A0A5K4FDB4_SCHMA Loading...

Zinc finger CW-type PWWP domain protein 1-like

AlphaFold DB , UniProt , Accession A0A5K4FDB4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 600 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.4	Very low	39.4	Very low	234 Å²	234	148.6 Å²	148.6	100%	1.153	82%	0.821	S	S	*	*				0	108.8	0	-78.7	152.9	146.2	0	0	107.4
2	N	32.2	Very low	39.5	Very low	167 Å²	167	146.1 Å²	146.1	89%	0.893	81%	0.805	S	S	*	*			trans	172.9	78.1	166.7	-98	-6	0	0	0	107.2
3	V	37.5	Very low	40.5	Very low	137 Å²	137	146.7 Å²	146.7	83%	0.83	80%	0.804	S	S	*	*			trans	-142	20.7	-171.9	-149.8	0	0	0	0	112.9
4	L	46.1	Very low	41.3	Very low	148 Å²	148	143.1 Å²	143.1	78%	0.775	79%	0.794	S	S	*	*	S	Bend	trans	-128.7	0.9	179.3	-72.5	177.2	0	0	0	114.9	L6	L4-L6 WeakPolarHBondContact O-CG 3.36Å; L4-L6 PolarHBondContact O-N 3.48Å
5	G	32.6	Very low	42.4	Very low	88 Å²	88	138.6 Å²	138.6	91%	0.907	77%	0.768	S	S	*	*			trans	61.3	12	162.6	0	0	0	0	0	118.1
6	L	37.1	Very low	43.4	Very low	131 Å²	131	135.8 Å²	135.8	69%	0.686	75%	0.746	S	S	*	*	S	Bend	trans	-123.9	144	-174.2	-69.9	171.2	0	0	0	111.5	L4 I8	L4-L6 WeakPolarHBondContact O-CG 3.36Å; L4-L6 PolarHBondContact O-N 3.48Å; L6-I8 PolarHBondContact O-N 3.21Å
7	P	34	Very low	44.3	Very low	117 Å²	117	135.1 Å²	135.1	76%	0.76	74%	0.741	S	S	*	*			trans	-71.4	117.5	178.7	29	-33.5	0	0	0	110.5	K9	P7-K9 PolarHBondContact O-N 3.04Å
8	I	45	Very low	45.4	Very low	158 Å²	158	135.6 Å²	135.6	81%	0.81	74%	0.735	S	S	*	*			trans	-72.5	99.5	172.2	-56.5	174.2	0	0	0	107.7	L6	L6-I8 PolarHBondContact O-N 3.21Å
9	K	46.5	Very low	46.4	Very low	190 Å²	190	133.7 Å²	133.7	83%	0.826	72%	0.719	S	S	*	*			trans	-69.3	139	157.2	-73.5	-172.4	174.7	-175.5	0	108	P7	P7-K9 PolarHBondContact O-N 3.04Å
10	E	42.6	Very low	47.3	Very low	184 Å²	184	129.6 Å²	129.6	86%	0.86	70%	0.699	S	S	*	*			trans	-59.7	127.1	178.6	-63.1	-177.1	137.5	0	0	110.2	N12	E10-N12 PolarHBondContact O-N 3.19Å
11	P	44.7	Very low	48	Very low	81 Å²	81	128.4 Å²	128.4	53%	0.526	69%	0.692	S	S	.	*			trans	-72.7	113.1	179.8	28.4	-32.6	0	0	0	109.4	I13	P11-I13 PolarHBondContact O-N 2.84Å
12	N	41	Very low	49.6	Very low	118 Å²	118	121.7 Å²	121.7	63%	0.631	66%	0.658	S	S	*	*			trans	-57.9	129.1	169.3	-169.6	-17.1	0	0	0	108.8	E10 S14 N15	E10-N12 PolarHBondContact O-N 3.19Å; N12-S14 PolarHBondContact O-N 2.79Å; N12-N15 PolarHBondContact O-N 2.97Å
13	I	52.3	Low	51	Low	154 Å²	154	116.9 Å²	116.9	79%	0.79	63%	0.632	S	S	*	*	G	3₁₀ helix	trans	-55.1	-29.6	-164.8	-62.9	173.4	0	0	0	112.2	P11 N15 F16	P11-I13 PolarHBondContact O-N 2.84Å; I13-N15 PolarHBondContact O-N 2.9Å; I13-N15 VanDerWaalsContact O-N 3.17Å; I13-F16 PolarHBondContact O-N 3.12Å
14	S	51.6	Low	52.4	Low	96 Å²	96	114 Å²	114	67%	0.671	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-67.2	-4.9	177.2	56.4	0	0	0	0	116.5	N12	N12-S14 PolarHBondContact O-N 2.79Å
15	N	57.3	Low	53.4	Low	76 Å²	76	111.8 Å²	111.8	41%	0.406	60%	0.6	S	S	.	*	G	3₁₀ helix	trans	-121.8	12.7	175.6	-80.8	-55.9	0	0	0	113.9	N12 I13 D17 K18 F19	N12-N15 PolarHBondContact O-N 2.97Å; I13-N15 PolarHBondContact O-N 2.9Å; I13-N15 VanDerWaalsContact O-N 3.17Å; N15-D17 PolarHBondContact O-N 2.89Å; N15-K18 PolarHBondContact O-N 3.04Å; N15-K18 PolarHBondContact OD1-NZ 3.3Å; N15-F19 PolarHBondContact O-N 3.1Å
16	F	58.2	Low	55	Low	94 Å²	94	113.8 Å²	113.8	41%	0.412	58%	0.58	S	S	.	*	H	α-helix	trans	-56.8	-44.6	-177.2	-177.9	-99.6	0	0	0	113.1	I13 K18 F19 V20	I13-F16 PolarHBondContact O-N 3.12Å; F16-K18 PolarHBondContact O-N 3.41Å; F16-F19 WeakPolarHBondContact O-CB 3.35Å; F16-F19 PolarHBondContact O-N 3.38Å; F16-F19 VanDerWaalsContact O-N 3.08Å; F16-V20 HydrophobicContact CD1-CG2 4.03Å; F16-V20 HydrophobicContact CE1-CG2 3.54Å; F16-V20 HydrophobicContact CE2-CG2 4.31Å; F16-V20 HydrophobicContact CZ-CG2 3.7Å; F16-V20 PolarHBondContact O-N 3.35Å
17	D	58.9	Low	56.4	Low	124 Å²	124	111.4 Å²	111.4	66%	0.663	57%	0.567	S	S	*	*	H	α-helix	trans	-61.2	-42.9	-178.6	-57.6	-37.8	0	0	0	112	N15 F19 V20 D21	N15-D17 PolarHBondContact O-N 2.89Å; D17-F19 VanDerWaalsContact C-N 3.29Å; D17-F19 PolarHBondContact O-N 3.28Å; D17-V20 WeakPolarHBondContact O-CB 3.28Å; D17-V20 PolarHBondContact O-N 3.25Å; D17-V20 VanDerWaalsContact O-N 3.14Å; D17-D21 PolarHBondContact O-N 2.81Å
18	K	64.5	Low	57.9	Low	143 Å²	143	110 Å²	110	62%	0.622	56%	0.56	S	S	*	*	H	α-helix	trans	-62.9	-34.5	175.1	-68.4	-177.5	-168.2	151.5	0	113	N15 F16 E22	N15-K18 PolarHBondContact O-N 3.04Å; N15-K18 PolarHBondContact OD1-NZ 3.3Å; F16-K18 PolarHBondContact O-N 3.41Å; K18-E22 WeakPolarHBondContact O-CB 3.23Å; K18-E22 PolarHBondContact O-N 2.87Å
19	F	64.6	Low	59.2	Low	101 Å²	101	107.3 Å²	107.3	44%	0.443	55%	0.551	S	S	.	*	H	α-helix	trans	-69.3	-38.6	175.4	171.8	-100.9	0	0	0	111.2	N15 F16 D17 I23	N15-F19 PolarHBondContact O-N 3.1Å; F16-F19 WeakPolarHBondContact O-CB 3.35Å; F16-F19 PolarHBondContact O-N 3.38Å; F16-F19 VanDerWaalsContact O-N 3.08Å; D17-F19 VanDerWaalsContact C-N 3.29Å; D17-F19 PolarHBondContact O-N 3.28Å; F19-I23 HydrophobicContact CD2-CG1 4.31Å; F19-I23 HydrophobicContact CE1-CG1 4.14Å; F19-I23 HydrophobicContact CE2-CD1 4.13Å; F19-I23 HydrophobicContact CE2-CG1 3.9Å; F19-I23 HydrophobicContact CZ-CD1 4.1Å; F19-I23 HydrophobicContact CZ-CG1 3.82Å; F19-I23 WeakPolarHBondContact O-CB 3.38Å; F19-I23 WeakPolarHBondContact O-CG1 3.46Å; F19-I23 PolarHBondContact O-N 3.48Å
20	V	64.1	Low	60.2	Low	51 Å²	51	101 Å²	101	31%	0.309	53%	0.526	S	S	.	.	H	α-helix	trans	-63.6	-46	172.4	174.3	0	0	0	0	110.7	F16 D17 I23 L24	F16-V20 HydrophobicContact CD1-CG2 4.03Å; F16-V20 HydrophobicContact CE1-CG2 3.54Å; F16-V20 HydrophobicContact CE2-CG2 4.31Å; F16-V20 HydrophobicContact CZ-CG2 3.7Å; F16-V20 PolarHBondContact O-N 3.35Å; D17-V20 WeakPolarHBondContact O-CB 3.28Å; D17-V20 PolarHBondContact O-N 3.25Å; D17-V20 VanDerWaalsContact O-N 3.14Å; V20-I23 PolarHBondContact O-N 2.69Å; V20-L24 HydrophobicContact CG1-CD1 3.87Å; V20-L24 HydrophobicContact CG1-CG 4.33Å; V20-L24 WeakPolarHBondContact O-CB 3.31Å; V20-L24 VanDerWaalsContact O-CG 3.31Å; V20-L24 WeakPolarHBondContact O-CG 3.4Å; V20-L24 PolarHBondContact O-N 3.49Å
21	D	61.6	Low	61.4	Low	104 Å²	104	95.5 Å²	95.5	56%	0.556	51%	0.506	S	S	*	.	H	α-helix	trans	-61.4	-44.7	177.1	-71.8	-25	0	0	0	112.1	D17 I23 L24 D25	D17-D21 PolarHBondContact O-N 2.81Å; D21-I23 VanDerWaalsContact C-N 3.34Å; D21-I23 PolarHBondContact O-N 2.84Å; D21-L24 PolarHBondContact O-N 2.87Å; D21-D25 WeakPolarHBondContact O-CB 3.46Å; D21-D25 PolarHBondContact O-N 2.77Å
22	E	68.9	Low	62	Low	94 Å²	94	97.5 Å²	97.5	44%	0.439	51%	0.512	S	S	.	.	H	α-helix	trans	-61.5	-41.7	175.9	-164.8	-152.1	125.5	0	0	111.6	K18 R26	K18-E22 WeakPolarHBondContact O-CB 3.23Å; K18-E22 PolarHBondContact O-N 2.87Å; E22-R26 VanDerWaalsContact O-CB 3.27Å; E22-R26 WeakPolarHBondContact O-CB 3.25Å; E22-R26 WeakPolarHBondContact O-CD 3.5Å; E22-R26 WeakPolarHBondContact O-CG 3.46Å; E22-R26 PolarHBondContact O-N 3.38Å; E22-R26 VanDerWaalsContact OE1-CD 3.23Å; E22-R26 WeakPolarHBondContact OE1-CD 3.36Å; E22-R26 IonicContact OE1-CZ 3.86Å; E22-R26 IonicContact OE1-NE 3.89Å; E22-R26 IonicContact OE1-NH1 2.73Å; E22-R26 PolarHBondContact OE1-NH1 3.34Å
23	I	63	Low	62.9	Low	66 Å²	66	97 Å²	97	34%	0.338	51%	0.509	S	S	.	.	H	α-helix	trans	-66.3	-40.4	177.1	-70.9	-71.3	0	0	0	111.2	F19 V20 D21 I27	F19-I23 HydrophobicContact CD2-CG1 4.31Å; F19-I23 HydrophobicContact CE1-CG1 4.14Å; F19-I23 HydrophobicContact CE2-CD1 4.13Å; F19-I23 HydrophobicContact CE2-CG1 3.9Å; F19-I23 HydrophobicContact CZ-CD1 4.1Å; F19-I23 HydrophobicContact CZ-CG1 3.82Å; F19-I23 WeakPolarHBondContact O-CB 3.38Å; F19-I23 WeakPolarHBondContact O-CG1 3.46Å; F19-I23 PolarHBondContact O-N 3.48Å; V20-I23 PolarHBondContact O-N 2.69Å; D21-I23 VanDerWaalsContact C-N 3.34Å; D21-I23 PolarHBondContact O-N 2.84Å; I23-I27 HydrophobicContact CG2-CD1 3.78Å; I23-I27 WeakPolarHBondContact O-CB 3.28Å; I23-I27 WeakPolarHBondContact O-CD1 3.2Å; I23-I27 WeakPolarHBondContact O-CG1 3.29Å; I23-I27 PolarHBondContact O-N 3.19Å
24	L	66	Low	63.4	Low	76 Å²	76	93.3 Å²	93.3	40%	0.398	49%	0.49	S	S	.	.	H	α-helix	trans	-68.1	-44.7	177.9	-72.9	173.3	0	0	0	112.1	V20 D21 I27 S28	V20-L24 HydrophobicContact CG1-CD1 3.87Å; V20-L24 HydrophobicContact CG1-CG 4.33Å; V20-L24 WeakPolarHBondContact O-CB 3.31Å; V20-L24 VanDerWaalsContact O-CG 3.31Å; V20-L24 WeakPolarHBondContact O-CG 3.4Å; V20-L24 PolarHBondContact O-N 3.49Å; D21-L24 PolarHBondContact O-N 2.87Å; L24-I27 PolarHBondContact O-N 3.21Å; L24-S28 PolarHBondContact O-N 3.42Å
25	D	66.9	Low	63.3	Low	101 Å²	101	89.8 Å²	89.8	54%	0.54	46%	0.464	S	S	.	.	H	α-helix	trans	-58.5	-50.7	174.5	-177.7	68.2	0	0	0	110.6	D21 I27 S28 T29	D21-D25 WeakPolarHBondContact O-CB 3.46Å; D21-D25 PolarHBondContact O-N 2.77Å; D25-I27 VanDerWaalsContact C-N 3.34Å; D25-I27 PolarHBondContact O-N 3.23Å; D25-S28 WeakPolarHBondContact O-CA 3.31Å; D25-S28 WeakPolarHBondContact O-CB 3.34Å; D25-S28 PolarHBondContact O-N 3.11Å; D25-S28 PolarHBondContact O-OG 2.61Å; D25-T29 PolarHBondContact O-N 3.13Å
26	R	67.1	Low	62.9	Low	130 Å²	130	93.6 Å²	93.6	49%	0.491	47%	0.473	S	S	.	.	H	α-helix	trans	-61	-38.7	177.9	-70.2	172.4	71	169.7	4.2	112.5	E22 T29	E22-R26 VanDerWaalsContact O-CB 3.27Å; E22-R26 WeakPolarHBondContact O-CB 3.25Å; E22-R26 WeakPolarHBondContact O-CD 3.5Å; E22-R26 WeakPolarHBondContact O-CG 3.46Å; E22-R26 PolarHBondContact O-N 3.38Å; E22-R26 VanDerWaalsContact OE1-CD 3.23Å; E22-R26 WeakPolarHBondContact OE1-CD 3.36Å; E22-R26 IonicContact OE1-CZ 3.86Å; E22-R26 IonicContact OE1-NE 3.89Å; E22-R26 IonicContact OE1-NH1 2.73Å; E22-R26 PolarHBondContact OE1-NH1 3.34Å; R26-T29 PolarHBondContact O-N 3.1Å; R26-T29 PolarHBondContact O-OG1 2.85Å
27	I	65.2	Low	62.5	Low	81 Å²	81	93.9 Å²	93.9	42%	0.415	48%	0.476	S	S	.	.	H	α-helix	trans	-64.9	-39	172.8	-72.6	166.1	0	0	0	111.3	I23 L24 D25 T29 I30	I23-I27 HydrophobicContact CG2-CD1 3.78Å; I23-I27 WeakPolarHBondContact O-CB 3.28Å; I23-I27 WeakPolarHBondContact O-CD1 3.2Å; I23-I27 WeakPolarHBondContact O-CG1 3.29Å; I23-I27 PolarHBondContact O-N 3.19Å; L24-I27 PolarHBondContact O-N 3.21Å; D25-I27 VanDerWaalsContact C-N 3.34Å; D25-I27 PolarHBondContact O-N 3.23Å; I27-T29 PolarHBondContact O-N 3.28Å; I27-I30 PolarHBondContact O-N 2.85Å; I27-I30 VanDerWaalsContact O-N 3.15Å
28	S	66.7	Low	62.1	Low	88 Å²	88	93.3 Å²	93.3	62%	0.615	47%	0.473	S	S	*	.	H	α-helix	trans	-62.9	-29.9	179.9	85.4	0	0	0	0	113.2	L24 D25 I30	L24-S28 PolarHBondContact O-N 3.42Å; D25-S28 WeakPolarHBondContact O-CA 3.31Å; D25-S28 WeakPolarHBondContact O-CB 3.34Å; D25-S28 PolarHBondContact O-N 3.11Å; D25-S28 PolarHBondContact O-OG 2.61Å; S28-I30 VanDerWaalsContact C-N 3.3Å; S28-I30 PolarHBondContact O-N 2.98Å
29	T	71.1	Confident	61.1	Low	101 Å²	101	94 Å²	94	62%	0.62	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-10.7	177.1	66.6	0	0	0	0	114.6	D25 R26 I27 P31	D25-T29 PolarHBondContact O-N 3.13Å; R26-T29 PolarHBondContact O-N 3.1Å; R26-T29 PolarHBondContact O-OG1 2.85Å; I27-T29 PolarHBondContact O-N 3.28Å; T29-P31 WeakPolarHBondContact O-CD 3.35Å
30	I	68.5	Low	60.2	Low	59 Å²	59	93.7 Å²	93.7	30%	0.303	47%	0.471	S	S	.	.	S	Bend	trans	-86.3	122.1	-176.8	-55.3	173.3	0	0	0	110.2	I27 S28 L32 I34 L35	I27-I30 PolarHBondContact O-N 2.85Å; I27-I30 VanDerWaalsContact O-N 3.15Å; S28-I30 VanDerWaalsContact C-N 3.3Å; S28-I30 PolarHBondContact O-N 2.98Å; I30-L32 PolarHBondContact O-N 2.91Å; I30-I34 HydrophobicContact CG2-CB 4.05Å; I30-I34 HydrophobicContact CG2-CG2 3.97Å; I30-L35 HydrophobicContact CB-CD1 4.42Å; I30-L35 HydrophobicContact CB-CD2 4.01Å; I30-L35 HydrophobicContact CB-CG 4.07Å; I30-L35 HydrophobicContact CD1-CD2 4.08Å; I30-L35 HydrophobicContact CG2-CD2 3.76Å; I30-L35 HydrophobicContact CG2-CG 3.75Å
31	P	68.4	Low	59.1	Low	68 Å²	68	97.4 Å²	97.4	44%	0.442	48%	0.483	S	S	.	.			trans	-52.4	134.8	175.1	-30	36.8	0	0	0	113.8	T29 N33 I34 L35	T29-P31 WeakPolarHBondContact O-CD 3.35Å; P31-N33 WeakPolarHBondContact CB-OD1 3.4Å; P31-N33 PolarHBondContact O-N 3.03Å; P31-N33 VanDerWaalsContact O-N 3.08Å; P31-I34 HydrophobicContact CB-CD1 4.18Å; P31-I34 HydrophobicContact CB-CG1 4.28Å; P31-I34 HydrophobicContact CG-CD1 4.11Å; P31-I34 WeakPolarHBondContact O-CB 3.31Å; P31-I34 PolarHBondContact O-N 3.07Å; P31-L35 PolarHBondContact O-N 2.91Å
32	L	55.9	Low	57.8	Low	122 Å²	122	103.4 Å²	103.4	64%	0.639	50%	0.5	S	S	*	.	H	α-helix	trans	-53.9	-35.6	-172.4	-131.1	85.2	0	0	0	113.8	I30 L35 Y36 Y543	I30-L32 PolarHBondContact O-N 2.91Å; L32-L35 PolarHBondContact O-N 3.17Å; L32-Y36 WeakPolarHBondContact O-CB 3.47Å; L32-Y36 PolarHBondContact O-N 2.81Å; L32-Y543 WeakPolarHBondContact CD1-OH 3.37Å; L32-Y543 WeakPolarHBondContact CG-OH 3.26Å
33	N	60	Low	56.1	Low	109 Å²	109	103.5 Å²	103.5	58%	0.583	51%	0.511	S	S	*	.	H	α-helix	trans	-67.9	-35.5	177.5	60.5	-34.5	0	0	0	112.8	P31 Y36 E37	P31-N33 WeakPolarHBondContact CB-OD1 3.4Å; P31-N33 PolarHBondContact O-N 3.03Å; P31-N33 VanDerWaalsContact O-N 3.08Å; N33-Y36 PolarHBondContact O-N 2.83Å; N33-E37 WeakPolarHBondContact O-CB 3.42Å; N33-E37 PolarHBondContact O-N 2.91Å
34	I	62.6	Low	54.6	Low	75 Å²	75	110 Å²	110	39%	0.385	54%	0.537	S	S	.	.	H	α-helix	trans	-70.8	-39.8	176.3	-62.1	179.4	0	0	0	110	I30 P31 Y36 N38	I30-I34 HydrophobicContact CG2-CB 4.05Å; I30-I34 HydrophobicContact CG2-CG2 3.97Å; P31-I34 HydrophobicContact CB-CD1 4.18Å; P31-I34 HydrophobicContact CB-CG1 4.28Å; P31-I34 HydrophobicContact CG-CD1 4.11Å; P31-I34 WeakPolarHBondContact O-CB 3.31Å; P31-I34 PolarHBondContact O-N 3.07Å; I34-Y36 VanDerWaalsContact C-N 3.35Å; I34-N38 WeakPolarHBondContact CG2-ND2 3.18Å; I34-N38 WeakPolarHBondContact O-CB 3.42Å; I34-N38 PolarHBondContact O-N 3.18Å; I34-N38 PolarHBondContact O-ND2 3.19Å
35	L	50.7	Low	53.2	Low	22 Å²	22	112.2 Å²	112.2	12%	0.115	56%	0.556	C	S	.	*	H	α-helix	trans	-60.7	-44.5	171.7	-67.6	175.8	0	0	0	111.4	I30 P31 L32 Y39 F40	I30-L35 HydrophobicContact CB-CD1 4.42Å; I30-L35 HydrophobicContact CB-CD2 4.01Å; I30-L35 HydrophobicContact CB-CG 4.07Å; I30-L35 HydrophobicContact CD1-CD2 4.08Å; I30-L35 HydrophobicContact CG2-CD2 3.76Å; I30-L35 HydrophobicContact CG2-CG 3.75Å; P31-L35 PolarHBondContact O-N 2.91Å; L32-L35 PolarHBondContact O-N 3.17Å; L35-Y39 HydrophobicContact CD2-CD2 4.16Å; L35-Y39 HydrophobicContact CD2-CE2 4.07Å; L35-Y39 WeakPolarHBondContact O-CD2 3.46Å; L35-Y39 PolarHBondContact O-N 2.82Å; L35-Y39 VanDerWaalsContact O-N 3.1Å; L35-F40 WeakPolarHBondContact O-CD2 3.41Å
36	Y	48.6	Very low	51.5	Low	156 Å²	156	116.8 Å²	116.8	61%	0.612	57%	0.574	S	S	*	*	H	α-helix	trans	-63.1	-49.2	179.5	-165.4	-95.5	0	0	0	112.8	L32 N33 I34 F40	L32-Y36 WeakPolarHBondContact O-CB 3.47Å; L32-Y36 PolarHBondContact O-N 2.81Å; N33-Y36 PolarHBondContact O-N 2.83Å; I34-Y36 VanDerWaalsContact C-N 3.35Å; Y36-F40 HydrophobicContact CD2-CB 4.33Å; Y36-F40 HydrophobicContact CE2-CB 4.48Å; Y36-F40 PolarHBondContact O-N 3.41Å
37	E	49.8	Very low	49.9	Very low	101 Å²	101	114.2 Å²	114.2	47%	0.472	59%	0.588	S	S	.	*	H	α-helix	trans	-60.4	-44.6	178	-89	-77.1	113.9	0	0	112.9	N33 K41	N33-E37 WeakPolarHBondContact O-CB 3.42Å; N33-E37 PolarHBondContact O-N 2.91Å; E37-K41 WeakPolarHBondContact O-CD 2.95Å; E37-K41 WeakPolarHBondContact OE1-CE 3.35Å; E37-K41 IonicContact OE1-NZ 2.67Å; E37-K41 PolarHBondContact OE1-NZ 3.29Å; E37-K41 IonicContact OE2-NZ 2.69Å; E37-K41 PolarHBondContact OE2-NZ 2.9Å
38	N	49.7	Very low	48.2	Very low	111 Å²	111	117.9 Å²	117.9	59%	0.594	61%	0.608	S	S	*	*	H	α-helix	trans	-83.7	-30.6	-171.4	-71.4	-18.6	0	0	0	114.1	I34	I34-N38 WeakPolarHBondContact CG2-ND2 3.18Å; I34-N38 WeakPolarHBondContact O-CB 3.42Å; I34-N38 PolarHBondContact O-N 3.18Å; I34-N38 PolarHBondContact O-ND2 3.19Å
39	Y	44.4	Very low	46.7	Very low	157 Å²	157	123.2 Å²	123.2	62%	0.616	62%	0.624	S	S	*	*	H	α-helix	trans	-117.4	-17.7	-169	-60.6	-81.6	0	0	0	115.1	L35	L35-Y39 HydrophobicContact CD2-CD2 4.16Å; L35-Y39 HydrophobicContact CD2-CE2 4.07Å; L35-Y39 WeakPolarHBondContact O-CD2 3.46Å; L35-Y39 PolarHBondContact O-N 2.82Å; L35-Y39 VanDerWaalsContact O-N 3.1Å
40	F	45.3	Very low	44.7	Very low	95 Å²	95	123.5 Å²	123.5	42%	0.417	63%	0.629	S	S	.	*	S	Bend	trans	-121.3	4.8	-170.1	-62	-81.5	0	0	0	115.1	L35 Y36 Y42 S43	L35-F40 WeakPolarHBondContact O-CD2 3.41Å; Y36-F40 HydrophobicContact CD2-CB 4.33Å; Y36-F40 HydrophobicContact CE2-CB 4.48Å; Y36-F40 PolarHBondContact O-N 3.41Å; F40-Y42 PolarHBondContact O-N 3.14Å; F40-S43 PolarHBondContact O-OG 3.18Å
41	K	40.8	Very low	42.9	Very low	130 Å²	130	127.9 Å²	127.9	57%	0.565	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	7	-170.5	-155.6	158.1	179.4	166.2	0	116.8	E37	E37-K41 WeakPolarHBondContact O-CD 2.95Å; E37-K41 WeakPolarHBondContact OE1-CE 3.35Å; E37-K41 IonicContact OE1-NZ 2.67Å; E37-K41 PolarHBondContact OE1-NZ 3.29Å; E37-K41 IonicContact OE2-NZ 2.69Å; E37-K41 PolarHBondContact OE2-NZ 2.9Å
42	Y	35.2	Very low	41.2	Very low	230 Å²	230	130.2 Å²	130.2	90%	0.902	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.8	16	-171.6	-73.3	-74.1	0	0	0	115.7	F40	F40-Y42 PolarHBondContact O-N 3.14Å
43	S	32.3	Very low	40	Very low	96 Å²	96	130 Å²	130	67%	0.671	68%	0.676	S	S	*	*			trans	-132.8	64.8	-176.7	48.4	0	0	0	0	114.6	F40	F40-S43 PolarHBondContact O-OG 3.18Å
44	K	31.9	Very low	38.6	Very low	201 Å²	201	132.8 Å²	132.8	87%	0.874	69%	0.691	S	S	*	*			trans	-106.6	121.3	163.1	-80.5	-172	176.2	-178.3	0	111.7
45	P	35.6	Very low	36.9	Very low	123 Å²	123	138.2 Å²	138.2	80%	0.799	71%	0.712	S	S	*	*			trans	-88.1	136.1	155.3	32.5	-26.9	0	0	0	110.4
46	E	31.9	Very low	35.9	Very low	197 Å²	197	144 Å²	144	92%	0.921	75%	0.748	S	S	*	*			trans	-84.9	151.3	173.2	-58.3	172.9	143.2	0	0	110.5
47	G	33.6	Very low	34.8	Very low	76 Å²	76	144.6 Å²	144.6	78%	0.784	76%	0.756	S	S	*	*			trans	152	87.5	174	0	0	0	0	0	115.5
48	N	30	Very low	33.9	Very low	159 Å²	159	150.9 Å²	150.9	85%	0.85	78%	0.777	S	S	*	*			trans	-66.6	145.5	-179	-51.4	-36	0	0	0	113.7
49	Q	35.2	Very low	32.8	Very low	200 Å²	200	148.7 Å²	148.7	94%	0.935	78%	0.78	S	S	*	*				176.8	167.9	111.5	-94.6	178.7	0.3	0	0	112
50	S	28.1	Very low	32.2	Very low	106 Å²	106	150.8 Å²	150.8	74%	0.741	80%	0.796	S	S	*	*			trans	-133.1	136.7	-158.6	54.3	0	0	0	0	114.7
51	V	31.6	Very low	31.3	Very low	151 Å²	151	152.3 Å²	152.3	92%	0.915	81%	0.813	S	S	*	*			trans	-139.9	153.3	163	-175.4	0	0	0	0	109.1
52	T	32.8	Very low	30.8	Very low	118 Å²	118	154.2 Å²	154.2	72%	0.724	83%	0.827	S	S	*	*			trans	-110.7	136.3	-159	48.1	0	0	0	0	115.9
53	T	29.4	Very low	30.5	Very low	117 Å²	117	147.8 Å²	147.8	72%	0.718	82%	0.816	S	S	*	*			trans	37.1	131.7	142.4	59.1	0	0	0	0	121.7
54	N	31.8	Very low	30.4	Very low	168 Å²	168	153.6 Å²	153.6	90%	0.898	83%	0.825	S	S	*	*				-156.5	160.3	108	-100.8	-29.3	0	0	0	112.8
55	K	27.1	Very low	30.3	Very low	189 Å²	189	152.3 Å²	152.3	82%	0.822	83%	0.826	S	S	*	*			trans	-105.7	146.4	-175.7	-62.1	175.5	179.5	176.4	0	111.5
56	V	29.6	Very low	30.1	Very low	144 Å²	144	151 Å²	151	87%	0.873	82%	0.819	S	S	*	*			trans	-133.3	146.6	148.1	-179.4	0	0	0	0	107.5
57	Q	25.4	Very low	30.1	Very low	167 Å²	167	147.4 Å²	147.4	78%	0.78	81%	0.807	S	S	*	*			trans	-138.2	118	-170	171.1	-176	-15.6	0	0	109
58	Y	31.1	Very low	30.1	Very low	234 Å²	234	146.4 Å²	146.4	92%	0.918	80%	0.796	S	S	*	*			trans	-147.2	149.4	161.4	-96.7	-80.7	0	0	0	108.6
59	G	26	Very low	30.1	Very low	64 Å²	64	141.4 Å²	141.4	66%	0.66	77%	0.769	S	S	*	*			trans	-163.2	163.4	167.3	0	0	0	0	0	107.8
60	E	31.7	Very low	30.2	Very low	202 Å²	202	141.9 Å²	141.9	94%	0.944	76%	0.763	S	S	*	*			trans	-153.9	159.2	158.8	-126	162.3	-156.2	0	0	110.7
61	T	26	Very low	30.4	Very low	127 Å²	127	141.2 Å²	141.2	78%	0.779	75%	0.746	S	S	*	*			trans	-98.9	160.2	-172	-41	0	0	0	0	109.4
62	I	30.7	Very low	30.7	Very low	169 Å²	169	141.4 Å²	141.4	87%	0.867	74%	0.742	S	S	*	*				-173.7	162.9	129.3	-96.6	154.7	0	0	0	111.6
63	S	29.6	Very low	30.6	Very low	96 Å²	96	142.7 Å²	142.7	67%	0.671	75%	0.745	S	S	*	*			trans	-83.7	156.8	-152.5	51.3	0	0	0	0	118.6
64	Y	28.6	Very low	30.9	Very low	217 Å²	217	147.3 Å²	147.3	85%	0.851	76%	0.755	S	S	*	*			trans	-52.5	165.3	161.9	-35.8	-93.6	0	0	0	115.5
