A0A077ZBA7_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZBA7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 270 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.6	Very low	69.4	Low	243 Å²	243	114.4 Å²	114.4	100%	1.197	58%	0.582	S	S	*	*				0	110.7	0	-74.4	179.7	-105.3	0	0	106.9	D3	M1-D3 PolarHBondContact O-N 3.3Å; M1-D3 VanDerWaalsContact O-N 3.11Å
2	I	37.3	Very low	71.4	Confident	163 Å²	163	109 Å²	109	84%	0.836	58%	0.577	S	S	*	*			trans	-69.9	109.5	177.6	-61.6	171.3	0	0	0	105.8	V4	I2-V4 VanDerWaalsContact C-N 3.32Å; I2-V4 PolarHBondContact O-N 3.18Å
3	D	46.5	Very low	73.2	Confident	146 Å²	146	108.2 Å²	108.2	78%	0.781	57%	0.571	S	S	*	*			trans	-57.7	101.2	167.3	-170.7	11.2	0	0	0	106.2	M1 K5	M1-D3 PolarHBondContact O-N 3.3Å; M1-D3 VanDerWaalsContact O-N 3.11Å; D3-K5 VanDerWaalsContact C-N 3.26Å; D3-K5 PolarHBondContact O-N 3.27Å
4	V	54	Low	74.8	Confident	112 Å²	112	106 Å²	106	68%	0.679	55%	0.551	S	S	*	*			trans	-60.6	98.9	177	176.6	0	0	0	0	104.9	I2 Q6	I2-V4 VanDerWaalsContact C-N 3.32Å; I2-V4 PolarHBondContact O-N 3.18Å; V4-Q6 PolarHBondContact O-N 3.3Å
5	K	58	Low	76.2	Confident	185 Å²	185	99.6 Å²	99.6	80%	0.804	52%	0.519	S	S	*	.			trans	-34.7	113.4	178.6	-79.7	-176.7	177.5	178.6	0	107.9	D3 T7	D3-K5 VanDerWaalsContact C-N 3.26Å; D3-K5 PolarHBondContact O-N 3.27Å; K5-T7 VanDerWaalsContact O-CG2 3.28Å; K5-T7 WeakPolarHBondContact O-CG2 3.07Å; K5-T7 PolarHBondContact O-N 2.99Å
6	Q	62.2	Low	77.5	Confident	121 Å²	121	93.6 Å²	93.6	57%	0.565	49%	0.488	S	S	*	.			trans	-54	102.4	-171	-176.3	177.6	0.9	0	0	110.3	V4 C8 C10	V4-Q6 PolarHBondContact O-N 3.3Å; Q6-C8 WeakPolarHBondContact CG-O 3.31Å; Q6-C8 PolarHBondContact NE2-O 3.31Å; Q6-C8 PolarHBondContact O-N 3.12Å; Q6-C10 PolarHBondContact NE2-O 3.28Å
7	T	85.9	Confident	78.6	Confident	103 Å²	103	92.2 Å²	92.2	63%	0.632	48%	0.481	S	S	*	.			trans	-79.4	-2.5	-173.8	56	0	0	0	0	113.2	K5	K5-T7 VanDerWaalsContact O-CG2 3.28Å; K5-T7 WeakPolarHBondContact O-CG2 3.07Å; K5-T7 PolarHBondContact O-N 2.99Å
8	C	94.5	Very high	79.5	Confident	5 Å²	5	92.9 Å²	92.9	3%	0.034	49%	0.485	C	S	.	.	S	Bend	trans	-137.5	148.3	-179.3	74.3	0	0	0	0	112.2	Q6 C10 C16 L18	Q6-C8 WeakPolarHBondContact CG-O 3.31Å; Q6-C8 PolarHBondContact NE2-O 3.31Å; Q6-C8 PolarHBondContact O-N 3.12Å; C8-C10 PolarHBondContact O-N 3.2Å; C8-C10 VanDerWaalsContact O-N 3.07Å; C8-C16 VanDerWaalsContact SG-SG 3.64Å; C8-L18 HydrophobicContact CB-CD1 4.35Å
9	P	95.5	Very high	80.3	Confident	42 Å²	42	88.8 Å²	88.8	27%	0.273	47%	0.465	S	S	.	.			trans	-78	10.6	-177.3	33.8	-39.5	0	0	0	114.6	P112 S113 Q114	P9-P112 HydrophobicContact CG-CB 4.08Å; P9-S113 WeakPolarHBondContact CG-O 3.49Å; P9-Q114 WeakPolarHBondContact O-CG 3.33Å; P9-Q114 PolarHBondContact O-NE2 3.26Å
10	C	96.9	Very high	81	Confident	1 Å²	1	88.1 Å²	88.1	1%	0.007	46%	0.459	C	S	.	.			trans	-63.6	136.2	-176.8	-63.9	0	0	0	0	112.7	Q6 C8 R14 S115	Q6-C10 PolarHBondContact NE2-O 3.28Å; C8-C10 PolarHBondContact O-N 3.2Å; C8-C10 VanDerWaalsContact O-N 3.07Å; C10-R14 WeakPolarHBondContact CB-O 3.21Å; C10-S115 PolarHBondContact SG-N 2.99Å
11	K	94.9	Very high	81.6	Confident	137 Å²	137	89.9 Å²	89.9	60%	0.596	46%	0.464	S	S	*	.			trans	-143.6	162.2	179.3	-58.6	-178.7	179.3	-176.6	0	111.6	I13 R14 Q114	K11-I13 PolarHBondContact O-N 3.08Å; K11-R14 VanDerWaalsContact O-CB 3.31Å; K11-R14 WeakPolarHBondContact O-CB 3.27Å; K11-R14 PolarHBondContact O-N 2.95Å; K11-Q114 VanDerWaalsContact N-NE2 3.15Å
12	G	94	Very high	84.3	Confident	50 Å²	50	80.3 Å²	80.3	52%	0.515	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	-125.8	175.9	0	0	0	0	0	112	R14 R24	G12-R14 VanDerWaalsContact C-N 3.28Å; G12-R14 PolarHBondContact O-N 3.01Å; G12-R24 PolarHBondContact O-NH1 3.38Å
13	I	94.4	Very high	87.1	Confident	98 Å²	98	78 Å²	78	50%	0.503	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-12.7	176.2	66.6	168.2	0	0	0	113.5	K11 L28 R30 D179	K11-I13 PolarHBondContact O-N 3.08Å; I13-L28 HydrophobicContact CG2-CD2 4.27Å; I13-L28 WeakPolarHBondContact O-CD1 3.38Å; I13-R30 PolarHBondContact O-NH2 3.32Å; I13-D179 HydrophobicContact CD1-CB 4.24Å
14	R	96	Very high	89.4	Confident	78 Å²	78	74.6 Å²	74.6	29%	0.294	39%	0.387	S	S	.	.			trans	-83.2	140.9	-172.6	-65.8	169.8	-175.5	125.9	14.5	111.8	C10 K11 G12 R24 Q114 S115 D179	C10-R14 WeakPolarHBondContact CB-O 3.21Å; K11-R14 VanDerWaalsContact O-CB 3.31Å; K11-R14 WeakPolarHBondContact O-CB 3.27Å; K11-R14 PolarHBondContact O-N 2.95Å; G12-R14 VanDerWaalsContact C-N 3.28Å; G12-R14 PolarHBondContact O-N 3.01Å; R14-R24 PolarHBondContact O-NH1 3.39Å; R14-R24 PolarHBondContact O-NH2 3.15Å; R14-Q114 HydrophobicContact CB-CB 4.29Å; R14-S115 VanDerWaalsContact CB-OG 3.31Å; R14-S115 WeakPolarHBondContact CB-OG 3.49Å; R14-D179 IonicContact CZ-OD1 2.73Å; R14-D179 IonicContact CZ-OD2 3.74Å; R14-D179 IonicContact NE-OD1 3.9Å; R14-D179 PolarHBondContact NE-OD1 3.05Å; R14-D179 IonicContact NE-OD2 3.74Å; R14-D179 PolarHBondContact NE-OD2 2.83Å; R14-D179 VanDerWaalsContact NE-OD2 3.15Å; R14-D179 IonicContact NH2-OD1 3.46Å; R14-D179 IonicContact NH2-OD2 2.78Å; R14-D179 PolarHBondContact NH2-OD2 2.76Å
15	C	96	Very high	91.3	Very high	10 Å²	10	70 Å²	70	7%	0.068	36%	0.359	C	S	.	.			trans	-151.6	160.9	-178.1	65.7	0	0	0	0	112.1	V25 R30 S115 W177	C15-V25 HydrophobicContact CB-CB 4.46Å; C15-V25 HydrophobicContact CB-CG1 4.01Å; C15-V25 HydrophobicContact CB-CG2 3.54Å; C15-R30 PolarHBondContact SG-NH1 2.81Å; C15-R30 VanDerWaalsContact SG-NH1 3.38Å; C15-S115 VanDerWaalsContact O-CA 3.27Å; C15-S115 WeakPolarHBondContact O-CA 3.3Å; C15-W177 PolarHBondContact O-NE1 2.88Å
16	C	96.6	Very high	93	Very high	4 Å²	4	69.2 Å²	69.2	3%	0.027	35%	0.351	C	S	.	.			trans	-135.9	174.6	172.7	71.3	0	0	0	0	108.4	C8 L18 C19 Q20 G116 R174	C8-C16 VanDerWaalsContact SG-SG 3.64Å; C16-L18 PolarHBondContact O-N 3.35Å; C16-L18 VanDerWaalsContact O-N 3.15Å; C16-C19 PolarHBondContact N-SG 3.1Å; C16-C19 VanDerWaalsContact N-SG 3.44Å; C16-C19 CarbonylContact O-C 3.58Å; C16-C19 PolarHBondContact O-N 3.35Å; C16-Q20 WeakPolarHBondContact O-CB 3.41Å; C16-Q20 PolarHBondContact O-N 3Å; C16-G116 VanDerWaalsContact CB-N 3.32Å; C16-R174 WeakPolarHBondContact CB-O 3.47Å
17	L	95.5	Very high	94.6	Very high	70 Å²	70	71.8 Å²	71.8	37%	0.366	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-58.4	-31.3	-179	-66	176.5	0	0	0	113	C19 Q20 S173 R174 G175	L17-C19 VanDerWaalsContact C-N 3.28Å; L17-C19 PolarHBondContact O-N 3.17Å; L17-Q20 WeakPolarHBondContact O-CG 3.33Å; L17-Q20 PolarHBondContact O-NE2 3.09Å; L17-S173 WeakPolarHBondContact CD1-O 3.44Å; L17-R174 PolarHBondContact N-O 3.1Å; L17-G175 VanDerWaalsContact CD1-N 3.34Å
18	L	94.8	Very high	95	Very high	105 Å²	105	69.5 Å²	69.5	55%	0.55	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-65.1	-29.8	178.1	-57.7	176.9	0	0	0	113.4	C8 C16	C8-L18 HydrophobicContact CB-CD1 4.35Å; C16-L18 PolarHBondContact O-N 3.35Å; C16-L18 VanDerWaalsContact O-N 3.15Å
19	C	95.4	Very high	94.8	Very high	15 Å²	15	76.1 Å²	76.1	10%	0.101	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-117.7	6.1	-176.8	78.2	0	0	0	0	113.6	C16 L17 H21 S22 R24 V25	C16-C19 PolarHBondContact N-SG 3.1Å; C16-C19 VanDerWaalsContact N-SG 3.44Å; C16-C19 CarbonylContact O-C 3.58Å; C16-C19 PolarHBondContact O-N 3.35Å; L17-C19 VanDerWaalsContact C-N 3.28Å; L17-C19 PolarHBondContact O-N 3.17Å; C19-H21 PolarHBondContact O-N 2.92Å; C19-S22 WeakPolarHBondContact O-CB 3.47Å; C19-S22 PolarHBondContact O-N 2.87Å; C19-S22 PolarHBondContact O-OG 3.22Å; C19-R24 PolarHBondContact SG-NH2 3.31Å; C19-V25 VanDerWaalsContact O-CG2 3.3Å; C19-V25 WeakPolarHBondContact O-CG2 3.46Å
20	Q	94.1	Very high	94.5	Very high	74 Å²	74	79.5 Å²	79.5	35%	0.346	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-28.7	-172.5	70.3	-176.1	-35.3	0	0	112.7	C16 L17 V25	C16-Q20 WeakPolarHBondContact O-CB 3.41Å; C16-Q20 PolarHBondContact O-N 3Å; L17-Q20 WeakPolarHBondContact O-CG 3.33Å; L17-Q20 PolarHBondContact O-NE2 3.09Å; Q20-V25 WeakPolarHBondContact O-CB 3.4Å; Q20-V25 WeakPolarHBondContact O-CG1 3.03Å
21	H	93.8	Very high	94.1	Very high	125 Å²	125	86 Å²	86	58%	0.579	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	3.7	179.3	-55.8	-56.9	0	0	0	114	C19 R26	C19-H21 PolarHBondContact O-N 2.92Å; H21-R26 PolarHBondContact O-NE 2.9Å
22	S	94.4	Very high	93.6	Very high	42 Å²	42	83.9 Å²	83.9	29%	0.294	42%	0.423	S	S	.	.	S	Bend	trans	-66.5	151.7	175.5	63.7	0	0	0	0	111.4	C19 R24 V25 R26	C19-S22 WeakPolarHBondContact O-CB 3.47Å; C19-S22 PolarHBondContact O-N 2.87Å; C19-S22 PolarHBondContact O-OG 3.22Å; S22-R24 PolarHBondContact O-N 3.21Å; S22-V25 PolarHBondContact O-N 3.11Å; S22-V25 WeakPolarHBondContact OG-CG2 3.39Å; S22-R26 PolarHBondContact O-N 3.3Å
23	D	95.3	Very high	93.4	Very high	115 Å²	115	82.3 Å²	82.3	62%	0.615	40%	0.402	S	S	*	.	H	α-helix	trans	-54.3	-39.1	178.9	-66.3	-24	0	0	0	112.5	V25 R26 K27	D23-V25 VanDerWaalsContact C-N 3.29Å; D23-V25 PolarHBondContact O-N 3.33Å; D23-R26 PolarHBondContact O-N 2.88Å; D23-K27 WeakPolarHBondContact O-CB 3.48Å; D23-K27 VanDerWaalsContact O-CG 3.22Å; D23-K27 WeakPolarHBondContact O-CG 3.09Å; D23-K27 PolarHBondContact O-N 2.8Å
24	R	94.8	Very high	93.2	Very high	74 Å²	74	80.9 Å²	80.9	28%	0.279	40%	0.399	S	S	.	.	H	α-helix	trans	-54.7	-45.4	174.8	179.7	-178.8	62.9	86.7	0.7	111.8	G12 R14 C19 S22	G12-R24 PolarHBondContact O-NH1 3.38Å; R14-R24 PolarHBondContact O-NH1 3.39Å; R14-R24 PolarHBondContact O-NH2 3.15Å; C19-R24 PolarHBondContact SG-NH2 3.31Å; S22-R24 PolarHBondContact O-N 3.21Å
25	V	94.8	Very high	93.2	Very high	15 Å²	15	78 Å²	78	9%	0.091	39%	0.388	C	S	.	.	H	α-helix	trans	-78.4	-39.2	-176.5	178.2	0	0	0	0	111.1	C15 C19 Q20 S22 D23 K27 L28	C15-V25 HydrophobicContact CB-CB 4.46Å; C15-V25 HydrophobicContact CB-CG1 4.01Å; C15-V25 HydrophobicContact CB-CG2 3.54Å; C19-V25 VanDerWaalsContact O-CG2 3.3Å; C19-V25 WeakPolarHBondContact O-CG2 3.46Å; Q20-V25 WeakPolarHBondContact O-CB 3.4Å; Q20-V25 WeakPolarHBondContact O-CG1 3.03Å; S22-V25 PolarHBondContact O-N 3.11Å; S22-V25 WeakPolarHBondContact OG-CG2 3.39Å; D23-V25 VanDerWaalsContact C-N 3.29Å; D23-V25 PolarHBondContact O-N 3.33Å; V25-K27 VanDerWaalsContact C-N 3.26Å; V25-K27 PolarHBondContact O-N 3.16Å; V25-L28 HydrophobicContact CG1-CD1 4.48Å; V25-L28 VanDerWaalsContact O-CB 3.3Å; V25-L28 WeakPolarHBondContact O-CB 3.38Å; V25-L28 PolarHBondContact O-N 3.24Å
26	R	94.2	Very high	93	Very high	170 Å²	170	82.8 Å²	82.8	64%	0.642	41%	0.41	S	S	*	.	H	α-helix	trans	-57.3	-40.7	174.4	-67.9	-178.8	-175.6	-151.9	-4.7	111.8	H21 S22 D23 L28 N29	H21-R26 PolarHBondContact O-NE 2.9Å; S22-R26 PolarHBondContact O-N 3.3Å; D23-R26 PolarHBondContact O-N 2.88Å; R26-L28 PolarHBondContact O-N 3.38Å; R26-N29 PolarHBondContact O-N 2.92Å
27	K	95.9	Very high	92.9	Very high	174 Å²	174	86.7 Å²	86.7	76%	0.757	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-14.6	177	-73.8	173.3	-177	-178.6	0	114.7	D23 V25 N29	D23-K27 WeakPolarHBondContact O-CB 3.48Å; D23-K27 VanDerWaalsContact O-CG 3.22Å; D23-K27 WeakPolarHBondContact O-CG 3.09Å; D23-K27 PolarHBondContact O-N 2.8Å; V25-K27 VanDerWaalsContact C-N 3.26Å; V25-K27 PolarHBondContact O-N 3.16Å; K27-N29 PolarHBondContact O-N 2.94Å
28	L	93.4	Very high	92.9	Very high	56 Å²	56	85.2 Å²	85.2	29%	0.293	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-14.8	175	-60.2	177.1	0	0	0	112.8	I13 V25 R26 R30	I13-L28 HydrophobicContact CG2-CD2 4.27Å; I13-L28 WeakPolarHBondContact O-CD1 3.38Å; V25-L28 HydrophobicContact CG1-CD1 4.48Å; V25-L28 VanDerWaalsContact O-CB 3.3Å; V25-L28 WeakPolarHBondContact O-CB 3.38Å; V25-L28 PolarHBondContact O-N 3.24Å; R26-L28 PolarHBondContact O-N 3.38Å; L28-R30 VanDerWaalsContact C-N 3.29Å; L28-R30 HydrophobicContact CB-CG 4.09Å; L28-R30 PolarHBondContact O-N 2.8Å
29	N	90.8	Very high	93	Very high	144 Å²	144	86 Å²	86	77%	0.77	43%	0.432	S	S	*	.			trans	43.9	51	177.2	-164.5	29.1	0	0	0	113.6	R26 K27 K31	R26-N29 PolarHBondContact O-N 2.92Å; K27-N29 PolarHBondContact O-N 2.94Å; N29-K31 PolarHBondContact O-N 3.26Å
30	R	89.2	Confident	93	Very high	113 Å²	113	85.4 Å²	85.4	43%	0.426	43%	0.428	S	S	.	.			trans	-69.3	130.5	-174.5	-66.5	-177.8	176.6	-168.6	-6.6	110.7	I13 C15 L28	I13-R30 PolarHBondContact O-NH2 3.32Å; C15-R30 PolarHBondContact SG-NH1 2.81Å; C15-R30 VanDerWaalsContact SG-NH1 3.38Å; L28-R30 VanDerWaalsContact C-N 3.29Å; L28-R30 HydrophobicContact CB-CG 4.09Å; L28-R30 PolarHBondContact O-N 2.8Å
31	K	88.1	Confident	93	Very high	136 Å²	136	83 Å²	83	59%	0.591	42%	0.416	S	S	*	.			trans	-66.8	155.6	168.2	-64	-175.1	174.8	-173	0	111	N29 F33 P34 E36	N29-K31 PolarHBondContact O-N 3.26Å; K31-F33 VanDerWaalsContact C-N 3.35Å; K31-P34 HydrophobicContact CB-CB 4.36Å; K31-E36 IonicContact NZ-OE2 3.3Å
32	A	84.8	Confident	93.1	Very high	94 Å²	94	77.1 Å²	77.1	78%	0.777	39%	0.389	S	S	*	.	S	Bend	trans	-58.8	-46.1	173.2	0	0	0	0	0	111.1	F58	A32-F58 WeakPolarHBondContact O-CE2 3.12Å
33	F	88.3	Confident	93.1	Very high	17 Å²	17	75.5 Å²	75.5	8%	0.075	38%	0.377	C	S	.	.			trans	-137.6	94.4	174.5	-178	-111.3	0	0	0	110.9	K31 F35 E36 P56 F58 L213	K31-F33 VanDerWaalsContact C-N 3.35Å; F33-F35 HydrophobicContact CD1-CB 4.44Å; F33-F35 HydrophobicContact CD2-CD2 4.23Å; F33-F35 HydrophobicContact CE1-CB 3.8Å; F33-F35 WeakPolarHBondContact CE1-O 3.41Å; F33-F35 HydrophobicContact CE2-CB 4.21Å; F33-F35 AromaticContact CE2-CD2 3.88Å; F33-F35 HydrophobicContact CE2-CD2 3.88Å; F33-F35 HydrophobicContact CZ-CB 3.67Å; F33-F35 HydrophobicContact CZ-CD2 4.21Å; F33-F35 HydrophobicContact CZ-CG 4.46Å; F33-F35 PolarHBondContact O-N 2.82Å; F33-E36 HydrophobicContact CD1-CG 4.1Å; F33-P56 VanDerWaalsContact CE1-C 3.45Å; F33-P56 HydrophobicContact CE1-CB 3.92Å; F33-P56 WeakPolarHBondContact CE1-O 3.49Å; F33-P56 HydrophobicContact CZ-CB 4.38Å; F33-F58 HydrophobicContact CB-CD2 4.46Å; F33-F58 HydrophobicContact CB-CE2 4.38Å; F33-F58 AromaticContact CD2-CD1 3.58Å; F33-F58 HydrophobicContact CD2-CD1 3.58Å; F33-F58 AromaticContact CD2-CD2 3.78Å; F33-F58 HydrophobicContact CD2-CD2 3.78Å; F33-F58 AromaticContact CD2-CE1 3.52Å; F33-F58 HydrophobicContact CD2-CE1 3.52Å; F33-F58 AromaticContact CD2-CE2 3.76Å; F33-F58 HydrophobicContact CD2-CE2 3.76Å; F33-F58 AromaticContact CD2-CG 3.72Å; F33-F58 HydrophobicContact CD2-CG 3.72Å; F33-F58 AromaticContact CD2-CZ 3.64Å; F33-F58 HydrophobicContact CD2-CZ 3.64Å; F33-F58 AromaticContact CE2-CD1 3.6Å; F33-F58 HydrophobicContact CE2-CD1 3.6Å; F33-F58 AromaticContact CE2-CE1 3.66Å; F33-F58 HydrophobicContact CE2-CE1 3.66Å; F33-F58 HydrophobicContact CE2-CG 4.11Å; F33-F58 HydrophobicContact CE2-CZ 4.23Å; F33-L213 HydrophobicContact CZ-CD2 4.35Å
34	P	91.1	Very high	92.9	Very high	67 Å²	67	70.4 Å²	70.4	44%	0.435	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	7.7	-171.1	28.8	-33	0	0	0	115	K31	K31-P34 HydrophobicContact CB-CB 4.36Å
35	F	95	Very high	92.5	Very high	17 Å²	17	69.6 Å²	69.6	8%	0.075	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117	23.2	-175.5	-44.8	-77	0	0	0	112.8	F33 A37 Y38 F180 L206 L213 F239	F33-F35 HydrophobicContact CD1-CB 4.44Å; F33-F35 HydrophobicContact CD2-CD2 4.23Å; F33-F35 HydrophobicContact CE1-CB 3.8Å; F33-F35 WeakPolarHBondContact CE1-O 3.41Å; F33-F35 HydrophobicContact CE2-CB 4.21Å; F33-F35 AromaticContact CE2-CD2 3.88Å; F33-F35 HydrophobicContact CE2-CD2 3.88Å; F33-F35 HydrophobicContact CZ-CB 3.67Å; F33-F35 HydrophobicContact CZ-CD2 4.21Å; F33-F35 HydrophobicContact CZ-CG 4.46Å; F33-F35 PolarHBondContact O-N 2.82Å; F35-A37 PolarHBondContact O-N 2.66Å; F35-A37 VanDerWaalsContact O-N 3.15Å; F35-Y38 HydrophobicContact CB-CD2 3.93Å; F35-Y38 HydrophobicContact CB-CG 3.96Å; F35-Y38 HydrophobicContact CD1-CD1 4.27Å; F35-Y38 HydrophobicContact CD1-CD2 4.07Å; F35-Y38 HydrophobicContact CD1-CE1 4.28Å; F35-Y38 HydrophobicContact CD1-CE2 4.07Å; F35-Y38 HydrophobicContact CD1-CG 4.19Å; F35-Y38 WeakPolarHBondContact O-CB 3.21Å; F35-Y38 PolarHBondContact O-N 3.36Å; F35-F180 HydrophobicContact CE1-CE2 4.21Å; F35-F180 HydrophobicContact CE2-CE2 4.22Å; F35-F180 HydrophobicContact CZ-CD2 4.13Å; F35-F180 AromaticContact CZ-CE2 3.55Å; F35-F180 HydrophobicContact CZ-CE2 3.55Å; F35-F180 HydrophobicContact CZ-CZ 4.43Å; F35-L206 HydrophobicContact CD1-CD1 3.67Å; F35-L206 HydrophobicContact CE1-CD1 3.57Å; F35-L206 HydrophobicContact CE1-CD2 3.83Å; F35-L206 HydrophobicContact CE1-CG 4.38Å; F35-L213 HydrophobicContact CB-CD2 4.03Å; F35-L213 HydrophobicContact CD2-CD2 4.16Å; F35-L213 HydrophobicContact CG-CD2 4.04Å; F35-F239 HydrophobicContact CD2-CE1 4.3Å; F35-F239 AromaticContact CD2-CZ 3.97Å; F35-F239 HydrophobicContact CD2-CZ 3.97Å; F35-F239 AromaticContact CE2-CE1 3.35Å; F35-F239 HydrophobicContact CE2-CE1 3.35Å; F35-F239 AromaticContact CE2-CZ 3.35Å; F35-F239 HydrophobicContact CE2-CZ 3.35Å; F35-F239 AromaticContact CZ-CE1 3.93Å; F35-F239 HydrophobicContact CZ-CE1 3.93Å; F35-F239 AromaticContact CZ-CZ 3.97Å; F35-F239 HydrophobicContact CZ-CZ 3.97Å
36	E	93.4	Very high	92.1	Very high	111 Å²	111	74.8 Å²	74.8	52%	0.519	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-36.2	177.1	-70.7	113.3	-173.3	0	0	112.7	K31 F33	K31-E36 IonicContact NZ-OE2 3.3Å; F33-E36 HydrophobicContact CD1-CG 4.1Å
37	A	94	Very high	91.7	Very high	87 Å²	87	67.7 Å²	67.7	72%	0.719	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	1.1	-178.6	0	0	0	0	0	114.2	F35	F35-A37 PolarHBondContact O-N 2.66Å; F35-A37 VanDerWaalsContact O-N 3.15Å
38	Y	95.9	Very high	90.9	Very high	38 Å²	38	67.3 Å²	67.3	15%	0.149	36%	0.358	C	S	.	.	S	Bend	trans	-88.8	148.9	-177.8	-77.2	-120.4	0	0	0	110.7	F35 P56 L206 N211 L213	F35-Y38 HydrophobicContact CB-CD2 3.93Å; F35-Y38 HydrophobicContact CB-CG 3.96Å; F35-Y38 HydrophobicContact CD1-CD1 4.27Å; F35-Y38 HydrophobicContact CD1-CD2 4.07Å; F35-Y38 HydrophobicContact CD1-CE1 4.28Å; F35-Y38 HydrophobicContact CD1-CE2 4.07Å; F35-Y38 HydrophobicContact CD1-CG 4.19Å; F35-Y38 WeakPolarHBondContact O-CB 3.21Å; F35-Y38 PolarHBondContact O-N 3.36Å; Y38-P56 WeakPolarHBondContact O-CB 3.41Å; Y38-P56 WeakPolarHBondContact O-CG 3.43Å; Y38-L206 HydrophobicContact CD1-CD1 3.58Å; Y38-L206 HydrophobicContact CE1-CD1 3.25Å; Y38-L206 HydrophobicContact CE1-CG 4.05Å; Y38-N211 CarbonylContact C-O 3.55Å; Y38-N211 WeakPolarHBondContact CA-O 3.4Å; Y38-N211 WeakPolarHBondContact CB-O 3.41Å; Y38-N211 HydrophobicContact CD1-CB 4Å; Y38-N211 WeakPolarHBondContact CD1-O 3.4Å; Y38-N211 HydrophobicContact CD2-CB 4.17Å; Y38-N211 HydrophobicContact CE1-CB 4.15Å; Y38-N211 HydrophobicContact CE2-CB 4.33Å; Y38-N211 WeakPolarHBondContact CE2-OD1 3.45Å; Y38-N211 HydrophobicContact CG-CB 3.98Å; Y38-L213 HydrophobicContact CD1-CB 4.36Å
39	K	95.4	Very high	90.4	Very high	123 Å²	123	65 Å²	65	54%	0.535	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	121.6	162.6	-62.1	172	-125.1	168.3	0	107.7	F41 N211 L213	K39-F41 HydrophobicContact CB-CD2 4.47Å; K39-F41 HydrophobicContact CB-CE2 3.59Å; K39-F41 HydrophobicContact CB-CZ 4.11Å; K39-N211 PolarHBondContact N-O 3.35Å; K39-L213 PolarHBondContact O-N 3Å
40	A	95.5	Very high	90.3	Very high	2 Å²	2	60.3 Å²	60.3	2%	0.017	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	141.3	178.7	0	0	0	0	0	110.6	L54 P56 L213 Y215	A40-L54 HydrophobicContact CB-CB 4.1Å; A40-L54 PolarHBondContact O-N 2.99Å; A40-P56 HydrophobicContact CB-CB 4.18Å; A40-P56 HydrophobicContact CB-CG 4.13Å; A40-L213 CarbonylContact C-O 3.58Å; A40-L213 VanDerWaalsContact CA-O 3.29Å; A40-L213 WeakPolarHBondContact CA-O 3.35Å; A40-Y215 HydrophobicContact CB-CE2 4.32Å
41	F	95.3	Very high	90.5	Very high	24 Å²	24	55 Å²	55	11%	0.105	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	160	176.9	-58.6	-93.4	0	0	0	111.4	K39 A51 H52 P53 C81 T212 L213 I214 Y215	K39-F41 HydrophobicContact CB-CD2 4.47Å; K39-F41 HydrophobicContact CB-CE2 3.59Å; K39-F41 HydrophobicContact CB-CZ 4.11Å; F41-A51 HydrophobicContact CB-CB 3.77Å; F41-H52 CarbonylContact C-O 3.39Å; F41-H52 WeakPolarHBondContact CA-O 3.25Å; F41-H52 WeakPolarHBondContact CB-O 3.37Å; F41-P53 HydrophobicContact CD1-CB 4.34Å; F41-P53 HydrophobicContact CE1-CB 4.28Å; F41-C81 HydrophobicContact CD1-CB 3.68Å; F41-C81 HydrophobicContact CD2-CB 4.07Å; F41-C81 HydrophobicContact CE1-CB 3.77Å; F41-C81 HydrophobicContact CE2-CB 4.13Å; F41-C81 HydrophobicContact CG-CB 3.85Å; F41-C81 HydrophobicContact CZ-CB 4Å; F41-T212 HydrophobicContact CD2-CG2 3.79Å; F41-T212 HydrophobicContact CE2-CG2 3.8Å; F41-L213 PolarHBondContact N-O 3.1Å; F41-I214 HydrophobicContact CB-CG1 4.3Å; F41-I214 HydrophobicContact CB-CG2 4.43Å; F41-I214 HydrophobicContact CD2-CG1 4.49Å; F41-I214 CarbonylContact O-C 3.39Å; F41-I214 WeakPolarHBondContact O-CA 3.45Å; F41-Y215 WeakPolarHBondContact O-CD2 3.37Å; F41-Y215 PolarHBondContact O-N 3.33Å
42	I	95.2	Very high	90.7	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	126.3	175.1	-178.8	63.2	0	0	0	109.8	C44 A51 H52 L54 L64 F67 Q68 M71 Y215 P217	I42-C44 PolarHBondContact O-N 2.75Å; I42-A51 CarbonylContact O-C 3.56Å; I42-A51 WeakPolarHBondContact O-CA 3.33Å; I42-A51 WeakPolarHBondContact O-CB 3.47Å; I42-H52 HydrophobicContact CG2-CB 4.07Å; I42-H52 WeakPolarHBondContact CG2-O 3.13Å; I42-H52 PolarHBondContact N-O 2.94Å; I42-H52 PolarHBondContact O-N 3.48Å; I42-L54 HydrophobicContact CB-CD1 3.67Å; I42-L54 HydrophobicContact CB-CG 4.06Å; I42-L54 HydrophobicContact CG2-CD1 3.97Å; I42-L54 HydrophobicContact CG2-CD2 4.18Å; I42-L54 HydrophobicContact CG2-CG 3.81Å; I42-L64 HydrophobicContact CD1-CB 4.36Å; I42-L64 HydrophobicContact CD1-CD2 3.97Å; I42-F67 HydrophobicContact CG1-CB 4.2Å; I42-Q68 HydrophobicContact CD1-CB 4.45Å; I42-Q68 HydrophobicContact CG1-CB 4.31Å; I42-M71 HydrophobicContact CG2-SD 3.69Å; I42-Y215 WeakPolarHBondContact CD1-O 3.48Å; I42-P217 HydrophobicContact CD1-CG 3.48Å; I42-P217 VanDerWaalsContact CD1-CG 3.48Å
43	L	94.5	Very high	91.1	Very high	8 Å²	8	46.8 Å²	46.8	4%	0.042	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	128.1	174.3	178.7	72.3	0	0	0	109.9	Q68 V83 V86 L88 Y215 V216	L43-Q68 WeakPolarHBondContact O-CG 3.41Å; L43-V83 HydrophobicContact CD1-CB 4.43Å; L43-V83 HydrophobicContact CD1-CG2 3.38Å; L43-V86 HydrophobicContact CD2-CG1 3.9Å; L43-L88 HydrophobicContact CD2-CD1 3.53Å; L43-L88 HydrophobicContact CD2-CG 3.8Å; L43-Y215 PolarHBondContact N-O 2.9Å; L43-V216 HydrophobicContact CB-CG2 4Å; L43-V216 HydrophobicContact CD2-CG1 3.72Å; L43-V216 HydrophobicContact CD2-CG2 4.25Å
44	C	91.2	Very high	91.3	Very high	8 Å²	8	47 Å²	47	5%	0.054	26%	0.256	C	S	.	.			trans	-82.6	137.7	176.5	-170.8	0	0	0	0	111.3	I42 R46 C47 I50 H52	I42-C44 PolarHBondContact O-N 2.75Å; C44-R46 VanDerWaalsContact C-N 3.3Å; C44-R46 PolarHBondContact SG-N 2.95Å; C44-R46 VanDerWaalsContact SG-N 3.35Å; C44-C47 HydrophobicContact CB-CB 3.84Å; C44-C47 PolarHBondContact SG-N 2.84Å; C44-I50 WeakPolarHBondContact CB-O 3.5Å; C44-I50 PolarHBondContact N-O 3.43Å; C44-I50 VanDerWaalsContact N-O 3.15Å; C44-H52 VanDerWaalsContact CB-NE2 3.27Å; C44-H52 WeakPolarHBondContact CB-NE2 3.33Å; C44-H52 PolarHBondContact SG-NE2 2.56Å
