.49Å
136	I	95.1	Very high	94.1	Very high	44 Å²	44	77.1 Å²	77.1	23%	0.226	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	138	-179.9	-163.3	163.3	0	0	0	110.6	F121 A143 I144 L147	F121-I136 HydrophobicContact CZ-CB 4.38Å; I136-A143 HydrophobicContact CD1-CB 3.58Å; I136-A143 WeakPolarHBondContact CD1-O 3.5Å; I136-A143 HydrophobicContact CG1-CB 4.05Å; I136-I144 HydrophobicContact CD1-CB 4.38Å; I136-I144 HydrophobicContact CD1-CG1 3.89Å; I136-I144 HydrophobicContact CG1-CG1 4.36Å; I136-L147 HydrophobicContact CD1-CB 4.32Å; I136-L147 HydrophobicContact CD1-CD2 4.33Å; I136-L147 HydrophobicContact CG2-CD2 4.22Å
137	S	91.8	Very high	94.1	Very high	20 Å²	20	78.3 Å²	78.3	14%	0.14	41%	0.408	C	S	.	.			trans	-90.6	165.7	172.5	71.2	0	0	0	0	111.4	P107 C108 E139	P107-S137 VanDerWaalsContact O-CB 3.29Å; P107-S137 WeakPolarHBondContact O-CB 3.44Å; P107-S137 PolarHBondContact O-OG 2.98Å; C108-S137 PolarHBondContact O-N 3.5Å; C108-S137 PolarHBondContact O-OG 3.44Å; S137-E139 PolarHBondContact O-N 3.02Å
138	E	91.9	Very high	94.3	Very high	187 Å²	187	80 Å²	80	87%	0.874	42%	0.418	S	S	*	.	S	Bend	trans	-78.5	-6.1	178.2	-62.4	-179.7	-171.1	0	0	113.2
139	E	87.9	Confident	94.4	Very high	114 Å²	114	75.5 Å²	75.5	53%	0.533	39%	0.392	S	S	.	.	S	Bend	trans	-73.9	-31.7	-169.6	-61	-74	-174.4	0	0	113.3	T106 S137 P141	T106-E139 WeakPolarHBondContact OG1-CG 3.47Å; T106-E139 PolarHBondContact OG1-OE1 3.23Å; S137-E139 PolarHBondContact O-N 3.02Å; E139-P141 VanDerWaalsContact O-CD 3.25Å; E139-P141 WeakPolarHBondContact O-CD 3.39Å
140	C	93.4	Very high	94.4	Very high	10 Å²	10	71.5 Å²	71.5	7%	0.068	37%	0.372	C	S	.	.			trans	-115.3	93.8	-171.6	-57.1	0	0	0	0	111.2	C108 L142 A143 I144	C108-C140 WeakPolarHBondContact CA-SG 3.4Å; C108-C140 HydrophobicContact CB-CB 3.58Å; C108-C140 WeakPolarHBondContact CB-SG 3.26Å; C108-C140 WeakPolarHBondContact SG-CB 3.49Å; C108-C140 CovalentContact SG-SG 2.03Å; C108-C140 PolarHBondContact SG-SG 3.11Å; C140-L142 PolarHBondContact O-N 2.97Å; C140-L142 VanDerWaalsContact O-N 3.13Å; C140-A143 HydrophobicContact CB-CB 3.95Å; C140-A143 WeakPolarHBondContact O-CB 3.22Å; C140-A143 PolarHBondContact O-N 2.83Å; C140-I144 PolarHBondContact O-N 3.33Å
141	P	94.8	Very high	94.6	Very high	97 Å²	97	72.6 Å²	72.6	63%	0.63	37%	0.366	S	S	*	.	H	α-helix	trans	-56.1	-32	176.7	-26.8	33.7	0	0	0	113.3	E139 I144 F145	E139-P141 VanDerWaalsContact O-CD 3.25Å; E139-P141 WeakPolarHBondContact O-CD 3.39Å; P141-I144 PolarHBondContact O-N 2.63Å; P141-F145 WeakPolarHBondContact O-CB 3.33Å; P141-F145 PolarHBondContact O-N 2.71Å
142	L	95.4	Very high	94.7	Very high	107 Å²	107	68.9 Å²	68.9	56%	0.56	36%	0.36	S	S	*	.	H	α-helix	trans	-63.8	-41.3	177	-175.9	61.4	0	0	0	111.7	I90 C140 I144 F145 T146	I90-L142 HydrophobicContact CD1-CD2 4.46Å; I90-L142 HydrophobicContact CD1-CG 4.11Å; I90-L142 HydrophobicContact CG1-CD2 3.99Å; I90-L142 HydrophobicContact CG1-CG 4.19Å; C140-L142 PolarHBondContact O-N 2.97Å; C140-L142 VanDerWaalsContact O-N 3.13Å; L142-I144 VanDerWaalsContact C-N 3.31Å; L142-I144 PolarHBondContact O-N 2.98Å; L142-F145 PolarHBondContact O-N 3.16Å; L142-T146 WeakPolarHBondContact O-CB 3.27Å; L142-T146 PolarHBondContact O-N 2.83Å; L142-T146 PolarHBondContact O-OG1 2.95Å
143	A	95.4	Very high	94.9	Very high	0 Å²	0	71.5 Å²	71.5	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-63	-41.5	176	0	0	0	0	0	110.7	I90 C108 I136 C140 T146 L147	I90-A143 HydrophobicContact CG2-CB 4.11Å; C108-A143 HydrophobicContact CB-CB 4.26Å; I136-A143 HydrophobicContact CD1-CB 3.58Å; I136-A143 WeakPolarHBondContact CD1-O 3.5Å; I136-A143 HydrophobicContact CG1-CB 4.05Å; C140-A143 HydrophobicContact CB-CB 3.95Å; C140-A143 WeakPolarHBondContact O-CB 3.22Å; C140-A143 PolarHBondContact O-N 2.83Å; A143-T146 PolarHBondContact O-N 3.4Å; A143-L147 PolarHBondContact O-N 3.46Å
144	I	96.8	Very high	94.8	Very high	72 Å²	72	66 Å²	66	37%	0.369	34%	0.338	S	S	.	.	H	α-helix	trans	-64.3	-46.2	179.9	-61.2	171.7	0	0	0	109.5	I136 C140 P141 L142 T146 L147 V148	I136-I144 HydrophobicContact CD1-CB 4.38Å; I136-I144 HydrophobicContact CD1-CG1 3.89Å; I136-I144 HydrophobicContact CG1-CG1 4.36Å; C140-I144 PolarHBondContact O-N 3.33Å; P141-I144 PolarHBondContact O-N 2.63Å; L142-I144 VanDerWaalsContact C-N 3.31Å; L142-I144 PolarHBondContact O-N 2.98Å; I144-T146 PolarHBondContact O-N 3.21Å; I144-L147 PolarHBondContact O-N 3.22Å; I144-V148 WeakPolarHBondContact O-CG2 3.43Å; I144-V148 PolarHBondContact O-N 3.47Å
145	F	97.1	Very high	94.7	Very high	141 Å²	141	64.9 Å²	64.9	62%	0.618	34%	0.342	S	S	*	.	H	α-helix	trans	-60	-44.1	175.1	177.8	-96.2	0	0	0	112	P141 L142 L147 V148 A149	P141-F145 WeakPolarHBondContact O-CB 3.33Å; P141-F145 PolarHBondContact O-N 2.71Å; L142-F145 PolarHBondContact O-N 3.16Å; F145-L147 VanDerWaalsContact C-N 3.34Å; F145-L147 PolarHBondContact O-N 2.96Å; F145-V148 PolarHBondContact O-N 3.34Å; F145-A149 HydrophobicContact CE1-CB 4.46Å; F145-A149 WeakPolarHBondContact O-CB 3.3Å; F145-A149 PolarHBondContact O-N 3.44Å
146	T	97.1	Very high	94.6	Very high	16 Å²	16	64.4 Å²	64.4	10%	0.098	35%	0.347	C	S	.	.	H	α-helix	trans	-62.3	-39.6	177.2	-62.7	0	0	0	0	112.1	F83 F86 F87 I90 L142 A143 I144 A149 Q150	F83-T146 HydrophobicContact CD1-CG2 4.06Å; F83-T146 HydrophobicContact CE1-CG2 4.43Å; F86-T146 HydrophobicContact CB-CG2 4.1Å; F87-T146 HydrophobicContact CD1-CG2 4.41Å; F87-T146 HydrophobicContact CE1-CG2 3.91Å; F87-T146 HydrophobicContact CE2-CG2 4.24Å; F87-T146 HydrophobicContact CZ-CG2 3.81Å; I90-T146 HydrophobicContact CD1-CG2 4.17Å; I90-T146 WeakPolarHBondContact CD1-OG1 3.46Å; L142-T146 WeakPolarHBondContact O-CB 3.27Å; L142-T146 PolarHBondContact O-N 2.83Å; L142-T146 PolarHBondContact O-OG1 2.95Å; A143-T146 PolarHBondContact O-N 3.4Å; I144-T146 PolarHBondContact O-N 3.21Å; T146-A149 PolarHBondContact O-N 2.81Å; T146-Q150 VanDerWaalsContact O-CB 3.3Å; T146-Q150 WeakPolarHBondContact O-CB 3.35Å; T146-Q150 PolarHBondContact O-N 3.42Å
147	L	96.6	Very high	94.4	Very high	35 Å²	35	64 Å²	64	18%	0.183	35%	0.351	C	S	.	.	H	α-helix	trans	-62.2	-47.2	173.9	177.7	64.6	0	0	0	111.5	F87 I136 A143 I144 F145 A149 Q150 L151	F87-L147 HydrophobicContact CZ-CB 4.15Å; I136-L147 HydrophobicContact CD1-CB 4.32Å; I136-L147 HydrophobicContact CD1-CD2 4.33Å; I136-L147 HydrophobicContact CG2-CD2 4.22Å; A143-L147 PolarHBondContact O-N 3.46Å; I144-L147 PolarHBondContact O-N 3.22Å; F145-L147 VanDerWaalsContact C-N 3.34Å; F145-L147 PolarHBondContact O-N 2.96Å; L147-A149 PolarHBondContact O-N 3.18Å; L147-Q150 WeakPolarHBondContact O-CB 3.24Å; L147-Q150 PolarHBondContact O-N 3.36Å; L147-L151 WeakPolarHBondContact O-CG 3.43Å; L147-L151 PolarHBondContact O-N 2.96Å
148	V	96.9	Very high	94.2	Very high	81 Å²	81	65.8 Å²	65.8	49%	0.491	36%	0.357	S	S	.	.	H	α-helix	trans	-61.9	-45.7	177.1	173.7	0	0	0	0	110.8	I144 F145 Q150 L151 V152	I144-V148 WeakPolarHBondContact O-CG2 3.43Å; I144-V148 PolarHBondContact O-N 3.47Å; F145-V148 PolarHBondContact O-N 3.34Å; V148-Q150 VanDerWaalsContact C-N 3.32Å; V148-Q150 PolarHBondContact O-N 3.3Å; V148-L151 PolarHBondContact O-N 2.97Å; V148-V152 WeakPolarHBondContact O-CG2 3.47Å; V148-V152 PolarHBondContact O-N 3.41Å
149	A	96.7	Very high	94.2	Very high	22 Å²	22	62.6 Å²	62.6	18%	0.182	35%	0.345	C	S	.	.	H	α-helix	trans	-62.1	-40.2	177.5	0	0	0	0	0	111.8	F145 T146 L147 I153	F145-A149 HydrophobicContact CE1-CB 4.46Å; F145-A149 WeakPolarHBondContact O-CB 3.3Å; F145-A149 PolarHBondContact O-N 3.44Å; T146-A149 PolarHBondContact O-N 2.81Å; L147-A149 PolarHBondContact O-N 3.18Å; A149-I153 HydrophobicContact CB-CD1 4.46Å; A149-I153 VanDerWaalsContact O-CB 3.3Å; A149-I153 WeakPolarHBondContact O-CB 3.37Å; A149-I153 VanDerWaalsContact O-CG1 3.24Å; A149-I153 WeakPolarHBondContact O-CG1 2.9Å; A149-I153 PolarHBondContact O-N 3.28Å
150	Q	96.7	Very high	94.3	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-55.2	-58.5	173.8	-176.4	-179.1	8	0	0	110.2	F83 F87 S122 T146 L147 V148 V152 I153 T154	F83-Q150 HydrophobicContact CB-CG 4.08Å; F83-Q150 HydrophobicContact CD1-CB 3.53Å; F83-Q150 HydrophobicContact CD1-CG 3.78Å; F83-Q150 HydrophobicContact CD2-CB 4.27Å; F83-Q150 HydrophobicContact CD2-CG 3.73Å; F83-Q150 VanDerWaalsContact CE1-CA 3.43Å; F83-Q150 HydrophobicContact CE1-CB 3.55Å; F83-Q150 HydrophobicContact CE1-CG 4.11Å; F83-Q150 HydrophobicContact CE2-CB 4.29Å; F83-Q150 HydrophobicContact CE2-CG 4.07Å; F83-Q150 HydrophobicContact CG-CB 3.91Å; F83-Q150 HydrophobicContact CG-CG 3.58Å; F83-Q150 VanDerWaalsContact CZ-CA 3.45Å; F83-Q150 HydrophobicContact CZ-CB 3.96Å; F83-Q150 HydrophobicContact CZ-CG 4.26Å; F87-Q150 VanDerWaalsContact CE2-OE1 3.3Å; S122-Q150 PolarHBondContact O-NE2 3.46Å; S122-Q150 PolarHBondContact OG-NE2 3.47Å; T146-Q150 VanDerWaalsContact O-CB 3.3Å; T146-Q150 WeakPolarHBondContact O-CB 3.35Å; T146-Q150 PolarHBondContact O-N 3.42Å; L147-Q150 WeakPolarHBondContact O-CB 3.24Å; L147-Q150 PolarHBondContact O-N 3.36Å; V148-Q150 VanDerWaalsContact C-N 3.32Å; V148-Q150 PolarHBondContact O-N 3.3Å; Q150-V152 VanDerWaalsContact C-N 3.32Å; Q150-V152 PolarHBondContact O-N 2.89Å; Q150-I153 PolarHBondContact O-N 2.9Å; Q150-T154 HydrophobicContact CG-CG2 4.25Å; Q150-T154 WeakPolarHBondContact O-CB 3.31Å; Q150-T154 VanDerWaalsContact O-CG2 3.3Å; Q150-T154 WeakPolarHBondContact O-CG2 3.23Å; Q150-T154 PolarHBondContact O-N 3.06Å; Q150-T154 PolarHBondContact O-OG1 3.13Å
151	L	95.7	Very high	94	Very high	73 Å²	73	62.1 Å²	62.1	38%	0.382	34%	0.342	S	S	.	.	H	α-helix	trans	-59	-41.7	-176.2	-64.8	176.9	0	0	0	112.6	S125 L147 V148 G155	S125-L151 WeakPolarHBondContact O-CD2 3.47Å; L147-L151 WeakPolarHBondContact O-CG 3.43Å; L147-L151 PolarHBondContact O-N 2.96Å; V148-L151 PolarHBondContact O-N 2.97Å; L151-G155 WeakPolarHBondContact O-CA 3.24Å; L151-G155 PolarHBondContact O-N 3.16Å
152	V	95.9	Very high	93.7	Very high	85 Å²	85	60.6 Å²	60.6	52%	0.515	33%	0.33	S	S	.	.	H	α-helix	trans	-68.6	-50.1	179.8	173.8	0	0	0	0	111.5	V148 Q150 L156	V148-V152 WeakPolarHBondContact O-CG2 3.47Å; V148-V152 PolarHBondContact O-N 3.41Å; Q150-V152 VanDerWaalsContact C-N 3.32Å; Q150-V152 PolarHBondContact O-N 2.89Å; V152-L156 HydrophobicContact CG1-CD1 4.29Å; V152-L156 VanDerWaalsContact O-CG 3.3Å; V152-L156 WeakPolarHBondContact O-CG 3.44Å; V152-L156 PolarHBondContact O-N 3.34Å; V152-L156 VanDerWaalsContact O-N 3.12Å
153	I	93.6	Very high	93.6	Very high	102 Å²	102	56.8 Å²	56.8	52%	0.523	32%	0.317	S	S	.	.	H	α-helix	trans	-67.6	-45.9	-175.4	-67.4	168.6	0	0	0	110.6	F83 A149 Q150 L156 A157	F83-I153 HydrophobicContact CZ-CD1 4.43Å; A149-I153 HydrophobicContact CB-CD1 4.46Å; A149-I153 VanDerWaalsContact O-CB 3.3Å; A149-I153 WeakPolarHBondContact O-CB 3.37Å; A149-I153 VanDerWaalsContact O-CG1 3.24Å; A149-I153 WeakPolarHBondContact O-CG1 2.9Å; A149-I153 PolarHBondContact O-N 3.28Å; Q150-I153 PolarHBondContact O-N 2.9Å; I153-L156 PolarHBondContact O-N 3.3Å; I153-A157 PolarHBondContact O-N 3.27Å; I153-A157 VanDerWaalsContact O-N 3.11Å
154	T	93.7	Very high	93.3	Very high	4 Å²	4	56.9 Å²	56.9	3%	0.025	32%	0.318	C	S	.	.	H	α-helix	trans	-72.5	-37.2	-178	65.2	0	0	0	0	111	T79 F83 Q126 Q150 L156 A157 E158	T79-T154 HydrophobicContact CG2-CG2 4.19Å; F83-T154 HydrophobicContact CD2-CG2 4.22Å; F83-T154 HydrophobicContact CE2-CG2 3.85Å; Q126-T154 HydrophobicContact CG-CG2 4.22Å; Q126-T154 WeakPolarHBondContact CG-OG1 3.25Å; Q150-T154 HydrophobicContact CG-CG2 4.25Å; Q150-T154 WeakPolarHBondContact O-CB 3.31Å; Q150-T154 VanDerWaalsContact O-CG2 3.3Å; Q150-T154 WeakPolarHBondContact O-CG2 3.23Å; Q150-T154 PolarHBondContact O-N 3.06Å; Q150-T154 PolarHBondContact O-OG1 3.13Å; T154-L156 VanDerWaalsContact C-N 3.34Å; T154-L156 PolarHBondContact O-N 3.46Å; T154-A157 PolarHBondContact O-N 3.47Å; T154-A157 VanDerWaalsContact O-N 3.17Å; T154-E158 WeakPolarHBondContact O-CB 3.39Å; T154-E158 VanDerWaalsContact O-CG 3.23Å; T154-E158 WeakPolarHBondContact O-CG 3.5Å; T154-E158 PolarHBondContact O-N 3.43Å
155	G	92.8	Very high	93	Very high	25 Å²	25	56.2 Å²	56.2	26%	0.258	31%	0.312	S	S	.	.	H	α-helix	trans	-58.6	-44.2	173.8	0	0	0	0	0	112.5	L151 A157 E158 I159	L151-G155 WeakPolarHBondContact O-CA 3.24Å; L151-G155 PolarHBondContact O-N 3.16Å; G155-A157 PolarHBondContact O-N 2.9Å; G155-E158 PolarHBondContact O-N 2.89Å; G155-I159 VanDerWaalsContact O-CG1 3.3Å; G155-I159 WeakPolarHBondContact O-CG1 3.26Å; G155-I159 PolarHBondContact O-N 2.98Å
156	L	92	Very high	92.6	Very high	117 Å²	117	54.4 Å²	54.4	61%	0.613	31%	0.309	S	S	*	.	H	α-helix	trans	-62.8	-42.1	174.6	-71.5	173.1	0	0	0	112.2	V152 I153 T154 I159 F160	V152-L156 HydrophobicContact CG1-CD1 4.29Å; V152-L156 VanDerWaalsContact O-CG 3.3Å; V152-L156 WeakPolarHBondContact O-CG 3.44Å; V152-L156 PolarHBondContact O-N 3.34Å; V152-L156 VanDerWaalsContact O-N 3.12Å; I153-L156 PolarHBondContact O-N 3.3Å; T154-L156 VanDerWaalsContact C-N 3.34Å; T154-L156 PolarHBondContact O-N 3.46Å; L156-I159 PolarHBondContact O-N 2.83Å; L156-F160 PolarHBondContact O-N 2.89Å
157	A	89.8	Confident	92.2	Very high	37 Å²	37	55.1 Å²	55.1	31%	0.306	32%	0.317	S	S	.	.	H	α-helix	trans	-65.1	-40	176.8	0	0	0	0	0	112.2	I153 T154 G155 F160 V161	I153-A157 PolarHBondContact O-N 3.27Å; I153-A157 VanDerWaalsContact O-N 3.11Å; T154-A157 PolarHBondContact O-N 3.47Å; T154-A157 VanDerWaalsContact O-N 3.17Å; G155-A157 PolarHBondContact O-N 2.9Å; A157-F160 WeakPolarHBondContact O-CB 3.49Å; A157-F160 PolarHBondContact O-N 2.88Å; A157-V161 WeakPolarHBondContact O-CG2 3.29Å; A157-V161 PolarHBondContact O-N 3.32Å
158	E	88.8	Confident	91.9	Very high	56 Å²	56	54.9 Å²	54.9	26%	0.262	31%	0.314	S	S	.	.	H	α-helix	trans	-65.9	-39.5	178.6	-75.4	173.8	-164.3	0	0	112	F76 Q126 T154 G155 F160 V161 T162	F76-E158 HydrophobicContact CE1-CG 3.78Å; F76-E158 WeakPolarHBondContact CE1-OE1 3.33Å; F76-E158 HydrophobicContact CZ-CG 3.77Å; Q126-E158 PolarHBondContact NE2-OE1 3.42Å; Q126-E158 VanDerWaalsContact NE2-OE1 3.08Å; T154-E158 WeakPolarHBondContact O-CB 3.39Å; T154-E158 VanDerWaalsContact O-CG 3.23Å; T154-E158 WeakPolarHBondContact O-CG 3.5Å; T154-E158 PolarHBondContact O-N 3.43Å; G155-E158 PolarHBondContact O-N 2.89Å; E158-F160 VanDerWaalsContact C-N 3.33Å; E158-F160 PolarHBondContact O-N 3Å; E158-V161 PolarHBondContact O-N 2.99Å; E158-T162 WeakPolarHBondContact O-CB 3.44Å; E158-T162 PolarHBondContact O-N 2.95Å; E158-T162 PolarHBondContact O-OG1 3.29Å
159	I	91.7	Very high	91.3	Very high	121 Å²	121	55.8 Å²	55.8	62%	0.621	32%	0.316	S	S	*	.	H	α-helix	trans	-58.9	-46.7	172.4	-69.8	164.9	0	0	0	110.2	G155 L156 G163	G155-I159 VanDerWaalsContact O-CG1 3.3Å; G155-I159 WeakPolarHBondContact O-CG1 3.26Å; G155-I159 PolarHBondContact O-N 2.98Å; L156-I159 PolarHBondContact O-N 2.83Å; I159-G163 PolarHBondContact O-N 2.9Å