65	I	30.6	Very low	30.8	Very low	174 Å²	174	149.2 Å²	149.2	89%	0.892	76%	0.755	S	S	*	*				-157.9	156.4	130	-101.3	152.3	0	0	0	109.6
66	S	31.1	Very low	30.8	Very low	95 Å²	95	151.9 Å²	151.9	66%	0.664	76%	0.76	S	S	*	*			trans	-100	-167.9	-174.7	57.3	0	0	0	0	111.8
67	N	32	Very low	30.8	Very low	123 Å²	123	149.2 Å²	149.2	66%	0.658	75%	0.748	S	S	*	*			cis	-171.2	166.2	22	-139.6	-20.7	0	0	0	110.5
68	G	33.3	Very low	30.9	Very low	54 Å²	54	151.4 Å²	151.4	56%	0.557	76%	0.755	S	S	*	*			trans	132.5	129.3	162.8	0	0	0	0	0	117.1
69	N	31.1	Very low	30.9	Very low	54 Å²	54	145.8 Å²	145.8	29%	0.289	74%	0.74	S	S	.	*			trans	-161.8	171.7	-161	-58.8	-79.9	0	0	0	115.9	L575 S576 L577	N69-L575 HydrophobicContact CB-CD2 3.97Å; N69-L575 VanDerWaalsContact CG-C 3.45Å; N69-L575 VanDerWaalsContact ND2-CA 3.32Å; N69-L575 WeakPolarHBondContact ND2-CA 3.43Å; N69-L575 WeakPolarHBondContact ND2-CB 3.49Å; N69-L575 PolarHBondContact ND2-O 3.41Å; N69-S576 VanDerWaalsContact CG-N 3.33Å; N69-S576 PolarHBondContact ND2-N 2.85Å; N69-S576 WeakPolarHBondContact OD1-CA 3.25Å; N69-L577 PolarHBondContact OD1-N 2.91Å
70	R	36.1	Very low	31.1	Very low	210 Å²	210	147.3 Å²	147.3	79%	0.792	73%	0.731	S	S	*	*			trans	-159	154.6	149.3	-112.1	162	-173.3	174.2	1.5	114.2	L577	R70-L577 WeakPolarHBondContact O-CB 3.39Å
71	K	32.4	Very low	31.5	Very low	93 Å²	93	138.6 Å²	138.6	40%	0.404	69%	0.693	S	S	.	*			trans	-84.8	162	-174.2	-58.6	-178.6	-173.8	169.4	0	113.5	Q573 Q574	K71-Q573 WeakPolarHBondContact CE-O 3.4Å; K71-Q573 PolarHBondContact NZ-O 3.32Å; K71-Q574 VanDerWaalsContact CE-CD 3.41Å; K71-Q574 VanDerWaalsContact NZ-CD 3.31Å
72	N	39.1	Very low	32.5	Very low	154 Å²	154	135 Å²	135	82%	0.824	67%	0.666	S	S	*	*			trans	-155.8	151.8	144	-113.9	-30	0	0	0	112.4
73	N	30.5	Very low	32.8	Very low	146 Å²	146	127 Å²	127	78%	0.781	63%	0.626	S	S	*	*			trans	-87.1	145.7	-168.1	-56.7	-36.8	0	0	0	113.1
74	K	34.9	Very low	33.2	Very low	213 Å²	213	123 Å²	123	93%	0.926	60%	0.596	S	S	*	*			trans	-153.5	152.2	157.5	-110.2	161.4	-171.7	180	0	111.5
75	K	30.7	Very low	33.8	Very low	209 Å²	209	113 Å²	113	91%	0.909	56%	0.558	S	S	*	*			trans	-68.9	134.1	-171.4	-62.2	173.8	178.3	178.7	0	111	S77	K75-S77 PolarHBondContact O-N 2.76Å
76	R	27.4	Very low	34	Very low	244 Å²	244	108 Å²	108	92%	0.921	53%	0.532	S	S	*	.			trans	-75.4	106.6	164.4	-86.7	-177.8	165.7	173	-6.1	109.4
77	S	29.1	Very low	34.2	Very low	89 Å²	89	105 Å²	105	62%	0.622	52%	0.515	S	S	*	.			trans	-70.5	151.5	149.6	42.6	0	0	0	0	109	K75 I79	K75-S77 PolarHBondContact O-N 2.76Å; S77-I79 PolarHBondContact O-N 3.3Å
78	F	26.7	Very low	34.5	Very low	213 Å²	213	105.2 Å²	105.2	93%	0.934	52%	0.517	S	S	*	.			trans	-73.6	115.5	171.3	-67.5	-93.3	0	0	0	108.5
79	I	31.4	Very low	34.7	Very low	116 Å²	116	105.8 Å²	105.8	60%	0.595	52%	0.516	S	S	*	.			trans	-97	115.7	175.2	-63.8	169.8	0	0	0	107	S77	S77-I79 PolarHBondContact O-N 3.3Å
80	M	30.8	Very low	35.2	Very low	95 Å²	95	109.9 Å²	109.9	47%	0.468	54%	0.538	S	S	.	.			trans	-68	135.4	164.4	-60.7	171.7	69.9	0	0	108	K82 D132	M80-K82 PolarHBondContact O-N 3.32Å; M80-D132 CarbonylContact C-O 3.48Å; M80-D132 HydrophobicContact CB-CB 4.1Å; M80-D132 HydrophobicContact CE-CB 4.38Å; M80-D132 HydrophobicContact CG-CB 4.07Å
81	S	39.3	Very low	35.3	Very low	20 Å²	20	103.3 Å²	103.3	14%	0.14	52%	0.524	C	S	.	.			trans	-60.4	101.4	178.8	57.6	0	0	0	0	110.7	N131 D132	S81-N131 PolarHBondContact OG-O 2.61Å; S81-N131 VanDerWaalsContact OG-O 3.06Å; S81-D132 PolarHBondContact N-O 2.96Å; S81-D132 PolarHBondContact OG-O 3Å
82	K	47.3	Very low	35.3	Very low	50 Å²	50	105.4 Å²	105.4	22%	0.217	55%	0.545	C	S	.	.			trans	-63.3	140.1	-176.8	-68.8	-167.4	170.5	-166	0	110.9	M80 Y84 F177 E217	M80-K82 PolarHBondContact O-N 3.32Å; K82-Y84 HydrophobicContact CB-CE2 3.73Å; K82-F177 HydrophobicContact CD-CD1 3.8Å; K82-E217 IonicContact NZ-OE1 3.65Å; K82-E217 PolarHBondContact NZ-OE1 3.43Å
83	G	36.9	Very low	35.1	Very low	3 Å²	3	107.8 Å²	107.8	3%	0.031	54%	0.544	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	143.9	176.8	0	0	0	0	0	111.4	W109 Q178	G83-W109 CarbonylContact C-O 3.51Å; G83-W109 VanDerWaalsContact CA-O 3.32Å; G83-W109 WeakPolarHBondContact CA-O 3.5Å; G83-Q178 PolarHBondContact N-O 3.15Å; G83-Q178 CarbonylContact O-C 3.6Å; G83-Q178 VanDerWaalsContact O-CG 3.28Å; G83-Q178 WeakPolarHBondContact O-CG 3.29Å; G83-Q178 PolarHBondContact O-N 3.32Å
84	Y	37.8	Very low	35.1	Very low	11 Å²	11	103.5 Å²	103.5	4%	0.043	53%	0.525	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	143.9	-179.8	-48.3	-117.5	0	0	0	110.5	K82 T108 W109 W118 F175 I176 F177	K82-Y84 HydrophobicContact CB-CE2 3.73Å; Y84-T108 WeakPolarHBondContact O-CA 3.4Å; Y84-W109 HydrophobicContact CD2-CB 4.35Å; Y84-W109 PolarHBondContact N-O 3.27Å; Y84-W109 PolarHBondContact O-N 2.83Å; Y84-W118 HydrophobicContact CD2-CH2 4.17Å; Y84-W118 AromaticContact CD2-CZ3 3.73Å; Y84-W118 HydrophobicContact CD2-CZ3 3.73Å; Y84-W118 HydrophobicContact CE2-CE3 4.31Å; Y84-W118 AromaticContact CE2-CH2 3.21Å; Y84-W118 HydrophobicContact CE2-CH2 3.21Å; Y84-W118 HydrophobicContact CE2-CZ2 4.3Å; Y84-W118 AromaticContact CE2-CZ3 3.2Å; Y84-W118 HydrophobicContact CE2-CZ3 3.2Å; Y84-W118 AromaticContact CZ-CH2 3.49Å; Y84-W118 VanDerWaalsContact CZ-CH2 3.49Å; Y84-W118 AromaticContact CZ-CZ3 3.93Å; Y84-W118 VanDerWaalsContact OH-CH2 3.24Å; Y84-W118 WeakPolarHBondContact OH-CH2 3.16Å; Y84-F175 HydrophobicContact CD1-CB 3.91Å; Y84-F175 HydrophobicContact CE1-CB 4.43Å; Y84-I176 WeakPolarHBondContact CD1-O 3.21Å; Y84-F177 HydrophobicContact CE1-CB 4.31Å; Y84-F177 AromaticContact CE1-CD1 3.41Å; Y84-F177 HydrophobicContact CE1-CD1 3.41Å; Y84-F177 VanDerWaalsContact CE1-CD1 3.41Å; Y84-F177 HydrophobicContact CE1-CD2 4.24Å; Y84-F177 AromaticContact CE1-CE1 3.71Å; Y84-F177 HydrophobicContact CE1-CE1 3.71Å; Y84-F177 HydrophobicContact CE1-CE2 4.46Å; Y84-F177 AromaticContact CE1-CG 3.71Å; Y84-F177 HydrophobicContact CE1-CG 3.71Å; Y84-F177 HydrophobicContact CE1-CZ 4.21Å; Y84-F177 AromaticContact CZ-CD1 3.54Å; Y84-F177 AromaticContact CZ-CE1 3.8Å; Y84-F177 WeakPolarHBondContact OH-CD1 3.35Å; Y84-F177 WeakPolarHBondContact OH-CE1 3.3Å
85	V	40.9	Very low	35	Very low	8 Å²	8	97 Å²	97	5%	0.048	51%	0.505	C	S	.	.			trans	-125.7	138.7	169.4	167	0	0	0	0	106.7	P106 Q178	V85-P106 HydrophobicContact CG1-CB 3.99Å; V85-P106 HydrophobicContact CG1-CG 3.43Å; V85-P106 VanDerWaalsContact CG1-CG 3.43Å; V85-Q178 VanDerWaalsContact CG2-NE2 3.32Å
86	I	35.2	Very low	35.3	Very low	69 Å²	69	97.7 Å²	97.7	35%	0.354	50%	0.501	S	S	.	.	B	Isolated β-bridge	trans	-70.5	135	174.7	-57.6	168.9	0	0	0	108.1	F175	I86-F175 HydrophobicContact CG1-CE1 4.35Å
87	G	35.3	Very low	36.1	Very low	30 Å²	30	92.7 Å²	92.7	31%	0.309	49%	0.491	S	S	.	.			trans	-158.2	119.5	178.6	0	0	0	0	0	112.7	A89	G87-A89 PolarHBondContact O-N 3.37Å
88	D	38	Very low	36.4	Very low	129 Å²	129	93.3 Å²	93.3	69%	0.69	49%	0.488	S	S	*	.			trans	-68.3	125.7	-179.6	-55.2	-41.3	0	0	0	111.1	D90	D88-D90 VanDerWaalsContact C-N 3.34Å; D88-D90 PolarHBondContact O-N 2.92Å
89	A	38.8	Very low	37.2	Very low	66 Å²	66	86.4 Å²	86.4	55%	0.545	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-35.8	178.6	0	0	0	0	0	112.7	G87 R207	G87-A89 PolarHBondContact O-N 3.37Å; A89-R207 PolarHBondContact O-NH2 2.92Å
90	D	40.2	Very low	38.1	Very low	140 Å²	140	82.1 Å²	82.1	75%	0.749	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	14.7	-163.2	-69.7	-34.4	0	0	0	115.3	D88 T92	D88-D90 VanDerWaalsContact C-N 3.34Å; D88-D90 PolarHBondContact O-N 2.92Å; D90-T92 VanDerWaalsContact C-N 3.29Å; D90-T92 PolarHBondContact O-N 2.79Å; D90-T92 PolarHBondContact O-OG1 2.7Å
91	S	38.6	Very low	38.8	Very low	71 Å²	71	84.6 Å²	84.6	50%	0.497	45%	0.448	S	S	.	.			trans	-73.8	77.7	177.7	66.6	0	0	0	0	112.1	Y93	S91-Y93 PolarHBondContact O-N 3.11Å
92	T	33.3	Very low	39.4	Very low	137 Å²	137	92 Å²	92	84%	0.84	48%	0.481	S	S	*	.			trans	-69.6	15.8	-175.9	-36.7	0	0	0	0	114.7	D90	D90-T92 VanDerWaalsContact C-N 3.29Å; D90-T92 PolarHBondContact O-N 2.79Å; D90-T92 PolarHBondContact O-OG1 2.7Å
93	Y	33.3	Very low	39.7	Very low	205 Å²	205	95.8 Å²	95.8	80%	0.804	50%	0.499	S	S	*	.			trans	-143.1	114.3	-177.9	-149.7	-98.8	0	0	0	110.7	S91 P95	S91-Y93 PolarHBondContact O-N 3.11Å; Y93-P95 WeakPolarHBondContact O-CD 3.35Å
94	C	31.7	Very low	41.2	Very low	56 Å²	56	103.2 Å²	103.2	38%	0.378	54%	0.538	S	S	.	.			trans	-109.1	104.6	179.4	-175.5	0	0	0	0	109.9	R96	C94-R96 PolarHBondContact O-N 3.43Å
95	P	32.4	Very low	43	Very low	77 Å²	77	104.5 Å²	104.5	50%	0.5	55%	0.545	S	S	.	.			trans	-62.9	134.1	173.3	-19.8	32.8	0	0	0	110.4	Y93 I97	Y93-P95 WeakPolarHBondContact O-CD 3.35Å; P95-I97 PolarHBondContact O-N 3.06Å
96	R	36.6	Very low	44.9	Very low	222 Å²	222	106.5 Å²	106.5	84%	0.838	56%	0.559	S	S	*	*	S	Bend	trans	-57	126	-179.7	-70.8	173.2	171.6	150.4	-3.8	111.1	C94 N98	C94-R96 PolarHBondContact O-N 3.43Å; R96-N98 PolarHBondContact O-N 3.12Å; R96-N98 PolarHBondContact O-OD1 3.25Å
97	I	44.9	Very low	47.2	Very low	140 Å²	140	103.3 Å²	103.3	72%	0.718	54%	0.543	S	S	*	.	S	Bend	trans	69.4	-36.4	153.2	-62.1	170	0	0	0	117	P95 I99	P95-I97 PolarHBondContact O-N 3.06Å; I97-I99 VanDerWaalsContact C-N 3.27Å; I97-I99 PolarHBondContact O-N 3.42Å; I97-I99 VanDerWaalsContact O-N 3.13Å
98	N	35.8	Very low	49.6	Very low	102 Å²	102	101.9 Å²	101.9	55%	0.545	53%	0.528	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-20	-169.5	-69.8	23.4	0	0	0	115.5	R96 I100 E101	R96-N98 PolarHBondContact O-N 3.12Å; R96-N98 PolarHBondContact O-OD1 3.25Å; N98-I100 PolarHBondContact O-N 3.38Å; N98-I100 VanDerWaalsContact O-N 3.1Å; N98-E101 PolarHBondContact O-N 3.49Å; N98-E101 VanDerWaalsContact O-N 3.11Å
99	I	43.5	Very low	52	Low	67 Å²	67	96.6 Å²	96.6	34%	0.344	50%	0.499	S	S	.	.	H	α-helix	trans	-54.4	-34.5	-175.9	-57	176.3	0	0	0	112	I97 Q103	I97-I99 VanDerWaalsContact C-N 3.27Å; I97-I99 PolarHBondContact O-N 3.42Å; I97-I99 VanDerWaalsContact O-N 3.13Å; I99-Q103 WeakPolarHBondContact O-CB 3.28Å
100	I	49.9	Very low	54.3	Low	26 Å²	26	93.4 Å²	93.4	13%	0.133	47%	0.473	C	S	.	.	H	α-helix	trans	-87.1	-24.3	-177.1	-69.6	175.8	0	0	0	113	N98 K279 L282 Y287	N98-I100 PolarHBondContact O-N 3.38Å; N98-I100 VanDerWaalsContact O-N 3.1Å; I100-K279 HydrophobicContact CG2-CG 4.2Å; I100-K279 WeakPolarHBondContact O-CE 3.32Å; I100-K279 PolarHBondContact O-NZ 3.21Å; I100-L282 HydrophobicContact CD1-CB 4.04Å; I100-L282 HydrophobicContact CD1-CD1 4.1Å; I100-Y287 HydrophobicContact CD1-CE2 3.56Å; I100-Y287 VanDerWaalsContact CD1-OH 3.25Å; I100-Y287 WeakPolarHBondContact CD1-OH 3.46Å
101	E	46.1	Very low	56.6	Low	148 Å²	148	88.7 Å²	88.7	69%	0.692	45%	0.446	S	S	*	.	H	α-helix	trans	-78.5	-45.9	-174.2	-62.6	-147	120.8	0	0	112.2	N98 K279	N98-E101 PolarHBondContact O-N 3.49Å; N98-E101 VanDerWaalsContact O-N 3.11Å; E101-K279 PolarHBondContact O-NZ 3.32Å
102	E	50.1	Low	59.1	Low	176 Å²	176	85.3 Å²	85.3	82%	0.822	42%	0.422	S	S	*	.	H	α-helix	trans	-104.5	-24.9	-172.7	-64.3	-170.7	135	0	0	115.6
103	Q	54.1	Low	61.7	Low	128 Å²	128	81.2 Å²	81.2	60%	0.598	40%	0.4	S	S	*	.	S	Bend	trans	-93	140.4	-179.3	-60.5	-178.9	-11.6	0	0	111.6	I99	I99-Q103 WeakPolarHBondContact O-CB 3.28Å
104	D	68.6	Low	64.3	Low	159 Å²	159	76.1 Å²	76.1	85%	0.85	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-75.2	135.1	169	-88.5	-32.8	0	0	0	109.6
105	L	76.5	Confident	67.2	Low	38 Å²	38	75.5 Å²	75.5	20%	0.199	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-62.5	136.6	176.1	-71.8	168.4	0	0	0	110.1	C125 V278 L282	L105-C125 HydrophobicContact CB-CB 3.82Å; L105-C125 HydrophobicContact CD1-CB 4.4Å; L105-C125 PolarHBondContact O-SG 2.9Å; L105-C125 VanDerWaalsContact O-SG 3.37Å; L105-V278 HydrophobicContact CD1-CB 3.83Å; L105-V278 HydrophobicContact CD1-CG1 3.59Å; L105-L282 HydrophobicContact CD1-CD1 4.15Å; L105-L282 HydrophobicContact CD2-CD1 4.4Å
106	P	79.4	Confident	69.9	Low	50 Å²	50	75.2 Å²	75.2	33%	0.325	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-57.8	146.3	-177.3	23.5	-34.5	0	0	0	111.9	V85 C125	V85-P106 HydrophobicContact CG1-CB 3.99Å; V85-P106 HydrophobicContact CG1-CG 3.43Å; V85-P106 VanDerWaalsContact CG1-CG 3.43Å; P106-C125 WeakPolarHBondContact O-CA 3.43Å
107	G	84.2	Confident	72.4	Confident	3 Å²	3	67.1 Å²	67.1	3%	0.031	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-74.2	164.6	173.9	0	0	0	0	0	112.5	Y120 L121 V124	G107-Y120 WeakPolarHBondContact CA-OH 3.24Å; G107-Y120 PolarHBondContact N-OH 3.09Å; G107-Y120 WeakPolarHBondContact O-CE2 3.43Å; G107-L121 WeakPolarHBondContact CA-O 3.18Å; G107-V124 CarbonylContact C-O 3.59Å
108	T	85.9	Confident	74.5	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	126.8	176.8	-63.6	0	0	0	0	110.1	Y84 L121 V124 P127 L130	Y84-T108 WeakPolarHBondContact O-CA 3.4Å; T108-L121 PolarHBondContact N-O 2.92Å; T108-L121 WeakPolarHBondContact O-CA 3.49Å; T108-L121 WeakPolarHBondContact O-CB 3.29Å; T108-L121 PolarHBondContact O-N 2.85Å; T108-V124 WeakPolarHBondContact CB-O 3.43Å; T108-V124 PolarHBondContact N-O 2.87Å; T108-V124 PolarHBondContact OG1-O 2.91Å; T108-P127 HydrophobicContact CG2-CB 3.8Å; T108-L130 HydrophobicContact CG2-CD1 3.84Å
109	W	87.7	Confident	77	Confident	17 Å²	17	58.3 Å²	58.3	6%	0.064	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	142	157.9	-68.4	90.2	0	0	0	110.1	G83 Y84 W118 R119 Y120 D165 A168 F175	G83-W109 CarbonylContact C-O 3.51Å; G83-W109 VanDerWaalsContact CA-O 3.32Å; G83-W109 WeakPolarHBondContact CA-O 3.5Å; Y84-W109 HydrophobicContact CD2-CB 4.35Å; Y84-W109 PolarHBondContact N-O 3.27Å; Y84-W109 PolarHBondContact O-N 2.83Å; W109-W118 HydrophobicContact CE3-CB 4.3Å; W109-W118 HydrophobicContact CZ3-CB 4.47Å; W109-R119 CarbonylContact C-O 3.58Å; W109-R119 WeakPolarHBondContact CA-O 3.44Å; W109-Y120 AromaticContact CD1-CD2 3.74Å; W109-Y120 AromaticContact CD2-CD2 3.84Å; W109-Y120 HydrophobicContact CD2-CD2 3.84Å; W109-Y120 HydrophobicContact CD2-CG 4.3Å; W109-Y120 AromaticContact CE2-CD2 3.63Å; W109-Y120 AromaticContact CG-CD2 3.91Å; W109-Y120 HydrophobicContact CG-CD2 3.91Å; W109-Y120 HydrophobicContact CZ2-CD2 4.22Å; W109-Y120 HydrophobicContact CZ2-CG 4.2Å; W109-Y120 AromaticContact NE1-CD2 3.56Å; W109-Y120 AromaticContact NE1-CE2 3.9Å; W109-D165 HydrophobicContact CH2-CB 4.16Å; W109-D165 HydrophobicContact CZ3-CB 3.83Å; W109-A168 HydrophobicContact CE3-CB 4.21Å; W109-A168 HydrophobicContact CH2-CB 4.3Å; W109-A168 HydrophobicContact CZ3-CB 3.75Å; W109-F175 AromaticContact CD1-CE1 3.96Å; W109-F175 HydrophobicContact CG-CE1 4.45Å; W109-F175 AromaticContact NE1-CE1 3.82Å
110	V	86.9	Confident	79.2	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	145.3	179.9	63.5	0	0	0	0	111.9	W118 R119 L121 L130 W134	V110-W118 VanDerWaalsContact C-CE3 3.45Å; V110-W118 VanDerWaalsContact C-CZ3 3.46Å; V110-R119 HydrophobicContact CG1-CB 4.24Å; V110-R119 PolarHBondContact N-O 2.85Å; V110-R119 PolarHBondContact O-N 3Å; V110-L121 HydrophobicContact CG1-CD1 3.65Å; V110-L121 HydrophobicContact CG1-CG 3.94Å; V110-L130 HydrophobicContact CB-CD1 4Å; V110-L130 HydrophobicContact CG2-CD1 3.89Å; V110-W134 HydrophobicContact CB-CE3 4.33Å; V110-W134 HydrophobicContact CG1-CD2 3.77Å; V110-W134 HydrophobicContact CG1-CE3 3.5Å; V110-W134 VanDerWaalsContact CG1-CE3 3.5Å; V110-W134 HydrophobicContact CG1-CH2 3.91Å; V110-W134 HydrophobicContact CG1-CZ2 4.14Å; V110-W134 HydrophobicContact CG1-CZ3 3.58Å; V110-W134 HydrophobicContact CG2-CB 4.07Å; V110-W134 HydrophobicContact CG2-CD2 4.03Å; V110-W134 HydrophobicContact CG2-CE3 3.85Å; V110-W134 HydrophobicContact CG2-CG 4.14Å
111	E	89	Confident	81	Confident	40 Å²	40	58.2 Å²	58.2	19%	0.187	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	135.6	173.6	-153.7	-165.6	141.1	0	0	110.5	S113 S116 W118	E111-S113 PolarHBondContact O-N 2.97Å; E111-S116 VanDerWaalsContact OE1-CA 3.29Å; E111-S116 WeakPolarHBondContact OE1-CA 3.47Å; E111-S116 WeakPolarHBondContact OE1-CB 3.49Å; E111-S116 PolarHBondContact OE1-OG 3.48Å; E111-W118 HydrophobicContact CB-CE3 4.23Å; E111-W118 HydrophobicContact CB-CH2 3.54Å; E111-W118 HydrophobicContact CB-CZ2 4.13Å; E111-W118 HydrophobicContact CB-CZ3 3.63Å; E111-W118 HydrophobicContact CG-CH2 3.92Å; E111-W118 HydrophobicContact CG-CZ2 3.98Å; E111-W118 HydrophobicContact CG-CZ3 4.31Å
112	C	90.7	Very high	82.9	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.287	C	S	.	.			trans	-79.7	111.1	171.5	173.8	0	0	0	0	111.9	F114 C115 S116 K117 W134 C136	C112-F114 PolarHBondContact O-N 3.24Å; C112-C115 PolarHBondContact O-N 3.25Å; C112-C115 PolarHBondContact SG-SG 2.85Å; C112-S116 WeakPolarHBondContact O-CA 3.36Å; C112-S116 PolarHBondContact O-N 3.46Å; C112-K117 PolarHBondContact N-O 3Å; C112-W134 HydrophobicContact CB-CZ3 4.22Å; C112-C136 VanDerWaalsContact CB-SG 3.54Å; C112-C136 PolarHBondContact SG-N 3.36Å
113	S	89.4	Confident	84.6	Confident	52 Å²	52	54.7 Å²	54.7	36%	0.364	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-21.6	-178.3	66.8	0	0	0	0	116.3	E111 S133 W134	E111-S113 PolarHBondContact O-N 2.97Å; S113-S133 PolarHBondContact OG-O 3.1Å; S113-W134 WeakPolarHBondContact CB-O 3.28Å; S113-W134 PolarHBondContact N-O 2.98Å; S113-W134 PolarHBondContact OG-O 2.69Å; S113-W134 VanDerWaalsContact OG-O 3.11Å
114	F	87.5	Confident	86.2	Confident	98 Å²	98	50.1 Å²	50.1	43%	0.43	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-19.4	175.6	-69.2	-50.9	0	0	0	116.5	C112 Y135 Y549	C112-F114 PolarHBondContact O-N 3.24Å; F114-Y135 VanDerWaalsContact CD2-CB 3.48Å; F114-Y135 HydrophobicContact CD2-CD1 4.29Å; F114-Y135 AromaticContact CD2-CD2 3.52Å; F114-Y135 HydrophobicContact CD2-CD2 3.52Å; F114-Y135 HydrophobicContact CD2-CE2 4.27Å; F114-Y135 AromaticContact CD2-CG 3.53Å; F114-Y135 HydrophobicContact CD2-CG 3.53Å; F114-Y135 AromaticContact CE2-CD1 3.83Å; F114-Y135 HydrophobicContact CE2-CD1 3.83Å; F114-Y135 AromaticContact CE2-CD2 3.56Å; F114-Y135 HydrophobicContact CE2-CD2 3.56Å; F114-Y135 HydrophobicContact CE2-CE1 4.22Å; F114-Y135 AromaticContact CE2-CE2 3.93Å; F114-Y135 HydrophobicContact CE2-CE2 3.93Å; F114-Y135 AromaticContact CE2-CG 3.52Å; F114-Y135 HydrophobicContact CE2-CG 3.52Å; F114-Y549 WeakPolarHBondContact CE1-OH 3.23Å
115	C	91.1	Very high	87	Confident	42 Å²	42	44 Å²	44	28%	0.284	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-140.5	2.8	-174.5	70.5	0	0	0	0	115.5	C112 K117 C160	C112-C115 PolarHBondContact O-N 3.25Å; C112-C115 PolarHBondContact SG-SG 2.85Å; C115-K117 PolarHBondContact O-N 3.19Å; C115-C160 HydrophobicContact CB-CB 3.88Å
116	S	89.4	Confident	87.5	Confident	72 Å²	72	42.1 Å²	42.1	50%	0.503	22%	0.222	S	C	.	.			trans	53.3	14.9	-179	-67.5	0	0	0	0	116.3	E111 C112	E111-S116 VanDerWaalsContact OE1-CA 3.29Å; E111-S116 WeakPolarHBondContact OE1-CA 3.47Å; E111-S116 WeakPolarHBondContact OE1-CB 3.49Å; E111-S116 PolarHBondContact OE1-OG 3.48Å; C112-S116 WeakPolarHBondContact O-CA 3.36Å; C112-S116 PolarHBondContact O-N 3.46Å
117	K	89.5	Confident	87.9	Confident	52 Å²	52	40.2 Å²	40.2	23%	0.226	21%	0.21	C	C	.	.			trans	-78.7	138	173	-66.8	178.1	179.7	170.6	0	111	C112 C115 C160 G161 E162 E164	C112-K117 PolarHBondContact N-O 3Å; C115-K117 PolarHBondContact O-N 3.19Å; K117-C160 PolarHBondContact NZ-O 2.91Å; K117-G161 PolarHBondContact NZ-O 3.3Å; K117-G161 VanDerWaalsContact NZ-O 3.09Å; K117-E162 WeakPolarHBondContact CD-O 3.29Å; K117-E162 WeakPolarHBondContact CE-O 3.48Å; K117-E162 PolarHBondContact NZ-O 2.88Å; K117-E164 VanDerWaalsContact CA-OE2 3.22Å; K117-E164 WeakPolarHBondContact CA-OE2 3.3Å