45	A	87.4	Confident	91.4	Very high	58 Å²	58	49.7 Å²	49.7	48%	0.479	27%	0.265	S	S	.	.	S	Bend	trans	-74.1	-20.6	172.8	0	0	0	0	0	113.4	Q68	A45-Q68 HydrophobicContact CB-CG 3.86Å; A45-Q68 WeakPolarHBondContact CB-O 3.45Å; A45-Q68 PolarHBondContact N-O 3.35Å
46	R	85.2	Confident	91.4	Very high	124 Å²	124	50.9 Å²	50.9	47%	0.468	28%	0.275	S	S	.	.	S	Bend	trans	-106.9	-36.2	-175.5	-58.7	-171	-166.4	176.8	11.1	113.8	C44 I48 H72	C44-R46 VanDerWaalsContact C-N 3.3Å; C44-R46 PolarHBondContact SG-N 2.95Å; C44-R46 VanDerWaalsContact SG-N 3.35Å; R46-I48 PolarHBondContact O-N 3.49Å; R46-H72 HydrophobicContact CB-CB 4.18Å
47	C	85.4	Confident	91.4	Very high	20 Å²	20	50.2 Å²	50.2	14%	0.135	27%	0.271	C	S	.	.	S	Bend	trans	-81.6	104.6	175.4	-60.7	0	0	0	0	110	C44 G49 I50 H52 H72	C44-C47 HydrophobicContact CB-CB 3.84Å; C44-C47 PolarHBondContact SG-N 2.84Å; C47-G49 PolarHBondContact O-N 3.22Å; C47-G49 VanDerWaalsContact O-N 3.08Å; C47-I50 HydrophobicContact CB-CB 3.67Å; C47-I50 HydrophobicContact CB-CG1 4.14Å; C47-I50 HydrophobicContact CB-CG2 4.34Å; C47-I50 PolarHBondContact O-N 3.25Å; C47-H52 VanDerWaalsContact SG-CE1 3.54Å; C47-H72 PolarHBondContact SG-ND1 2.77Å
48	I	80.2	Confident	91.4	Very high	167 Å²	167	49.4 Å²	49.4	86%	0.856	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	117.9	178.8	-59.4	174.4	0	0	0	109.5	R46 I50	R46-I48 PolarHBondContact O-N 3.49Å; I48-I50 VanDerWaalsContact C-N 3.31Å; I48-I50 PolarHBondContact O-N 2.64Å
49	G	83.1	Confident	91.4	Very high	7 Å²	7	48.2 Å²	48.2	7%	0.072	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.9	20.3	174.3	0	0	0	0	0	115.4	C47 V83 Q84	C47-G49 PolarHBondContact O-N 3.22Å; C47-G49 VanDerWaalsContact O-N 3.08Å; G49-V83 CarbonylContact O-C 3.54Å; G49-V83 PolarHBondContact O-N 3.12Å; G49-Q84 PolarHBondContact O-N 3.24Å
50	I	88.7	Confident	91.5	Very high	46 Å²	46	44.9 Å²	44.9	24%	0.236	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	135.3	177.4	-56.8	-65.4	0	0	0	110.6	C44 C47 I48	C44-I50 WeakPolarHBondContact CB-O 3.5Å; C44-I50 PolarHBondContact N-O 3.43Å; C44-I50 VanDerWaalsContact N-O 3.15Å; C47-I50 HydrophobicContact CB-CB 3.67Å; C47-I50 HydrophobicContact CB-CG1 4.14Å; C47-I50 HydrophobicContact CB-CG2 4.34Å; C47-I50 PolarHBondContact O-N 3.25Å; I48-I50 VanDerWaalsContact C-N 3.31Å; I48-I50 PolarHBondContact O-N 2.64Å
51	A	92.5	Very high	91.7	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	133.4	167.6	0	0	0	0	0	110.8	F41 I42 G80 C81 V83 I214	F41-A51 HydrophobicContact CB-CB 3.77Å; I42-A51 CarbonylContact O-C 3.56Å; I42-A51 WeakPolarHBondContact O-CA 3.33Å; I42-A51 WeakPolarHBondContact O-CB 3.47Å; A51-G80 VanDerWaalsContact O-CA 3.31Å; A51-G80 WeakPolarHBondContact O-CA 3.46Å; A51-C81 HydrophobicContact CB-CB 4.38Å; A51-C81 PolarHBondContact N-O 3.37Å; A51-C81 PolarHBondContact O-N 3.35Å; A51-V83 HydrophobicContact CB-CG1 4.22Å; A51-V83 HydrophobicContact CB-CG2 4.03Å; A51-I214 HydrophobicContact CB-CG2 3.98Å
52	H	92.5	Very high	91.8	Very high	5 Å²	5	47.9 Å²	47.9	2%	0.023	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	147.2	-178.4	-62.8	-48.7	0	0	0	111.9	F41 I42 C44 C47 M71 C75	F41-H52 CarbonylContact C-O 3.39Å; F41-H52 WeakPolarHBondContact CA-O 3.25Å; F41-H52 WeakPolarHBondContact CB-O 3.37Å; I42-H52 HydrophobicContact CG2-CB 4.07Å; I42-H52 WeakPolarHBondContact CG2-O 3.13Å; I42-H52 PolarHBondContact N-O 2.94Å; I42-H52 PolarHBondContact O-N 3.48Å; C44-H52 VanDerWaalsContact CB-NE2 3.27Å; C44-H52 WeakPolarHBondContact CB-NE2 3.33Å; C44-H52 PolarHBondContact SG-NE2 2.56Å; C47-H52 VanDerWaalsContact SG-CE1 3.54Å; H52-M71 HydrophobicContact CB-CE 4.45Å; H52-C75 PolarHBondContact CE1-SG 2.89Å
53	P	92.8	Very high	91.9	Very high	53 Å²	53	51.5 Å²	51.5	34%	0.344	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	145.5	-178.9	27.6	-35.1	0	0	0	112.4	F41 M71 Q79	F41-P53 HydrophobicContact CD1-CB 4.34Å; F41-P53 HydrophobicContact CE1-CB 4.28Å; P53-M71 WeakPolarHBondContact O-CE 3.42Å; P53-Q79 HydrophobicContact CG-CB 4.31Å
54	L	93.5	Very high	92.1	Very high	23 Å²	23	51.1 Å²	51.1	12%	0.12	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	158.5	172.6	-76.4	-177	0	0	0	110.7	A40 I42 Y59 L64 F67 M71 Y215	A40-L54 HydrophobicContact CB-CB 4.1Å; A40-L54 PolarHBondContact O-N 2.99Å; I42-L54 HydrophobicContact CB-CD1 3.67Å; I42-L54 HydrophobicContact CB-CG 4.06Å; I42-L54 HydrophobicContact CG2-CD1 3.97Å; I42-L54 HydrophobicContact CG2-CD2 4.18Å; I42-L54 HydrophobicContact CG2-CG 3.81Å; L54-Y59 HydrophobicContact CB-CE2 4.38Å; L54-Y59 HydrophobicContact CD1-CD2 4.38Å; L54-Y59 HydrophobicContact CD1-CE2 4.02Å; L54-L64 HydrophobicContact CD1-CD2 3.89Å; L54-F67 HydrophobicContact CD1-CD2 4.21Å; L54-F67 HydrophobicContact CD2-CD2 3.79Å; L54-F67 HydrophobicContact CD2-CE2 4.07Å; L54-F67 HydrophobicContact CD2-CG 4.46Å; L54-M71 HydrophobicContact CD2-CE 3.92Å; L54-M71 HydrophobicContact CD2-SD 3.55Å; L54-M71 VanDerWaalsContact CD2-SD 3.55Å; L54-Y215 HydrophobicContact CD1-CD2 4.09Å
55	I	93.6	Very high	92.3	Very high	122 Å²	122	52.2 Å²	52.2	63%	0.626	29%	0.285	S	S	*	.			trans	-70	131.1	166.2	-61.8	172.9	0	0	0	108.3	K57 Y59	I55-K57 PolarHBondContact O-N 3.47Å; I55-Y59 PolarHBondContact N-OH 3.09Å; I55-Y59 VanDerWaalsContact O-CE2 3.23Å; I55-Y59 WeakPolarHBondContact O-CE2 3.09Å; I55-Y59 PolarHBondContact O-OH 3.2Å
56	P	93.9	Very high	92.7	Very high	43 Å²	43	53.6 Å²	53.6	28%	0.279	28%	0.284	S	S	.	.	S	Bend	trans	-68.9	102.6	179.8	-17.9	32.1	0	0	0	111.6	F33 Y38 A40	F33-P56 VanDerWaalsContact CE1-C 3.45Å; F33-P56 HydrophobicContact CE1-CB 3.92Å; F33-P56 WeakPolarHBondContact CE1-O 3.49Å; F33-P56 HydrophobicContact CZ-CB 4.38Å; Y38-P56 WeakPolarHBondContact O-CB 3.41Å; Y38-P56 WeakPolarHBondContact O-CG 3.43Å; A40-P56 HydrophobicContact CB-CB 4.18Å; A40-P56 HydrophobicContact CB-CG 4.13Å
57	K	94.6	Very high	93.2	Very high	97 Å²	97	50 Å²	50	42%	0.422	27%	0.272	S	S	.	.	S	Bend	trans	-160	173.9	171.2	63.2	178.3	-175.9	174.6	0	109.5	I55 Y59 Y215	I55-K57 PolarHBondContact O-N 3.47Å; K57-Y59 HydrophobicContact CD-CE1 4.17Å; K57-Y59 WeakPolarHBondContact CE-OH 3.45Å; K57-Y59 HydrophobicContact CG-CD1 4.48Å; K57-Y59 HydrophobicContact CG-CD2 4.18Å; K57-Y59 HydrophobicContact CG-CE1 4.01Å; K57-Y59 HydrophobicContact CG-CE2 3.62Å; K57-Y59 VanDerWaalsContact O-CD2 3.3Å; K57-Y59 WeakPolarHBondContact O-CD2 3.49Å; K57-Y59 WeakPolarHBondContact O-CE2 3.3Å; K57-Y215 PolarHBondContact O-OH 2.92Å
58	F	93.1	Very high	93.6	Very high	70 Å²	70	49.5 Å²	49.5	31%	0.307	27%	0.268	S	S	.	.			trans	-77.4	131.7	166.3	-72.1	-42.8	0	0	0	111.5	A32 F33 F239	A32-F58 WeakPolarHBondContact O-CE2 3.12Å; F33-F58 HydrophobicContact CB-CD2 4.46Å; F33-F58 HydrophobicContact CB-CE2 4.38Å; F33-F58 AromaticContact CD2-CD1 3.58Å; F33-F58 HydrophobicContact CD2-CD1 3.58Å; F33-F58 AromaticContact CD2-CD2 3.78Å; F33-F58 HydrophobicContact CD2-CD2 3.78Å; F33-F58 AromaticContact CD2-CE1 3.52Å; F33-F58 HydrophobicContact CD2-CE1 3.52Å; F33-F58 AromaticContact CD2-CE2 3.76Å; F33-F58 HydrophobicContact CD2-CE2 3.76Å; F33-F58 AromaticContact CD2-CG 3.72Å; F33-F58 HydrophobicContact CD2-CG 3.72Å; F33-F58 AromaticContact CD2-CZ 3.64Å; F33-F58 HydrophobicContact CD2-CZ 3.64Å; F33-F58 AromaticContact CE2-CD1 3.6Å; F33-F58 HydrophobicContact CE2-CD1 3.6Å; F33-F58 AromaticContact CE2-CE1 3.66Å; F33-F58 HydrophobicContact CE2-CE1 3.66Å; F33-F58 HydrophobicContact CE2-CG 4.11Å; F33-F58 HydrophobicContact CE2-CZ 4.23Å; F58-F239 AromaticContact CE1-CD1 3.86Å; F58-F239 HydrophobicContact CE1-CD1 3.86Å; F58-F239 AromaticContact CE1-CD2 3.98Å; F58-F239 HydrophobicContact CE1-CD2 3.98Å; F58-F239 HydrophobicContact CE1-CE1 4.01Å; F58-F239 HydrophobicContact CE1-CE2 4.1Å; F58-F239 AromaticContact CE1-CG 3.85Å; F58-F239 HydrophobicContact CE1-CG 3.85Å; F58-F239 HydrophobicContact CE1-CZ 4.1Å; F58-F239 HydrophobicContact CZ-CD1 4.11Å; F58-F239 HydrophobicContact CZ-CE1 4.33Å; F58-F239 HydrophobicContact CZ-CG 4.43Å
59	Y	96.5	Very high	94.2	Very high	13 Å²	13	45.3 Å²	45.3	5%	0.051	24%	0.244	C	C	.	.			trans	-115.1	149.1	171	-61.3	-87.7	0	0	0	108.9	L54 I55 K57 E63 L64 F67 Y215 H242	L54-Y59 HydrophobicContact CB-CE2 4.38Å; L54-Y59 HydrophobicContact CD1-CD2 4.38Å; L54-Y59 HydrophobicContact CD1-CE2 4.02Å; I55-Y59 PolarHBondContact N-OH 3.09Å; I55-Y59 VanDerWaalsContact O-CE2 3.23Å; I55-Y59 WeakPolarHBondContact O-CE2 3.09Å; I55-Y59 PolarHBondContact O-OH 3.2Å; K57-Y59 HydrophobicContact CD-CE1 4.17Å; K57-Y59 WeakPolarHBondContact CE-OH 3.45Å; K57-Y59 HydrophobicContact CG-CD1 4.48Å; K57-Y59 HydrophobicContact CG-CD2 4.18Å; K57-Y59 HydrophobicContact CG-CE1 4.01Å; K57-Y59 HydrophobicContact CG-CE2 3.62Å; K57-Y59 VanDerWaalsContact O-CD2 3.3Å; K57-Y59 WeakPolarHBondContact O-CD2 3.49Å; K57-Y59 WeakPolarHBondContact O-CE2 3.3Å; Y59-E63 HydrophobicContact CD1-CB 4.45Å; Y59-L64 HydrophobicContact CD2-CD2 4.01Å; Y59-L64 HydrophobicContact CG-CD2 4.06Å; Y59-L64 HydrophobicContact CG-CG 4.32Å; Y59-F67 AromaticContact CD1-CE2 3.52Å; Y59-F67 HydrophobicContact CD1-CE2 3.52Å; Y59-F67 HydrophobicContact CD1-CZ 4.18Å; Y59-F67 AromaticContact CE1-CE2 3.51Å; Y59-F67 HydrophobicContact CE1-CE2 3.51Å; Y59-F67 HydrophobicContact CE1-CZ 4.06Å; Y59-F67 HydrophobicContact CG-CE2 4.23Å; Y59-Y215 HydrophobicContact CD2-CE2 4.46Å; Y59-H242 PolarHBondContact O-NE2 2.92Å
60	S	97.5	Very high	94.6	Very high	52 Å²	52	48.1 Å²	48.1	36%	0.364	26%	0.258	S	S	.	.			trans	-65	161.6	168.3	67.2	0	0	0	0	111.2	A62 E63 L64	S60-A62 PolarHBondContact O-N 3.27Å; S60-E63 VanDerWaalsContact CB-OE2 3.27Å; S60-E63 WeakPolarHBondContact CB-OE2 3.46Å; S60-E63 PolarHBondContact N-OE2 3.15Å; S60-E63 PolarHBondContact O-N 3.33Å; S60-E63 WeakPolarHBondContact OG-CB 3.29Å; S60-E63 VanDerWaalsContact OG-CG 3.28Å; S60-E63 WeakPolarHBondContact OG-CG 3.4Å; S60-E63 PolarHBondContact OG-N 3.44Å; S60-E63 PolarHBondContact OG-OE2 2.86Å; S60-L64 WeakPolarHBondContact O-CG 3.42Å; S60-L64 PolarHBondContact O-N 2.85Å; S60-L64 VanDerWaalsContact O-N 3.13Å
61	I	98.3	Very high	94.4	Very high	18 Å²	18	47.7 Å²	47.7	9%	0.092	26%	0.255	C	S	.	.	H	α-helix	trans	-60.4	-39.6	174.7	-59.8	174.1	0	0	0	110.3	L64 L65 D200 V202 H242 V244	I61-L64 PolarHBondContact O-N 2.85Å; I61-L65 HydrophobicContact CG2-CD1 3.83Å; I61-L65 HydrophobicContact CG2-CG 4.31Å; I61-L65 WeakPolarHBondContact O-CB 3.27Å; I61-L65 WeakPolarHBondContact O-CG 3.41Å; I61-L65 PolarHBondContact O-N 2.91Å; I61-D200 HydrophobicContact CG2-CB 3.89Å; I61-V202 HydrophobicContact CG1-CG2 4.37Å; I61-H242 WeakPolarHBondContact CD1-O 3.11Å; I61-H242 HydrophobicContact CG1-CB 4.4Å; I61-V244 HydrophobicContact CD1-CB 4.3Å; I61-V244 HydrophobicContact CD1-CG2 3.66Å
62	A	97.9	Very high	94	Very high	71 Å²	71	51.1 Å²	51.1	59%	0.587	27%	0.271	S	S	*	.	H	α-helix	trans	-63.6	-46.1	180	0	0	0	0	0	112.2	S60 L64 L65 D66	S60-A62 PolarHBondContact O-N 3.27Å; A62-L64 VanDerWaalsContact C-N 3.35Å; A62-L64 PolarHBondContact O-N 3.26Å; A62-L65 PolarHBondContact O-N 2.95Å; A62-D66 WeakPolarHBondContact O-CB 3.43Å; A62-D66 PolarHBondContact O-N 2.98Å
63	E	97.8	Very high	93.2	Very high	77 Å²	77	58.1 Å²	58.1	36%	0.36	30%	0.304	S	S	.	.	H	α-helix	trans	-59.8	-44.6	175	-73.9	164.8	111.5	0	0	111.5	Y59 S60 D66 F67	Y59-E63 HydrophobicContact CD1-CB 4.45Å; S60-E63 VanDerWaalsContact CB-OE2 3.27Å; S60-E63 WeakPolarHBondContact CB-OE2 3.46Å; S60-E63 PolarHBondContact N-OE2 3.15Å; S60-E63 PolarHBondContact O-N 3.33Å; S60-E63 WeakPolarHBondContact OG-CB 3.29Å; S60-E63 VanDerWaalsContact OG-CG 3.28Å; S60-E63 WeakPolarHBondContact OG-CG 3.4Å; S60-E63 PolarHBondContact OG-N 3.44Å; S60-E63 PolarHBondContact OG-OE2 2.86Å; E63-D66 WeakPolarHBondContact O-CB 3.2Å; E63-D66 PolarHBondContact O-N 2.81Å; E63-F67 HydrophobicContact CB-CE2 4.26Å; E63-F67 HydrophobicContact CB-CZ 4.33Å; E63-F67 WeakPolarHBondContact O-CB 3.42Å; E63-F67 WeakPolarHBondContact O-CD1 3.19Å; E63-F67 WeakPolarHBondContact O-CD2 3.49Å; E63-F67 WeakPolarHBondContact O-CG 3.47Å; E63-F67 PolarHBondContact O-N 2.8Å
64	L	97.9	Very high	92.2	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-69.9	-35.4	-177.7	-69.3	166	0	0	0	112.7	I42 L54 Y59 S60 I61 A62 F67 Q68 V202 Y215 P217	I42-L64 HydrophobicContact CD1-CB 4.36Å; I42-L64 HydrophobicContact CD1-CD2 3.97Å; L54-L64 HydrophobicContact CD1-CD2 3.89Å; Y59-L64 HydrophobicContact CD2-CD2 4.01Å; Y59-L64 HydrophobicContact CG-CD2 4.06Å; Y59-L64 HydrophobicContact CG-CG 4.32Å; S60-L64 WeakPolarHBondContact O-CG 3.42Å; S60-L64 PolarHBondContact O-N 2.85Å; S60-L64 VanDerWaalsContact O-N 3.13Å; I61-L64 PolarHBondContact O-N 2.85Å; A62-L64 VanDerWaalsContact C-N 3.35Å; A62-L64 PolarHBondContact O-N 3.26Å; L64-F67 HydrophobicContact CD2-CD2 4.28Å; L64-F67 PolarHBondContact O-N 2.78Å; L64-Q68 WeakPolarHBondContact O-CB 3.27Å; L64-Q68 PolarHBondContact O-N 2.8Å; L64-V202 HydrophobicContact CB-CG2 4.25Å; L64-V202 HydrophobicContact CD1-CB 4.38Å; L64-V202 HydrophobicContact CD1-CG1 4.1Å; L64-V202 HydrophobicContact CD1-CG2 3.65Å; L64-Y215 HydrophobicContact CD1-CD1 4.22Å; L64-Y215 HydrophobicContact CD1-CG 4.32Å; L64-Y215 HydrophobicContact CD2-CD2 4.1Å; L64-Y215 HydrophobicContact CD2-CG 4.06Å; L64-P217 HydrophobicContact CB-CG 3.89Å; L64-P217 WeakPolarHBondContact O-CG 3.5Å
65	L	96.9	Very high	90.7	Very high	31 Å²	31	60.5 Å²	60.5	16%	0.162	32%	0.324	C	S	.	.	H	α-helix	trans	-64.4	-41.7	172.1	-76.5	168	0	0	0	111.7	I61 A62 Q68 Q69 D200 P217 K219	I61-L65 HydrophobicContact CG2-CD1 3.83Å; I61-L65 HydrophobicContact CG2-CG 4.31Å; I61-L65 WeakPolarHBondContact O-CB 3.27Å; I61-L65 WeakPolarHBondContact O-CG 3.41Å; I61-L65 PolarHBondContact O-N 2.91Å; A62-L65 PolarHBondContact O-N 2.95Å; L65-Q68 PolarHBondContact O-N 3.45Å; L65-Q69 PolarHBondContact O-N 3.26Å; L65-D200 HydrophobicContact CD1-CB 4.12Å; L65-P217 HydrophobicContact CD2-CB 3.66Å; L65-P217 HydrophobicContact CG-CB 4.1Å; L65-K219 HydrophobicContact CD2-CG 3.83Å
66	D	95.9	Very high	89.3	Confident	87 Å²	87	60.6 Å²	60.6	47%	0.465	32%	0.321	S	S	.	.	H	α-helix	trans	-61.7	-47.4	174.9	-175.3	78.8	0	0	0	111.1	A62 E63 Q68 Q69 N70	A62-D66 WeakPolarHBondContact O-CB 3.43Å; A62-D66 PolarHBondContact O-N 2.98Å; E63-D66 WeakPolarHBondContact O-CB 3.2Å; E63-D66 PolarHBondContact O-N 2.81Å; D66-Q68 PolarHBondContact O-N 3.39Å; D66-Q69 PolarHBondContact O-N 2.9Å; D66-Q69 VanDerWaalsContact O-N 3.12Å; D66-N70 VanDerWaalsContact CG-ND2 3.31Å; D66-N70 WeakPolarHBondContact O-CB 3.31Å; D66-N70 PolarHBondContact O-N 2.98Å; D66-N70 PolarHBondContact O-ND2 2.9Å; D66-N70 PolarHBondContact OD1-ND2 2.82Å; D66-N70 PolarHBondContact OD2-ND2 2.84Å
67	F	95.1	Very high	87.6	Confident	49 Å²	49	66.8 Å²	66.8	22%	0.215	35%	0.346	C	S	.	.	H	α-helix	trans	-60.5	-45	177.2	-66.3	-16.5	0	0	0	113	I42 L54 Y59 E63 L64 Q69 N70 M71	I42-F67 HydrophobicContact CG1-CB 4.2Å; L54-F67 HydrophobicContact CD1-CD2 4.21Å; L54-F67 HydrophobicContact CD2-CD2 3.79Å; L54-F67 HydrophobicContact CD2-CE2 4.07Å; L54-F67 HydrophobicContact CD2-CG 4.46Å; Y59-F67 AromaticContact CD1-CE2 3.52Å; Y59-F67 HydrophobicContact CD1-CE2 3.52Å; Y59-F67 HydrophobicContact CD1-CZ 4.18Å; Y59-F67 AromaticContact CE1-CE2 3.51Å; Y59-F67 HydrophobicContact CE1-CE2 3.51Å; Y59-F67 HydrophobicContact CE1-CZ 4.06Å; Y59-F67 HydrophobicContact CG-CE2 4.23Å; E63-F67 HydrophobicContact CB-CE2 4.26Å; E63-F67 HydrophobicContact CB-CZ 4.33Å; E63-F67 WeakPolarHBondContact O-CB 3.42Å; E63-F67 WeakPolarHBondContact O-CD1 3.19Å; E63-F67 WeakPolarHBondContact O-CD2 3.49Å; E63-F67 WeakPolarHBondContact O-CG 3.47Å; E63-F67 PolarHBondContact O-N 2.8Å; L64-F67 HydrophobicContact CD2-CD2 4.28Å; L64-F67 PolarHBondContact O-N 2.78Å; F67-Q69 PolarHBondContact O-N 3.03Å; F67-N70 PolarHBondContact O-N 3.47Å; F67-M71 HydrophobicContact CB-CG 3.89Å; F67-M71 HydrophobicContact CB-SD 3.65Å; F67-M71 HydrophobicContact CD1-CG 4.34Å; F67-M71 HydrophobicContact CD1-SD 4.27Å; F67-M71 HydrophobicContact CD2-SD 4.4Å; F67-M71 HydrophobicContact CG-CG 4.31Å; F67-M71 HydrophobicContact CG-SD 3.87Å; F67-M71 WeakPolarHBondContact O-CB 3.45Å; F67-M71 WeakPolarHBondContact O-CG 2.88Å; F67-M71 PolarHBondContact O-N 2.92Å
68	Q	94.3	Very high	85.9	Confident	9 Å²	9	70.4 Å²	70.4	4%	0.042	37%	0.37	C	S	.	.	H	α-helix	trans	-57.3	-33.9	177	168.1	177.9	63.2	0	0	112.1	I42 L43 A45 L64 L65 D66 P217	I42-Q68 HydrophobicContact CD1-CB 4.45Å; I42-Q68 HydrophobicContact CG1-CB 4.31Å; L43-Q68 WeakPolarHBondContact O-CG 3.41Å; A45-Q68 HydrophobicContact CB-CG 3.86Å; A45-Q68 WeakPolarHBondContact CB-O 3.45Å; A45-Q68 PolarHBondContact N-O 3.35Å; L64-Q68 WeakPolarHBondContact O-CB 3.27Å; L64-Q68 PolarHBondContact O-N 2.8Å; L65-Q68 PolarHBondContact O-N 3.45Å; D66-Q68 PolarHBondContact O-N 3.39Å; Q68-P217 HydrophobicContact CB-CG 4Å; Q68-P217 PolarHBondContact NE2-O 2.7Å
69	Q	92	Very high	84.6	Confident	78 Å²	78	72.3 Å²	72.3	36%	0.364	38%	0.379	S	S	.	.	H	α-helix	trans	-84	-35.3	-178.2	-174.8	60.3	26.9	0	0	113.5	L65 D66 F67	L65-Q69 PolarHBondContact O-N 3.26Å; D66-Q69 PolarHBondContact O-N 2.9Å; D66-Q69 VanDerWaalsContact O-N 3.12Å; F67-Q69 PolarHBondContact O-N 3.03Å
70	N	91	Very high	83.3	Confident	66 Å²	66	73 Å²	73	35%	0.353	39%	0.39	S	S	.	.	H	α-helix	trans	-113	-22.4	-164.8	-60.6	-36.9	0	0	0	114.5	D66 F67 H72 E73	D66-N70 VanDerWaalsContact CG-ND2 3.31Å; D66-N70 WeakPolarHBondContact O-CB 3.31Å; D66-N70 PolarHBondContact O-N 2.98Å; D66-N70 PolarHBondContact O-ND2 2.9Å; D66-N70 PolarHBondContact OD1-ND2 2.82Å; D66-N70 PolarHBondContact OD2-ND2 2.84Å; F67-N70 PolarHBondContact O-N 3.47Å; N70-H72 PolarHBondContact O-N 3.07Å; N70-H72 VanDerWaalsContact O-N 3.1Å; N70-E73 PolarHBondContact O-N 3.39Å
71	M	85.8	Confident	82.4	Confident	38 Å²	38	71.6 Å²	71.6	19%	0.187	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-69.4	-9.5	-176.5	-73.2	-168.2	75.9	0	0	114.8	I42 H52 P53 L54 F67 E73 S74	I42-M71 HydrophobicContact CG2-SD 3.69Å; H52-M71 HydrophobicContact CB-CE 4.45Å; P53-M71 WeakPolarHBondContact O-CE 3.42Å; L54-M71 HydrophobicContact CD2-CE 3.92Å; L54-M71 HydrophobicContact CD2-SD 3.55Å; L54-M71 VanDerWaalsContact CD2-SD 3.55Å; F67-M71 HydrophobicContact CB-CG 3.89Å; F67-M71 HydrophobicContact CB-SD 3.65Å; F67-M71 HydrophobicContact CD1-CG 4.34Å; F67-M71 HydrophobicContact CD1-SD 4.27Å; F67-M71 HydrophobicContact CD2-SD 4.4Å; F67-M71 HydrophobicContact CG-CG 4.31Å; F67-M71 HydrophobicContact CG-SD 3.87Å; F67-M71 WeakPolarHBondContact O-CB 3.45Å; F67-M71 WeakPolarHBondContact O-CG 2.88Å; F67-M71 PolarHBondContact O-N 2.92Å; M71-E73 PolarHBondContact O-N 2.73Å; M71-S74 PolarHBondContact O-N 3.49Å; M71-S74 PolarHBondContact O-OG 3.16Å; M71-S74 VanDerWaalsContact O-OG 3.09Å
72	H	84	Confident	81.6	Confident	71 Å²	71	74.2 Å²	74.2	33%	0.329	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-53.7	-35.4	172.6	174.5	62.9	0	0	0	112.5	R46 C47 N70 S74 C75	R46-H72 HydrophobicContact CB-CB 4.18Å; C47-H72 PolarHBondContact SG-ND1 2.77Å; N70-H72 PolarHBondContact O-N 3.07Å; N70-H72 VanDerWaalsContact O-N 3.1Å; H72-S74 VanDerWaalsContact C-N 3.26Å; H72-S74 PolarHBondContact O-N 3.24Å; H72-C75 WeakPolarHBondContact O-CB 3.43Å; H72-C75 PolarHBondContact O-N 2.81Å; H72-C75 VanDerWaalsContact O-N 3.12Å
73	E	75.9	Confident	80.9	Confident	152 Å²	152	71 Å²	71	71%	0.71	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-69.7	-22.6	-174.1	-63.2	177.9	-176.8	0	0	113.3	N70 M71	N70-E73 PolarHBondContact O-N 3.39Å; M71-E73 PolarHBondContact O-N 2.73Å
74	S	71.1	Confident	80	Confident	88 Å²	88	74.9 Å²	74.9	62%	0.615	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-97.9	9.3	175.4	59	0	0	0	0	113.2	M71 H72 Q76	M71-S74 PolarHBondContact O-N 3.49Å; M71-S74 PolarHBondContact O-OG 3.16Å; M71-S74 VanDerWaalsContact O-OG 3.09Å; H72-S74 VanDerWaalsContact C-N 3.26Å; H72-S74 PolarHBondContact O-N 3.24Å; S74-Q76 PolarHBondContact O-N 3.4Å
75	C	62.6	Low	79.3	Confident	39 Å²	39	76 Å²	76	26%	0.264	40%	0.399	S	S	.	.			trans	-65.9	121.5	-174.6	179.4	0	0	0	0	112.2	H52 H72	H52-C75 PolarHBondContact CE1-SG 2.89Å; H72-C75 WeakPolarHBondContact O-CB 3.43Å; H72-C75 PolarHBondContact O-N 2.81Å; H72-C75 VanDerWaalsContact O-N 3.12Å
76	Q	64	Low	79.2	Confident	124 Å²	124	75.1 Å²	75.1	58%	0.579	40%	0.395	S	S	*	.			trans	-102.6	114.1	153.9	-63.7	-173.6	-8.5	0	0	107.3	S74 L78 Q79	S74-Q76 PolarHBondContact O-N 3.4Å; Q76-L78 PolarHBondContact O-N 2.66Å; Q76-Q79 HydrophobicContact CB-CG 4.34Å; Q76-Q79 PolarHBondContact O-N 3.1Å; Q76-Q79 VanDerWaalsContact OE1-NE2 3.09Å
77	E	57.8	Low	79	Confident	172 Å²	172	75 Å²	75	80%	0.804	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-49.9	-34.8	-176.1	-71.4	-175.8	159.9	0	0	112.9	Q79 G80	E77-Q79 PolarHBondContact O-N 2.89Å; E77-G80 PolarHBondContact O-N 3.34Å
78	L	58.8	Low	79	Confident	174 Å²	174	74.8 Å²	74.8	91%	0.911	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-66.5	-13.1	-179.2	-66.7	168.8	0	0	0	114.9	Q76	Q76-L78 PolarHBondContact O-N 2.66Å
79	Q	65.1	Low	79	Confident	109 Å²	109	76.1 Å²	76.1	51%	0.509	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-105.9	-0.8	-179.2	-60.2	-173.6	3.7	0	0	113.4	P53 Q76 E77	P53-Q79 HydrophobicContact CG-CB 4.31Å; Q76-Q79 HydrophobicContact CB-CG 4.34Å; Q76-Q79 PolarHBondContact O-N 3.1Å; Q76-Q79 VanDerWaalsContact OE1-NE2 3.09Å; E77-Q79 PolarHBondContact O-N 2.89Å
80	G	69.2	Low	79.2	Confident	27 Å²	27	75.8 Å²	75.8	28%	0.278	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-78.9	151	-177.8	0	0	0	0	0	113.9	A51 E77	A51-G80 VanDerWaalsContact O-CA 3.31Å; A51-G80 WeakPolarHBondContact O-CA 3.46Å; E77-G80 PolarHBondContact O-N 3.34Å
81	C	79.4	Confident	79.5	Confident	24 Å²	24	77.8 Å²	77.8	16%	0.162	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	128.1	166.3	-176.5	0	0	0	0	109.4	F41 A51 V83	F41-C81 HydrophobicContact CD1-CB 3.68Å; F41-C81 HydrophobicContact CD2-CB 4.07Å; F41-C81 HydrophobicContact CE1-CB 3.77Å; F41-C81 HydrophobicContact CE2-CB 4.13Å; F41-C81 HydrophobicContact CG-CB 3.85Å; F41-C81 HydrophobicContact CZ-CB 4Å; A51-C81 HydrophobicContact CB-CB 4.38Å; A51-C81 PolarHBondContact N-O 3.37Å; A51-C81 PolarHBondContact O-N 3.35Å; C81-V83 PolarHBondContact O-N 3.07Å
82	S	80.6	Confident	80.1	Confident	72 Å²	72	76.7 Å²	76.7	50%	0.503	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	122.5	176.2	-178.7	0	0	0	0	110.8