160	F	88.6	Confident	90.7	Very high	90 Å²	90	58.2 Å²	58.2	40%	0.395	34%	0.335	S	S	.	.	H	α-helix	trans	-61.7	-49.4	179.5	179.4	-95.2	0	0	0	112	W57 L156 A157 E158 G163 A164	W57-F160 HydrophobicContact CE3-CD2 4.37Å; W57-F160 AromaticContact CE3-CE2 3.72Å; W57-F160 HydrophobicContact CE3-CE2 3.72Å; W57-F160 HydrophobicContact CE3-CZ 4.06Å; W57-F160 HydrophobicContact CZ3-CD2 4.46Å; W57-F160 HydrophobicContact CZ3-CE2 4.23Å; L156-F160 PolarHBondContact O-N 2.89Å; A157-F160 WeakPolarHBondContact O-CB 3.49Å; A157-F160 PolarHBondContact O-N 2.88Å; E158-F160 VanDerWaalsContact C-N 3.33Å; E158-F160 PolarHBondContact O-N 3Å; F160-G163 PolarHBondContact O-N 3.34Å; F160-A164 WeakPolarHBondContact O-CB 3.49Å; F160-A164 PolarHBondContact O-N 3.28Å
161	V	88	Confident	90	Very high	24 Å²	24	63 Å²	63	15%	0.145	35%	0.353	C	S	.	.	H	α-helix	trans	-64.6	-44.9	-178.4	169.8	0	0	0	0	111.2	F72 A157 E158 A164 F165	F72-V161 HydrophobicContact CB-CG1 4.42Å; F72-V161 HydrophobicContact CD2-CG1 3.18Å; F72-V161 HydrophobicContact CE2-CG1 3.68Å; F72-V161 HydrophobicContact CG-CG1 4.14Å; A157-V161 WeakPolarHBondContact O-CG2 3.29Å; A157-V161 PolarHBondContact O-N 3.32Å; E158-V161 PolarHBondContact O-N 2.99Å; V161-A164 PolarHBondContact O-N 3.17Å; V161-F165 PolarHBondContact O-N 3.1Å
162	T	89.4	Confident	88.9	Confident	64 Å²	64	61.2 Å²	61.2	39%	0.393	35%	0.346	S	S	.	.	H	α-helix	trans	-65.1	-42.5	177.4	-57.1	0	0	0	0	111	E158 A164 F165 L166	E158-T162 WeakPolarHBondContact O-CB 3.44Å; E158-T162 PolarHBondContact O-N 2.95Å; E158-T162 PolarHBondContact O-OG1 3.29Å; T162-A164 VanDerWaalsContact C-N 3.35Å; T162-A164 PolarHBondContact O-N 3.46Å; T162-F165 WeakPolarHBondContact O-CB 3.2Å; T162-F165 PolarHBondContact O-N 3.48Å; T162-F165 VanDerWaalsContact O-N 3.13Å; T162-L166 HydrophobicContact CG2-CD1 4.21Å; T162-L166 HydrophobicContact CG2-CG 4.43Å; T162-L166 WeakPolarHBondContact O-CG 3.46Å; T162-L166 PolarHBondContact O-N 3.03Å
163	G	91.6	Very high	87.8	Confident	28 Å²	28	64.4 Å²	64.4	29%	0.289	35%	0.353	S	S	.	.	H	α-helix	trans	-57.8	-45.6	173.9	0	0	0	0	0	112	I159 F160 F165 L166 A167	I159-G163 PolarHBondContact O-N 2.9Å; F160-G163 PolarHBondContact O-N 3.34Å; G163-F165 VanDerWaalsContact C-N 3.29Å; G163-F165 PolarHBondContact O-N 3.18Å; G163-L166 PolarHBondContact O-N 3.35Å; G163-A167 VanDerWaalsContact O-CB 3.23Å; G163-A167 WeakPolarHBondContact O-CB 3.36Å; G163-A167 PolarHBondContact O-N 3.35Å
164	A	90.1	Very high	87	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.008	36%	0.358	C	S	.	.	H	α-helix	trans	-67	-29.3	176.9	0	0	0	0	0	113.1	W57 V60 V61 K68 F160 V161 T162 K168	W57-A164 HydrophobicContact CE3-CB 4.43Å; W57-A164 HydrophobicContact CH2-CB 4.31Å; W57-A164 HydrophobicContact CZ3-CB 3.84Å; V60-A164 HydrophobicContact CG1-CB 3.81Å; V61-A164 HydrophobicContact CG2-CB 4.37Å; K68-A164 PolarHBondContact NZ-O 3.43Å; F160-A164 WeakPolarHBondContact O-CB 3.49Å; F160-A164 PolarHBondContact O-N 3.28Å; V161-A164 PolarHBondContact O-N 3.17Å; T162-A164 VanDerWaalsContact C-N 3.35Å; T162-A164 PolarHBondContact O-N 3.46Å; A164-K168 PolarHBondContact O-N 3.41Å
165	F	90.1	Very high	86.4	Confident	58 Å²	58	66.7 Å²	66.7	25%	0.254	36%	0.359	S	S	.	.	H	α-helix	trans	-69.8	-52	173.9	-168.6	-87.4	0	0	0	111.1	W65 K68 L69 V161 T162 G163 A167 K168 L169	W65-F165 HydrophobicContact CE3-CE2 4.35Å; W65-F165 HydrophobicContact CH2-CE2 4.29Å; W65-F165 HydrophobicContact CH2-CZ 4.23Å; W65-F165 AromaticContact CZ3-CD2 3.92Å; W65-F165 HydrophobicContact CZ3-CD2 3.92Å; W65-F165 HydrophobicContact CZ3-CE1 4.43Å; W65-F165 AromaticContact CZ3-CE2 3.47Å; W65-F165 HydrophobicContact CZ3-CE2 3.47Å; W65-F165 VanDerWaalsContact CZ3-CE2 3.47Å; W65-F165 AromaticContact CZ3-CZ 3.74Å; W65-F165 HydrophobicContact CZ3-CZ 3.74Å; K68-F165 HydrophobicContact CD-CD2 4.15Å; K68-F165 HydrophobicContact CG-CD2 4.41Å; L69-F165 HydrophobicContact CD2-CE2 4.03Å; V161-F165 PolarHBondContact O-N 3.1Å; T162-F165 WeakPolarHBondContact O-CB 3.2Å; T162-F165 PolarHBondContact O-N 3.48Å; T162-F165 VanDerWaalsContact O-N 3.13Å; G163-F165 VanDerWaalsContact C-N 3.29Å; G163-F165 PolarHBondContact O-N 3.18Å; F165-A167 PolarHBondContact O-N 2.8Å; F165-K168 PolarHBondContact O-N 2.6Å; F165-K168 VanDerWaalsContact O-N 3.16Å; F165-L169 HydrophobicContact CD1-CD1 3.76Å; F165-L169 HydrophobicContact CD1-CG 4.28Å; F165-L169 HydrophobicContact CE1-CD1 3.52Å; F165-L169 HydrophobicContact CE1-CG 4.15Å; F165-L169 PolarHBondContact O-N 3.18Å
166	L	89.2	Confident	85.8	Confident	103 Å²	103	66.2 Å²	66.2	54%	0.539	35%	0.353	S	S	.	.	H	α-helix	trans	-60.7	-42.7	177.2	-69.4	177	0	0	0	111.9	T162 G163 K168 L169 A170	T162-L166 HydrophobicContact CG2-CD1 4.21Å; T162-L166 HydrophobicContact CG2-CG 4.43Å; T162-L166 WeakPolarHBondContact O-CG 3.46Å; T162-L166 PolarHBondContact O-N 3.03Å; G163-L166 PolarHBondContact O-N 3.35Å; L166-K168 VanDerWaalsContact C-N 3.27Å; L166-K168 PolarHBondContact O-N 3.1Å; L166-L169 PolarHBondContact O-N 3.24Å; L166-L169 VanDerWaalsContact O-N 3.13Å; L166-A170 WeakPolarHBondContact O-CB 3.5Å; L166-A170 PolarHBondContact O-N 3.06Å
167	A	89.3	Confident	85.4	Confident	32 Å²	32	66.4 Å²	66.4	26%	0.264	35%	0.35	S	S	.	.	H	α-helix	trans	-58.4	-39	176.3	0	0	0	0	0	112	W57 V61 G163 F165 R171	W57-A167 HydrophobicContact CH2-CB 4.15Å; W57-A167 HydrophobicContact CZ2-CB 3.86Å; V61-A167 HydrophobicContact CG1-CB 4.25Å; V61-A167 HydrophobicContact CG2-CB 4.21Å; G163-A167 VanDerWaalsContact O-CB 3.23Å; G163-A167 WeakPolarHBondContact O-CB 3.36Å; G163-A167 PolarHBondContact O-N 3.35Å; F165-A167 PolarHBondContact O-N 2.8Å; A167-R171 WeakPolarHBondContact O-CG 3.32Å; A167-R171 PolarHBondContact O-N 2.96Å
168	K	88.9	Confident	85.2	Confident	30 Å²	30	66.4 Å²	66.4	13%	0.13	35%	0.347	C	S	.	.	H	α-helix	trans	-71.6	-38	176.4	-169.1	-176.8	-167.9	79.2	0	112.3	V61 D62 M63 W65 K68 A164 F165 L166 A170 R171	V61-K168 HydrophobicContact CG1-CB 4.2Å; V61-K168 WeakPolarHBondContact O-CD 3.37Å; V61-K168 WeakPolarHBondContact O-CG 3.48Å; V61-K168 PolarHBondContact O-NZ 3.43Å; D62-K168 PolarHBondContact O-NZ 3.49Å; D62-K168 VanDerWaalsContact O-NZ 3.16Å; M63-K168 WeakPolarHBondContact O-CE 3.32Å; M63-K168 PolarHBondContact O-NZ 2.74Å; W65-K168 HydrophobicContact CD2-CD 4.24Å; W65-K168 HydrophobicContact CE3-CD 4.49Å; W65-K168 HydrophobicContact CH2-CB 4.49Å; W65-K168 HydrophobicContact CH2-CD 4.18Å; W65-K168 HydrophobicContact CH2-CG 4.42Å; W65-K168 HydrophobicContact CZ2-CD 3.93Å; W65-K168 HydrophobicContact CZ2-CG 4.09Å; W65-K168 HydrophobicContact CZ3-CD 4.45Å; K68-K168 HydrophobicContact CD-CD 3.97Å; A164-K168 PolarHBondContact O-N 3.41Å; F165-K168 PolarHBondContact O-N 2.6Å; F165-K168 VanDerWaalsContact O-N 3.16Å; L166-K168 VanDerWaalsContact C-N 3.27Å; L166-K168 PolarHBondContact O-N 3.1Å; K168-A170 VanDerWaalsContact C-N 3.31Å; K168-R171 WeakPolarHBondContact O-CB 3.42Å; K168-R171 PolarHBondContact O-N 2.86Å
169	L	85.6	Confident	85.3	Confident	100 Å²	100	64.3 Å²	64.3	52%	0.524	34%	0.337	S	S	.	.	H	α-helix	trans	-63.5	-38.3	174.9	-75	177	0	0	0	112.1	W65 F165 L166 R171	W65-L169 HydrophobicContact CH2-CD2 3.5Å; W65-L169 HydrophobicContact CH2-CG 3.81Å; W65-L169 HydrophobicContact CZ2-CD2 3.66Å; W65-L169 HydrophobicContact CZ2-CG 4.31Å; F165-L169 HydrophobicContact CD1-CD1 3.76Å; F165-L169 HydrophobicContact CD1-CG 4.28Å; F165-L169 HydrophobicContact CE1-CD1 3.52Å; F165-L169 HydrophobicContact CE1-CG 4.15Å; F165-L169 PolarHBondContact O-N 3.18Å; L166-L169 PolarHBondContact O-N 3.24Å; L166-L169 VanDerWaalsContact O-N 3.13Å; L169-R171 PolarHBondContact O-N 2.97Å
170	A	84	Confident	85.4	Confident	72 Å²	72	61.5 Å²	61.5	60%	0.595	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-11.3	178.6	0	0	0	0	0	113.6	L166 K168	L166-A170 WeakPolarHBondContact O-CB 3.5Å; L166-A170 PolarHBondContact O-N 3.06Å; K168-A170 VanDerWaalsContact C-N 3.31Å
171	R	81.1	Confident	85.7	Confident	100 Å²	100	57.9 Å²	57.9	38%	0.377	30%	0.304	S	S	.	.			trans	-66.6	132.2	-178	-76.4	-174.3	-179.8	-139.8	10.1	111.5	D62 A167 K168 L169 K173	D62-R171 VanDerWaalsContact CG-NH2 3.31Å; D62-R171 IonicContact OD1-CZ 3.98Å; D62-R171 IonicContact OD1-NH1 2.74Å; D62-R171 PolarHBondContact OD1-NH1 2.89Å; D62-R171 IonicContact OD1-NH2 3.69Å; D62-R171 PolarHBondContact OD1-NH2 3.13Å; D62-R171 IonicContact OD2-CZ 3.76Å; D62-R171 IonicContact OD2-NH1 2.77Å; D62-R171 PolarHBondContact OD2-NH1 3.42Å; D62-R171 IonicContact OD2-NH2 3.19Å; D62-R171 PolarHBondContact OD2-NH2 3.39Å; A167-R171 WeakPolarHBondContact O-CG 3.32Å; A167-R171 PolarHBondContact O-N 2.96Å; K168-R171 WeakPolarHBondContact O-CB 3.42Å; K168-R171 PolarHBondContact O-N 2.86Å; L169-R171 PolarHBondContact O-N 2.97Å; R171-K173 PolarHBondContact O-N 2.85Å
172	P	72.8	Confident	86.1	Confident	36 Å²	36	56.8 Å²	56.8	23%	0.234	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	11.4	-176.2	33.6	-38.7	0	0	0	114.3	K174 R175 A176 M288 T294 C295	P172-K174 VanDerWaalsContact C-N 3.27Å; P172-K174 PolarHBondContact O-N 2.99Å; P172-R175 WeakPolarHBondContact O-CA 3.46Å; P172-R175 WeakPolarHBondContact O-CB 3.31Å; P172-R175 PolarHBondContact O-N 3.33Å; P172-A176 PolarHBondContact O-N 3.47Å; P172-M288 HydrophobicContact CB-CE 3.38Å; P172-M288 HydrophobicContact CB-SD 4.09Å; P172-T294 VanDerWaalsContact CG-O 3.31Å; P172-T294 WeakPolarHBondContact CG-O 3.49Å; P172-C295 HydrophobicContact CB-CB 4.16Å
173	K	73.2	Confident	86.3	Confident	153 Å²	153	58.7 Å²	58.7	67%	0.665	30%	0.302	S	S	*	.	H	α-helix	trans	-58.1	-39.2	-171	-171.4	172.9	-178.3	174.1	0	112.6	R171 R175 A176	R171-K173 PolarHBondContact O-N 2.85Å; K173-R175 PolarHBondContact O-N 2.92Å; K173-A176 PolarHBondContact O-N 3.12Å
174	K	75.5	Confident	86.5	Confident	142 Å²	142	58.8 Å²	58.8	62%	0.617	30%	0.297	S	S	*	.	H	α-helix	trans	-69.8	-19.9	176.1	-69.3	-53.4	-166.3	-178.7	0	113.8	P172 E177	P172-K174 VanDerWaalsContact C-N 3.27Å; P172-K174 PolarHBondContact O-N 2.99Å; K174-E177 WeakPolarHBondContact CD-OE2 3.31Å; K174-E177 IonicContact NZ-OE1 3.38Å; K174-E177 PolarHBondContact NZ-OE1 3.44Å; K174-E177 IonicContact NZ-OE2 3.26Å; K174-E177 PolarHBondContact NZ-OE2 3.24Å
175	R	81.6	Confident	86.8	Confident	11 Å²	11	58.8 Å²	58.8	4%	0.042	30%	0.297	C	S	.	.	H	α-helix	trans	-72.2	-41	173.2	-169.8	77.7	165.3	104.9	4.7	111.6	P172 K173 E177 T178 N202 S206 L208 M288	P172-R175 WeakPolarHBondContact O-CA 3.46Å; P172-R175 WeakPolarHBondContact O-CB 3.31Å; P172-R175 PolarHBondContact O-N 3.33Å; K173-R175 PolarHBondContact O-N 2.92Å; R175-E177 PolarHBondContact O-N 3Å; R175-T178 PolarHBondContact NH1-OG1 3.01Å; R175-T178 WeakPolarHBondContact O-CA 3.34Å; R175-T178 WeakPolarHBondContact O-CB 3.22Å; R175-T178 PolarHBondContact O-N 2.94Å; R175-T178 PolarHBondContact O-OG1 3.4Å; R175-N202 PolarHBondContact NH1-OD1 2.93Å; R175-N202 PolarHBondContact NH2-OD1 3.03Å; R175-S206 PolarHBondContact NH2-O 3.12Å; R175-S206 PolarHBondContact NH2-OG 3.35Å; R175-L208 HydrophobicContact CG-CD2 4.46Å; R175-M288 HydrophobicContact CB-SD 3.46Å; R175-M288 WeakPolarHBondContact CB-SD 3.21Å; R175-M288 HydrophobicContact CG-CG 3.88Å; R175-M288 HydrophobicContact CG-SD 3.32Å; R175-M288 WeakPolarHBondContact CG-SD 3.32Å
176	A	80.4	Confident	87.1	Confident	16 Å²	16	56 Å²	56	13%	0.132	29%	0.285	C	S	.	.	H	α-helix	trans	-57.8	-35.5	179.6	0	0	0	0	0	112.1	P172 K173 T178 I179 Q296 S297	P172-A176 PolarHBondContact O-N 3.47Å; K173-A176 PolarHBondContact O-N 3.12Å; A176-T178 PolarHBondContact O-N 3.45Å; A176-I179 PolarHBondContact O-N 3.37Å; A176-I179 VanDerWaalsContact O-N 3.15Å; A176-Q296 VanDerWaalsContact CB-O 3.24Å; A176-Q296 WeakPolarHBondContact CB-O 3.16Å; A176-S297 PolarHBondContact O-OG 3.06Å; A176-S297 VanDerWaalsContact O-OG 3.11Å
177	E	83.3	Confident	87.4	Confident	121 Å²	121	51.2 Å²	51.2	57%	0.565	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-17.7	174.2	-63.9	173.6	-166.8	0	0	113.4	K174 R175 I179	K174-E177 WeakPolarHBondContact CD-OE2 3.31Å; K174-E177 IonicContact NZ-OE1 3.38Å; K174-E177 PolarHBondContact NZ-OE1 3.44Å; K174-E177 IonicContact NZ-OE2 3.26Å; K174-E177 PolarHBondContact NZ-OE2 3.24Å; R175-E177 PolarHBondContact O-N 3Å; E177-I179 VanDerWaalsContact C-N 3.33Å
178	T	86.6	Confident	87.7	Confident	37 Å²	37	50 Å²	50	23%	0.227	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-0.3	177	67.2	0	0	0	0	113.6	R175 A176 M203	R175-T178 PolarHBondContact NH1-OG1 3.01Å; R175-T178 WeakPolarHBondContact O-CA 3.34Å; R175-T178 WeakPolarHBondContact O-CB 3.22Å; R175-T178 PolarHBondContact O-N 2.94Å; R175-T178 PolarHBondContact O-OG1 3.4Å; A176-T178 PolarHBondContact O-N 3.45Å; T178-M203 VanDerWaalsContact O-CB 3.26Å; T178-M203 WeakPolarHBondContact O-CB 3.25Å; T178-M203 WeakPolarHBondContact O-CG 3.27Å; T178-M203 PolarHBondContact O-N 3.35Å
179	I	90.9	Very high	87.8	Confident	11 Å²	11	57.8 Å²	57.8	6%	0.056	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	117.5	176.3	-57.2	176.3	0	0	0	106.9	A176 E177 F181 V200 A201 L208 L284	A176-I179 PolarHBondContact O-N 3.37Å; A176-I179 VanDerWaalsContact O-N 3.15Å; E177-I179 VanDerWaalsContact C-N 3.33Å; I179-F181 HydrophobicContact CG2-CE2 4.39Å; I179-V200 HydrophobicContact CG2-CG1 3.89Å; I179-A201 CarbonylContact C-O 3.58Å; I179-A201 WeakPolarHBondContact CA-O 3.36Å; I179-L208 HydrophobicContact CD1-CD1 3.53Å; I179-L208 HydrophobicContact CG1-CD1 3.88Å; I179-L284 HydrophobicContact CD1-CD2 4Å; I179-L284 HydrophobicContact CG2-CD2 3.61Å
180	K	92.5	Very high	88	Confident	63 Å²	63	55.5 Å²	55.5	27%	0.274	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	129.9	-178.2	-170.5	-179.2	175.6	-168.6	0	109.8	V200 A201 M203 F331 D332	K180-V200 CarbonylContact O-C 3.56Å; K180-V200 WeakPolarHBondContact O-CA 3.08Å; K180-A201 PolarHBondContact N-O 2.77Å; K180-A201 PolarHBondContact O-N 3.01Å; K180-M203 HydrophobicContact CB-CG 4.15Å; K180-M203 HydrophobicContact CB-SD 4.23Å; K180-M203 HydrophobicContact CD-SD 4.41Å; K180-F331 HydrophobicContact CB-CE1 4.5Å; K180-F331 HydrophobicContact CB-CZ 4.46Å; K180-F331 HydrophobicContact CD-CD1 3.91Å; K180-F331 HydrophobicContact CD-CE1 3.76Å; K180-F331 HydrophobicContact CD-CZ 4.44Å; K180-F331 HydrophobicContact CG-CD1 4.45Å; K180-F331 HydrophobicContact CG-CE1 3.79Å; K180-F331 HydrophobicContact CG-CZ 4.23Å; K180-D332 IonicContact NZ-OD2 3.14Å; K180-D332 PolarHBondContact NZ-OD2 3.27Å
181	F	95.4	Very high	88.2	Confident	14 Å²	14	59.6 Å²	59.6	6%	0.061	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	152.8	167	-64.1	-88.7	0	0	0	110.1	I179 V198 R199 V200 L213 I282 L284 T299	I179-F181 HydrophobicContact CG2-CE2 4.39Å; F181-V198 HydrophobicContact CD1-CG1 4.37Å; F181-R199 CarbonylContact C-O 3.47Å; F181-R199 WeakPolarHBondContact CA-O 3.01Å; F181-V200 HydrophobicContact CD1-CG1 4.36Å; F181-V200 HydrophobicContact CD1-CG2 3.7Å; F181-V200 HydrophobicContact CE1-CG1 4.2Å; F181-V200 HydrophobicContact CE1-CG2 3.82Å; F181-L213 HydrophobicContact CE1-CD1 3.93Å; F181-I282 HydrophobicContact CD1-CG2 4.33Å; F181-I282 HydrophobicContact CE1-CG2 3.88Å; F181-L284 HydrophobicContact CE1-CB 4.19Å; F181-L284 HydrophobicContact CZ-CB 3.75Å; F181-T299 HydrophobicContact CB-CG2 3.64Å; F181-T299 HydrophobicContact CD1-CG2 3.62Å; F181-T299 HydrophobicContact CD2-CG2 3.74Å; F181-T299 HydrophobicContact CE1-CG2 4.19Å; F181-T299 HydrophobicContact CE2-CG2 4.27Å; F181-T299 HydrophobicContact CG-CG2 3.38Å; F181-T299 HydrophobicContact CZ-CG2 4.48Å