118	W	88.8	Confident	88	Confident	55 Å²	55	40.7 Å²	40.7	21%	0.208	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	141.7	173.2	-68.5	104.7	0	0	0	112.9	Y84 W109 V110 E111 E164 A168	Y84-W118 HydrophobicContact CD2-CH2 4.17Å; Y84-W118 AromaticContact CD2-CZ3 3.73Å; Y84-W118 HydrophobicContact CD2-CZ3 3.73Å; Y84-W118 HydrophobicContact CE2-CE3 4.31Å; Y84-W118 AromaticContact CE2-CH2 3.21Å; Y84-W118 HydrophobicContact CE2-CH2 3.21Å; Y84-W118 HydrophobicContact CE2-CZ2 4.3Å; Y84-W118 AromaticContact CE2-CZ3 3.2Å; Y84-W118 HydrophobicContact CE2-CZ3 3.2Å; Y84-W118 AromaticContact CZ-CH2 3.49Å; Y84-W118 VanDerWaalsContact CZ-CH2 3.49Å; Y84-W118 AromaticContact CZ-CZ3 3.93Å; Y84-W118 VanDerWaalsContact OH-CH2 3.24Å; Y84-W118 WeakPolarHBondContact OH-CH2 3.16Å; W109-W118 HydrophobicContact CE3-CB 4.3Å; W109-W118 HydrophobicContact CZ3-CB 4.47Å; V110-W118 VanDerWaalsContact C-CE3 3.45Å; V110-W118 VanDerWaalsContact C-CZ3 3.46Å; E111-W118 HydrophobicContact CB-CE3 4.23Å; E111-W118 HydrophobicContact CB-CH2 3.54Å; E111-W118 HydrophobicContact CB-CZ2 4.13Å; E111-W118 HydrophobicContact CB-CZ3 3.63Å; E111-W118 HydrophobicContact CG-CH2 3.92Å; E111-W118 HydrophobicContact CG-CZ2 3.98Å; E111-W118 HydrophobicContact CG-CZ3 4.31Å; W118-E164 HydrophobicContact CB-CG 3.94Å; W118-E164 PolarHBondContact N-OE2 3.04Å; W118-A168 HydrophobicContact CB-CB 3.4Å; W118-A168 VanDerWaalsContact CB-CB 3.4Å; W118-A168 HydrophobicContact CG-CB 3.75Å
119	R	89.1	Confident	88	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.008	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	130.9	178.7	-64.4	-64.1	175.6	-149.3	-8.2	111.1	W109 V110 W134 C136 E162 S163 D165	W109-R119 CarbonylContact C-O 3.58Å; W109-R119 WeakPolarHBondContact CA-O 3.44Å; V110-R119 HydrophobicContact CG1-CB 4.24Å; V110-R119 PolarHBondContact N-O 2.85Å; V110-R119 PolarHBondContact O-N 3Å; R119-W134 HydrophobicContact CB-CH2 3.79Å; R119-W134 HydrophobicContact CB-CZ3 3.99Å; R119-W134 HydrophobicContact CG-CH2 3.85Å; R119-W134 HydrophobicContact CG-CZ3 3.92Å; R119-C136 PolarHBondContact NE-SG 2.87Å; R119-C136 VanDerWaalsContact NE-SG 3.37Å; R119-E162 IonicContact CZ-OE2 2.63Å; R119-E162 IonicContact NH1-OE2 3.65Å; R119-E162 PolarHBondContact NH2-O 2.94Å; R119-E162 IonicContact NH2-OE2 2.83Å; R119-S163 PolarHBondContact NH1-O 2.81Å; R119-S163 PolarHBondContact NH2-O 2.87Å; R119-S163 VanDerWaalsContact NH2-O 3.17Å; R119-D165 WeakPolarHBondContact CA-OD2 3.41Å; R119-D165 IonicContact CZ-OD1 3.95Å; R119-D165 IonicContact NH1-OD1 3.94Å; R119-D165 PolarHBondContact NH1-OD1 3.27Å
120	Y	89.4	Confident	87.9	Confident	78 Å²	78	45.4 Å²	45.4	31%	0.306	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	129.8	172.9	-172.2	-128.8	0	0	0	111.2	G107 W109 P122 D165	G107-Y120 WeakPolarHBondContact CA-OH 3.24Å; G107-Y120 PolarHBondContact N-OH 3.09Å; G107-Y120 WeakPolarHBondContact O-CE2 3.43Å; W109-Y120 AromaticContact CD1-CD2 3.74Å; W109-Y120 AromaticContact CD2-CD2 3.84Å; W109-Y120 HydrophobicContact CD2-CD2 3.84Å; W109-Y120 HydrophobicContact CD2-CG 4.3Å; W109-Y120 AromaticContact CE2-CD2 3.63Å; W109-Y120 AromaticContact CG-CD2 3.91Å; W109-Y120 HydrophobicContact CG-CD2 3.91Å; W109-Y120 HydrophobicContact CZ2-CD2 4.22Å; W109-Y120 HydrophobicContact CZ2-CG 4.2Å; W109-Y120 AromaticContact NE1-CD2 3.56Å; W109-Y120 AromaticContact NE1-CE2 3.9Å; Y120-P122 HydrophobicContact CD1-CB 4.13Å; Y120-P122 HydrophobicContact CD1-CG 4.29Å; Y120-P122 HydrophobicContact CE1-CB 3.68Å; Y120-P122 HydrophobicContact CE1-CG 4.33Å; Y120-P122 VanDerWaalsContact O-CD 3.23Å; Y120-P122 WeakPolarHBondContact O-CD 3.49Å; Y120-D165 PolarHBondContact N-OD2 3.12Å
121	L	88.4	Confident	87.8	Confident	12 Å²	12	50.3 Å²	50.3	6%	0.063	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	81.9	177.5	-58.5	-176.5	0	0	0	110.1	G107 T108 V110 K123 V124 L130 W134 N139	G107-L121 WeakPolarHBondContact CA-O 3.18Å; T108-L121 PolarHBondContact N-O 2.92Å; T108-L121 WeakPolarHBondContact O-CA 3.49Å; T108-L121 WeakPolarHBondContact O-CB 3.29Å; T108-L121 PolarHBondContact O-N 2.85Å; V110-L121 HydrophobicContact CG1-CD1 3.65Å; V110-L121 HydrophobicContact CG1-CG 3.94Å; L121-K123 PolarHBondContact O-N 2.9Å; L121-V124 HydrophobicContact CB-CB 4.09Å; L121-V124 HydrophobicContact CB-CG2 4.1Å; L121-V124 HydrophobicContact CD1-CG2 4.2Å; L121-V124 PolarHBondContact O-N 2.85Å; L121-V124 VanDerWaalsContact O-N 3.07Å; L121-L130 HydrophobicContact CD1-CD1 4.22Å; L121-L130 HydrophobicContact CD1-CD2 3.76Å; L121-W134 HydrophobicContact CD1-CZ2 4.13Å; L121-W134 HydrophobicContact CD2-CH2 4.47Å; L121-W134 HydrophobicContact CD2-CZ2 3.97Å; L121-N139 HydrophobicContact CD2-CB 4.45Å; L121-N139 WeakPolarHBondContact CD2-ND2 3.39Å
122	P	85.3	Confident	87.3	Confident	86 Å²	86	52 Å²	52	56%	0.558	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	12.9	-178	28	-37	0	0	0	115	Y120	Y120-P122 HydrophobicContact CD1-CB 4.13Å; Y120-P122 HydrophobicContact CD1-CG 4.29Å; Y120-P122 HydrophobicContact CE1-CB 3.68Å; Y120-P122 HydrophobicContact CE1-CG 4.33Å; Y120-P122 VanDerWaalsContact O-CD 3.23Å; Y120-P122 WeakPolarHBondContact O-CD 3.49Å
123	K	85.6	Confident	87	Confident	165 Å²	165	54.8 Å²	54.8	72%	0.717	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.2	4.6	179.7	-59.2	-167.3	177.1	-165.6	0	113.3	L121	L121-K123 PolarHBondContact O-N 2.9Å
124	V	86.8	Confident	87	Confident	31 Å²	31	52.8 Å²	52.8	19%	0.188	28%	0.276	C	S	.	.			trans	-119.6	97.4	174.7	-179.3	0	0	0	0	106	G107 T108 L121 D126 L130	G107-V124 CarbonylContact C-O 3.59Å; T108-V124 WeakPolarHBondContact CB-O 3.43Å; T108-V124 PolarHBondContact N-O 2.87Å; T108-V124 PolarHBondContact OG1-O 2.91Å; L121-V124 HydrophobicContact CB-CB 4.09Å; L121-V124 HydrophobicContact CB-CG2 4.1Å; L121-V124 HydrophobicContact CD1-CG2 4.2Å; L121-V124 PolarHBondContact O-N 2.85Å; L121-V124 VanDerWaalsContact O-N 3.07Å; V124-D126 WeakPolarHBondContact CG1-O 3.39Å; V124-L130 HydrophobicContact CG1-CD2 3.95Å; V124-L130 HydrophobicContact CG1-CG 4.06Å; V124-L130 HydrophobicContact CG2-CD2 4.22Å
125	C	86.1	Confident	87.1	Confident	30 Å²	30	48.4 Å²	48.4	20%	0.203	26%	0.257	C	S	.	.			trans	-88	-17.5	178.1	-49.1	0	0	0	0	112	L105 P106 S181 V278	L105-C125 HydrophobicContact CB-CB 3.82Å; L105-C125 HydrophobicContact CD1-CB 4.4Å; L105-C125 PolarHBondContact O-SG 2.9Å; L105-C125 VanDerWaalsContact O-SG 3.37Å; P106-C125 WeakPolarHBondContact O-CA 3.43Å; C125-S181 PolarHBondContact O-OG 3.03Å; C125-V278 HydrophobicContact CB-CG2 4.34Å
126	D	87.8	Confident	87.1	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.243	C	C	.	.			trans	-112.6	100.1	-178.8	178.2	-1.1	0	0	0	108.7	V124 S128 Q129 S181 S184 V278 R281	V124-D126 WeakPolarHBondContact CG1-O 3.39Å; D126-S128 PolarHBondContact O-N 3Å; D126-S128 WeakPolarHBondContact OD1-CB 3.42Å; D126-S128 PolarHBondContact OD1-N 2.86Å; D126-S128 PolarHBondContact OD1-OG 2.81Å; D126-Q129 HydrophobicContact CB-CG 3.91Å; D126-Q129 WeakPolarHBondContact O-CB 3.22Å; D126-Q129 PolarHBondContact O-N 2.96Å; D126-Q129 WeakPolarHBondContact OD2-CG 3.47Å; D126-S181 WeakPolarHBondContact CA-OG 3.38Å; D126-S184 WeakPolarHBondContact OD1-CB 3.12Å; D126-S184 PolarHBondContact OD1-OG 2.8Å; D126-V278 HydrophobicContact CB-CG2 3.88Å; D126-R281 IonicContact OD2-CZ 2.68Å; D126-R281 IonicContact OD2-NH1 3.82Å; D126-R281 PolarHBondContact OD2-NH1 3.16Å
127	P	86.9	Confident	87	Confident	10 Å²	10	43.9 Å²	43.9	7%	0.065	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-64.3	-25.5	-173.8	26.4	-34.1	0	0	0	111.7	T108 Q129 L130 S181	T108-P127 HydrophobicContact CG2-CB 3.8Å; P127-Q129 PolarHBondContact O-N 3.48Å; P127-L130 WeakPolarHBondContact O-CB 3.12Å; P127-L130 PolarHBondContact O-N 2.87Å; P127-S181 WeakPolarHBondContact CD-OG 3.42Å
128	S	87	Confident	86.9	Confident	12 Å²	12	43.9 Å²	43.9	8%	0.084	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-65.4	-16.7	177.2	81.8	0	0	0	0	113.1	D126 L130 K243	D126-S128 PolarHBondContact O-N 3Å; D126-S128 WeakPolarHBondContact OD1-CB 3.42Å; D126-S128 PolarHBondContact OD1-N 2.86Å; D126-S128 PolarHBondContact OD1-OG 2.81Å; S128-L130 VanDerWaalsContact C-N 3.27Å; S128-L130 PolarHBondContact O-N 3.3Å; S128-K243 WeakPolarHBondContact O-CD 3.35Å; S128-K243 WeakPolarHBondContact O-CE 3.38Å; S128-K243 PolarHBondContact O-NZ 3.49Å
129	Q	84.8	Confident	86.8	Confident	102 Å²	102	41.9 Å²	41.9	48%	0.477	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-78.6	-7.7	173.9	-58.8	-165.5	-56.1	0	0	113.9	D126 P127	D126-Q129 HydrophobicContact CB-CG 3.91Å; D126-Q129 WeakPolarHBondContact O-CB 3.22Å; D126-Q129 PolarHBondContact O-N 2.96Å; D126-Q129 WeakPolarHBondContact OD2-CG 3.47Å; P127-Q129 PolarHBondContact O-N 3.48Å
130	L	86.2	Confident	86.5	Confident	15 Å²	15	45.3 Å²	45.3	8%	0.079	25%	0.246	C	C	.	.	S	Bend	trans	-74.1	157.6	171.9	-60.6	176.5	0	0	0	110.9	T108 V110 L121 V124 P127 S128 K243	T108-L130 HydrophobicContact CG2-CD1 3.84Å; V110-L130 HydrophobicContact CB-CD1 4Å; V110-L130 HydrophobicContact CG2-CD1 3.89Å; L121-L130 HydrophobicContact CD1-CD1 4.22Å; L121-L130 HydrophobicContact CD1-CD2 3.76Å; V124-L130 HydrophobicContact CG1-CD2 3.95Å; V124-L130 HydrophobicContact CG1-CG 4.06Å; V124-L130 HydrophobicContact CG2-CD2 4.22Å; P127-L130 WeakPolarHBondContact O-CB 3.12Å; P127-L130 PolarHBondContact O-N 2.87Å; S128-L130 VanDerWaalsContact C-N 3.27Å; S128-L130 PolarHBondContact O-N 3.3Å; L130-K243 PolarHBondContact O-NZ 3.39Å
131	N	84.2	Confident	86.1	Confident	103 Å²	103	45.4 Å²	45.4	55%	0.551	25%	0.248	S	C	*	.			trans	-83.4	134.7	167.7	-67.9	-1.5	0	0	0	108.2	S81 S133 W134	S81-N131 PolarHBondContact OG-O 2.61Å; S81-N131 VanDerWaalsContact OG-O 3.06Å; N131-S133 PolarHBondContact O-N 2.71Å; N131-W134 WeakPolarHBondContact O-CB 3.28Å; N131-W134 PolarHBondContact O-N 3.1Å
132	D	78.7	Confident	85.6	Confident	76 Å²	76	46.4 Å²	46.4	41%	0.406	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-15.4	-174.9	-46.6	-27.7	0	0	0	114.3	M80 S81 K243	M80-D132 CarbonylContact C-O 3.48Å; M80-D132 HydrophobicContact CB-CB 4.1Å; M80-D132 HydrophobicContact CE-CB 4.38Å; M80-D132 HydrophobicContact CG-CB 4.07Å; S81-D132 PolarHBondContact N-O 2.96Å; S81-D132 PolarHBondContact OG-O 3Å; D132-K243 IonicContact OD1-NZ 2.69Å
133	S	85	Confident	84.8	Confident	57 Å²	57	47 Å²	47	40%	0.399	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	17.1	175.2	57	0	0	0	0	114.1	S113 N131 Y135	S113-S133 PolarHBondContact OG-O 3.1Å; N131-S133 PolarHBondContact O-N 2.71Å; S133-Y135 PolarHBondContact O-N 3.42Å
134	W	89.7	Confident	83.5	Confident	10 Å²	10	46.7 Å²	46.7	4%	0.038	24%	0.244	C	C	.	.			trans	-51.2	135	-167.5	-167.7	94.2	0	0	0	113.8	V110 C112 S113 R119 L121 N131 N139	V110-W134 HydrophobicContact CB-CE3 4.33Å; V110-W134 HydrophobicContact CG1-CD2 3.77Å; V110-W134 HydrophobicContact CG1-CE3 3.5Å; V110-W134 VanDerWaalsContact CG1-CE3 3.5Å; V110-W134 HydrophobicContact CG1-CH2 3.91Å; V110-W134 HydrophobicContact CG1-CZ2 4.14Å; V110-W134 HydrophobicContact CG1-CZ3 3.58Å; V110-W134 HydrophobicContact CG2-CB 4.07Å; V110-W134 HydrophobicContact CG2-CD2 4.03Å; V110-W134 HydrophobicContact CG2-CE3 3.85Å; V110-W134 HydrophobicContact CG2-CG 4.14Å; C112-W134 HydrophobicContact CB-CZ3 4.22Å; S113-W134 WeakPolarHBondContact CB-O 3.28Å; S113-W134 PolarHBondContact N-O 2.98Å; S113-W134 PolarHBondContact OG-O 2.69Å; S113-W134 VanDerWaalsContact OG-O 3.11Å; R119-W134 HydrophobicContact CB-CH2 3.79Å; R119-W134 HydrophobicContact CB-CZ3 3.99Å; R119-W134 HydrophobicContact CG-CH2 3.85Å; R119-W134 HydrophobicContact CG-CZ3 3.92Å; L121-W134 HydrophobicContact CD1-CZ2 4.13Å; L121-W134 HydrophobicContact CD2-CH2 4.47Å; L121-W134 HydrophobicContact CD2-CZ2 3.97Å; N131-W134 WeakPolarHBondContact O-CB 3.28Å; N131-W134 PolarHBondContact O-N 3.1Å; W134-N139 HydrophobicContact CH2-CB 4.23Å; W134-N139 HydrophobicContact CZ2-CB 3.85Å
135	Y	90.2	Very high	81.9	Confident	7 Å²	7	48.4 Å²	48.4	3%	0.027	26%	0.255	C	S	.	.			trans	-141.9	159.8	179	69.5	-82	0	0	0	111.5	F114 S133 A137 L138 D545 I548	F114-Y135 VanDerWaalsContact CD2-CB 3.48Å; F114-Y135 HydrophobicContact CD2-CD1 4.29Å; F114-Y135 AromaticContact CD2-CD2 3.52Å; F114-Y135 HydrophobicContact CD2-CD2 3.52Å; F114-Y135 HydrophobicContact CD2-CE2 4.27Å; F114-Y135 AromaticContact CD2-CG 3.53Å; F114-Y135 HydrophobicContact CD2-CG 3.53Å; F114-Y135 AromaticContact CE2-CD1 3.83Å; F114-Y135 HydrophobicContact CE2-CD1 3.83Å; F114-Y135 AromaticContact CE2-CD2 3.56Å; F114-Y135 HydrophobicContact CE2-CD2 3.56Å; F114-Y135 HydrophobicContact CE2-CE1 4.22Å; F114-Y135 AromaticContact CE2-CE2 3.93Å; F114-Y135 HydrophobicContact CE2-CE2 3.93Å; F114-Y135 AromaticContact CE2-CG 3.52Å; F114-Y135 HydrophobicContact CE2-CG 3.52Å; S133-Y135 PolarHBondContact O-N 3.42Å; Y135-A137 VanDerWaalsContact C-N 3.26Å; Y135-A137 HydrophobicContact CD2-CB 3.85Å; Y135-A137 HydrophobicContact CE2-CB 3.37Å; Y135-A137 PolarHBondContact O-N 3.08Å; Y135-L138 HydrophobicContact CD1-CD1 3.71Å; Y135-L138 HydrophobicContact CD1-CD2 4.5Å; Y135-L138 HydrophobicContact CD1-CG 3.74Å; Y135-L138 HydrophobicContact CE1-CD1 3.69Å; Y135-L138 HydrophobicContact CE1-CD2 3.79Å; Y135-L138 HydrophobicContact CE1-CG 3.53Å; Y135-L138 HydrophobicContact CG-CG 4.35Å; Y135-L138 WeakPolarHBondContact O-CB 3.46Å; Y135-L138 PolarHBondContact O-N 2.98Å; Y135-D545 PolarHBondContact OH-OD1 2.91Å; Y135-I548 HydrophobicContact CE2-CD1 3.68Å
136	C	90.8	Very high	80.1	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.007	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-48.4	-39.9	-168.6	-76.8	0	0	0	0	114.8	C112 R119 L138 N139 Y142 P159	C112-C136 VanDerWaalsContact CB-SG 3.54Å; C112-C136 PolarHBondContact SG-N 3.36Å; R119-C136 PolarHBondContact NE-SG 2.87Å; R119-C136 VanDerWaalsContact NE-SG 3.37Å; C136-L138 PolarHBondContact O-N 2.87Å; C136-L138 VanDerWaalsContact O-N 3.16Å; C136-N139 VanDerWaalsContact O-CB 3.25Å; C136-N139 WeakPolarHBondContact O-CB 3.48Å; C136-N139 PolarHBondContact O-N 3.39Å; C136-Y142 VanDerWaalsContact O-CD2 3.31Å; C136-Y142 WeakPolarHBondContact O-CD2 3.44Å; C136-Y142 WeakPolarHBondContact O-CE2 3.24Å; C136-P159 VanDerWaalsContact CB-C 3.45Å; C136-P159 HydrophobicContact CB-CB 3.5Å; C136-P159 WeakPolarHBondContact CB-O 3.43Å; C136-P159 PolarHBondContact SG-O 2.81Å; C136-P159 VanDerWaalsContact SG-O 3.37Å
137	A	87.6	Confident	78	Confident	18 Å²	18	59.3 Å²	59.3	15%	0.149	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-64.5	-20.8	-177.8	0	0	0	0	0	113.4	Y135 N139 F143 P159 I548	Y135-A137 VanDerWaalsContact C-N 3.26Å; Y135-A137 HydrophobicContact CD2-CB 3.85Å; Y135-A137 HydrophobicContact CE2-CB 3.37Å; Y135-A137 PolarHBondContact O-N 3.08Å; A137-N139 PolarHBondContact O-N 3.15Å; A137-F143 WeakPolarHBondContact O-CE2 3.42Å; A137-F143 WeakPolarHBondContact O-CZ 3.07Å; A137-P159 HydrophobicContact CB-CB 4.17Å; A137-P159 HydrophobicContact CB-CG 3.76Å; A137-I548 HydrophobicContact CB-CD1 4.44Å
138	L	86.5	Confident	75.8	Confident	52 Å²	52	62.4 Å²	62.4	27%	0.272	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-76.6	-3	173.6	-55.2	-175.8	0	0	0	113	Y135 C136 S140	Y135-L138 HydrophobicContact CD1-CD1 3.71Å; Y135-L138 HydrophobicContact CD1-CD2 4.5Å; Y135-L138 HydrophobicContact CD1-CG 3.74Å; Y135-L138 HydrophobicContact CE1-CD1 3.69Å; Y135-L138 HydrophobicContact CE1-CD2 3.79Å; Y135-L138 HydrophobicContact CE1-CG 3.53Å; Y135-L138 HydrophobicContact CG-CG 4.35Å; Y135-L138 WeakPolarHBondContact O-CB 3.46Å; Y135-L138 PolarHBondContact O-N 2.98Å; C136-L138 PolarHBondContact O-N 2.87Å; C136-L138 VanDerWaalsContact O-N 3.16Å; L138-S140 PolarHBondContact O-N 3.44Å
139	N	86.8	Confident	73.9	Confident	13 Å²	13	69.3 Å²	69.3	7%	0.07	38%	0.377	C	S	.	.	S	Bend	trans	-67.3	125	171.9	-169.3	-35.7	0	0	0	110.6	L121 W134 C136 A137 K141 Y142	L121-N139 HydrophobicContact CD2-CB 4.45Å; L121-N139 WeakPolarHBondContact CD2-ND2 3.39Å; W134-N139 HydrophobicContact CH2-CB 4.23Å; W134-N139 HydrophobicContact CZ2-CB 3.85Å; C136-N139 VanDerWaalsContact O-CB 3.25Å; C136-N139 WeakPolarHBondContact O-CB 3.48Å; C136-N139 PolarHBondContact O-N 3.39Å; A137-N139 PolarHBondContact O-N 3.15Å; N139-K141 HydrophobicContact CB-CG 4.29Å; N139-K141 PolarHBondContact O-N 3.26Å; N139-K141 PolarHBondContact OD1-N 3.25Å; N139-K141 VanDerWaalsContact OD1-N 3.13Å; N139-Y142 HydrophobicContact CB-CD2 3.9Å; N139-Y142 HydrophobicContact CB-CE2 3.88Å; N139-Y142 WeakPolarHBondContact O-CD2 3.29Å; N139-Y142 PolarHBondContact O-N 3.06Å
140	S	82.4	Confident	72.2	Confident	73 Å²	73	68.1 Å²	68.1	51%	0.51	38%	0.38	S	S	.	.	H	α-helix	trans	-49	-24.4	179.8	70.1	0	0	0	0	115.4	L138 Y142 F143	L138-S140 PolarHBondContact O-N 3.44Å; S140-Y142 VanDerWaalsContact C-N 3.25Å; S140-Y142 PolarHBondContact O-N 3.04Å; S140-F143 PolarHBondContact O-N 2.57Å
141	K	81.9	Confident	70.4	Confident	81 Å²	81	73.2 Å²	73.2	35%	0.352	41%	0.412	S	S	.	.	H	α-helix	trans	-59.6	-33.4	177.2	71.1	-177.7	177.1	169.4	0	113.1	N139 E162	N139-K141 HydrophobicContact CB-CG 4.29Å; N139-K141 PolarHBondContact O-N 3.26Å; N139-K141 PolarHBondContact OD1-N 3.25Å; N139-K141 VanDerWaalsContact OD1-N 3.13Å; K141-E162 WeakPolarHBondContact CE-OE1 3.28Å; K141-E162 WeakPolarHBondContact CE-OE2 3.39Å; K141-E162 IonicContact NZ-OE1 3.98Å; K141-E162 PolarHBondContact NZ-OE1 2.85Å; K141-E162 IonicContact NZ-OE2 3.2Å; K141-E162 PolarHBondContact NZ-OE2 3.38Å
142	Y	77.6	Confident	68.6	Low	32 Å²	32	75.7 Å²	75.7	13%	0.125	42%	0.423	C	S	.	.	H	α-helix	trans	-80.9	-26.1	-175.9	-58.1	-57.1	0	0	0	114.7	C136 N139 S140 T145 H157 P159 E162	C136-Y142 VanDerWaalsContact O-CD2 3.31Å; C136-Y142 WeakPolarHBondContact O-CD2 3.44Å; C136-Y142 WeakPolarHBondContact O-CE2 3.24Å; N139-Y142 HydrophobicContact CB-CD2 3.9Å; N139-Y142 HydrophobicContact CB-CE2 3.88Å; N139-Y142 WeakPolarHBondContact O-CD2 3.29Å; N139-Y142 PolarHBondContact O-N 3.06Å; S140-Y142 VanDerWaalsContact C-N 3.25Å; S140-Y142 PolarHBondContact O-N 3.04Å; Y142-T145 VanDerWaalsContact C-OG1 3.3Å; Y142-T145 WeakPolarHBondContact CA-OG1 3.24Å; Y142-T145 PolarHBondContact O-N 3.17Å; Y142-T145 PolarHBondContact O-OG1 3.34Å; Y142-H157 AromaticContact CE1-CE1 3.26Å; Y142-H157 WeakPolarHBondContact CE1-CE1 3.48Å; Y142-H157 AromaticContact CE1-ND1 3.47Å; Y142-H157 WeakPolarHBondContact CE1-ND1 3.4Å; Y142-H157 AromaticContact CZ-CE1 3.8Å; Y142-P159 HydrophobicContact CD2-CB 4.21Å; Y142-P159 HydrophobicContact CD2-CG 4.39Å; Y142-P159 HydrophobicContact CE2-CB 3.63Å; Y142-P159 HydrophobicContact CE2-CG 4.24Å; Y142-E162 PolarHBondContact OH-OE1 3.36Å; Y142-E162 PolarHBondContact OH-OE2 2.8Å
143	F	67.9	Low	66.8	Low	99 Å²	99	78.3 Å²	78.3	43%	0.434	44%	0.437	S	S	.	.	H	α-helix	trans	-74.3	-30.5	179.4	-64.2	-88.8	0	0	0	112.3	A137 S140 T145	A137-F143 WeakPolarHBondContact O-CE2 3.42Å; A137-F143 WeakPolarHBondContact O-CZ 3.07Å; S140-F143 PolarHBondContact O-N 2.57Å; F143-T145 PolarHBondContact O-N 2.85Å
144	K	59.5	Low	64.9	Low	158 Å²	158	80.9 Å²	80.9	69%	0.687	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-64.4	-28.1	174.4	-72.9	-169.3	170.2	-164.1	0	113.3	L146 T147	K144-L146 PolarHBondContact O-N 2.91Å; K144-L146 VanDerWaalsContact O-N 3.16Å; K144-T147 PolarHBondContact O-OG1 3.48Å
145	T	51.8	Low	62.7	Low	67 Å²	67	89.3 Å²	89.3	41%	0.411	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-75.7	3.5	-174.2	21.8	0	0	0	0	115.3	Y142 F143 K154	Y142-T145 VanDerWaalsContact C-OG1 3.3Å; Y142-T145 WeakPolarHBondContact CA-OG1 3.24Å; Y142-T145 PolarHBondContact O-N 3.17Å; Y142-T145 PolarHBondContact O-OG1 3.34Å; F143-T145 PolarHBondContact O-N 2.85Å; T145-K154 PolarHBondContact O-NZ 3.42Å
146	L	49.6	Very low	61.1	Low	145 Å²	145	94.8 Å²	94.8	76%	0.759	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-103.8	-10.6	-177.7	-68.8	167.1	0	0	0	114.5	K144	K144-L146 PolarHBondContact O-N 2.91Å; K144-L146 VanDerWaalsContact O-N 3.16Å
147	T	42.6	Very low	59.7	Low	114 Å²	114	99.9 Å²	99.9	70%	0.699	53%	0.527	S	S	*	.	S	Bend	trans	-87.9	117.9	-178.7	51.5	0	0	0	0	112.4	K144	K144-T147 PolarHBondContact O-OG1 3.48Å
148	A	40.5	Very low	59.2	Low	75 Å²	75	103.5 Å²	103.5	62%	0.62	54%	0.543	S	S	*	.	S	Bend	trans	68.3	132.6	170.1	0	0	0	0	0	118.4	S150	A148-S150 VanDerWaalsContact C-N 3.33Å; A148-S150 PolarHBondContact O-N 3.5Å
149	N	47.5	Very low	59.1	Low	158 Å²	158	102 Å²	102	85%	0.845	54%	0.537	S	S	*	.			trans	64.1	7.1	150.9	-52.8	-3.1	0	0	0	119.6	T151	N149-T151 PolarHBondContact O-N 3.27Å