83	V	82.7	Confident	80.7	Confident	3 Å²	3	73.3 Å²	73.3	2%	0.018	39%	0.39	C	S	.	.			trans	-132.8	34.8	179.1	-68.8	0	0	0	0	110.2	L43 G49 A51 C81 S85 V86 I214 V230	L43-V83 HydrophobicContact CD1-CB 4.43Å; L43-V83 HydrophobicContact CD1-CG2 3.38Å; G49-V83 CarbonylContact O-C 3.54Å; G49-V83 PolarHBondContact O-N 3.12Å; A51-V83 HydrophobicContact CB-CG1 4.22Å; A51-V83 HydrophobicContact CB-CG2 4.03Å; C81-V83 PolarHBondContact O-N 3.07Å; V83-S85 PolarHBondContact O-N 2.99Å; V83-V86 HydrophobicContact CB-CG2 4.32Å; V83-V86 PolarHBondContact O-N 2.76Å; V83-I214 HydrophobicContact CG1-CD1 3.51Å; V83-I214 HydrophobicContact CG1-CG2 4.31Å; V83-V230 HydrophobicContact CG1-CG2 4.46Å
84	Q	78.9	Confident	81.8	Confident	159 Å²	159	68.6 Å²	68.6	74%	0.743	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-22.8	-178.3	-72.7	-178.4	-20.4	0	0	114.2	G49	G49-Q84 PolarHBondContact O-N 3.24Å
85	S	84.9	Confident	83.1	Confident	24 Å²	24	67.9 Å²	67.9	17%	0.168	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	15.4	178.7	70.3	0	0	0	0	114.4	V83 F226 S227 V230	V83-S85 PolarHBondContact O-N 2.99Å; S85-F226 CarbonylContact O-C 3.58Å; S85-F226 WeakPolarHBondContact O-CA 3.46Å; S85-S227 WeakPolarHBondContact CB-O 3.06Å; S85-S227 PolarHBondContact O-N 3.17Å; S85-S227 PolarHBondContact OG-O 3.06Å; S85-V230 WeakPolarHBondContact OG-CB 3.41Å; S85-V230 WeakPolarHBondContact OG-CG2 3.37Å; S85-V230 PolarHBondContact OG-N 3.27Å
86	V	93.7	Very high	84.9	Confident	12 Å²	12	72.7 Å²	72.7	7%	0.073	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	121.9	169.4	-176.2	0	0	0	0	109	L43 V83 F205 V216 C225 F226 V230	L43-V86 HydrophobicContact CD2-CG1 3.9Å; V83-V86 HydrophobicContact CB-CG2 4.32Å; V83-V86 PolarHBondContact O-N 2.76Å; V86-F205 HydrophobicContact CG2-CE2 4.25Å; V86-F205 HydrophobicContact CG2-CZ 4.47Å; V86-V216 HydrophobicContact CG1-CG1 4.31Å; V86-V216 HydrophobicContact CG1-CG2 4.46Å; V86-C225 WeakPolarHBondContact CA-O 3.34Å; V86-F226 HydrophobicContact CG2-CB 4.21Å; V86-V230 HydrophobicContact CG2-CB 4.12Å; V86-V230 HydrophobicContact CG2-CG1 3.8Å; V86-V230 HydrophobicContact CG2-CG2 3.96Å
87	F	91.7	Very high	86.5	Confident	85 Å²	85	68.9 Å²	68.9	37%	0.373	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	132.6	-176.3	177.4	-103	0	0	0	110.5	V89 I154 C156 C224 C225	F87-V89 HydrophobicContact CD1-CG2 4Å; F87-V89 HydrophobicContact CE1-CG2 3.16Å; F87-V89 HydrophobicContact CZ-CG2 3.65Å; F87-I154 HydrophobicContact CD1-CG2 4.22Å; F87-I154 HydrophobicContact CE1-CG2 3.43Å; F87-I154 VanDerWaalsContact CE1-CG2 3.43Å; F87-I154 HydrophobicContact CZ-CG2 3.93Å; F87-C156 VanDerWaalsContact CD1-SG 3.5Å; F87-C224 CarbonylContact O-C 3.57Å; F87-C224 WeakPolarHBondContact O-CA 3.22Å; F87-C225 HydrophobicContact CB-CB 4.36Å; F87-C225 PolarHBondContact N-O 3.45Å; F87-C225 PolarHBondContact O-N 2.82Å
88	L	94.6	Very high	88.5	Confident	45 Å²	45	60.7 Å²	60.7	24%	0.236	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	140.9	-179.4	-63.6	-172.1	0	0	0	111.6	L43 V216 L218 L223 C224	L43-L88 HydrophobicContact CD2-CD1 3.53Å; L43-L88 HydrophobicContact CD2-CG 3.8Å; L88-V216 HydrophobicContact CD1-CG1 4.2Å; L88-V216 HydrophobicContact CD2-CG1 4.01Å; L88-L218 HydrophobicContact CD1-CD2 4.48Å; L88-L218 HydrophobicContact CD2-CD2 3.45Å; L88-L218 VanDerWaalsContact CD2-CD2 3.45Å; L88-L223 CarbonylContact C-O 3.5Å; L88-L223 WeakPolarHBondContact CA-O 3.4Å; L88-C224 HydrophobicContact CD2-CB 3.42Å; L88-C224 VanDerWaalsContact CD2-CB 3.42Å
89	V	95	Very high	90.3	Very high	36 Å²	36	56 Å²	56	22%	0.218	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	109.4	169.9	-172.5	0	0	0	0	108.8	F87 F92 I154 S222 L223	F87-V89 HydrophobicContact CD1-CG2 4Å; F87-V89 HydrophobicContact CE1-CG2 3.16Å; F87-V89 HydrophobicContact CZ-CG2 3.65Å; V89-F92 HydrophobicContact CB-CB 4.3Å; V89-F92 HydrophobicContact CB-CD2 4.36Å; V89-F92 HydrophobicContact CG1-CB 4.15Å; V89-F92 HydrophobicContact CG1-CD2 4.09Å; V89-I154 HydrophobicContact CG2-CD1 4.07Å; V89-S222 CarbonylContact O-C 3.6Å; V89-S222 WeakPolarHBondContact O-CA 3.48Å; V89-S222 WeakPolarHBondContact O-CB 3.27Å; V89-L223 HydrophobicContact CB-CB 4.32Å; V89-L223 HydrophobicContact CG2-CD2 4.23Å; V89-L223 PolarHBondContact N-O 2.87Å; V89-L223 PolarHBondContact O-N 3.43Å
90	D	95.8	Very high	91.9	Very high	72 Å²	72	54.4 Å²	54.4	39%	0.385	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	148.4	171.9	-85.9	-7.5	0	0	0	110.9	F92 K219	D90-F92 PolarHBondContact O-N 3.08Å; D90-F92 VanDerWaalsContact O-N 3.11Å; D90-K219 IonicContact OD2-NZ 2.7Å; D90-K219 PolarHBondContact OD2-NZ 2.79Å
91	N	97.3	Very high	93.3	Very high	108 Å²	108	53.3 Å²	53.3	58%	0.578	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.6	36.2	-180	-58.2	-60	0	0	0	113.9	I93 R221	N91-I93 PolarHBondContact O-N 3.34Å; N91-R221 CarbonylContact C-O 3.6Å; N91-R221 PolarHBondContact OD1-NH2 2.64Å
92	F	98.1	Very high	94.2	Very high	14 Å²	14	54.8 Å²	54.8	6%	0.061	28%	0.284	C	S	.	.			trans	-59	-30.8	176.8	-179.5	-106.9	0	0	0	112.8	V89 D90 L147 R150 L151 I154 R221 L223	V89-F92 HydrophobicContact CB-CB 4.3Å; V89-F92 HydrophobicContact CB-CD2 4.36Å; V89-F92 HydrophobicContact CG1-CB 4.15Å; V89-F92 HydrophobicContact CG1-CD2 4.09Å; D90-F92 PolarHBondContact O-N 3.08Å; D90-F92 VanDerWaalsContact O-N 3.11Å; F92-L147 HydrophobicContact CD1-CD2 4.34Å; F92-L147 HydrophobicContact CE1-CD2 3.77Å; F92-R150 HydrophobicContact CE2-CB 4.3Å; F92-R150 HydrophobicContact CE2-CG 3.57Å; F92-R150 HydrophobicContact CZ-CB 3.88Å; F92-R150 HydrophobicContact CZ-CG 3.64Å; F92-R150 WeakPolarHBondContact O-CD 3.04Å; F92-R150 PolarHBondContact O-NH1 3.36Å; F92-L151 HydrophobicContact CE1-CD2 4.2Å; F92-L151 HydrophobicContact CZ-CD2 3.75Å; F92-I154 HydrophobicContact CD2-CD1 4.12Å; F92-I154 HydrophobicContact CE2-CD1 3.59Å; F92-I154 HydrophobicContact CZ-CD1 4.43Å; F92-R221 PolarHBondContact N-O 3.41Å; F92-L223 HydrophobicContact CB-CB 3.68Å; F92-L223 HydrophobicContact CD1-CB 3.7Å; F92-L223 HydrophobicContact CD1-CD1 3.65Å; F92-L223 HydrophobicContact CD1-CG 4.34Å; F92-L223 HydrophobicContact CD2-CB 4.07Å; F92-L223 HydrophobicContact CD2-CD1 4.05Å; F92-L223 HydrophobicContact CE1-CB 4.39Å; F92-L223 HydrophobicContact CE1-CD1 3.44Å; F92-L223 VanDerWaalsContact CE1-CD1 3.44Å; F92-L223 HydrophobicContact CE2-CD1 3.86Å; F92-L223 HydrophobicContact CG-CB 3.52Å; F92-L223 HydrophobicContact CG-CD1 3.95Å; F92-L223 HydrophobicContact CG-CG 4.38Å; F92-L223 HydrophobicContact CZ-CD1 3.57Å
93	I	98.6	Very high	95.1	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.285	C	S	.	.	S	Bend	trans	-117.1	151.3	168.7	65.2	175.3	0	0	0	111.2	N91 E97 E98 L101 F146 L147 L197 R221	N91-I93 PolarHBondContact O-N 3.34Å; I93-E97 VanDerWaalsContact CA-OE2 3.31Å; I93-E97 WeakPolarHBondContact CA-OE2 3.49Å; I93-E97 HydrophobicContact CB-CB 4.18Å; I93-E98 HydrophobicContact CD1-CB 3.77Å; I93-E98 HydrophobicContact CD1-CG 4.16Å; I93-E98 HydrophobicContact CG1-CB 4.45Å; I93-L101 HydrophobicContact CD1-CD1 4.18Å; I93-F146 HydrophobicContact CG2-CE2 4.42Å; I93-L147 HydrophobicContact CG2-CD2 3.4Å; I93-L147 VanDerWaalsContact CG2-CD2 3.4Å; I93-L197 HydrophobicContact CD1-CD1 4.42Å; I93-L197 HydrophobicContact CD1-CD2 4.13Å; I93-L197 HydrophobicContact CD1-CG 3.83Å; I93-R221 HydrophobicContact CD1-CB 4.32Å; I93-R221 HydrophobicContact CD1-CG 4.24Å; I93-R221 HydrophobicContact CG1-CB 3.53Å; I93-R221 HydrophobicContact CG1-CG 3.8Å; I93-R221 PolarHBondContact N-O 3.26Å; I93-R221 WeakPolarHBondContact O-CB 3.49Å; I93-R221 WeakPolarHBondContact O-CD 3.38Å
94	S	98.5	Very high	95.8	Very high	54 Å²	54	56.4 Å²	56.4	38%	0.378	30%	0.298	S	S	.	.			trans	-77	164.4	172.6	72.4	0	0	0	0	111.8	K96 E97 E98	S94-K96 PolarHBondContact O-N 2.81Å; S94-E97 PolarHBondContact N-OE2 2.79Å; S94-E97 PolarHBondContact O-N 2.83Å; S94-E97 VanDerWaalsContact OG-CG 3.28Å; S94-E97 WeakPolarHBondContact OG-CG 3.47Å; S94-E97 PolarHBondContact OG-N 3.11Å; S94-E97 VanDerWaalsContact OG-N 3.13Å; S94-E97 PolarHBondContact OG-OE2 2.85Å; S94-E98 PolarHBondContact O-N 3.24Å
95	Q	98.7	Very high	96.8	Very high	73 Å²	73	48.8 Å²	48.8	34%	0.341	26%	0.262	S	S	.	.	H	α-helix	trans	-60.4	-35.9	173.1	-173.7	57.7	63.1	0	0	112.2	E98 N99	Q95-E98 PolarHBondContact NE2-OE2 2.98Å; Q95-E98 PolarHBondContact OE1-OE2 3.32Å; Q95-N99 PolarHBondContact NE2-OD1 3.02Å; Q95-N99 PolarHBondContact O-N 3.23Å; Q95-N99 VanDerWaalsContact O-N 3.09Å; Q95-N99 PolarHBondContact O-ND2 2.85Å; Q95-N99 PolarHBondContact O-OD1 3.3Å
96	K	98.6	Very high	97.4	Very high	140 Å²	140	50.6 Å²	50.6	61%	0.609	27%	0.27	S	S	*	.	H	α-helix	trans	-64.4	-49.1	176.7	-175.9	-173.9	179	-61.7	0	110.8	S94 E98 N99 D100	S94-K96 PolarHBondContact O-N 2.81Å; K96-E98 VanDerWaalsContact C-N 3.31Å; K96-E98 PolarHBondContact O-N 2.94Å; K96-N99 PolarHBondContact O-N 2.83Å; K96-D100 IonicContact NZ-OD1 2.68Å; K96-D100 IonicContact NZ-OD2 3.15Å; K96-D100 PolarHBondContact NZ-OD2 2.86Å; K96-D100 VanDerWaalsContact O-CG 3.26Å; K96-D100 PolarHBondContact O-N 3.43Å
97	E	98.7	Very high	97.6	Very high	44 Å²	44	54.7 Å²	54.7	21%	0.206	30%	0.299	C	S	.	.	H	α-helix	trans	-60.5	-41.2	178.4	-72.1	167.3	165.3	0	0	111.9	I93 S94 N99 D100 L101 F146 R150	I93-E97 VanDerWaalsContact CA-OE2 3.31Å; I93-E97 WeakPolarHBondContact CA-OE2 3.49Å; I93-E97 HydrophobicContact CB-CB 4.18Å; S94-E97 PolarHBondContact N-OE2 2.79Å; S94-E97 PolarHBondContact O-N 2.83Å; S94-E97 VanDerWaalsContact OG-CG 3.28Å; S94-E97 WeakPolarHBondContact OG-CG 3.47Å; S94-E97 PolarHBondContact OG-N 3.11Å; S94-E97 VanDerWaalsContact OG-N 3.13Å; S94-E97 PolarHBondContact OG-OE2 2.85Å; E97-N99 PolarHBondContact O-N 2.84Å; E97-D100 PolarHBondContact O-N 3.47Å; E97-L101 VanDerWaalsContact O-CB 3.29Å; E97-L101 WeakPolarHBondContact O-CB 3.35Å; E97-L101 WeakPolarHBondContact O-CG 3.46Å; E97-L101 PolarHBondContact O-N 3.13Å; E97-F146 HydrophobicContact CB-CE2 4.22Å; E97-F146 HydrophobicContact CB-CZ 4.01Å; E97-F146 HydrophobicContact CG-CE2 3.95Å; E97-F146 HydrophobicContact CG-CZ 4.11Å; E97-R150 IonicContact OE1-CZ 3.87Å; E97-R150 IonicContact OE1-NH1 3.93Å; E97-R150 PolarHBondContact OE1-NH1 3.34Å; E97-R150 IonicContact OE1-NH2 2.65Å; E97-R150 PolarHBondContact OE1-NH2 2.87Å; E97-R150 IonicContact OE2-CZ 3.26Å; E97-R150 IonicContact OE2-NH1 3.67Å; E97-R150 PolarHBondContact OE2-NH1 2.88Å; E97-R150 IonicContact OE2-NH2 3.73Å
98	E	98.8	Very high	97.8	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-60.5	-43.5	175.1	-172.5	-175.8	-133.8	0	0	112.2	I93 S94 Q95 K96 Q102 L197 L198 R220 R221	I93-E98 HydrophobicContact CD1-CB 3.77Å; I93-E98 HydrophobicContact CD1-CG 4.16Å; I93-E98 HydrophobicContact CG1-CB 4.45Å; S94-E98 PolarHBondContact O-N 3.24Å; Q95-E98 PolarHBondContact NE2-OE2 2.98Å; Q95-E98 PolarHBondContact OE1-OE2 3.32Å; K96-E98 VanDerWaalsContact C-N 3.31Å; K96-E98 PolarHBondContact O-N 2.94Å; E98-Q102 WeakPolarHBondContact O-CB 3.4Å; E98-Q102 PolarHBondContact O-N 3.41Å; E98-L197 HydrophobicContact CG-CB 4.12Å; E98-L197 HydrophobicContact CG-CD2 4.05Å; E98-L197 HydrophobicContact CG-CG 4.14Å; E98-L197 WeakPolarHBondContact OE1-CA 3.4Å; E98-L198 HydrophobicContact CG-CD2 4.08Å; E98-L198 PolarHBondContact OE1-N 3.01Å; E98-R220 IonicContact OE1-CZ 3.46Å; E98-R220 IonicContact OE1-NE 3.69Å; E98-R220 PolarHBondContact OE1-NE 3.12Å; E98-R220 IonicContact OE1-NH2 3.93Å; E98-R220 IonicContact OE2-CZ 3.41Å; E98-R220 IonicContact OE2-NE 2.83Å; E98-R220 PolarHBondContact OE2-NE 2.98Å; E98-R220 IonicContact OE2-NH2 2.82Å; E98-R220 PolarHBondContact OE2-NH2 3.14Å; E98-R221 HydrophobicContact CB-CG 4.16Å; E98-R221 VanDerWaalsContact CD-CG 3.42Å; E98-R221 HydrophobicContact CG-CG 4.22Å; E98-R221 VanDerWaalsContact OE1-CG 3.3Å; E98-R221 WeakPolarHBondContact OE1-CG 3.27Å; E98-R221 IonicContact OE2-NH1 2.79Å
99	N	98.7	Very high	97.7	Very high	76 Å²	76	53.1 Å²	53.1	41%	0.406	30%	0.304	S	S	.	.	H	α-helix	trans	-65.3	-43.9	177.3	-67.3	-11.5	0	0	0	111.6	Q95 K96 E97 Q102 A103	Q95-N99 PolarHBondContact NE2-OD1 3.02Å; Q95-N99 PolarHBondContact O-N 3.23Å; Q95-N99 VanDerWaalsContact O-N 3.09Å; Q95-N99 PolarHBondContact O-ND2 2.85Å; Q95-N99 PolarHBondContact O-OD1 3.3Å; K96-N99 PolarHBondContact O-N 2.83Å; E97-N99 PolarHBondContact O-N 2.84Å; N99-Q102 PolarHBondContact O-N 2.67Å; N99-A103 WeakPolarHBondContact O-CB 3.19Å; N99-A103 PolarHBondContact O-N 2.77Å
100	D	98.6	Very high	97.8	Very high	75 Å²	75	52.9 Å²	52.9	40%	0.401	30%	0.299	S	S	.	.	H	α-helix	trans	-64.8	-43.1	179.1	-66.9	-20.2	0	0	0	111.2	K96 E97 T104	K96-D100 IonicContact NZ-OD1 2.68Å; K96-D100 IonicContact NZ-OD2 3.15Å; K96-D100 PolarHBondContact NZ-OD2 2.86Å; K96-D100 VanDerWaalsContact O-CG 3.26Å; K96-D100 PolarHBondContact O-N 3.43Å; E97-D100 PolarHBondContact O-N 3.47Å; D100-T104 WeakPolarHBondContact O-CB 3.29Å; D100-T104 PolarHBondContact O-N 2.76Å; D100-T104 PolarHBondContact O-OG1 3.3Å
101	L	98.6	Very high	97.9	Very high	3 Å²	3	55 Å²	55	2%	0.016	31%	0.307	C	S	.	.	H	α-helix	trans	-60.4	-48.4	173.3	-75.9	173.4	0	0	0	111.3	I93 E97 T104 M105 Y143 F146 L147 L197 M250	I93-L101 HydrophobicContact CD1-CD1 4.18Å; E97-L101 VanDerWaalsContact O-CB 3.29Å; E97-L101 WeakPolarHBondContact O-CB 3.35Å; E97-L101 WeakPolarHBondContact O-CG 3.46Å; E97-L101 PolarHBondContact O-N 3.13Å; L101-T104 PolarHBondContact O-N 2.83Å; L101-M105 HydrophobicContact CB-CE 4.1Å; L101-M105 HydrophobicContact CD2-CE 4.12Å; L101-M105 WeakPolarHBondContact O-CB 3.5Å; L101-M105 VanDerWaalsContact O-CG 3.24Å; L101-M105 WeakPolarHBondContact O-CG 3.41Å; L101-M105 PolarHBondContact O-N 2.92Å; L101-Y143 HydrophobicContact CD2-CD2 3.57Å; L101-Y143 HydrophobicContact CD2-CE2 4.07Å; L101-F146 HydrophobicContact CD1-CE1 4.35Å; L101-F146 HydrophobicContact CD1-CZ 3.95Å; L101-F146 HydrophobicContact CD2-CE1 3.96Å; L101-F146 HydrophobicContact CD2-CZ 4.39Å; L101-F146 HydrophobicContact CG-CE1 4.23Å; L101-F146 HydrophobicContact CG-CZ 4.24Å; L101-L147 HydrophobicContact CD1-CD1 4.09Å; L101-L147 HydrophobicContact CD2-CD1 4.44Å; L101-L197 HydrophobicContact CB-CD2 3.88Å; L101-L197 HydrophobicContact CD1-CD2 3.89Å; L101-M250 HydrophobicContact CD1-SD 3.9Å; L101-M250 HydrophobicContact CD2-CE 4.34Å; L101-M250 HydrophobicContact CD2-SD 4.07Å
102	Q	98.4	Very high	97.9	Very high	55 Å²	55	53.9 Å²	53.9	26%	0.257	31%	0.305	S	S	.	.	H	α-helix	trans	-58.1	-51.9	177.8	-179.9	-170.6	-13	0	0	111.2	E98 N99 T104 M105 D106 L198 I248	E98-Q102 WeakPolarHBondContact O-CB 3.4Å; E98-Q102 PolarHBondContact O-N 3.41Å; N99-Q102 PolarHBondContact O-N 2.67Å; Q102-T104 VanDerWaalsContact C-N 3.3Å; Q102-T104 PolarHBondContact O-N 3.2Å; Q102-M105 PolarHBondContact O-N 3.04Å; Q102-D106 WeakPolarHBondContact O-CB 3.41Å; Q102-D106 VanDerWaalsContact O-CG 3.32Å; Q102-D106 PolarHBondContact O-N 3.43Å; Q102-L198 HydrophobicContact CB-CD2 4.24Å; Q102-L198 HydrophobicContact CG-CD1 4.22Å; Q102-L198 HydrophobicContact CG-CD2 4.25Å; Q102-I248 HydrophobicContact CG-CD1 4.32Å
103	A	98.4	Very high	97.8	Very high	62 Å²	62	54 Å²	54	51%	0.512	31%	0.307	S	S	.	.	H	α-helix	trans	-59.7	-42.9	-178.2	0	0	0	0	0	111.5	N99 D106 S107	N99-A103 WeakPolarHBondContact O-CB 3.19Å; N99-A103 PolarHBondContact O-N 2.77Å; A103-D106 PolarHBondContact O-N 3.21Å; A103-S107 PolarHBondContact O-N 2.83Å
104	T	98.3	Very high	97.7	Very high	47 Å²	47	55.9 Å²	55.9	29%	0.288	32%	0.316	S	S	.	.	H	α-helix	trans	-66.8	-43.8	178.7	-55	0	0	0	0	112	D100 L101 Q102 D106 S107 V108 Y143	D100-T104 WeakPolarHBondContact O-CB 3.29Å; D100-T104 PolarHBondContact O-N 2.76Å; D100-T104 PolarHBondContact O-OG1 3.3Å; L101-T104 PolarHBondContact O-N 2.83Å; Q102-T104 VanDerWaalsContact C-N 3.3Å; Q102-T104 PolarHBondContact O-N 3.2Å; T104-D106 VanDerWaalsContact C-N 3.33Å; T104-D106 PolarHBondContact O-N 3.02Å; T104-S107 PolarHBondContact O-N 3.32Å; T104-S107 PolarHBondContact O-OG 3.28Å; T104-V108 WeakPolarHBondContact O-CG2 3.39Å; T104-V108 PolarHBondContact O-N 2.85Å; T104-V108 VanDerWaalsContact O-N 3.12Å; T104-Y143 HydrophobicContact CG2-CD1 3.47Å; T104-Y143 VanDerWaalsContact CG2-CD1 3.47Å; T104-Y143 HydrophobicContact CG2-CE1 4.15Å; T104-Y143 HydrophobicContact CG2-CG 3.77Å
105	M	98.3	Very high	97.7	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-65.4	-39.6	177.3	-68.6	175.5	-160.8	0	0	111.2	L101 Q102 S107 V108 G109 W110 Q120 Y143 N167 I248 M250	L101-M105 HydrophobicContact CB-CE 4.1Å; L101-M105 HydrophobicContact CD2-CE 4.12Å; L101-M105 WeakPolarHBondContact O-CB 3.5Å; L101-M105 VanDerWaalsContact O-CG 3.24Å; L101-M105 WeakPolarHBondContact O-CG 3.41Å; L101-M105 PolarHBondContact O-N 2.92Å; Q102-M105 PolarHBondContact O-N 3.04Å; M105-S107 VanDerWaalsContact C-N 3.32Å; M105-S107 PolarHBondContact O-N 2.8Å; M105-V108 PolarHBondContact O-N 2.8Å; M105-G109 PolarHBondContact O-N 2.9Å; M105-W110 HydrophobicContact CB-CH2 4.23Å; M105-W110 HydrophobicContact CB-CZ2 3.66Å; M105-W110 HydrophobicContact SD-CH2 4.16Å; M105-W110 HydrophobicContact SD-CZ2 4.32Å; M105-Q120 PolarHBondContact O-NE2 2.8Å; M105-Y143 HydrophobicContact CE-CE2 3.91Å; M105-Y143 HydrophobicContact CG-CE2 4.41Å; M105-N167 HydrophobicContact SD-CB 4.09Å; M105-I248 HydrophobicContact SD-CD1 4.48Å; M105-I248 HydrophobicContact SD-CG2 3.72Å; M105-M250 HydrophobicContact CE-CE 3.8Å; M105-M250 HydrophobicContact CE-CG 3.6Å; M105-M250 HydrophobicContact CE-SD 3.4Å; M105-M250 WeakPolarHBondContact CE-SD 3.45Å
106	D	98.3	Very high	97.6	Very high	62 Å²	62	49.9 Å²	49.9	33%	0.332	28%	0.283	S	S	.	.	H	α-helix	trans	-64.5	-36.6	177.1	-73.9	-19.2	0	0	0	112.2	Q102 A103 T104 G109 W110 R246	Q102-D106 WeakPolarHBondContact O-CB 3.41Å; Q102-D106 VanDerWaalsContact O-CG 3.32Å; Q102-D106 PolarHBondContact O-N 3.43Å; A103-D106 PolarHBondContact O-N 3.21Å; T104-D106 VanDerWaalsContact C-N 3.33Å; T104-D106 PolarHBondContact O-N 3.02Å; D106-G109 PolarHBondContact O-N 3Å; D106-W110 PolarHBondContact OD1-NE1 3.1Å; D106-R246 IonicContact OD1-CZ 3.89Å; D106-R246 IonicContact OD1-NH1 3.12Å; D106-R246 PolarHBondContact OD1-NH1 2.78Å; D106-R246 IonicContact OD1-NH2 2.72Å; D106-R246 PolarHBondContact OD1-NH2 2.72Å; D106-R246 IonicContact OD2-CZ 2.66Å; D106-R246 IonicContact OD2-NH1 2.67Å; D106-R246 PolarHBondContact OD2-NH1 3.15Å; D106-R246 IonicContact OD2-NH2 3.29Å
107	S	98.1	Very high	97.6	Very high	98 Å²	98	44.1 Å²	44.1	69%	0.685	26%	0.257	S	S	*	.	H	α-helix	trans	-71.8	-30	176.5	72.6	0	0	0	0	113.7	A103 T104 M105 G109	A103-S107 PolarHBondContact O-N 2.83Å; T104-S107 PolarHBondContact O-N 3.32Å; T104-S107 PolarHBondContact O-OG 3.28Å; M105-S107 VanDerWaalsContact C-N 3.32Å; M105-S107 PolarHBondContact O-N 2.8Å; S107-G109 VanDerWaalsContact C-N 3.27Å; S107-G109 PolarHBondContact O-N 2.94Å
108	V	95.7	Very high	97.6	Very high	68 Å²	68	45.6 Å²	45.6	41%	0.412	26%	0.261	S	S	.	.	H	α-helix	trans	-69	-28.3	175.3	170.3	0	0	0	0	111.9	T104 M105	T104-V108 WeakPolarHBondContact O-CG2 3.39Å; T104-V108 PolarHBondContact O-N 2.85Å; T104-V108 VanDerWaalsContact O-N 3.12Å; M105-V108 PolarHBondContact O-N 2.8Å
109	G	92.9	Very high	97.6	Very high	28 Å²	28	48.9 Å²	48.9	29%	0.289	28%	0.275	S	S	.	.			trans	87.5	146.8	-178.6	0	0	0	0	0	113.7	M105 D106 S107 Q120	M105-G109 PolarHBondContact O-N 2.9Å; D106-G109 PolarHBondContact O-N 3Å; S107-G109 VanDerWaalsContact C-N 3.27Å; S107-G109 PolarHBondContact O-N 2.94Å; G109-Q120 PolarHBondContact O-NE2 3.06Å
110	W	97.6	Very high	97.6	Very high	32 Å²	32	45.3 Å²	45.3	12%	0.121	26%	0.256	C	S	.	.			trans	-107.6	138.4	-171	-70.8	99.1	0	0	0	112.1	M105 D106 R118 Q120 N167 D169 I248	M105-W110 HydrophobicContact CB-CH2 4.23Å; M105-W110 HydrophobicContact CB-CZ2 3.66Å; M105-W110 HydrophobicContact SD-CH2 4.16Å; M105-W110 HydrophobicContact SD-CZ2 4.32Å; D106-W110 PolarHBondContact OD1-NE1 3.1Å; W110-R118 HydrophobicContact CB-CB 3.81Å; W110-R118 HydrophobicContact CB-CG 4.36Å; W110-R118 HydrophobicContact CD2-CB 4.41Å; W110-R118 HydrophobicContact CE3-CB 4.11Å; W110-R118 HydrophobicContact CG-CB 4.34Å; W110-Q120 HydrophobicContact CD2-CG 4.32Å; W110-Q120 HydrophobicContact CE3-CG 3.79Å; W110-Q120 HydrophobicContact CZ3-CG 3.95Å; W110-N167 HydrophobicContact CH2-CB 3.86Å; W110-N167 HydrophobicContact CZ3-CB 3.94Å; W110-D169 HydrophobicContact CD2-CB 3.96Å; W110-D169 HydrophobicContact CE3-CB 3.65Å; W110-D169 HydrophobicContact CH2-CB 3.67Å; W110-D169 HydrophobicContact CZ2-CB 3.95Å; W110-D169 HydrophobicContact CZ3-CB 3.5Å; W110-I248 HydrophobicContact CH2-CD1 4.41Å; W110-I248 HydrophobicContact CH2-CG1 4.41Å; W110-I248 HydrophobicContact CH2-CG2 4.29Å; W110-I248 HydrophobicContact CZ2-CD1 3.94Å; W110-I248 HydrophobicContact CZ2-CG1 4.34Å
111	Q	96.9	Very high	97.5	Very high	117 Å²	117	44.5 Å²	44.5	55%	0.547	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	137.9	174.7	-62.3	-59.8	-51.5	0	0	111.2	S113 R118 K119	Q111-S113 PolarHBondContact O-N 3.33Å; Q111-R118 CarbonylContact O-C 3.6Å; Q111-R118 WeakPolarHBondContact O-CA 3.35Å; Q111-R118 WeakPolarHBondContact O-CB 3.23Å; Q111-K119 PolarHBondContact N-O 3.25Å; Q111-K119 VanDerWaalsContact N-O 3.07Å; Q111-K119 PolarHBondContact O-N 3.14Å
112	P	96.7	Very high	97.4	Very high	84 Å²	84	44.9 Å²	44.9	55%	0.545	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.1	136.5	175.5	-25.9	34.6	0	0	0	112.7	P9	P9-P112 HydrophobicContact CG-CB 4.08Å
113	S	97	Very high	97.3	Very high	16 Å²	16	42.7 Å²	42.7	11%	0.112	25%	0.245	C	C	.	.			trans	-130.8	165.6	175.5	-168.7	0	0	0	0	111.3	P9 Q111 R117	P9-S113 WeakPolarHBondContact CG-O 3.49Å; Q111-S113 PolarHBondContact O-N 3.33Å; S113-R117 CarbonylContact C-O 3.5Å; S113-R117 WeakPolarHBondContact CA-O 3.44Å; S113-R117 PolarHBondContact N-O 3.42Å; S113-R117 VanDerWaalsContact O-O 3.09Å
114	Q	96.8	Very high	97	Very high	40 Å²	40	41 Å²	41	19%	0.187	23%	0.229	C	C	.	.	S	Bend	trans	-68.2	158.2	-178.7	-47.6	-161.6	-73.5	0	0	111.1	P9 K11 R14 R117	P9-Q114 WeakPolarHBondContact O-CG 3.33Å; P9-Q114 PolarHBondContact O-NE2 3.26Å; K11-Q114 VanDerWaalsContact N-NE2 3.15Å; R14-Q114 HydrophobicContact CB-CB 4.29Å; Q114-R117 PolarHBondContact O-NE 2.92Å; Q114-R117 PolarHBondContact O-NH2 3.03Å
115	S	97.7	Very high	96.5	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.6	46.3	177.3	-54.4	0	0	0	0	113.8	C10 R14 C15 R117 S176 W177	C10-S115 PolarHBondContact SG-N 2.99Å; R14-S115 VanDerWaalsContact CB-OG 3.31Å; R14-S115 WeakPolarHBondContact CB-OG 3.49Å; C15-S115 VanDerWaalsContact O-CA 3.27Å; C15-S115 WeakPolarHBondContact O-CA 3.3Å; S115-R117 PolarHBondContact O-N 3.28Å; S115-R117 VanDerWaalsContact O-N 3.08Å; S115-S176 VanDerWaalsContact O-CA 3.22Å; S115-S176 WeakPolarHBondContact O-CA 3.25Å; S115-W177 WeakPolarHBondContact CB-O 3.4Å; S115-W177 PolarHBondContact O-N 2.88Å; S115-W177 VanDerWaalsContact O-N 3.12Å