182	S	95.9	Very high	88.5	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.007	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-58.1	144.9	169.4	49.6	0	0	0	0	111	V184 R199 Y301	S182-V184 VanDerWaalsContact C-N 3.27Å; S182-V184 VanDerWaalsContact CB-O 3.24Å; S182-V184 WeakPolarHBondContact CB-O 3.37Å; S182-V184 PolarHBondContact O-N 2.97Å; S182-V184 PolarHBondContact OG-O 3.18Å; S182-R199 PolarHBondContact N-O 2.84Å; S182-R199 PolarHBondContact OG-N 3.33Å; S182-Y301 WeakPolarHBondContact O-CE1 3.2Å; S182-Y301 PolarHBondContact O-OH 3.49Å; S182-Y301 PolarHBondContact OG-OH 2.92Å
183	Q	94.5	Very high	89.4	Confident	103 Å²	103	62.1 Å²	62.1	48%	0.481	30%	0.301	S	S	.	.	S	Bend	trans	-64.7	-36.4	177.6	-68.9	-58.2	-47.5	0	0	112.2	K34 D332	K34-Q183 PolarHBondContact NZ-O 3.08Å; Q183-D332 PolarHBondContact N-OD1 2.75Å
184	V	95.9	Very high	90.4	Very high	31 Å²	31	57 Å²	57	19%	0.188	28%	0.28	C	S	.	.	S	Bend	trans	-115	155.5	177.7	-62.8	0	0	0	0	110.8	S182 E305 L307 F312 I334	S182-V184 VanDerWaalsContact C-N 3.27Å; S182-V184 VanDerWaalsContact CB-O 3.24Å; S182-V184 WeakPolarHBondContact CB-O 3.37Å; S182-V184 PolarHBondContact O-N 2.97Å; S182-V184 PolarHBondContact OG-O 3.18Å; V184-E305 CarbonylContact C-O 3.36Å; V184-E305 VanDerWaalsContact CA-O 3.26Å; V184-E305 WeakPolarHBondContact CA-O 3.38Å; V184-E305 WeakPolarHBondContact CB-O 3.3Å; V184-L307 HydrophobicContact CB-CD1 4.12Å; V184-L307 HydrophobicContact CB-CG 4.38Å; V184-L307 HydrophobicContact CG1-CD1 4.1Å; V184-L307 HydrophobicContact CG1-CG 4.49Å; V184-L307 HydrophobicContact CG2-CD1 4.05Å; V184-F312 HydrophobicContact CG2-CE1 4.49Å; V184-F312 WeakPolarHBondContact O-CZ 3.29Å; V184-I334 HydrophobicContact CG2-CG2 4.05Å
185	A	96.7	Very high	91.4	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	153.1	163.1	0	0	0	0	0	108.6	L196 M197 V198 Y301 E305 I306 L307	A185-L196 HydrophobicContact CB-CD1 3.9Å; A185-M197 WeakPolarHBondContact CA-O 3.47Å; A185-V198 HydrophobicContact CB-CG2 3.85Å; A185-Y301 HydrophobicContact CB-CD1 3.87Å; A185-Y301 HydrophobicContact CB-CD2 4.5Å; A185-Y301 HydrophobicContact CB-CE1 4.08Å; A185-Y301 HydrophobicContact CB-CG 4.11Å; A185-E305 PolarHBondContact N-O 2.91Å; A185-I306 HydrophobicContact CB-CG1 4.27Å; A185-I306 CarbonylContact O-C 3.51Å; A185-I306 WeakPolarHBondContact O-CA 3.48Å; A185-L307 PolarHBondContact O-N 2.64Å
186	V	96.3	Very high	92.1	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	146.2	-179.6	-56.7	0	0	0	0	111.1	L196 M197 L307 Y310 F312 I334	V186-L196 CarbonylContact O-C 3.55Å; V186-L196 WeakPolarHBondContact O-CA 3.24Å; V186-M197 HydrophobicContact CG2-CB 3.83Å; V186-M197 PolarHBondContact N-O 3.44Å; V186-M197 PolarHBondContact O-N 2.79Å; V186-L307 CarbonylContact C-O 3.59Å; V186-L307 VanDerWaalsContact CA-O 3.29Å; V186-L307 WeakPolarHBondContact CA-O 3.4Å; V186-L307 HydrophobicContact CG1-CB 4.48Å; V186-Y310 WeakPolarHBondContact CB-O 3.36Å; V186-Y310 WeakPolarHBondContact CG2-O 3.25Å; V186-F312 HydrophobicContact CG1-CE1 4.22Å; V186-F312 HydrophobicContact CG1-CE2 4.4Å; V186-F312 HydrophobicContact CG1-CZ 4.11Å; V186-F312 HydrophobicContact CG2-CD2 3.73Å; V186-F312 HydrophobicContact CG2-CE2 3.6Å; V186-F312 HydrophobicContact CG2-CG 4.38Å; V186-F312 HydrophobicContact CG2-CZ 4.15Å; V186-I334 HydrophobicContact CG1-CB 4.44Å; V186-I334 HydrophobicContact CG1-CG2 3.67Å
187	I	96.1	Very high	92.8	Very high	2 Å²	2	50 Å²	50	1%	0.01	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	117.7	173.7	-63.6	172.6	0	0	0	108.1	L194 C195 L196 I259 L273 I306 L307 W308 G309	I187-L194 HydrophobicContact CG2-CD1 3.61Å; I187-L194 HydrophobicContact CG2-CD2 4.27Å; I187-L194 HydrophobicContact CG2-CG 3.86Å; I187-C195 WeakPolarHBondContact CA-O 3.28Å; I187-L196 HydrophobicContact CD1-CD1 4.19Å; I187-L196 HydrophobicContact CG1-CB 4.34Å; I187-L196 HydrophobicContact CG1-CD1 3.55Å; I187-I259 HydrophobicContact CD1-CD1 4.36Å; I187-I259 HydrophobicContact CG2-CD1 4.32Å; I187-L273 HydrophobicContact CD1-CD2 4.47Å; I187-I306 HydrophobicContact CD1-CG2 3.62Å; I187-I306 HydrophobicContact CG1-CG2 3.8Å; I187-L307 PolarHBondContact N-O 3.06Å; I187-W308 HydrophobicContact CB-CD2 4.24Å; I187-W308 HydrophobicContact CB-CE3 4.14Å; I187-W308 HydrophobicContact CD1-CE3 3.61Å; I187-W308 HydrophobicContact CD1-CZ3 3.79Å; I187-W308 HydrophobicContact CG1-CE3 4.47Å; I187-W308 HydrophobicContact CG2-CD2 3.97Å; I187-W308 HydrophobicContact CG2-CE3 3.93Å; I187-W308 HydrophobicContact CG2-CH2 4.22Å; I187-W308 HydrophobicContact CG2-CZ2 4.25Å; I187-W308 HydrophobicContact CG2-CZ3 4.05Å; I187-G309 WeakPolarHBondContact O-CA 3.38Å; I187-G309 PolarHBondContact O-N 3.35Å
188	C	94.3	Very high	93.4	Very high	8 Å²	8	44.2 Å²	44.2	5%	0.054	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	174.7	176.5	66.6	0	0	0	0	111.2	C195 M197 Y310 E311	C188-C195 PolarHBondContact N-O 3.5Å; C188-C195 VanDerWaalsContact N-O 3.07Å; C188-C195 PolarHBondContact O-N 3.41Å; C188-M197 WeakPolarHBondContact SG-CE 3.19Å; C188-Y310 WeakPolarHBondContact CB-O 3.46Å; C188-E311 HydrophobicContact CB-CG 3.64Å
189	R	92.3	Very high	93.7	Very high	193 Å²	193	43 Å²	43	73%	0.728	21%	0.212	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	117	174	-77.4	-171	172.6	-164.1	-1.7	109.8	K193 L194	R189-K193 CarbonylContact C-O 3.56Å; R189-K193 VanDerWaalsContact CA-O 3.29Å; R189-K193 WeakPolarHBondContact CA-O 3.24Å; R189-L194 HydrophobicContact CG-CD1 4.35Å
190	H	89.1	Confident	93.9	Very high	51 Å²	51	42.4 Å²	42.4	24%	0.236	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	126.1	174.7	-171	59.9	0	0	0	109.7	G192 K193 C195 M197 D241	H190-G192 PolarHBondContact O-N 2.95Å; H190-G192 VanDerWaalsContact O-N 3.13Å; H190-K193 PolarHBondContact N-O 3.5Å; H190-K193 PolarHBondContact O-N 3.39Å; H190-C195 HydrophobicContact CB-CB 4.31Å; H190-M197 HydrophobicContact CB-CE 3.5Å; H190-M197 VanDerWaalsContact CB-CE 3.5Å; H190-D241 IonicContact CD2-OD1 3.87Å; H190-D241 IonicContact CE1-OD2 3.94Å; H190-D241 IonicContact NE2-OD1 2.81Å; H190-D241 PolarHBondContact NE2-OD1 3.25Å; H190-D241 IonicContact NE2-OD2 3.28Å; H190-D241 PolarHBondContact NE2-OD2 2.95Å
191	Q	87.1	Confident	93.8	Very high	158 Å²	158	39.5 Å²	39.5	74%	0.738	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	50	38.9	-177.6	-57.6	179.4	2.9	0	0	113.5	K193	Q191-K193 VanDerWaalsContact C-N 3.26Å; Q191-K193 PolarHBondContact O-N 3.3Å
192	G	88.2	Confident	93.6	Very high	69 Å²	69	39.2 Å²	39.2	71%	0.711	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.6	-2.1	179.2	0	0	0	0	0	115.5	H190	H190-G192 PolarHBondContact O-N 2.95Å; H190-G192 VanDerWaalsContact O-N 3.13Å
193	K	92.4	Very high	93.1	Very high	120 Å²	120	43.6 Å²	43.6	52%	0.522	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	148.2	176.6	-61.4	-177.4	-176.8	178.2	0	110.9	R189 H190 Q191 I258	R189-K193 CarbonylContact C-O 3.56Å; R189-K193 VanDerWaalsContact CA-O 3.29Å; R189-K193 WeakPolarHBondContact CA-O 3.24Å; H190-K193 PolarHBondContact N-O 3.5Å; H190-K193 PolarHBondContact O-N 3.39Å; Q191-K193 VanDerWaalsContact C-N 3.26Å; Q191-K193 PolarHBondContact O-N 3.3Å; K193-I258 HydrophobicContact CB-CG2 4.2Å; K193-I258 HydrophobicContact CD-CD1 4.25Å; K193-I258 HydrophobicContact CD-CG2 3.88Å
194	L	94.3	Very high	92.6	Very high	45 Å²	45	46 Å²	46	24%	0.236	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	124.6	173.6	-170.5	72.8	0	0	0	109.1	I187 R189 I259 W308	I187-L194 HydrophobicContact CG2-CD1 3.61Å; I187-L194 HydrophobicContact CG2-CD2 4.27Å; I187-L194 HydrophobicContact CG2-CG 3.86Å; R189-L194 HydrophobicContact CG-CD1 4.35Å; L194-I259 HydrophobicContact CD2-CB 4.35Å; L194-I259 HydrophobicContact CD2-CD1 4.11Å; L194-I259 HydrophobicContact CG-CD1 4.26Å; L194-I259 PolarHBondContact O-N 3.46Å; L194-W308 HydrophobicContact CD1-CH2 4.47Å; L194-W308 HydrophobicContact CD1-CZ2 3.94Å; L194-W308 HydrophobicContact CD2-CH2 3.57Å; L194-W308 HydrophobicContact CD2-CZ2 3.79Å
195	C	95.3	Very high	91.8	Very high	2 Å²	2	54.3 Å²	54.3	1%	0.014	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	136.3	-173.9	-67.1	0	0	0	0	111.2	I187 C188 H190 M197 Y256 H257	I187-C195 WeakPolarHBondContact CA-O 3.28Å; C188-C195 PolarHBondContact N-O 3.5Å; C188-C195 VanDerWaalsContact N-O 3.07Å; C188-C195 PolarHBondContact O-N 3.41Å; H190-C195 HydrophobicContact CB-CB 4.31Å; C195-M197 HydrophobicContact CB-CE 4.3Å; C195-Y256 HydrophobicContact CB-CD2 4.48Å; C195-H257 CarbonylContact C-O 3.57Å; C195-H257 VanDerWaalsContact CA-O 3.22Å; C195-H257 WeakPolarHBondContact CA-O 3.49Å
196	L	95.9	Very high	91.3	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.005	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	124.1	165.7	175.9	72.4	0	0	0	108.9	A185 V186 I187 F238 Y256 H257 I259 L265 L280 I306	A185-L196 HydrophobicContact CB-CD1 3.9Å; V186-L196 CarbonylContact O-C 3.55Å; V186-L196 WeakPolarHBondContact O-CA 3.24Å; I187-L196 HydrophobicContact CD1-CD1 4.19Å; I187-L196 HydrophobicContact CG1-CB 4.34Å; I187-L196 HydrophobicContact CG1-CD1 3.55Å; L196-F238 HydrophobicContact CD2-CZ 4.21Å; L196-Y256 CarbonylContact O-C 3.55Å; L196-Y256 WeakPolarHBondContact O-CA 3.35Å; L196-H257 HydrophobicContact CB-CB 4.43Å; L196-H257 PolarHBondContact N-O 2.91Å; L196-H257 PolarHBondContact O-N 3.08Å; L196-I259 HydrophobicContact CB-CD1 4.26Å; L196-L265 HydrophobicContact CD2-CD1 3.79Å; L196-L280 HydrophobicContact CD2-CD2 3.35Å; L196-I306 HydrophobicContact CD1-CG2 3.71Å
197	M	95.7	Very high	90.7	Very high	19 Å²	19	57.6 Å²	57.6	9%	0.094	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	139	-176.3	-59.3	-168.6	175.4	0	0	112.3	A185 V186 C188 H190 C195 T254 F255 F312	A185-M197 WeakPolarHBondContact CA-O 3.47Å; V186-M197 HydrophobicContact CG2-CB 3.83Å; V186-M197 PolarHBondContact N-O 3.44Å; V186-M197 PolarHBondContact O-N 2.79Å; C188-M197 WeakPolarHBondContact SG-CE 3.19Å; H190-M197 HydrophobicContact CB-CE 3.5Å; H190-M197 VanDerWaalsContact CB-CE 3.5Å; C195-M197 HydrophobicContact CB-CE 4.3Å; M197-T254 HydrophobicContact CB-CG2 3.79Å; M197-T254 HydrophobicContact CG-CG2 4.22Å; M197-T254 HydrophobicContact SD-CG2 3.96Å; M197-F255 CarbonylContact C-O 3.52Å; M197-F255 VanDerWaalsContact CA-O 3.3Å; M197-F255 WeakPolarHBondContact CA-O 3.45Å; M197-F312 HydrophobicContact CB-CD2 4.41Å; M197-F312 HydrophobicContact CB-CE2 4.09Å
198	V	96	Very high	90.2	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	133	175.1	174.6	0	0	0	0	108.7	F181 A185 V200 F238 F255 Y301	F181-V198 HydrophobicContact CD1-CG1 4.37Å; A185-V198 HydrophobicContact CB-CG2 3.85Å; V198-V200 HydrophobicContact CG1-CG2 4.33Å; V198-F238 HydrophobicContact CG2-CE1 4.13Å; V198-F255 PolarHBondContact N-O 3.48Å; V198-F255 PolarHBondContact O-N 2.97Å; V198-Y301 HydrophobicContact CG1-CE2 4.07Å; V198-Y301 VanDerWaalsContact CG1-OH 3.27Å; V198-Y301 WeakPolarHBondContact CG1-OH 3.49Å; V198-Y301 HydrophobicContact CG2-CE2 3.94Å
199	R	94	Very high	89.7	Confident	11 Å²	11	61.3 Å²	61.3	4%	0.042	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	138.2	177.7	-172.3	179.8	-78.4	175.7	-17.9	110.9	F181 S182 P252 L253 F312 T313 V315 F330 F331	F181-R199 CarbonylContact C-O 3.47Å; F181-R199 WeakPolarHBondContact CA-O 3.01Å; S182-R199 PolarHBondContact N-O 2.84Å; S182-R199 PolarHBondContact OG-N 3.33Å; R199-P252 HydrophobicContact CG-CB 4.35Å; R199-L253 WeakPolarHBondContact CA-O 3.32Å; R199-F312 HydrophobicContact CB-CD2 4.39Å; R199-F312 HydrophobicContact CB-CE1 4.48Å; R199-F312 HydrophobicContact CB-CE2 4.15Å; R199-F312 HydrophobicContact CB-CZ 4.21Å; R199-T313 PolarHBondContact NH1-O 3.26Å; R199-T313 VanDerWaalsContact NH1-O 3.09Å; R199-T313 PolarHBondContact NH2-O 2.73Å; R199-V315 VanDerWaalsContact NH1-CG1 3.28Å; R199-F330 PolarHBondContact NH1-O 3.39Å; R199-F331 HydrophobicContact CB-CE2 4.45Å; R199-F331 HydrophobicContact CB-CZ 4.43Å; R199-F331 HydrophobicContact CG-CD2 4.2Å; R199-F331 HydrophobicContact CG-CE2 3.59Å; R199-F331 HydrophobicContact CG-CZ 4.04Å; R199-F331 PolarHBondContact NH1-O 2.92Å
200	V	93.6	Very high	89.3	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	136.6	-178.6	-171.9	0	0	0	0	109.4	I179 K180 F181 V198 L213 P252 L253 F255 L284	I179-V200 HydrophobicContact CG2-CG1 3.89Å; K180-V200 CarbonylContact O-C 3.56Å; K180-V200 WeakPolarHBondContact O-CA 3.08Å; F181-V200 HydrophobicContact CD1-CG1 4.36Å; F181-V200 HydrophobicContact CD1-CG2 3.7Å; F181-V200 HydrophobicContact CE1-CG1 4.2Å; F181-V200 HydrophobicContact CE1-CG2 3.82Å; V198-V200 HydrophobicContact CG1-CG2 4.33Å; V200-L213 HydrophobicContact CG2-CD1 4.23Å; V200-L213 HydrophobicContact CG2-CD2 4.47Å; V200-P252 CarbonylContact O-C 3.59Å; V200-P252 WeakPolarHBondContact O-CA 3.32Å; V200-L253 PolarHBondContact N-O 3.39Å; V200-L253 PolarHBondContact O-N 2.94Å; V200-F255 HydrophobicContact CB-CD2 4.21Å; V200-F255 HydrophobicContact CB-CE2 4.02Å; V200-F255 HydrophobicContact CG2-CD2 3.82Å; V200-F255 HydrophobicContact CG2-CE2 4.05Å; V200-L284 HydrophobicContact CG1-CD2 3.94Å
201	A	91.3	Very high	89.3	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.008	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	145.5	176.3	0	0	0	0	0	112.3	I179 K180 P252 F328 F331	I179-A201 CarbonylContact C-O 3.58Å; I179-A201 WeakPolarHBondContact CA-O 3.36Å; K180-A201 PolarHBondContact N-O 2.77Å; K180-A201 PolarHBondContact O-N 3.01Å; A201-P252 HydrophobicContact CB-CB 3.98Å; A201-P252 HydrophobicContact CB-CG 3.95Å; A201-F328 HydrophobicContact CB-CE1 3.81Å; A201-F328 HydrophobicContact CB-CZ 4.26Å; A201-F331 HydrophobicContact CB-CD2 4.18Å; A201-F331 HydrophobicContact CB-CE2 3.47Å; A201-F331 VanDerWaalsContact CB-CE2 3.47Å; A201-F331 HydrophobicContact CB-CZ 4.09Å
202	N	89.9	Confident	89.4	Confident	9 Å²	9	53.8 Å²	53.8	5%	0.048	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	114.7	165.6	175.4	20.3	0	0	0	108.6	R175 R204 S206 L208 L249	R175-N202 PolarHBondContact NH1-OD1 2.93Å; R175-N202 PolarHBondContact NH2-OD1 3.03Å; N202-R204 VanDerWaalsContact CG-O 3.29Å; N202-R204 PolarHBondContact ND2-O 3.04Å; N202-R204 VanDerWaalsContact ND2-O 3.09Å; N202-R204 PolarHBondContact O-N 2.87Å; N202-R204 PolarHBondContact OD1-N 3.37Å; N202-R204 PolarHBondContact OD1-O 3.35Å; N202-S206 PolarHBondContact ND2-O 3.27Å; N202-L208 HydrophobicContact CB-CD1 4.45Å; N202-L249 HydrophobicContact CB-CB 4.47Å; N202-L249 VanDerWaalsContact CB-O 3.24Å; N202-L249 WeakPolarHBondContact CB-O 3.02Å; N202-L249 PolarHBondContact ND2-O 3.36Å