150	S	48.7	Very low	59.2	Low	77 Å²	77	103 Å²	103	54%	0.538	54%	0.544	S	S	.	.			trans	-80.2	96.8	166.7	-68	0	0	0	0	111.3	A148 I152	A148-S150 VanDerWaalsContact C-N 3.33Å; A148-S150 PolarHBondContact O-N 3.5Å; S150-I152 PolarHBondContact O-N 3.45Å
151	T	48.6	Very low	59.3	Low	121 Å²	121	101.9 Å²	101.9	74%	0.742	54%	0.544	S	S	*	.			trans	-65.4	95	174.5	47.2	0	0	0	0	112.2	N149 N153	N149-T151 PolarHBondContact O-N 3.27Å; T151-N153 PolarHBondContact O-N 3.4Å
152	I	46.8	Very low	59.4	Low	155 Å²	155	100.6 Å²	100.6	80%	0.795	54%	0.539	S	S	*	.	S	Bend	trans	55.9	-26	150.6	-63.9	174.3	0	0	0	119.2	S150 K154	S150-I152 PolarHBondContact O-N 3.45Å; I152-K154 PolarHBondContact O-N 3.43Å; I152-K154 VanDerWaalsContact O-N 3.12Å
153	N	41.8	Very low	59.8	Low	131 Å²	131	103.6 Å²	103.6	70%	0.701	57%	0.565	S	S	*	*			trans	-79.1	15.4	178.3	-70.4	-2.7	0	0	0	114.1	T151 Y155	T151-N153 PolarHBondContact O-N 3.4Å; N153-Y155 PolarHBondContact O-N 3.26Å
154	K	44.4	Very low	60.7	Low	112 Å²	112	101.3 Å²	101.3	49%	0.487	56%	0.556	S	S	.	*			trans	-84.1	52.9	-179.7	-157.9	169.4	-164.4	157.3	0	111.1	T145 I152 L156	T145-K154 PolarHBondContact O-NZ 3.42Å; I152-K154 PolarHBondContact O-N 3.43Å; I152-K154 VanDerWaalsContact O-N 3.12Å; K154-L156 PolarHBondContact O-N 3Å
155	Y	43.5	Very low	61.7	Low	187 Å²	187	95.8 Å²	95.8	73%	0.733	53%	0.534	S	S	*	.			trans	-59.8	124.1	-176.1	-76.2	-88	0	0	0	111.4	N153 H157	N153-Y155 PolarHBondContact O-N 3.26Å; Y155-H157 PolarHBondContact O-N 3.3Å
156	L	55.5	Low	62.6	Low	122 Å²	122	98.7 Å²	98.7	64%	0.639	55%	0.546	S	S	*	.			trans	51.1	50.4	148.4	-149.7	74.8	0	0	0	116.7	K154 I158	K154-L156 PolarHBondContact O-N 3Å; L156-I158 VanDerWaalsContact C-N 3.3Å; L156-I158 HydrophobicContact CD2-CD1 4.07Å; L156-I158 HydrophobicContact CD2-CG1 4.3Å; L156-I158 HydrophobicContact CG-CD1 4.21Å; L156-I158 HydrophobicContact CG-CG1 3.87Å; L156-I158 PolarHBondContact O-N 3.08Å
157	H	62.5	Low	63.5	Low	108 Å²	108	92.9 Å²	92.9	50%	0.5	52%	0.522	S	S	.	.			trans	-69.8	89.3	163.7	-174.3	-68	0	0	0	110.2	Y142 Y155 P159 E162	Y142-H157 AromaticContact CE1-CE1 3.26Å; Y142-H157 WeakPolarHBondContact CE1-CE1 3.48Å; Y142-H157 AromaticContact CE1-ND1 3.47Å; Y142-H157 WeakPolarHBondContact CE1-ND1 3.4Å; Y142-H157 AromaticContact CZ-CE1 3.8Å; Y155-H157 PolarHBondContact O-N 3.3Å; H157-P159 WeakPolarHBondContact O-CD 3.48Å; H157-E162 IonicContact CE1-OE1 3.86Å; H157-E162 IonicContact NE2-OE1 2.68Å
158	I	77.1	Confident	64.3	Low	93 Å²	93	87.7 Å²	87.7	48%	0.477	49%	0.49	S	S	.	.			trans	-70.7	111.6	177.6	-53.8	178.6	0	0	0	109.2	L156 C160 G161	L156-I158 VanDerWaalsContact C-N 3.3Å; L156-I158 HydrophobicContact CD2-CD1 4.07Å; L156-I158 HydrophobicContact CD2-CG1 4.3Å; L156-I158 HydrophobicContact CG-CD1 4.21Å; L156-I158 HydrophobicContact CG-CG1 3.87Å; L156-I158 PolarHBondContact O-N 3.08Å; I158-C160 HydrophobicContact CG2-CB 4.4Å; I158-C160 PolarHBondContact O-N 2.82Å; I158-G161 WeakPolarHBondContact O-CA 3.44Å; I158-G161 PolarHBondContact O-N 2.93Å
159	P	83.7	Confident	65.1	Low	22 Å²	22	88.4 Å²	88.4	14%	0.143	49%	0.487	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-25.5	-174.8	-27.6	41.5	0	0	0	114.1	C136 A137 Y142 H157 G161	C136-P159 VanDerWaalsContact CB-C 3.45Å; C136-P159 HydrophobicContact CB-CB 3.5Å; C136-P159 WeakPolarHBondContact CB-O 3.43Å; C136-P159 PolarHBondContact SG-O 2.81Å; C136-P159 VanDerWaalsContact SG-O 3.37Å; A137-P159 HydrophobicContact CB-CB 4.17Å; A137-P159 HydrophobicContact CB-CG 3.76Å; Y142-P159 HydrophobicContact CD2-CB 4.21Å; Y142-P159 HydrophobicContact CD2-CG 4.39Å; Y142-P159 HydrophobicContact CE2-CB 3.63Å; Y142-P159 HydrophobicContact CE2-CG 4.24Å; H157-P159 WeakPolarHBondContact O-CD 3.48Å; P159-G161 VanDerWaalsContact C-N 3.32Å
160	C	88.9	Confident	65.4	Low	32 Å²	32	90.9 Å²	90.9	22%	0.216	48%	0.484	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-12.1	173.1	-59.4	0	0	0	0	113	C115 K117 I158	C115-C160 HydrophobicContact CB-CB 3.88Å; K117-C160 PolarHBondContact NZ-O 2.91Å; I158-C160 HydrophobicContact CG2-CB 4.4Å; I158-C160 PolarHBondContact O-N 2.82Å
161	G	84.8	Confident	65.8	Low	51 Å²	51	89.3 Å²	89.3	53%	0.526	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-43.1	-178.8	0	0	0	0	0	113	K117 I158 P159	K117-G161 PolarHBondContact NZ-O 3.3Å; K117-G161 VanDerWaalsContact NZ-O 3.09Å; I158-G161 WeakPolarHBondContact O-CA 3.44Å; I158-G161 PolarHBondContact O-N 2.93Å; P159-G161 VanDerWaalsContact C-N 3.32Å
162	E	84.8	Confident	65.9	Low	53 Å²	53	90.6 Å²	90.6	25%	0.248	47%	0.466	C	S	.	.	S	Bend	trans	-42.4	140.6	176.2	-72	-173.6	151.5	0	0	112.6	K117 R119 K141 Y142 H157	K117-E162 WeakPolarHBondContact CD-O 3.29Å; K117-E162 WeakPolarHBondContact CE-O 3.48Å; K117-E162 PolarHBondContact NZ-O 2.88Å; R119-E162 IonicContact CZ-OE2 2.63Å; R119-E162 IonicContact NH1-OE2 3.65Å; R119-E162 PolarHBondContact NH2-O 2.94Å; R119-E162 IonicContact NH2-OE2 2.83Å; K141-E162 WeakPolarHBondContact CE-OE1 3.28Å; K141-E162 WeakPolarHBondContact CE-OE2 3.39Å; K141-E162 IonicContact NZ-OE1 3.98Å; K141-E162 PolarHBondContact NZ-OE1 2.85Å; K141-E162 IonicContact NZ-OE2 3.2Å; K141-E162 PolarHBondContact NZ-OE2 3.38Å; Y142-E162 PolarHBondContact OH-OE1 3.36Å; Y142-E162 PolarHBondContact OH-OE2 2.8Å; H157-E162 IonicContact CE1-OE1 3.86Å; H157-E162 IonicContact NE2-OE1 2.68Å
163	S	86	Confident	66.2	Low	95 Å²	95	89.9 Å²	89.9	66%	0.664	46%	0.464	S	S	*	.			trans	-52.4	156.2	167.1	54.8	0	0	0	0	111.2	R119	R119-S163 PolarHBondContact NH1-O 2.81Å; R119-S163 PolarHBondContact NH2-O 2.87Å; R119-S163 VanDerWaalsContact NH2-O 3.17Å
164	E	86	Confident	67.1	Low	52 Å²	52	88.6 Å²	88.6	24%	0.243	45%	0.453	C	S	.	.			trans	-62	151.2	171.3	-175.5	156.8	108.1	0	0	111.8	K117 W118 L166 A168 V169	K117-E164 VanDerWaalsContact CA-OE2 3.22Å; K117-E164 WeakPolarHBondContact CA-OE2 3.3Å; W118-E164 HydrophobicContact CB-CG 3.94Å; W118-E164 PolarHBondContact N-OE2 3.04Å; E164-L166 PolarHBondContact O-N 3.01Å; E164-A168 HydrophobicContact CG-CB 4.28Å; E164-V169 HydrophobicContact CG-CG2 4.49Å; E164-V169 WeakPolarHBondContact OE1-CG2 3.35Å
165	D	80	Confident	68	Low	42 Å²	42	84.3 Å²	84.3	23%	0.225	44%	0.435	C	S	.	.			trans	-73.1	110.9	177.6	-62.5	-5.4	0	0	0	108.9	W109 R119 Y120 G167 A168	W109-D165 HydrophobicContact CH2-CB 4.16Å; W109-D165 HydrophobicContact CZ3-CB 3.83Å; R119-D165 WeakPolarHBondContact CA-OD2 3.41Å; R119-D165 IonicContact CZ-OD1 3.95Å; R119-D165 IonicContact NH1-OD1 3.94Å; R119-D165 PolarHBondContact NH1-OD1 3.27Å; Y120-D165 PolarHBondContact N-OD2 3.12Å; D165-G167 PolarHBondContact O-N 2.87Å; D165-A168 PolarHBondContact O-N 2.93Å
166	L	72.1	Confident	68.7	Low	127 Å²	127	76.3 Å²	76.3	67%	0.665	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-11.5	-164.6	-67.4	176.1	0	0	0	117.9	E164	E164-L166 PolarHBondContact O-N 3.01Å
167	G	67.7	Low	69.1	Low	24 Å²	24	73.8 Å²	73.8	25%	0.247	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-38.5	171.5	0	0	0	0	0	112.5	D165 V169 R170 Q171	D165-G167 PolarHBondContact O-N 2.87Å; G167-V169 VanDerWaalsContact C-N 3.34Å; G167-V169 PolarHBondContact O-N 2.77Å; G167-R170 PolarHBondContact O-N 3.48Å; G167-R170 VanDerWaalsContact O-N 3.1Å; G167-Q171 PolarHBondContact O-OE1 2.96Å
168	A	60.1	Low	69.5	Low	4 Å²	4	68.7 Å²	68.7	3%	0.033	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-58.1	-45.2	-178.7	0	0	0	0	0	112.5	W109 W118 E164 D165 R170 Q171 F175	W109-A168 HydrophobicContact CE3-CB 4.21Å; W109-A168 HydrophobicContact CH2-CB 4.3Å; W109-A168 HydrophobicContact CZ3-CB 3.75Å; W118-A168 HydrophobicContact CB-CB 3.4Å; W118-A168 VanDerWaalsContact CB-CB 3.4Å; W118-A168 HydrophobicContact CG-CB 3.75Å; E164-A168 HydrophobicContact CG-CB 4.28Å; D165-A168 PolarHBondContact O-N 2.93Å; A168-R170 PolarHBondContact O-N 2.79Å; A168-R170 VanDerWaalsContact O-N 3.08Å; A168-Q171 PolarHBondContact O-N 3Å; A168-F175 WeakPolarHBondContact O-CE2 3.43Å
169	V	56.5	Low	69.7	Low	91 Å²	91	68.2 Å²	68.2	55%	0.552	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-65.9	-13.2	-178.2	-170.8	0	0	0	0	113.1	E164 G167	E164-V169 HydrophobicContact CG-CG2 4.49Å; E164-V169 WeakPolarHBondContact OE1-CG2 3.35Å; G167-V169 VanDerWaalsContact C-N 3.34Å; G167-V169 PolarHBondContact O-N 2.77Å
170	R	53.5	Low	70	Confident	210 Å²	210	67.9 Å²	67.9	79%	0.792	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-105.9	-9.3	-174.3	-67.7	-176.9	175.8	-149.5	-3.4	114.7	G167 A168	G167-R170 PolarHBondContact O-N 3.48Å; G167-R170 VanDerWaalsContact O-N 3.1Å; A168-R170 PolarHBondContact O-N 2.79Å; A168-R170 VanDerWaalsContact O-N 3.08Å
171	Q	57.4	Low	70.1	Confident	43 Å²	43	66.6 Å²	66.6	20%	0.201	35%	0.348	C	S	.	.			trans	-133.2	23.9	-160.6	-69.4	-176.8	-66.3	0	0	113.8	G167 A168 D173 E174 F175	G167-Q171 PolarHBondContact O-OE1 2.96Å; A168-Q171 PolarHBondContact O-N 3Å; Q171-D173 PolarHBondContact O-N 2.89Å; Q171-E174 HydrophobicContact CB-CB 4.26Å; Q171-E174 WeakPolarHBondContact CG-OE2 3.33Å; Q171-E174 PolarHBondContact NE2-OE2 3.33Å; Q171-E174 PolarHBondContact O-N 3.47Å; Q171-F175 HydrophobicContact CB-CD1 4.5Å; Q171-F175 HydrophobicContact CB-CD2 4.29Å; Q171-F175 HydrophobicContact CB-CE1 3.91Å; Q171-F175 HydrophobicContact CB-CE2 3.67Å; Q171-F175 HydrophobicContact CB-CZ 3.45Å; Q171-F175 VanDerWaalsContact CB-CZ 3.45Å; Q171-F175 WeakPolarHBondContact O-CD2 3.48Å; Q171-F175 WeakPolarHBondContact O-CG 3.47Å; Q171-F175 PolarHBondContact O-N 3.45Å
172	E	51.5	Low	70.4	Confident	148 Å²	148	64.5 Å²	64.5	69%	0.692	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-21	178.2	-66.1	-171.5	-178.7	0	0	114.3	K216	E172-K216 PolarHBondContact O-NZ 3.26Å
173	D	51.9	Low	70.7	Confident	141 Å²	141	62 Å²	62	75%	0.754	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-11.5	174.8	-72.1	-44.1	0	0	0	115.6	Q171 K216	Q171-D173 PolarHBondContact O-N 2.89Å; D173-K216 IonicContact OD1-NZ 2.62Å; D173-K216 PolarHBondContact OD1-NZ 3.04Å
174	E	60.8	Low	71.2	Confident	104 Å²	104	57.4 Å²	57.4	49%	0.486	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102	-4.5	178	-62.3	172.4	-168.8	0	0	112.7	Q171	Q171-E174 HydrophobicContact CB-CB 4.26Å; Q171-E174 WeakPolarHBondContact CG-OE2 3.33Å; Q171-E174 PolarHBondContact NE2-OE2 3.33Å; Q171-E174 PolarHBondContact O-N 3.47Å
175	F	62.7	Low	71.6	Confident	22 Å²	22	55 Å²	55	10%	0.096	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-93.4	129.2	-177.8	-67	-38.7	0	0	0	114	Y84 I86 W109 A168 Q171	Y84-F175 HydrophobicContact CD1-CB 3.91Å; Y84-F175 HydrophobicContact CE1-CB 4.43Å; I86-F175 HydrophobicContact CG1-CE1 4.35Å; W109-F175 AromaticContact CD1-CE1 3.96Å; W109-F175 HydrophobicContact CG-CE1 4.45Å; W109-F175 AromaticContact NE1-CE1 3.82Å; A168-F175 WeakPolarHBondContact O-CE2 3.43Å; Q171-F175 HydrophobicContact CB-CD1 4.5Å; Q171-F175 HydrophobicContact CB-CD2 4.29Å; Q171-F175 HydrophobicContact CB-CE1 3.91Å; Q171-F175 HydrophobicContact CB-CE2 3.67Å; Q171-F175 HydrophobicContact CB-CZ 3.45Å; Q171-F175 VanDerWaalsContact CB-CZ 3.45Å; Q171-F175 WeakPolarHBondContact O-CD2 3.48Å; Q171-F175 WeakPolarHBondContact O-CG 3.47Å; Q171-F175 PolarHBondContact O-N 3.45Å
176	I	59.3	Low	72.4	Confident	19 Å²	19	53 Å²	53	10%	0.097	26%	0.259	C	S	.	.			trans	-109.4	129	176.7	-55.6	179.6	0	0	0	109.7	Y84 Q178 F211	Y84-I176 WeakPolarHBondContact CD1-O 3.21Å; I176-Q178 PolarHBondContact O-N 2.85Å; I176-F211 HydrophobicContact CD1-CD1 4.28Å; I176-F211 HydrophobicContact CD1-CD2 3.92Å; I176-F211 HydrophobicContact CD1-CE1 4.11Å; I176-F211 HydrophobicContact CD1-CE2 3.74Å; I176-F211 HydrophobicContact CD1-CG 4.18Å; I176-F211 HydrophobicContact CD1-CZ 3.83Å; I176-F211 HydrophobicContact CG2-CD1 3.37Å; I176-F211 HydrophobicContact CG2-CE1 3.54Å; I176-F211 HydrophobicContact CG2-CG 4.03Å; I176-F211 HydrophobicContact CG2-CZ 4.31Å
177	F	64.7	Low	73.5	Confident	69 Å²	69	47.8 Å²	47.8	30%	0.303	23%	0.231	S	C	.	.	B	Isolated β-bridge	trans	-81.1	109.1	-176.7	-64.1	-101.1	0	0	0	110.6	K82 Y84 K216 E217	K82-F177 HydrophobicContact CD-CD1 3.8Å; Y84-F177 HydrophobicContact CE1-CB 4.31Å; Y84-F177 AromaticContact CE1-CD1 3.41Å; Y84-F177 HydrophobicContact CE1-CD1 3.41Å; Y84-F177 VanDerWaalsContact CE1-CD1 3.41Å; Y84-F177 HydrophobicContact CE1-CD2 4.24Å; Y84-F177 AromaticContact CE1-CE1 3.71Å; Y84-F177 HydrophobicContact CE1-CE1 3.71Å; Y84-F177 HydrophobicContact CE1-CE2 4.46Å; Y84-F177 AromaticContact CE1-CG 3.71Å; Y84-F177 HydrophobicContact CE1-CG 3.71Å; Y84-F177 HydrophobicContact CE1-CZ 4.21Å; Y84-F177 AromaticContact CZ-CD1 3.54Å; Y84-F177 AromaticContact CZ-CE1 3.8Å; Y84-F177 WeakPolarHBondContact OH-CD1 3.35Å; Y84-F177 WeakPolarHBondContact OH-CE1 3.3Å; F177-K216 HydrophobicContact CD2-CB 3.98Å; F177-K216 HydrophobicContact CE2-CB 4.2Å; F177-K216 PolarHBondContact N-O 2.88Å; F177-E217 HydrophobicContact CB-CG 4.31Å
178	Q	70.7	Confident	74.9	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-135.6	166.1	-175.7	67.2	179.7	24	0	0	115	G83 V85 I176 F180 Y208 V218	G83-Q178 PolarHBondContact N-O 3.15Å; G83-Q178 CarbonylContact O-C 3.6Å; G83-Q178 VanDerWaalsContact O-CG 3.28Å; G83-Q178 WeakPolarHBondContact O-CG 3.29Å; G83-Q178 PolarHBondContact O-N 3.32Å; V85-Q178 VanDerWaalsContact CG2-NE2 3.32Å; I176-Q178 PolarHBondContact O-N 2.85Å; Q178-F180 VanDerWaalsContact CD-O 3.27Å; Q178-F180 PolarHBondContact NE2-O 2.83Å; Q178-F180 PolarHBondContact OE1-O 2.82Å; Q178-Y208 PolarHBondContact OE1-OH 3.12Å; Q178-V218 HydrophobicContact CB-CG2 3.83Å
179	H	80	Confident	76.6	Confident	83 Å²	83	50 Å²	50	38%	0.384	23%	0.233	S	C	.	.	S	Bend	trans	-118.8	-17.9	178.7	-62.2	87.8	0	0	0	112	Y221	H179-Y221 PolarHBondContact N-OH 3.11Å
180	F	91	Very high	78.4	Confident	15 Å²	15	47.1 Å²	47.1	7%	0.066	22%	0.216	C	C	.	.			trans	-136.5	151.2	-178.9	-50.4	-66.6	0	0	0	109.3	Q178 V186 V200 Y221 I241 K243	Q178-F180 VanDerWaalsContact CD-O 3.27Å; Q178-F180 PolarHBondContact NE2-O 2.83Å; Q178-F180 PolarHBondContact OE1-O 2.82Å; F180-V186 HydrophobicContact CB-CG1 4.45Å; F180-V186 HydrophobicContact CD1-CG1 3.44Å; F180-V186 VanDerWaalsContact CD1-CG1 3.44Å; F180-V186 HydrophobicContact CD2-CG1 4.28Å; F180-V186 HydrophobicContact CE1-CG1 3.71Å; F180-V186 HydrophobicContact CE2-CG1 4.49Å; F180-V186 HydrophobicContact CG-CG1 3.78Å; F180-V186 HydrophobicContact CZ-CG1 4.25Å; F180-V200 HydrophobicContact CB-CG2 4.03Å; F180-Y221 HydrophobicContact CB-CD1 4.34Å; F180-Y221 HydrophobicContact CB-CE1 3.77Å; F180-Y221 HydrophobicContact CD2-CE1 4.28Å; F180-Y221 AromaticContact CD2-CE2 3.94Å; F180-Y221 HydrophobicContact CD2-CE2 3.94Å; F180-Y221 AromaticContact CD2-CZ 3.76Å; F180-Y221 WeakPolarHBondContact O-CE1 3.38Å; F180-I241 HydrophobicContact CD2-CG2 3.94Å; F180-I241 HydrophobicContact CE2-CB 4.37Å; F180-I241 HydrophobicContact CE2-CG2 3.7Å; F180-I241 HydrophobicContact CZ-CG2 4.29Å; F180-K243 HydrophobicContact CE1-CB 4.05Å; F180-K243 HydrophobicContact CZ-CB 4.49Å
181	S	90.4	Very high	80.3	Confident	5 Å²	5	45.4 Å²	45.4	4%	0.035	22%	0.217	C	C	.	.			trans	-129	-176.6	171.6	71.9	0	0	0	0	109.2	C125 D126 P127 G183 S184 V200	C125-S181 PolarHBondContact O-OG 3.03Å; D126-S181 WeakPolarHBondContact CA-OG 3.38Å; P127-S181 WeakPolarHBondContact CD-OG 3.42Å; S181-G183 PolarHBondContact O-N 3.45Å; S181-S184 PolarHBondContact N-OG 3.42Å; S181-S184 VanDerWaalsContact O-CB 3.29Å; S181-S184 WeakPolarHBondContact O-CB 3.49Å; S181-S184 PolarHBondContact O-N 2.85Å; S181-S184 PolarHBondContact O-OG 2.73Å; S181-S184 VanDerWaalsContact O-OG 3.12Å; S181-V200 VanDerWaalsContact O-CB 3.3Å; S181-V200 WeakPolarHBondContact O-CB 3.38Å; S181-V200 WeakPolarHBondContact O-CG1 3.43Å
182	V	90.8	Very high	81.9	Confident	7 Å²	7	46.1 Å²	46.1	4%	0.042	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	123.8	-177.9	-160.9	0	0	0	0	110.5	Y202 Y208 V278 L282	V182-Y202 HydrophobicContact CB-CD2 4.19Å; V182-Y202 HydrophobicContact CB-CE2 3.85Å; V182-Y202 HydrophobicContact CG1-CD2 3.38Å; V182-Y202 HydrophobicContact CG1-CE2 3.52Å; V182-Y202 HydrophobicContact CG1-CG 3.97Å; V182-Y202 HydrophobicContact CG2-CD1 4.06Å; V182-Y202 HydrophobicContact CG2-CD2 4.11Å; V182-Y202 HydrophobicContact CG2-CE1 3.69Å; V182-Y202 HydrophobicContact CG2-CE2 3.71Å; V182-Y202 HydrophobicContact CG2-CG 4.29Å; V182-Y208 VanDerWaalsContact CG2-CB 3.46Å; V182-Y208 HydrophobicContact CG2-CD1 3.5Å; V182-Y208 HydrophobicContact CG2-CD2 3.92Å; V182-Y208 HydrophobicContact CG2-CE1 4.17Å; V182-Y208 HydrophobicContact CG2-CG 3.35Å; V182-V278 WeakPolarHBondContact O-CG1 3.31Å; V182-L282 HydrophobicContact CB-CD1 4.49Å; V182-L282 HydrophobicContact CB-CD2 4.48Å; V182-L282 HydrophobicContact CG1-CD1 4.01Å; V182-L282 HydrophobicContact CG1-CD2 3.43Å; V182-L282 VanDerWaalsContact CG1-CD2 3.43Å; V182-L282 HydrophobicContact CG1-CG 4.38Å
183	G	92.6	Very high	83.9	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.9	-0.6	-174.4	0	0	0	0	0	115	S181 V200 R281	S181-G183 PolarHBondContact O-N 3.45Å; G183-V200 PolarHBondContact N-O 3.14Å; G183-R281 VanDerWaalsContact O-CD 3.24Å; G183-R281 WeakPolarHBondContact O-CD 3.13Å; G183-R281 PolarHBondContact O-NH1 3.4Å
184	S	94.5	Very high	85.9	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.191	C	C	.	.			trans	-59.4	134	162.6	-65.1	0	0	0	0	110.1	D126 S181 M199 V200	D126-S184 WeakPolarHBondContact OD1-CB 3.12Å; D126-S184 PolarHBondContact OD1-OG 2.8Å; S181-S184 PolarHBondContact N-OG 3.42Å; S181-S184 VanDerWaalsContact O-CB 3.29Å; S181-S184 WeakPolarHBondContact O-CB 3.49Å; S181-S184 PolarHBondContact O-N 2.85Å; S181-S184 PolarHBondContact O-OG 2.73Å; S181-S184 VanDerWaalsContact O-OG 3.12Å; S184-M199 WeakPolarHBondContact O-CA 3.43Å; S184-M199 WeakPolarHBondContact O-CG 3.46Å; S184-V200 PolarHBondContact O-N 3.38Å
185	V	95.4	Very high	87.5	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	129.4	175.6	-169.5	0	0	0	0	108.6	L226 F244 A270 A273 L274	V185-L226 HydrophobicContact CG1-CD1 4.25Å; V185-F244 HydrophobicContact CB-CB 4.37Å; V185-F244 HydrophobicContact CG1-CB 3.94Å; V185-F244 HydrophobicContact CG1-CD1 3.98Å; V185-F244 HydrophobicContact CG1-CG 4.03Å; V185-F244 WeakPolarHBondContact O-CB 3.4Å; V185-F244 PolarHBondContact O-N 3.25Å; V185-A270 HydrophobicContact CG1-CB 3.85Å; V185-A273 HydrophobicContact CG2-CB 3.92Å; V185-L274 HydrophobicContact CB-CD2 3.95Å; V185-L274 HydrophobicContact CB-CG 4.37Å; V185-L274 HydrophobicContact CG2-CD2 3.89Å; V185-L274 HydrophobicContact CG2-CG 4.29Å
186	V	96.2	Very high	89.1	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	153.5	-166.8	-61.4	0	0	0	0	112.1	F180 P197 A198 V200 I223 I241 H242	F180-V186 HydrophobicContact CB-CG1 4.45Å; F180-V186 HydrophobicContact CD1-CG1 3.44Å; F180-V186 VanDerWaalsContact CD1-CG1 3.44Å; F180-V186 HydrophobicContact CD2-CG1 4.28Å; F180-V186 HydrophobicContact CE1-CG1 3.71Å; F180-V186 HydrophobicContact CE2-CG1 4.49Å; F180-V186 HydrophobicContact CG-CG1 3.78Å; F180-V186 HydrophobicContact CZ-CG1 4.25Å; V186-P197 CarbonylContact O-C 3.52Å; V186-A198 HydrophobicContact CG2-CB 4.09Å; V186-A198 PolarHBondContact N-O 3.07Å; V186-A198 PolarHBondContact O-N 2.96Å; V186-V200 HydrophobicContact CG1-CG2 4.36Å; V186-V200 HydrophobicContact CG2-CG2 4.49Å; V186-I223 HydrophobicContact CG2-CG2 4.4Å; V186-I241 HydrophobicContact CB-CG2 3.59Å; V186-I241 HydrophobicContact CG1-CG2 3.83Å; V186-I241 HydrophobicContact CG2-CG2 3.75Å; V186-H242 CarbonylContact C-O 3.58Å; V186-H242 VanDerWaalsContact CA-O 3.31Å; V186-H242 WeakPolarHBondContact CA-O 3.47Å; V186-H242 WeakPolarHBondContact CB-O 3.25Å