116	G	97.4	Very high	96	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.01	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.9	-6.7	173.1	0	0	0	0	0	114.9	C16 R174 S176	C16-G116 VanDerWaalsContact CB-N 3.32Å; G116-R174 WeakPolarHBondContact O-CD 3.36Å; G116-R174 VanDerWaalsContact O-CZ 3.3Å; G116-R174 PolarHBondContact O-NE 2.66Å; G116-R174 PolarHBondContact O-NH1 3.01Å; G116-S176 PolarHBondContact O-OG 3.2Å
117	R	98.2	Very high	95.4	Very high	18 Å²	18	46.2 Å²	46.2	7%	0.068	25%	0.249	C	C	.	.			trans	-82.7	168.1	-174	-65.3	171.7	-64.9	169.2	-12.4	113.5	S113 Q114 S115 D169 Y170 R174 W177 I178	S113-R117 CarbonylContact C-O 3.5Å; S113-R117 WeakPolarHBondContact CA-O 3.44Å; S113-R117 PolarHBondContact N-O 3.42Å; S113-R117 VanDerWaalsContact O-O 3.09Å; Q114-R117 PolarHBondContact O-NE 2.92Å; Q114-R117 PolarHBondContact O-NH2 3.03Å; S115-R117 PolarHBondContact O-N 3.28Å; S115-R117 VanDerWaalsContact O-N 3.08Å; R117-D169 CarbonylContact C-O 3.54Å; R117-D169 WeakPolarHBondContact CA-O 3.27Å; R117-D169 WeakPolarHBondContact CB-O 3.33Å; R117-Y170 VanDerWaalsContact CD-CZ 3.48Å; R117-Y170 HydrophobicContact CG-CD1 3.75Å; R117-Y170 HydrophobicContact CG-CD2 4.47Å; R117-Y170 HydrophobicContact CG-CE1 3.88Å; R117-Y170 HydrophobicContact CG-CG 4.05Å; R117-R174 PolarHBondContact O-NH1 2.79Å; R117-W177 WeakPolarHBondContact CD-O 3.47Å; R117-W177 PolarHBondContact NE-O 2.93Å; R117-W177 VanDerWaalsContact NE-O 3.17Å; R117-I178 VanDerWaalsContact NH1-CG1 3.25Å
118	R	98.4	Very high	94.8	Very high	76 Å²	76	46.2 Å²	46.2	29%	0.287	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	165.2	159.2	-53.4	173.9	-73.8	-175.7	-4.4	109.2	W110 Q111 D169	W110-R118 HydrophobicContact CB-CB 3.81Å; W110-R118 HydrophobicContact CB-CG 4.36Å; W110-R118 HydrophobicContact CD2-CB 4.41Å; W110-R118 HydrophobicContact CE3-CB 4.11Å; W110-R118 HydrophobicContact CG-CB 4.34Å; Q111-R118 CarbonylContact O-C 3.6Å; Q111-R118 WeakPolarHBondContact O-CA 3.35Å; Q111-R118 WeakPolarHBondContact O-CB 3.23Å; R118-D169 HydrophobicContact CB-CB 4.22Å; R118-D169 IonicContact CZ-OD2 3.09Å; R118-D169 PolarHBondContact N-O 3.33Å; R118-D169 IonicContact NE-OD2 2.72Å; R118-D169 PolarHBondContact NE-OD2 2.88Å; R118-D169 VanDerWaalsContact NH2-CG 3.35Å; R118-D169 IonicContact NH2-OD1 3.63Å; R118-D169 PolarHBondContact NH2-OD1 2.93Å; R118-D169 IonicContact NH2-OD2 3.13Å; R118-D169 PolarHBondContact NH2-OD2 3.43Å; R118-D169 PolarHBondContact O-N 2.64Å
119	K	98.2	Very high	94.2	Very high	69 Å²	69	52.8 Å²	52.8	30%	0.3	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	158	-175.9	67.4	178.5	-175.1	146.3	0	115.2	Q111 D121 N167 L168	Q111-K119 PolarHBondContact N-O 3.25Å; Q111-K119 VanDerWaalsContact N-O 3.07Å; Q111-K119 PolarHBondContact O-N 3.14Å; K119-D121 WeakPolarHBondContact CD-OD2 3.3Å; K119-D121 VanDerWaalsContact CE-OD2 3.32Å; K119-D121 WeakPolarHBondContact CE-OD2 3.46Å; K119-D121 IonicContact NZ-OD2 3.4Å; K119-D121 PolarHBondContact NZ-OD2 2.54Å; K119-N167 CarbonylContact C-O 3.52Å; K119-N167 WeakPolarHBondContact CA-O 3.46Å; K119-L168 HydrophobicContact CB-CD2 3.59Å
120	Q	98.1	Very high	93.9	Very high	1 Å²	1	58.4 Å²	58.4	1%	0.005	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	110.8	165.4	-60.8	169.1	-19.7	0	0	109.2	M105 G109 W110 Y122 R138 S166 N167	M105-Q120 PolarHBondContact O-NE2 2.8Å; G109-Q120 PolarHBondContact O-NE2 3.06Å; W110-Q120 HydrophobicContact CD2-CG 4.32Å; W110-Q120 HydrophobicContact CE3-CG 3.79Å; W110-Q120 HydrophobicContact CZ3-CG 3.95Å; Q120-Y122 HydrophobicContact CB-CE2 3.76Å; Q120-R138 VanDerWaalsContact CA-NH2 3.32Å; Q120-S166 WeakPolarHBondContact O-CA 3.28Å; Q120-N167 HydrophobicContact CB-CB 4.17Å; Q120-N167 PolarHBondContact N-O 3.36Å; Q120-N167 PolarHBondContact O-N 3.42Å; Q120-N167 PolarHBondContact OE1-ND2 3.31Å
121	D	97.2	Very high	93.1	Very high	58 Å²	58	62.5 Å²	62.5	31%	0.31	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	135.7	177.2	-52.1	-43.7	0	0	0	111.3	K119 R138 S166	K119-D121 WeakPolarHBondContact CD-OD2 3.3Å; K119-D121 VanDerWaalsContact CE-OD2 3.32Å; K119-D121 WeakPolarHBondContact CE-OD2 3.46Å; K119-D121 IonicContact NZ-OD2 3.4Å; K119-D121 PolarHBondContact NZ-OD2 2.54Å; D121-R138 PolarHBondContact O-NE 2.6Å; D121-R138 VanDerWaalsContact O-NE 3.07Å; D121-R138 PolarHBondContact O-NH2 2.91Å; D121-S166 PolarHBondContact OD1-OG 3.41Å
122	Y	97.7	Very high	92.5	Very high	11 Å²	11	59.9 Å²	59.9	4%	0.043	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	143.9	177.2	-57.8	-92	0	0	0	109.4	Q120 R138 P139 P141 Y143 E164 L165	Q120-Y122 HydrophobicContact CB-CE2 3.76Å; Y122-R138 HydrophobicContact CD1-CB 3.69Å; Y122-R138 HydrophobicContact CE1-CB 4.25Å; Y122-P139 VanDerWaalsContact CD1-O 3.24Å; Y122-P139 WeakPolarHBondContact CD1-O 3.49Å; Y122-P141 HydrophobicContact CD1-CB 4.08Å; Y122-P141 HydrophobicContact CD1-CG 3.96Å; Y122-P141 HydrophobicContact CD2-CG 4.09Å; Y122-P141 HydrophobicContact CE1-CB 3.78Å; Y122-P141 HydrophobicContact CE1-CG 3.92Å; Y122-P141 HydrophobicContact CE2-CG 4.07Å; Y122-P141 HydrophobicContact CG-CG 4.02Å; Y122-Y143 VanDerWaalsContact CE2-OH 3.3Å; Y122-Y143 WeakPolarHBondContact CE2-OH 3.22Å; Y122-Y143 PolarHBondContact OH-OH 3.14Å; Y122-E164 WeakPolarHBondContact O-CA 3.18Å; Y122-E164 WeakPolarHBondContact O-CG 3.32Å; Y122-L165 HydrophobicContact CD2-CB 4.48Å; Y122-L165 HydrophobicContact CD2-CD2 4.15Å; Y122-L165 HydrophobicContact CD2-CG 4.23Å; Y122-L165 PolarHBondContact N-O 2.93Å; Y122-L165 PolarHBondContact O-N 2.82Å
123	G	95.2	Very high	92	Very high	9 Å²	9	57 Å²	57	9%	0.093	26%	0.26	C	S	.	.	S	Bend	trans	94.9	-166.6	-173.4	0	0	0	0	0	113.6	A136 R138 V163	G123-A136 VanDerWaalsContact C-CB 3.41Å; G123-A136 WeakPolarHBondContact O-CA 3.28Å; G123-A136 WeakPolarHBondContact O-CB 3.26Å; G123-R138 PolarHBondContact N-O 2.91Å; G123-V163 WeakPolarHBondContact CA-O 3.31Å
124	P	91.8	Very high	91.6	Very high	26 Å²	26	61.2 Å²	61.2	17%	0.169	28%	0.276	C	S	.	.			trans	-64.4	149	-169.5	25.6	-32.5	0	0	0	112.5	V133 V163 W188	P124-V133 HydrophobicContact CB-CG1 3.58Å; P124-V163 WeakPolarHBondContact CD-O 3.3Å; P124-V163 HydrophobicContact CG-CG2 4.14Å; P124-W188 HydrophobicContact CG-CH2 4.09Å; P124-W188 HydrophobicContact CG-CZ3 4.16Å
125	R	89.4	Confident	91.1	Very high	128 Å²	128	64.5 Å²	64.5	48%	0.483	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	109.9	-178.8	-66.7	-179.8	-63.2	138.2	-0.9	110.7	K134 P135	R125-K134 HydrophobicContact CB-CB 4.29Å; R125-K134 PolarHBondContact N-O 3.23Å; R125-K134 PolarHBondContact O-N 2.85Å; R125-P135 PolarHBondContact NE-O 3.26Å; R125-P135 VanDerWaalsContact NE-O 3.09Å; R125-P135 PolarHBondContact NH2-O 2.71Å
126	A	87	Confident	90.6	Very high	30 Å²	30	66.7 Å²	66.7	25%	0.248	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	138.3	178.1	0	0	0	0	0	112.4	F128 L187	A126-F128 HydrophobicContact CB-CD1 3.93Å; A126-F128 HydrophobicContact CB-CD2 4.32Å; A126-F128 HydrophobicContact CB-CE1 3.51Å; A126-F128 HydrophobicContact CB-CE2 3.93Å; A126-F128 HydrophobicContact CB-CG 4.33Å; A126-F128 HydrophobicContact CB-CZ 3.52Å; A126-L187 HydrophobicContact CB-CD2 3.39Å
127	N	85.6	Confident	90.2	Very high	60 Å²	60	75.2 Å²	75.2	32%	0.321	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	91.4	155.8	-176	-28	0	0	0	107.8	K129 K130 R131 K132	N127-K129 VanDerWaalsContact C-N 3.31Å; N127-K129 PolarHBondContact O-N 3.31Å; N127-K129 PolarHBondContact OD1-N 3.36Å; N127-K130 HydrophobicContact CB-CB 4.37Å; N127-K130 CarbonylContact O-C 3.58Å; N127-K130 PolarHBondContact O-N 3.21Å; N127-K130 PolarHBondContact OD1-N 3.46Å; N127-R131 WeakPolarHBondContact O-CA 3.36Å; N127-R131 PolarHBondContact O-N 2.68Å; N127-K132 HydrophobicContact CB-CB 4.44Å; N127-K132 PolarHBondContact N-O 2.71Å; N127-K132 PolarHBondContact O-N 2.98Å; N127-K132 VanDerWaalsContact O-N 3.11Å
128	F	85.6	Confident	90	Very high	99 Å²	99	77.7 Å²	77.7	43%	0.434	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-58.9	-40	-177	-57.6	-70.3	0	0	0	113	A126 K130 R131 D184 W186 L187	A126-F128 HydrophobicContact CB-CD1 3.93Å; A126-F128 HydrophobicContact CB-CD2 4.32Å; A126-F128 HydrophobicContact CB-CE1 3.51Å; A126-F128 HydrophobicContact CB-CE2 3.93Å; A126-F128 HydrophobicContact CB-CG 4.33Å; A126-F128 HydrophobicContact CB-CZ 3.52Å; F128-K130 VanDerWaalsContact C-N 3.32Å; F128-K130 PolarHBondContact O-N 3.13Å; F128-R131 PolarHBondContact O-N 3.45Å; F128-R131 VanDerWaalsContact O-N 3.16Å; F128-D184 HydrophobicContact CD1-CB 4.02Å; F128-D184 WeakPolarHBondContact CD1-OD2 3.47Å; F128-D184 HydrophobicContact CE1-CB 4.03Å; F128-D184 VanDerWaalsContact CE1-OD2 3.31Å; F128-D184 WeakPolarHBondContact CE1-OD2 3.37Å; F128-W186 HydrophobicContact CD1-CZ2 4.01Å; F128-L187 HydrophobicContact CE1-CD2 4.36Å
129	K	83.9	Confident	89.8	Confident	206 Å²	206	79 Å²	79	90%	0.896	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-62.8	-37.9	178.7	-176.8	173.5	-179	177.4	0	112.5	N127	N127-K129 VanDerWaalsContact C-N 3.31Å; N127-K129 PolarHBondContact O-N 3.31Å; N127-K129 PolarHBondContact OD1-N 3.36Å
130	K	85.2	Confident	89.8	Confident	146 Å²	146	78 Å²	78	64%	0.635	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-94.8	-1	178.3	-62.4	-169.1	178	-171.7	0	113	N127 F128 K132	N127-K130 HydrophobicContact CB-CB 4.37Å; N127-K130 CarbonylContact O-C 3.58Å; N127-K130 PolarHBondContact O-N 3.21Å; N127-K130 PolarHBondContact OD1-N 3.46Å; F128-K130 VanDerWaalsContact C-N 3.32Å; F128-K130 PolarHBondContact O-N 3.13Å; K130-K132 HydrophobicContact CB-CB 4.41Å; K130-K132 HydrophobicContact CB-CD 4.4Å; K130-K132 HydrophobicContact CB-CG 4.24Å; K130-K132 PolarHBondContact O-N 2.83Å
131	R	82.1	Confident	89.8	Confident	118 Å²	118	78.6 Å²	78.6	45%	0.445	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	41.6	47.2	-168.1	-60.2	-176.8	174.5	-173.3	-2.1	113	N127 F128 W186 I269	N127-R131 WeakPolarHBondContact O-CA 3.36Å; N127-R131 PolarHBondContact O-N 2.68Å; F128-R131 PolarHBondContact O-N 3.45Å; F128-R131 VanDerWaalsContact O-N 3.16Å; R131-W186 HydrophobicContact CB-CD2 4.46Å; R131-W186 HydrophobicContact CB-CH2 4.39Å; R131-W186 HydrophobicContact CB-CZ2 4.23Å; R131-W186 HydrophobicContact CG-CZ2 4.48Å; R131-I269 HydrophobicContact CB-CD1 3.31Å; R131-I269 HydrophobicContact CG-CD1 4.27Å; R131-I269 WeakPolarHBondContact O-CD1 3.28Å
132	K	83.8	Confident	89.8	Confident	61 Å²	61	82.2 Å²	82.2	27%	0.265	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	148.1	179.6	-76.4	-174.4	170.6	-158.3	0	110.8	N127 K130 E265	N127-K132 HydrophobicContact CB-CB 4.44Å; N127-K132 PolarHBondContact N-O 2.71Å; N127-K132 PolarHBondContact O-N 2.98Å; N127-K132 VanDerWaalsContact O-N 3.11Å; K130-K132 HydrophobicContact CB-CB 4.41Å; K130-K132 HydrophobicContact CB-CD 4.4Å; K130-K132 HydrophobicContact CB-CG 4.24Å; K130-K132 PolarHBondContact O-N 2.83Å; K132-E265 HydrophobicContact CD-CG 3.94Å; K132-E265 HydrophobicContact CG-CG 4.33Å; K132-E265 VanDerWaalsContact NZ-CD 3.34Å; K132-E265 IonicContact NZ-OE1 2.94Å; K132-E265 IonicContact NZ-OE2 3.3Å; K132-E265 PolarHBondContact NZ-OE2 2.89Å
133	V	86	Confident	89.8	Confident	23 Å²	23	83.8 Å²	83.8	14%	0.139	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	127.7	176.9	-173.9	0	0	0	0	109.5	P124 W186 L187 W258	P124-V133 HydrophobicContact CB-CG1 3.58Å; V133-W186 HydrophobicContact CG2-CH2 3.99Å; V133-W186 HydrophobicContact CG2-CZ3 3.79Å; V133-L187 HydrophobicContact CG2-CD1 3.46Å; V133-L187 VanDerWaalsContact CG2-CD1 3.46Å; V133-L187 HydrophobicContact CG2-CD2 4.43Å; V133-W258 HydrophobicContact CG2-CH2 4.25Å; V133-W258 HydrophobicContact CG2-CZ3 3.96Å
134	K	87.9	Confident	89.9	Confident	106 Å²	106	83.3 Å²	83.3	46%	0.461	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	153.2	172.2	-68	-173.3	176.3	-170.1	0	110.4	R125	R125-K134 HydrophobicContact CB-CB 4.29Å; R125-K134 PolarHBondContact N-O 3.23Å; R125-K134 PolarHBondContact O-N 2.85Å
135	P	86.3	Confident	90.2	Very high	108 Å²	108	85.1 Å²	85.1	70%	0.701	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-53.4	150.6	172.3	-26.7	34.7	0	0	0	113	R125	R125-P135 PolarHBondContact NE-O 3.26Å; R125-P135 VanDerWaalsContact NE-O 3.09Å; R125-P135 PolarHBondContact NH2-O 2.71Å
136	A	88	Confident	90.6	Very high	47 Å²	47	81.8 Å²	81.8	39%	0.388	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-59.7	134.5	177.6	0	0	0	0	0	110.8	G123	G123-A136 VanDerWaalsContact C-CB 3.41Å; G123-A136 WeakPolarHBondContact O-CA 3.28Å; G123-A136 WeakPolarHBondContact O-CB 3.26Å
137	K	89.8	Confident	91.1	Very high	179 Å²	179	80.4 Å²	80.4	78%	0.778	39%	0.392	S	S	*	.	S	Bend	trans	-78.9	-30.7	167.4	-174.9	178.4	177.9	-176.5	0	110.8
138	R	93.1	Very high	91.6	Very high	71 Å²	71	78.6 Å²	78.6	27%	0.268	38%	0.381	S	S	.	.	S	Bend	trans	-130	126.8	175.5	-63.3	-173.7	-67.8	-172.6	1.4	108	Q120 D121 Y122 G123	Q120-R138 VanDerWaalsContact CA-NH2 3.32Å; D121-R138 PolarHBondContact O-NE 2.6Å; D121-R138 VanDerWaalsContact O-NE 3.07Å; D121-R138 PolarHBondContact O-NH2 2.91Å; Y122-R138 HydrophobicContact CD1-CB 3.69Å; Y122-R138 HydrophobicContact CE1-CB 4.25Å; G123-R138 PolarHBondContact N-O 2.91Å
139	P	95.1	Very high	92.1	Very high	103 Å²	103	80.4 Å²	80.4	67%	0.669	39%	0.391	S	S	*	.	P	Polyproline II helix	trans	-64.3	171.4	172.3	31.6	-36	0	0	0	110.2	Y122	Y122-P139 VanDerWaalsContact CD1-O 3.24Å; Y122-P139 WeakPolarHBondContact CD1-O 3.49Å
140	L	97.1	Very high	92.7	Very high	48 Å²	48	74 Å²	74	25%	0.251	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-56.7	135.5	169.6	-67.5	178.2	0	0	0	109.6	F148 P162 L165	L140-F148 HydrophobicContact CB-CE2 4.11Å; L140-F148 HydrophobicContact CB-CZ 4.48Å; L140-F148 HydrophobicContact CD1-CE2 4.15Å; L140-F148 HydrophobicContact CD1-CZ 4.38Å; L140-F148 HydrophobicContact CD2-CZ 4.31Å; L140-P162 HydrophobicContact CD1-CB 4.05Å; L140-P162 WeakPolarHBondContact CD1-O 3.27Å; L140-L165 HydrophobicContact CD2-CB 3.92Å
141	P	97.5	Very high	93.3	Very high	14 Å²	14	67.1 Å²	67.1	9%	0.091	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-85.7	141.7	-170.6	32.9	-33.7	0	0	0	112.3	Y122 Y143 A144 L165	Y122-P141 HydrophobicContact CD1-CB 4.08Å; Y122-P141 HydrophobicContact CD1-CG 3.96Å; Y122-P141 HydrophobicContact CD2-CG 4.09Å; Y122-P141 HydrophobicContact CE1-CB 3.78Å; Y122-P141 HydrophobicContact CE1-CG 3.92Å; Y122-P141 HydrophobicContact CE2-CG 4.07Å; Y122-P141 HydrophobicContact CG-CG 4.02Å; P141-Y143 VanDerWaalsContact C-N 3.26Å; P141-Y143 HydrophobicContact CB-CD1 3.66Å; P141-Y143 HydrophobicContact CB-CE1 3.31Å; P141-Y143 HydrophobicContact CB-CG 4.43Å; P141-Y143 HydrophobicContact CG-CD1 4.15Å; P141-Y143 HydrophobicContact CG-CE1 3.54Å; P141-Y143 HydrophobicContact CG-CE2 4.05Å; P141-Y143 VanDerWaalsContact CG-CZ 3.44Å; P141-Y143 PolarHBondContact O-N 3.18Å; P141-A144 HydrophobicContact CG-CB 4.15Å; P141-A144 PolarHBondContact O-N 3.43Å; P141-L165 HydrophobicContact CG-CD2 3.65Å
142	D	97.5	Very high	93.8	Very high	134 Å²	134	65 Å²	65	72%	0.717	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-60.8	-31.9	-174.9	-66.4	-37.6	0	0	0	114.1	A144 N145	D142-A144 PolarHBondContact O-N 3.4Å; D142-A144 VanDerWaalsContact O-N 3.1Å; D142-N145 WeakPolarHBondContact CA-ND2 3.46Å; D142-N145 WeakPolarHBondContact O-CB 3.25Å; D142-N145 PolarHBondContact O-N 2.68Å; D142-N145 PolarHBondContact O-ND2 3.41Å; D142-N145 PolarHBondContact OD1-ND2 3.37Å
143	Y	97.5	Very high	94.3	Very high	43 Å²	43	67 Å²	67	17%	0.169	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-61.9	-20	178.1	70.3	-107	0	0	0	113.1	L101 T104 M105 Y122 P141 F146 N167 M250	L101-Y143 HydrophobicContact CD2-CD2 3.57Å; L101-Y143 HydrophobicContact CD2-CE2 4.07Å; T104-Y143 HydrophobicContact CG2-CD1 3.47Å; T104-Y143 VanDerWaalsContact CG2-CD1 3.47Å; T104-Y143 HydrophobicContact CG2-CE1 4.15Å; T104-Y143 HydrophobicContact CG2-CG 3.77Å; M105-Y143 HydrophobicContact CE-CE2 3.91Å; M105-Y143 HydrophobicContact CG-CE2 4.41Å; Y122-Y143 VanDerWaalsContact CE2-OH 3.3Å; Y122-Y143 WeakPolarHBondContact CE2-OH 3.22Å; Y122-Y143 PolarHBondContact OH-OH 3.14Å; P141-Y143 VanDerWaalsContact C-N 3.26Å; P141-Y143 HydrophobicContact CB-CD1 3.66Å; P141-Y143 HydrophobicContact CB-CE1 3.31Å; P141-Y143 HydrophobicContact CB-CG 4.43Å; P141-Y143 HydrophobicContact CG-CD1 4.15Å; P141-Y143 HydrophobicContact CG-CE1 3.54Å; P141-Y143 HydrophobicContact CG-CE2 4.05Å; P141-Y143 VanDerWaalsContact CG-CZ 3.44Å; P141-Y143 PolarHBondContact O-N 3.18Å; Y143-F146 VanDerWaalsContact O-CD1 3.27Å; Y143-F146 WeakPolarHBondContact O-CD1 3.24Å; Y143-F146 WeakPolarHBondContact O-CE1 3.4Å; Y143-N167 PolarHBondContact OH-ND2 2.78Å; Y143-M250 HydrophobicContact CE2-CE 3.96Å
144	A	97.8	Very high	94.6	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-93.2	-5.9	179.6	0	0	0	0	0	113	P141 D142 F146 L147 F148 L165 M250	P141-A144 HydrophobicContact CG-CB 4.15Å; P141-A144 PolarHBondContact O-N 3.43Å; D142-A144 PolarHBondContact O-N 3.4Å; D142-A144 VanDerWaalsContact O-N 3.1Å; A144-F146 VanDerWaalsContact C-N 3.28Å; A144-F146 PolarHBondContact O-N 3Å; A144-L147 WeakPolarHBondContact O-CB 3.4Å; A144-L147 PolarHBondContact O-N 3.25Å; A144-F148 HydrophobicContact CB-CE1 4.1Å; A144-F148 HydrophobicContact CB-CE2 3.84Å; A144-F148 HydrophobicContact CB-CZ 3.56Å; A144-F148 WeakPolarHBondContact O-CG 3.19Å; A144-F148 PolarHBondContact O-N 3.06Å; A144-F148 VanDerWaalsContact O-N 3.14Å; A144-L165 HydrophobicContact CB-CD2 3.87Å; A144-M250 HydrophobicContact CB-CE 3.89Å
145	N	97.6	Very high	94.8	Very high	64 Å²	64	69.2 Å²	69.2	34%	0.342	37%	0.365	S	S	.	.	H	α-helix	trans	-59.2	-37.6	-175	-74.5	-19.4	0	0	0	113	D142 L147 F148 Q149	D142-N145 WeakPolarHBondContact CA-ND2 3.46Å; D142-N145 WeakPolarHBondContact O-CB 3.25Å; D142-N145 PolarHBondContact O-N 2.68Å; D142-N145 PolarHBondContact O-ND2 3.41Å; D142-N145 PolarHBondContact OD1-ND2 3.37Å; N145-L147 VanDerWaalsContact C-N 3.27Å; N145-L147 PolarHBondContact O-N 2.77Å; N145-F148 PolarHBondContact O-N 2.83Å; N145-Q149 WeakPolarHBondContact O-CG 3.36Å; N145-Q149 PolarHBondContact O-N 2.95Å
146	F	97.6	Very high	95	Very high	57 Å²	57	66.9 Å²	66.9	25%	0.25	35%	0.35	C	S	.	.	H	α-helix	trans	-63.6	-34.8	177.5	83.8	-87.6	0	0	0	112	I93 E97 L101 Y143 A144 R150	I93-F146 HydrophobicContact CG2-CE2 4.42Å; E97-F146 HydrophobicContact CB-CE2 4.22Å; E97-F146 HydrophobicContact CB-CZ 4.01Å; E97-F146 HydrophobicContact CG-CE2 3.95Å; E97-F146 HydrophobicContact CG-CZ 4.11Å; L101-F146 HydrophobicContact CD1-CE1 4.35Å; L101-F146 HydrophobicContact CD1-CZ 3.95Å; L101-F146 HydrophobicContact CD2-CE1 3.96Å; L101-F146 HydrophobicContact CD2-CZ 4.39Å; L101-F146 HydrophobicContact CG-CE1 4.23Å; L101-F146 HydrophobicContact CG-CZ 4.24Å; Y143-F146 VanDerWaalsContact O-CD1 3.27Å; Y143-F146 WeakPolarHBondContact O-CD1 3.24Å; Y143-F146 WeakPolarHBondContact O-CE1 3.4Å; A144-F146 VanDerWaalsContact C-N 3.28Å; A144-F146 PolarHBondContact O-N 3Å; F146-R150 WeakPolarHBondContact O-CB 3.41Å; F146-R150 PolarHBondContact O-N 3.01Å
147	L	97.4	Very high	95.3	Very high	1 Å²	1	64.6 Å²	64.6	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-66.3	-48.9	174.8	-66.5	170.7	0	0	0	109.6	F92 I93 L101 A144 N145 Q149 R150 L151 M250	F92-L147 HydrophobicContact CD1-CD2 4.34Å; F92-L147 HydrophobicContact CE1-CD2 3.77Å; I93-L147 HydrophobicContact CG2-CD2 3.4Å; I93-L147 VanDerWaalsContact CG2-CD2 3.4Å; L101-L147 HydrophobicContact CD1-CD1 4.09Å; L101-L147 HydrophobicContact CD2-CD1 4.44Å; A144-L147 WeakPolarHBondContact O-CB 3.4Å; A144-L147 PolarHBondContact O-N 3.25Å; N145-L147 VanDerWaalsContact C-N 3.27Å; N145-L147 PolarHBondContact O-N 2.77Å; L147-Q149 VanDerWaalsContact C-N 3.29Å; L147-Q149 PolarHBondContact O-N 2.72Å; L147-R150 CarbonylContact O-C 3.56Å; L147-R150 WeakPolarHBondContact O-CA 3.4Å; L147-R150 PolarHBondContact O-N 2.86Å; L147-L151 WeakPolarHBondContact O-CG 3.27Å; L147-L151 PolarHBondContact O-N 2.86Å; L147-M250 HydrophobicContact CD1-CE 3.52Å; L147-M250 HydrophobicContact CD1-SD 3.36Å; L147-M250 WeakPolarHBondContact CD1-SD 3.43Å
148	F	97.3	Very high	95.4	Very high	22 Å²	22	61.7 Å²	61.7	10%	0.096	33%	0.325	C	S	.	.	H	α-helix	trans	-56	-43.6	179.5	-57.9	-27.7	0	0	0	112.2	L140 A144 N145 L151 P162 L165 I252	L140-F148 HydrophobicContact CB-CE2 4.11Å; L140-F148 HydrophobicContact CB-CZ 4.48Å; L140-F148 HydrophobicContact CD1-CE2 4.15Å; L140-F148 HydrophobicContact CD1-CZ 4.38Å; L140-F148 HydrophobicContact CD2-CZ 4.31Å; A144-F148 HydrophobicContact CB-CE1 4.1Å; A144-F148 HydrophobicContact CB-CE2 3.84Å; A144-F148 HydrophobicContact CB-CZ 3.56Å; A144-F148 WeakPolarHBondContact O-CG 3.19Å; A144-F148 PolarHBondContact O-N 3.06Å; A144-F148 VanDerWaalsContact O-N 3.14Å; N145-F148 PolarHBondContact O-N 2.83Å; F148-L151 PolarHBondContact O-N 2.8Å; F148-P162 HydrophobicContact CB-CG 3.9Å; F148-P162 HydrophobicContact CD1-CB 3.84Å; F148-P162 HydrophobicContact CD1-CG 3.59Å; F148-P162 HydrophobicContact CD2-CG 4.43Å; F148-P162 HydrophobicContact CE1-CB 3.97Å; F148-P162 HydrophobicContact CE1-CG 4.23Å; F148-P162 HydrophobicContact CG-CB 4.15Å; F148-P162 HydrophobicContact CG-CG 3.71Å; F148-P162 HydrophobicContact CZ-CB 4.37Å; F148-L165 HydrophobicContact CZ-CD2 4.36Å; F148-I252 HydrophobicContact CD1-CD1 4.11Å; F148-I252 HydrophobicContact CD1-CG2 4.37Å; F148-I252 HydrophobicContact CE1-CD1 3.88Å; F148-I252 HydrophobicContact CE1-CG1 4.15Å; F148-I252 HydrophobicContact CE1-CG2 3.98Å
149	Q	95.9	Very high	95.4	Very high	138 Å²	138	60.7 Å²	60.7	65%	0.645	34%	0.337	S	S	*	.	H	α-helix	trans	-65	-41.1	174.2	-70	173.1	-10.8	0	0	112.1	N145 L147 L151 T152	N145-Q149 WeakPolarHBondContact O-CG 3.36Å; N145-Q149 PolarHBondContact O-N 2.95Å; L147-Q149 VanDerWaalsContact C-N 3.29Å; L147-Q149 PolarHBondContact O-N 2.72Å; Q149-L151 VanDerWaalsContact C-N 3.32Å; Q149-L151 PolarHBondContact O-N 2.85Å; Q149-T152 PolarHBondContact O-N 2.99Å; Q149-T152 PolarHBondContact O-OG1 2.72Å
150	R	96.9	Very high	95.4	Very high	71 Å²	71	56.2 Å²	56.2	27%	0.268	31%	0.307	S	S	.	.	H	α-helix	trans	-66.4	-32.7	177.7	-167.9	178.8	-64.3	158.3	5.5	112.5	F92 E97 F146 L147 T152 T153	F92-R150 HydrophobicContact CE2-CB 4.3Å; F92-R150 HydrophobicContact CE2-CG 3.57Å; F92-R150 HydrophobicContact CZ-CB 3.88Å; F92-R150 HydrophobicContact CZ-CG 3.64Å; F92-R150 WeakPolarHBondContact O-CD 3.04Å; F92-R150 PolarHBondContact O-NH1 3.36Å; E97-R150 IonicContact OE1-CZ 3.87Å; E97-R150 IonicContact OE1-NH1 3.93Å; E97-R150 PolarHBondContact OE1-NH1 3.34Å; E97-R150 IonicContact OE1-NH2 2.65Å; E97-R150 PolarHBondContact OE1-NH2 2.87Å; E97-R150 IonicContact OE2-CZ 3.26Å; E97-R150 IonicContact OE2-NH1 3.67Å; E97-R150 PolarHBondContact OE2-NH1 2.88Å; E97-R150 IonicContact OE2-NH2 3.73Å; F146-R150 WeakPolarHBondContact O-CB 3.41Å; F146-R150 PolarHBondContact O-N 3.01Å; L147-R150 CarbonylContact O-C 3.56Å; L147-R150 WeakPolarHBondContact O-CA 3.4Å; L147-R150 PolarHBondContact O-N 2.86Å; R150-T152 PolarHBondContact O-N 2.87Å; R150-T153 WeakPolarHBondContact O-CB 3.49Å; R150-T153 PolarHBondContact O-N 3.12Å; R150-T153 VanDerWaalsContact O-N 3.09Å; R150-T153 PolarHBondContact O-OG1 3.34Å