203	M	86.5	Confident	89.6	Confident	92 Å²	92	50.9 Å²	50.9	45%	0.453	24%	0.236	S	C	.	.			trans	-76	-3.7	-178.4	-63.9	-59.2	-44.8	0	0	113.5	T178 K180 F328	T178-M203 VanDerWaalsContact O-CB 3.26Å; T178-M203 WeakPolarHBondContact O-CB 3.25Å; T178-M203 WeakPolarHBondContact O-CG 3.27Å; T178-M203 PolarHBondContact O-N 3.35Å; K180-M203 HydrophobicContact CB-CG 4.15Å; K180-M203 HydrophobicContact CB-SD 4.23Å; K180-M203 HydrophobicContact CD-SD 4.41Å; M203-F328 HydrophobicContact CE-CD1 4Å; M203-F328 HydrophobicContact CE-CD2 4.1Å; M203-F328 HydrophobicContact CE-CE1 3.78Å; M203-F328 HydrophobicContact CE-CE2 3.87Å; M203-F328 HydrophobicContact CE-CG 4.15Å; M203-F328 HydrophobicContact CE-CZ 3.7Å; M203-F328 HydrophobicContact SD-CD1 3.73Å; M203-F328 HydrophobicContact SD-CE1 3.17Å; M203-F328 WeakPolarHBondContact SD-CE1 3.44Å; M203-F328 HydrophobicContact SD-CE2 4.28Å; M203-F328 HydrophobicContact SD-CG 4.48Å; M203-F328 HydrophobicContact SD-CZ 3.49Å; M203-F328 WeakPolarHBondContact SD-CZ 3.41Å
204	R	84.6	Confident	89.6	Confident	153 Å²	153	47 Å²	47	58%	0.577	22%	0.223	S	C	*	.	S	Bend	trans	-116.8	151.4	-176.1	-157.8	173.1	178.7	-174.3	-0.8	110.9	N202 S206	N202-R204 VanDerWaalsContact CG-O 3.29Å; N202-R204 PolarHBondContact ND2-O 3.04Å; N202-R204 VanDerWaalsContact ND2-O 3.09Å; N202-R204 PolarHBondContact O-N 2.87Å; N202-R204 PolarHBondContact OD1-N 3.37Å; N202-R204 PolarHBondContact OD1-O 3.35Å; R204-S206 VanDerWaalsContact C-N 3.33Å; R204-S206 WeakPolarHBondContact CD-OG 3.46Å; R204-S206 PolarHBondContact O-N 3.42Å
205	K	79.2	Confident	89.7	Confident	206 Å²	206	45 Å²	45	90%	0.896	21%	0.212	S	C	*	.	S	Bend	trans	-66.8	-28.6	176.9	-63.7	-174.7	178.6	-178.5	0	114.5
206	S	84.8	Confident	89.7	Confident	33 Å²	33	49.4 Å²	49.4	23%	0.231	23%	0.231	C	C	.	.	S	Bend	trans	-64.2	141	177	51.3	0	0	0	0	110.1	R175 N202 R204	R175-S206 PolarHBondContact NH2-O 3.12Å; R175-S206 PolarHBondContact NH2-OG 3.35Å; N202-S206 PolarHBondContact ND2-O 3.27Å; R204-S206 VanDerWaalsContact C-N 3.33Å; R204-S206 WeakPolarHBondContact CD-OG 3.46Å; R204-S206 PolarHBondContact O-N 3.42Å
207	L	84.2	Confident	89.6	Confident	37 Å²	37	49.7 Å²	49.7	19%	0.194	23%	0.233	C	C	.	.			trans	-78.4	156.8	-175.2	-55.5	177.3	0	0	0	112.1	F248 I250 E289	L207-F248 HydrophobicContact CD1-CE2 3.96Å; L207-F248 HydrophobicContact CD1-CZ 4.49Å; L207-F248 HydrophobicContact CD2-CE2 4.07Å; L207-F248 HydrophobicContact CD2-CZ 4.29Å; L207-I250 HydrophobicContact CD2-CD1 3.46Å; L207-I250 VanDerWaalsContact CD2-CD1 3.46Å; L207-I250 HydrophobicContact CD2-CG1 3.29Å; L207-E289 HydrophobicContact CB-CB 4.31Å; L207-E289 WeakPolarHBondContact CB-OE2 3.06Å; L207-E289 WeakPolarHBondContact CG-OE2 3.31Å; L207-E289 PolarHBondContact N-OE2 2.81Å
208	L	85.7	Confident	89.3	Confident	6 Å²	6	49.6 Å²	49.6	3%	0.031	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	126.4	163.9	-64.4	173.2	0	0	0	106.7	R175 I179 N202 C211 T287 M288	R175-L208 HydrophobicContact CG-CD2 4.46Å; I179-L208 HydrophobicContact CD1-CD1 3.53Å; I179-L208 HydrophobicContact CG1-CD1 3.88Å; N202-L208 HydrophobicContact CB-CD1 4.45Å; L208-C211 WeakPolarHBondContact CB-SG 3.35Å; L208-C211 PolarHBondContact O-SG 3.22Å; L208-T287 WeakPolarHBondContact CA-O 3.47Å; L208-M288 HydrophobicContact CD2-CG 4.09Å
209	I	84.6	Confident	88.9	Confident	81 Å²	81	53.4 Å²	53.4	42%	0.415	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	153.4	-177.6	-56.3	172.7	0	0	0	107.9	C211 T287 E289	I209-C211 VanDerWaalsContact C-N 3.3Å; I209-C211 PolarHBondContact O-N 2.97Å; I209-T287 PolarHBondContact N-O 3.1Å; I209-T287 PolarHBondContact O-N 3.26Å; I209-E289 HydrophobicContact CD1-CB 3.93Å; I209-E289 HydrophobicContact CD1-CG 4.13Å; I209-E289 HydrophobicContact CG1-CB 4.4Å
210	Q	83.9	Confident	88	Confident	120 Å²	120	55.8 Å²	55.8	56%	0.561	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	52.9	46.5	176.6	-72.2	167.1	-31	0	0	112.9	Q212	Q210-Q212 PolarHBondContact O-N 3.49Å
211	C	87.7	Confident	86.7	Confident	3 Å²	3	58.9 Å²	58.9	2%	0.02	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	123.6	-179.5	-63.6	0	0	0	0	110.2	L208 I209 P247 L249 L284 N285	L208-C211 WeakPolarHBondContact CB-SG 3.35Å; L208-C211 PolarHBondContact O-SG 3.22Å; I209-C211 VanDerWaalsContact C-N 3.3Å; I209-C211 PolarHBondContact O-N 2.97Å; C211-P247 HydrophobicContact CB-CB 4.43Å; C211-P247 HydrophobicContact CB-CG 4.01Å; C211-P247 WeakPolarHBondContact O-CD 3.23Å; C211-P247 VanDerWaalsContact O-CG 3.31Å; C211-P247 WeakPolarHBondContact O-CG 3.47Å; C211-L249 HydrophobicContact CB-CD1 3.71Å; C211-L284 HydrophobicContact CB-CD1 4.4Å; C211-N285 CarbonylContact C-O 3.52Å; C211-N285 VanDerWaalsContact CA-O 3.26Å; C211-N285 WeakPolarHBondContact CA-O 3.43Å
212	Q	89.6	Confident	85.4	Confident	122 Å²	122	64 Å²	64	57%	0.57	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.8	123.8	177.4	-169.5	-178.7	4	0	0	109.3	Q210 T214 L284 N285	Q210-Q212 PolarHBondContact O-N 3.49Å; Q212-T214 HydrophobicContact CG-CG2 4.16Å; Q212-L284 WeakPolarHBondContact O-CA 3.48Å; Q212-N285 PolarHBondContact N-O 3.21Å; Q212-N285 PolarHBondContact O-N 3.09Å
213	L	92.4	Very high	84	Confident	8 Å²	8	66 Å²	66	4%	0.042	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	125.2	174.1	-164.4	75.9	0	0	0	109.3	F181 V200 F238 F255 I282 T283 L284	F181-L213 HydrophobicContact CE1-CD1 3.93Å; V200-L213 HydrophobicContact CG2-CD1 4.23Å; V200-L213 HydrophobicContact CG2-CD2 4.47Å; L213-F238 HydrophobicContact CB-CB 4.17Å; L213-F238 HydrophobicContact CD2-CB 3.87Å; L213-F238 HydrophobicContact CD2-CD1 3.91Å; L213-F238 HydrophobicContact CD2-CD2 4.45Å; L213-F238 HydrophobicContact CD2-CG 3.81Å; L213-F238 HydrophobicContact CG-CB 4.23Å; L213-F238 HydrophobicContact CG-CG 4.37Å; L213-F255 HydrophobicContact CB-CD1 3.78Å; L213-F255 HydrophobicContact CB-CE1 3.94Å; L213-F255 HydrophobicContact CB-CG 4.14Å; L213-F255 HydrophobicContact CB-CZ 4.44Å; L213-F255 HydrophobicContact CD2-CB 3.33Å; L213-F255 HydrophobicContact CD2-CD1 3.93Å; L213-F255 HydrophobicContact CD2-CD2 3.84Å; L213-F255 HydrophobicContact CD2-CG 3.43Å; L213-F255 VanDerWaalsContact CD2-CG 3.43Å; L213-F255 HydrophobicContact CG-CD1 4.49Å; L213-F255 HydrophobicContact CG-CG 4.37Å; L213-I282 HydrophobicContact CD1-CG2 3.47Å; L213-I282 VanDerWaalsContact CD1-CG2 3.47Å; L213-I282 HydrophobicContact CD2-CG2 4.07Å; L213-I282 HydrophobicContact CG-CG2 3.88Å; L213-T283 WeakPolarHBondContact CA-O 3.47Å; L213-L284 HydrophobicContact CB-CD1 4.13Å; L213-L284 HydrophobicContact CD1-CB 3.86Å; L213-L284 HydrophobicContact CD1-CD1 3.73Å; L213-L284 HydrophobicContact CD1-CG 4.42Å
214	T	93.6	Very high	82.6	Confident	39 Å²	39	71.7 Å²	71.7	24%	0.239	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	144.9	175.4	58.9	0	0	0	0	110.3	Q212 T283	Q212-T214 HydrophobicContact CG-CG2 4.16Å; T214-T283 PolarHBondContact N-O 3.32Å; T214-T283 PolarHBondContact O-N 3.29Å
215	G	95.3	Very high	81.7	Confident	1 Å²	1	72.6 Å²	72.6	1%	0.01	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	149.8	175.8	0	0	0	0	0	112.1	V236 L281	G215-V236 VanDerWaalsContact CA-O 3.3Å; G215-V236 WeakPolarHBondContact CA-O 3.12Å; G215-V236 PolarHBondContact N-O 3.22Å; G215-V236 PolarHBondContact O-N 3.34Å; G215-L281 CarbonylContact C-O 3.52Å; G215-L281 VanDerWaalsContact CA-O 3.25Å; G215-L281 WeakPolarHBondContact CA-O 3.45Å
216	K	94.9	Very high	80.7	Confident	96 Å²	96	65.5 Å²	65.5	42%	0.417	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	124	166.3	-71.3	-168.4	172.1	-168.1	0	109.3	F218 S234 L281	K216-F218 HydrophobicContact CB-CE1 3.94Å; K216-F218 HydrophobicContact CB-CZ 4.22Å; K216-F218 HydrophobicContact CD-CE1 4.37Å; K216-S234 CarbonylContact C-O 3.57Å; K216-S234 WeakPolarHBondContact CA-O 3.36Å; K216-L281 HydrophobicContact CB-CB 4.39Å; K216-L281 PolarHBondContact N-O 2.95Å; K216-L281 PolarHBondContact O-N 2.88Å
217	L	93.3	Very high	79	Confident	7 Å²	7	70.8 Å²	70.8	4%	0.037	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	120.5	173.5	-168.7	72.7	0	0	0	109.1	Q233 S234 V236 P264 L265 F278 L280	L217-Q233 WeakPolarHBondContact O-CA 3.43Å; L217-S234 PolarHBondContact N-O 2.86Å; L217-S234 PolarHBondContact O-N 3.2Å; L217-V236 HydrophobicContact CB-CG2 4.07Å; L217-P264 HydrophobicContact CB-CG 4.47Å; L217-P264 HydrophobicContact CD2-CB 3.82Å; L217-P264 HydrophobicContact CD2-CG 4.23Å; L217-L265 HydrophobicContact CD1-CD2 3.77Å; L217-L265 HydrophobicContact CD2-CD2 3.96Å; L217-F278 HydrophobicContact CD1-CB 4.05Å; L217-F278 HydrophobicContact CD1-CD2 3.34Å; L217-F278 HydrophobicContact CD1-CE2 3.96Å; L217-F278 HydrophobicContact CD1-CG 3.87Å; L217-F278 HydrophobicContact CG-CB 4.43Å; L217-L280 HydrophobicContact CD1-CB 4.18Å; L217-L280 HydrophobicContact CD1-CD1 4.22Å
218	F	91.1	Very high	77.5	Confident	16 Å²	16	78.3 Å²	78.3	7%	0.07	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	118.6	172.9	-58.8	-37.4	0	0	0	109.2	I31 K216 I231 H232 Q233 F278 E279 L281	I31-F218 HydrophobicContact CD1-CB 4.09Å; I31-F218 HydrophobicContact CD1-CD2 3.79Å; I31-F218 HydrophobicContact CD1-CE2 4.46Å; I31-F218 HydrophobicContact CD1-CG 4.07Å; K216-F218 HydrophobicContact CB-CE1 3.94Å; K216-F218 HydrophobicContact CB-CZ 4.22Å; K216-F218 HydrophobicContact CD-CE1 4.37Å; F218-I231 HydrophobicContact CB-CG2 3.81Å; F218-I231 HydrophobicContact CD1-CG2 4.18Å; F218-I231 HydrophobicContact CG-CG2 4.19Å; F218-H232 WeakPolarHBondContact CA-O 3.44Å; F218-Q233 HydrophobicContact CD1-CB 4.16Å; F218-Q233 HydrophobicContact CD1-CG 3.71Å; F218-Q233 HydrophobicContact CE1-CB 4.17Å; F218-Q233 HydrophobicContact CE1-CG 3.68Å; F218-F278 CarbonylContact O-C 3.47Å; F218-F278 WeakPolarHBondContact O-CA 3.16Å; F218-F278 WeakPolarHBondContact O-CB 3.35Å; F218-E279 HydrophobicContact CB-CB 4.36Å; F218-E279 PolarHBondContact N-O 2.82Å; F218-E279 PolarHBondContact O-N 2.95Å; F218-L281 HydrophobicContact CD2-CB 4.24Å; F218-L281 HydrophobicContact CE2-CB 3.56Å; F218-L281 HydrophobicContact CE2-CD2 3.76Å; F218-L281 HydrophobicContact CE2-CG 4.25Å; F218-L281 HydrophobicContact CZ-CB 3.96Å; F218-L281 HydrophobicContact CZ-CD2 3.57Å; F218-L281 HydrophobicContact CZ-CG 4.42Å
219	K	86.8	Confident	76.2	Confident	81 Å²	81	81.5 Å²	81.5	35%	0.352	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	128.8	176.7	-166.7	-179	176.2	-167.8	0	109.6	N221 H232	K219-N221 WeakPolarHBondContact CD-OD1 3.35Å; K219-N221 WeakPolarHBondContact CE-OD1 3.26Å; K219-N221 PolarHBondContact O-N 3.3Å; K219-H232 PolarHBondContact N-O 3.03Å; K219-H232 PolarHBondContact O-N 2.85Å
220	S	75.3	Confident	75.3	Confident	61 Å²	61	84.7 Å²	84.7	43%	0.427	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	113.3	170.3	-165.3	0	0	0	0	107.9	T229	S220-T229 WeakPolarHBondContact OG-CB 3.39Å; S220-T229 WeakPolarHBondContact OG-CG2 3.43Å
221	N	66.1	Low	75.1	Confident	65 Å²	65	83.2 Å²	83.2	35%	0.348	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	132.5	172.9	-73.1	-17.1	0	0	0	108.3	K219 T229 Q230	K219-N221 WeakPolarHBondContact CD-OD1 3.35Å; K219-N221 WeakPolarHBondContact CE-OD1 3.26Å; K219-N221 PolarHBondContact O-N 3.3Å; N221-T229 WeakPolarHBondContact O-CA 3.33Å; N221-Q230 PolarHBondContact N-O 3.48Å
222	V	64	Low	74.9	Confident	107 Å²	107	88.1 Å²	88.1	65%	0.648	45%	0.451	S	S	*	.			trans	-84.2	125.8	164.1	-173.3	0	0	0	0	105.9	T229	V222-T229 HydrophobicContact CG2-CG2 4.41Å
223	T	60.2	Low	75	Confident	53 Å²	53	87.5 Å²	87.5	33%	0.325	45%	0.448	S	S	.	.			trans	-66.7	155.3	174.9	55.3	0	0	0	0	109.6	E225 G226 E227	T223-E225 PolarHBondContact O-N 2.89Å; T223-G226 PolarHBondContact O-N 2.81Å; T223-E227 PolarHBondContact OG1-N 3.13Å
224	E	58.4	Low	74.9	Confident	210 Å²	210	88.4 Å²	88.4	98%	0.981	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-20.7	177.8	-63.1	-172.4	163.9	0	0	112.5	G226	E224-G226 VanDerWaalsContact C-N 3.32Å
225	E	65.9	Low	74.9	Confident	172 Å²	172	90.3 Å²	90.3	80%	0.804	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	1.1	177.9	-63.7	164.5	168.9	0	0	113.5	T223 E227	T223-E225 PolarHBondContact O-N 2.89Å; E225-E227 VanDerWaalsContact C-N 3.27Å; E225-E227 PolarHBondContact O-N 3.08Å
226	G	57.4	Low	74.9	Confident	58 Å²	58	90.3 Å²	90.3	60%	0.598	47%	0.47	S	S	*	.			trans	74	11.7	176.1	0	0	0	0	0	115	T223 E224	T223-G226 PolarHBondContact O-N 2.81Å; E224-G226 VanDerWaalsContact C-N 3.32Å
227	E	48.3	Very low	74.7	Confident	144 Å²	144	89.7 Å²	89.7	67%	0.673	47%	0.471	S	S	*	.			trans	-79.4	145.7	178.5	-148.7	-177.2	-168	0	0	111.5	T223 E225 T229	T223-E227 PolarHBondContact OG1-N 3.13Å; E225-E227 VanDerWaalsContact C-N 3.27Å; E225-E227 PolarHBondContact O-N 3.08Å; E227-T229 PolarHBondContact O-N 3.09Å
228	K	53.3	Low	74.7	Confident	194 Å²	194	90.2 Å²	90.2	84%	0.843	47%	0.473	S	S	*	.			trans	-62.2	106.3	-167.9	-74.9	176.8	178.1	172.2	0	112.9	Q230	K228-Q230 PolarHBondContact O-N 2.65Å
229	T	58.2	Low	74.6	Confident	73 Å²	73	95 Å²	95	45%	0.448	49%	0.492	S	S	.	.			trans	39.2	75.7	143.1	44.1	0	0	0	0	117.1	S220 N221 V222 E227	S220-T229 WeakPolarHBondContact OG-CB 3.39Å; S220-T229 WeakPolarHBondContact OG-CG2 3.43Å; N221-T229 WeakPolarHBondContact O-CA 3.33Å; V222-T229 HydrophobicContact CG2-CG2 4.41Å; E227-T229 PolarHBondContact O-N 3.09Å
230	Q	66.5	Low	74.5	Confident	149 Å²	149	92.6 Å²	92.6	70%	0.696	48%	0.482	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.4	136.8	158.8	-71.5	-173.9	-1.6	0	0	109.9	N221 K228 H232	N221-Q230 PolarHBondContact N-O 3.48Å; K228-Q230 PolarHBondContact O-N 2.65Å; Q230-H232 PolarHBondContact O-N 3.32Å
231	I	78.3	Confident	74.4	Confident	89 Å²	89	94.1 Å²	94.1	46%	0.456	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	104.3	173.1	-62.4	164.5	0	0	0	107.8	I31 F218	I31-I231 HydrophobicContact CD1-CD1 3.56Å; I31-I231 HydrophobicContact CD1-CG1 4.41Å; I31-I231 HydrophobicContact CD1-CG2 4.09Å; I31-I231 HydrophobicContact CG1-CD1 4.37Å; F218-I231 HydrophobicContact CB-CG2 3.81Å; F218-I231 HydrophobicContact CD1-CG2 4.18Å; F218-I231 HydrophobicContact CG-CG2 4.19Å
232	H	85.1	Confident	74.3	Confident	106 Å²	106	95.2 Å²	95.2	49%	0.491	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	132.6	172.8	-171.4	77	0	0	0	109.6	F218 K219 Q230	F218-H232 WeakPolarHBondContact CA-O 3.44Å; K219-H232 PolarHBondContact N-O 3.03Å; K219-H232 PolarHBondContact O-N 2.85Å; Q230-H232 PolarHBondContact O-N 3.32Å
233	Q	90.1	Very high	73.9	Confident	108 Å²	108	96.6 Å²	96.6	51%	0.505	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	117.9	179.3	-48.1	-170.4	7.5	0	0	109.7	L217 F218	L217-Q233 WeakPolarHBondContact O-CA 3.43Å; F218-Q233 HydrophobicContact CD1-CB 4.16Å; F218-Q233 HydrophobicContact CD1-CG 3.71Å; F218-Q233 HydrophobicContact CE1-CB 4.17Å; F218-Q233 HydrophobicContact CE1-CG 3.68Å
234	S	91.4	Very high	73.8	Confident	27 Å²	27	95.9 Å²	95.9	19%	0.189	51%	0.512	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	142	172.2	50.6	0	0	0	0	111	K216 L217 P264	K216-S234 CarbonylContact C-O 3.57Å; K216-S234 WeakPolarHBondContact CA-O 3.36Å; L217-S234 PolarHBondContact N-O 2.86Å; L217-S234 PolarHBondContact O-N 3.2Å; S234-P264 VanDerWaalsContact OG-CB 3.24Å; S234-P264 WeakPolarHBondContact OG-CB 3.42Å