187	W	96.7	Very high	90.9	Very high	19 Å²	19	34.7 Å²	34.7	7%	0.072	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	137.6	157.6	-71.3	112.3	0	0	0	109.3	D195 P197 I241 H242 F244 F247 V250 L263	W187-D195 HydrophobicContact CE3-CB 4.07Å; W187-D195 WeakPolarHBondContact CZ3-O 3.42Å; W187-P197 HydrophobicContact CE3-CG 4.15Å; W187-P197 HydrophobicContact CH2-CG 3.88Å; W187-P197 HydrophobicContact CZ3-CG 3.56Å; W187-I241 CarbonylContact O-C 3.51Å; W187-I241 VanDerWaalsContact O-CA 3.28Å; W187-I241 WeakPolarHBondContact O-CA 3.5Å; W187-H242 WeakPolarHBondContact CB-CE1 3.5Å; W187-H242 WeakPolarHBondContact CB-ND1 3.49Å; W187-H242 WeakPolarHBondContact CB-NE2 3.49Å; W187-H242 AromaticContact CD1-CE1 3.53Å; W187-H242 AromaticContact CD1-ND1 3.45Å; W187-H242 AromaticContact CG-CE1 3.47Å; W187-H242 VanDerWaalsContact CG-CE1 3.47Å; W187-H242 AromaticContact CG-ND1 3.72Å; W187-H242 PolarHBondContact N-O 3.42Å; W187-H242 PolarHBondContact O-N 2.77Å; W187-F244 AromaticContact CD2-CD2 3.82Å; W187-F244 HydrophobicContact CD2-CD2 3.82Å; W187-F244 HydrophobicContact CD2-CE2 4.37Å; W187-F244 AromaticContact CE2-CD2 3.36Å; W187-F244 AromaticContact CE2-CE2 3.69Å; W187-F244 HydrophobicContact CE3-CD2 4.43Å; W187-F244 HydrophobicContact CG-CD2 4.23Å; W187-F244 HydrophobicContact CH2-CD2 4.23Å; W187-F244 AromaticContact CH2-CE2 3.8Å; W187-F244 HydrophobicContact CH2-CE2 3.8Å; W187-F244 AromaticContact CZ2-CD2 3.59Å; W187-F244 HydrophobicContact CZ2-CD2 3.59Å; W187-F244 AromaticContact CZ2-CE2 3.36Å; W187-F244 HydrophobicContact CZ2-CE2 3.36Å; W187-F244 HydrophobicContact CZ2-CZ 4.44Å; W187-F244 HydrophobicContact CZ3-CE2 4.49Å; W187-F244 AromaticContact NE1-CD2 3.56Å; W187-F247 AromaticContact CH2-CD2 3.79Å; W187-F247 HydrophobicContact CH2-CD2 3.79Å; W187-F247 AromaticContact CH2-CE2 3.93Å; W187-F247 HydrophobicContact CH2-CE2 3.93Å; W187-F247 HydrophobicContact CZ2-CD2 4.31Å; W187-V250 HydrophobicContact CH2-CG2 3.42Å; W187-V250 VanDerWaalsContact CH2-CG2 3.42Å; W187-V250 HydrophobicContact CZ2-CG2 3.43Å; W187-V250 VanDerWaalsContact CZ2-CG2 3.43Å; W187-L263 HydrophobicContact CZ3-CD1 4.28Å
188	A	96.9	Very high	92.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	135.8	177.6	0	0	0	0	0	112.2	W196 A198 I223 F225 R240 I241	A188-W196 PolarHBondContact N-O 3.49Å; A188-W196 PolarHBondContact O-N 3.22Å; A188-A198 HydrophobicContact CB-CB 4.16Å; A188-I223 HydrophobicContact CB-CD1 3.25Å; A188-F225 HydrophobicContact CB-CE1 3.85Å; A188-F225 HydrophobicContact CB-CZ 4.47Å; A188-R240 WeakPolarHBondContact CA-O 3.47Å; A188-I241 HydrophobicContact CB-CG1 4.42Å
189	K	95.6	Very high	93.5	Very high	74 Å²	74	31.4 Å²	31.4	32%	0.322	16%	0.161	S	C	.	.			trans	-100.8	118.6	-177.3	-167.4	73.3	-178.5	172.2	0	112.5	Y193 D195 R240	K189-Y193 PolarHBondContact NZ-O 3.01Å; K189-Y193 VanDerWaalsContact NZ-O 3.11Å; K189-D195 WeakPolarHBondContact CD-OD1 3.45Å; K189-D195 WeakPolarHBondContact CE-OD1 3.24Å; K189-D195 IonicContact NZ-OD1 2.71Å; K189-D195 PolarHBondContact NZ-OD1 2.84Å; K189-R240 HydrophobicContact CB-CB 4.02Å; K189-R240 HydrophobicContact CB-CG 4.3Å; K189-R240 PolarHBondContact N-O 2.9Å
190	T	93.7	Very high	94.2	Very high	30 Å²	30	27.5 Å²	27.5	18%	0.184	14%	0.143	C	C	.	.			trans	-114.8	153.6	167.5	43.7	0	0	0	0	111.5	Y193 F225 I236	T190-Y193 PolarHBondContact O-N 3.31Å; T190-F225 HydrophobicContact CG2-CE2 4.32Å; T190-F225 HydrophobicContact CG2-CZ 3.67Å; T190-I236 HydrophobicContact CG2-CD1 3.53Å
191	Q	92.7	Very high	94.2	Very high	174 Å²	174	27.8 Å²	27.8	81%	0.813	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.5	133.9	179.1	-173.6	171.2	-4	0	0	110.4	Y193	Q191-Y193 VanDerWaalsContact C-N 3.31Å; Q191-Y193 WeakPolarHBondContact O-CD2 3.37Å; Q191-Y193 PolarHBondContact O-N 3.45Å
192	G	92.5	Very high	94	Very high	59 Å²	59	29.6 Å²	29.6	61%	0.608	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.4	-5.4	-177.5	0	0	0	0	0	115.9
193	Y	92.6	Very high	93.8	Very high	111 Å²	111	30 Å²	30	44%	0.435	15%	0.152	S	C	.	.	S	Bend	trans	-118.4	154.2	-178.5	-69	-90.6	0	0	0	112.5	K189 T190 Q191 F259	K189-Y193 PolarHBondContact NZ-O 3.01Å; K189-Y193 VanDerWaalsContact NZ-O 3.11Å; T190-Y193 PolarHBondContact O-N 3.31Å; Q191-Y193 VanDerWaalsContact C-N 3.31Å; Q191-Y193 WeakPolarHBondContact O-CD2 3.37Å; Q191-Y193 PolarHBondContact O-N 3.45Å; Y193-F259 HydrophobicContact CD1-CD1 4.3Å; Y193-F259 AromaticContact CD1-CE1 3.5Å; Y193-F259 HydrophobicContact CD1-CE1 3.5Å; Y193-F259 VanDerWaalsContact CD1-CE1 3.5Å; Y193-F259 AromaticContact CD1-CZ 3.94Å; Y193-F259 HydrophobicContact CD1-CZ 3.94Å; Y193-F259 AromaticContact CE1-CE1 3.73Å; Y193-F259 HydrophobicContact CE1-CE1 3.73Å; Y193-F259 HydrophobicContact CE1-CZ 4.35Å; Y193-F259 HydrophobicContact CG-CE1 4.49Å
194	P	94.4	Very high	93.3	Very high	11 Å²	11	35.9 Å²	35.9	7%	0.071	19%	0.193	C	C	.	.			trans	-63.7	164.7	160.7	31.3	-35	0	0	0	109.7	W196 I255 F259 L263	P194-W196 HydrophobicContact CG-CE3 3.97Å; P194-W196 HydrophobicContact CG-CZ3 3.98Å; P194-W196 PolarHBondContact O-N 3.3Å; P194-I255 HydrophobicContact CB-CD1 4.2Å; P194-I255 HydrophobicContact CB-CG1 4.42Å; P194-I255 HydrophobicContact CB-CG2 3.92Å; P194-I255 HydrophobicContact CG-CG2 4.03Å; P194-F259 HydrophobicContact CG-CB 4.04Å; P194-F259 HydrophobicContact CG-CD1 4.49Å; P194-F259 HydrophobicContact CG-CD2 3.94Å; P194-F259 HydrophobicContact CG-CE2 4.47Å; P194-F259 HydrophobicContact CG-CG 3.92Å; P194-L263 HydrophobicContact CB-CD2 4.4Å; P194-L263 HydrophobicContact CG-CD2 4.26Å
195	D	94.9	Very high	92.7	Very high	53 Å²	53	41.3 Å²	41.3	28%	0.283	22%	0.219	S	C	.	.			trans	-55.4	128.6	168.7	-64.6	55.4	0	0	0	108.7	W187 K189 H242	W187-D195 HydrophobicContact CE3-CB 4.07Å; W187-D195 WeakPolarHBondContact CZ3-O 3.42Å; K189-D195 WeakPolarHBondContact CD-OD1 3.45Å; K189-D195 WeakPolarHBondContact CE-OD1 3.24Å; K189-D195 IonicContact NZ-OD1 2.71Å; K189-D195 PolarHBondContact NZ-OD1 2.84Å; D195-H242 IonicContact OD2-CD2 2.73Å; D195-H242 IonicContact OD2-CE1 2.94Å; D195-H242 IonicContact OD2-NE2 3.93Å; D195-H242 PolarHBondContact OD2-NE2 3.05Å
196	W	95.7	Very high	92.1	Very high	19 Å²	19	42.5 Å²	42.5	7%	0.072	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	136.8	-168.5	-153.6	-82.2	0	0	0	111.4	A188 P194 A198 F225 L226 F259 R262 L263 A266	A188-W196 PolarHBondContact N-O 3.49Å; A188-W196 PolarHBondContact O-N 3.22Å; P194-W196 HydrophobicContact CG-CE3 3.97Å; P194-W196 HydrophobicContact CG-CZ3 3.98Å; P194-W196 PolarHBondContact O-N 3.3Å; W196-A198 PolarHBondContact O-N 3.24Å; W196-F225 HydrophobicContact CB-CD1 3.89Å; W196-F225 HydrophobicContact CB-CE1 4Å; W196-F225 AromaticContact CD1-CD1 3.8Å; W196-F225 HydrophobicContact CG-CD1 4.07Å; W196-L226 PolarHBondContact NE1-O 3.05Å; W196-F259 HydrophobicContact CZ3-CB 4.29Å; W196-F259 AromaticContact CZ3-CD1 3.97Å; W196-F259 HydrophobicContact CZ3-CD1 3.97Å; W196-F259 HydrophobicContact CZ3-CG 4.41Å; W196-R262 HydrophobicContact CH2-CB 3.59Å; W196-R262 HydrophobicContact CZ2-CB 3.89Å; W196-L263 HydrophobicContact CD2-CD1 4.13Å; W196-L263 HydrophobicContact CE3-CD1 3.99Å; W196-L263 HydrophobicContact CH2-CB 4.16Å; W196-L263 HydrophobicContact CZ3-CB 4.28Å; W196-L263 HydrophobicContact CZ3-CD1 4.22Å; W196-A266 HydrophobicContact CZ2-CB 4.26Å
197	P	96.4	Very high	91.6	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	132.8	176.5	-17.5	31.3	0	0	0	111.1	V186 W187 L226 F244 L263 A266 A270	V186-P197 CarbonylContact O-C 3.52Å; W187-P197 HydrophobicContact CE3-CG 4.15Å; W187-P197 HydrophobicContact CH2-CG 3.88Å; W187-P197 HydrophobicContact CZ3-CG 3.56Å; P197-L226 WeakPolarHBondContact O-CB 3.42Å; P197-L226 PolarHBondContact O-N 3.37Å; P197-F244 HydrophobicContact CB-CD2 4.12Å; P197-F244 HydrophobicContact CB-CE2 3.97Å; P197-F244 HydrophobicContact CG-CD2 4.44Å; P197-F244 HydrophobicContact CG-CE2 3.96Å; P197-L263 HydrophobicContact CG-CD1 4.47Å; P197-A266 HydrophobicContact CB-CB 4.42Å; P197-A266 HydrophobicContact CG-CB 3.96Å; P197-A270 HydrophobicContact CB-CB 3.63Å
198	A	95.8	Very high	91.3	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	173.6	-177.1	0	0	0	0	0	110.3	V186 A188 W196 I223 V224 F225	V186-A198 HydrophobicContact CG2-CB 4.09Å; V186-A198 PolarHBondContact N-O 3.07Å; V186-A198 PolarHBondContact O-N 2.96Å; A188-A198 HydrophobicContact CB-CB 4.16Å; W196-A198 PolarHBondContact O-N 3.24Å; A198-I223 HydrophobicContact CB-CB 4.25Å; A198-I223 HydrophobicContact CB-CD1 3.95Å; A198-V224 CarbonylContact C-O 3.57Å; A198-V224 VanDerWaalsContact CA-O 3.24Å; A198-V224 WeakPolarHBondContact CA-O 3.44Å; A198-V224 WeakPolarHBondContact CB-O 3.48Å; A198-F225 HydrophobicContact CB-CD1 4.02Å; A198-F225 HydrophobicContact CB-CE1 4.5Å
199	M	95.3	Very high	91	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	142.3	172.2	-170.2	-172.7	72.4	0	0	109.3	S184 I223 V224 R281 L282 Y285	S184-M199 WeakPolarHBondContact O-CA 3.43Å; S184-M199 WeakPolarHBondContact O-CG 3.46Å; M199-I223 CarbonylContact O-C 3.49Å; M199-I223 VanDerWaalsContact O-CA 3.29Å; M199-I223 WeakPolarHBondContact O-CA 3.38Å; M199-V224 HydrophobicContact CB-CG1 4.09Å; M199-V224 HydrophobicContact CE-CG1 4.08Å; M199-V224 PolarHBondContact N-O 3.27Å; M199-V224 WeakPolarHBondContact O-CG1 3.46Å; M199-V224 PolarHBondContact O-N 3.33Å; M199-R281 HydrophobicContact SD-CB 3.79Å; M199-L282 HydrophobicContact CE-CD2 3.9Å; M199-Y285 HydrophobicContact SD-CD2 4.49Å
200	V	94.3	Very high	90.8	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	134.8	171.7	177	0	0	0	0	109.2	F180 S181 G183 S184 V186 Y208 Y221 Y222 I223	F180-V200 HydrophobicContact CB-CG2 4.03Å; S181-V200 VanDerWaalsContact O-CB 3.3Å; S181-V200 WeakPolarHBondContact O-CB 3.38Å; S181-V200 WeakPolarHBondContact O-CG1 3.43Å; G183-V200 PolarHBondContact N-O 3.14Å; S184-V200 PolarHBondContact O-N 3.38Å; V186-V200 HydrophobicContact CG1-CG2 4.36Å; V186-V200 HydrophobicContact CG2-CG2 4.49Å; V200-Y208 HydrophobicContact CG1-CD2 4.14Å; V200-Y221 HydrophobicContact CG1-CD1 4.22Å; V200-Y221 HydrophobicContact CG2-CD1 4.2Å; V200-Y222 WeakPolarHBondContact CA-O 3.31Å; V200-I223 HydrophobicContact CG2-CG2 4.25Å
201	Y	90.9	Very high	90.5	Very high	22 Å²	22	49.1 Å²	49.1	9%	0.086	26%	0.256	C	S	.	.			trans	-139.8	161.4	-176.1	84.7	-66.6	0	0	0	111.8	Y208 Y222 I223 V224 K233 G286	Y201-Y208 WeakPolarHBondContact O-CA 3.42Å; Y201-Y222 WeakPolarHBondContact CD1-O 3.22Å; Y201-Y222 PolarHBondContact N-O 3.48Å; Y201-I223 VanDerWaalsContact CE1-C 3.44Å; Y201-I223 VanDerWaalsContact CE1-O 3.26Å; Y201-I223 WeakPolarHBondContact CE1-O 3.36Å; Y201-V224 HydrophobicContact CD1-CB 4.08Å; Y201-V224 HydrophobicContact CD1-CG1 4.27Å; Y201-V224 HydrophobicContact CG-CB 4.34Å; Y201-V224 HydrophobicContact CG-CG1 4.24Å; Y201-K233 HydrophobicContact CE1-CB 4.36Å; Y201-K233 HydrophobicContact CE1-CG 4.15Å; Y201-K233 HydrophobicContact CE2-CD 3.8Å; Y201-K233 HydrophobicContact CE2-CG 4.14Å; Y201-G286 VanDerWaalsContact CD2-O 3.28Å; Y201-G286 WeakPolarHBondContact CD2-O 3.45Å
202	Y	86.7	Confident	90.2	Very high	43 Å²	43	43.4 Å²	43.4	17%	0.169	23%	0.231	C	C	.	.			trans	-78.2	125.2	172.3	-69.4	-73.7	0	0	0	111.1	V182 G206 Y208 Y287	V182-Y202 HydrophobicContact CB-CD2 4.19Å; V182-Y202 HydrophobicContact CB-CE2 3.85Å; V182-Y202 HydrophobicContact CG1-CD2 3.38Å; V182-Y202 HydrophobicContact CG1-CE2 3.52Å; V182-Y202 HydrophobicContact CG1-CG 3.97Å; V182-Y202 HydrophobicContact CG2-CD1 4.06Å; V182-Y202 HydrophobicContact CG2-CD2 4.11Å; V182-Y202 HydrophobicContact CG2-CE1 3.69Å; V182-Y202 HydrophobicContact CG2-CE2 3.71Å; V182-Y202 HydrophobicContact CG2-CG 4.29Å; Y202-G206 WeakPolarHBondContact CD1-O 3.18Å; Y202-Y208 HydrophobicContact CD1-CD1 4.17Å; Y202-Y208 AromaticContact CE1-CD1 3.81Å; Y202-Y208 HydrophobicContact CE1-CD1 3.81Å; Y202-Y287 WeakPolarHBondContact CD2-OH 3.32Å
203	N	86.7	Confident	89.7	Confident	15 Å²	15	45.1 Å²	45.1	8%	0.08	24%	0.239	C	C	.	.			trans	-66.8	178.6	170.9	82.2	-2	0	0	0	111.8	Q205 G206 R207 Y222	N203-Q205 PolarHBondContact ND2-OE1 3.27Å; N203-Q205 PolarHBondContact O-N 3.39Å; N203-Q205 VanDerWaalsContact OD1-CA 3.31Å; N203-Q205 WeakPolarHBondContact OD1-CA 3.31Å; N203-Q205 WeakPolarHBondContact OD1-CB 3.4Å; N203-Q205 PolarHBondContact OD1-N 3.02Å; N203-G206 PolarHBondContact O-N 2.68Å; N203-G206 PolarHBondContact OD1-N 3.37Å; N203-R207 WeakPolarHBondContact CB-O 3.49Å; N203-R207 PolarHBondContact N-O 2.97Å; N203-R207 PolarHBondContact OD1-N 3.42Å; N203-R207 PolarHBondContact OD1-O 3.21Å; N203-Y222 HydrophobicContact CB-CD1 3.77Å; N203-Y222 HydrophobicContact CB-CD2 4.23Å; N203-Y222 HydrophobicContact CB-CE1 3.98Å; N203-Y222 HydrophobicContact CB-CE2 4.4Å; N203-Y222 HydrophobicContact CB-CG 3.9Å; N203-Y222 WeakPolarHBondContact ND2-CE2 3.4Å; N203-Y222 PolarHBondContact ND2-OH 3.42Å
204	S	82.4	Confident	89.3	Confident	124 Å²	124	47 Å²	47	87%	0.867	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-10.3	179	49.3	0	0	0	0	115.5
205	Q	81.9	Confident	88.8	Confident	113 Å²	113	49.2 Å²	49.2	53%	0.528	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	2.8	176.1	-55.9	173.2	-50.9	0	0	112.5	N203 R207	N203-Q205 PolarHBondContact ND2-OE1 3.27Å; N203-Q205 PolarHBondContact O-N 3.39Å; N203-Q205 VanDerWaalsContact OD1-CA 3.31Å; N203-Q205 WeakPolarHBondContact OD1-CA 3.31Å; N203-Q205 WeakPolarHBondContact OD1-CB 3.4Å; N203-Q205 PolarHBondContact OD1-N 3.02Å; Q205-R207 VanDerWaalsContact C-N 3.34Å
206	G	82.6	Confident	88	Confident	25 Å²	25	49.5 Å²	49.5	26%	0.258	27%	0.271	S	S	.	.	S	Bend	trans	77.9	13.6	-174.2	0	0	0	0	0	114.6	Y202 N203	Y202-G206 WeakPolarHBondContact CD1-O 3.18Å; N203-G206 PolarHBondContact O-N 2.68Å; N203-G206 PolarHBondContact OD1-N 3.37Å
207	R	85.4	Confident	87.4	Confident	112 Å²	112	53 Å²	53	42%	0.423	29%	0.288	S	S	.	.			trans	-102.2	137.1	177.8	-66	179.1	169.4	177.7	-6.4	111	A89 N203 Q205 Y222	A89-R207 PolarHBondContact O-NH2 2.92Å; N203-R207 WeakPolarHBondContact CB-O 3.49Å; N203-R207 PolarHBondContact N-O 2.97Å; N203-R207 PolarHBondContact OD1-N 3.42Å; N203-R207 PolarHBondContact OD1-O 3.21Å; Q205-R207 VanDerWaalsContact C-N 3.34Å; R207-Y222 HydrophobicContact CB-CE2 4.49Å
208	Y	89.2	Confident	87.1	Confident	18 Å²	18	53.9 Å²	53.9	7%	0.071	29%	0.293	C	S	.	.	S	Bend	trans	-111.1	-11	179.2	64.3	-88.1	0	0	0	113.8	Q178 V182 V200 Y201 Y202 Y222	Q178-Y208 PolarHBondContact OE1-OH 3.12Å; V182-Y208 VanDerWaalsContact CG2-CB 3.46Å; V182-Y208 HydrophobicContact CG2-CD1 3.5Å; V182-Y208 HydrophobicContact CG2-CD2 3.92Å; V182-Y208 HydrophobicContact CG2-CE1 4.17Å; V182-Y208 HydrophobicContact CG2-CG 3.35Å; V200-Y208 HydrophobicContact CG1-CD2 4.14Å; Y201-Y208 WeakPolarHBondContact O-CA 3.42Å; Y202-Y208 HydrophobicContact CD1-CD1 4.17Å; Y202-Y208 AromaticContact CE1-CD1 3.81Å; Y202-Y208 HydrophobicContact CE1-CD1 3.81Å; Y208-Y222 PolarHBondContact O-N 2.73Å
209	A	91.4	Very high	86.9	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.008	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	164.4	176.6	0	0	0	0	0	109.9	F211 V218 D220 Y221	A209-F211 HydrophobicContact CB-CD1 4.2Å; A209-F211 HydrophobicContact CB-CE1 3.38Å; A209-F211 HydrophobicContact CB-CZ 3.64Å; A209-V218 HydrophobicContact CB-CG1 3.81Å; A209-D220 CarbonylContact C-O 3.6Å; A209-D220 WeakPolarHBondContact CA-O 3.28Å; A209-D220 WeakPolarHBondContact CB-O 3.38Å; A209-Y221 HydrophobicContact CB-CD1 3.94Å; A209-Y221 HydrophobicContact CB-CE1 4.31Å; A209-Y221 HydrophobicContact CB-CG 4.47Å
210	E	90.9	Very high	86.9	Confident	59 Å²	59	57.5 Å²	57.5	28%	0.276	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	146.6	165.2	-67.8	178.1	-164.2	0	0	108.6	V218 T219 D220 Y222 K235	E210-V218 CarbonylContact O-C 3.53Å; E210-V218 WeakPolarHBondContact O-CA 3.49Å; E210-V218 WeakPolarHBondContact O-CG1 3.19Å; E210-T219 PolarHBondContact O-N 3.07Å; E210-T219 PolarHBondContact O-OG1 2.63Å; E210-D220 HydrophobicContact CB-CB 4.46Å; E210-D220 PolarHBondContact N-O 3.17Å; E210-D220 PolarHBondContact O-N 2.58Å; E210-Y222 HydrophobicContact CG-CE2 4.02Å; E210-Y222 PolarHBondContact OE1-OH 3.29Å; E210-K235 VanDerWaalsContact CD-CD 3.46Å; E210-K235 HydrophobicContact CG-CD 4.26Å; E210-K235 WeakPolarHBondContact OE1-CD 3.46Å; E210-K235 WeakPolarHBondContact OE1-CE 3.1Å; E210-K235 IonicContact OE1-NZ 2.61Å; E210-K235 PolarHBondContact OE1-NZ 2.83Å; E210-K235 IonicContact OE2-NZ 2.61Å; E210-K235 PolarHBondContact OE2-NZ 3.46Å
211	F	87.6	Confident	87	Confident	73 Å²	73	57.7 Å²	57.7	32%	0.32	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	143.2	-168.3	-39.2	-75.2	0	0	0	109.4	I176 A209 E217 V218	I176-F211 HydrophobicContact CD1-CD1 4.28Å; I176-F211 HydrophobicContact CD1-CD2 3.92Å; I176-F211 HydrophobicContact CD1-CE1 4.11Å; I176-F211 HydrophobicContact CD1-CE2 3.74Å; I176-F211 HydrophobicContact CD1-CG 4.18Å; I176-F211 HydrophobicContact CD1-CZ 3.83Å; I176-F211 HydrophobicContact CG2-CD1 3.37Å; I176-F211 HydrophobicContact CG2-CE1 3.54Å; I176-F211 HydrophobicContact CG2-CG 4.03Å; I176-F211 HydrophobicContact CG2-CZ 4.31Å; A209-F211 HydrophobicContact CB-CD1 4.2Å; A209-F211 HydrophobicContact CB-CE1 3.38Å; A209-F211 HydrophobicContact CB-CZ 3.64Å; F211-E217 WeakPolarHBondContact CA-O 3.28Å; F211-V218 HydrophobicContact CD1-CB 4.34Å; F211-V218 HydrophobicContact CD1-CG2 3.8Å; F211-V218 HydrophobicContact CE1-CG2 3.88Å
212	D	86.9	Confident	87.1	Confident	54 Å²	54	58.2 Å²	58.2	29%	0.289	32%	0.318	S	S	.	.			trans	-78.8	122.4	168.2	162.4	50.8	0	0	0	109.3	N214 S215 K216 E217 T219	D212-N214 PolarHBondContact O-N 3.18Å; D212-N214 VanDerWaalsContact O-N 3.13Å; D212-N214 PolarHBondContact OD1-N 2.6Å; D212-N214 PolarHBondContact OD1-ND2 3.27Å; D212-N214 PolarHBondContact OD2-N 3.47Å; D212-S215 WeakPolarHBondContact CB-OG 3.4Å; D212-S215 PolarHBondContact O-N 3.38Å; D212-S215 VanDerWaalsContact OD2-CB 3.23Å; D212-S215 WeakPolarHBondContact OD2-CB 3.27Å; D212-S215 PolarHBondContact OD2-N 3.03Å; D212-S215 PolarHBondContact OD2-OG 2.97Å; D212-K216 WeakPolarHBondContact O-CA 3.42Å; D212-K216 PolarHBondContact O-N 3.23Å; D212-E217 PolarHBondContact N-O 2.91Å; D212-T219 HydrophobicContact CB-CG2 3.96Å
213	A	82.6	Confident	87.5	Confident	95 Å²	95	56.2 Å²	56.2	79%	0.785	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-20.3	-176.7	0	0	0	0	0	113.6
214	N	83.7	Confident	87.8	Confident	150 Å²	150	55.5 Å²	55.5	80%	0.802	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-45.1	-178	-53.6	-83.6	0	0	0	112.4	D212	D212-N214 PolarHBondContact O-N 3.18Å; D212-N214 VanDerWaalsContact O-N 3.13Å; D212-N214 PolarHBondContact OD1-N 2.6Å; D212-N214 PolarHBondContact OD1-ND2 3.27Å; D212-N214 PolarHBondContact OD2-N 3.47Å
215	S	83	Confident	88.4	Confident	58 Å²	58	51 Å²	51	41%	0.406	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-17.3	-177.8	60.3	0	0	0	0	114.5	D212 E217	D212-S215 WeakPolarHBondContact CB-OG 3.4Å; D212-S215 PolarHBondContact O-N 3.38Å; D212-S215 VanDerWaalsContact OD2-CB 3.23Å; D212-S215 WeakPolarHBondContact OD2-CB 3.27Å; D212-S215 PolarHBondContact OD2-N 3.03Å; D212-S215 PolarHBondContact OD2-OG 2.97Å; S215-E217 PolarHBondContact O-N 2.69Å; S215-E217 PolarHBondContact OG-N 3.47Å
216	K	78.9	Confident	88.9	Confident	58 Å²	58	45.7 Å²	45.7	25%	0.252	25%	0.246	S	C	.	.			trans	57.9	20.1	-170.2	-57.2	170.3	178.4	162.1	0	113.4	E172 D173 F177 D212	E172-K216 PolarHBondContact O-NZ 3.26Å; D173-K216 IonicContact OD1-NZ 2.62Å; D173-K216 PolarHBondContact OD1-NZ 3.04Å; F177-K216 HydrophobicContact CD2-CB 3.98Å; F177-K216 HydrophobicContact CE2-CB 4.2Å; F177-K216 PolarHBondContact N-O 2.88Å; D212-K216 WeakPolarHBondContact O-CA 3.42Å; D212-K216 PolarHBondContact O-N 3.23Å
217	E	83.6	Confident	89.1	Confident	94 Å²	94	45 Å²	45	44%	0.439	24%	0.239	S	C	.	.	B	Isolated β-bridge	trans	-95.5	149.9	174.1	-61.2	-154.9	138.6	0	0	111.8	K82 F177 F211 D212 S215 T219	K82-E217 IonicContact NZ-OE1 3.65Å; K82-E217 PolarHBondContact NZ-OE1 3.43Å; F177-E217 HydrophobicContact CB-CG 4.31Å; F211-E217 WeakPolarHBondContact CA-O 3.28Å; D212-E217 PolarHBondContact N-O 2.91Å; S215-E217 PolarHBondContact O-N 2.69Å; S215-E217 PolarHBondContact OG-N 3.47Å; E217-T219 PolarHBondContact O-N 3.25Å