151	L	96.9	Very high	95.2	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.005	32%	0.317	C	S	.	.	H	α-helix	trans	-56.3	-38.4	176.2	-63.9	-175.5	0	0	0	111.9	F92 L147 F148 Q149 T153 I154 L157 F160 V193 L223 I252	F92-L151 HydrophobicContact CE1-CD2 4.2Å; F92-L151 HydrophobicContact CZ-CD2 3.75Å; L147-L151 WeakPolarHBondContact O-CG 3.27Å; L147-L151 PolarHBondContact O-N 2.86Å; F148-L151 PolarHBondContact O-N 2.8Å; Q149-L151 VanDerWaalsContact C-N 3.32Å; Q149-L151 PolarHBondContact O-N 2.85Å; L151-T153 PolarHBondContact O-N 3.4Å; L151-I154 PolarHBondContact O-N 3.13Å; L151-I154 VanDerWaalsContact O-N 3.15Å; L151-L157 HydrophobicContact CB-CD1 4.22Å; L151-L157 HydrophobicContact CD2-CD1 3.87Å; L151-L157 VanDerWaalsContact O-CB 3.25Å; L151-L157 WeakPolarHBondContact O-CB 3.23Å; L151-F160 HydrophobicContact CD1-CD1 3.8Å; L151-F160 HydrophobicContact CD1-CE1 3.78Å; L151-V193 HydrophobicContact CD1-CG1 4.36Å; L151-V193 HydrophobicContact CD1-CG2 4.44Å; L151-V193 HydrophobicContact CD2-CG1 3.81Å; L151-L223 HydrophobicContact CD2-CD1 3.3Å; L151-I252 HydrophobicContact CD1-CD1 3.93Å
152	T	93.7	Very high	95.2	Very high	75 Å²	75	58.3 Å²	58.3	46%	0.46	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-11.6	-177.6	69.7	0	0	0	0	113.5	Q149 R150 I154	Q149-T152 PolarHBondContact O-N 2.99Å; Q149-T152 PolarHBondContact O-OG1 2.72Å; R150-T152 PolarHBondContact O-N 2.87Å; T152-I154 VanDerWaalsContact C-N 3.3Å
153	T	93.2	Very high	95.1	Very high	103 Å²	103	53.8 Å²	53.8	63%	0.632	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-8.9	174.7	72.2	0	0	0	0	113.1	R150 L151	R150-T153 WeakPolarHBondContact O-CB 3.49Å; R150-T153 PolarHBondContact O-N 3.12Å; R150-T153 VanDerWaalsContact O-N 3.09Å; R150-T153 PolarHBondContact O-OG1 3.34Å; L151-T153 PolarHBondContact O-N 3.4Å
154	I	93.4	Very high	95.1	Very high	19 Å²	19	52.6 Å²	52.6	10%	0.097	30%	0.295	C	S	.	.	S	Bend	trans	-94.5	123.3	177.1	-63	169	0	0	0	108.2	F87 V89 F92 L151 T152 C156 L157 N158 L223	F87-I154 HydrophobicContact CD1-CG2 4.22Å; F87-I154 HydrophobicContact CE1-CG2 3.43Å; F87-I154 VanDerWaalsContact CE1-CG2 3.43Å; F87-I154 HydrophobicContact CZ-CG2 3.93Å; V89-I154 HydrophobicContact CG2-CD1 4.07Å; F92-I154 HydrophobicContact CD2-CD1 4.12Å; F92-I154 HydrophobicContact CE2-CD1 3.59Å; F92-I154 HydrophobicContact CZ-CD1 4.43Å; L151-I154 PolarHBondContact O-N 3.13Å; L151-I154 VanDerWaalsContact O-N 3.15Å; T152-I154 VanDerWaalsContact C-N 3.3Å; I154-C156 VanDerWaalsContact C-N 3.33Å; I154-C156 WeakPolarHBondContact CG2-SG 3.48Å; I154-C156 PolarHBondContact O-N 3.19Å; I154-L157 HydrophobicContact CB-CB 4.15Å; I154-L157 HydrophobicContact CB-CD1 4.25Å; I154-L157 HydrophobicContact CB-CG 4.39Å; I154-L157 HydrophobicContact CD1-CD1 3.96Å; I154-L157 HydrophobicContact CG2-CB 4.37Å; I154-L157 HydrophobicContact CG2-CD1 4.33Å; I154-L157 HydrophobicContact CG2-CG 4.24Å; I154-L157 CarbonylContact O-C 3.35Å; I154-L157 WeakPolarHBondContact O-CA 3.49Å; I154-L157 PolarHBondContact O-N 3.11Å; I154-N158 PolarHBondContact O-N 2.9Å; I154-N158 VanDerWaalsContact O-N 3.11Å; I154-L223 HydrophobicContact CD1-CD1 4.42Å; I154-L223 HydrophobicContact CD1-CD2 4.28Å
155	D	91.8	Very high	95.1	Very high	155 Å²	155	52.6 Å²	52.6	83%	0.829	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-52.6	-44.8	-174.9	-67.5	-22.7	0	0	0	113.8	L157 N158	D155-L157 PolarHBondContact O-N 3.32Å; D155-N158 WeakPolarHBondContact O-CB 3.46Å; D155-N158 PolarHBondContact O-N 2.84Å; D155-N158 VanDerWaalsContact O-N 3.16Å
156	C	90.4	Very high	95.1	Very high	59 Å²	59	50 Å²	50	40%	0.399	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-70.9	-14.2	179.5	69.1	0	0	0	0	113.9	F87 I154 R191	F87-C156 VanDerWaalsContact CD1-SG 3.5Å; I154-C156 VanDerWaalsContact C-N 3.33Å; I154-C156 WeakPolarHBondContact CG2-SG 3.48Å; I154-C156 PolarHBondContact O-N 3.19Å; C156-R191 WeakPolarHBondContact O-CD 3.01Å; C156-R191 PolarHBondContact O-NH1 2.72Å
157	L	94.8	Very high	95.2	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-107.7	11.3	176.2	-65	178.9	0	0	0	112.1	L151 I154 D155 G159 F160 R191 V193 L223 C225	L151-L157 HydrophobicContact CB-CD1 4.22Å; L151-L157 HydrophobicContact CD2-CD1 3.87Å; L151-L157 VanDerWaalsContact O-CB 3.25Å; L151-L157 WeakPolarHBondContact O-CB 3.23Å; I154-L157 HydrophobicContact CB-CB 4.15Å; I154-L157 HydrophobicContact CB-CD1 4.25Å; I154-L157 HydrophobicContact CB-CG 4.39Å; I154-L157 HydrophobicContact CD1-CD1 3.96Å; I154-L157 HydrophobicContact CG2-CB 4.37Å; I154-L157 HydrophobicContact CG2-CD1 4.33Å; I154-L157 HydrophobicContact CG2-CG 4.24Å; I154-L157 CarbonylContact O-C 3.35Å; I154-L157 WeakPolarHBondContact O-CA 3.49Å; I154-L157 PolarHBondContact O-N 3.11Å; D155-L157 PolarHBondContact O-N 3.32Å; L157-G159 PolarHBondContact O-N 2.76Å; L157-F160 HydrophobicContact CB-CB 4.25Å; L157-F160 HydrophobicContact CD2-CD2 3.98Å; L157-F160 HydrophobicContact CD2-CG 4.41Å; L157-F160 WeakPolarHBondContact O-CB 3.28Å; L157-F160 PolarHBondContact O-N 2.7Å; L157-R191 HydrophobicContact CD2-CB 4.43Å; L157-V193 HydrophobicContact CD1-CG2 3.88Å; L157-V193 HydrophobicContact CD2-CG2 3.65Å; L157-V193 HydrophobicContact CG-CG2 4.45Å; L157-L223 HydrophobicContact CD1-CD2 4.44Å; L157-C225 HydrophobicContact CD2-CB 4.19Å; L157-C225 VanDerWaalsContact CD2-SG 3.56Å
158	N	91.5	Very high	95.2	Very high	118 Å²	118	48.1 Å²	48.1	63%	0.631	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	134	172.9	-172.5	17.9	0	0	0	110.2	I154 D155 F160 R191	I154-N158 PolarHBondContact O-N 2.9Å; I154-N158 VanDerWaalsContact O-N 3.11Å; D155-N158 WeakPolarHBondContact O-CB 3.46Å; D155-N158 PolarHBondContact O-N 2.84Å; D155-N158 VanDerWaalsContact O-N 3.16Å; N158-F160 PolarHBondContact O-N 3.19Å; N158-R191 PolarHBondContact O-NH1 2.82Å
159	G	91.7	Very high	95.3	Very high	50 Å²	50	47.1 Å²	47.1	52%	0.515	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.2	14	-174.7	0	0	0	0	0	115.4	L157 V161 R191	L157-G159 PolarHBondContact O-N 2.76Å; G159-V161 PolarHBondContact O-N 3.18Å; G159-R191 PolarHBondContact O-NH2 2.65Å
160	F	95.3	Very high	95.4	Very high	8 Å²	8	40.8 Å²	40.8	4%	0.035	24%	0.24	C	C	.	.			trans	-64.5	128.8	171.7	-175.1	-87.2	0	0	0	110.6	L151 L157 N158 P162 R191 V193 I252 E254	L151-F160 HydrophobicContact CD1-CD1 3.8Å; L151-F160 HydrophobicContact CD1-CE1 3.78Å; L157-F160 HydrophobicContact CB-CB 4.25Å; L157-F160 HydrophobicContact CD2-CD2 3.98Å; L157-F160 HydrophobicContact CD2-CG 4.41Å; L157-F160 WeakPolarHBondContact O-CB 3.28Å; L157-F160 PolarHBondContact O-N 2.7Å; N158-F160 PolarHBondContact O-N 3.19Å; F160-P162 HydrophobicContact CD1-CG 4Å; F160-P162 HydrophobicContact CE1-CB 4.3Å; F160-P162 HydrophobicContact CE1-CG 3.9Å; F160-R191 VanDerWaalsContact CA-NH2 3.31Å; F160-R191 HydrophobicContact CD2-CB 3.98Å; F160-R191 HydrophobicContact CE2-CB 3.93Å; F160-V193 HydrophobicContact CD2-CG2 4.4Å; F160-V193 HydrophobicContact CE2-CG2 3.87Å; F160-V193 HydrophobicContact CZ-CB 4.49Å; F160-V193 HydrophobicContact CZ-CG2 3.95Å; F160-I252 HydrophobicContact CE1-CG2 3.7Å; F160-I252 HydrophobicContact CZ-CB 4.48Å; F160-I252 HydrophobicContact CZ-CG2 4.01Å; F160-E254 HydrophobicContact CD2-CB 4.06Å; F160-E254 HydrophobicContact CD2-CG 4.22Å; F160-E254 WeakPolarHBondContact CD2-OE2 3.3Å; F160-E254 HydrophobicContact CE1-CB 4.5Å; F160-E254 HydrophobicContact CE2-CB 3.74Å; F160-E254 HydrophobicContact CE2-CG 3.91Å; F160-E254 HydrophobicContact CZ-CB 3.98Å
161	V	94.6	Very high	95.5	Very high	79 Å²	79	39.3 Å²	39.3	48%	0.479	24%	0.237	S	C	.	.			trans	-116.6	102.4	-179.2	-178.7	0	0	0	0	109.5	G159 V163 E254 P255	G159-V161 PolarHBondContact O-N 3.18Å; V161-V163 PolarHBondContact O-N 3.09Å; V161-E254 WeakPolarHBondContact O-CA 3.48Å; V161-E254 VanDerWaalsContact O-CB 3.25Å; V161-E254 WeakPolarHBondContact O-CB 3.38Å; V161-P255 VanDerWaalsContact O-CD 3.22Å; V161-P255 WeakPolarHBondContact O-CD 3.32Å
162	P	96.7	Very high	95.5	Very high	28 Å²	28	41.6 Å²	41.6	18%	0.182	25%	0.253	C	S	.	.			trans	-61.4	127.2	175.1	-19.2	31	0	0	0	110.9	L140 F148 F160 I252	L140-P162 HydrophobicContact CD1-CB 4.05Å; L140-P162 WeakPolarHBondContact CD1-O 3.27Å; F148-P162 HydrophobicContact CB-CG 3.9Å; F148-P162 HydrophobicContact CD1-CB 3.84Å; F148-P162 HydrophobicContact CD1-CG 3.59Å; F148-P162 HydrophobicContact CD2-CG 4.43Å; F148-P162 HydrophobicContact CE1-CB 3.97Å; F148-P162 HydrophobicContact CE1-CG 4.23Å; F148-P162 HydrophobicContact CG-CB 4.15Å; F148-P162 HydrophobicContact CG-CG 3.71Å; F148-P162 HydrophobicContact CZ-CB 4.37Å; F160-P162 HydrophobicContact CD1-CG 4Å; F160-P162 HydrophobicContact CE1-CB 4.3Å; F160-P162 HydrophobicContact CE1-CG 3.9Å; P162-I252 HydrophobicContact CB-CG2 3.75Å; P162-I252 HydrophobicContact CG-CG2 4.27Å
163	V	95.3	Very high	95.7	Very high	39 Å²	39	42 Å²	42	24%	0.236	26%	0.259	C	S	.	.			trans	-122.5	-26.5	172.6	72	0	0	0	0	112.3	G123 P124 V161 W188 R253 P255	G123-V163 WeakPolarHBondContact CA-O 3.31Å; P124-V163 WeakPolarHBondContact CD-O 3.3Å; P124-V163 HydrophobicContact CG-CG2 4.14Å; V161-V163 PolarHBondContact O-N 3.09Å; V163-W188 HydrophobicContact CG1-CE3 4.22Å; V163-W188 HydrophobicContact CG1-CZ3 3.87Å; V163-R253 WeakPolarHBondContact CG1-O 3.5Å; V163-R253 PolarHBondContact N-O 2.94Å; V163-P255 HydrophobicContact CB-CB 4.43Å; V163-P255 HydrophobicContact CB-CG 4.4Å; V163-P255 HydrophobicContact CG1-CB 4Å; V163-P255 HydrophobicContact CG1-CG 4.34Å
164	E	96.8	Very high	95.9	Very high	18 Å²	18	39.6 Å²	39.6	8%	0.084	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	141	178.2	-173.4	-104.6	-166.9	0	0	110	Y122 W188 I252 R253	Y122-E164 WeakPolarHBondContact O-CA 3.18Å; Y122-E164 WeakPolarHBondContact O-CG 3.32Å; E164-W188 HydrophobicContact CB-CH2 3.6Å; E164-W188 HydrophobicContact CB-CZ2 4.39Å; E164-W188 HydrophobicContact CB-CZ3 3.68Å; E164-W188 HydrophobicContact CG-CH2 3.71Å; E164-W188 HydrophobicContact CG-CZ2 4.16Å; E164-W188 HydrophobicContact CG-CZ3 4.31Å; E164-I252 WeakPolarHBondContact O-CA 3.09Å; E164-R253 HydrophobicContact CB-CB 4.38Å; E164-R253 VanDerWaalsContact CD-NH1 3.3Å; E164-R253 PolarHBondContact N-O 3.44Å; E164-R253 PolarHBondContact O-N 3.15Å; E164-R253 IonicContact OE1-NH1 3.66Å; E164-R253 PolarHBondContact OE1-NH1 2.98Å; E164-R253 VanDerWaalsContact OE1-NH1 3.12Å; E164-R253 WeakPolarHBondContact OE2-CD 3.31Å; E164-R253 WeakPolarHBondContact OE2-CG 3.28Å; E164-R253 IonicContact OE2-CZ 3.37Å; E164-R253 IonicContact OE2-NE 2.64Å; E164-R253 IonicContact OE2-NH1 3.33Å; E164-R253 PolarHBondContact OE2-NH1 3.48Å
165	L	98.3	Very high	96	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	122.8	170.6	168.4	67.6	0	0	0	108	Y122 L140 P141 A144 F148 M250 T251 I252	Y122-L165 HydrophobicContact CD2-CB 4.48Å; Y122-L165 HydrophobicContact CD2-CD2 4.15Å; Y122-L165 HydrophobicContact CD2-CG 4.23Å; Y122-L165 PolarHBondContact N-O 2.93Å; Y122-L165 PolarHBondContact O-N 2.82Å; L140-L165 HydrophobicContact CD2-CB 3.92Å; P141-L165 HydrophobicContact CG-CD2 3.65Å; A144-L165 HydrophobicContact CB-CD2 3.87Å; F148-L165 HydrophobicContact CZ-CD2 4.36Å; L165-M250 HydrophobicContact CD1-CB 3.82Å; L165-M250 HydrophobicContact CD1-CE 3.85Å; L165-M250 HydrophobicContact CD2-CE 3.79Å; L165-M250 HydrophobicContact CG-CE 4.48Å; L165-T251 WeakPolarHBondContact CA-O 3.49Å; L165-I252 HydrophobicContact CD1-CG1 3.77Å
166	S	98	Very high	96.4	Very high	9 Å²	9	32 Å²	32	6%	0.063	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	112.8	169.2	-169.9	0	0	0	0	109.5	Q120 D121 T251	Q120-S166 WeakPolarHBondContact O-CA 3.28Å; D121-S166 PolarHBondContact OD1-OG 3.41Å; S166-T251 PolarHBondContact N-O 3.29Å; S166-T251 PolarHBondContact O-N 2.94Å
167	N	98.7	Very high	96.7	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	127	165.9	-53.7	-30.4	0	0	0	108.3	M105 W110 K119 Q120 Y143 V249 M250	M105-N167 HydrophobicContact SD-CB 4.09Å; W110-N167 HydrophobicContact CH2-CB 3.86Å; W110-N167 HydrophobicContact CZ3-CB 3.94Å; K119-N167 CarbonylContact C-O 3.52Å; K119-N167 WeakPolarHBondContact CA-O 3.46Å; Q120-N167 HydrophobicContact CB-CB 4.17Å; Q120-N167 PolarHBondContact N-O 3.36Å; Q120-N167 PolarHBondContact O-N 3.42Å; Q120-N167 PolarHBondContact OE1-ND2 3.31Å; Y143-N167 PolarHBondContact OH-ND2 2.78Å; N167-V249 CarbonylContact C-O 3.53Å; N167-V249 VanDerWaalsContact CA-O 3.29Å; N167-V249 WeakPolarHBondContact CA-O 3.39Å; N167-M250 WeakPolarHBondContact OD1-CG 3.33Å
168	L	98.7	Very high	96.9	Very high	18 Å²	18	31.3 Å²	31.3	9%	0.094	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	128.1	174	-62.8	176.9	0	0	0	109.5	K119 Y170 I248 V249	K119-L168 HydrophobicContact CB-CD2 3.59Å; L168-Y170 HydrophobicContact CB-CD2 4.23Å; L168-Y170 HydrophobicContact CB-CE2 3.52Å; L168-Y170 HydrophobicContact CD1-CE2 4.3Å; L168-I248 CarbonylContact O-C 3.55Å; L168-I248 WeakPolarHBondContact O-CA 3.25Å; L168-V249 HydrophobicContact CB-CG1 3.74Å; L168-V249 HydrophobicContact CD1-CG1 4.44Å; L168-V249 HydrophobicContact CG-CG1 4.48Å; L168-V249 PolarHBondContact N-O 2.84Å; L168-V249 PolarHBondContact O-N 3.07Å
169	D	98.7	Very high	97.1	Very high	2 Å²	2	26.2 Å²	26.2	1%	0.011	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	121.3	177	172.5	87.7	0	0	0	109	W110 R117 R118 R246 I248	W110-D169 HydrophobicContact CD2-CB 3.96Å; W110-D169 HydrophobicContact CE3-CB 3.65Å; W110-D169 HydrophobicContact CH2-CB 3.67Å; W110-D169 HydrophobicContact CZ2-CB 3.95Å; W110-D169 HydrophobicContact CZ3-CB 3.5Å; R117-D169 CarbonylContact C-O 3.54Å; R117-D169 WeakPolarHBondContact CA-O 3.27Å; R117-D169 WeakPolarHBondContact CB-O 3.33Å; R118-D169 HydrophobicContact CB-CB 4.22Å; R118-D169 IonicContact CZ-OD2 3.09Å; R118-D169 PolarHBondContact N-O 3.33Å; R118-D169 IonicContact NE-OD2 2.72Å; R118-D169 PolarHBondContact NE-OD2 2.88Å; R118-D169 VanDerWaalsContact NH2-CG 3.35Å; R118-D169 IonicContact NH2-OD1 3.63Å; R118-D169 PolarHBondContact NH2-OD1 2.93Å; R118-D169 IonicContact NH2-OD2 3.13Å; R118-D169 PolarHBondContact NH2-OD2 3.43Å; R118-D169 PolarHBondContact O-N 2.64Å; D169-R246 IonicContact OD1-CZ 3.66Å; D169-R246 VanDerWaalsContact OD1-CZ 3.3Å; D169-R246 IonicContact OD1-NE 2.73Å; D169-R246 PolarHBondContact OD1-NE 3.3Å; D169-R246 IonicContact OD1-NH2 2.74Å; D169-R246 PolarHBondContact OD1-NH2 2.92Å; D169-I248 HydrophobicContact CB-CG1 4.45Å
170	Y	98.7	Very high	97.4	Very high	5 Å²	5	25.8 Å²	25.8	2%	0.02	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	145.1	178.7	-61.6	-114.3	0	0	0	108.5	R117 L168 I178 I238 I243 R246 R247 V249	R117-Y170 VanDerWaalsContact CD-CZ 3.48Å; R117-Y170 HydrophobicContact CG-CD1 3.75Å; R117-Y170 HydrophobicContact CG-CD2 4.47Å; R117-Y170 HydrophobicContact CG-CE1 3.88Å; R117-Y170 HydrophobicContact CG-CG 4.05Å; L168-Y170 HydrophobicContact CB-CD2 4.23Å; L168-Y170 HydrophobicContact CB-CE2 3.52Å; L168-Y170 HydrophobicContact CD1-CE2 4.3Å; Y170-I178 HydrophobicContact CE1-CB 4.26Å; Y170-I178 HydrophobicContact CE1-CG2 4.26Å; Y170-I238 HydrophobicContact CE1-CD1 4.41Å; Y170-I243 HydrophobicContact CD1-CD1 3.6Å; Y170-I243 HydrophobicContact CD1-CG1 3.99Å; Y170-I243 HydrophobicContact CE1-CD1 4.27Å; Y170-I243 HydrophobicContact CG-CD1 3.95Å; Y170-R246 WeakPolarHBondContact O-CA 3.49Å; Y170-R247 VanDerWaalsContact CE2-NH1 3.3Å; Y170-R247 PolarHBondContact N-O 3.1Å; Y170-R247 PolarHBondContact O-N 3.41Å; Y170-V249 HydrophobicContact CE2-CG1 3.76Å
171	D	98.1	Very high	97.4	Very high	39 Å²	39	27.5 Å²	27.5	21%	0.209	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	124.1	177.8	-168.8	-34.3	0	0	0	109.7	S173 R174 G175 S176 G245	D171-S173 PolarHBondContact O-N 3.3Å; D171-S173 VanDerWaalsContact OD1-CB 3.25Å; D171-S173 WeakPolarHBondContact OD1-CB 3.36Å; D171-S173 PolarHBondContact OD1-N 2.84Å; D171-S173 PolarHBondContact OD1-OG 3.18Å; D171-S173 PolarHBondContact OD2-OG 3.45Å; D171-R174 HydrophobicContact CB-CG 4.31Å; D171-R174 PolarHBondContact O-N 3.37Å; D171-R174 VanDerWaalsContact O-N 3.1Å; D171-G175 PolarHBondContact O-N 2.73Å; D171-S176 VanDerWaalsContact N-CB 3.34Å; D171-S176 PolarHBondContact N-OG 3.29Å; D171-S176 VanDerWaalsContact O-CB 3.3Å; D171-S176 WeakPolarHBondContact O-CB 3.29Å; D171-S176 PolarHBondContact O-N 3.08Å; D171-S176 VanDerWaalsContact O-N 3.11Å; D171-S176 PolarHBondContact O-OG 2.98Å; D171-G245 WeakPolarHBondContact CA-O 3.31Å
172	S	97.9	Very high	97.4	Very high	49 Å²	49	28.5 Å²	28.5	34%	0.343	16%	0.155	S	C	.	.	G	3₁₀ helix	trans	-63	-29.8	178.2	65.1	0	0	0	0	112.4	R174 G175 I243 G245	S172-R174 PolarHBondContact O-N 2.96Å; S172-G175 PolarHBondContact O-N 3.15Å; S172-I243 VanDerWaalsContact CB-O 3.25Å; S172-I243 WeakPolarHBondContact CB-O 3.27Å; S172-G245 PolarHBondContact N-O 3.24Å; S172-G245 WeakPolarHBondContact OG-CA 3.31Å; S172-G245 PolarHBondContact OG-N 2.86Å
173	S	97.5	Very high	97.3	Very high	84 Å²	84	27.8 Å²	27.8	59%	0.587	15%	0.149	S	C	*	.	G	3₁₀ helix	trans	-66.3	-16	175	74	0	0	0	0	113.3	L17 D171	L17-S173 WeakPolarHBondContact CD1-O 3.44Å; D171-S173 PolarHBondContact O-N 3.3Å; D171-S173 VanDerWaalsContact OD1-CB 3.25Å; D171-S173 WeakPolarHBondContact OD1-CB 3.36Å; D171-S173 PolarHBondContact OD1-N 2.84Å; D171-S173 PolarHBondContact OD1-OG 3.18Å; D171-S173 PolarHBondContact OD2-OG 3.45Å
174	R	96.4	Very high	97.1	Very high	53 Å²	53	28.6 Å²	28.6	20%	0.2	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-101.2	-1.7	171.7	-59.3	-168.7	69.4	-152.4	4.5	112.8	C16 L17 G116 R117 D171 S172 S176	C16-R174 WeakPolarHBondContact CB-O 3.47Å; L17-R174 PolarHBondContact N-O 3.1Å; G116-R174 WeakPolarHBondContact O-CD 3.36Å; G116-R174 VanDerWaalsContact O-CZ 3.3Å; G116-R174 PolarHBondContact O-NE 2.66Å; G116-R174 PolarHBondContact O-NH1 3.01Å; R117-R174 PolarHBondContact O-NH1 2.79Å; D171-R174 HydrophobicContact CB-CG 4.31Å; D171-R174 PolarHBondContact O-N 3.37Å; D171-R174 VanDerWaalsContact O-N 3.1Å; S172-R174 PolarHBondContact O-N 2.96Å; R174-S176 VanDerWaalsContact C-N 3.34Å
175	G	97.1	Very high	96.8	Very high	14 Å²	14	31 Å²	31	14%	0.144	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	52.4	-168.9	0	0	0	0	0	110.5	L17 D171 S172	L17-G175 VanDerWaalsContact CD1-N 3.34Å; D171-G175 PolarHBondContact O-N 2.73Å; S172-G175 PolarHBondContact O-N 3.15Å
176	S	98.3	Very high	96.3	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.007	18%	0.176	C	C	.	.			trans	-69.3	143.8	-179.4	-59.3	0	0	0	0	111.3	S115 G116 D171 R174 I243	S115-S176 VanDerWaalsContact O-CA 3.22Å; S115-S176 WeakPolarHBondContact O-CA 3.25Å; G116-S176 PolarHBondContact O-OG 3.2Å; D171-S176 VanDerWaalsContact N-CB 3.34Å; D171-S176 PolarHBondContact N-OG 3.29Å; D171-S176 VanDerWaalsContact O-CB 3.3Å; D171-S176 WeakPolarHBondContact O-CB 3.29Å; D171-S176 PolarHBondContact O-N 3.08Å; D171-S176 VanDerWaalsContact O-N 3.11Å; D171-S176 PolarHBondContact O-OG 2.98Å; R174-S176 VanDerWaalsContact C-N 3.34Å; S176-I243 VanDerWaalsContact O-CG1 3.28Å; S176-I243 WeakPolarHBondContact O-CG1 3.32Å
177	W	98	Very high	95.9	Very high	27 Å²	27	32.1 Å²	32.1	10%	0.102	17%	0.173	C	C	.	.			trans	-164.8	175.2	175.6	66.3	-69.8	0	0	0	109.3	C15 S115 R117 D179 I238 P240	C15-W177 PolarHBondContact O-NE1 2.88Å; S115-W177 WeakPolarHBondContact CB-O 3.4Å; S115-W177 PolarHBondContact O-N 2.88Å; S115-W177 VanDerWaalsContact O-N 3.12Å; R117-W177 WeakPolarHBondContact CD-O 3.47Å; R117-W177 PolarHBondContact NE-O 2.93Å; R117-W177 VanDerWaalsContact NE-O 3.17Å; W177-D179 HydrophobicContact CH2-CB 3.91Å; W177-D179 HydrophobicContact CZ3-CB 3.71Å; W177-I238 WeakPolarHBondContact CB-O 3.39Å; W177-P240 HydrophobicContact CB-CB 4.27Å; W177-P240 HydrophobicContact CB-CG 3.78Å; W177-P240 HydrophobicContact CD2-CG 4.25Å; W177-P240 HydrophobicContact CG-CG 3.8Å
178	I	98	Very high	95.7	Very high	16 Å²	16	32.6 Å²	32.6	8%	0.082	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	128.3	172.1	-172.2	174.1	0	0	0	109.2	R117 Y170 H181 I238	R117-I178 VanDerWaalsContact NH1-CG1 3.25Å; Y170-I178 HydrophobicContact CE1-CB 4.26Å; Y170-I178 HydrophobicContact CE1-CG2 4.26Å; I178-H181 WeakPolarHBondContact CD1-CE1 3.48Å; I178-I238 HydrophobicContact CG2-CB 3.86Å; I178-I238 HydrophobicContact CG2-CD1 4.34Å; I178-I238 HydrophobicContact CG2-CG1 3.9Å; I178-I238 VanDerWaalsContact CG2-N 3.29Å; I178-I238 PolarHBondContact N-O 3.28Å; I178-I238 PolarHBondContact O-N 3.29Å; I178-I238 VanDerWaalsContact O-N 3.13Å
179	D	96.5	Very high	95.5	Very high	11 Å²	11	32.3 Å²	32.3	6%	0.059	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	151.5	177	50.2	-61.4	0	0	0	111.5	I13 R14 W177 H181	I13-D179 HydrophobicContact CD1-CB 4.24Å; R14-D179 IonicContact CZ-OD1 2.73Å; R14-D179 IonicContact CZ-OD2 3.74Å; R14-D179 IonicContact NE-OD1 3.9Å; R14-D179 PolarHBondContact NE-OD1 3.05Å; R14-D179 IonicContact NE-OD2 3.74Å; R14-D179 PolarHBondContact NE-OD2 2.83Å; R14-D179 VanDerWaalsContact NE-OD2 3.15Å; R14-D179 IonicContact NH2-OD1 3.46Å; R14-D179 IonicContact NH2-OD2 2.78Å; R14-D179 PolarHBondContact NH2-OD2 2.76Å; W177-D179 HydrophobicContact CH2-CB 3.91Å; W177-D179 HydrophobicContact CZ3-CB 3.71Å; D179-H181 PolarHBondContact O-N 3.19Å; D179-H181 PolarHBondContact O-ND1 3.15Å
180	F	97.5	Very high	95.4	Very high	41 Å²	41	36 Å²	36	18%	0.18	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	118	173.8	-74.8	-74.4	0	0	0	110.4	F35 S204 L206 L213 K235 H236 F239	F35-F180 HydrophobicContact CE1-CE2 4.21Å; F35-F180 HydrophobicContact CE2-CE2 4.22Å; F35-F180 HydrophobicContact CZ-CD2 4.13Å; F35-F180 AromaticContact CZ-CE2 3.55Å; F35-F180 HydrophobicContact CZ-CE2 3.55Å; F35-F180 HydrophobicContact CZ-CZ 4.43Å; F180-S204 WeakPolarHBondContact CE1-O 3.31Å; F180-L206 HydrophobicContact CB-CD2 4.12Å; F180-L206 HydrophobicContact CD1-CB 3.46Å; F180-L206 VanDerWaalsContact CD1-CB 3.46Å; F180-L206 HydrophobicContact CD1-CD2 4.17Å; F180-L206 HydrophobicContact CD1-CG 4.44Å; F180-L206 HydrophobicContact CD2-CD2 3.83Å; F180-L206 HydrophobicContact CE1-CB 3.53Å; F180-L206 HydrophobicContact CE2-CD2 4.25Å; F180-L206 HydrophobicContact CG-CB 3.98Å; F180-L206 HydrophobicContact CG-CD2 3.78Å; F180-L206 HydrophobicContact CZ-CB 4.1Å; F180-L213 HydrophobicContact CZ-CD1 4.06Å; F180-K235 HydrophobicContact CB-CB 3.82Å; F180-K235 HydrophobicContact CB-CD 3.91Å; F180-K235 HydrophobicContact CD1-CB 4.27Å; F180-H236 WeakPolarHBondContact CA-O 3.44Å; F180-F239 AromaticContact CE2-CE1 3.55Å; F180-F239 HydrophobicContact CE2-CE1 3.55Å; F180-F239 HydrophobicContact CE2-CE2 4.45Å; F180-F239 AromaticContact CE2-CZ 3.49Å; F180-F239 HydrophobicContact CE2-CZ 3.49Å; F180-F239 VanDerWaalsContact CE2-CZ 3.49Å; F180-F239 AromaticContact CZ-CE1 3.97Å; F180-F239 HydrophobicContact CZ-CE1 3.97Å; F180-F239 HydrophobicContact CZ-CE2 4.05Å; F180-F239 AromaticContact CZ-CZ 3.47Å; F180-F239 HydrophobicContact CZ-CZ 3.47Å; F180-F239 VanDerWaalsContact CZ-CZ 3.47Å