235	S	93.6	Very high	73.8	Confident	80 Å²	80	93.9 Å²	93.9	56%	0.559	51%	0.508	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74	144.6	178.7	-163.5	0	0	0	0	110.8
236	V	94	Very high	73.6	Confident	1 Å²	1	89.2 Å²	89.2	1%	0.006	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	113.8	174.4	-176.9	0	0	0	0	108	G215 L217 F238 H257 P264 L280	G215-V236 VanDerWaalsContact CA-O 3.3Å; G215-V236 WeakPolarHBondContact CA-O 3.12Å; G215-V236 PolarHBondContact N-O 3.22Å; G215-V236 PolarHBondContact O-N 3.34Å; L217-V236 HydrophobicContact CB-CG2 4.07Å; V236-F238 HydrophobicContact CB-CE2 4.24Å; V236-F238 HydrophobicContact CG1-CD2 4.29Å; V236-F238 HydrophobicContact CG1-CE2 3.66Å; V236-F238 HydrophobicContact CG1-CZ 4.24Å; V236-H257 HydrophobicContact CG1-CB 4.04Å; V236-H257 VanDerWaalsContact CG1-CG 3.43Å; V236-H257 WeakPolarHBondContact CG1-ND1 3.41Å; V236-P264 HydrophobicContact CG2-CG 3.58Å; V236-L280 HydrophobicContact CB-CD1 4.33Å; V236-L280 HydrophobicContact CG2-CD1 3.99Å
237	D	92	Very high	74	Confident	82 Å²	82	87 Å²	87	44%	0.439	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	132.5	-177.2	-61.1	-31.3	0	0	0	110.8	Y239 H257	D237-Y239 HydrophobicContact CB-CE2 4.22Å; D237-H257 PolarHBondContact O-ND1 3.41Å
238	F	92.1	Very high	75.1	Confident	19 Å²	19	86.5 Å²	86.5	8%	0.083	47%	0.465	C	S	.	.			trans	-110.1	138.7	178.9	-79.5	-96.3	0	0	0	110.7	L196 V198 L213 V236 F255 H257 L280 I282	L196-F238 HydrophobicContact CD2-CZ 4.21Å; V198-F238 HydrophobicContact CG2-CE1 4.13Å; L213-F238 HydrophobicContact CB-CB 4.17Å; L213-F238 HydrophobicContact CD2-CB 3.87Å; L213-F238 HydrophobicContact CD2-CD1 3.91Å; L213-F238 HydrophobicContact CD2-CD2 4.45Å; L213-F238 HydrophobicContact CD2-CG 3.81Å; L213-F238 HydrophobicContact CG-CB 4.23Å; L213-F238 HydrophobicContact CG-CG 4.37Å; V236-F238 HydrophobicContact CB-CE2 4.24Å; V236-F238 HydrophobicContact CG1-CD2 4.29Å; V236-F238 HydrophobicContact CG1-CE2 3.66Å; V236-F238 HydrophobicContact CG1-CZ 4.24Å; F238-F255 HydrophobicContact CB-CB 4.32Å; F238-F255 HydrophobicContact CD1-CB 4.08Å; F238-H257 HydrophobicContact CD1-CB 4.07Å; F238-H257 HydrophobicContact CE1-CB 3.88Å; F238-H257 HydrophobicContact CE2-CB 4.38Å; F238-H257 HydrophobicContact CG-CB 4.41Å; F238-H257 HydrophobicContact CZ-CB 4.04Å; F238-L280 HydrophobicContact CZ-CD2 4.42Å; F238-I282 HydrophobicContact CD2-CD1 4.23Å; F238-I282 HydrophobicContact CE1-CD1 4.41Å; F238-I282 HydrophobicContact CE2-CD1 3.29Å; F238-I282 HydrophobicContact CZ-CD1 3.41Å; F238-I282 VanDerWaalsContact CZ-CD1 3.41Å
239	Y	88.8	Confident	76.2	Confident	116 Å²	116	77.4 Å²	77.4	46%	0.455	43%	0.425	S	S	.	.	B	Isolated β-bridge	trans	-120.5	168.2	-178.6	-52.4	-78.1	0	0	0	110.6	D237 F255 Y256	D237-Y239 HydrophobicContact CB-CE2 4.22Å; Y239-F255 CarbonylContact O-C 3.56Å; Y239-F255 WeakPolarHBondContact O-CA 3.47Å; Y239-Y256 PolarHBondContact N-O 3.32Å; Y239-Y256 PolarHBondContact O-N 2.85Å
240	M	85.1	Confident	77.1	Confident	30 Å²	30	77.9 Å²	77.9	15%	0.148	42%	0.424	C	S	.	.			trans	-136.5	149.6	176.2	-179.2	-176.6	60.8	0	0	107.9	T242 P247 L253 F255	M240-T242 VanDerWaalsContact CE-CB 3.45Å; M240-T242 VanDerWaalsContact CE-OG1 3.23Å; M240-T242 WeakPolarHBondContact CE-OG1 3.25Å; M240-T242 PolarHBondContact O-N 2.92Å; M240-P247 HydrophobicContact CE-CB 3.74Å; M240-P247 HydrophobicContact CE-CG 4.03Å; M240-P247 HydrophobicContact SD-CB 3.82Å; M240-P247 HydrophobicContact SD-CG 4.34Å; M240-L253 HydrophobicContact SD-CB 4.47Å; M240-L253 HydrophobicContact SD-CD1 3.7Å; M240-L253 HydrophobicContact SD-CD2 4.45Å; M240-L253 HydrophobicContact SD-CG 4.42Å; M240-F255 HydrophobicContact CB-CD1 4.33Å; M240-F255 HydrophobicContact CB-CE1 4.4Å
241	D	72.9	Confident	77.9	Confident	94 Å²	94	73.8 Å²	73.8	50%	0.503	41%	0.407	S	S	.	.	S	Bend	trans	-66.2	-6.2	-177	-70.6	-45.2	0	0	0	113.9	H190 Y256	H190-D241 IonicContact CD2-OD1 3.87Å; H190-D241 IonicContact CE1-OD2 3.94Å; H190-D241 IonicContact NE2-OD1 2.81Å; H190-D241 PolarHBondContact NE2-OD1 3.25Å; H190-D241 IonicContact NE2-OD2 3.28Å; H190-D241 PolarHBondContact NE2-OD2 2.95Å; D241-Y256 VanDerWaalsContact OD1-CE1 3.26Å; D241-Y256 WeakPolarHBondContact OD1-CE1 3.35Å; D241-Y256 PolarHBondContact OD1-OH 2.97Å
242	T	64.9	Low	78.3	Confident	88 Å²	88	70.1 Å²	70.1	54%	0.54	39%	0.389	S	S	.	.	S	Bend	trans	-89.1	133	-179.1	-30.6	0	0	0	0	110.7	M240 G244	M240-T242 VanDerWaalsContact CE-CB 3.45Å; M240-T242 VanDerWaalsContact CE-OG1 3.23Å; M240-T242 WeakPolarHBondContact CE-OG1 3.25Å; M240-T242 PolarHBondContact O-N 2.92Å; T242-G244 PolarHBondContact O-N 3.1Å
243	S	54.3	Low	78.6	Confident	136 Å²	136	66.8 Å²	66.8	95%	0.951	37%	0.374	S	S	*	.	S	Bend	trans	-69.7	19.3	-175.6	60.6	0	0	0	0	115.7
244	G	58.7	Low	78.6	Confident	38 Å²	38	63.7 Å²	63.7	39%	0.392	36%	0.363	S	S	.	.	S	Bend	trans	-129.7	139.9	-177.1	0	0	0	0	0	112.1	T242 C246	T242-G244 PolarHBondContact O-N 3.1Å; G244-C246 PolarHBondContact O-N 2.88Å
245	D	58	Low	78.7	Confident	168 Å²	168	62.7 Å²	62.7	90%	0.898	36%	0.355	S	S	*	.	S	Bend	trans	-67.1	1.1	-175	-64.6	-34.3	0	0	0	114.8
246	C	61.8	Low	78.7	Confident	73 Å²	73	60.2 Å²	60.2	49%	0.493	33%	0.334	S	S	.	.	S	Bend	trans	-135	102.8	-175.4	-73.2	0	0	0	0	110.7	G244 F248	G244-C246 PolarHBondContact O-N 2.88Å; C246-F248 PolarHBondContact O-N 3.36Å
247	P	67.4	Low	78.8	Confident	12 Å²	12	60.8 Å²	60.8	8%	0.078	34%	0.336	C	S	.	.			trans	-62.3	134.8	176.1	-11.8	22.5	0	0	0	111.3	C211 M240 L249 L253 F255	C211-P247 HydrophobicContact CB-CB 4.43Å; C211-P247 HydrophobicContact CB-CG 4.01Å; C211-P247 WeakPolarHBondContact O-CD 3.23Å; C211-P247 VanDerWaalsContact O-CG 3.31Å; C211-P247 WeakPolarHBondContact O-CG 3.47Å; M240-P247 HydrophobicContact CE-CB 3.74Å; M240-P247 HydrophobicContact CE-CG 4.03Å; M240-P247 HydrophobicContact SD-CB 3.82Å; M240-P247 HydrophobicContact SD-CG 4.34Å; P247-L249 HydrophobicContact CB-CG 4.36Å; P247-L249 PolarHBondContact O-N 3.41Å; P247-L253 HydrophobicContact CB-CD1 3.66Å; P247-F255 HydrophobicContact CB-CZ 4.16Å; P247-F255 HydrophobicContact CG-CE1 3.91Å; P247-F255 HydrophobicContact CG-CZ 3.82Å
248	F	70.9	Confident	78.9	Confident	134 Å²	134	58.9 Å²	58.9	59%	0.588	33%	0.325	S	S	*	.			trans	-87.6	82.8	169.5	-167.7	-119.6	0	0	0	110.3	L207 C246 I250	L207-F248 HydrophobicContact CD1-CE2 3.96Å; L207-F248 HydrophobicContact CD1-CZ 4.49Å; L207-F248 HydrophobicContact CD2-CE2 4.07Å; L207-F248 HydrophobicContact CD2-CZ 4.29Å; C246-F248 PolarHBondContact O-N 3.36Å; F248-I250 HydrophobicContact CD1-CB 4.25Å; F248-I250 HydrophobicContact CD1-CD1 4.1Å; F248-I250 HydrophobicContact CD1-CG1 3.87Å; F248-I250 HydrophobicContact CE1-CB 4.09Å; F248-I250 HydrophobicContact CE1-CD1 3.15Å; F248-I250 HydrophobicContact CE1-CG1 3.43Å; F248-I250 VanDerWaalsContact CE1-CG1 3.43Å; F248-I250 HydrophobicContact CE2-CD1 4.01Å; F248-I250 HydrophobicContact CE2-CG1 4.1Å; F248-I250 HydrophobicContact CG-CG1 4.41Å; F248-I250 HydrophobicContact CZ-CD1 3.11Å; F248-I250 HydrophobicContact CZ-CG1 3.58Å; F248-I250 PolarHBondContact O-N 3.35Å
249	L	76.8	Confident	79	Confident	2 Å²	2	59 Å²	59	1%	0.01	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	52.4	-178.6	-83.1	169	0	0	0	113.3	N202 C211 P247 L253 L284	N202-L249 HydrophobicContact CB-CB 4.47Å; N202-L249 VanDerWaalsContact CB-O 3.24Å; N202-L249 WeakPolarHBondContact CB-O 3.02Å; N202-L249 PolarHBondContact ND2-O 3.36Å; C211-L249 HydrophobicContact CB-CD1 3.71Å; P247-L249 HydrophobicContact CB-CG 4.36Å; P247-L249 PolarHBondContact O-N 3.41Å; L249-L253 HydrophobicContact CD2-CB 4.02Å; L249-L253 HydrophobicContact CD2-CD1 3.63Å; L249-L253 HydrophobicContact CD2-CG 3.86Å; L249-L253 HydrophobicContact CG-CD1 3.86Å; L249-L284 HydrophobicContact CD1-CD1 4.33Å; L249-L284 HydrophobicContact CD1-CD2 3.97Å
250	I	76.7	Confident	79.1	Confident	83 Å²	83	57.4 Å²	57.4	43%	0.426	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-38.1	160.5	-64.8	-163.4	0	0	0	110.2	L207 F248	L207-I250 HydrophobicContact CD2-CD1 3.46Å; L207-I250 VanDerWaalsContact CD2-CD1 3.46Å; L207-I250 HydrophobicContact CD2-CG1 3.29Å; F248-I250 HydrophobicContact CD1-CB 4.25Å; F248-I250 HydrophobicContact CD1-CD1 4.1Å; F248-I250 HydrophobicContact CD1-CG1 3.87Å; F248-I250 HydrophobicContact CE1-CB 4.09Å; F248-I250 HydrophobicContact CE1-CD1 3.15Å; F248-I250 HydrophobicContact CE1-CG1 3.43Å; F248-I250 VanDerWaalsContact CE1-CG1 3.43Å; F248-I250 HydrophobicContact CE2-CD1 4.01Å; F248-I250 HydrophobicContact CE2-CG1 4.1Å; F248-I250 HydrophobicContact CG-CG1 4.41Å; F248-I250 HydrophobicContact CZ-CD1 3.11Å; F248-I250 HydrophobicContact CZ-CG1 3.58Å; F248-I250 PolarHBondContact O-N 3.35Å
251	L	82	Confident	79.3	Confident	64 Å²	64	65 Å²	65	34%	0.335	36%	0.361	S	S	.	.	S	Bend	trans	-103.2	155.5	-179.3	-54.4	177.9	0	0	0	109.1	L253 L316 V326	L251-L253 PolarHBondContact O-N 3.38Å; L251-L316 HydrophobicContact CB-CD2 4.39Å; L251-L316 HydrophobicContact CD1-CD1 3.8Å; L251-L316 HydrophobicContact CD1-CD2 3.81Å; L251-L316 HydrophobicContact CD1-CG 4.47Å; L251-L316 HydrophobicContact CD2-CD2 3.72Å; L251-L316 HydrophobicContact CG-CD2 4.15Å; L251-V326 HydrophobicContact CD2-CG2 3.68Å
252	P	88.1	Confident	80.1	Confident	11 Å²	11	69.7 Å²	69.7	7%	0.071	38%	0.377	C	S	.	.			trans	-58.2	128.6	167.5	-22.8	34.2	0	0	0	110.1	R199 V200 A201 V315 V326 F328 F331	R199-P252 HydrophobicContact CG-CB 4.35Å; V200-P252 CarbonylContact O-C 3.59Å; V200-P252 WeakPolarHBondContact O-CA 3.32Å; A201-P252 HydrophobicContact CB-CB 3.98Å; A201-P252 HydrophobicContact CB-CG 3.95Å; P252-V315 HydrophobicContact CB-CG2 3.9Å; P252-V315 HydrophobicContact CG-CG2 3.87Å; P252-V326 HydrophobicContact CG-CG1 3.57Å; P252-F328 HydrophobicContact CG-CE1 4.43Å; P252-F328 HydrophobicContact CG-CZ 4.46Å; P252-F331 HydrophobicContact CB-CD2 4.11Å; P252-F331 HydrophobicContact CB-CE2 4.03Å; P252-F331 HydrophobicContact CG-CD2 4.3Å
253	L	89.9	Confident	81.4	Confident	36 Å²	36	65.9 Å²	65.9	19%	0.188	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	142.8	179	-61.2	174.5	0	0	0	109.4	R199 V200 M240 P247 L249 L251 F255	R199-L253 WeakPolarHBondContact CA-O 3.32Å; V200-L253 PolarHBondContact N-O 3.39Å; V200-L253 PolarHBondContact O-N 2.94Å; M240-L253 HydrophobicContact SD-CB 4.47Å; M240-L253 HydrophobicContact SD-CD1 3.7Å; M240-L253 HydrophobicContact SD-CD2 4.45Å; M240-L253 HydrophobicContact SD-CG 4.42Å; P247-L253 HydrophobicContact CB-CD1 3.66Å; L249-L253 HydrophobicContact CD2-CB 4.02Å; L249-L253 HydrophobicContact CD2-CD1 3.63Å; L249-L253 HydrophobicContact CD2-CG 3.86Å; L249-L253 HydrophobicContact CG-CD1 3.86Å; L251-L253 PolarHBondContact O-N 3.38Å; L253-F255 HydrophobicContact CB-CE2 4.06Å
254	T	91.9	Very high	83.1	Confident	43 Å²	43	61.8 Å²	61.8	26%	0.264	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	118	172	-55.4	0	0	0	0	108	M197 F312	M197-T254 HydrophobicContact CB-CG2 3.79Å; M197-T254 HydrophobicContact CG-CG2 4.22Å; M197-T254 HydrophobicContact SD-CG2 3.96Å; T254-F312 HydrophobicContact CG2-CD2 4.18Å; T254-F312 HydrophobicContact CG2-CE2 4.49Å
255	F	93.1	Very high	84.6	Confident	6 Å²	6	60.3 Å²	60.3	3%	0.026	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	144.8	170.8	-68	-96.9	0	0	0	108.8	M197 V198 V200 L213 F238 Y239 M240 P247 L253	M197-F255 CarbonylContact C-O 3.52Å; M197-F255 VanDerWaalsContact CA-O 3.3Å; M197-F255 WeakPolarHBondContact CA-O 3.45Å; V198-F255 PolarHBondContact N-O 3.48Å; V198-F255 PolarHBondContact O-N 2.97Å; V200-F255 HydrophobicContact CB-CD2 4.21Å; V200-F255 HydrophobicContact CB-CE2 4.02Å; V200-F255 HydrophobicContact CG2-CD2 3.82Å; V200-F255 HydrophobicContact CG2-CE2 4.05Å; L213-F255 HydrophobicContact CB-CD1 3.78Å; L213-F255 HydrophobicContact CB-CE1 3.94Å; L213-F255 HydrophobicContact CB-CG 4.14Å; L213-F255 HydrophobicContact CB-CZ 4.44Å; L213-F255 HydrophobicContact CD2-CB 3.33Å; L213-F255 HydrophobicContact CD2-CD1 3.93Å; L213-F255 HydrophobicContact CD2-CD2 3.84Å; L213-F255 HydrophobicContact CD2-CG 3.43Å; L213-F255 VanDerWaalsContact CD2-CG 3.43Å; L213-F255 HydrophobicContact CG-CD1 4.49Å; L213-F255 HydrophobicContact CG-CG 4.37Å; F238-F255 HydrophobicContact CB-CB 4.32Å; F238-F255 HydrophobicContact CD1-CB 4.08Å; Y239-F255 CarbonylContact O-C 3.56Å; Y239-F255 WeakPolarHBondContact O-CA 3.47Å; M240-F255 HydrophobicContact CB-CD1 4.33Å; M240-F255 HydrophobicContact CB-CE1 4.4Å; P247-F255 HydrophobicContact CB-CZ 4.16Å; P247-F255 HydrophobicContact CG-CE1 3.91Å; P247-F255 HydrophobicContact CG-CZ 3.82Å; L253-F255 HydrophobicContact CB-CE2 4.06Å
256	Y	94	Very high	86	Confident	28 Å²	28	54.1 Å²	54.1	11%	0.11	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	145	179.9	65.2	-91.8	0	0	0	112.3	C195 L196 Y239 D241 I258	C195-Y256 HydrophobicContact CB-CD2 4.48Å; L196-Y256 CarbonylContact O-C 3.55Å; L196-Y256 WeakPolarHBondContact O-CA 3.35Å; Y239-Y256 PolarHBondContact N-O 3.32Å; Y239-Y256 PolarHBondContact O-N 2.85Å; D241-Y256 VanDerWaalsContact OD1-CE1 3.26Å; D241-Y256 WeakPolarHBondContact OD1-CE1 3.35Å; D241-Y256 PolarHBondContact OD1-OH 2.97Å; Y256-I258 HydrophobicContact CD2-CG1 4.13Å; Y256-I258 HydrophobicContact CE2-CD1 4.32Å; Y256-I258 HydrophobicContact CE2-CG1 4.03Å
257	H	95.1	Very high	87.1	Confident	13 Å²	13	53.5 Å²	53.5	6%	0.06	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	125.8	170.7	171.8	68.7	0	0	0	108.7	C195 L196 V236 D237 F238 I259 S263	C195-H257 CarbonylContact C-O 3.57Å; C195-H257 VanDerWaalsContact CA-O 3.22Å; C195-H257 WeakPolarHBondContact CA-O 3.49Å; L196-H257 HydrophobicContact CB-CB 4.43Å; L196-H257 PolarHBondContact N-O 2.91Å; L196-H257 PolarHBondContact O-N 3.08Å; V236-H257 HydrophobicContact CG1-CB 4.04Å; V236-H257 VanDerWaalsContact CG1-CG 3.43Å; V236-H257 WeakPolarHBondContact CG1-ND1 3.41Å; D237-H257 PolarHBondContact O-ND1 3.41Å; F238-H257 HydrophobicContact CD1-CB 4.07Å; F238-H257 HydrophobicContact CE1-CB 3.88Å; F238-H257 HydrophobicContact CE2-CB 4.38Å; F238-H257 HydrophobicContact CG-CB 4.41Å; F238-H257 HydrophobicContact CZ-CB 4.04Å; H257-I259 PolarHBondContact O-N 3.28Å; H257-S263 WeakPolarHBondContact NE2-CB 3.23Å; H257-S263 PolarHBondContact NE2-OG 2.91Å
258	I	94.7	Very high	88.1	Confident	42 Å²	42	53.7 Å²	53.7	22%	0.215	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	120.5	176.5	-59	173.1	0	0	0	108.2	K193 Y256 D260	K193-I258 HydrophobicContact CB-CG2 4.2Å; K193-I258 HydrophobicContact CD-CD1 4.25Å; K193-I258 HydrophobicContact CD-CG2 3.88Å; Y256-I258 HydrophobicContact CD2-CG1 4.13Å; Y256-I258 HydrophobicContact CE2-CD1 4.32Å; Y256-I258 HydrophobicContact CE2-CG1 4.03Å; I258-D260 HydrophobicContact CG2-CB 4.45Å; I258-D260 PolarHBondContact O-N 2.93Å; I258-D260 VanDerWaalsContact O-N 3.16Å