218	V	88.9	Confident	88.4	Confident	17 Å²	17	44 Å²	44	10%	0.103	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	121.1	177.9	-175.9	0	0	0	0	111.1	Q178 A209 E210 F211 D220 Y221 A238	Q178-V218 HydrophobicContact CB-CG2 3.83Å; A209-V218 HydrophobicContact CB-CG1 3.81Å; E210-V218 CarbonylContact O-C 3.53Å; E210-V218 WeakPolarHBondContact O-CA 3.49Å; E210-V218 WeakPolarHBondContact O-CG1 3.19Å; F211-V218 HydrophobicContact CD1-CB 4.34Å; F211-V218 HydrophobicContact CD1-CG2 3.8Å; F211-V218 HydrophobicContact CE1-CG2 3.88Å; V218-D220 VanDerWaalsContact CG1-O 3.29Å; V218-D220 WeakPolarHBondContact CG1-O 3.43Å; V218-Y221 HydrophobicContact CB-CE2 4.02Å; V218-Y221 HydrophobicContact CG1-CD1 4.25Å; V218-Y221 HydrophobicContact CG1-CD2 3.69Å; V218-Y221 HydrophobicContact CG1-CE1 3.99Å; V218-Y221 HydrophobicContact CG1-CE2 3.41Å; V218-Y221 VanDerWaalsContact CG1-CE2 3.41Å; V218-Y221 HydrophobicContact CG1-CG 4.13Å; V218-Y221 HydrophobicContact CG2-CE1 4.31Å; V218-Y221 HydrophobicContact CG2-CE2 4.47Å; V218-A238 HydrophobicContact CB-CB 4.48Å; V218-A238 HydrophobicContact CG1-CB 4.33Å; V218-A238 VanDerWaalsContact O-CB 3.26Å; V218-A238 WeakPolarHBondContact O-CB 3.35Å
219	T	92.7	Very high	87.3	Confident	54 Å²	54	54 Å²	54	33%	0.331	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	-42.6	172.4	70.1	0	0	0	0	111.1	E210 D212 E217 Q237 A238	E210-T219 PolarHBondContact O-N 3.07Å; E210-T219 PolarHBondContact O-OG1 2.63Å; D212-T219 HydrophobicContact CB-CG2 3.96Å; E217-T219 PolarHBondContact O-N 3.25Å; T219-Q237 CarbonylContact O-C 3.55Å; T219-Q237 VanDerWaalsContact O-CA 3.25Å; T219-Q237 WeakPolarHBondContact O-CA 3.26Å; T219-A238 PolarHBondContact O-N 2.78Å
220	D	94.9	Very high	85.9	Confident	23 Å²	23	65.8 Å²	65.8	12%	0.123	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	149.6	-170.8	-65.7	-101	0	0	0	111.3	A209 E210 V218 K235 I236 Q237	A209-D220 CarbonylContact C-O 3.6Å; A209-D220 WeakPolarHBondContact CA-O 3.28Å; A209-D220 WeakPolarHBondContact CB-O 3.38Å; E210-D220 HydrophobicContact CB-CB 4.46Å; E210-D220 PolarHBondContact N-O 3.17Å; E210-D220 PolarHBondContact O-N 2.58Å; V218-D220 VanDerWaalsContact CG1-O 3.29Å; V218-D220 WeakPolarHBondContact CG1-O 3.43Å; D220-K235 HydrophobicContact CB-CD 3.75Å; D220-K235 HydrophobicContact CB-CG 3.58Å; D220-I236 CarbonylContact C-O 3.6Å; D220-I236 WeakPolarHBondContact CA-O 3.36Å; D220-Q237 VanDerWaalsContact OD1-CA 3.28Å; D220-Q237 WeakPolarHBondContact OD1-CA 3.23Å; D220-Q237 VanDerWaalsContact OD1-CG 3.22Å; D220-Q237 WeakPolarHBondContact OD1-CG 3.43Å; D220-Q237 PolarHBondContact OD1-N 2.96Å; D220-Q237 VanDerWaalsContact OD1-N 3.1Å
221	Y	95.2	Very high	85.2	Confident	3 Å²	3	65.2 Å²	65.2	1%	0.012	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	146.6	169	-63.8	-99.1	0	0	0	111.2	H179 F180 V200 A209 V218 K235 I236 A238 I241	H179-Y221 PolarHBondContact N-OH 3.11Å; F180-Y221 HydrophobicContact CB-CD1 4.34Å; F180-Y221 HydrophobicContact CB-CE1 3.77Å; F180-Y221 HydrophobicContact CD2-CE1 4.28Å; F180-Y221 AromaticContact CD2-CE2 3.94Å; F180-Y221 HydrophobicContact CD2-CE2 3.94Å; F180-Y221 AromaticContact CD2-CZ 3.76Å; F180-Y221 WeakPolarHBondContact O-CE1 3.38Å; V200-Y221 HydrophobicContact CG1-CD1 4.22Å; V200-Y221 HydrophobicContact CG2-CD1 4.2Å; A209-Y221 HydrophobicContact CB-CD1 3.94Å; A209-Y221 HydrophobicContact CB-CE1 4.31Å; A209-Y221 HydrophobicContact CB-CG 4.47Å; V218-Y221 HydrophobicContact CB-CE2 4.02Å; V218-Y221 HydrophobicContact CG1-CD1 4.25Å; V218-Y221 HydrophobicContact CG1-CD2 3.69Å; V218-Y221 HydrophobicContact CG1-CE1 3.99Å; V218-Y221 HydrophobicContact CG1-CE2 3.41Å; V218-Y221 VanDerWaalsContact CG1-CE2 3.41Å; V218-Y221 HydrophobicContact CG1-CG 4.13Å; V218-Y221 HydrophobicContact CG2-CE1 4.31Å; V218-Y221 HydrophobicContact CG2-CE2 4.47Å; Y221-K235 WeakPolarHBondContact O-CA 3.32Å; Y221-I236 PolarHBondContact N-O 2.94Å; Y221-I236 PolarHBondContact O-N 3.5Å; Y221-A238 HydrophobicContact CD2-CB 4.13Å; Y221-A238 HydrophobicContact CE2-CB 3.76Å; Y221-I241 HydrophobicContact CD2-CD1 3.83Å; Y221-I241 HydrophobicContact CG-CD1 4.12Å
222	Y	94.7	Very high	85.2	Confident	34 Å²	34	64.4 Å²	64.4	13%	0.133	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	117.4	166.4	-71.6	-83.1	0	0	0	109.2	V200 Y201 N203 R207 Y208 E210 K235	V200-Y222 WeakPolarHBondContact CA-O 3.31Å; Y201-Y222 WeakPolarHBondContact CD1-O 3.22Å; Y201-Y222 PolarHBondContact N-O 3.48Å; N203-Y222 HydrophobicContact CB-CD1 3.77Å; N203-Y222 HydrophobicContact CB-CD2 4.23Å; N203-Y222 HydrophobicContact CB-CE1 3.98Å; N203-Y222 HydrophobicContact CB-CE2 4.4Å; N203-Y222 HydrophobicContact CB-CG 3.9Å; N203-Y222 WeakPolarHBondContact ND2-CE2 3.4Å; N203-Y222 PolarHBondContact ND2-OH 3.42Å; R207-Y222 HydrophobicContact CB-CE2 4.49Å; Y208-Y222 PolarHBondContact O-N 2.73Å; E210-Y222 HydrophobicContact CG-CE2 4.02Å; E210-Y222 PolarHBondContact OE1-OH 3.29Å; Y222-K235 HydrophobicContact CD1-CB 4.2Å; Y222-K235 HydrophobicContact CE1-CB 4.1Å; Y222-K235 HydrophobicContact CE1-CD 4.25Å; Y222-K235 HydrophobicContact CE1-CG 4.4Å; Y222-K235 HydrophobicContact CE2-CD 4.47Å
223	I	94.7	Very high	85.4	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	153.3	-176.8	65.4	166.2	0	0	0	112.8	V186 A188 A198 M199 V200 Y201 F225 K233 S234 I236 I241	V186-I223 HydrophobicContact CG2-CG2 4.4Å; A188-I223 HydrophobicContact CB-CD1 3.25Å; A198-I223 HydrophobicContact CB-CB 4.25Å; A198-I223 HydrophobicContact CB-CD1 3.95Å; M199-I223 CarbonylContact O-C 3.49Å; M199-I223 VanDerWaalsContact O-CA 3.29Å; M199-I223 WeakPolarHBondContact O-CA 3.38Å; V200-I223 HydrophobicContact CG2-CG2 4.25Å; Y201-I223 VanDerWaalsContact CE1-C 3.44Å; Y201-I223 VanDerWaalsContact CE1-O 3.26Å; Y201-I223 WeakPolarHBondContact CE1-O 3.36Å; I223-F225 HydrophobicContact CD1-CD1 4.4Å; I223-F225 HydrophobicContact CD1-CE1 3.82Å; I223-F225 HydrophobicContact CD1-CE2 4.23Å; I223-F225 HydrophobicContact CD1-CZ 3.7Å; I223-K233 WeakPolarHBondContact O-CA 3.28Å; I223-S234 PolarHBondContact N-O 3.41Å; I223-S234 PolarHBondContact O-N 3.22Å; I223-I236 HydrophobicContact CD1-CB 4.13Å; I223-I236 HydrophobicContact CD1-CG1 3.56Å; I223-I236 HydrophobicContact CG1-CG1 3.99Å; I223-I241 HydrophobicContact CG2-CD1 3.87Å
224	V	93.5	Very high	85.9	Confident	1 Å²	1	62.7 Å²	62.7	1%	0.006	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	117.4	169.9	57.8	0	0	0	0	109	A198 M199 Y201 A232 K233	A198-V224 CarbonylContact C-O 3.57Å; A198-V224 VanDerWaalsContact CA-O 3.24Å; A198-V224 WeakPolarHBondContact CA-O 3.44Å; A198-V224 WeakPolarHBondContact CB-O 3.48Å; M199-V224 HydrophobicContact CB-CG1 4.09Å; M199-V224 HydrophobicContact CE-CG1 4.08Å; M199-V224 PolarHBondContact N-O 3.27Å; M199-V224 WeakPolarHBondContact O-CG1 3.46Å; M199-V224 PolarHBondContact O-N 3.33Å; Y201-V224 HydrophobicContact CD1-CB 4.08Å; Y201-V224 HydrophobicContact CD1-CG1 4.27Å; Y201-V224 HydrophobicContact CG-CB 4.34Å; Y201-V224 HydrophobicContact CG-CG1 4.24Å; V224-A232 WeakPolarHBondContact CA-O 3.46Å; V224-K233 HydrophobicContact CB-CG 4.25Å; V224-K233 HydrophobicContact CG2-CG 4.21Å
225	F	94.1	Very high	86.5	Confident	28 Å²	28	59.6 Å²	59.6	12%	0.123	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	129.1	179.3	-70.9	-71.3	0	0	0	110.7	A188 T190 W196 A198 I223 S231 A232	A188-F225 HydrophobicContact CB-CE1 3.85Å; A188-F225 HydrophobicContact CB-CZ 4.47Å; T190-F225 HydrophobicContact CG2-CE2 4.32Å; T190-F225 HydrophobicContact CG2-CZ 3.67Å; W196-F225 HydrophobicContact CB-CD1 3.89Å; W196-F225 HydrophobicContact CB-CE1 4Å; W196-F225 AromaticContact CD1-CD1 3.8Å; W196-F225 HydrophobicContact CG-CD1 4.07Å; A198-F225 HydrophobicContact CB-CD1 4.02Å; A198-F225 HydrophobicContact CB-CE1 4.5Å; I223-F225 HydrophobicContact CD1-CD1 4.4Å; I223-F225 HydrophobicContact CD1-CE1 3.82Å; I223-F225 HydrophobicContact CD1-CE2 4.23Å; I223-F225 HydrophobicContact CD1-CZ 3.7Å; F225-S231 WeakPolarHBondContact O-CA 3.38Å; F225-S231 VanDerWaalsContact O-CB 3.29Å; F225-S231 WeakPolarHBondContact O-CB 2.95Å; F225-A232 HydrophobicContact CB-CB 4.48Å; F225-A232 HydrophobicContact CD2-CB 4.16Å; F225-A232 VanDerWaalsContact CD2-O 3.31Å; F225-A232 WeakPolarHBondContact CD2-O 3.39Å; F225-A232 PolarHBondContact N-O 2.89Å
226	L	93.3	Very high	87.1	Confident	2 Å²	2	57.4 Å²	57.4	1%	0.01	28%	0.279	C	S	.	.			trans	-80.8	152.6	178.1	-58.9	172.6	0	0	0	110.4	V185 W196 P197 A266 E269 A270 Y285	V185-L226 HydrophobicContact CG1-CD1 4.25Å; W196-L226 PolarHBondContact NE1-O 3.05Å; P197-L226 WeakPolarHBondContact O-CB 3.42Å; P197-L226 PolarHBondContact O-N 3.37Å; L226-A266 WeakPolarHBondContact O-CB 3.38Å; L226-E269 HydrophobicContact CB-CG 4.41Å; L226-A270 HydrophobicContact CD1-CB 3.68Å; L226-Y285 HydrophobicContact CD2-CD1 3.75Å; L226-Y285 HydrophobicContact CD2-CE1 4.35Å; L226-Y285 HydrophobicContact CD2-CG 4.03Å
227	G	87	Confident	87.9	Confident	11 Å²	11	58.2 Å²	58.2	11%	0.113	28%	0.283	C	S	.	.	S	Bend	trans	145.9	161.9	179.3	0	0	0	0	0	114.6	R229 E269	G227-R229 PolarHBondContact O-N 3.03Å; G227-E269 VanDerWaalsContact C-OE2 3.29Å; G227-E269 VanDerWaalsContact CA-OE2 3.28Å; G227-E269 WeakPolarHBondContact CA-OE2 3.35Å; G227-E269 PolarHBondContact N-OE2 3.04Å
228	P	69.1	Low	88.3	Confident	90 Å²	90	55 Å²	55	58%	0.584	27%	0.273	S	S	*	.	S	Bend	trans	-73.6	14.3	-165.5	31.1	-39	0	0	0	116.1	A265	P228-A265 HydrophobicContact CG-CB 3.77Å
229	R	66.3	Low	88.6	Confident	230 Å²	230	62.4 Å²	62.4	87%	0.868	30%	0.304	S	S	*	.	S	Bend	trans	-147.7	120.3	175.9	-66	-173.4	-178.5	-168.6	0.3	109.2	G227	G227-R229 PolarHBondContact O-N 3.03Å
230	R	63.3	Low	88.7	Confident	247 Å²	247	65.3 Å²	65.3	93%	0.932	31%	0.308	S	S	*	.			trans	24.6	92.9	173.5	-74.2	-169.2	179.4	-177.5	0.5	114.1	A232	R230-A232 PolarHBondContact O-N 3.01Å
231	S	75.5	Confident	88.7	Confident	47 Å²	47	64.9 Å²	64.9	33%	0.329	31%	0.306	S	S	.	.			trans	-49.7	105.5	-178.3	-33.9	0	0	0	0	111.5	F225	F225-S231 WeakPolarHBondContact O-CA 3.38Å; F225-S231 VanDerWaalsContact O-CB 3.29Å; F225-S231 WeakPolarHBondContact O-CB 2.95Å
232	A	87.4	Confident	88.7	Confident	56 Å²	56	68.8 Å²	68.8	46%	0.463	32%	0.324	S	S	.	.			trans	-76	133.3	-170.6	0	0	0	0	0	110.4	V224 F225 R230	V224-A232 WeakPolarHBondContact CA-O 3.46Å; F225-A232 HydrophobicContact CB-CB 4.48Å; F225-A232 HydrophobicContact CD2-CB 4.16Å; F225-A232 VanDerWaalsContact CD2-O 3.31Å; F225-A232 WeakPolarHBondContact CD2-O 3.39Å; F225-A232 PolarHBondContact N-O 2.89Å; R230-A232 PolarHBondContact O-N 3.01Å
233	K	90.9	Very high	88.6	Confident	73 Å²	73	70.5 Å²	70.5	32%	0.317	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	141.8	-179.2	-71.1	167.6	-179.7	169.8	0	110.8	Y201 I223 V224 D288	Y201-K233 HydrophobicContact CE1-CB 4.36Å; Y201-K233 HydrophobicContact CE1-CG 4.15Å; Y201-K233 HydrophobicContact CE2-CD 3.8Å; Y201-K233 HydrophobicContact CE2-CG 4.14Å; I223-K233 WeakPolarHBondContact O-CA 3.28Å; V224-K233 HydrophobicContact CB-CG 4.25Å; V224-K233 HydrophobicContact CG2-CG 4.21Å; K233-D288 IonicContact NZ-OD1 2.69Å; K233-D288 PolarHBondContact NZ-OD1 2.92Å; K233-D288 IonicContact NZ-OD2 3.65Å; K233-D288 PolarHBondContact NZ-OD2 2.75Å
234	S	93.4	Very high	88.6	Confident	40 Å²	40	70.8 Å²	70.8	28%	0.28	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	160.7	179.4	-160.8	0	0	0	0	111.7	I223	I223-S234 PolarHBondContact N-O 3.41Å; I223-S234 PolarHBondContact O-N 3.22Å
235	K	95.4	Very high	88.5	Confident	85 Å²	85	73.7 Å²	73.7	37%	0.37	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	125.8	164.2	-177.8	175.3	73.3	171.4	0	107.7	E210 D220 Y221 Y222	E210-K235 VanDerWaalsContact CD-CD 3.46Å; E210-K235 HydrophobicContact CG-CD 4.26Å; E210-K235 WeakPolarHBondContact OE1-CD 3.46Å; E210-K235 WeakPolarHBondContact OE1-CE 3.1Å; E210-K235 IonicContact OE1-NZ 2.61Å; E210-K235 PolarHBondContact OE1-NZ 2.83Å; E210-K235 IonicContact OE2-NZ 2.61Å; E210-K235 PolarHBondContact OE2-NZ 3.46Å; D220-K235 HydrophobicContact CB-CD 3.75Å; D220-K235 HydrophobicContact CB-CG 3.58Å; Y221-K235 WeakPolarHBondContact O-CA 3.32Å; Y222-K235 HydrophobicContact CD1-CB 4.2Å; Y222-K235 HydrophobicContact CE1-CB 4.1Å; Y222-K235 HydrophobicContact CE1-CD 4.25Å; Y222-K235 HydrophobicContact CE1-CG 4.4Å; Y222-K235 HydrophobicContact CE2-CD 4.47Å
236	I	95.9	Very high	88.5	Confident	13 Å²	13	73.7 Å²	73.7	7%	0.067	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	131.1	-176.4	-60.9	-64.9	0	0	0	110.1	T190 D220 Y221 I223 R240 I241	T190-I236 HydrophobicContact CG2-CD1 3.53Å; D220-I236 CarbonylContact C-O 3.6Å; D220-I236 WeakPolarHBondContact CA-O 3.36Å; Y221-I236 PolarHBondContact N-O 2.94Å; Y221-I236 PolarHBondContact O-N 3.5Å; I223-I236 HydrophobicContact CD1-CB 4.13Å; I223-I236 HydrophobicContact CD1-CG1 3.56Å; I223-I236 HydrophobicContact CG1-CG1 3.99Å; I236-R240 HydrophobicContact CG2-CB 3.63Å; I236-I241 HydrophobicContact CB-CD1 4.08Å; I236-I241 HydrophobicContact CB-CG1 4.29Å; I236-I241 HydrophobicContact CG2-CD1 4.14Å; I236-I241 HydrophobicContact CG2-CG1 3.79Å
237	Q	95.6	Very high	88.4	Confident	74 Å²	74	74.6 Å²	74.6	35%	0.346	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.1	137.9	177.4	-68.1	176.3	-14.7	0	0	111.9	T219 D220 K239 R240	T219-Q237 CarbonylContact O-C 3.55Å; T219-Q237 VanDerWaalsContact O-CA 3.25Å; T219-Q237 WeakPolarHBondContact O-CA 3.26Å; D220-Q237 VanDerWaalsContact OD1-CA 3.28Å; D220-Q237 WeakPolarHBondContact OD1-CA 3.23Å; D220-Q237 VanDerWaalsContact OD1-CG 3.22Å; D220-Q237 WeakPolarHBondContact OD1-CG 3.43Å; D220-Q237 PolarHBondContact OD1-N 2.96Å; D220-Q237 VanDerWaalsContact OD1-N 3.1Å; Q237-K239 VanDerWaalsContact C-N 3.26Å; Q237-K239 HydrophobicContact CB-CG 4.26Å; Q237-K239 PolarHBondContact O-N 3.13Å; Q237-K239 VanDerWaalsContact O-N 3.15Å; Q237-R240 WeakPolarHBondContact O-CA 3.23Å; Q237-R240 WeakPolarHBondContact O-CB 3.49Å; Q237-R240 PolarHBondContact O-N 2.62Å
238	A	93.6	Very high	88.6	Confident	26 Å²	26	80.6 Å²	80.6	22%	0.215	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-53.3	-40.5	-176.5	0	0	0	0	0	113	V218 T219 Y221 R240 I241	V218-A238 HydrophobicContact CB-CB 4.48Å; V218-A238 HydrophobicContact CG1-CB 4.33Å; V218-A238 VanDerWaalsContact O-CB 3.26Å; V218-A238 WeakPolarHBondContact O-CB 3.35Å; T219-A238 PolarHBondContact O-N 2.78Å; Y221-A238 HydrophobicContact CD2-CB 4.13Å; Y221-A238 HydrophobicContact CE2-CB 3.76Å; A238-R240 PolarHBondContact O-N 3.02Å; A238-I241 PolarHBondContact O-N 2.86Å
239	K	94	Very high	89.4	Confident	174 Å²	174	83.2 Å²	83.2	76%	0.757	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-64.1	-4.8	174.9	70.6	-173.7	176.2	-170	0	115.5	Q237	Q237-K239 VanDerWaalsContact C-N 3.26Å; Q237-K239 HydrophobicContact CB-CG 4.26Å; Q237-K239 PolarHBondContact O-N 3.13Å; Q237-K239 VanDerWaalsContact O-N 3.15Å
240	R	95.8	Very high	90.5	Very high	114 Å²	114	73.9 Å²	73.9	43%	0.43	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-111.6	13.3	175.6	-75.3	-177.8	176.3	175.3	0.5	112	A188 K189 I236 Q237 A238	A188-R240 WeakPolarHBondContact CA-O 3.47Å; K189-R240 HydrophobicContact CB-CB 4.02Å; K189-R240 HydrophobicContact CB-CG 4.3Å; K189-R240 PolarHBondContact N-O 2.9Å; I236-R240 HydrophobicContact CG2-CB 3.63Å; Q237-R240 WeakPolarHBondContact O-CA 3.23Å; Q237-R240 WeakPolarHBondContact O-CB 3.49Å; Q237-R240 PolarHBondContact O-N 2.62Å; A238-R240 PolarHBondContact O-N 3.02Å
241	I	95	Very high	91.7	Very high	14 Å²	14	65.4 Å²	65.4	7%	0.072	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	137	179.6	-59.2	-177.8	0	0	0	109.5	F180 V186 W187 A188 Y221 I223 I236 A238	F180-I241 HydrophobicContact CD2-CG2 3.94Å; F180-I241 HydrophobicContact CE2-CB 4.37Å; F180-I241 HydrophobicContact CE2-CG2 3.7Å; F180-I241 HydrophobicContact CZ-CG2 4.29Å; V186-I241 HydrophobicContact CB-CG2 3.59Å; V186-I241 HydrophobicContact CG1-CG2 3.83Å; V186-I241 HydrophobicContact CG2-CG2 3.75Å; W187-I241 CarbonylContact O-C 3.51Å; W187-I241 VanDerWaalsContact O-CA 3.28Å; W187-I241 WeakPolarHBondContact O-CA 3.5Å; A188-I241 HydrophobicContact CB-CG1 4.42Å; Y221-I241 HydrophobicContact CD2-CD1 3.83Å; Y221-I241 HydrophobicContact CG-CD1 4.12Å; I223-I241 HydrophobicContact CG2-CD1 3.87Å; I236-I241 HydrophobicContact CB-CD1 4.08Å; I236-I241 HydrophobicContact CB-CG1 4.29Å; I236-I241 HydrophobicContact CG2-CD1 4.14Å; I236-I241 HydrophobicContact CG2-CG1 3.79Å; A238-I241 PolarHBondContact O-N 2.86Å
242	H	93.7	Very high	92.4	Very high	86 Å²	86	65.6 Å²	65.6	40%	0.398	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	162.9	175	54.7	106.7	0	0	0	112.1	V186 W187 D195 F244	V186-H242 CarbonylContact C-O 3.58Å; V186-H242 VanDerWaalsContact CA-O 3.31Å; V186-H242 WeakPolarHBondContact CA-O 3.47Å; V186-H242 WeakPolarHBondContact CB-O 3.25Å; W187-H242 WeakPolarHBondContact CB-CE1 3.5Å; W187-H242 WeakPolarHBondContact CB-ND1 3.49Å; W187-H242 WeakPolarHBondContact CB-NE2 3.49Å; W187-H242 AromaticContact CD1-CE1 3.53Å; W187-H242 AromaticContact CD1-ND1 3.45Å; W187-H242 AromaticContact CG-CE1 3.47Å; W187-H242 VanDerWaalsContact CG-CE1 3.47Å; W187-H242 AromaticContact CG-ND1 3.72Å; W187-H242 PolarHBondContact N-O 3.42Å; W187-H242 PolarHBondContact O-N 2.77Å; D195-H242 IonicContact OD2-CD2 2.73Å; D195-H242 IonicContact OD2-CE1 2.94Å; D195-H242 IonicContact OD2-NE2 3.93Å; D195-H242 PolarHBondContact OD2-NE2 3.05Å; H242-F244 PolarHBondContact O-N 3.22Å
243	K	94	Very high	92.5	Very high	70 Å²	70	67.5 Å²	67.5	30%	0.304	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	127.2	-173	173.8	171	164.9	169.5	0	111.6	S128 L130 D132 F180 S245	S128-K243 WeakPolarHBondContact O-CD 3.35Å; S128-K243 WeakPolarHBondContact O-CE 3.38Å; S128-K243 PolarHBondContact O-NZ 3.49Å; L130-K243 PolarHBondContact O-NZ 3.39Å; D132-K243 IonicContact OD1-NZ 2.69Å; F180-K243 HydrophobicContact CE1-CB 4.05Å; F180-K243 HydrophobicContact CZ-CB 4.49Å; K243-S245 PolarHBondContact O-N 2.78Å
244	F	94.8	Very high	92.5	Very high	5 Å²	5	71.9 Å²	71.9	2%	0.022	36%	0.362	C	S	.	.			trans	-85.6	110.8	172.2	-175.1	-82	0	0	0	109.8	V185 W187 P197 H242 F247 A270 E271 L274	V185-F244 HydrophobicContact CB-CB 4.37Å; V185-F244 HydrophobicContact CG1-CB 3.94Å; V185-F244 HydrophobicContact CG1-CD1 3.98Å; V185-F244 HydrophobicContact CG1-CG 4.03Å; V185-F244 WeakPolarHBondContact O-CB 3.4Å; V185-F244 PolarHBondContact O-N 3.25Å; W187-F244 AromaticContact CD2-CD2 3.82Å; W187-F244 HydrophobicContact CD2-CD2 3.82Å; W187-F244 HydrophobicContact CD2-CE2 4.37Å; W187-F244 AromaticContact CE2-CD2 3.36Å; W187-F244 AromaticContact CE2-CE2 3.69Å; W187-F244 HydrophobicContact CE3-CD2 4.43Å; W187-F244 HydrophobicContact CG-CD2 4.23Å; W187-F244 HydrophobicContact CH2-CD2 4.23Å; W187-F244 AromaticContact CH2-CE2 3.8Å; W187-F244 HydrophobicContact CH2-CE2 3.8Å; W187-F244 AromaticContact CZ2-CD2 3.59Å; W187-F244 HydrophobicContact CZ2-CD2 3.59Å; W187-F244 AromaticContact CZ2-CE2 3.36Å; W187-F244 HydrophobicContact CZ2-CE2 3.36Å; W187-F244 HydrophobicContact CZ2-CZ 4.44Å; W187-F244 HydrophobicContact CZ3-CE2 4.49Å; W187-F244 AromaticContact NE1-CD2 3.56Å; P197-F244 HydrophobicContact CB-CD2 4.12Å; P197-F244 HydrophobicContact CB-CE2 3.97Å; P197-F244 HydrophobicContact CG-CD2 4.44Å; P197-F244 HydrophobicContact CG-CE2 3.96Å; H242-F244 PolarHBondContact O-N 3.22Å; F244-F247 HydrophobicContact CZ-CB 4.2Å; F244-A270 HydrophobicContact CD1-CB 3.95Å; F244-A270 HydrophobicContact CD2-CB 4.13Å; F244-A270 HydrophobicContact CE1-CB 3.55Å; F244-A270 HydrophobicContact CE2-CB 3.73Å; F244-A270 HydrophobicContact CG-CB 4.25Å; F244-A270 HydrophobicContact CZ-CB 3.44Å; F244-A270 VanDerWaalsContact CZ-CB 3.44Å; F244-E271 HydrophobicContact CE1-CG 4.47Å; F244-L274 HydrophobicContact CD1-CD1 3.82Å; F244-L274 HydrophobicContact CD1-CG 4.42Å; F244-L274 HydrophobicContact CE1-CD1 4.11Å
245	S	91.2	Very high	92.4	Very high	63 Å²	63	71.2 Å²	71.2	44%	0.441	36%	0.355	S	S	.	.			trans	-97.1	-49.2	177.2	-61.6	0	0	0	0	112.5	K243 L274	K243-S245 PolarHBondContact O-N 2.78Å; S245-L274 WeakPolarHBondContact O-CD1 3.49Å
246	T	92.8	Very high	92.3	Very high	27 Å²	27	70.3 Å²	70.3	17%	0.166	36%	0.357	C	S	.	.			trans	-157.4	161.3	177.4	-179.2	0	0	0	0	110.2	N248 E249	T246-N248 HydrophobicContact CG2-CB 4.36Å; T246-N248 PolarHBondContact OG1-N 3.31Å; T246-N248 PolarHBondContact OG1-ND2 2.81Å; T246-E249 HydrophobicContact CG2-CB 4.31Å; T246-E249 VanDerWaalsContact CG2-CD 3.44Å; T246-E249 HydrophobicContact CG2-CG 3.69Å; T246-E249 WeakPolarHBondContact CG2-OE1 3.24Å