181	H	96.2	Very high	95.2	Very high	44 Å²	44	37.9 Å²	37.9	20%	0.204	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	163.8	179.8	65	-62.8	0	0	0	110.9	I178 D179 D183 K235 H236	I178-H181 WeakPolarHBondContact CD1-CE1 3.48Å; D179-H181 PolarHBondContact O-N 3.19Å; D179-H181 PolarHBondContact O-ND1 3.15Å; H181-D183 IonicContact CD2-OD1 3.63Å; H181-D183 IonicContact NE2-OD1 3.88Å; H181-K235 CarbonylContact O-C 3.51Å; H181-K235 VanDerWaalsContact O-CA 3.23Å; H181-K235 WeakPolarHBondContact O-CA 3.43Å; H181-H236 AromaticContact CE1-CD2 3.81Å; H181-H236 AromaticContact CE1-CE1 3.78Å; H181-H236 AromaticContact CE1-NE2 3.34Å; H181-H236 PolarHBondContact CE1-NE2 2.79Å; H181-H236 VanDerWaalsContact CE1-NE2 3.34Å; H181-H236 PolarHBondContact N-O 3.35Å; H181-H236 VanDerWaalsContact N-O 3.11Å; H181-H236 PolarHBondContact ND1-O 2.66Å; H181-H236 AromaticContact NE2-CE1 3.64Å; H181-H236 AromaticContact NE2-NE2 3.4Å; H181-H236 PolarHBondContact NE2-NE2 2.67Å; H181-H236 PolarHBondContact O-N 2.74Å; H181-H236 PolarHBondContact O-ND1 3.29Å
182	K	94.9	Very high	95.2	Very high	101 Å²	101	36 Å²	36	44%	0.439	19%	0.193	S	C	.	.			trans	-107.9	141.7	168.2	-63.9	-173.2	-179.9	-175.4	0	108.7	V232 A233 K235	K182-V232 WeakPolarHBondContact CE-O 3.43Å; K182-V232 PolarHBondContact NZ-O 3.12Å; K182-A233 WeakPolarHBondContact CE-O 3.3Å; K182-A233 VanDerWaalsContact NZ-C 3.3Å; K182-A233 PolarHBondContact NZ-O 2.9Å; K182-K235 HydrophobicContact CG-CG 3.95Å
183	D	93.3	Very high	95.2	Very high	13 Å²	13	33.7 Å²	33.7	7%	0.07	18%	0.177	C	C	.	.			trans	-80.3	131.2	170.2	-82.5	-1.4	0	0	0	110	H181 C185 I192 R231 H236 R253	H181-D183 IonicContact CD2-OD1 3.63Å; H181-D183 IonicContact NE2-OD1 3.88Å; D183-C185 PolarHBondContact O-N 2.82Å; D183-I192 HydrophobicContact CB-CD1 3.71Å; D183-I192 WeakPolarHBondContact OD2-CD1 3.5Å; D183-R231 PolarHBondContact O-NH2 3.01Å; D183-H236 IonicContact OD1-CE1 3.52Å; D183-R253 IonicContact OD1-NH2 2.54Å; D183-R253 PolarHBondContact OD1-NH2 3.47Å; D183-R253 IonicContact OD2-CZ 3.58Å; D183-R253 IonicContact OD2-NE 2.82Å; D183-R253 PolarHBondContact OD2-NE 3.07Å; D183-R253 IonicContact OD2-NH2 2.83Å; D183-R253 PolarHBondContact OD2-NH2 3.18Å
184	D	91.5	Very high	95.3	Very high	55 Å²	55	30.3 Å²	30.3	29%	0.294	15%	0.152	S	C	.	.			trans	-55	106.7	-177.2	-75.2	-100.4	0	0	0	113.9	F128 W186 L187 W188	F128-D184 HydrophobicContact CD1-CB 4.02Å; F128-D184 WeakPolarHBondContact CD1-OD2 3.47Å; F128-D184 HydrophobicContact CE1-CB 4.03Å; F128-D184 VanDerWaalsContact CE1-OD2 3.31Å; F128-D184 WeakPolarHBondContact CE1-OD2 3.37Å; D184-W186 HydrophobicContact CB-CG 4.5Å; D184-W186 PolarHBondContact O-N 2.83Å; D184-W186 PolarHBondContact OD1-NE1 3.45Å; D184-L187 PolarHBondContact O-N 2.92Å; D184-L187 VanDerWaalsContact O-N 3.14Å; D184-W188 PolarHBondContact O-N 2.75Å
185	C	89.7	Confident	95.4	Very high	70 Å²	70	27.9 Å²	27.9	47%	0.473	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-17.4	179.8	-57.4	0	0	0	0	114	D183 L187	D183-C185 PolarHBondContact O-N 2.82Å; C185-L187 PolarHBondContact O-N 2.84Å
186	W	87.8	Confident	95.4	Very high	32 Å²	32	27.2 Å²	27.2	12%	0.121	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-27	174.1	68.9	-94.4	0	0	0	111.6	F128 R131 V133 D184 S256 W258	F128-W186 HydrophobicContact CD1-CZ2 4.01Å; R131-W186 HydrophobicContact CB-CD2 4.46Å; R131-W186 HydrophobicContact CB-CH2 4.39Å; R131-W186 HydrophobicContact CB-CZ2 4.23Å; R131-W186 HydrophobicContact CG-CZ2 4.48Å; V133-W186 HydrophobicContact CG2-CH2 3.99Å; V133-W186 HydrophobicContact CG2-CZ3 3.79Å; D184-W186 HydrophobicContact CB-CG 4.5Å; D184-W186 PolarHBondContact O-N 2.83Å; D184-W186 PolarHBondContact OD1-NE1 3.45Å; W186-S256 PolarHBondContact O-OG 3.41Å; W186-W258 HydrophobicContact CE3-CD2 4.43Å; W186-W258 AromaticContact CE3-CE3 3.74Å; W186-W258 HydrophobicContact CE3-CE3 3.74Å; W186-W258 AromaticContact CE3-CH2 3.95Å; W186-W258 HydrophobicContact CE3-CH2 3.95Å; W186-W258 AromaticContact CE3-CZ3 3.5Å; W186-W258 HydrophobicContact CE3-CZ3 3.5Å; W186-W258 VanDerWaalsContact CE3-CZ3 3.5Å; W186-W258 HydrophobicContact CZ3-CE3 4.08Å; W186-W258 AromaticContact CZ3-CH2 3.66Å; W186-W258 HydrophobicContact CZ3-CH2 3.66Å; W186-W258 AromaticContact CZ3-CZ3 3.35Å; W186-W258 HydrophobicContact CZ3-CZ3 3.35Å; W186-W258 VanDerWaalsContact O-CE3 3.31Å
187	L	91.2	Very high	95.5	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-44.7	-177.5	-177.3	56.5	0	0	0	112.5	A126 F128 V133 D184 C185 S256 W258 C259	A126-L187 HydrophobicContact CB-CD2 3.39Å; F128-L187 HydrophobicContact CE1-CD2 4.36Å; V133-L187 HydrophobicContact CG2-CD1 3.46Å; V133-L187 VanDerWaalsContact CG2-CD1 3.46Å; V133-L187 HydrophobicContact CG2-CD2 4.43Å; D184-L187 PolarHBondContact O-N 2.92Å; D184-L187 VanDerWaalsContact O-N 3.14Å; C185-L187 PolarHBondContact O-N 2.84Å; L187-S256 PolarHBondContact O-N 2.78Å; L187-S256 PolarHBondContact O-OG 3.32Å; L187-W258 HydrophobicContact CD1-CZ3 4.42Å; L187-C259 HydrophobicContact CD1-CB 4.2Å; L187-C259 WeakPolarHBondContact O-CB 3.43Å
188	W	94.5	Very high	95.5	Very high	10 Å²	10	27 Å²	27	4%	0.038	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	137.3	-175	-49	128.7	0	0	0	110.6	P124 V163 E164 D184 R253 E254	P124-W188 HydrophobicContact CG-CH2 4.09Å; P124-W188 HydrophobicContact CG-CZ3 4.16Å; V163-W188 HydrophobicContact CG1-CE3 4.22Å; V163-W188 HydrophobicContact CG1-CZ3 3.87Å; E164-W188 HydrophobicContact CB-CH2 3.6Å; E164-W188 HydrophobicContact CB-CZ2 4.39Å; E164-W188 HydrophobicContact CB-CZ3 3.68Å; E164-W188 HydrophobicContact CG-CH2 3.71Å; E164-W188 HydrophobicContact CG-CZ2 4.16Å; E164-W188 HydrophobicContact CG-CZ3 4.31Å; D184-W188 PolarHBondContact O-N 2.75Å; W188-R253 HydrophobicContact CB-CB 4.45Å; W188-R253 HydrophobicContact CD2-CB 4.07Å; W188-R253 HydrophobicContact CD2-CG 4.44Å; W188-R253 HydrophobicContact CE3-CB 3.96Å; W188-R253 HydrophobicContact CG-CB 4.31Å; W188-R253 VanDerWaalsContact CG-CD 3.48Å; W188-R253 HydrophobicContact CG-CG 4.43Å; W188-E254 CarbonylContact C-O 3.44Å; W188-E254 WeakPolarHBondContact CA-O 3.44Å
189	G	94.3	Very high	95.5	Very high	11 Å²	11	27.1 Å²	27.1	11%	0.113	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	-174.4	178.2	0	0	0	0	0	112.6	R191 R231 E254	G189-R191 PolarHBondContact O-N 3.35Å; G189-R231 PolarHBondContact O-NH1 3.21Å; G189-E254 PolarHBondContact N-O 2.76Å
190	D	95	Very high	95.6	Very high	80 Å²	80	29.3 Å²	29.3	43%	0.428	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	-40.9	-169	-174.5	46.8	0	0	0	112.3	S227 G228 R231	D190-S227 WeakPolarHBondContact O-CA 3.24Å; D190-S227 WeakPolarHBondContact OD2-CB 3.46Å; D190-G228 PolarHBondContact OD1-N 3.33Å; D190-G228 PolarHBondContact OD2-N 3.11Å; D190-R231 WeakPolarHBondContact O-CG 3.32Å
191	R	96.2	Very high	95.7	Very high	44 Å²	44	27.3 Å²	27.3	17%	0.166	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	129.9	-174.2	-57.7	168.2	-68.1	-173.9	-1.8	111.3	C156 L157 N158 G159 F160 G189 E254	C156-R191 WeakPolarHBondContact O-CD 3.01Å; C156-R191 PolarHBondContact O-NH1 2.72Å; L157-R191 HydrophobicContact CD2-CB 4.43Å; N158-R191 PolarHBondContact O-NH1 2.82Å; G159-R191 PolarHBondContact O-NH2 2.65Å; F160-R191 VanDerWaalsContact CA-NH2 3.31Å; F160-R191 HydrophobicContact CD2-CB 3.98Å; F160-R191 HydrophobicContact CE2-CB 3.93Å; G189-R191 PolarHBondContact O-N 3.35Å; R191-E254 VanDerWaalsContact CB-OE1 3.27Å; R191-E254 WeakPolarHBondContact CB-OE1 3.49Å; R191-E254 WeakPolarHBondContact CG-OE1 3.47Å; R191-E254 IonicContact CZ-OE1 3.75Å; R191-E254 IonicContact CZ-OE2 2.72Å; R191-E254 PolarHBondContact N-OE1 3.34Å; R191-E254 IonicContact NE-OE1 3.64Å; R191-E254 PolarHBondContact NE-OE1 3.04Å; R191-E254 IonicContact NE-OE2 2.7Å; R191-E254 PolarHBondContact NE-OE2 2.97Å; R191-E254 IonicContact NH2-OE1 3.56Å; R191-E254 IonicContact NH2-OE2 3.32Å; R191-E254 PolarHBondContact NH2-OE2 3.41Å
192	I	97.7	Very high	95.8	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.005	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	130.3	164.9	-62.7	173.9	0	0	0	108.3	D183 T194 C225 F226 T251	D183-I192 HydrophobicContact CB-CD1 3.71Å; D183-I192 WeakPolarHBondContact OD2-CD1 3.5Å; I192-T194 HydrophobicContact CG2-CG2 4.36Å; I192-C225 VanDerWaalsContact O-CA 3.3Å; I192-C225 WeakPolarHBondContact O-CA 3.4Å; I192-F226 HydrophobicContact CB-CD1 4.42Å; I192-F226 HydrophobicContact CB-CD2 4.36Å; I192-F226 HydrophobicContact CB-CE1 3.93Å; I192-F226 HydrophobicContact CB-CE2 3.88Å; I192-F226 HydrophobicContact CB-CZ 3.64Å; I192-F226 HydrophobicContact CD1-CE2 3.6Å; I192-F226 HydrophobicContact CD1-CZ 3.74Å; I192-F226 HydrophobicContact CG1-CE2 4.2Å; I192-F226 HydrophobicContact CG1-CZ 4.27Å; I192-F226 HydrophobicContact CG2-CE1 3.79Å; I192-F226 HydrophobicContact CG2-CE2 4.36Å; I192-F226 HydrophobicContact CG2-CZ 3.62Å; I192-F226 PolarHBondContact N-O 2.63Å; I192-F226 PolarHBondContact O-N 2.94Å; I192-T251 HydrophobicContact CG2-CG2 3.8Å
193	V	98.2	Very high	96	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	136.6	175.5	178.3	0	0	0	0	109.5	L151 L157 F160 L223 C224 C225 T251 I252	L151-V193 HydrophobicContact CD1-CG1 4.36Å; L151-V193 HydrophobicContact CD1-CG2 4.44Å; L151-V193 HydrophobicContact CD2-CG1 3.81Å; L157-V193 HydrophobicContact CD1-CG2 3.88Å; L157-V193 HydrophobicContact CD2-CG2 3.65Å; L157-V193 HydrophobicContact CG-CG2 4.45Å; F160-V193 HydrophobicContact CD2-CG2 4.4Å; F160-V193 HydrophobicContact CE2-CG2 3.87Å; F160-V193 HydrophobicContact CZ-CB 4.49Å; F160-V193 HydrophobicContact CZ-CG2 3.95Å; V193-L223 HydrophobicContact CG1-CD1 3.47Å; V193-L223 VanDerWaalsContact CG1-CD1 3.47Å; V193-L223 HydrophobicContact CG1-CD2 4.32Å; V193-L223 HydrophobicContact CG1-CG 3.81Å; V193-C224 CarbonylContact C-O 3.44Å; V193-C225 HydrophobicContact CG2-CB 4.35Å; V193-T251 CarbonylContact O-C 3.57Å; V193-T251 WeakPolarHBondContact O-CA 3.17Å; V193-I252 HydrophobicContact CB-CB 4.31Å; V193-I252 HydrophobicContact CG1-CD1 4.49Å; V193-I252 PolarHBondContact N-O 3.03Å; V193-I252 PolarHBondContact O-N 3.35Å
194	T	98.3	Very high	96.2	Very high	12 Å²	12	20.2 Å²	20.2	7%	0.074	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	128.1	171.2	63.5	0	0	0	0	109.3	I192 L223 C224 F226 V249 M250 T251	I192-T194 HydrophobicContact CG2-CG2 4.36Å; T194-L223 CarbonylContact O-C 3.49Å; T194-L223 VanDerWaalsContact O-CA 3.3Å; T194-L223 WeakPolarHBondContact O-CA 3.2Å; T194-C224 PolarHBondContact N-O 2.73Å; T194-C224 PolarHBondContact O-N 2.74Å; T194-C224 WeakPolarHBondContact OG1-CB 3.33Å; T194-C224 PolarHBondContact OG1-O 3.38Å; T194-F226 HydrophobicContact CG2-CE1 4.18Å; T194-V249 HydrophobicContact CG2-CG2 4.4Å; T194-M250 CarbonylContact C-O 3.5Å; T194-M250 VanDerWaalsContact CA-O 3.32Å; T194-M250 WeakPolarHBondContact CA-O 3.36Å; T194-T251 HydrophobicContact CG2-CG2 4.29Å
195	C	98.7	Very high	96.4	Very high	2 Å²	2	17.7 Å²	17.7	1%	0.014	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	121.6	169	-171.4	0	0	0	0	108.2	L197 V249 M250	C195-L197 HydrophobicContact CB-CD1 4.36Å; C195-L197 VanDerWaalsContact O-CD1 3.25Å; C195-L197 WeakPolarHBondContact O-CD1 3.38Å; C195-V249 VanDerWaalsContact O-CA 3.29Å; C195-V249 WeakPolarHBondContact O-CA 3.41Å; C195-V249 WeakPolarHBondContact O-CG2 3.4Å; C195-M250 HydrophobicContact CB-CB 4.18Å; C195-M250 PolarHBondContact N-O 3.44Å; C195-M250 PolarHBondContact O-N 3.36Å
196	N	98.7	Very high	96.8	Very high	1 Å²	1	14.7 Å²	14.7	1%	0.005	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	130	-175.1	-170.9	59.2	0	0	0	110.9	S199 T201 L218 K219 R221 S222 R247	N196-S199 PolarHBondContact ND2-O 2.78Å; N196-T201 WeakPolarHBondContact OD1-CG2 3.32Å; N196-L218 HydrophobicContact CB-CB 4.34Å; N196-L218 PolarHBondContact ND2-O 2.96Å; N196-K219 VanDerWaalsContact ND2-C 3.34Å; N196-K219 PolarHBondContact ND2-O 3.07Å; N196-R221 WeakPolarHBondContact O-CA 3.47Å; N196-R221 PolarHBondContact O-N 3.16Å; N196-S222 PolarHBondContact N-O 3.08Å; N196-R247 PolarHBondContact OD1-NE 3.01Å; N196-R247 PolarHBondContact OD1-NH2 3.19Å
197	L	98.8	Very high	97.2	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	154.1	-175.8	-67.9	82.3	0	0	0	111.5	I93 E98 L101 C195 S199 I248 M250	I93-L197 HydrophobicContact CD1-CD1 4.42Å; I93-L197 HydrophobicContact CD1-CD2 4.13Å; I93-L197 HydrophobicContact CD1-CG 3.83Å; E98-L197 HydrophobicContact CG-CB 4.12Å; E98-L197 HydrophobicContact CG-CD2 4.05Å; E98-L197 HydrophobicContact CG-CG 4.14Å; E98-L197 WeakPolarHBondContact OE1-CA 3.4Å; L101-L197 HydrophobicContact CB-CD2 3.88Å; L101-L197 HydrophobicContact CD1-CD2 3.89Å; C195-L197 HydrophobicContact CB-CD1 4.36Å; C195-L197 VanDerWaalsContact O-CD1 3.25Å; C195-L197 WeakPolarHBondContact O-CD1 3.38Å; L197-S199 PolarHBondContact O-N 2.83Å; L197-I248 WeakPolarHBondContact CA-O 3.44Å; L197-I248 HydrophobicContact CB-CB 4.05Å; L197-I248 WeakPolarHBondContact CB-O 3.36Å; L197-I248 PolarHBondContact N-O 2.93Å; L197-I248 PolarHBondContact O-N 3.49Å; L197-I248 VanDerWaalsContact O-N 3.08Å; L197-M250 HydrophobicContact CD1-CG 4.03Å; L197-M250 HydrophobicContact CD1-SD 4.4Å
198	L	98.6	Very high	97.3	Very high	24 Å²	24	17.1 Å²	17.1	13%	0.126	9%	0.091	C	C	.	.	S	Bend	trans	71.7	-42.2	171.8	-50.2	-174.8	0	0	0	115.8	E98 Q102 R246 I248	E98-L198 HydrophobicContact CG-CD2 4.08Å; E98-L198 PolarHBondContact OE1-N 3.01Å; Q102-L198 HydrophobicContact CB-CD2 4.24Å; Q102-L198 HydrophobicContact CG-CD1 4.22Å; Q102-L198 HydrophobicContact CG-CD2 4.25Å; L198-R246 WeakPolarHBondContact CB-O 3.36Å; L198-R246 HydrophobicContact CD1-CG 4.01Å; L198-I248 HydrophobicContact CD1-CB 4.4Å; L198-I248 HydrophobicContact CD1-CD1 3.62Å; L198-I248 HydrophobicContact CD1-CG1 3.79Å; L198-I248 HydrophobicContact CG-CD1 4.4Å; L198-I248 HydrophobicContact CG-CG1 4.47Å
199	S	98.5	Very high	97.3	Very high	17 Å²	17	25.3 Å²	25.3	12%	0.119	13%	0.13	C	C	.	.	S	Bend	trans	-142.9	154.5	178	69.4	0	0	0	0	113.3	N196 L197 V244 R246 R247	N196-S199 PolarHBondContact ND2-O 2.78Å; L197-S199 PolarHBondContact O-N 2.83Å; S199-V244 WeakPolarHBondContact CB-O 3.12Å; S199-V244 PolarHBondContact OG-O 2.75Å; S199-R246 PolarHBondContact OG-O 3Å; S199-R247 VanDerWaalsContact OG-CB 3.29Å; S199-R247 WeakPolarHBondContact OG-CB 3.48Å
200	D	98.6	Very high	97.2	Very high	57 Å²	57	28 Å²	28	31%	0.305	14%	0.144	S	C	.	.			trans	-67	150.5	171.2	-56.8	-16.5	0	0	0	109.6	I61 L65 L218 K219 R220	I61-D200 HydrophobicContact CG2-CB 3.89Å; L65-D200 HydrophobicContact CD1-CB 4.12Å; D200-L218 CarbonylContact C-O 3.49Å; D200-L218 VanDerWaalsContact CA-O 3.31Å; D200-L218 WeakPolarHBondContact CA-O 3.24Å; D200-K219 VanDerWaalsContact OD1-CA 3.28Å; D200-K219 WeakPolarHBondContact OD1-CA 3.41Å; D200-R220 PolarHBondContact OD1-N 3.17Å
201	T	98.7	Very high	97.2	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	178.4	-179.5	-167.4	0	0	0	0	110.2	N196 P217 L218 H242	N196-T201 WeakPolarHBondContact OD1-CG2 3.32Å; T201-P217 WeakPolarHBondContact O-CA 3.15Å; T201-L218 HydrophobicContact CG2-CB 3.81Å; T201-L218 HydrophobicContact CG2-CD1 4.04Å; T201-L218 HydrophobicContact CG2-CG 4.29Å; T201-L218 PolarHBondContact N-O 3.11Å; T201-L218 PolarHBondContact O-N 2.76Å; T201-H242 PolarHBondContact OG1-O 3.38Å
202	V	98.5	Very high	97.2	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	116.1	166.2	-177.4	0	0	0	0	109.5	I61 L64 Y215 P217 H242	I61-V202 HydrophobicContact CG1-CG2 4.37Å; L64-V202 HydrophobicContact CB-CG2 4.25Å; L64-V202 HydrophobicContact CD1-CB 4.38Å; L64-V202 HydrophobicContact CD1-CG1 4.1Å; L64-V202 HydrophobicContact CD1-CG2 3.65Å; V202-Y215 HydrophobicContact CG1-CD1 3.81Å; V202-Y215 HydrophobicContact CG1-CG 4.31Å; V202-P217 HydrophobicContact CG2-CB 4.44Å; V202-H242 HydrophobicContact CB-CB 4.13Å
203	L	98.2	Very high	97.2	Very high	9 Å²	9	25.7 Å²	25.7	5%	0.047	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	129.7	164.9	-179	64.1	0	0	0	107.7	F205 V216 L218 F226 H236 I238	L203-F205 HydrophobicContact CD2-CE2 3.85Å; L203-F205 HydrophobicContact CD2-CZ 3.65Å; L203-F205 HydrophobicContact CG-CE2 4.09Å; L203-F205 HydrophobicContact CG-CZ 4.21Å; L203-V216 HydrophobicContact CB-CB 4.37Å; L203-V216 PolarHBondContact N-O 2.92Å; L203-V216 WeakPolarHBondContact O-CA 3.29Å; L203-V216 VanDerWaalsContact O-CB 3.32Å; L203-V216 WeakPolarHBondContact O-CB 3.28Å; L203-V216 PolarHBondContact O-N 3.4Å; L203-L218 HydrophobicContact CB-CD1 3.89Å; L203-L218 HydrophobicContact CB-CG 4.4Å; L203-F226 HydrophobicContact CD2-CD1 4.29Å; L203-F226 HydrophobicContact CD2-CE1 4.15Å; L203-H236 HydrophobicContact CD1-CB 4.18Å; L203-I238 HydrophobicContact CD1-CG1 4.22Å
204	S	97.7	Very high	97.1	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	137.7	179.3	-58.2	0	0	0	0	110.1	F180 I214 H236 G237 F239	F180-S204 WeakPolarHBondContact CE1-O 3.31Å; S204-I214 CarbonylContact C-O 3.53Å; S204-I214 VanDerWaalsContact CA-O 3.28Å; S204-I214 WeakPolarHBondContact CA-O 3.38Å; S204-H236 CarbonylContact O-C 3.57Å; S204-H236 VanDerWaalsContact O-CA 3.24Å; S204-H236 WeakPolarHBondContact O-CA 3.22Å; S204-G237 PolarHBondContact N-O 2.91Å; S204-G237 PolarHBondContact O-N 3.36Å; S204-F239 WeakPolarHBondContact OG-CE2 3.01Å
205	F	97.4	Very high	97	Very high	2 Å²	2	25.1 Å²	25.1	1%	0.009	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	134.4	171.4	-65.4	-84.9	0	0	0	110	V86 L203 L213 I214 V216 F226 V230 F234 K235 H236	V86-F205 HydrophobicContact CG2-CE2 4.25Å; V86-F205 HydrophobicContact CG2-CZ 4.47Å; L203-F205 HydrophobicContact CD2-CE2 3.85Å; L203-F205 HydrophobicContact CD2-CZ 3.65Å; L203-F205 HydrophobicContact CG-CE2 4.09Å; L203-F205 HydrophobicContact CG-CZ 4.21Å; F205-L213 CarbonylContact O-C 3.54Å; F205-L213 WeakPolarHBondContact O-CA 3.35Å; F205-I214 HydrophobicContact CB-CB 4.27Å; F205-I214 PolarHBondContact N-O 2.88Å; F205-I214 PolarHBondContact O-N 2.86Å; F205-V216 HydrophobicContact CD2-CG2 3.72Å; F205-V216 HydrophobicContact CE2-CB 4.35Å; F205-V216 HydrophobicContact CE2-CG2 3.69Å; F205-F226 HydrophobicContact CE1-CB 4.22Å; F205-F226 HydrophobicContact CE1-CD1 4.26Å; F205-F226 AromaticContact CE1-CD2 3.74Å; F205-F226 HydrophobicContact CE1-CD2 3.74Å; F205-F226 HydrophobicContact CE1-CE2 4.1Å; F205-F226 AromaticContact CE1-CG 3.82Å; F205-F226 HydrophobicContact CE1-CG 3.82Å; F205-F226 HydrophobicContact CZ-CB 3.83Å; F205-F226 AromaticContact CZ-CD1 3.8Å; F205-F226 HydrophobicContact CZ-CD1 3.8Å; F205-F226 HydrophobicContact CZ-CD2 4.07Å; F205-F226 HydrophobicContact CZ-CE1 4.36Å; F205-F226 AromaticContact CZ-CG 3.63Å; F205-F226 HydrophobicContact CZ-CG 3.63Å; F205-V230 HydrophobicContact CD1-CG1 3.36Å; F205-V230 HydrophobicContact CD2-CG1 4.27Å; F205-V230 HydrophobicContact CE1-CG1 3.43Å; F205-V230 VanDerWaalsContact CE1-CG1 3.43Å; F205-V230 HydrophobicContact CE2-CG1 4.33Å; F205-V230 HydrophobicContact CG-CG1 3.81Å; F205-V230 HydrophobicContact CZ-CG1 3.93Å; F205-F234 HydrophobicContact CB-CB 3.97Å; F205-F234 HydrophobicContact CB-CD1 3.7Å; F205-F234 HydrophobicContact CB-CG 4.17Å; F205-F234 HydrophobicContact CD1-CB 4.1Å; F205-K235 CarbonylContact C-O 3.5Å; F205-K235 VanDerWaalsContact CA-O 3.27Å; F205-K235 WeakPolarHBondContact CA-O 3.32Å; F205-H236 HydrophobicContact CD1-CB 3.82Å; F205-H236 HydrophobicContact CE1-CB 3.77Å
206	L	96.8	Very high	96.9	Very high	7 Å²	7	25.1 Å²	25.1	4%	0.037	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	124.5	-176.1	-174.9	78.7	0	0	0	109.9	F35 Y38 F180 T212 L213 F234 K235	F35-L206 HydrophobicContact CD1-CD1 3.67Å; F35-L206 HydrophobicContact CE1-CD1 3.57Å; F35-L206 HydrophobicContact CE1-CD2 3.83Å; F35-L206 HydrophobicContact CE1-CG 4.38Å; Y38-L206 HydrophobicContact CD1-CD1 3.58Å; Y38-L206 HydrophobicContact CE1-CD1 3.25Å; Y38-L206 HydrophobicContact CE1-CG 4.05Å; F180-L206 HydrophobicContact CB-CD2 4.12Å; F180-L206 HydrophobicContact CD1-CB 3.46Å; F180-L206 VanDerWaalsContact CD1-CB 3.46Å; F180-L206 HydrophobicContact CD1-CD2 4.17Å; F180-L206 HydrophobicContact CD1-CG 4.44Å; F180-L206 HydrophobicContact CD2-CD2 3.83Å; F180-L206 HydrophobicContact CE1-CB 3.53Å; F180-L206 HydrophobicContact CE2-CD2 4.25Å; F180-L206 HydrophobicContact CG-CB 3.98Å; F180-L206 HydrophobicContact CG-CD2 3.78Å; F180-L206 HydrophobicContact CZ-CB 4.1Å; L206-T212 WeakPolarHBondContact CA-O 3.47Å; L206-L213 HydrophobicContact CD1-CB 4.36Å; L206-L213 HydrophobicContact CD1-CD1 4.14Å; L206-F234 CarbonylContact O-C 3.45Å; L206-F234 WeakPolarHBondContact O-CA 3.21Å; L206-K235 HydrophobicContact CB-CB 4.48Å; L206-K235 PolarHBondContact N-O 3.05Å; L206-K235 PolarHBondContact O-N 3.48Å
207	E	95.7	Very high	96.9	Very high	15 Å²	15	25 Å²	25	7%	0.07	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	120.3	173.2	-161.2	-59.5	117.3	0	0	107.6	E209 T210 N211 T212 A233 F234	E207-E209 VanDerWaalsContact CD-N 3.32Å; E207-E209 WeakPolarHBondContact OE1-CB 3.2Å; E207-E209 WeakPolarHBondContact OE1-CG 3.29Å; E207-E209 PolarHBondContact OE1-N 3.31Å; E207-E209 PolarHBondContact OE2-N 2.91Å; E207-E209 VanDerWaalsContact OE2-N 3.1Å; E207-T210 WeakPolarHBondContact OE2-CA 3.36Å; E207-T210 WeakPolarHBondContact OE2-CB 3.5Å; E207-T210 WeakPolarHBondContact OE2-CG2 3.44Å; E207-T210 PolarHBondContact OE2-N 2.91Å; E207-T210 PolarHBondContact OE2-OG1 2.73Å; E207-N211 WeakPolarHBondContact O-CA 3.4Å; E207-N211 PolarHBondContact O-N 2.94Å; E207-T212 PolarHBondContact N-O 2.74Å; E207-T212 PolarHBondContact O-N 3.23Å; E207-A233 HydrophobicContact CG-CB 4.28Å; E207-F234 HydrophobicContact CB-CD1 3.55Å; E207-F234 HydrophobicContact CB-CD2 4.12Å; E207-F234 HydrophobicContact CB-CE1 3.47Å; E207-F234 VanDerWaalsContact CB-CE1 3.47Å; E207-F234 HydrophobicContact CB-CE2 4.03Å; E207-F234 HydrophobicContact CB-CG 3.87Å; E207-F234 HydrophobicContact CB-CZ 3.71Å; E207-F234 HydrophobicContact CG-CD1 4.46Å; E207-F234 HydrophobicContact CG-CD2 4.16Å; E207-F234 HydrophobicContact CG-CE1 4.33Å; E207-F234 HydrophobicContact CG-CE2 4.01Å; E207-F234 HydrophobicContact CG-CG 4.36Å; E207-F234 HydrophobicContact CG-CZ 4.1Å