259	I	94.1	Very high	88.9	Confident	23 Å²	23	49.9 Å²	49.9	12%	0.118	27%	0.274	C	S	.	.			trans	-86	86.8	176.1	-53.1	175.9	0	0	0	107.8	I187 L194 L196 H257 L265	I187-I259 HydrophobicContact CD1-CD1 4.36Å; I187-I259 HydrophobicContact CG2-CD1 4.32Å; L194-I259 HydrophobicContact CD2-CB 4.35Å; L194-I259 HydrophobicContact CD2-CD1 4.11Å; L194-I259 HydrophobicContact CG-CD1 4.26Å; L194-I259 PolarHBondContact O-N 3.46Å; L196-I259 HydrophobicContact CB-CD1 4.26Å; H257-I259 PolarHBondContact O-N 3.28Å; I259-L265 HydrophobicContact CG2-CB 4.3Å
260	D	90.9	Very high	89.4	Confident	81 Å²	81	53.1 Å²	53.1	43%	0.433	30%	0.295	S	S	.	.			trans	-99	-174.3	171.9	70	6.5	0	0	0	111.6	I258 K262 S263 A266	I258-D260 HydrophobicContact CG2-CB 4.45Å; I258-D260 PolarHBondContact O-N 2.93Å; I258-D260 VanDerWaalsContact O-N 3.16Å; D260-K262 PolarHBondContact O-N 3.36Å; D260-K262 WeakPolarHBondContact OD1-CA 3.47Å; D260-K262 WeakPolarHBondContact OD1-CB 3.33Å; D260-K262 PolarHBondContact OD1-N 3.13Å; D260-S263 VanDerWaalsContact O-CB 3.31Å; D260-S263 WeakPolarHBondContact O-CB 3.38Å; D260-S263 PolarHBondContact O-N 2.92Å; D260-S263 PolarHBondContact OD1-N 3.4Å; D260-A266 WeakPolarHBondContact O-CB 3.43Å
261	E	89.7	Confident	89.9	Confident	190 Å²	190	57 Å²	57	89%	0.888	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-20.9	179.1	-62.7	179.8	175.4	0	0	113.6
262	K	89.3	Confident	90.2	Very high	193 Å²	193	56.2 Å²	56.2	84%	0.839	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-18.9	179	-63	179.7	-178.7	178.1	0	112.1	D260	D260-K262 PolarHBondContact O-N 3.36Å; D260-K262 WeakPolarHBondContact OD1-CA 3.47Å; D260-K262 WeakPolarHBondContact OD1-CB 3.33Å; D260-K262 PolarHBondContact OD1-N 3.13Å
263	S	91.4	Very high	90.1	Very high	7 Å²	7	56 Å²	56	5%	0.049	31%	0.307	C	S	.	.	S	Bend	trans	-59.3	137	177.7	178.9	0	0	0	0	111.1	H257 D260 L265 A266	H257-S263 WeakPolarHBondContact NE2-CB 3.23Å; H257-S263 PolarHBondContact NE2-OG 2.91Å; D260-S263 VanDerWaalsContact O-CB 3.31Å; D260-S263 WeakPolarHBondContact O-CB 3.38Å; D260-S263 PolarHBondContact O-N 2.92Å; D260-S263 PolarHBondContact OD1-N 3.4Å; S263-L265 PolarHBondContact O-N 2.91Å; S263-L265 VanDerWaalsContact O-N 3.09Å; S263-L265 WeakPolarHBondContact OG-CB 3.2Å; S263-L265 PolarHBondContact OG-N 2.82Å; S263-L265 VanDerWaalsContact OG-N 3.12Å; S263-A266 WeakPolarHBondContact O-CB 3.37Å; S263-A266 PolarHBondContact O-N 3.31Å
264	P	89.7	Confident	89.8	Confident	51 Å²	51	58 Å²	58	33%	0.331	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-9.1	172.2	31.5	-36.8	0	0	0	112.7	L217 S234 V236	L217-P264 HydrophobicContact CB-CG 4.47Å; L217-P264 HydrophobicContact CD2-CB 3.82Å; L217-P264 HydrophobicContact CD2-CG 4.23Å; S234-P264 VanDerWaalsContact OG-CB 3.24Å; S234-P264 WeakPolarHBondContact OG-CB 3.42Å; V236-P264 HydrophobicContact CG2-CG 3.58Å
265	L	90.4	Very high	89.4	Confident	6 Å²	6	62.3 Å²	62.3	3%	0.031	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	6.5	173	-62.7	171.9	0	0	0	112.3	L196 L217 I259 S263 L268 F278	L196-L265 HydrophobicContact CD2-CD1 3.79Å; L217-L265 HydrophobicContact CD1-CD2 3.77Å; L217-L265 HydrophobicContact CD2-CD2 3.96Å; I259-L265 HydrophobicContact CG2-CB 4.3Å; S263-L265 PolarHBondContact O-N 2.91Å; S263-L265 VanDerWaalsContact O-N 3.09Å; S263-L265 WeakPolarHBondContact OG-CB 3.2Å; S263-L265 PolarHBondContact OG-N 2.82Å; S263-L265 VanDerWaalsContact OG-N 3.12Å; L265-L268 HydrophobicContact CB-CD1 3.81Å; L265-L268 HydrophobicContact CD2-CD1 3.67Å; L265-L268 HydrophobicContact CG-CD1 4.29Å; L265-L268 WeakPolarHBondContact O-CB 3.45Å; L265-L268 VanDerWaalsContact O-CG 3.28Å; L265-L268 WeakPolarHBondContact O-CG 3.49Å; L265-L268 PolarHBondContact O-N 3.35Å; L265-F278 HydrophobicContact CD2-CE2 4.29Å; L265-F278 HydrophobicContact CD2-CZ 4.3Å
266	A	88.3	Confident	88.9	Confident	38 Å²	38	66.6 Å²	66.6	31%	0.314	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	142.3	176.3	0	0	0	0	0	111.8	D260 S263 L268	D260-A266 WeakPolarHBondContact O-CB 3.43Å; S263-A266 WeakPolarHBondContact O-CB 3.37Å; S263-A266 PolarHBondContact O-N 3.31Å; A266-L268 VanDerWaalsContact C-N 3.26Å; A266-L268 PolarHBondContact O-N 3.5Å
267	G	85.4	Confident	88.6	Confident	60 Å²	60	70.3 Å²	70.3	62%	0.619	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.6	11.1	-179.5	0	0	0	0	0	114.8
268	L	86.8	Confident	88.3	Confident	16 Å²	16	70.4 Å²	70.4	8%	0.084	38%	0.384	C	S	.	.			trans	-69.2	138.7	165	-74.4	176.2	0	0	0	110.5	L265 A266 L273 R276 F278 W308	L265-L268 HydrophobicContact CB-CD1 3.81Å; L265-L268 HydrophobicContact CD2-CD1 3.67Å; L265-L268 HydrophobicContact CG-CD1 4.29Å; L265-L268 WeakPolarHBondContact O-CB 3.45Å; L265-L268 VanDerWaalsContact O-CG 3.28Å; L265-L268 WeakPolarHBondContact O-CG 3.49Å; L265-L268 PolarHBondContact O-N 3.35Å; A266-L268 VanDerWaalsContact C-N 3.26Å; A266-L268 PolarHBondContact O-N 3.5Å; L268-L273 HydrophobicContact CD1-CD1 4.17Å; L268-L273 HydrophobicContact CD2-CD1 4.23Å; L268-R276 HydrophobicContact CD2-CG 3.99Å; L268-F278 HydrophobicContact CD1-CZ 4.49Å; L268-F278 HydrophobicContact CD2-CE1 4.29Å; L268-W308 HydrophobicContact CB-CZ3 4.06Å; L268-W308 VanDerWaalsContact O-CH2 3.26Å; L268-W308 WeakPolarHBondContact O-CH2 3.3Å
269	T	88.3	Confident	88.3	Confident	55 Å²	55	68.9 Å²	68.9	34%	0.337	38%	0.376	S	S	.	.			trans	-130.1	161.2	173.4	64.6	0	0	0	0	108.7	E271 T272 L273	T269-E271 PolarHBondContact O-N 3.17Å; T269-E271 VanDerWaalsContact O-N 3.16Å; T269-T272 PolarHBondContact N-OG1 3.47Å; T269-T272 PolarHBondContact O-N 3.11Å; T269-T272 VanDerWaalsContact O-N 3.13Å; T269-T272 PolarHBondContact O-OG1 2.99Å; T269-T272 WeakPolarHBondContact OG1-CB 3.31Å; T269-T272 VanDerWaalsContact OG1-CG2 3.27Å; T269-T272 WeakPolarHBondContact OG1-CG2 3.47Å; T269-T272 PolarHBondContact OG1-N 3.42Å; T269-T272 PolarHBondContact OG1-OG1 2.93Å; T269-L273 WeakPolarHBondContact O-CB 3.2Å; T269-L273 PolarHBondContact O-N 3.23Å
270	P	88.4	Confident	88.3	Confident	70 Å²	70	67.8 Å²	67.8	46%	0.455	37%	0.37	S	S	.	.	H	α-helix	trans	-52.1	-39.5	176.9	-22.8	29.2	0	0	0	112.6	W308	P270-W308 HydrophobicContact CB-CB 4.49Å; P270-W308 HydrophobicContact CB-CD2 4.35Å; P270-W308 HydrophobicContact CB-CG 4.13Å; P270-W308 HydrophobicContact CG-CD2 3.87Å; P270-W308 HydrophobicContact CG-CG 3.88Å; P270-W308 HydrophobicContact CG-CZ2 4.3Å
271	E	87.1	Confident	88.5	Confident	164 Å²	164	64.7 Å²	64.7	77%	0.766	35%	0.354	S	S	*	.	H	α-helix	trans	-74.9	-34.2	-177.4	-62.9	165	-167.8	0	0	112.9	T269	T269-E271 PolarHBondContact O-N 3.17Å; T269-E271 VanDerWaalsContact O-N 3.16Å
272	T	86.6	Confident	88.8	Confident	47 Å²	47	55.7 Å²	55.7	29%	0.288	31%	0.311	S	S	.	.	H	α-helix	trans	-86.1	-22.3	-177.9	56.6	0	0	0	0	112.7	T269 S274 N275 R276	T269-T272 PolarHBondContact N-OG1 3.47Å; T269-T272 PolarHBondContact O-N 3.11Å; T269-T272 VanDerWaalsContact O-N 3.13Å; T269-T272 PolarHBondContact O-OG1 2.99Å; T269-T272 WeakPolarHBondContact OG1-CB 3.31Å; T269-T272 VanDerWaalsContact OG1-CG2 3.27Å; T269-T272 WeakPolarHBondContact OG1-CG2 3.47Å; T269-T272 PolarHBondContact OG1-N 3.42Å; T269-T272 PolarHBondContact OG1-OG1 2.93Å; T272-S274 PolarHBondContact O-N 3.49Å; T272-N275 PolarHBondContact O-N 2.95Å; T272-R276 WeakPolarHBondContact O-CG 3.45Å; T272-R276 PolarHBondContact O-N 3.12Å; T272-R276 VanDerWaalsContact O-N 3.16Å
273	L	87.5	Confident	89.1	Confident	6 Å²	6	47.1 Å²	47.1	3%	0.031	28%	0.275	C	S	.	.	H	α-helix	trans	-56.3	-50.1	-176.3	-176.8	65.4	0	0	0	111.9	I187 L268 T269 N275 R276 F278 P303 I306 W308	I187-L273 HydrophobicContact CD1-CD2 4.47Å; L268-L273 HydrophobicContact CD1-CD1 4.17Å; L268-L273 HydrophobicContact CD2-CD1 4.23Å; T269-L273 WeakPolarHBondContact O-CB 3.2Å; T269-L273 PolarHBondContact O-N 3.23Å; L273-N275 VanDerWaalsContact C-N 3.25Å; L273-N275 PolarHBondContact O-N 3.04Å; L273-R276 PolarHBondContact O-N 3.39Å; L273-F278 HydrophobicContact CD1-CE1 4.22Å; L273-F278 HydrophobicContact CD1-CZ 3.96Å; L273-P303 HydrophobicContact CD1-CB 4.47Å; L273-P303 WeakPolarHBondContact O-CB 3.42Å; L273-I306 HydrophobicContact CD1-CB 4.48Å; L273-I306 HydrophobicContact CD1-CG2 4.44Å; L273-I306 HydrophobicContact CD2-CB 4.18Å; L273-I306 HydrophobicContact CD2-CG2 4.06Å; L273-I306 VanDerWaalsContact CD2-O 3.3Å; L273-I306 WeakPolarHBondContact CD2-O 3.34Å; L273-W308 HydrophobicContact CD2-CE3 4.35Å
274	S	83.1	Confident	89.2	Confident	78 Å²	78	46.8 Å²	46.8	55%	0.545	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-25.3	-177.6	-54.5	0	0	0	0	113.9	T272	T272-S274 PolarHBondContact O-N 3.49Å
275	N	83.2	Confident	89.3	Confident	135 Å²	135	47 Å²	47	72%	0.722	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-6	-177.1	-67.5	-26.5	0	0	0	113.2	T272 L273	T272-N275 PolarHBondContact O-N 2.95Å; L273-N275 VanDerWaalsContact C-N 3.25Å; L273-N275 PolarHBondContact O-N 3.04Å
276	R	83.9	Confident	89.2	Confident	95 Å²	95	46.9 Å²	46.9	36%	0.358	27%	0.272	S	S	.	.			trans	-83	141.3	-179.3	-75.3	-94.8	-178.1	149.5	0.1	110.3	L268 T272 L273 F278 P303	L268-R276 HydrophobicContact CD2-CG 3.99Å; T272-R276 WeakPolarHBondContact O-CG 3.45Å; T272-R276 PolarHBondContact O-N 3.12Å; T272-R276 VanDerWaalsContact O-N 3.16Å; L273-R276 PolarHBondContact O-N 3.39Å; R276-F278 HydrophobicContact CB-CD1 3.78Å; R276-F278 HydrophobicContact CB-CE1 3.84Å; R276-P303 WeakPolarHBondContact O-CG 3.3Å
277	N	85.8	Confident	89.3	Confident	107 Å²	107	46.1 Å²	46.1	57%	0.572	26%	0.263	S	S	*	.			trans	-103.3	93.7	174.9	-72.8	-29.6	0	0	0	110.4	Q28	Q28-N277 PolarHBondContact NE2-OD1 3.36Å
278	F	90.3	Very high	89.3	Confident	15 Å²	15	44 Å²	44	7%	0.066	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	166.5	170.9	67.5	-96.3	0	0	0	110.9	L217 F218 L265 L268 L273 R276 P303 I306	L217-F278 HydrophobicContact CD1-CB 4.05Å; L217-F278 HydrophobicContact CD1-CD2 3.34Å; L217-F278 HydrophobicContact CD1-CE2 3.96Å; L217-F278 HydrophobicContact CD1-CG 3.87Å; L217-F278 HydrophobicContact CG-CB 4.43Å; F218-F278 CarbonylContact O-C 3.47Å; F218-F278 WeakPolarHBondContact O-CA 3.16Å; F218-F278 WeakPolarHBondContact O-CB 3.35Å; L265-F278 HydrophobicContact CD2-CE2 4.29Å; L265-F278 HydrophobicContact CD2-CZ 4.3Å; L268-F278 HydrophobicContact CD1-CZ 4.49Å; L268-F278 HydrophobicContact CD2-CE1 4.29Å; L273-F278 HydrophobicContact CD1-CE1 4.22Å; L273-F278 HydrophobicContact CD1-CZ 3.96Å; R276-F278 HydrophobicContact CB-CD1 3.78Å; R276-F278 HydrophobicContact CB-CE1 3.84Å; F278-P303 HydrophobicContact CD1-CG 4.11Å; F278-P303 HydrophobicContact CE1-CB 4.08Å; F278-P303 HydrophobicContact CE1-CG 3.97Å; F278-P303 HydrophobicContact CG-CG 4.46Å; F278-P303 HydrophobicContact CZ-CB 4.13Å; F278-P303 HydrophobicContact CZ-CG 4.21Å; F278-P303 WeakPolarHBondContact O-CD 3.44Å; F278-I306 HydrophobicContact CE2-CD1 3.67Å; F278-I306 HydrophobicContact CZ-CD1 3.82Å
279	E	93.2	Very high	89.2	Confident	9 Å²	9	48.4 Å²	48.4	4%	0.042	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	127.6	168.9	-179.4	-179.2	168.4	0	0	108.3	R30 I31 V32 F218 S300 I302	R30-E279 WeakPolarHBondContact CA-OE2 3.24Å; I31-E279 WeakPolarHBondContact CB-OE2 3.4Å; I31-E279 PolarHBondContact N-OE1 3.29Å; I31-E279 PolarHBondContact N-OE2 3.2Å; V32-E279 PolarHBondContact N-OE1 3.34Å; F218-E279 HydrophobicContact CB-CB 4.36Å; F218-E279 PolarHBondContact N-O 2.82Å; F218-E279 PolarHBondContact O-N 2.95Å; E279-S300 WeakPolarHBondContact OE1-CB 3.46Å; E279-S300 PolarHBondContact OE1-OG 3.45Å; E279-I302 HydrophobicContact CG-CG2 4.37Å
280	L	94.9	Very high	89	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	105	176.7	177.9	65.3	0	0	0	109.5	L196 L217 V236 F238 I282 S300 Y301	L196-L280 HydrophobicContact CD2-CD2 3.35Å; L217-L280 HydrophobicContact CD1-CB 4.18Å; L217-L280 HydrophobicContact CD1-CD1 4.22Å; V236-L280 HydrophobicContact CB-CD1 4.33Å; V236-L280 HydrophobicContact CG2-CD1 3.99Å; F238-L280 HydrophobicContact CZ-CD2 4.42Å; L280-I282 HydrophobicContact CD1-CD1 4.03Å; L280-I282 HydrophobicContact CD2-CD1 3.91Å; L280-I282 HydrophobicContact CD2-CG1 4.46Å; L280-I282 HydrophobicContact CG-CD1 3.7Å; L280-I282 HydrophobicContact CG-CG1 4.22Å; L280-S300 CarbonylContact O-C 3.57Å; L280-S300 VanDerWaalsContact O-CA 3.31Å; L280-S300 WeakPolarHBondContact O-CA 3.48Å; L280-Y301 PolarHBondContact N-O 3.34Å; L280-Y301 PolarHBondContact O-N 3.4Å
281	L	95.8	Very high	88.9	Confident	17 Å²	17	51.2 Å²	51.2	9%	0.089	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	124.3	171.6	173.9	64.9	0	0	0	109.4	V32 G215 K216 F218 R298 T299	V32-L281 HydrophobicContact CB-CD1 4.04Å; V32-L281 HydrophobicContact CG1-CD1 3.93Å; V32-L281 HydrophobicContact CG2-CD1 3.87Å; G215-L281 CarbonylContact C-O 3.52Å; G215-L281 VanDerWaalsContact CA-O 3.25Å; G215-L281 WeakPolarHBondContact CA-O 3.45Å; K216-L281 HydrophobicContact CB-CB 4.39Å; K216-L281 PolarHBondContact N-O 2.95Å; K216-L281 PolarHBondContact O-N 2.88Å; F218-L281 HydrophobicContact CD2-CB 4.24Å; F218-L281 HydrophobicContact CE2-CB 3.56Å; F218-L281 HydrophobicContact CE2-CD2 3.76Å; F218-L281 HydrophobicContact CE2-CG 4.25Å; F218-L281 HydrophobicContact CZ-CB 3.96Å; F218-L281 HydrophobicContact CZ-CD2 3.57Å; F218-L281 HydrophobicContact CZ-CG 4.42Å; L281-R298 HydrophobicContact CD1-CB 4.23Å; L281-T299 WeakPolarHBondContact CD1-O 3.3Å
282	I	96.1	Very high	88.9	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	131.7	172.9	-58.9	-55.7	0	0	0	108.9	F181 L213 F238 L280 R298 T299 Y301	F181-I282 HydrophobicContact CD1-CG2 4.33Å; F181-I282 HydrophobicContact CE1-CG2 3.88Å; L213-I282 HydrophobicContact CD1-CG2 3.47Å; L213-I282 VanDerWaalsContact CD1-CG2 3.47Å; L213-I282 HydrophobicContact CD2-CG2 4.07Å; L213-I282 HydrophobicContact CG-CG2 3.88Å; F238-I282 HydrophobicContact CD2-CD1 4.23Å; F238-I282 HydrophobicContact CE1-CD1 4.41Å; F238-I282 HydrophobicContact CE2-CD1 3.29Å; F238-I282 HydrophobicContact CZ-CD1 3.41Å; F238-I282 VanDerWaalsContact CZ-CD1 3.41Å; L280-I282 HydrophobicContact CD1-CD1 4.03Å; L280-I282 HydrophobicContact CD2-CD1 3.91Å; L280-I282 HydrophobicContact CD2-CG1 4.46Å; L280-I282 HydrophobicContact CG-CD1 3.7Å; L280-I282 HydrophobicContact CG-CG1 4.22Å; I282-R298 CarbonylContact O-C 3.5Å; I282-R298 VanDerWaalsContact O-CA 3.27Å; I282-R298 WeakPolarHBondContact O-CA 3.4Å; I282-T299 HydrophobicContact CB-CG2 4Å; I282-T299 PolarHBondContact N-O 3.23Å; I282-T299 PolarHBondContact O-N 3.45Å; I282-Y301 HydrophobicContact CB-CE2 4.29Å; I282-Y301 HydrophobicContact CG1-CD2 3.79Å; I282-Y301 HydrophobicContact CG1-CE2 3.67Å
283	T	95.3	Very high	88.9	Confident	13 Å²	13	46.2 Å²	46.2	8%	0.08	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	123.6	179.9	-59	0	0	0	0	109.7	L213 T214 Q296 S297 R298	L213-T283 WeakPolarHBondContact CA-O 3.47Å; T214-T283 PolarHBondContact N-O 3.32Å; T214-T283 PolarHBondContact O-N 3.29Å; T283-Q296 HydrophobicContact CG2-CG 3.49Å; T283-Q296 VanDerWaalsContact CG2-CG 3.49Å; T283-S297 WeakPolarHBondContact CA-O 3.3Å; T283-R298 HydrophobicContact CG2-CG 3.93Å