247	F	92.8	Very high	92.1	Very high	22 Å²	22	76.6 Å²	76.6	10%	0.096	39%	0.387	C	S	.	.	S	Bend	trans	-82.1	-18.7	169.6	-166.2	-106.3	0	0	0	113.2	W187 F244 E249 V250 L252 L263 Q264	W187-F247 AromaticContact CH2-CD2 3.79Å; W187-F247 HydrophobicContact CH2-CD2 3.79Å; W187-F247 AromaticContact CH2-CE2 3.93Å; W187-F247 HydrophobicContact CH2-CE2 3.93Å; W187-F247 HydrophobicContact CZ2-CD2 4.31Å; F244-F247 HydrophobicContact CZ-CB 4.2Å; F247-E249 PolarHBondContact O-N 3.07Å; F247-E249 VanDerWaalsContact O-N 3.17Å; F247-V250 HydrophobicContact CD2-CG2 3.88Å; F247-V250 HydrophobicContact CE2-CB 4.26Å; F247-V250 HydrophobicContact CE2-CG1 4.37Å; F247-V250 HydrophobicContact CE2-CG2 3.93Å; F247-V250 HydrophobicContact CG-CG2 4.45Å; F247-V250 HydrophobicContact CZ-CB 4.35Å; F247-V250 HydrophobicContact CZ-CG1 4.35Å; F247-V250 HydrophobicContact CZ-CG2 4.49Å; F247-V250 WeakPolarHBondContact O-CB 3Å; F247-V250 VanDerWaalsContact O-CG2 3.31Å; F247-V250 WeakPolarHBondContact O-CG2 3.01Å; F247-V250 PolarHBondContact O-N 2.71Å; F247-V250 VanDerWaalsContact O-N 3.12Å; F247-L252 HydrophobicContact CZ-CD2 4.2Å; F247-L263 HydrophobicContact CE2-CD1 4.41Å; F247-L263 HydrophobicContact CE2-CG 3.93Å; F247-L263 WeakPolarHBondContact CE2-O 3.25Å; F247-L263 HydrophobicContact CZ-CG 4.06Å; F247-Q264 HydrophobicContact CE1-CB 4.15Å; F247-Q264 HydrophobicContact CE1-CG 4.14Å; F247-Q264 HydrophobicContact CZ-CB 4.32Å
248	N	89.6	Confident	92	Very high	136 Å²	136	81.8 Å²	81.8	73%	0.727	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-13.9	-172.6	-62.2	-43.8	0	0	0	114.3	T246 V250	T246-N248 HydrophobicContact CG2-CB 4.36Å; T246-N248 PolarHBondContact OG1-N 3.31Å; T246-N248 PolarHBondContact OG1-ND2 2.81Å; N248-V250 VanDerWaalsContact C-N 3.29Å
249	E	86.3	Confident	91.9	Very high	145 Å²	145	81.2 Å²	81.2	68%	0.678	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-4.6	175.9	-70.9	161.9	-171.7	0	0	112.6	T246 F247 D251	T246-E249 HydrophobicContact CG2-CB 4.31Å; T246-E249 VanDerWaalsContact CG2-CD 3.44Å; T246-E249 HydrophobicContact CG2-CG 3.69Å; T246-E249 WeakPolarHBondContact CG2-OE1 3.24Å; F247-E249 PolarHBondContact O-N 3.07Å; F247-E249 VanDerWaalsContact O-N 3.17Å; E249-D251 PolarHBondContact O-N 2.98Å
250	V	88.6	Confident	91.9	Very high	34 Å²	34	77.5 Å²	77.5	21%	0.206	38%	0.377	C	S	.	.			trans	-84.6	107.5	-176.8	-177.5	0	0	0	0	111.4	W187 F247 N248 L252 I255	W187-V250 HydrophobicContact CH2-CG2 3.42Å; W187-V250 VanDerWaalsContact CH2-CG2 3.42Å; W187-V250 HydrophobicContact CZ2-CG2 3.43Å; W187-V250 VanDerWaalsContact CZ2-CG2 3.43Å; F247-V250 HydrophobicContact CD2-CG2 3.88Å; F247-V250 HydrophobicContact CE2-CB 4.26Å; F247-V250 HydrophobicContact CE2-CG1 4.37Å; F247-V250 HydrophobicContact CE2-CG2 3.93Å; F247-V250 HydrophobicContact CG-CG2 4.45Å; F247-V250 HydrophobicContact CZ-CB 4.35Å; F247-V250 HydrophobicContact CZ-CG1 4.35Å; F247-V250 HydrophobicContact CZ-CG2 4.49Å; F247-V250 WeakPolarHBondContact O-CB 3Å; F247-V250 VanDerWaalsContact O-CG2 3.31Å; F247-V250 WeakPolarHBondContact O-CG2 3.01Å; F247-V250 PolarHBondContact O-N 2.71Å; F247-V250 VanDerWaalsContact O-N 3.12Å; N248-V250 VanDerWaalsContact C-N 3.29Å; V250-L252 HydrophobicContact CG1-CD2 4.13Å; V250-L252 PolarHBondContact O-N 3.21Å; V250-I255 HydrophobicContact CG1-CD1 3.66Å
251	D	90.1	Very high	91.7	Very high	69 Å²	69	82.5 Å²	82.5	37%	0.369	40%	0.396	S	S	.	.			trans	-71.8	95.4	168.3	-177.6	-0.4	0	0	0	111.2	E249 S253 K254	E249-D251 PolarHBondContact O-N 2.98Å; D251-S253 VanDerWaalsContact CG-OG 3.3Å; D251-S253 PolarHBondContact O-N 3.2Å; D251-S253 VanDerWaalsContact OD1-CB 3.28Å; D251-S253 WeakPolarHBondContact OD1-CB 3.36Å; D251-S253 PolarHBondContact OD1-N 3.05Å; D251-S253 PolarHBondContact OD1-OG 2.81Å; D251-S253 PolarHBondContact OD2-OG 2.76Å; D251-K254 HydrophobicContact CB-CD 4.47Å; D251-K254 PolarHBondContact O-N 3.47Å; D251-K254 IonicContact OD2-NZ 3.87Å; D251-K254 PolarHBondContact OD2-NZ 3.49Å
252	L	89.6	Confident	91.6	Very high	52 Å²	52	88.4 Å²	88.4	27%	0.272	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-61.3	-23.1	177.9	-67	176.6	0	0	0	113.5	F247 V250 K254 I255 W260 L263	F247-L252 HydrophobicContact CZ-CD2 4.2Å; V250-L252 HydrophobicContact CG1-CD2 4.13Å; V250-L252 PolarHBondContact O-N 3.21Å; L252-K254 PolarHBondContact O-N 3.17Å; L252-I255 HydrophobicContact CD2-CD1 4.5Å; L252-I255 PolarHBondContact O-N 3.07Å; L252-W260 PolarHBondContact O-NE1 3.42Å; L252-L263 HydrophobicContact CD2-CD2 4.38Å
253	S	88.8	Confident	91.6	Very high	95 Å²	95	84.3 Å²	84.3	66%	0.664	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-65.1	-26.4	-179.8	75.4	0	0	0	0	112.7	D251 I255	D251-S253 VanDerWaalsContact CG-OG 3.3Å; D251-S253 PolarHBondContact O-N 3.2Å; D251-S253 VanDerWaalsContact OD1-CB 3.28Å; D251-S253 WeakPolarHBondContact OD1-CB 3.36Å; D251-S253 PolarHBondContact OD1-N 3.05Å; D251-S253 PolarHBondContact OD1-OG 2.81Å; D251-S253 PolarHBondContact OD2-OG 2.76Å; S253-I255 VanDerWaalsContact C-N 3.28Å; S253-I255 PolarHBondContact O-N 2.59Å
254	K	91.5	Very high	91.6	Very high	166 Å²	166	86.4 Å²	86.4	72%	0.722	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-82.3	-0.9	176	-63.5	-177	174	93.5	0	113.6	D251 L252	D251-K254 HydrophobicContact CB-CD 4.47Å; D251-K254 PolarHBondContact O-N 3.47Å; D251-K254 IonicContact OD2-NZ 3.87Å; D251-K254 PolarHBondContact OD2-NZ 3.49Å; L252-K254 PolarHBondContact O-N 3.17Å
255	I	91.7	Very high	91.4	Very high	26 Å²	26	87.9 Å²	87.9	13%	0.133	42%	0.422	C	S	.	.	S	Bend	trans	-114.5	133.6	-172	-60.4	-174.8	0	0	0	109.7	P194 V250 L252 S253 E257 F259 W260 L263	P194-I255 HydrophobicContact CB-CD1 4.2Å; P194-I255 HydrophobicContact CB-CG1 4.42Å; P194-I255 HydrophobicContact CB-CG2 3.92Å; P194-I255 HydrophobicContact CG-CG2 4.03Å; V250-I255 HydrophobicContact CG1-CD1 3.66Å; L252-I255 HydrophobicContact CD2-CD1 4.5Å; L252-I255 PolarHBondContact O-N 3.07Å; S253-I255 VanDerWaalsContact C-N 3.28Å; S253-I255 PolarHBondContact O-N 2.59Å; I255-E257 PolarHBondContact O-N 3.47Å; I255-F259 HydrophobicContact CG2-CB 4.13Å; I255-F259 HydrophobicContact CG2-CD2 4.48Å; I255-W260 PolarHBondContact O-NE1 2.98Å; I255-L263 HydrophobicContact CD1-CD2 3.39Å; I255-L263 HydrophobicContact CG2-CD2 4.07Å
256	P	93.1	Very high	91.6	Very high	65 Å²	65	84.9 Å²	84.9	42%	0.422	40%	0.401	S	S	.	.			trans	-59.1	127.3	176.8	-25.7	34.5	0	0	0	112.5	R258 F259	P256-R258 HydrophobicContact CB-CG 4.19Å; P256-R258 PolarHBondContact O-N 3.1Å; P256-F259 HydrophobicContact CB-CD2 3.97Å; P256-F259 HydrophobicContact CB-CE2 4.21Å; P256-F259 HydrophobicContact CG-CD2 4.28Å; P256-F259 HydrophobicContact CG-CE2 4.29Å; P256-F259 PolarHBondContact O-N 3.34Å
257	E	92.5	Very high	91.7	Very high	145 Å²	145	83.6 Å²	83.6	68%	0.678	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-49.1	-36.9	-171.5	-174.5	-176.8	178.2	0	0	114.1	I255 F259 W260	I255-E257 PolarHBondContact O-N 3.47Å; E257-F259 PolarHBondContact O-N 3.01Å; E257-W260 HydrophobicContact CB-CD2 4.27Å; E257-W260 HydrophobicContact CB-CE3 4.49Å; E257-W260 HydrophobicContact CB-CZ2 4.42Å; E257-W260 HydrophobicContact CG-CD2 4.01Å; E257-W260 HydrophobicContact CG-CE3 3.81Å; E257-W260 HydrophobicContact CG-CH2 4.42Å; E257-W260 HydrophobicContact CG-CZ3 4.03Å; E257-W260 WeakPolarHBondContact O-CB 3.44Å; E257-W260 PolarHBondContact O-N 3.39Å
258	R	92.6	Very high	91.7	Very high	184 Å²	184	86.8 Å²	86.8	69%	0.694	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-49.2	-21.4	174.7	71.1	-176	-174.2	-139.7	3.4	114.7	P256	P256-R258 HydrophobicContact CB-CG 4.19Å; P256-R258 PolarHBondContact O-N 3.1Å
259	F	92.4	Very high	91.8	Very high	13 Å²	13	81.4 Å²	81.4	6%	0.057	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-97.3	-26	177.2	-60.7	-62.6	0	0	0	114.2	Y193 P194 W196 I255 P256 E257 R261 R262 L263	Y193-F259 HydrophobicContact CD1-CD1 4.3Å; Y193-F259 AromaticContact CD1-CE1 3.5Å; Y193-F259 HydrophobicContact CD1-CE1 3.5Å; Y193-F259 VanDerWaalsContact CD1-CE1 3.5Å; Y193-F259 AromaticContact CD1-CZ 3.94Å; Y193-F259 HydrophobicContact CD1-CZ 3.94Å; Y193-F259 AromaticContact CE1-CE1 3.73Å; Y193-F259 HydrophobicContact CE1-CE1 3.73Å; Y193-F259 HydrophobicContact CE1-CZ 4.35Å; Y193-F259 HydrophobicContact CG-CE1 4.49Å; P194-F259 HydrophobicContact CG-CB 4.04Å; P194-F259 HydrophobicContact CG-CD1 4.49Å; P194-F259 HydrophobicContact CG-CD2 3.94Å; P194-F259 HydrophobicContact CG-CE2 4.47Å; P194-F259 HydrophobicContact CG-CG 3.92Å; W196-F259 HydrophobicContact CZ3-CB 4.29Å; W196-F259 AromaticContact CZ3-CD1 3.97Å; W196-F259 HydrophobicContact CZ3-CD1 3.97Å; W196-F259 HydrophobicContact CZ3-CG 4.41Å; I255-F259 HydrophobicContact CG2-CB 4.13Å; I255-F259 HydrophobicContact CG2-CD2 4.48Å; P256-F259 HydrophobicContact CB-CD2 3.97Å; P256-F259 HydrophobicContact CB-CE2 4.21Å; P256-F259 HydrophobicContact CG-CD2 4.28Å; P256-F259 HydrophobicContact CG-CE2 4.29Å; P256-F259 PolarHBondContact O-N 3.34Å; E257-F259 PolarHBondContact O-N 3.01Å; F259-R261 PolarHBondContact O-N 2.69Å; F259-R262 PolarHBondContact O-N 2.83Å; F259-L263 WeakPolarHBondContact O-CB 3.18Å; F259-L263 PolarHBondContact O-N 2.88Å
260	W	93	Very high	92.2	Very high	96 Å²	96	74.5 Å²	74.5	36%	0.364	35%	0.347	S	S	.	.	H	α-helix	trans	-48	-57.3	-166.4	-70.5	-2	0	0	0	113.4	L252 I255 E257 R262 L263 Q264	L252-W260 PolarHBondContact O-NE1 3.42Å; I255-W260 PolarHBondContact O-NE1 2.98Å; E257-W260 HydrophobicContact CB-CD2 4.27Å; E257-W260 HydrophobicContact CB-CE3 4.49Å; E257-W260 HydrophobicContact CB-CZ2 4.42Å; E257-W260 HydrophobicContact CG-CD2 4.01Å; E257-W260 HydrophobicContact CG-CE3 3.81Å; E257-W260 HydrophobicContact CG-CH2 4.42Å; E257-W260 HydrophobicContact CG-CZ3 4.03Å; E257-W260 WeakPolarHBondContact O-CB 3.44Å; E257-W260 PolarHBondContact O-N 3.39Å; W260-R262 VanDerWaalsContact C-N 3.27Å; W260-R262 PolarHBondContact O-N 3.2Å; W260-L263 PolarHBondContact O-N 3.28Å; W260-Q264 WeakPolarHBondContact O-CB 3.45Å; W260-Q264 PolarHBondContact O-N 2.62Å
261	R	91.9	Very high	92.5	Very high	220 Å²	220	74.4 Å²	74.4	83%	0.83	34%	0.344	S	S	*	.	H	α-helix	trans	-60.4	-32.8	-178.8	-68.9	-177	64.1	-175	1.3	113.9	F259 A265	F259-R261 PolarHBondContact O-N 2.69Å; R261-A265 WeakPolarHBondContact O-CB 3.35Å
262	R	92.3	Very high	92.7	Very high	137 Å²	137	72.1 Å²	72.1	52%	0.517	33%	0.332	S	S	.	.	H	α-helix	trans	-79	-39.7	178.2	-73.7	176.6	59.7	-179.3	-2.8	111.1	W196 F259 W260 A265 A266	W196-R262 HydrophobicContact CH2-CB 3.59Å; W196-R262 HydrophobicContact CZ2-CB 3.89Å; F259-R262 PolarHBondContact O-N 2.83Å; W260-R262 VanDerWaalsContact C-N 3.27Å; W260-R262 PolarHBondContact O-N 3.2Å; R262-A265 PolarHBondContact O-N 2.9Å; R262-A266 WeakPolarHBondContact O-CB 3.43Å; R262-A266 PolarHBondContact O-N 3.02Å
263	L	93.8	Very high	92.8	Very high	0 Å²	0	69.7 Å²	69.7	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-70.8	-42.5	-178.5	-176.4	62.3	0	0	0	111.5	W187 P194 W196 P197 F247 L252 I255 F259 W260 A265 A266 G267	W187-L263 HydrophobicContact CZ3-CD1 4.28Å; P194-L263 HydrophobicContact CB-CD2 4.4Å; P194-L263 HydrophobicContact CG-CD2 4.26Å; W196-L263 HydrophobicContact CD2-CD1 4.13Å; W196-L263 HydrophobicContact CE3-CD1 3.99Å; W196-L263 HydrophobicContact CH2-CB 4.16Å; W196-L263 HydrophobicContact CZ3-CB 4.28Å; W196-L263 HydrophobicContact CZ3-CD1 4.22Å; P197-L263 HydrophobicContact CG-CD1 4.47Å; F247-L263 HydrophobicContact CE2-CD1 4.41Å; F247-L263 HydrophobicContact CE2-CG 3.93Å; F247-L263 WeakPolarHBondContact CE2-O 3.25Å; F247-L263 HydrophobicContact CZ-CG 4.06Å; L252-L263 HydrophobicContact CD2-CD2 4.38Å; I255-L263 HydrophobicContact CD1-CD2 3.39Å; I255-L263 HydrophobicContact CG2-CD2 4.07Å; F259-L263 WeakPolarHBondContact O-CB 3.18Å; F259-L263 PolarHBondContact O-N 2.88Å; W260-L263 PolarHBondContact O-N 3.28Å; L263-A265 VanDerWaalsContact C-N 3.33Å; L263-A265 PolarHBondContact O-N 2.93Å; L263-A266 PolarHBondContact O-N 2.82Å; L263-G267 PolarHBondContact O-N 3.26Å
264	Q	93.5	Very high	93	Very high	114 Å²	114	67.4 Å²	67.4	53%	0.533	30%	0.299	S	S	.	.	H	α-helix	trans	-61.3	-40.4	173.4	-171.8	-176.7	16.4	0	0	111.9	F247 W260 G267 Q268	F247-Q264 HydrophobicContact CE1-CB 4.15Å; F247-Q264 HydrophobicContact CE1-CG 4.14Å; F247-Q264 HydrophobicContact CZ-CB 4.32Å; W260-Q264 WeakPolarHBondContact O-CB 3.45Å; W260-Q264 PolarHBondContact O-N 2.62Å; Q264-G267 PolarHBondContact O-N 2.94Å; Q264-Q268 PolarHBondContact O-N 2.9Å
265	A	92	Very high	93.1	Very high	36 Å²	36	61.2 Å²	61.2	30%	0.298	27%	0.274	S	S	.	.	H	α-helix	trans	-66.6	-41.3	175.1	0	0	0	0	0	112.3	P228 R261 R262 L263 G267 E269	P228-A265 HydrophobicContact CG-CB 3.77Å; R261-A265 WeakPolarHBondContact O-CB 3.35Å; R262-A265 PolarHBondContact O-N 2.9Å; L263-A265 VanDerWaalsContact C-N 3.33Å; L263-A265 PolarHBondContact O-N 2.93Å; A265-G267 VanDerWaalsContact C-N 3.35Å; A265-E269 WeakPolarHBondContact O-CB 3.22Å; A265-E269 PolarHBondContact O-N 2.83Å; A265-E269 VanDerWaalsContact O-N 3.08Å
266	A	94.4	Very high	93	Very high	0 Å²	0	61 Å²	61	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-64.2	-38.3	172.8	0	0	0	0	0	112.3	W196 P197 L226 R262 L263 E269 A270	W196-A266 HydrophobicContact CZ2-CB 4.26Å; P197-A266 HydrophobicContact CB-CB 4.42Å; P197-A266 HydrophobicContact CG-CB 3.96Å; L226-A266 WeakPolarHBondContact O-CB 3.38Å; R262-A266 WeakPolarHBondContact O-CB 3.43Å; R262-A266 PolarHBondContact O-N 3.02Å; L263-A266 PolarHBondContact O-N 2.82Å; A266-E269 PolarHBondContact O-N 3.08Å; A266-A270 WeakPolarHBondContact O-CB 3.48Å; A266-A270 PolarHBondContact O-N 2.91Å
267	G	95	Very high	92.9	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-64.3	-44.9	176.5	0	0	0	0	0	112.7	L263 Q264 A265 E269 A270 E271	L263-G267 PolarHBondContact O-N 3.26Å; Q264-G267 PolarHBondContact O-N 2.94Å; A265-G267 VanDerWaalsContact C-N 3.35Å; G267-E269 VanDerWaalsContact C-N 3.28Å; G267-E269 PolarHBondContact O-N 3.32Å; G267-A270 PolarHBondContact O-N 3.13Å; G267-E271 PolarHBondContact O-N 3.46Å
268	Q	93.1	Very high	92.8	Very high	89 Å²	89	54.2 Å²	54.2	42%	0.416	24%	0.242	S	C	.	.	H	α-helix	trans	-65.5	-33.8	175	-172.4	61.2	93.4	0	0	112	Q264 E271 N272	Q264-Q268 PolarHBondContact O-N 2.9Å; Q268-E271 PolarHBondContact NE2-OE2 3.38Å; Q268-N272 PolarHBondContact NE2-OD1 2.7Å; Q268-N272 WeakPolarHBondContact O-CB 3.12Å; Q268-N272 PolarHBondContact O-N 3.35Å; Q268-N272 PolarHBondContact O-ND2 2.95Å; Q268-N272 PolarHBondContact O-OD1 2.73Å
269	E	92.5	Very high	92.6	Very high	24 Å²	24	49.1 Å²	49.1	11%	0.112	23%	0.225	C	C	.	.	H	α-helix	trans	-69.6	-37.5	175.3	-169.9	151.9	-115.5	0	0	112.4	L226 G227 A265 A266 G267 N272 A273 Y285 K323	L226-E269 HydrophobicContact CB-CG 4.41Å; G227-E269 VanDerWaalsContact C-OE2 3.29Å; G227-E269 VanDerWaalsContact CA-OE2 3.28Å; G227-E269 WeakPolarHBondContact CA-OE2 3.35Å; G227-E269 PolarHBondContact N-OE2 3.04Å; A265-E269 WeakPolarHBondContact O-CB 3.22Å; A265-E269 PolarHBondContact O-N 2.83Å; A265-E269 VanDerWaalsContact O-N 3.08Å; A266-E269 PolarHBondContact O-N 3.08Å; G267-E269 VanDerWaalsContact C-N 3.28Å; G267-E269 PolarHBondContact O-N 3.32Å; E269-N272 PolarHBondContact O-N 2.67Å; E269-A273 PolarHBondContact O-N 3.37Å; E269-Y285 HydrophobicContact CG-CD1 4.37Å; E269-Y285 HydrophobicContact CG-CE1 3.5Å; E269-Y285 VanDerWaalsContact CG-CE1 3.5Å; E269-K323 IonicContact OE1-NZ 2.84Å; E269-K323 PolarHBondContact OE1-NZ 3.39Å
270	A	94.9	Very high	92.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-67	-41.8	172.4	0	0	0	0	0	112.9	V185 P197 L226 F244 A266 G267 N272 A273 L274	V185-A270 HydrophobicContact CG1-CB 3.85Å; P197-A270 HydrophobicContact CB-CB 3.63Å; L226-A270 HydrophobicContact CD1-CB 3.68Å; F244-A270 HydrophobicContact CD1-CB 3.95Å; F244-A270 HydrophobicContact CD2-CB 4.13Å; F244-A270 HydrophobicContact CE1-CB 3.55Å; F244-A270 HydrophobicContact CE2-CB 3.73Å; F244-A270 HydrophobicContact CG-CB 4.25Å; F244-A270 HydrophobicContact CZ-CB 3.44Å; F244-A270 VanDerWaalsContact CZ-CB 3.44Å; A266-A270 WeakPolarHBondContact O-CB 3.48Å; A266-A270 PolarHBondContact O-N 2.91Å; G267-A270 PolarHBondContact O-N 3.13Å; A270-N272 VanDerWaalsContact C-N 3.29Å; A270-N272 PolarHBondContact O-N 2.69Å; A270-A273 WeakPolarHBondContact O-CB 3.29Å; A270-A273 PolarHBondContact O-N 3.42Å; A270-L274 PolarHBondContact O-N 2.83Å
271	E	94.8	Very high	92.3	Very high	32 Å²	32	47.1 Å²	47.1	15%	0.15	22%	0.222	C	C	.	.	H	α-helix	trans	-58.3	-42.5	168.7	-74.6	-162.5	161.4	0	0	111.8	F244 G267 Q268 A273 L274 L275 K312	F244-E271 HydrophobicContact CE1-CG 4.47Å; G267-E271 PolarHBondContact O-N 3.46Å; Q268-E271 PolarHBondContact NE2-OE2 3.38Å; E271-A273 VanDerWaalsContact C-N 3.31Å; E271-A273 PolarHBondContact O-N 2.9Å; E271-L274 PolarHBondContact O-N 3.03Å; E271-L275 WeakPolarHBondContact O-CG 3.26Å; E271-L275 PolarHBondContact O-N 2.91Å; E271-K312 IonicContact OE2-NZ 2.73Å; E271-K312 PolarHBondContact OE2-NZ 3.06Å
272	N	92.7	Very high	92.2	Very high	21 Å²	21	36.7 Å²	36.7	11%	0.112	18%	0.183	C	C	.	.	H	α-helix	trans	-66.7	-35.2	179.7	-71.8	-9.7	0	0	0	111.4	Q268 E269 A270 L275 K312 I316	Q268-N272 PolarHBondContact NE2-OD1 2.7Å; Q268-N272 WeakPolarHBondContact O-CB 3.12Å; Q268-N272 PolarHBondContact O-N 3.35Å; Q268-N272 PolarHBondContact O-ND2 2.95Å; Q268-N272 PolarHBondContact O-OD1 2.73Å; E269-N272 PolarHBondContact O-N 2.67Å; A270-N272 VanDerWaalsContact C-N 3.29Å; A270-N272 PolarHBondContact O-N 2.69Å; N272-L275 PolarHBondContact O-N 3.39Å; N272-K312 VanDerWaalsContact OD1-CE 3.24Å; N272-K312 WeakPolarHBondContact OD1-CE 3.5Å; N272-I316 HydrophobicContact CB-CD1 3.78Å; N272-I316 HydrophobicContact CB-CG1 4.01Å
273	A	93.3	Very high	91.8	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-63.1	-42.3	171.3	0	0	0	0	0	112.5	V185 E269 A270 E271 L275 L276 R281 Y285	V185-A273 HydrophobicContact CG2-CB 3.92Å; E269-A273 PolarHBondContact O-N 3.37Å; A270-A273 WeakPolarHBondContact O-CB 3.29Å; A270-A273 PolarHBondContact O-N 3.42Å; E271-A273 VanDerWaalsContact C-N 3.31Å; E271-A273 PolarHBondContact O-N 2.9Å; A273-L275 PolarHBondContact O-N 2.85Å; A273-L276 WeakPolarHBondContact O-CB 3.1Å; A273-L276 PolarHBondContact O-N 2.93Å; A273-R281 HydrophobicContact CB-CG 4.32Å; A273-R281 WeakPolarHBondContact O-CD 3.46Å; A273-R281 VanDerWaalsContact O-CG 3.24Å; A273-R281 WeakPolarHBondContact O-CG 3.47Å; A273-R281 PolarHBondContact O-NE 3.06Å; A273-Y285 HydrophobicContact CB-CD2 4.04Å; A273-Y285 HydrophobicContact CB-CE2 3.54Å
274	L	93	Very high	91.4	Very high	48 Å²	48	32.6 Å²	32.6	25%	0.251	18%	0.175	S	C	.	.	H	α-helix	trans	-60.4	-25.4	176.9	-74.9	-179.4	0	0	0	113.8	V185 F244 S245 A270 E271 L276	V185-L274 HydrophobicContact CB-CD2 3.95Å; V185-L274 HydrophobicContact CB-CG 4.37Å; V185-L274 HydrophobicContact CG2-CD2 3.89Å; V185-L274 HydrophobicContact CG2-CG 4.29Å; F244-L274 HydrophobicContact CD1-CD1 3.82Å; F244-L274 HydrophobicContact CD1-CG 4.42Å; F244-L274 HydrophobicContact CE1-CD1 4.11Å; S245-L274 WeakPolarHBondContact O-CD1 3.49Å; A270-L274 PolarHBondContact O-N 2.83Å; E271-L274 PolarHBondContact O-N 3.03Å; L274-L276 VanDerWaalsContact C-N 3.28Å
275	L	92.3	Very high	91	Very high	36 Å²	36	28 Å²	28	19%	0.188	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-4.7	177.9	-57.6	168.3	0	0	0	113.7	E271 N272 A273 Y309 K312 L313 I316	E271-L275 WeakPolarHBondContact O-CG 3.26Å; E271-L275 PolarHBondContact O-N 2.91Å; N272-L275 PolarHBondContact O-N 3.39Å; A273-L275 PolarHBondContact O-N 2.85Å; L275-Y309 WeakPolarHBondContact CA-OH 3.49Å; L275-Y309 HydrophobicContact CB-CE1 4.48Å; L275-Y309 HydrophobicContact CD2-CD2 4.18Å; L275-Y309 HydrophobicContact CD2-CE1 4.22Å; L275-Y309 HydrophobicContact CD2-CE2 3.39Å; L275-Y309 VanDerWaalsContact CD2-CZ 3.43Å; L275-Y309 WeakPolarHBondContact CD2-OH 3.44Å; L275-Y309 PolarHBondContact O-OH 2.75Å; L275-K312 HydrophobicContact CD1-CB 4.49Å; L275-K312 HydrophobicContact CD1-CD 3.54Å; L275-K312 HydrophobicContact CD1-CG 3.78Å; L275-L313 HydrophobicContact CB-CD2 4.29Å; L275-I316 HydrophobicContact CB-CD1 4.42Å; L275-I316 HydrophobicContact CD1-CD1 3.88Å