208	D	94.5	Very high	96.9	Very high	68 Å²	68	25.2 Å²	25.2	36%	0.364	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-31.1	-170.3	-50.6	-49.4	0	0	0	112.4	T210 N211 K235	D208-T210 VanDerWaalsContact C-N 3.32Å; D208-T210 PolarHBondContact O-N 2.9Å; D208-N211 PolarHBondContact O-N 2.97Å; D208-N211 PolarHBondContact O-OD1 2.8Å; D208-K235 IonicContact OD1-NZ 3.61Å; D208-K235 PolarHBondContact OD1-NZ 3.46Å; D208-K235 WeakPolarHBondContact OD2-CE 3.3Å; D208-K235 IonicContact OD2-NZ 2.9Å; D208-K235 PolarHBondContact OD2-NZ 3.38Å
209	E	93.2	Very high	96.9	Very high	181 Å²	181	27.6 Å²	27.6	85%	0.846	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-37	-174.1	-61.8	179.3	-178.4	0	0	111.6	E207	E207-E209 VanDerWaalsContact CD-N 3.32Å; E207-E209 WeakPolarHBondContact OE1-CB 3.2Å; E207-E209 WeakPolarHBondContact OE1-CG 3.29Å; E207-E209 PolarHBondContact OE1-N 3.31Å; E207-E209 PolarHBondContact OE2-N 2.91Å; E207-E209 VanDerWaalsContact OE2-N 3.1Å
210	T	93.3	Very high	96.8	Very high	68 Å²	68	30.3 Å²	30.3	42%	0.417	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-2.1	179.9	67.5	0	0	0	0	112.9	E207 D208 T212	E207-T210 WeakPolarHBondContact OE2-CA 3.36Å; E207-T210 WeakPolarHBondContact OE2-CB 3.5Å; E207-T210 WeakPolarHBondContact OE2-CG2 3.44Å; E207-T210 PolarHBondContact OE2-N 2.91Å; E207-T210 PolarHBondContact OE2-OG1 2.73Å; D208-T210 VanDerWaalsContact C-N 3.32Å; D208-T210 PolarHBondContact O-N 2.9Å; T210-T212 WeakPolarHBondContact OG1-CB 3.29Å; T210-T212 PolarHBondContact OG1-OG1 3.46Å
211	N	95.8	Very high	96.9	Very high	67 Å²	67	29.8 Å²	29.8	36%	0.358	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.8	56.6	-170.7	-65.8	-58.4	0	0	0	111.8	Y38 K39 E207 D208	Y38-N211 CarbonylContact C-O 3.55Å; Y38-N211 WeakPolarHBondContact CA-O 3.4Å; Y38-N211 WeakPolarHBondContact CB-O 3.41Å; Y38-N211 HydrophobicContact CD1-CB 4Å; Y38-N211 WeakPolarHBondContact CD1-O 3.4Å; Y38-N211 HydrophobicContact CD2-CB 4.17Å; Y38-N211 HydrophobicContact CE1-CB 4.15Å; Y38-N211 HydrophobicContact CE2-CB 4.33Å; Y38-N211 WeakPolarHBondContact CE2-OD1 3.45Å; Y38-N211 HydrophobicContact CG-CB 3.98Å; K39-N211 PolarHBondContact N-O 3.35Å; E207-N211 WeakPolarHBondContact O-CA 3.4Å; E207-N211 PolarHBondContact O-N 2.94Å; D208-N211 PolarHBondContact O-N 2.97Å; D208-N211 PolarHBondContact O-OD1 2.8Å
212	T	95.5	Very high	96.8	Very high	9 Å²	9	29.9 Å²	29.9	6%	0.055	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	128.8	-177.3	-61	0	0	0	0	110.8	F41 L206 E207 T210 I214 F234	F41-T212 HydrophobicContact CD2-CG2 3.79Å; F41-T212 HydrophobicContact CE2-CG2 3.8Å; L206-T212 WeakPolarHBondContact CA-O 3.47Å; E207-T212 PolarHBondContact N-O 2.74Å; E207-T212 PolarHBondContact O-N 3.23Å; T210-T212 WeakPolarHBondContact OG1-CB 3.29Å; T210-T212 PolarHBondContact OG1-OG1 3.46Å; T212-I214 HydrophobicContact CG2-CD1 4.11Å; T212-I214 HydrophobicContact CG2-CG1 3.82Å; T212-F234 HydrophobicContact CG2-CE1 4.01Å; T212-F234 HydrophobicContact CG2-CZ 4.45Å
213	L	96.7	Very high	96.8	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	123.8	174.1	175.8	61.3	0	0	0	109.3	F33 F35 Y38 K39 A40 F41 F180 F205 L206 Y215 F239	F33-L213 HydrophobicContact CZ-CD2 4.35Å; F35-L213 HydrophobicContact CB-CD2 4.03Å; F35-L213 HydrophobicContact CD2-CD2 4.16Å; F35-L213 HydrophobicContact CG-CD2 4.04Å; Y38-L213 HydrophobicContact CD1-CB 4.36Å; K39-L213 PolarHBondContact O-N 3Å; A40-L213 CarbonylContact C-O 3.58Å; A40-L213 VanDerWaalsContact CA-O 3.29Å; A40-L213 WeakPolarHBondContact CA-O 3.35Å; F41-L213 PolarHBondContact N-O 3.1Å; F180-L213 HydrophobicContact CZ-CD1 4.06Å; F205-L213 CarbonylContact O-C 3.54Å; F205-L213 WeakPolarHBondContact O-CA 3.35Å; L206-L213 HydrophobicContact CD1-CB 4.36Å; L206-L213 HydrophobicContact CD1-CD1 4.14Å; L213-Y215 HydrophobicContact CD2-CE1 4.2Å; L213-Y215 HydrophobicContact CD2-CE2 4.1Å; L213-Y215 VanDerWaalsContact CD2-OH 3.26Å; L213-Y215 WeakPolarHBondContact CD2-OH 3.43Å; L213-Y215 HydrophobicContact CG-CE1 4.43Å; L213-Y215 HydrophobicContact CG-CE2 4.29Å; L213-F239 HydrophobicContact CD1-CE2 4.48Å; L213-F239 HydrophobicContact CD1-CZ 4.47Å
214	I	96	Very high	96.7	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.005	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	120.6	-178.2	-49.8	178.8	0	0	0	108.6	F41 A51 V83 S204 F205 T212 V216 F234	F41-I214 HydrophobicContact CB-CG1 4.3Å; F41-I214 HydrophobicContact CB-CG2 4.43Å; F41-I214 HydrophobicContact CD2-CG1 4.49Å; F41-I214 CarbonylContact O-C 3.39Å; F41-I214 WeakPolarHBondContact O-CA 3.45Å; A51-I214 HydrophobicContact CB-CG2 3.98Å; V83-I214 HydrophobicContact CG1-CD1 3.51Å; V83-I214 HydrophobicContact CG1-CG2 4.31Å; S204-I214 CarbonylContact C-O 3.53Å; S204-I214 VanDerWaalsContact CA-O 3.28Å; S204-I214 WeakPolarHBondContact CA-O 3.38Å; F205-I214 HydrophobicContact CB-CB 4.27Å; F205-I214 PolarHBondContact N-O 2.88Å; F205-I214 PolarHBondContact O-N 2.86Å; T212-I214 HydrophobicContact CG2-CD1 4.11Å; T212-I214 HydrophobicContact CG2-CG1 3.82Å; I214-V216 HydrophobicContact CG2-CG2 4.35Å; I214-F234 HydrophobicContact CD1-CD1 4.29Å; I214-F234 HydrophobicContact CD1-CE1 3.54Å; I214-F234 HydrophobicContact CD1-CZ 4.05Å; I214-F234 HydrophobicContact CG1-CE1 4.12Å
215	Y	97.3	Very high	96.7	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	133.3	172.5	-62.4	-70.6	0	0	0	110.1	A40 F41 I42 L43 L54 K57 Y59 L64 V202 L213 F239 H242	A40-Y215 HydrophobicContact CB-CE2 4.32Å; F41-Y215 WeakPolarHBondContact O-CD2 3.37Å; F41-Y215 PolarHBondContact O-N 3.33Å; I42-Y215 WeakPolarHBondContact CD1-O 3.48Å; L43-Y215 PolarHBondContact N-O 2.9Å; L54-Y215 HydrophobicContact CD1-CD2 4.09Å; K57-Y215 PolarHBondContact O-OH 2.92Å; Y59-Y215 HydrophobicContact CD2-CE2 4.46Å; L64-Y215 HydrophobicContact CD1-CD1 4.22Å; L64-Y215 HydrophobicContact CD1-CG 4.32Å; L64-Y215 HydrophobicContact CD2-CD2 4.1Å; L64-Y215 HydrophobicContact CD2-CG 4.06Å; V202-Y215 HydrophobicContact CG1-CD1 3.81Å; V202-Y215 HydrophobicContact CG1-CG 4.31Å; L213-Y215 HydrophobicContact CD2-CE1 4.2Å; L213-Y215 HydrophobicContact CD2-CE2 4.1Å; L213-Y215 VanDerWaalsContact CD2-OH 3.26Å; L213-Y215 WeakPolarHBondContact CD2-OH 3.43Å; L213-Y215 HydrophobicContact CG-CE1 4.43Å; L213-Y215 HydrophobicContact CG-CE2 4.29Å; Y215-F239 HydrophobicContact CE1-CD2 4.26Å; Y215-F239 AromaticContact CE1-CE2 3.82Å; Y215-F239 HydrophobicContact CE1-CE2 3.82Å; Y215-H242 AromaticContact CE1-CE1 3.99Å
216	V	97.1	Very high	96.6	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.006	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	92.3	176	-179.1	0	0	0	0	107.9	L43 V86 L88 L203 F205 I214 L218	L43-V216 HydrophobicContact CB-CG2 4Å; L43-V216 HydrophobicContact CD2-CG1 3.72Å; L43-V216 HydrophobicContact CD2-CG2 4.25Å; V86-V216 HydrophobicContact CG1-CG1 4.31Å; V86-V216 HydrophobicContact CG1-CG2 4.46Å; L88-V216 HydrophobicContact CD1-CG1 4.2Å; L88-V216 HydrophobicContact CD2-CG1 4.01Å; L203-V216 HydrophobicContact CB-CB 4.37Å; L203-V216 PolarHBondContact N-O 2.92Å; L203-V216 WeakPolarHBondContact O-CA 3.29Å; L203-V216 VanDerWaalsContact O-CB 3.32Å; L203-V216 WeakPolarHBondContact O-CB 3.28Å; L203-V216 PolarHBondContact O-N 3.4Å; F205-V216 HydrophobicContact CD2-CG2 3.72Å; F205-V216 HydrophobicContact CE2-CB 4.35Å; F205-V216 HydrophobicContact CE2-CG2 3.69Å; I214-V216 HydrophobicContact CG2-CG2 4.35Å; V216-L218 HydrophobicContact CG1-CD2 3.9Å
217	P	98	Very high	96.5	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	136.9	174.8	-18.2	31.4	0	0	0	109.9	I42 L64 L65 Q68 T201 V202	I42-P217 HydrophobicContact CD1-CG 3.48Å; I42-P217 VanDerWaalsContact CD1-CG 3.48Å; L64-P217 HydrophobicContact CB-CG 3.89Å; L64-P217 WeakPolarHBondContact O-CG 3.5Å; L65-P217 HydrophobicContact CD2-CB 3.66Å; L65-P217 HydrophobicContact CG-CB 4.1Å; Q68-P217 HydrophobicContact CB-CG 4Å; Q68-P217 PolarHBondContact NE2-O 2.7Å; T201-P217 WeakPolarHBondContact O-CA 3.15Å; V202-P217 HydrophobicContact CG2-CB 4.44Å
218	L	98.2	Very high	96.4	Very high	3 Å²	3	31 Å²	31	2%	0.016	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	116.8	179.5	-56.1	179.4	0	0	0	107.7	L88 N196 D200 T201 L203 V216 C224	L88-L218 HydrophobicContact CD1-CD2 4.48Å; L88-L218 HydrophobicContact CD2-CD2 3.45Å; L88-L218 VanDerWaalsContact CD2-CD2 3.45Å; N196-L218 HydrophobicContact CB-CB 4.34Å; N196-L218 PolarHBondContact ND2-O 2.96Å; D200-L218 CarbonylContact C-O 3.49Å; D200-L218 VanDerWaalsContact CA-O 3.31Å; D200-L218 WeakPolarHBondContact CA-O 3.24Å; T201-L218 HydrophobicContact CG2-CB 3.81Å; T201-L218 HydrophobicContact CG2-CD1 4.04Å; T201-L218 HydrophobicContact CG2-CG 4.29Å; T201-L218 PolarHBondContact N-O 3.11Å; T201-L218 PolarHBondContact O-N 2.76Å; L203-L218 HydrophobicContact CB-CD1 3.89Å; L203-L218 HydrophobicContact CB-CG 4.4Å; V216-L218 HydrophobicContact CG1-CD2 3.9Å; L218-C224 HydrophobicContact CD1-CB 4.29Å; L218-C224 HydrophobicContact CD2-CB 3.61Å
219	K	98.3	Very high	96.3	Very high	74 Å²	74	32.9 Å²	32.9	32%	0.322	17%	0.168	S	C	.	.			trans	-67.9	155.6	169.6	-65.4	175.4	-169.8	155.6	0	109.9	L65 D90 N196 D200 S222	L65-K219 HydrophobicContact CD2-CG 3.83Å; D90-K219 IonicContact OD2-NZ 2.7Å; D90-K219 PolarHBondContact OD2-NZ 2.79Å; N196-K219 VanDerWaalsContact ND2-C 3.34Å; N196-K219 PolarHBondContact ND2-O 3.07Å; D200-K219 VanDerWaalsContact OD1-CA 3.28Å; D200-K219 WeakPolarHBondContact OD1-CA 3.41Å; K219-S222 VanDerWaalsContact O-CB 3.29Å; K219-S222 WeakPolarHBondContact O-CB 3.13Å; K219-S222 PolarHBondContact O-N 3.43Å; K219-S222 PolarHBondContact O-OG 2.91Å
220	R	98.4	Very high	96.2	Very high	75 Å²	75	24.3 Å²	24.3	28%	0.283	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	148.6	165.1	67.8	-178.4	-67.7	-178	-0.6	109.7	E98 D200 S222	E98-R220 IonicContact OE1-CZ 3.46Å; E98-R220 IonicContact OE1-NE 3.69Å; E98-R220 PolarHBondContact OE1-NE 3.12Å; E98-R220 IonicContact OE1-NH2 3.93Å; E98-R220 IonicContact OE2-CZ 3.41Å; E98-R220 IonicContact OE2-NE 2.83Å; E98-R220 PolarHBondContact OE2-NE 2.98Å; E98-R220 IonicContact OE2-NH2 2.82Å; E98-R220 PolarHBondContact OE2-NH2 3.14Å; D200-R220 PolarHBondContact OD1-N 3.17Å; R220-S222 PolarHBondContact O-N 2.96Å
221	R	98.7	Very high	96.3	Very high	46 Å²	46	21.4 Å²	21.4	17%	0.174	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.8	9.7	-175.1	-52.3	-177.8	-58.2	-82.7	-13.8	115.6	N91 F92 I93 E98 N196	N91-R221 CarbonylContact C-O 3.6Å; N91-R221 PolarHBondContact OD1-NH2 2.64Å; F92-R221 PolarHBondContact N-O 3.41Å; I93-R221 HydrophobicContact CD1-CB 4.32Å; I93-R221 HydrophobicContact CD1-CG 4.24Å; I93-R221 HydrophobicContact CG1-CB 3.53Å; I93-R221 HydrophobicContact CG1-CG 3.8Å; I93-R221 PolarHBondContact N-O 3.26Å; I93-R221 WeakPolarHBondContact O-CB 3.49Å; I93-R221 WeakPolarHBondContact O-CD 3.38Å; E98-R221 HydrophobicContact CB-CG 4.16Å; E98-R221 VanDerWaalsContact CD-CG 3.42Å; E98-R221 HydrophobicContact CG-CG 4.22Å; E98-R221 VanDerWaalsContact OE1-CG 3.3Å; E98-R221 WeakPolarHBondContact OE1-CG 3.27Å; E98-R221 IonicContact OE2-NH1 2.79Å; N196-R221 WeakPolarHBondContact O-CA 3.47Å; N196-R221 PolarHBondContact O-N 3.16Å
222	S	98.3	Very high	96.1	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.014	12%	0.117	C	C	.	.			trans	-85.6	158	174.6	66.6	0	0	0	0	112	V89 N196 K219 R220	V89-S222 CarbonylContact O-C 3.6Å; V89-S222 WeakPolarHBondContact O-CA 3.48Å; V89-S222 WeakPolarHBondContact O-CB 3.27Å; N196-S222 PolarHBondContact N-O 3.08Å; K219-S222 VanDerWaalsContact O-CB 3.29Å; K219-S222 WeakPolarHBondContact O-CB 3.13Å; K219-S222 PolarHBondContact O-N 3.43Å; K219-S222 PolarHBondContact O-OG 2.91Å; R220-S222 PolarHBondContact O-N 2.96Å
223	L	97.9	Very high	96	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	139.5	166.9	175.2	148.8	0	0	0	109.8	L88 V89 F92 L151 I154 L157 V193 T194 C225	L88-L223 CarbonylContact C-O 3.5Å; L88-L223 WeakPolarHBondContact CA-O 3.4Å; V89-L223 HydrophobicContact CB-CB 4.32Å; V89-L223 HydrophobicContact CG2-CD2 4.23Å; V89-L223 PolarHBondContact N-O 2.87Å; V89-L223 PolarHBondContact O-N 3.43Å; F92-L223 HydrophobicContact CB-CB 3.68Å; F92-L223 HydrophobicContact CD1-CB 3.7Å; F92-L223 HydrophobicContact CD1-CD1 3.65Å; F92-L223 HydrophobicContact CD1-CG 4.34Å; F92-L223 HydrophobicContact CD2-CB 4.07Å; F92-L223 HydrophobicContact CD2-CD1 4.05Å; F92-L223 HydrophobicContact CE1-CB 4.39Å; F92-L223 HydrophobicContact CE1-CD1 3.44Å; F92-L223 VanDerWaalsContact CE1-CD1 3.44Å; F92-L223 HydrophobicContact CE2-CD1 3.86Å; F92-L223 HydrophobicContact CG-CB 3.52Å; F92-L223 HydrophobicContact CG-CD1 3.95Å; F92-L223 HydrophobicContact CG-CG 4.38Å; F92-L223 HydrophobicContact CZ-CD1 3.57Å; L151-L223 HydrophobicContact CD2-CD1 3.3Å; I154-L223 HydrophobicContact CD1-CD1 4.42Å; I154-L223 HydrophobicContact CD1-CD2 4.28Å; L157-L223 HydrophobicContact CD1-CD2 4.44Å; V193-L223 HydrophobicContact CG1-CD1 3.47Å; V193-L223 VanDerWaalsContact CG1-CD1 3.47Å; V193-L223 HydrophobicContact CG1-CD2 4.32Å; V193-L223 HydrophobicContact CG1-CG 3.81Å; T194-L223 CarbonylContact O-C 3.49Å; T194-L223 VanDerWaalsContact O-CA 3.3Å; T194-L223 WeakPolarHBondContact O-CA 3.2Å; L223-C225 HydrophobicContact CD2-CB 4.41Å
224	C	96.8	Very high	95.9	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.007	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	124.6	168.7	173.7	0	0	0	0	109.4	F87 L88 V193 T194 L218	F87-C224 CarbonylContact O-C 3.57Å; F87-C224 WeakPolarHBondContact O-CA 3.22Å; L88-C224 HydrophobicContact CD2-CB 3.42Å; L88-C224 VanDerWaalsContact CD2-CB 3.42Å; V193-C224 CarbonylContact C-O 3.44Å; T194-C224 PolarHBondContact N-O 2.73Å; T194-C224 PolarHBondContact O-N 2.74Å; T194-C224 WeakPolarHBondContact OG1-CB 3.33Å; T194-C224 PolarHBondContact OG1-O 3.38Å; L218-C224 HydrophobicContact CD1-CB 4.29Å; L218-C224 HydrophobicContact CD2-CB 3.61Å
225	C	96.6	Very high	96	Very high	4 Å²	4	26.1 Å²	26.1	3%	0.027	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	132.7	167.7	174.2	0	0	0	0	108.9	V86 F87 L157 I192 V193 L223	V86-C225 WeakPolarHBondContact CA-O 3.34Å; F87-C225 HydrophobicContact CB-CB 4.36Å; F87-C225 PolarHBondContact N-O 3.45Å; F87-C225 PolarHBondContact O-N 2.82Å; L157-C225 HydrophobicContact CD2-CB 4.19Å; L157-C225 VanDerWaalsContact CD2-SG 3.56Å; I192-C225 VanDerWaalsContact O-CA 3.3Å; I192-C225 WeakPolarHBondContact O-CA 3.4Å; V193-C225 HydrophobicContact CG2-CB 4.35Å; L223-C225 HydrophobicContact CD2-CB 4.41Å
226	F	95.8	Very high	96	Very high	1 Å²	1	27 Å²	27	0%	0.004	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	140.2	168.7	59.9	-86.1	0	0	0	111.7	S85 V86 I192 T194 L203 F205 V230 R231	S85-F226 CarbonylContact O-C 3.58Å; S85-F226 WeakPolarHBondContact O-CA 3.46Å; V86-F226 HydrophobicContact CG2-CB 4.21Å; I192-F226 HydrophobicContact CB-CD1 4.42Å; I192-F226 HydrophobicContact CB-CD2 4.36Å; I192-F226 HydrophobicContact CB-CE1 3.93Å; I192-F226 HydrophobicContact CB-CE2 3.88Å; I192-F226 HydrophobicContact CB-CZ 3.64Å; I192-F226 HydrophobicContact CD1-CE2 3.6Å; I192-F226 HydrophobicContact CD1-CZ 3.74Å; I192-F226 HydrophobicContact CG1-CE2 4.2Å; I192-F226 HydrophobicContact CG1-CZ 4.27Å; I192-F226 HydrophobicContact CG2-CE1 3.79Å; I192-F226 HydrophobicContact CG2-CE2 4.36Å; I192-F226 HydrophobicContact CG2-CZ 3.62Å; I192-F226 PolarHBondContact N-O 2.63Å; I192-F226 PolarHBondContact O-N 2.94Å; T194-F226 HydrophobicContact CG2-CE1 4.18Å; L203-F226 HydrophobicContact CD2-CD1 4.29Å; L203-F226 HydrophobicContact CD2-CE1 4.15Å; F205-F226 HydrophobicContact CE1-CB 4.22Å; F205-F226 HydrophobicContact CE1-CD1 4.26Å; F205-F226 AromaticContact CE1-CD2 3.74Å; F205-F226 HydrophobicContact CE1-CD2 3.74Å; F205-F226 HydrophobicContact CE1-CE2 4.1Å; F205-F226 AromaticContact CE1-CG 3.82Å; F205-F226 HydrophobicContact CE1-CG 3.82Å; F205-F226 HydrophobicContact CZ-CB 3.83Å; F205-F226 AromaticContact CZ-CD1 3.8Å; F205-F226 HydrophobicContact CZ-CD1 3.8Å; F205-F226 HydrophobicContact CZ-CD2 4.07Å; F205-F226 HydrophobicContact CZ-CE1 4.36Å; F205-F226 AromaticContact CZ-CG 3.63Å; F205-F226 HydrophobicContact CZ-CG 3.63Å; F226-V230 HydrophobicContact CB-CG1 4.47Å; F226-R231 HydrophobicContact CD2-CB 4.43Å
227	S	95.2	Very high	96	Very high	26 Å²	26	26.9 Å²	26.9	18%	0.182	14%	0.141	C	C	.	.			trans	-148.4	-171.3	-173	66.1	0	0	0	0	111.9	S85 D190 V230 R231	S85-S227 WeakPolarHBondContact CB-O 3.06Å; S85-S227 PolarHBondContact O-N 3.17Å; S85-S227 PolarHBondContact OG-O 3.06Å; D190-S227 WeakPolarHBondContact O-CA 3.24Å; D190-S227 WeakPolarHBondContact OD2-CB 3.46Å; S227-V230 PolarHBondContact O-N 3.31Å; S227-R231 VanDerWaalsContact C-CB 3.48Å; S227-R231 PolarHBondContact O-N 3.09Å
228	G	93	Very high	96	Very high	24 Å²	24	27.1 Å²	27.1	25%	0.247	14%	0.143	C	C	.	.	H	α-helix	trans	53.3	-136.5	169	0	0	0	0	0	114	D190 V230 R231 V232	D190-G228 PolarHBondContact OD1-N 3.33Å; D190-G228 PolarHBondContact OD2-N 3.11Å; G228-V230 VanDerWaalsContact C-N 3.33Å; G228-V230 PolarHBondContact O-N 2.7Å; G228-R231 WeakPolarHBondContact O-CB 3.39Å; G228-R231 PolarHBondContact O-N 3.37Å; G228-R231 VanDerWaalsContact O-N 3.1Å; G228-V232 WeakPolarHBondContact O-CG2 3.39Å; G228-V232 PolarHBondContact O-N 3.19Å
229	N	91.4	Very high	96	Very high	107 Å²	107	27.8 Å²	27.8	57%	0.572	15%	0.145	S	C	*	.	H	α-helix	trans	-60.1	-40.7	-175.9	-172.8	53.8	0	0	0	112.8	R231 V232 A233	N229-R231 VanDerWaalsContact C-N 3.3Å; N229-R231 PolarHBondContact O-N 3.2Å; N229-V232 PolarHBondContact O-N 3.43Å; N229-A233 VanDerWaalsContact O-CB 3.31Å; N229-A233 WeakPolarHBondContact O-CB 3.25Å; N229-A233 PolarHBondContact O-N 3.33Å
230	V	92.9	Very high	95.9	Very high	2 Å²	2	26.7 Å²	26.7	1%	0.012	15%	0.146	C	C	.	.	H	α-helix	trans	-60.9	-42.3	176.7	174.5	0	0	0	0	110.8	V83 S85 V86 F205 F226 S227 G228 V232 F234	V83-V230 HydrophobicContact CG1-CG2 4.46Å; S85-V230 WeakPolarHBondContact OG-CB 3.41Å; S85-V230 WeakPolarHBondContact OG-CG2 3.37Å; S85-V230 PolarHBondContact OG-N 3.27Å; V86-V230 HydrophobicContact CG2-CB 4.12Å; V86-V230 HydrophobicContact CG2-CG1 3.8Å; V86-V230 HydrophobicContact CG2-CG2 3.96Å; F205-V230 HydrophobicContact CD1-CG1 3.36Å; F205-V230 HydrophobicContact CD2-CG1 4.27Å; F205-V230 HydrophobicContact CE1-CG1 3.43Å; F205-V230 VanDerWaalsContact CE1-CG1 3.43Å; F205-V230 HydrophobicContact CE2-CG1 4.33Å; F205-V230 HydrophobicContact CG-CG1 3.81Å; F205-V230 HydrophobicContact CZ-CG1 3.93Å; F226-V230 HydrophobicContact CB-CG1 4.47Å; S227-V230 PolarHBondContact O-N 3.31Å; G228-V230 VanDerWaalsContact C-N 3.33Å; G228-V230 PolarHBondContact O-N 2.7Å; V230-V232 PolarHBondContact O-N 2.74Å; V230-F234 HydrophobicContact CG1-CB 4.43Å; V230-F234 VanDerWaalsContact O-CB 3.27Å; V230-F234 WeakPolarHBondContact O-CB 3.19Å; V230-F234 PolarHBondContact O-N 3.34Å; V230-F234 VanDerWaalsContact O-N 3.16Å
231	R	93.8	Very high	95.8	Very high	6 Å²	6	26.7 Å²	26.7	2%	0.023	15%	0.149	C	C	.	.	H	α-helix	trans	-63.4	-41.6	176	170.7	60.2	-169.3	-76.8	-3.7	113.1	D183 G189 D190 F226 S227 G228 N229	D183-R231 PolarHBondContact O-NH2 3.01Å; G189-R231 PolarHBondContact O-NH1 3.21Å; D190-R231 WeakPolarHBondContact O-CG 3.32Å; F226-R231 HydrophobicContact CD2-CB 4.43Å; S227-R231 VanDerWaalsContact C-CB 3.48Å; S227-R231 PolarHBondContact O-N 3.09Å; G228-R231 WeakPolarHBondContact O-CB 3.39Å; G228-R231 PolarHBondContact O-N 3.37Å; G228-R231 VanDerWaalsContact O-N 3.1Å; N229-R231 VanDerWaalsContact C-N 3.3Å; N229-R231 PolarHBondContact O-N 3.2Å
232	V	92.6	Very high	95.7	Very high	83 Å²	83	24.5 Å²	24.5	50%	0.503	14%	0.141	S	C	.	.	H	α-helix	trans	-83	-46.7	-171.5	175.3	0	0	0	0	111.9	K182 G228 N229 V230	K182-V232 WeakPolarHBondContact CE-O 3.43Å; K182-V232 PolarHBondContact NZ-O 3.12Å; G228-V232 WeakPolarHBondContact O-CG2 3.39Å; G228-V232 PolarHBondContact O-N 3.19Å; N229-V232 PolarHBondContact O-N 3.43Å; V230-V232 PolarHBondContact O-N 2.74Å
233	A	92.3	Very high	95.7	Very high	24 Å²	24	24.6 Å²	24.6	20%	0.198	14%	0.141	C	C	.	.	H	α-helix	trans	-86.4	-34.9	-173.6	0	0	0	0	0	112.5	K182 E207 N229	K182-A233 WeakPolarHBondContact CE-O 3.3Å; K182-A233 VanDerWaalsContact NZ-C 3.3Å; K182-A233 PolarHBondContact NZ-O 2.9Å; E207-A233 HydrophobicContact CG-CB 4.28Å; N229-A233 VanDerWaalsContact O-CB 3.31Å; N229-A233 WeakPolarHBondContact O-CB 3.25Å; N229-A233 PolarHBondContact O-N 3.33Å
234	F	95.7	Very high	95.7	Very high	14 Å²	14	28.9 Å²	28.9	6%	0.061	17%	0.167	C	C	.	.			trans	-96.5	140.2	-172.2	-63.1	-118.4	0	0	0	111.5	F205 L206 E207 T212 I214 V230	F205-F234 HydrophobicContact CB-CB 3.97Å; F205-F234 HydrophobicContact CB-CD1 3.7Å; F205-F234 HydrophobicContact CB-CG 4.17Å; F205-F234 HydrophobicContact CD1-CB 4.1Å; L206-F234 CarbonylContact O-C 3.45Å; L206-F234 WeakPolarHBondContact O-CA 3.21Å; E207-F234 HydrophobicContact CB-CD1 3.55Å; E207-F234 HydrophobicContact CB-CD2 4.12Å; E207-F234 HydrophobicContact CB-CE1 3.47Å; E207-F234 VanDerWaalsContact CB-CE1 3.47Å; E207-F234 HydrophobicContact CB-CE2 4.03Å; E207-F234 HydrophobicContact CB-CG 3.87Å; E207-F234 HydrophobicContact CB-CZ 3.71Å; E207-F234 HydrophobicContact CG-CD1 4.46Å; E207-F234 HydrophobicContact CG-CD2 4.16Å; E207-F234 HydrophobicContact CG-CE1 4.33Å; E207-F234 HydrophobicContact CG-CE2 4.01Å; E207-F234 HydrophobicContact CG-CG 4.36Å; E207-F234 HydrophobicContact CG-CZ 4.1Å; T212-F234 HydrophobicContact CG2-CE1 4.01Å; T212-F234 HydrophobicContact CG2-CZ 4.45Å; I214-F234 HydrophobicContact CD1-CD1 4.29Å; I214-F234 HydrophobicContact CD1-CE1 3.54Å; I214-F234 HydrophobicContact CD1-CZ 4.05Å; I214-F234 HydrophobicContact CG1-CE1 4.12Å; V230-F234 HydrophobicContact CG1-CB 4.43Å; V230-F234 VanDerWaalsContact O-CB 3.27Å; V230-F234 WeakPolarHBondContact O-CB 3.19Å; V230-F234 PolarHBondContact O-N 3.34Å; V230-F234 VanDerWaalsContact O-N 3.16Å
235	K	97.5	Very high	95.8	Very high	55 Å²	55	30.4 Å²	30.4	24%	0.239	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	152.3	158.4	-61.3	172.9	-145.3	160.8	0	108.6	F180 H181 K182 F205 L206 D208	F180-K235 HydrophobicContact CB-CB 3.82Å; F180-K235 HydrophobicContact CB-CD 3.91Å; F180-K235 HydrophobicContact CD1-CB 4.27Å; H181-K235 CarbonylContact O-C 3.51Å; H181-K235 VanDerWaalsContact O-CA 3.23Å; H181-K235 WeakPolarHBondContact O-CA 3.43Å; K182-K235 HydrophobicContact CG-CG 3.95Å; F205-K235 CarbonylContact C-O 3.5Å; F205-K235 VanDerWaalsContact CA-O 3.27Å; F205-K235 WeakPolarHBondContact CA-O 3.32Å; L206-K235 HydrophobicContact CB-CB 4.48Å; L206-K235 PolarHBondContact N-O 3.05Å; L206-K235 PolarHBondContact O-N 3.48Å; D208-K235 IonicContact OD1-NZ 3.61Å; D208-K235 PolarHBondContact OD1-NZ 3.46Å; D208-K235 WeakPolarHBondContact OD2-CE 3.3Å; D208-K235 IonicContact OD2-NZ 2.9Å; D208-K235 PolarHBondContact OD2-NZ 3.38Å