284	L	92.9	Very high	89	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.005	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	118.1	167.9	-172.5	82.4	0	0	0	108.8	I179 F181 V200 C211 Q212 L213 L249 Q296 S297	I179-L284 HydrophobicContact CD1-CD2 4Å; I179-L284 HydrophobicContact CG2-CD2 3.61Å; F181-L284 HydrophobicContact CE1-CB 4.19Å; F181-L284 HydrophobicContact CZ-CB 3.75Å; V200-L284 HydrophobicContact CG1-CD2 3.94Å; C211-L284 HydrophobicContact CB-CD1 4.4Å; Q212-L284 WeakPolarHBondContact O-CA 3.48Å; L213-L284 HydrophobicContact CB-CD1 4.13Å; L213-L284 HydrophobicContact CD1-CB 3.86Å; L213-L284 HydrophobicContact CD1-CD1 3.73Å; L213-L284 HydrophobicContact CD1-CG 4.42Å; L249-L284 HydrophobicContact CD1-CD1 4.33Å; L249-L284 HydrophobicContact CD1-CD2 3.97Å; L284-Q296 WeakPolarHBondContact O-CA 3.46Å; L284-S297 PolarHBondContact N-O 2.82Å; L284-S297 PolarHBondContact O-N 3.44Å
285	N	91.6	Very high	89.2	Confident	54 Å²	54	47.7 Å²	47.7	29%	0.289	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	139.6	166.6	-63.2	-37.1	0	0	0	108.6	C211 Q212 C295 Q296	C211-N285 CarbonylContact C-O 3.52Å; C211-N285 VanDerWaalsContact CA-O 3.26Å; C211-N285 WeakPolarHBondContact CA-O 3.43Å; Q212-N285 PolarHBondContact N-O 3.21Å; Q212-N285 PolarHBondContact O-N 3.09Å; N285-C295 WeakPolarHBondContact CA-O 3.34Å; N285-Q296 WeakPolarHBondContact OD1-CG 3.21Å; N285-Q296 PolarHBondContact OD1-NE2 2.92Å
286	G	89.6	Confident	89.6	Confident	4 Å²	4	45.9 Å²	45.9	4%	0.041	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	156.4	173	0	0	0	0	0	111.9	C295	G286-C295 PolarHBondContact N-O 3.28Å; G286-C295 PolarHBondContact O-N 3.3Å; G286-C295 PolarHBondContact O-SG 3.45Å
287	T	89.4	Confident	90	Very high	22 Å²	22	42 Å²	42	14%	0.135	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	128.9	-178.8	-56.8	0	0	0	0	109.7	L208 I209	L208-T287 WeakPolarHBondContact CA-O 3.47Å; I209-T287 PolarHBondContact N-O 3.1Å; I209-T287 PolarHBondContact O-N 3.26Å
288	M	86.4	Confident	90.5	Very high	15 Å²	15	40.4 Å²	40.4	7%	0.074	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	128.8	176.6	-66.8	-170.8	-59.2	0	0	111	P172 R175 L208 S290 T291 A292 A293	P172-M288 HydrophobicContact CB-CE 3.38Å; P172-M288 HydrophobicContact CB-SD 4.09Å; R175-M288 HydrophobicContact CB-SD 3.46Å; R175-M288 WeakPolarHBondContact CB-SD 3.21Å; R175-M288 HydrophobicContact CG-CG 3.88Å; R175-M288 HydrophobicContact CG-SD 3.32Å; R175-M288 WeakPolarHBondContact CG-SD 3.32Å; L208-M288 HydrophobicContact CD2-CG 4.09Å; M288-S290 VanDerWaalsContact C-N 3.32Å; M288-S290 PolarHBondContact O-N 2.96Å; M288-T291 VanDerWaalsContact CE-OG1 3.24Å; M288-T291 WeakPolarHBondContact CE-OG1 3.24Å; M288-A292 VanDerWaalsContact O-CA 3.24Å; M288-A292 WeakPolarHBondContact O-CA 3.35Å; M288-A292 PolarHBondContact O-N 3.06Å; M288-A293 HydrophobicContact CE-CB 3.81Å; M288-A293 PolarHBondContact N-O 2.94Å
289	E	84.6	Confident	90.7	Very high	110 Å²	110	39.9 Å²	39.9	51%	0.514	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-42.3	178.4	179.7	-180	-150	0	0	112.9	L207 I209 T291	L207-E289 HydrophobicContact CB-CB 4.31Å; L207-E289 WeakPolarHBondContact CB-OE2 3.06Å; L207-E289 WeakPolarHBondContact CG-OE2 3.31Å; L207-E289 PolarHBondContact N-OE2 2.81Å; I209-E289 HydrophobicContact CD1-CB 3.93Å; I209-E289 HydrophobicContact CD1-CG 4.13Å; I209-E289 HydrophobicContact CG1-CB 4.4Å; E289-T291 PolarHBondContact O-N 2.87Å
290	S	83.5	Confident	90.8	Very high	99 Å²	99	39.4 Å²	39.4	69%	0.692	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74	-25	-171.5	58.1	0	0	0	0	115.1	M288	M288-S290 VanDerWaalsContact C-N 3.32Å; M288-S290 PolarHBondContact O-N 2.96Å
291	T	85.1	Confident	90.9	Very high	84 Å²	84	39.4 Å²	39.4	52%	0.515	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-130.7	-0.1	-175	73.5	0	0	0	0	113.7	M288 E289 A293	M288-T291 VanDerWaalsContact CE-OG1 3.24Å; M288-T291 WeakPolarHBondContact CE-OG1 3.24Å; E289-T291 PolarHBondContact O-N 2.87Å; T291-A293 PolarHBondContact O-N 3.35Å; T291-A293 VanDerWaalsContact OG1-CB 3.28Å; T291-A293 WeakPolarHBondContact OG1-CB 3.11Å; T291-A293 PolarHBondContact OG1-N 3.49Å
292	A	87.4	Confident	90.7	Very high	78 Å²	78	39.3 Å²	39.3	65%	0.645	23%	0.231	S	C	*	.			trans	52.7	16.9	-170.9	0	0	0	0	0	114.7	M288	M288-A292 VanDerWaalsContact O-CA 3.24Å; M288-A292 WeakPolarHBondContact O-CA 3.35Å; M288-A292 PolarHBondContact O-N 3.06Å
293	A	87.1	Confident	90.6	Very high	28 Å²	28	39.3 Å²	39.3	23%	0.231	23%	0.231	C	C	.	.			trans	-85.1	137.8	-179.6	0	0	0	0	0	110.2	M288 T291	M288-A293 HydrophobicContact CE-CB 3.81Å; M288-A293 PolarHBondContact N-O 2.94Å; T291-A293 PolarHBondContact O-N 3.35Å; T291-A293 VanDerWaalsContact OG1-CB 3.28Å; T291-A293 WeakPolarHBondContact OG1-CB 3.11Å; T291-A293 PolarHBondContact OG1-N 3.49Å
294	T	88.9	Confident	90.4	Very high	109 Å²	109	43.3 Å²	43.3	67%	0.669	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-75	134.4	175.6	54.6	0	0	0	0	110.2	P172	P172-T294 VanDerWaalsContact CG-O 3.31Å; P172-T294 WeakPolarHBondContact CG-O 3.49Å
295	C	89.1	Confident	90.5	Very high	6 Å²	6	44.7 Å²	44.7	4%	0.041	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	143.6	174.6	73.3	0	0	0	0	109.3	P172 N285 G286	P172-C295 HydrophobicContact CB-CB 4.16Å; N285-C295 WeakPolarHBondContact CA-O 3.34Å; G286-C295 PolarHBondContact N-O 3.28Å; G286-C295 PolarHBondContact O-N 3.3Å; G286-C295 PolarHBondContact O-SG 3.45Å
296	Q	90.9	Very high	90.6	Very high	97 Å²	97	42.5 Å²	42.5	45%	0.453	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	124	178.6	179.5	175.3	88.7	0	0	108.3	A176 T283 L284 N285 R298	A176-Q296 VanDerWaalsContact CB-O 3.24Å; A176-Q296 WeakPolarHBondContact CB-O 3.16Å; T283-Q296 HydrophobicContact CG2-CG 3.49Å; T283-Q296 VanDerWaalsContact CG2-CG 3.49Å; L284-Q296 WeakPolarHBondContact O-CA 3.46Å; N285-Q296 WeakPolarHBondContact OD1-CG 3.21Å; N285-Q296 PolarHBondContact OD1-NE2 2.92Å; Q296-R298 HydrophobicContact CG-CG 4.1Å
297	S	93	Very high	90.9	Very high	14 Å²	14	44.6 Å²	44.6	10%	0.098	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	144.3	171.4	-165.9	0	0	0	0	109.7	A176 T283 L284	A176-S297 PolarHBondContact O-OG 3.06Å; A176-S297 VanDerWaalsContact O-OG 3.11Å; T283-S297 WeakPolarHBondContact CA-O 3.3Å; L284-S297 PolarHBondContact N-O 2.82Å; L284-S297 PolarHBondContact O-N 3.44Å
298	R	94.6	Very high	91.2	Very high	74 Å²	74	46.9 Å²	46.9	28%	0.279	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	147.5	-170.4	-60.3	175.5	-59	-157.6	11.5	110.4	G36 N38 L281 I282 T283 Q296	G36-R298 WeakPolarHBondContact CA-O 3.3Å; G36-R298 PolarHBondContact N-O 3.13Å; G36-R298 PolarHBondContact O-NH2 2.93Å; N38-R298 PolarHBondContact OD1-NH2 3.35Å; L281-R298 HydrophobicContact CD1-CB 4.23Å; I282-R298 CarbonylContact O-C 3.5Å; I282-R298 VanDerWaalsContact O-CA 3.27Å; I282-R298 WeakPolarHBondContact O-CA 3.4Å; T283-R298 HydrophobicContact CG2-CG 3.93Å; Q296-R298 HydrophobicContact CG-CG 4.1Å
299	T	95.7	Very high	91.5	Very high	3 Å²	3	49 Å²	49	2%	0.018	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	163.6	169.7	-170.6	0	0	0	0	109.4	K34 F181 L281 I282 Y301	K34-T299 PolarHBondContact O-OG1 2.88Å; K34-T299 VanDerWaalsContact O-OG1 3.1Å; F181-T299 HydrophobicContact CB-CG2 3.64Å; F181-T299 HydrophobicContact CD1-CG2 3.62Å; F181-T299 HydrophobicContact CD2-CG2 3.74Å; F181-T299 HydrophobicContact CE1-CG2 4.19Å; F181-T299 HydrophobicContact CE2-CG2 4.27Å; F181-T299 HydrophobicContact CG-CG2 3.38Å; F181-T299 HydrophobicContact CZ-CG2 4.48Å; L281-T299 WeakPolarHBondContact CD1-O 3.3Å; I282-T299 HydrophobicContact CB-CG2 4Å; I282-T299 PolarHBondContact N-O 3.23Å; I282-T299 PolarHBondContact O-N 3.45Å; T299-Y301 HydrophobicContact CG2-CD2 4.5Å; T299-Y301 HydrophobicContact CG2-CE2 3.65Å
300	S	95.6	Very high	92	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	151.3	174.2	62.7	0	0	0	0	111.3	V32 K34 E279 L280	V32-S300 WeakPolarHBondContact O-CB 3.3Å; V32-S300 PolarHBondContact O-OG 3.32Å; K34-S300 WeakPolarHBondContact CD-O 3.49Å; K34-S300 WeakPolarHBondContact CE-O 3.07Å; K34-S300 PolarHBondContact NZ-O 3.16Å; E279-S300 WeakPolarHBondContact OE1-CB 3.46Å; E279-S300 PolarHBondContact OE1-OG 3.45Å; L280-S300 CarbonylContact O-C 3.57Å; L280-S300 VanDerWaalsContact O-CA 3.31Å; L280-S300 WeakPolarHBondContact O-CA 3.48Å
301	Y	95.4	Very high	92.4	Very high	0 Å²	0	50 Å²	50	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	118.9	169.4	-59.1	-86.7	0	0	0	109.4	S182 A185 V198 L280 I282 T299 E305	S182-Y301 WeakPolarHBondContact O-CE1 3.2Å; S182-Y301 PolarHBondContact O-OH 3.49Å; S182-Y301 PolarHBondContact OG-OH 2.92Å; A185-Y301 HydrophobicContact CB-CD1 3.87Å; A185-Y301 HydrophobicContact CB-CD2 4.5Å; A185-Y301 HydrophobicContact CB-CE1 4.08Å; A185-Y301 HydrophobicContact CB-CG 4.11Å; V198-Y301 HydrophobicContact CG1-CE2 4.07Å; V198-Y301 VanDerWaalsContact CG1-OH 3.27Å; V198-Y301 WeakPolarHBondContact CG1-OH 3.49Å; V198-Y301 HydrophobicContact CG2-CE2 3.94Å; L280-Y301 PolarHBondContact N-O 3.34Å; L280-Y301 PolarHBondContact O-N 3.4Å; I282-Y301 HydrophobicContact CB-CE2 4.29Å; I282-Y301 HydrophobicContact CG1-CD2 3.79Å; I282-Y301 HydrophobicContact CG1-CE2 3.67Å; T299-Y301 HydrophobicContact CG2-CD2 4.5Å; T299-Y301 HydrophobicContact CG2-CE2 3.65Å; Y301-E305 WeakPolarHBondContact CA-OE2 3.39Å; Y301-E305 HydrophobicContact CD1-CB 4.4Å
302	I	93.2	Very high	92.8	Very high	14 Å²	14	47 Å²	47	7%	0.072	26%	0.255	C	S	.	.			trans	-85.9	159	165.4	60.8	175.7	0	0	0	109.5	Q28 R30 E279 Q304 E305	Q28-I302 HydrophobicContact CB-CD1 4.4Å; R30-I302 VanDerWaalsContact NH2-CD1 3.33Å; E279-I302 HydrophobicContact CG-CG2 4.37Å; I302-Q304 VanDerWaalsContact CG1-OE1 3.31Å; I302-Q304 PolarHBondContact O-N 3.06Å; I302-Q304 VanDerWaalsContact O-N 3.08Å; I302-E305 HydrophobicContact CD1-CG 4.45Å; I302-E305 HydrophobicContact CG1-CB 4.39Å; I302-E305 VanDerWaalsContact CG1-CD 3.43Å; I302-E305 HydrophobicContact CG1-CG 3.7Å; I302-E305 WeakPolarHBondContact CG1-OE2 3.24Å; I302-E305 PolarHBondContact N-OE2 2.83Å; I302-E305 WeakPolarHBondContact O-CA 3.12Å; I302-E305 WeakPolarHBondContact O-CB 3.5Å; I302-E305 PolarHBondContact O-N 3.28Å
303	P	92.7	Very high	93	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.006	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-53.5	-33.1	-175.1	-7.9	-3.6	0	0	0	115.1	L273 R276 F278 E305 I306	L273-P303 HydrophobicContact CD1-CB 4.47Å; L273-P303 WeakPolarHBondContact O-CB 3.42Å; R276-P303 WeakPolarHBondContact O-CG 3.3Å; F278-P303 HydrophobicContact CD1-CG 4.11Å; F278-P303 HydrophobicContact CE1-CB 4.08Å; F278-P303 HydrophobicContact CE1-CG 3.97Å; F278-P303 HydrophobicContact CG-CG 4.46Å; F278-P303 HydrophobicContact CZ-CB 4.13Å; F278-P303 HydrophobicContact CZ-CG 4.21Å; F278-P303 WeakPolarHBondContact O-CD 3.44Å; P303-E305 PolarHBondContact O-N 3Å; P303-I306 PolarHBondContact O-N 2.98Å
304	Q	91.7	Very high	93	Very high	96 Å²	96	48.3 Å²	48.3	45%	0.449	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-68.3	-18.1	176	-55.8	87.5	-4.6	0	0	113.6	I302	I302-Q304 VanDerWaalsContact CG1-OE1 3.31Å; I302-Q304 PolarHBondContact O-N 3.06Å; I302-Q304 VanDerWaalsContact O-N 3.08Å
305	E	94.4	Very high	92.9	Very high	30 Å²	30	43.5 Å²	43.5	14%	0.14	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-96.4	6.8	177.9	-59.1	166.2	161.3	0	0	111.9	R30 K34 V184 A185 Y301 I302 P303	R30-E305 IonicContact CZ-OE1 3.54Å; R30-E305 IonicContact NH1-OE1 2.63Å; R30-E305 PolarHBondContact NH1-OE1 3Å; R30-E305 IonicContact NH1-OE2 2.89Å; R30-E305 IonicContact NH2-OE1 3.33Å; R30-E305 PolarHBondContact NH2-OE1 2.95Å; K34-E305 WeakPolarHBondContact CE-OE1 3.27Å; K34-E305 WeakPolarHBondContact CE-OE2 3.44Å; K34-E305 VanDerWaalsContact NZ-CD 3.26Å; K34-E305 IonicContact NZ-OE1 3.07Å; K34-E305 IonicContact NZ-OE2 2.75Å; K34-E305 PolarHBondContact NZ-OE2 2.78Å; V184-E305 CarbonylContact C-O 3.36Å; V184-E305 VanDerWaalsContact CA-O 3.26Å; V184-E305 WeakPolarHBondContact CA-O 3.38Å; V184-E305 WeakPolarHBondContact CB-O 3.3Å; A185-E305 PolarHBondContact N-O 2.91Å; Y301-E305 WeakPolarHBondContact CA-OE2 3.39Å; Y301-E305 HydrophobicContact CD1-CB 4.4Å; I302-E305 HydrophobicContact CD1-CG 4.45Å; I302-E305 HydrophobicContact CG1-CB 4.39Å; I302-E305 VanDerWaalsContact CG1-CD 3.43Å; I302-E305 HydrophobicContact CG1-CG 3.7Å; I302-E305 WeakPolarHBondContact CG1-OE2 3.24Å; I302-E305 PolarHBondContact N-OE2 2.83Å; I302-E305 WeakPolarHBondContact O-CA 3.12Å; I302-E305 WeakPolarHBondContact O-CB 3.5Å; I302-E305 PolarHBondContact O-N 3.28Å; P303-E305 PolarHBondContact O-N 3Å
306	I	95.4	Very high	92.7	Very high	8 Å²	8	46.6 Å²	46.6	4%	0.041	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	119.1	175.5	-55.4	178.4	0	0	0	108.1	A185 I187 L196 L273 F278 P303	A185-I306 HydrophobicContact CB-CG1 4.27Å; A185-I306 CarbonylContact O-C 3.51Å; A185-I306 WeakPolarHBondContact O-CA 3.48Å; I187-I306 HydrophobicContact CD1-CG2 3.62Å; I187-I306 HydrophobicContact CG1-CG2 3.8Å; L196-I306 HydrophobicContact CD1-CG2 3.71Å; L273-I306 HydrophobicContact CD1-CB 4.48Å; L273-I306 HydrophobicContact CD1-CG2 4.44Å; L273-I306 HydrophobicContact CD2-CB 4.18Å; L273-I306 HydrophobicContact CD2-CG2 4.06Å; L273-I306 VanDerWaalsContact CD2-O 3.3Å; L273-I306 WeakPolarHBondContact CD2-O 3.34Å; F278-I306 HydrophobicContact CE2-CD1 3.67Å; F278-I306 HydrophobicContact CZ-CD1 3.82Å; P303-I306 PolarHBondContact O-N 2.98Å
307	L	95.2	Very high	92.3	Very high	48 Å²	48	46 Å²	46	25%	0.251	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	122.7	-172.6	-58	179	0	0	0	111.1	V184 A185 V186 I187 Y310 I334	V184-L307 HydrophobicContact CB-CD1 4.12Å; V184-L307 HydrophobicContact CB-CG 4.38Å; V184-L307 HydrophobicContact CG1-CD1 4.1Å; V184-L307 HydrophobicContact CG1-CG 4.49Å; V184-L307 HydrophobicContact CG2-CD1 4.05Å; A185-L307 PolarHBondContact O-N 2.64Å; V186-L307 CarbonylContact C-O 3.59Å; V186-L307 VanDerWaalsContact CA-O 3.29Å; V186-L307 WeakPolarHBondContact CA-O 3.4Å; V186-L307 HydrophobicContact CG1-CB 4.48Å; I187-L307 PolarHBondContact N-O 3.06Å; L307-Y310 HydrophobicContact CB-CD2 3.67Å; L307-Y310 HydrophobicContact CB-CE2 4.26Å; L307-Y310 HydrophobicContact CB-CG 4.21Å; L307-I334 HydrophobicContact CD1-CD1 3.18Å
308	W	95.1	Very high	91.7	Very high	71 Å²	71	50 Å²	50	27%	0.269	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	134.2	-177.6	-164.4	-69.2	0	0	0	112.1	I187 L194 L268 P270 L273 Y310	I187-W308 HydrophobicContact CB-CD2 4.24Å; I187-W308 HydrophobicContact CB-CE3 4.14Å; I187-W308 HydrophobicContact CD1-CE3 3.61Å; I187-W308 HydrophobicContact CD1-CZ3 3.79Å; I187-W308 HydrophobicContact CG1-CE3 4.47Å; I187-W308 HydrophobicContact CG2-CD2 3.97Å; I187-W308 HydrophobicContact CG2-CE3 3.93Å; I187-W308 HydrophobicContact CG2-CH2 4.22Å; I187-W308 HydrophobicContact CG2-CZ2 4.25Å; I187-W308 HydrophobicContact CG2-CZ3 4.05Å; L194-W308 HydrophobicContact CD1-CH2 4.47Å; L194-W308 HydrophobicContact CD1-CZ2 3.94Å; L194-W308 HydrophobicContact CD2-CH2 3.57Å; L194-W308 HydrophobicContact CD2-CZ2 3.79Å; L268-W308 HydrophobicContact CB-CZ3 4.06Å; L268-W308 VanDerWaalsContact O-CH2 3.26Å; L268-W308 WeakPolarHBondContact O-CH2 3.3Å; P270-W308 HydrophobicContact CB-CB 4.49Å; P270-W308 HydrophobicContact CB-CD2 4.35Å; P270-W308 HydrophobicContact CB-CG 4.13Å; P270-W308 HydrophobicContact CG-CD2 3.87Å; P270-W308 HydrophobicContact CG-CG 3.88Å; P270-W308 HydrophobicContact CG-CZ2 4.3Å; L273-W308 HydrophobicContact CD2-CE3 4.35Å; W308-Y310 VanDerWaalsContact C-N 3.34Å; W308-Y310 VanDerWaalsContact O-CD2 3.24Å; W308-Y310 WeakPolarHBondContact O-CD2 3.32Å
309	G	93.5	Very high	91	Very high	59 Å²	59	48.6 Å²	48.6	61%	0.608	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.1	11.4	176.7	0	0	0	0	0	114.5	I187	I187-G309 WeakPolarHBondContact O-CA 3.38Å; I187-G309 PolarHBondContact O-N 3.35Å
310	Y	93.9	Very high	90	Very high	114 Å²	114	53.9 Å²	53.9	45%	0.447	30%	0.303	S	S	.	.			trans	-104.3	154.6	178.7	-71.4	-92.4	0	0	0	111.2	V186 C188 L307 W308 I334	V186-Y310 WeakPolarHBondContact CB-O 3.36Å; V186-Y310 WeakPolarHBondContact CG2-O 3.25Å; C188-Y310 WeakPolarHBondContact CB-O 3.46Å; L307-Y310 HydrophobicContact CB-CD2 3.67Å; L307-Y310 HydrophobicContact CB-CE2 4.26Å; L307-Y310 HydrophobicContact CB-CG 4.21Å; W308-Y310 VanDerWaalsContact C-N 3.34Å; W308-Y310 VanDerWaalsContact O-CD2 3.24Å; W308-Y310 WeakPolarHBondContact O-CD2 3.32Å; Y310-I334 HydrophobicContact CD1-CB 4.24Å; Y310-I334 HydrophobicContact CD1-CD1 3.51Å; Y310-I334 HydrophobicContact CD1-CG1 3.76Å; Y310-I334 HydrophobicContact CE1-CD1 4Å; Y310-I334 HydrophobicContact CE1-CG1 4.39Å; Y310-I334 HydrophobicContact CG-CD1 3.87Å; Y310-I334 HydrophobicContact CG-CG1 4.41Å
311	E	93.2	Very high	89.1	Confident	117 Å²	117	59.7 Å²	59.7	55%	0.547	33%	0.334	S	S	.	.			trans	-133.6	138.8	177.6	-69.1	-172.6	178.4	0	0	109.6	C188 T313 I334	C188-E311 HydrophobicContact CB-CG 3.64Å; E311-T313 PolarHBondContact O-N 3.01Å; E311-I334 CarbonylContact O-C 3.51Å; E311-I334 VanDerWaalsContact O-CA 3.31Å; E311-I334 WeakPolarHBondContact O-CA 3.25Å
312	F	93.4	Very high	88	Confident	21 Å²	21	65.5 Å²	65.5	9%	0.092	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-68.1	134.6	-178.8	-67.8	-73	0	0	0	112.5	V184 V186 M197 R199 T254 I334	V184-F312 HydrophobicContact CG2-CE1 4.49Å; V184-F312 WeakPolarHBondContact O-CZ 3.29Å; V186-F312 HydrophobicContact CG1-CE1 4.22Å; V186-F312 HydrophobicContact CG1-CE2 4.4Å; V186-F312 HydrophobicContact CG1-CZ 4.11Å; V186-F312 HydrophobicContact CG2-CD2 3.73Å; V186-F312 HydrophobicContact CG2-CE2 3.6Å; V186-F312 HydrophobicContact CG2-CG 4.38Å; V186-F312 HydrophobicContact CG2-CZ 4.15Å; M197-F312 HydrophobicContact CB-CD2 4.41Å; M197-F312 HydrophobicContact CB-CE2 4.09Å; R199-F312 HydrophobicContact CB-CD2 4.39Å; R199-F312 HydrophobicContact CB-CE1 4.48Å; R199-F312 HydrophobicContact CB-CE2 4.15Å; R199-F312 HydrophobicContact CB-CZ 4.21Å; T254-F312 HydrophobicContact CG2-CD2 4.18Å; T254-F312 HydrophobicContact CG2-CE2 4.49Å; F312-I334 HydrophobicContact CD1-CG2 3.71Å; F312-I334 HydrophobicContact CE1-CG2 3.93Å
313	T	91.4	Very high	87.3	Confident	43 Å²	43	73.7 Å²	73.7	26%	0.264	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-62.5	140	175	-51.6	0	0	0	0	110.7	R199 E311 F330 K333	R199-T313 PolarHBondContact NH1-O 3.26Å; R199-T313 VanDerWaalsContact NH1-O 3.09Å; R199-T313 PolarHBondContact NH2-O 2.73Å; E311-T313 PolarHBondContact O-N 3.01Å; T313-F330 HydrophobicContact CG2-CD1 3.97Å; T313-K333 PolarHBondContact N-O 2.82Å
314	P	87.4	Confident	86.7	Confident	89 Å²	89	82.8 Å²	82.8	58%	0.578	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-55.7	140.7	173.2	-25.4	34.6	0	0	0	112.3	F317	P314-F317 VanDerWaalsContact O-CZ 3.25Å; P314-F317 WeakPolarHBondContact O-CZ 3.34Å
315	V	86.6	Confident	86.4	Confident	8 Å²	8	81.7 Å²	81.7	5%	0.048	44%	0.438	C	S	.	.			trans	-111.6	-9.2	-177.3	-65.4	0	0	0	0	113.6	R199 P252 V326 D327 F330	R199-V315 VanDerWaalsContact NH1-CG1 3.28Å; P252-V315 HydrophobicContact CB-CG2 3.9Å; P252-V315 HydrophobicContact CG-CG2 3.87Å; V315-V326 WeakPolarHBondContact O-CA 3.41Å; V315-D327 PolarHBondContact O-N 3.29Å; V315-D327 VanDerWaalsContact O-N 3.12Å; V315-F330 HydrophobicContact CG1-CB 4.2Å
316	L	84.4	Confident	85.9	Confident	72 Å²	72	82 Å²	82	38%	0.377	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	119.3	-178.1	-72.7	165.9	0	0	0	109.7	L251 V326	L251-L316 HydrophobicContact CB-CD2 4.39Å; L251-L316 HydrophobicContact CD1-CD1 3.8Å; L251-L316 HydrophobicContact CD1-CD2 3.81Å; L251-L316 HydrophobicContact CD1-CG 4.47Å; L251-L316 HydrophobicContact CD2-CD2 3.72Å; L251-L316 HydrophobicContact CG-CD2 4.15Å; L316-V326 HydrophobicContact CD2-CG2 3.6Å
317	F	83.1	Confident	85.4	Confident	83 Å²	83	83.9 Å²	83.9	36%	0.364	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	147	178.1	-55.2	-79.9	0	0	0	110.3	P314 V325 D327 F330	P314-F317 VanDerWaalsContact O-CZ 3.25Å; P314-F317 WeakPolarHBondContact O-CZ 3.34Å; F317-V325 PolarHBondContact N-O 3.28Å; F317-V325 PolarHBondContact O-N 3.39Å; F317-D327 HydrophobicContact CD2-CB 4.06Å; F317-D327 HydrophobicContact CE2-CB 3.96Å; F317-F330 AromaticContact CE2-CD2 3.98Å; F317-F330 HydrophobicContact CE2-CD2 3.98Å; F317-F330 HydrophobicContact CE2-CE2 4.41Å; F317-F330 HydrophobicContact CE2-CG 4.36Å; F317-F330 HydrophobicContact CZ-CD2 4.18Å; F317-F330 HydrophobicContact CZ-CE2 4.44Å; F317-F330 HydrophobicContact CZ-CG 4.28Å
318	S	79.8	Confident	85	Confident	98 Å²	98	84.9 Å²	84.9	69%	0.685	46%	0.455	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.4	125.7	171.2	-173.1	0	0	0	0	109.3
319	S	79.6	Confident	84.6	Confident	45 Å²	45	87.3 Å²	87.3	32%	0.315	47%	0.473	S	S	.	.			trans	-89.7	155.4	174	-175.7	0	0	0	0	111.2	N321 C322 R323	S319-N321 PolarHBondContact O-N 2.03Å; S319-C322 PolarHBondContact O-N 3.3Å; S319-C322 VanDerWaalsContact O-N 3.07Å; S319-R323 WeakPolarHBondContact CB-O 3.06Å; S319-R323 PolarHBondContact N-O 3.47Å
320	S	75.4	Confident	84.3	Confident	115 Å²	115	87.3 Å²	87.3	80%	0.804	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-21.4	177.7	56.8	0	0	0	0	114.3
321	N	76.5	Confident	84.1	Confident	121 Å²	121	81.9 Å²	81.9	65%	0.647	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	23.8	-179.8	-64.1	0.6	0	0	0	113.4	S319 R323	S319-N321 PolarHBondContact O-N 2.03Å; N321-R323 PolarHBondContact O-N 3.47Å
322	C	72.9	Confident	84	Confident	123 Å²	123	78.7 Å²	78.7	83%	0.831	42%	0.422	S	S	*	.	S	Bend	trans	56.2	30.3	-177.9	-63.7	0	0	0	0	114.3	S319	S319-C322 PolarHBondContact O-N 3.3Å; S319-C322 VanDerWaalsContact O-N 3.07Å
323	R	78.3	Confident	83.8	Confident	185 Å²	185	82.3 Å²	82.3	70%	0.698	44%	0.438	S	S	*	.			trans	-114.3	139.6	175.6	-65.8	-176.4	-172.8	176.6	2.1	110.1	S319 N321	S319-R323 WeakPolarHBondContact CB-O 3.06Å; S319-R323 PolarHBondContact N-O 3.47Å; N321-R323 PolarHBondContact O-N 3.47Å
324	Y	80.3	Confident	83.7	Confident	192 Å²	192	84 Å²	84	75%	0.753	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.4	129.6	167.8	-66.9	-75.2	0	0	0	109.7
325	V	83.6	Confident	83.5	Confident	73 Å²	73	83.8 Å²	83.8	44%	0.442	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	127.9	176.6	-180	0	0	0	0	108.3	F317	F317-V325 PolarHBondContact N-O 3.28Å; F317-V325 PolarHBondContact O-N 3.39Å
326	V	84.3	Confident	83.3	Confident	37 Å²	37	87.7 Å²	87.7	22%	0.224	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	114.4	170.8	179.3	0	0	0	0	107.7	L251 P252 V315 L316 F328	L251-V326 HydrophobicContact CD2-CG2 3.68Å; P252-V326 HydrophobicContact CG-CG1 3.57Å; V315-V326 WeakPolarHBondContact O-CA 3.41Å; L316-V326 HydrophobicContact CD2-CG2 3.6Å; V326-F328 HydrophobicContact CB-CE2 4.39Å; V326-F328 HydrophobicContact CG1-CD2 4.09Å; V326-F328 HydrophobicContact CG1-CE2 3.79Å; V326-F328 HydrophobicContact CG1-CZ 4.12Å
327	D	85.4	Confident	83.2	Confident	47 Å²	47	88.6 Å²	88.6	25%	0.251	46%	0.462	S	S	.	.			trans	-94.5	106.7	173.9	-171.2	-9.5	0	0	0	110.5	V315 F317 N329 F330	V315-D327 PolarHBondContact O-N 3.29Å; V315-D327 VanDerWaalsContact O-N 3.12Å; F317-D327 HydrophobicContact CD2-CB 4.06Å; F317-D327 HydrophobicContact CE2-CB 3.96Å; D327-N329 PolarHBondContact O-N 3.27Å; D327-N329 WeakPolarHBondContact OD1-CB 3.01Å; D327-N329 VanDerWaalsContact OD1-CG 3.29Å; D327-N329 PolarHBondContact OD1-N 3Å; D327-N329 PolarHBondContact OD1-ND2 3.47Å; D327-F330 HydrophobicContact CB-CD2 3.9Å; D327-F330 HydrophobicContact CB-CE2 4.44Å; D327-F330 PolarHBondContact O-N 2.88Å; D327-F330 WeakPolarHBondContact OD2-CD2 3.39Å; D327-F330 VanDerWaalsContact OD2-CE2 3.32Å; D327-F330 WeakPolarHBondContact OD2-CE2 3.48Å
328	F	86	Confident	83.3	Confident	69 Å²	69	88.9 Å²	88.9	30%	0.303	47%	0.468	S	S	.	.	G	3₁₀ helix	trans	-69.1	-12.7	179.6	-81.2	-84.2	0	0	0	113.9	A201 M203 P252 V326 F330 F331	A201-F328 HydrophobicContact CB-CE1 3.81Å; A201-F328 HydrophobicContact CB-CZ 4.26Å; M203-F328 HydrophobicContact CE-CD1 4Å; M203-F328 HydrophobicContact CE-CD2 4.1Å; M203-F328 HydrophobicContact CE-CE1 3.78Å; M203-F328 HydrophobicContact CE-CE2 3.87Å; M203-F328 HydrophobicContact CE-CG 4.15Å; M203-F328 HydrophobicContact CE-CZ 3.7Å; M203-F328 HydrophobicContact SD-CD1 3.73Å; M203-F328 HydrophobicContact SD-CE1 3.17Å; M203-F328 WeakPolarHBondContact SD-CE1 3.44Å; M203-F328 HydrophobicContact SD-CE2 4.28Å; M203-F328 HydrophobicContact SD-CG 4.48Å; M203-F328 HydrophobicContact SD-CZ 3.49Å; M203-F328 WeakPolarHBondContact SD-CZ 3.41Å; P252-F328 HydrophobicContact CG-CE1 4.43Å; P252-F328 HydrophobicContact CG-CZ 4.46Å; V326-F328 HydrophobicContact CB-CE2 4.39Å; V326-F328 HydrophobicContact CG1-CD2 4.09Å; V326-F328 HydrophobicContact CG1-CE2 3.79Å; V326-F328 HydrophobicContact CG1-CZ 4.12Å; F328-F330 PolarHBondContact O-N 3.13Å; F328-F331 HydrophobicContact CD1-CB 4.09Å; F328-F331 HydrophobicContact CD1-CD2 4.2Å; F328-F331 HydrophobicContact CD1-CG 4.2Å; F328-F331 HydrophobicContact CE1-CD2 4.22Å; F328-F331 WeakPolarHBondContact O-CB 3.34Å; F328-F331 PolarHBondContact O-N 3Å; F328-F331 VanDerWaalsContact O-N 3.11Å
329	N	86.9	Confident	83.5	Confident	122 Å²	122	88.4 Å²	88.4	65%	0.652	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-65.9	-21.8	171.8	-62.1	-45.1	0	0	0	112.3	D327 K333	D327-N329 PolarHBondContact O-N 3.27Å; D327-N329 WeakPolarHBondContact OD1-CB 3.01Å; D327-N329 VanDerWaalsContact OD1-CG 3.29Å; D327-N329 PolarHBondContact OD1-N 3Å; D327-N329 PolarHBondContact OD1-ND2 3.47Å; N329-K333 VanDerWaalsContact O-CE 3.3Å; N329-K333 WeakPolarHBondContact O-CE 3.22Å
330	F	87.8	Confident	83.7	Confident	59 Å²	59	91.3 Å²	91.3	26%	0.259	46%	0.464	S	S	.	.	G	3₁₀ helix	trans	-97.2	-0	175.5	-64.9	-92.1	0	0	0	112.8	R199 T313 V315 F317 D327 F328 D332 K333	R199-F330 PolarHBondContact NH1-O 3.39Å; T313-F330 HydrophobicContact CG2-CD1 3.97Å; V315-F330 HydrophobicContact CG1-CB 4.2Å; F317-F330 AromaticContact CE2-CD2 3.98Å; F317-F330 HydrophobicContact CE2-CD2 3.98Å; F317-F330 HydrophobicContact CE2-CE2 4.41Å; F317-F330 HydrophobicContact CE2-CG 4.36Å; F317-F330 HydrophobicContact CZ-CD2 4.18Å; F317-F330 HydrophobicContact CZ-CE2 4.44Å; F317-F330 HydrophobicContact CZ-CG 4.28Å; D327-F330 HydrophobicContact CB-CD2 3.9Å; D327-F330 HydrophobicContact CB-CE2 4.44Å; D327-F330 PolarHBondContact O-N 2.88Å; D327-F330 WeakPolarHBondContact OD2-CD2 3.39Å; D327-F330 VanDerWaalsContact OD2-CE2 3.32Å; D327-F330 WeakPolarHBondContact OD2-CE2 3.48Å; F328-F330 PolarHBondContact O-N 3.13Å; F330-D332 PolarHBondContact O-N 3.33Å; F330-K333 HydrophobicContact CD1-CD 3.6Å; F330-K333 HydrophobicContact CE1-CD 4.06Å; F330-K333 HydrophobicContact CG-CD 4.25Å; F330-K333 PolarHBondContact O-N 3.41Å
331	F	90.2	Very high	84.3	Confident	0 Å²	0	89.6 Å²	89.6	0%	0	44%	0.44	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-46.2	-174.6	179.7	-96.6	0	0	0	112.4	K180 R199 A201 P252 F328	K180-F331 HydrophobicContact CB-CE1 4.5Å; K180-F331 HydrophobicContact CB-CZ 4.46Å; K180-F331 HydrophobicContact CD-CD1 3.91Å; K180-F331 HydrophobicContact CD-CE1 3.76Å; K180-F331 HydrophobicContact CD-CZ 4.44Å; K180-F331 HydrophobicContact CG-CD1 4.45Å; K180-F331 HydrophobicContact CG-CE1 3.79Å; K180-F331 HydrophobicContact CG-CZ 4.23Å; R199-F331 HydrophobicContact CB-CE2 4.45Å; R199-F331 HydrophobicContact CB-CZ 4.43Å; R199-F331 HydrophobicContact CG-CD2 4.2Å; R199-F331 HydrophobicContact CG-CE2 3.59Å; R199-F331 HydrophobicContact CG-CZ 4.04Å; R199-F331 PolarHBondContact NH1-O 2.92Å; A201-F331 HydrophobicContact CB-CD2 4.18Å; A201-F331 HydrophobicContact CB-CE2 3.47Å; A201-F331 VanDerWaalsContact CB-CE2 3.47Å; A201-F331 HydrophobicContact CB-CZ 4.09Å; P252-F331 HydrophobicContact CB-CD2 4.11Å; P252-F331 HydrophobicContact CB-CE2 4.03Å; P252-F331 HydrophobicContact CG-CD2 4.3Å; F328-F331 HydrophobicContact CD1-CB 4.09Å; F328-F331 HydrophobicContact CD1-CD2 4.2Å; F328-F331 HydrophobicContact CD1-CG 4.2Å; F328-F331 HydrophobicContact CE1-CD2 4.22Å; F328-F331 WeakPolarHBondContact O-CB 3.34Å; F328-F331 PolarHBondContact O-N 3Å; F328-F331 VanDerWaalsContact O-N 3.11Å
332	D	90.1	Very high	84.9	Confident	50 Å²	50	87.2 Å²	87.2	27%	0.267	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	1.7	-179.6	-64	-62.5	0	0	0	112.9	K180 Q183 F330	K180-D332 IonicContact NZ-OD2 3.14Å; K180-D332 PolarHBondContact NZ-OD2 3.27Å; Q183-D332 PolarHBondContact N-OD1 2.75Å; F330-D332 PolarHBondContact O-N 3.33Å
333	K	90.2	Very high	85.9	Confident	98 Å²	98	84.2 Å²	84.2	43%	0.426	39%	0.39	S	S	.	.			trans	-80.7	139.6	179.8	-69	-172.9	-175.8	173.3	0	111.5	T313 N329 F330	T313-K333 PolarHBondContact N-O 2.82Å; N329-K333 VanDerWaalsContact O-CE 3.3Å; N329-K333 WeakPolarHBondContact O-CE 3.22Å; F330-K333 HydrophobicContact CD1-CD 3.6Å; F330-K333 HydrophobicContact CE1-CD 4.06Å; F330-K333 HydrophobicContact CG-CD 4.25Å; F330-K333 PolarHBondContact O-N 3.41Å
334	I	87.9	Confident	86.6	Confident	78 Å²	78	75 Å²	75	40%	0.4	36%	0.362	S	S	.	.			trans	-127.1	0	-177.5	64.1	179.4	0	0	0	110.5	V184 V186 L307 Y310 E311 F312	V184-I334 HydrophobicContact CG2-CG2 4.05Å; V186-I334 HydrophobicContact CG1-CB 4.44Å; V186-I334 HydrophobicContact CG1-CG2 3.67Å; L307-I334 HydrophobicContact CD1-CD1 3.18Å; Y310-I334 HydrophobicContact CD1-CB 4.24Å; Y310-I334 HydrophobicContact CD1-CD1 3.51Å; Y310-I334 HydrophobicContact CD1-CG1 3.76Å; Y310-I334 HydrophobicContact CE1-CD1 4Å; Y310-I334 HydrophobicContact CE1-CG1 4.39Å; Y310-I334 HydrophobicContact CG-CD1 3.87Å; Y310-I334 HydrophobicContact CG-CG1 4.41Å; E311-I334 CarbonylContact O-C 3.51Å; E311-I334 VanDerWaalsContact O-CA 3.31Å; E311-I334 WeakPolarHBondContact O-CA 3.25Å; F312-I334 HydrophobicContact CD1-CG2 3.71Å; F312-I334 HydrophobicContact CE1-CG2 3.93Å

Retrieved 334 of 334 residues in 554.8 ms (Link to these results)

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