236	H	97.8	Very high	95.9	Very high	18 Å²	18	33 Å²	33	8%	0.083	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	148.1	171.7	65.9	-79.7	0	0	0	111.4	F180 H181 D183 L203 S204 F205	F180-H236 WeakPolarHBondContact CA-O 3.44Å; H181-H236 AromaticContact CE1-CD2 3.81Å; H181-H236 AromaticContact CE1-CE1 3.78Å; H181-H236 AromaticContact CE1-NE2 3.34Å; H181-H236 PolarHBondContact CE1-NE2 2.79Å; H181-H236 VanDerWaalsContact CE1-NE2 3.34Å; H181-H236 PolarHBondContact N-O 3.35Å; H181-H236 VanDerWaalsContact N-O 3.11Å; H181-H236 PolarHBondContact ND1-O 2.66Å; H181-H236 AromaticContact NE2-CE1 3.64Å; H181-H236 AromaticContact NE2-NE2 3.4Å; H181-H236 PolarHBondContact NE2-NE2 2.67Å; H181-H236 PolarHBondContact O-N 2.74Å; H181-H236 PolarHBondContact O-ND1 3.29Å; D183-H236 IonicContact OD1-CE1 3.52Å; L203-H236 HydrophobicContact CD1-CB 4.18Å; S204-H236 CarbonylContact O-C 3.57Å; S204-H236 VanDerWaalsContact O-CA 3.24Å; S204-H236 WeakPolarHBondContact O-CA 3.22Å; F205-H236 HydrophobicContact CD1-CB 3.82Å; F205-H236 HydrophobicContact CE1-CB 3.77Å
237	G	97.9	Very high	96	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160	168	-173.6	0	0	0	0	0	112.4	S204	S204-G237 PolarHBondContact N-O 2.91Å; S204-G237 PolarHBondContact O-N 3.36Å
238	I	98.2	Very high	96.2	Very high	5 Å²	5	31.9 Å²	31.9	3%	0.026	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	127.7	171.1	-56.7	173.8	0	0	0	107.2	Y170 W177 I178 L203 H242 I243	Y170-I238 HydrophobicContact CE1-CD1 4.41Å; W177-I238 WeakPolarHBondContact CB-O 3.39Å; I178-I238 HydrophobicContact CG2-CB 3.86Å; I178-I238 HydrophobicContact CG2-CD1 4.34Å; I178-I238 HydrophobicContact CG2-CG1 3.9Å; I178-I238 VanDerWaalsContact CG2-N 3.29Å; I178-I238 PolarHBondContact N-O 3.28Å; I178-I238 PolarHBondContact O-N 3.29Å; I178-I238 VanDerWaalsContact O-N 3.13Å; L203-I238 HydrophobicContact CD1-CG1 4.22Å; I238-H242 HydrophobicContact CG2-CB 3.96Å; I238-I243 HydrophobicContact CG2-CD1 3.65Å; I238-I243 HydrophobicContact CG2-CG1 4.1Å
239	F	97.1	Very high	96.5	Very high	16 Å²	16	30.9 Å²	30.9	7%	0.07	17%	0.173	C	C	.	.			trans	-73	151.9	178.6	-65.6	-64.7	0	0	0	112.3	F35 F58 F180 S204 L213 Y215 Q241 H242	F35-F239 HydrophobicContact CD2-CE1 4.3Å; F35-F239 AromaticContact CD2-CZ 3.97Å; F35-F239 HydrophobicContact CD2-CZ 3.97Å; F35-F239 AromaticContact CE2-CE1 3.35Å; F35-F239 HydrophobicContact CE2-CE1 3.35Å; F35-F239 AromaticContact CE2-CZ 3.35Å; F35-F239 HydrophobicContact CE2-CZ 3.35Å; F35-F239 AromaticContact CZ-CE1 3.93Å; F35-F239 HydrophobicContact CZ-CE1 3.93Å; F35-F239 AromaticContact CZ-CZ 3.97Å; F35-F239 HydrophobicContact CZ-CZ 3.97Å; F58-F239 AromaticContact CE1-CD1 3.86Å; F58-F239 HydrophobicContact CE1-CD1 3.86Å; F58-F239 AromaticContact CE1-CD2 3.98Å; F58-F239 HydrophobicContact CE1-CD2 3.98Å; F58-F239 HydrophobicContact CE1-CE1 4.01Å; F58-F239 HydrophobicContact CE1-CE2 4.1Å; F58-F239 AromaticContact CE1-CG 3.85Å; F58-F239 HydrophobicContact CE1-CG 3.85Å; F58-F239 HydrophobicContact CE1-CZ 4.1Å; F58-F239 HydrophobicContact CZ-CD1 4.11Å; F58-F239 HydrophobicContact CZ-CE1 4.33Å; F58-F239 HydrophobicContact CZ-CG 4.43Å; F180-F239 AromaticContact CE2-CE1 3.55Å; F180-F239 HydrophobicContact CE2-CE1 3.55Å; F180-F239 HydrophobicContact CE2-CE2 4.45Å; F180-F239 AromaticContact CE2-CZ 3.49Å; F180-F239 HydrophobicContact CE2-CZ 3.49Å; F180-F239 VanDerWaalsContact CE2-CZ 3.49Å; F180-F239 AromaticContact CZ-CE1 3.97Å; F180-F239 HydrophobicContact CZ-CE1 3.97Å; F180-F239 HydrophobicContact CZ-CE2 4.05Å; F180-F239 AromaticContact CZ-CZ 3.47Å; F180-F239 HydrophobicContact CZ-CZ 3.47Å; F180-F239 VanDerWaalsContact CZ-CZ 3.47Å; S204-F239 WeakPolarHBondContact OG-CE2 3.01Å; L213-F239 HydrophobicContact CD1-CE2 4.48Å; L213-F239 HydrophobicContact CD1-CZ 4.47Å; Y215-F239 HydrophobicContact CE1-CD2 4.26Å; Y215-F239 AromaticContact CE1-CE2 3.82Å; Y215-F239 HydrophobicContact CE1-CE2 3.82Å; F239-Q241 VanDerWaalsContact C-N 3.3Å; F239-Q241 PolarHBondContact O-N 2.64Å; F239-H242 HydrophobicContact CB-CB 4.48Å; F239-H242 AromaticContact CD2-CE1 3.82Å; F239-H242 AromaticContact CD2-ND1 3.53Å; F239-H242 PolarHBondContact O-N 2.82Å
240	P	95.7	Very high	96.8	Very high	52 Å²	52	25.8 Å²	25.8	34%	0.338	15%	0.146	S	C	.	.	G	3₁₀ helix	trans	-54.5	-42	177.9	-24.3	32.1	0	0	0	114	W177 H242 I243	W177-P240 HydrophobicContact CB-CB 4.27Å; W177-P240 HydrophobicContact CB-CG 3.78Å; W177-P240 HydrophobicContact CD2-CG 4.25Å; W177-P240 HydrophobicContact CG-CG 3.8Å; P240-H242 PolarHBondContact O-N 3.38Å; P240-I243 PolarHBondContact O-N 3.19Å
241	Q	95.9	Very high	97.1	Very high	74 Å²	74	26.3 Å²	26.3	35%	0.346	15%	0.149	S	C	.	.	G	3₁₀ helix	trans	-73.2	-9.4	178.9	70.7	-78.4	-3.5	0	0	114.1	F239 I243	F239-Q241 VanDerWaalsContact C-N 3.3Å; F239-Q241 PolarHBondContact O-N 2.64Å; Q241-I243 VanDerWaalsContact C-N 3.3Å
242	H	98.3	Very high	97.3	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-93.9	9.8	173.4	-64.2	155.9	0	0	0	112.4	Y59 I61 T201 V202 Y215 I238 F239 P240	Y59-H242 PolarHBondContact O-NE2 2.92Å; I61-H242 WeakPolarHBondContact CD1-O 3.11Å; I61-H242 HydrophobicContact CG1-CB 4.4Å; T201-H242 PolarHBondContact OG1-O 3.38Å; V202-H242 HydrophobicContact CB-CB 4.13Å; Y215-H242 AromaticContact CE1-CE1 3.99Å; I238-H242 HydrophobicContact CG2-CB 3.96Å; F239-H242 HydrophobicContact CB-CB 4.48Å; F239-H242 AromaticContact CD2-CE1 3.82Å; F239-H242 AromaticContact CD2-ND1 3.53Å; F239-H242 PolarHBondContact O-N 2.82Å; P240-H242 PolarHBondContact O-N 3.38Å
243	I	98.5	Very high	97.6	Very high	5 Å²	5	23.4 Å²	23.4	3%	0.026	13%	0.129	C	C	.	.			trans	-109.3	112.9	166.5	-58	-59	0	0	0	108.3	Y170 S172 S176 I238 P240 Q241	Y170-I243 HydrophobicContact CD1-CD1 3.6Å; Y170-I243 HydrophobicContact CD1-CG1 3.99Å; Y170-I243 HydrophobicContact CE1-CD1 4.27Å; Y170-I243 HydrophobicContact CG-CD1 3.95Å; S172-I243 VanDerWaalsContact CB-O 3.25Å; S172-I243 WeakPolarHBondContact CB-O 3.27Å; S176-I243 VanDerWaalsContact O-CG1 3.28Å; S176-I243 WeakPolarHBondContact O-CG1 3.32Å; I238-I243 HydrophobicContact CG2-CD1 3.65Å; I238-I243 HydrophobicContact CG2-CG1 4.1Å; P240-I243 PolarHBondContact O-N 3.19Å; Q241-I243 VanDerWaalsContact C-N 3.3Å
244	V	97.7	Very high	97.7	Very high	90 Å²	90	23.1 Å²	23.1	55%	0.545	12%	0.124	S	C	.	.			trans	-117.8	122.1	175.2	176.7	0	0	0	0	109.1	I61 S199	I61-V244 HydrophobicContact CD1-CB 4.3Å; I61-V244 HydrophobicContact CD1-CG2 3.66Å; S199-V244 WeakPolarHBondContact CB-O 3.12Å; S199-V244 PolarHBondContact OG-O 2.75Å
245	G	98.2	Very high	97.6	Very high	33 Å²	33	23.2 Å²	23.2	34%	0.34	13%	0.126	S	C	.	.	S	Bend	trans	63.9	-143.4	-174.7	0	0	0	0	0	111.9	D171 S172	D171-G245 WeakPolarHBondContact CA-O 3.31Å; S172-G245 PolarHBondContact N-O 3.24Å; S172-G245 WeakPolarHBondContact OG-CA 3.31Å; S172-G245 PolarHBondContact OG-N 2.86Å
246	R	98.5	Very high	97.3	Very high	57 Å²	57	20.9 Å²	20.9	22%	0.215	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	132	175.7	-172	-175.9	-178.4	-165.9	2.1	110	D106 D169 Y170 L198 S199	D106-R246 IonicContact OD1-CZ 3.89Å; D106-R246 IonicContact OD1-NH1 3.12Å; D106-R246 PolarHBondContact OD1-NH1 2.78Å; D106-R246 IonicContact OD1-NH2 2.72Å; D106-R246 PolarHBondContact OD1-NH2 2.72Å; D106-R246 IonicContact OD2-CZ 2.66Å; D106-R246 IonicContact OD2-NH1 2.67Å; D106-R246 PolarHBondContact OD2-NH1 3.15Å; D106-R246 IonicContact OD2-NH2 3.29Å; D169-R246 IonicContact OD1-CZ 3.66Å; D169-R246 VanDerWaalsContact OD1-CZ 3.3Å; D169-R246 IonicContact OD1-NE 2.73Å; D169-R246 PolarHBondContact OD1-NE 3.3Å; D169-R246 IonicContact OD1-NH2 2.74Å; D169-R246 PolarHBondContact OD1-NH2 2.92Å; Y170-R246 WeakPolarHBondContact O-CA 3.49Å; L198-R246 WeakPolarHBondContact CB-O 3.36Å; L198-R246 HydrophobicContact CD1-CG 4.01Å; S199-R246 PolarHBondContact OG-O 3Å
247	R	98.6	Very high	96.7	Very high	4 Å²	4	25.6 Å²	25.6	2%	0.015	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	133.4	174.3	-177.8	-168.3	171.3	-99.7	-3.7	109.4	Y170 N196 S199	Y170-R247 VanDerWaalsContact CE2-NH1 3.3Å; Y170-R247 PolarHBondContact N-O 3.1Å; Y170-R247 PolarHBondContact O-N 3.41Å; N196-R247 PolarHBondContact OD1-NE 3.01Å; N196-R247 PolarHBondContact OD1-NH2 3.19Å; S199-R247 VanDerWaalsContact OG-CB 3.29Å; S199-R247 WeakPolarHBondContact OG-CB 3.48Å
248	I	98.8	Very high	95.8	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	142.8	167.9	-65.3	171.3	0	0	0	108.2	Q102 M105 W110 L168 D169 L197 L198	Q102-I248 HydrophobicContact CG-CD1 4.32Å; M105-I248 HydrophobicContact SD-CD1 4.48Å; M105-I248 HydrophobicContact SD-CG2 3.72Å; W110-I248 HydrophobicContact CH2-CD1 4.41Å; W110-I248 HydrophobicContact CH2-CG1 4.41Å; W110-I248 HydrophobicContact CH2-CG2 4.29Å; W110-I248 HydrophobicContact CZ2-CD1 3.94Å; W110-I248 HydrophobicContact CZ2-CG1 4.34Å; L168-I248 CarbonylContact O-C 3.55Å; L168-I248 WeakPolarHBondContact O-CA 3.25Å; D169-I248 HydrophobicContact CB-CG1 4.45Å; L197-I248 WeakPolarHBondContact CA-O 3.44Å; L197-I248 HydrophobicContact CB-CB 4.05Å; L197-I248 WeakPolarHBondContact CB-O 3.36Å; L197-I248 PolarHBondContact N-O 2.93Å; L197-I248 PolarHBondContact O-N 3.49Å; L197-I248 VanDerWaalsContact O-N 3.08Å; L198-I248 HydrophobicContact CD1-CB 4.4Å; L198-I248 HydrophobicContact CD1-CD1 3.62Å; L198-I248 HydrophobicContact CD1-CG1 3.79Å; L198-I248 HydrophobicContact CG-CD1 4.4Å; L198-I248 HydrophobicContact CG-CG1 4.47Å
249	V	98.8	Very high	94.7	Very high	4 Å²	4	28.5 Å²	28.5	2%	0.024	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	138.5	167.2	61.5	0	0	0	0	109.6	N167 L168 Y170 T194 C195	N167-V249 CarbonylContact C-O 3.53Å; N167-V249 VanDerWaalsContact CA-O 3.29Å; N167-V249 WeakPolarHBondContact CA-O 3.39Å; L168-V249 HydrophobicContact CB-CG1 3.74Å; L168-V249 HydrophobicContact CD1-CG1 4.44Å; L168-V249 HydrophobicContact CG-CG1 4.48Å; L168-V249 PolarHBondContact N-O 2.84Å; L168-V249 PolarHBondContact O-N 3.07Å; Y170-V249 HydrophobicContact CE2-CG1 3.76Å; T194-V249 HydrophobicContact CG2-CG2 4.4Å; C195-V249 VanDerWaalsContact O-CA 3.29Å; C195-V249 WeakPolarHBondContact O-CA 3.41Å; C195-V249 WeakPolarHBondContact O-CG2 3.4Å
250	M	98.8	Very high	93.4	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	109.4	167.6	-58.1	-177.4	70.3	0	0	107.5	L101 M105 Y143 A144 L147 L165 N167 T194 C195 L197	L101-M250 HydrophobicContact CD1-SD 3.9Å; L101-M250 HydrophobicContact CD2-CE 4.34Å; L101-M250 HydrophobicContact CD2-SD 4.07Å; M105-M250 HydrophobicContact CE-CE 3.8Å; M105-M250 HydrophobicContact CE-CG 3.6Å; M105-M250 HydrophobicContact CE-SD 3.4Å; M105-M250 WeakPolarHBondContact CE-SD 3.45Å; Y143-M250 HydrophobicContact CE2-CE 3.96Å; A144-M250 HydrophobicContact CB-CE 3.89Å; L147-M250 HydrophobicContact CD1-CE 3.52Å; L147-M250 HydrophobicContact CD1-SD 3.36Å; L147-M250 WeakPolarHBondContact CD1-SD 3.43Å; L165-M250 HydrophobicContact CD1-CB 3.82Å; L165-M250 HydrophobicContact CD1-CE 3.85Å; L165-M250 HydrophobicContact CD2-CE 3.79Å; L165-M250 HydrophobicContact CG-CE 4.48Å; N167-M250 WeakPolarHBondContact OD1-CG 3.33Å; T194-M250 CarbonylContact C-O 3.5Å; T194-M250 VanDerWaalsContact CA-O 3.32Å; T194-M250 WeakPolarHBondContact CA-O 3.36Å; C195-M250 HydrophobicContact CB-CB 4.18Å; C195-M250 PolarHBondContact N-O 3.44Å; C195-M250 PolarHBondContact O-N 3.36Å; L197-M250 HydrophobicContact CD1-CG 4.03Å; L197-M250 HydrophobicContact CD1-SD 4.4Å
251	T	98.6	Very high	92.1	Very high	13 Å²	13	34.2 Å²	34.2	8%	0.08	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	120.4	173.5	-59.9	0	0	0	0	108.7	L165 S166 I192 V193 T194 R253	L165-T251 WeakPolarHBondContact CA-O 3.49Å; S166-T251 PolarHBondContact N-O 3.29Å; S166-T251 PolarHBondContact O-N 2.94Å; I192-T251 HydrophobicContact CG2-CG2 3.8Å; V193-T251 CarbonylContact O-C 3.57Å; V193-T251 WeakPolarHBondContact O-CA 3.17Å; T194-T251 HydrophobicContact CG2-CG2 4.29Å; T251-R253 HydrophobicContact CG2-CG 4.44Å
252	I	98.5	Very high	90.4	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.01	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	130.7	-177.3	-50.4	163.7	0	0	0	107.9	F148 L151 F160 P162 E164 L165 V193	F148-I252 HydrophobicContact CD1-CD1 4.11Å; F148-I252 HydrophobicContact CD1-CG2 4.37Å; F148-I252 HydrophobicContact CE1-CD1 3.88Å; F148-I252 HydrophobicContact CE1-CG1 4.15Å; F148-I252 HydrophobicContact CE1-CG2 3.98Å; L151-I252 HydrophobicContact CD1-CD1 3.93Å; F160-I252 HydrophobicContact CE1-CG2 3.7Å; F160-I252 HydrophobicContact CZ-CB 4.48Å; F160-I252 HydrophobicContact CZ-CG2 4.01Å; P162-I252 HydrophobicContact CB-CG2 3.75Å; P162-I252 HydrophobicContact CG-CG2 4.27Å; E164-I252 WeakPolarHBondContact O-CA 3.09Å; L165-I252 HydrophobicContact CD1-CG1 3.77Å; V193-I252 HydrophobicContact CB-CB 4.31Å; V193-I252 HydrophobicContact CG1-CD1 4.49Å; V193-I252 PolarHBondContact N-O 3.03Å; V193-I252 PolarHBondContact O-N 3.35Å
253	R	97.7	Very high	88.3	Confident	25 Å²	25	37.3 Å²	37.3	9%	0.094	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	143	-180	-59	-177.6	176.4	88.8	-3.8	110.6	V163 E164 D183 W188 T251	V163-R253 WeakPolarHBondContact CG1-O 3.5Å; V163-R253 PolarHBondContact N-O 2.94Å; E164-R253 HydrophobicContact CB-CB 4.38Å; E164-R253 VanDerWaalsContact CD-NH1 3.3Å; E164-R253 PolarHBondContact N-O 3.44Å; E164-R253 PolarHBondContact O-N 3.15Å; E164-R253 IonicContact OE1-NH1 3.66Å; E164-R253 PolarHBondContact OE1-NH1 2.98Å; E164-R253 VanDerWaalsContact OE1-NH1 3.12Å; E164-R253 WeakPolarHBondContact OE2-CD 3.31Å; E164-R253 WeakPolarHBondContact OE2-CG 3.28Å; E164-R253 IonicContact OE2-CZ 3.37Å; E164-R253 IonicContact OE2-NE 2.64Å; E164-R253 IonicContact OE2-NH1 3.33Å; E164-R253 PolarHBondContact OE2-NH1 3.48Å; D183-R253 IonicContact OD1-NH2 2.54Å; D183-R253 PolarHBondContact OD1-NH2 3.47Å; D183-R253 IonicContact OD2-CZ 3.58Å; D183-R253 IonicContact OD2-NE 2.82Å; D183-R253 PolarHBondContact OD2-NE 3.07Å; D183-R253 IonicContact OD2-NH2 2.83Å; D183-R253 PolarHBondContact OD2-NH2 3.18Å; W188-R253 HydrophobicContact CB-CB 4.45Å; W188-R253 HydrophobicContact CD2-CB 4.07Å; W188-R253 HydrophobicContact CD2-CG 4.44Å; W188-R253 HydrophobicContact CE3-CB 3.96Å; W188-R253 HydrophobicContact CG-CB 4.31Å; W188-R253 VanDerWaalsContact CG-CD 3.48Å; W188-R253 HydrophobicContact CG-CG 4.43Å; T251-R253 HydrophobicContact CG2-CG 4.44Å
254	E	95.8	Very high	86	Confident	18 Å²	18	43.1 Å²	43.1	8%	0.084	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	158.1	168.5	70.6	-177.8	167.4	0	0	110.9	F160 V161 W188 G189 R191	F160-E254 HydrophobicContact CD2-CB 4.06Å; F160-E254 HydrophobicContact CD2-CG 4.22Å; F160-E254 WeakPolarHBondContact CD2-OE2 3.3Å; F160-E254 HydrophobicContact CE1-CB 4.5Å; F160-E254 HydrophobicContact CE2-CB 3.74Å; F160-E254 HydrophobicContact CE2-CG 3.91Å; F160-E254 HydrophobicContact CZ-CB 3.98Å; V161-E254 WeakPolarHBondContact O-CA 3.48Å; V161-E254 VanDerWaalsContact O-CB 3.25Å; V161-E254 WeakPolarHBondContact O-CB 3.38Å; W188-E254 CarbonylContact C-O 3.44Å; W188-E254 WeakPolarHBondContact CA-O 3.44Å; G189-E254 PolarHBondContact N-O 2.76Å; R191-E254 VanDerWaalsContact CB-OE1 3.27Å; R191-E254 WeakPolarHBondContact CB-OE1 3.49Å; R191-E254 WeakPolarHBondContact CG-OE1 3.47Å; R191-E254 IonicContact CZ-OE1 3.75Å; R191-E254 IonicContact CZ-OE2 2.72Å; R191-E254 PolarHBondContact N-OE1 3.34Å; R191-E254 IonicContact NE-OE1 3.64Å; R191-E254 PolarHBondContact NE-OE1 3.04Å; R191-E254 IonicContact NE-OE2 2.7Å; R191-E254 PolarHBondContact NE-OE2 2.97Å; R191-E254 IonicContact NH2-OE1 3.56Å; R191-E254 IonicContact NH2-OE2 3.32Å; R191-E254 PolarHBondContact NH2-OE2 3.41Å
255	P	93.7	Very high	83.8	Confident	16 Å²	16	43.8 Å²	43.8	10%	0.104	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	146.4	179.7	30.3	-32.7	0	0	0	111	V161 V163 C259 Q260	V161-P255 VanDerWaalsContact O-CD 3.22Å; V161-P255 WeakPolarHBondContact O-CD 3.32Å; V163-P255 HydrophobicContact CB-CB 4.43Å; V163-P255 HydrophobicContact CB-CG 4.4Å; V163-P255 HydrophobicContact CG1-CB 4Å; V163-P255 HydrophobicContact CG1-CG 4.34Å; P255-C259 HydrophobicContact CB-CB 3.82Å; P255-Q260 HydrophobicContact CB-CG 4.03Å; P255-Q260 HydrophobicContact CG-CG 3.79Å
256	S	90.9	Very high	81.3	Confident	6 Å²	6	49.3 Å²	49.3	4%	0.042	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-67	163.6	165.4	70.2	0	0	0	0	110.6	W186 L187 W258 C259 Q260	W186-S256 PolarHBondContact O-OG 3.41Å; L187-S256 PolarHBondContact O-N 2.78Å; L187-S256 PolarHBondContact O-OG 3.32Å; S256-W258 PolarHBondContact O-N 3.36Å; S256-W258 PolarHBondContact OG-N 3.18Å; S256-C259 WeakPolarHBondContact O-CB 3.21Å; S256-C259 PolarHBondContact O-N 3Å; S256-C259 WeakPolarHBondContact OG-CB 3.22Å; S256-C259 PolarHBondContact OG-N 2.72Å; S256-Q260 WeakPolarHBondContact O-CG 3.4Å; S256-Q260 PolarHBondContact O-N 3.48Å
257	T	84.8	Confident	78.8	Confident	118 Å²	118	52.4 Å²	52.4	72%	0.724	29%	0.286	S	S	*	.	H	α-helix	trans	-56.7	-36	171	52.7	0	0	0	0	112	Q260 S261	T257-Q260 PolarHBondContact O-N 2.97Å; T257-S261 PolarHBondContact O-N 3.29Å; T257-S261 VanDerWaalsContact O-N 3.07Å
258	W	78.3	Confident	76.4	Confident	32 Å²	32	59.9 Å²	59.9	12%	0.121	33%	0.326	C	S	.	.	H	α-helix	trans	-63.5	-46.2	173.5	178.2	89.9	0	0	0	111.6	V133 W186 L187 S256 Q260 S261 K263 I269	V133-W258 HydrophobicContact CG2-CH2 4.25Å; V133-W258 HydrophobicContact CG2-CZ3 3.96Å; W186-W258 HydrophobicContact CE3-CD2 4.43Å; W186-W258 AromaticContact CE3-CE3 3.74Å; W186-W258 HydrophobicContact CE3-CE3 3.74Å; W186-W258 AromaticContact CE3-CH2 3.95Å; W186-W258 HydrophobicContact CE3-CH2 3.95Å; W186-W258 AromaticContact CE3-CZ3 3.5Å; W186-W258 HydrophobicContact CE3-CZ3 3.5Å; W186-W258 VanDerWaalsContact CE3-CZ3 3.5Å; W186-W258 HydrophobicContact CZ3-CE3 4.08Å; W186-W258 AromaticContact CZ3-CH2 3.66Å; W186-W258 HydrophobicContact CZ3-CH2 3.66Å; W186-W258 AromaticContact CZ3-CZ3 3.35Å; W186-W258 HydrophobicContact CZ3-CZ3 3.35Å; W186-W258 VanDerWaalsContact O-CE3 3.31Å; L187-W258 HydrophobicContact CD1-CZ3 4.42Å; S256-W258 PolarHBondContact O-N 3.36Å; S256-W258 PolarHBondContact OG-N 3.18Å; W258-Q260 PolarHBondContact O-N 3.17Å; W258-S261 WeakPolarHBondContact O-CB 3.37Å; W258-S261 PolarHBondContact O-N 3.04Å; W258-S261 VanDerWaalsContact O-N 3.08Å; W258-S261 PolarHBondContact O-OG 2.91Å; W258-K263 WeakPolarHBondContact CZ2-O 3.3Å; W258-I269 HydrophobicContact CZ2-CD1 4.22Å; W258-I269 HydrophobicContact CZ2-CG1 4.05Å
259	C	75.6	Confident	74	Confident	34 Å²	34	62 Å²	62	23%	0.23	34%	0.337	C	S	.	.	H	α-helix	trans	-61.9	-35.8	177.9	-175.4	0	0	0	0	111.5	L187 P255 S256 S261	L187-C259 HydrophobicContact CD1-CB 4.2Å; L187-C259 WeakPolarHBondContact O-CB 3.43Å; P255-C259 HydrophobicContact CB-CB 3.82Å; S256-C259 WeakPolarHBondContact O-CB 3.21Å; S256-C259 PolarHBondContact O-N 3Å; S256-C259 WeakPolarHBondContact OG-CB 3.22Å; S256-C259 PolarHBondContact OG-N 2.72Å; C259-S261 VanDerWaalsContact C-N 3.34Å
260	Q	70.1	Confident	71.7	Confident	126 Å²	126	69.2 Å²	69.2	59%	0.589	38%	0.384	S	S	*	.	H	α-helix	trans	-69.6	-29.4	175.7	-68.7	174	-9.7	0	0	113	P255 S256 T257 W258 G262	P255-Q260 HydrophobicContact CB-CG 4.03Å; P255-Q260 HydrophobicContact CG-CG 3.79Å; S256-Q260 WeakPolarHBondContact O-CG 3.4Å; S256-Q260 PolarHBondContact O-N 3.48Å; T257-Q260 PolarHBondContact O-N 2.97Å; W258-Q260 PolarHBondContact O-N 3.17Å; Q260-G262 PolarHBondContact O-N 2.92Å; Q260-G262 VanDerWaalsContact O-N 3.1Å
261	S	69	Low	70.4	Confident	61 Å²	61	72.7 Å²	72.7	43%	0.427	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-5.9	-178.6	73.8	0	0	0	0	114.9	T257 W258 C259 K263	T257-S261 PolarHBondContact O-N 3.29Å; T257-S261 VanDerWaalsContact O-N 3.07Å; W258-S261 WeakPolarHBondContact O-CB 3.37Å; W258-S261 PolarHBondContact O-N 3.04Å; W258-S261 VanDerWaalsContact O-N 3.08Å; W258-S261 PolarHBondContact O-OG 2.91Å; C259-S261 VanDerWaalsContact C-N 3.34Å; S261-K263 PolarHBondContact O-N 2.94Å; S261-K263 VanDerWaalsContact O-N 3.14Å; S261-K263 WeakPolarHBondContact OG-CG 3.18Å
262	G	58.4	Low	68.9	Low	55 Å²	55	75.8 Å²	75.8	57%	0.567	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.8	9.5	176.4	0	0	0	0	0	114.9	Q260 L264	Q260-G262 PolarHBondContact O-N 2.92Å; Q260-G262 VanDerWaalsContact O-N 3.1Å; G262-L264 PolarHBondContact O-N 2.79Å
263	K	55.5	Low	67.3	Low	85 Å²	85	79.9 Å²	79.9	37%	0.37	44%	0.443	S	S	.	.			trans	-64.2	91	178.3	-71.3	-176.4	176.3	-164.7	0	110.8	W258 S261 E267	W258-K263 WeakPolarHBondContact CZ2-O 3.3Å; S261-K263 PolarHBondContact O-N 2.94Å; S261-K263 VanDerWaalsContact O-N 3.14Å; S261-K263 WeakPolarHBondContact OG-CG 3.18Å; K263-E267 HydrophobicContact CD-CB 4.49Å; K263-E267 VanDerWaalsContact CE-OE2 3.27Å; K263-E267 WeakPolarHBondContact CE-OE2 3.36Å; K263-E267 IonicContact NZ-OE2 3.36Å
264	L	48.9	Very low	65.5	Low	126 Å²	126	83.2 Å²	83.2	66%	0.66	46%	0.463	S	S	*	.			trans	-92.5	137	175.8	-73.3	171.2	0	0	0	111.5	G262 N266	G262-L264 PolarHBondContact O-N 2.79Å; L264-N266 VanDerWaalsContact C-N 3.26Å; L264-N266 PolarHBondContact O-N 2.77Å
265	E	51.6	Low	63.6	Low	104 Å²	104	87.3 Å²	87.3	49%	0.486	49%	0.487	S	S	.	.	S	Bend	trans	43.4	-24.3	170.6	-65.2	-149	170.5	0	0	122.4	K132	K132-E265 HydrophobicContact CD-CG 3.94Å; K132-E265 HydrophobicContact CG-CG 4.33Å; K132-E265 VanDerWaalsContact NZ-CD 3.34Å; K132-E265 IonicContact NZ-OE1 2.94Å; K132-E265 IonicContact NZ-OE2 3.3Å; K132-E265 PolarHBondContact NZ-OE2 2.89Å
266	N	46.4	Very low	61.6	Low	150 Å²	150	92 Å²	92	80%	0.802	51%	0.512	S	S	*	.	S	Bend	trans	-131.4	14.9	-166.9	-71.8	-18.3	0	0	0	116.9	L264	L264-N266 VanDerWaalsContact C-N 3.26Å; L264-N266 PolarHBondContact O-N 2.77Å
267	E	46.7	Very low	59.5	Low	122 Å²	122	98.1 Å²	98.1	57%	0.57	55%	0.546	S	S	*	.	S	Bend	trans	-118.8	143.8	172	-70.4	-170.2	-179.2	0	0	112.3	K263 I269	K263-E267 HydrophobicContact CD-CB 4.49Å; K263-E267 VanDerWaalsContact CE-OE2 3.27Å; K263-E267 WeakPolarHBondContact CE-OE2 3.36Å; K263-E267 IonicContact NZ-OE2 3.36Å; E267-I269 PolarHBondContact O-N 3.11Å
268	N	48.1	Very low	57.5	Low	160 Å²	160	96.6 Å²	96.6	86%	0.856	53%	0.532	S	S	*	.			trans	-55.5	122	-179.9	-74	-30.1	0	0	0	110.4
269	I	48.6	Very low	55.8	Low	45 Å²	45	102 Å²	102	23%	0.231	57%	0.567	C	S	.	*			trans	-77.1	136.7	174.3	-55.4	174	0	0	0	106.8	R131 W258 E267	R131-I269 HydrophobicContact CB-CD1 3.31Å; R131-I269 HydrophobicContact CG-CD1 4.27Å; R131-I269 WeakPolarHBondContact O-CD1 3.28Å; W258-I269 HydrophobicContact CZ2-CD1 4.22Å; W258-I269 HydrophobicContact CZ2-CG1 4.05Å; E267-I269 PolarHBondContact O-N 3.11Å
270	P	50.8	Low	54	Low	156 Å²	156	108.2 Å²	108.2	100%	1.013	60%	0.597	S	S	*	*			trans	-57.5	0	173.8	20	-27.6	0	0	0	113.2

Retrieved 270 of 270 residues in 166.9 ms (Link to these results)

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