276	L	91.1	Very high	90.1	Very high	22 Å²	22	26.3 Å²	26.3	12%	0.115	14%	0.139	C	C	.	.	S	Bend	trans	-104.3	154.5	179.9	-66.4	169	0	0	0	110.8	A273 L274 D280 R281 I284 Y285	A273-L276 WeakPolarHBondContact O-CB 3.1Å; A273-L276 PolarHBondContact O-N 2.93Å; L274-L276 VanDerWaalsContact C-N 3.28Å; L276-D280 HydrophobicContact CB-CB 3.98Å; L276-D280 HydrophobicContact CD2-CB 4.24Å; L276-R281 HydrophobicContact CB-CG 3.93Å; L276-R281 PolarHBondContact O-NE 3.11Å; L276-R281 PolarHBondContact O-NH2 3.38Å; L276-I284 HydrophobicContact CD1-CD1 3.78Å; L276-Y285 HydrophobicContact CD1-CE2 3.98Å
277	S	90.5	Very high	88.7	Confident	51 Å²	51	30.3 Å²	30.3	36%	0.357	16%	0.155	S	C	.	.			trans	-67.7	158.8	170.6	81.7	0	0	0	0	110.5	K279 D280 R281	S277-K279 VanDerWaalsContact C-N 3.26Å; S277-K279 PolarHBondContact O-N 2.64Å; S277-D280 VanDerWaalsContact CB-OD2 3.28Å; S277-D280 WeakPolarHBondContact CB-OD2 3.21Å; S277-D280 PolarHBondContact N-OD2 3.42Å; S277-D280 PolarHBondContact O-N 3.49Å; S277-D280 VanDerWaalsContact OG-CG 3.22Å; S277-D280 PolarHBondContact OG-N 3.31Å; S277-D280 PolarHBondContact OG-OD2 3.36Å; S277-R281 WeakPolarHBondContact O-CG 3.47Å; S277-R281 PolarHBondContact O-N 2.68Å
278	V	89	Confident	86.8	Confident	15 Å²	15	36.9 Å²	36.9	9%	0.091	19%	0.19	C	C	.	.	H	α-helix	trans	-57.7	-39.9	-178.4	-169.2	0	0	0	0	111.5	L105 C125 D126 V182 R281 L282	L105-V278 HydrophobicContact CD1-CB 3.83Å; L105-V278 HydrophobicContact CD1-CG1 3.59Å; C125-V278 HydrophobicContact CB-CG2 4.34Å; D126-V278 HydrophobicContact CB-CG2 3.88Å; V182-V278 WeakPolarHBondContact O-CG1 3.31Å; V278-R281 PolarHBondContact O-N 2.81Å; V278-L282 HydrophobicContact CG1-CD1 4.39Å; V278-L282 VanDerWaalsContact O-CG 3.3Å; V278-L282 WeakPolarHBondContact O-CG 3.42Å; V278-L282 PolarHBondContact O-N 2.89Å; V278-L282 VanDerWaalsContact O-N 3.09Å
279	K	88.5	Confident	84.5	Confident	78 Å²	78	36.5 Å²	36.5	34%	0.339	19%	0.188	S	C	.	.	H	α-helix	trans	-64	-42.6	174.6	-175.7	155.2	172.5	153.8	0	112.4	I100 E101 S277 L282 A283	I100-K279 HydrophobicContact CG2-CG 4.2Å; I100-K279 WeakPolarHBondContact O-CE 3.32Å; I100-K279 PolarHBondContact O-NZ 3.21Å; E101-K279 PolarHBondContact O-NZ 3.32Å; S277-K279 VanDerWaalsContact C-N 3.26Å; S277-K279 PolarHBondContact O-N 2.64Å; K279-L282 PolarHBondContact O-N 3.32Å; K279-A283 PolarHBondContact O-N 3.08Å; K279-A283 VanDerWaalsContact O-N 3.12Å
280	D	89.6	Confident	82	Confident	64 Å²	64	42.4 Å²	42.4	34%	0.342	21%	0.214	S	C	.	.	H	α-helix	trans	-66.2	-39.5	175.3	-62.8	-56.2	0	0	0	112.4	L276 S277 L282 A283 I284	L276-D280 HydrophobicContact CB-CB 3.98Å; L276-D280 HydrophobicContact CD2-CB 4.24Å; S277-D280 VanDerWaalsContact CB-OD2 3.28Å; S277-D280 WeakPolarHBondContact CB-OD2 3.21Å; S277-D280 PolarHBondContact N-OD2 3.42Å; S277-D280 PolarHBondContact O-N 3.49Å; S277-D280 VanDerWaalsContact OG-CG 3.22Å; S277-D280 PolarHBondContact OG-N 3.31Å; S277-D280 PolarHBondContact OG-OD2 3.36Å; D280-L282 VanDerWaalsContact C-N 3.34Å; D280-L282 PolarHBondContact O-N 3.16Å; D280-A283 PolarHBondContact O-N 3Å; D280-I284 WeakPolarHBondContact O-CB 3.49Å; D280-I284 WeakPolarHBondContact O-CG1 3.33Å; D280-I284 PolarHBondContact O-N 2.93Å
281	R	91.2	Very high	79.5	Confident	3 Å²	3	45.4 Å²	45.4	1%	0.011	23%	0.225	C	C	.	.	H	α-helix	trans	-59.4	-45.9	175.4	-68.9	177.9	-159.9	161.3	7.7	111	D126 G183 M199 A273 L276 S277 V278 I284 Y285	D126-R281 IonicContact OD2-CZ 2.68Å; D126-R281 IonicContact OD2-NH1 3.82Å; D126-R281 PolarHBondContact OD2-NH1 3.16Å; G183-R281 VanDerWaalsContact O-CD 3.24Å; G183-R281 WeakPolarHBondContact O-CD 3.13Å; G183-R281 PolarHBondContact O-NH1 3.4Å; M199-R281 HydrophobicContact SD-CB 3.79Å; A273-R281 HydrophobicContact CB-CG 4.32Å; A273-R281 WeakPolarHBondContact O-CD 3.46Å; A273-R281 VanDerWaalsContact O-CG 3.24Å; A273-R281 WeakPolarHBondContact O-CG 3.47Å; A273-R281 PolarHBondContact O-NE 3.06Å; L276-R281 HydrophobicContact CB-CG 3.93Å; L276-R281 PolarHBondContact O-NE 3.11Å; L276-R281 PolarHBondContact O-NH2 3.38Å; S277-R281 WeakPolarHBondContact O-CG 3.47Å; S277-R281 PolarHBondContact O-N 2.68Å; V278-R281 PolarHBondContact O-N 2.81Å; R281-I284 PolarHBondContact O-N 2.62Å; R281-Y285 HydrophobicContact CB-CD2 4.44Å; R281-Y285 WeakPolarHBondContact O-CB 3.5Å; R281-Y285 WeakPolarHBondContact O-CD2 3.32Å; R281-Y285 PolarHBondContact O-N 3.18Å
282	L	88.3	Confident	76.9	Confident	1 Å²	1	50 Å²	50	1%	0.005	25%	0.247	C	C	.	.	I	π-helix	trans	-65.2	-42.1	-179.4	-67.5	169.9	0	0	0	111.8	I100 L105 V182 M199 V278 K279 D280 I284 G286	I100-L282 HydrophobicContact CD1-CB 4.04Å; I100-L282 HydrophobicContact CD1-CD1 4.1Å; L105-L282 HydrophobicContact CD1-CD1 4.15Å; L105-L282 HydrophobicContact CD2-CD1 4.4Å; V182-L282 HydrophobicContact CB-CD1 4.49Å; V182-L282 HydrophobicContact CB-CD2 4.48Å; V182-L282 HydrophobicContact CG1-CD1 4.01Å; V182-L282 HydrophobicContact CG1-CD2 3.43Å; V182-L282 VanDerWaalsContact CG1-CD2 3.43Å; V182-L282 HydrophobicContact CG1-CG 4.38Å; M199-L282 HydrophobicContact CE-CD2 3.9Å; V278-L282 HydrophobicContact CG1-CD1 4.39Å; V278-L282 VanDerWaalsContact O-CG 3.3Å; V278-L282 WeakPolarHBondContact O-CG 3.42Å; V278-L282 PolarHBondContact O-N 2.89Å; V278-L282 VanDerWaalsContact O-N 3.09Å; K279-L282 PolarHBondContact O-N 3.32Å; D280-L282 VanDerWaalsContact C-N 3.34Å; D280-L282 PolarHBondContact O-N 3.16Å; L282-I284 VanDerWaalsContact C-N 3.29Å; L282-I284 PolarHBondContact O-N 3.17Å; L282-G286 WeakPolarHBondContact O-CA 3.36Å; L282-G286 PolarHBondContact O-N 2.95Å
283	A	85.4	Confident	74.5	Confident	34 Å²	34	54.7 Å²	54.7	28%	0.281	27%	0.272	S	S	.	.	I	π-helix	trans	-65.4	-27.1	175	0	0	0	0	0	114	K279 D280 H289 I294	K279-A283 PolarHBondContact O-N 3.08Å; K279-A283 VanDerWaalsContact O-N 3.12Å; D280-A283 PolarHBondContact O-N 3Å; A283-H289 PolarHBondContact O-CD2 3.24Å; A283-H289 PolarHBondContact O-NE2 3.39Å; A283-I294 VanDerWaalsContact O-CD1 3.25Å; A283-I294 WeakPolarHBondContact O-CD1 3.37Å
284	I	84.9	Confident	72.4	Confident	16 Å²	16	56.4 Å²	56.4	8%	0.082	28%	0.281	C	S	.	.	I	π-helix	trans	-97.1	-29.5	-176.7	-67.9	169.6	0	0	0	113.1	L276 D280 R281 L282 I294 V296	L276-I284 HydrophobicContact CD1-CD1 3.78Å; D280-I284 WeakPolarHBondContact O-CB 3.49Å; D280-I284 WeakPolarHBondContact O-CG1 3.33Å; D280-I284 PolarHBondContact O-N 2.93Å; R281-I284 PolarHBondContact O-N 2.62Å; L282-I284 VanDerWaalsContact C-N 3.29Å; L282-I284 PolarHBondContact O-N 3.17Å; I284-I294 HydrophobicContact CG1-CG2 4.31Å; I284-V296 HydrophobicContact CD1-CG2 4.06Å; I284-V296 HydrophobicContact CG1-CG2 4.43Å
285	Y	84.8	Confident	70.1	Confident	18 Å²	18	63.3 Å²	63.3	7%	0.071	31%	0.309	C	S	.	.	I	π-helix	trans	-127.3	-17.3	-172	-54.8	-73	0	0	0	115.2	M199 L226 E269 A273 L276 R281	M199-Y285 HydrophobicContact SD-CD2 4.49Å; L226-Y285 HydrophobicContact CD2-CD1 3.75Å; L226-Y285 HydrophobicContact CD2-CE1 4.35Å; L226-Y285 HydrophobicContact CD2-CG 4.03Å; E269-Y285 HydrophobicContact CG-CD1 4.37Å; E269-Y285 HydrophobicContact CG-CE1 3.5Å; E269-Y285 VanDerWaalsContact CG-CE1 3.5Å; A273-Y285 HydrophobicContact CB-CD2 4.04Å; A273-Y285 HydrophobicContact CB-CE2 3.54Å; L276-Y285 HydrophobicContact CD1-CE2 3.98Å; R281-Y285 HydrophobicContact CB-CD2 4.44Å; R281-Y285 WeakPolarHBondContact O-CB 3.5Å; R281-Y285 WeakPolarHBondContact O-CD2 3.32Å; R281-Y285 PolarHBondContact O-N 3.18Å
286	G	72.2	Confident	67.9	Low	0 Å²	0	63.7 Å²	63.7	0%	0	31%	0.313	C	S	.	.	I	π-helix	trans	-78.2	-28.7	-166.5	0	0	0	0	0	115.8	Y201 L282	Y201-G286 VanDerWaalsContact CD2-O 3.28Å; Y201-G286 WeakPolarHBondContact CD2-O 3.45Å; L282-G286 WeakPolarHBondContact O-CA 3.36Å; L282-G286 PolarHBondContact O-N 2.95Å
287	Y	65.6	Low	65.8	Low	84 Å²	84	71 Å²	71	33%	0.329	34%	0.343	S	S	.	.	S	Bend	trans	-133.4	169.1	-168.8	-56.9	-85	0	0	0	113	I100 Y202 H289	I100-Y287 HydrophobicContact CD1-CE2 3.56Å; I100-Y287 VanDerWaalsContact CD1-OH 3.25Å; I100-Y287 WeakPolarHBondContact CD1-OH 3.46Å; Y202-Y287 WeakPolarHBondContact CD2-OH 3.32Å; Y287-H289 AromaticContact CD2-NE2 3.66Å; Y287-H289 PolarHBondContact O-N 3.37Å
288	D	56.2	Low	63.5	Low	139 Å²	139	71.6 Å²	71.6	74%	0.743	35%	0.351	S	S	*	.			trans	-77.4	48.2	175.4	-53.2	-52.2	0	0	0	111.4	K233 K290	K233-D288 IonicContact NZ-OD1 2.69Å; K233-D288 PolarHBondContact NZ-OD1 2.92Å; K233-D288 IonicContact NZ-OD2 3.65Å; K233-D288 PolarHBondContact NZ-OD2 2.75Å; D288-K290 PolarHBondContact O-N 3.46Å
289	H	43.4	Very low	61.2	Low	80 Å²	80	74.4 Å²	74.4	37%	0.37	37%	0.372	S	S	.	.			trans	-59.7	131	172.5	-64.1	-64.4	0	0	0	109.3	A283 Y287 Y291 I294	A283-H289 PolarHBondContact O-CD2 3.24Å; A283-H289 PolarHBondContact O-NE2 3.39Å; Y287-H289 AromaticContact CD2-NE2 3.66Å; Y287-H289 PolarHBondContact O-N 3.37Å; H289-Y291 PolarHBondContact O-N 3.1Å; H289-I294 HydrophobicContact CB-CD1 4.21Å; H289-I294 HydrophobicContact CB-CG1 4.46Å
290	K	39.8	Very low	59.1	Low	149 Å²	149	75.5 Å²	75.5	65%	0.648	39%	0.389	S	S	*	.			trans	-61.2	126.1	152.8	-70.5	180	-179.8	175.8	0	106	D288 E292 D293	D288-K290 PolarHBondContact O-N 3.46Å; K290-E292 PolarHBondContact O-N 2.81Å; K290-D293 PolarHBondContact O-N 2.97Å
291	Y	42.3	Very low	57	Low	62 Å²	62	79.2 Å²	79.2	24%	0.243	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-5.5	-172.1	-143.2	-96.6	0	0	0	113.7	H289 I294 V320 K323	H289-Y291 PolarHBondContact O-N 3.1Å; Y291-I294 HydrophobicContact CD2-CD1 4.45Å; Y291-V320 HydrophobicContact CE1-CB 4.27Å; Y291-V320 HydrophobicContact CE1-CG1 3.82Å; Y291-V320 VanDerWaalsContact CE1-O 3.31Å; Y291-V320 WeakPolarHBondContact CE1-O 3.43Å; Y291-K323 HydrophobicContact CD1-CB 3.84Å; Y291-K323 HydrophobicContact CE1-CB 3.52Å; Y291-K323 HydrophobicContact CE1-CD 4.07Å; Y291-K323 HydrophobicContact CE1-CG 4.45Å; Y291-K323 HydrophobicContact CE2-CD 4.35Å
292	E	41.9	Very low	55.1	Low	128 Å²	128	80.9 Å²	80.9	60%	0.598	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-22	-175.9	-61.4	171.4	124.6	0	0	112.5	K290	K290-E292 PolarHBondContact O-N 2.81Å
293	D	42.4	Very low	53.2	Low	121 Å²	121	89.4 Å²	89.4	65%	0.647	45%	0.452	S	S	*	.	S	Bend	trans	-89.2	-18.2	-174.6	-61.2	-50.7	0	0	0	114.3	K290 K295	K290-D293 PolarHBondContact O-N 2.97Å; D293-K295 PolarHBondContact O-N 3.45Å
294	I	47.6	Very low	51.7	Low	36 Å²	36	97.4 Å²	97.4	19%	0.185	48%	0.481	C	S	.	.			trans	-80.2	88.2	-168.7	-47.6	168	0	0	0	111.6	A283 I284 H289 Y291 V296	A283-I294 VanDerWaalsContact O-CD1 3.25Å; A283-I294 WeakPolarHBondContact O-CD1 3.37Å; I284-I294 HydrophobicContact CG1-CG2 4.31Å; H289-I294 HydrophobicContact CB-CD1 4.21Å; H289-I294 HydrophobicContact CB-CG1 4.46Å; Y291-I294 HydrophobicContact CD2-CD1 4.45Å; I294-V296 VanDerWaalsContact C-N 3.27Å; I294-V296 HydrophobicContact CG2-CG2 3.65Å; I294-V296 PolarHBondContact O-N 2.96Å
295	K	44.5	Very low	50.1	Low	192 Å²	192	99.1 Å²	99.1	84%	0.835	49%	0.489	S	S	*	.			trans	-71	75.6	169	-71.3	178.6	-179	169.4	0	111.6	D293 K297	D293-K295 PolarHBondContact O-N 3.45Å; K295-K297 PolarHBondContact O-N 2.83Å
296	V	46.7	Very low	48.9	Very low	45 Å²	45	101.8 Å²	101.8	27%	0.273	51%	0.511	S	S	.	.			trans	-59.4	96.5	176.7	-177.8	0	0	0	0	111	I284 I294 A298 V320	I284-V296 HydrophobicContact CD1-CG2 4.06Å; I284-V296 HydrophobicContact CG1-CG2 4.43Å; I294-V296 VanDerWaalsContact C-N 3.27Å; I294-V296 HydrophobicContact CG2-CG2 3.65Å; I294-V296 PolarHBondContact O-N 2.96Å; V296-A298 VanDerWaalsContact C-N 3.25Å; V296-A298 PolarHBondContact O-N 2.91Å; V296-V320 HydrophobicContact CG2-CG1 4.04Å
297	K	46.2	Very low	48.5	Very low	175 Å²	175	112 Å²	112	76%	0.761	55%	0.549	S	S	*	.			trans	-74.6	74.4	174.4	-72	-175.7	-179.5	172.6	0	110.4	K295 S299	K295-K297 PolarHBondContact O-N 2.83Å; K297-S299 PolarHBondContact O-N 3.32Å; K297-S299 PolarHBondContact O-OG 3.26Å; K297-S299 VanDerWaalsContact O-OG 3.1Å
298	A	42.4	Very low	48	Very low	63 Å²	63	112.6 Å²	112.6	52%	0.521	56%	0.564	S	S	.	*			trans	-66.7	62.1	174	0	0	0	0	0	112.5	V296	V296-A298 VanDerWaalsContact C-N 3.25Å; V296-A298 PolarHBondContact O-N 2.91Å
299	S	40.6	Very low	47.6	Very low	74 Å²	74	109.5 Å²	109.5	52%	0.517	54%	0.542	S	S	.	.			trans	-131.2	153.2	-162.3	64.5	0	0	0	0	111.8	K297 Q301	K297-S299 PolarHBondContact O-N 3.32Å; K297-S299 PolarHBondContact O-OG 3.26Å; K297-S299 VanDerWaalsContact O-OG 3.1Å; S299-Q301 PolarHBondContact O-N 3.02Å
300	S	44.4	Very low	48.3	Very low	102 Å²	102	110.4 Å²	110.4	71%	0.713	54%	0.542	S	S	*	.	S	Bend	trans	65.5	-65.4	-172.8	79	0	0	0	0	116.7	V302 K303	S300-V302 PolarHBondContact O-N 2.9Å; S300-K303 PolarHBondContact O-N 2.79Å
301	Q	47	Very low	49.6	Very low	142 Å²	142	109.9 Å²	109.9	66%	0.664	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-67.7	-31.8	-166.6	-61.8	-156.4	28.4	0	0	114.4	S299 K303 K304	S299-Q301 PolarHBondContact O-N 3.02Å; Q301-K303 PolarHBondContact O-N 3.36Å; Q301-K304 PolarHBondContact O-N 2.79Å
302	V	50	Low	50.7	Low	38 Å²	38	110.2 Å²	110.2	23%	0.23	54%	0.543	C	S	.	.	G	3₁₀ helix	trans	-53.8	-29.6	-178.1	-171.7	0	0	0	0	112.9	S300 K304 L305 R310 L313	S300-V302 PolarHBondContact O-N 2.9Å; V302-K304 VanDerWaalsContact C-N 3.27Å; V302-K304 PolarHBondContact O-N 2.89Å; V302-L305 PolarHBondContact O-N 3.47Å; V302-R310 HydrophobicContact CG1-CB 4.32Å; V302-R310 HydrophobicContact CG1-CG 3.92Å; V302-R310 WeakPolarHBondContact O-CD 3.43Å; V302-R310 PolarHBondContact O-NE 3.43Å; V302-L313 HydrophobicContact CG2-CD1 4.22Å
303	K	50	Low	51.4	Low	180 Å²	180	105.5 Å²	105.5	78%	0.783	52%	0.522	S	S	*	.	G	3₁₀ helix	trans	-68.1	-18.5	-179.7	-71.7	-171.7	176.5	-176.8	0	114.3	S300 Q301 R310	S300-K303 PolarHBondContact O-N 2.79Å; Q301-K303 PolarHBondContact O-N 3.36Å; K303-R310 PolarHBondContact O-NH2 3.05Å
304	K	52.7	Low	52.5	Low	202 Å²	202	105.4 Å²	105.4	88%	0.878	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-100.5	-12	-180	-69.1	-173.4	176.1	-178.1	0	114.7	Q301 V302	Q301-K304 PolarHBondContact O-N 2.79Å; V302-K304 VanDerWaalsContact C-N 3.27Å; V302-K304 PolarHBondContact O-N 2.89Å
305	L	51.6	Low	53.5	Low	51 Å²	51	107.1 Å²	107.1	27%	0.267	53%	0.53	S	S	.	.	S	Bend	trans	-83.6	160.9	-177	-72.4	157.3	0	0	0	112.4	V302 Y309 R310 L313	V302-L305 PolarHBondContact O-N 3.47Å; L305-Y309 HydrophobicContact CB-CD1 4.09Å; L305-Y309 HydrophobicContact CB-CG 4.39Å; L305-Y309 HydrophobicContact CD1-CD1 3.74Å; L305-Y309 HydrophobicContact CD1-CE1 3.71Å; L305-Y309 HydrophobicContact CD2-CD1 3.87Å; L305-Y309 HydrophobicContact CD2-CD2 4.41Å; L305-Y309 HydrophobicContact CD2-CE1 3.9Å; L305-Y309 HydrophobicContact CD2-CE2 4.42Å; L305-Y309 HydrophobicContact CD2-CG 4.12Å; L305-Y309 HydrophobicContact CG-CD1 4.11Å; L305-Y309 HydrophobicContact CG-CE1 4.33Å; L305-R310 HydrophobicContact CB-CG 4.46Å; L305-R310 VanDerWaalsContact O-CZ 3.28Å; L305-R310 PolarHBondContact O-NE 2.87Å; L305-R310 PolarHBondContact O-NH2 3.2Å; L305-L313 HydrophobicContact CD1-CD1 3.79Å
306	S	59.6	Low	54.4	Low	75 Å²	75	98.5 Å²	98.5	52%	0.524	49%	0.492	S	S	.	.			trans	-71.4	157.5	-177.9	67.4	0	0	0	0	112.8	Y309 R310	S306-Y309 PolarHBondContact O-N 3.18Å; S306-R310 WeakPolarHBondContact O-CG 3.45Å; S306-R310 PolarHBondContact O-N 3.07Å
307	R	62.9	Low	55.2	Low	213 Å²	213	97.2 Å²	97.2	80%	0.804	49%	0.486	S	S	*	.	H	α-helix	trans	-55.6	-39	-175.3	-162.5	178	-173.5	-174.7	2.7	114.2	K311	R307-K311 PolarHBondContact O-N 3.4Å
308	P	56.7	Low	56	Low	97 Å²	97	92.8 Å²	92.8	63%	0.63	47%	0.47	S	S	*	.	H	α-helix	trans	-66.6	-42	173.3	-20.9	34	0	0	0	112.9	R310 K311 K312	P308-R310 PolarHBondContact O-N 3.09Å; P308-K311 WeakPolarHBondContact O-CB 3.35Å; P308-K311 PolarHBondContact O-N 3.41Å; P308-K311 VanDerWaalsContact O-N 3.14Å; P308-K312 PolarHBondContact O-N 2.68Å
309	Y	46	Very low	57	Low	75 Å²	75	92.7 Å²	92.7	29%	0.294	46%	0.461	S	S	.	.	H	α-helix	trans	-65.6	-40.1	-178.5	-158.2	-70.3	0	0	0	111.5	L275 L305 S306 K311 K312 L313	L275-Y309 WeakPolarHBondContact CA-OH 3.49Å; L275-Y309 HydrophobicContact CB-CE1 4.48Å; L275-Y309 HydrophobicContact CD2-CD2 4.18Å; L275-Y309 HydrophobicContact CD2-CE1 4.22Å; L275-Y309 HydrophobicContact CD2-CE2 3.39Å; L275-Y309 VanDerWaalsContact CD2-CZ 3.43Å; L275-Y309 WeakPolarHBondContact CD2-OH 3.44Å; L275-Y309 PolarHBondContact O-OH 2.75Å; L305-Y309 HydrophobicContact CB-CD1 4.09Å; L305-Y309 HydrophobicContact CB-CG 4.39Å; L305-Y309 HydrophobicContact CD1-CD1 3.74Å; L305-Y309 HydrophobicContact CD1-CE1 3.71Å; L305-Y309 HydrophobicContact CD2-CD1 3.87Å; L305-Y309 HydrophobicContact CD2-CD2 4.41Å; L305-Y309 HydrophobicContact CD2-CE1 3.9Å; L305-Y309 HydrophobicContact CD2-CE2 4.42Å; L305-Y309 HydrophobicContact CD2-CG 4.12Å; L305-Y309 HydrophobicContact CG-CD1 4.11Å; L305-Y309 HydrophobicContact CG-CE1 4.33Å; S306-Y309 PolarHBondContact O-N 3.18Å; Y309-K311 VanDerWaalsContact C-N 3.29Å; Y309-K311 PolarHBondContact O-N 2.83Å; Y309-K312 PolarHBondContact O-N 3.21Å; Y309-L313 HydrophobicContact CD1-CD1 3.83Å; Y309-L313 HydrophobicContact CD1-CG 3.85Å; Y309-L313 HydrophobicContact CE1-CD1 3.79Å; Y309-L313 HydrophobicContact CE1-CD2 4.14Å; Y309-L313 HydrophobicContact CE1-CG 3.84Å; Y309-L313 PolarHBondContact O-N 2.97Å
310	R	59	Low	57.8	Low	98 Å²	98	90 Å²	90	37%	0.37	44%	0.441	S	S	.	.	H	α-helix	trans	-57.7	-40.9	172.2	-65.1	-175.9	-156.5	-165.3	-1.3	112	V302 K303 L305 S306 P308 Q314	V302-R310 HydrophobicContact CG1-CB 4.32Å; V302-R310 HydrophobicContact CG1-CG 3.92Å; V302-R310 WeakPolarHBondContact O-CD 3.43Å; V302-R310 PolarHBondContact O-NE 3.43Å; K303-R310 PolarHBondContact O-NH2 3.05Å; L305-R310 HydrophobicContact CB-CG 4.46Å; L305-R310 VanDerWaalsContact O-CZ 3.28Å; L305-R310 PolarHBondContact O-NE 2.87Å; L305-R310 PolarHBondContact O-NH2 3.2Å; S306-R310 WeakPolarHBondContact O-CG 3.45Å; S306-R310 PolarHBondContact O-N 3.07Å; P308-R310 PolarHBondContact O-N 3.09Å; R310-Q314 WeakPolarHBondContact O-CB 3.11Å; R310-Q314 VanDerWaalsContact O-CG 3.28Å; R310-Q314 WeakPolarHBondContact O-CG 3.43Å; R310-Q314 PolarHBondContact O-N 3.12Å
311	K	67.3	Low	58.4	Low	139 Å²	139	91.1 Å²	91.1	60%	0.604	43%	0.433	S	S	*	.	H	α-helix	trans	-63.3	-49.2	175	-73.1	-171.5	173.6	-169.3	0	111.4	R307 P308 Y309 L313 Q314 T315	R307-K311 PolarHBondContact O-N 3.4Å; P308-K311 WeakPolarHBondContact O-CB 3.35Å; P308-K311 PolarHBondContact O-N 3.41Å; P308-K311 VanDerWaalsContact O-N 3.14Å; Y309-K311 VanDerWaalsContact C-N 3.29Å; Y309-K311 PolarHBondContact O-N 2.83Å; K311-L313 VanDerWaalsContact C-N 3.34Å; K311-L313 PolarHBondContact O-N 2.63Å; K311-Q314 WeakPolarHBondContact O-CB 3.49Å; K311-Q314 PolarHBondContact O-N 2.95Å; K311-Q314 VanDerWaalsContact O-N 3.08Å; K311-T315 PolarHBondContact O-N 3Å; K311-T315 PolarHBondContact O-OG1 2.98Å
312	K	64.5	Low	58.6	Low	68 Å²	68	90 Å²	90	30%	0.296	43%	0.428	S	S	.	.	H	α-helix	trans	-62.3	-38.3	179.9	-164.8	165.2	177	-179.6	0	112.1	E271 N272 L275 P308 Y309 T315 I316	E271-K312 IonicContact OE2-NZ 2.73Å; E271-K312 PolarHBondContact OE2-NZ 3.06Å; N272-K312 VanDerWaalsContact OD1-CE 3.24Å; N272-K312 WeakPolarHBondContact OD1-CE 3.5Å; L275-K312 HydrophobicContact CD1-CB 4.49Å; L275-K312 HydrophobicContact CD1-CD 3.54Å; L275-K312 HydrophobicContact CD1-CG 3.78Å; P308-K312 PolarHBondContact O-N 2.68Å; Y309-K312 PolarHBondContact O-N 3.21Å; K312-T315 PolarHBondContact O-N 3.22Å; K312-I316 HydrophobicContact CG-CD1 4.34Å; K312-I316 VanDerWaalsContact O-CG1 3.29Å; K312-I316 WeakPolarHBondContact O-CG1 3.44Å; K312-I316 PolarHBondContact O-N 3.31Å
313	L	57.7	Low	58.6	Low	30 Å²	30	92.8 Å²	92.8	16%	0.157	44%	0.437	C	S	.	.	H	α-helix	trans	-64.9	-37.7	171.2	-72.4	-176.6	0	0	0	113.7	L275 V302 L305 Y309 K311 I316 S317	L275-L313 HydrophobicContact CB-CD2 4.29Å; V302-L313 HydrophobicContact CG2-CD1 4.22Å; L305-L313 HydrophobicContact CD1-CD1 3.79Å; Y309-L313 HydrophobicContact CD1-CD1 3.83Å; Y309-L313 HydrophobicContact CD1-CG 3.85Å; Y309-L313 HydrophobicContact CE1-CD1 3.79Å; Y309-L313 HydrophobicContact CE1-CD2 4.14Å; Y309-L313 HydrophobicContact CE1-CG 3.84Å; Y309-L313 PolarHBondContact O-N 2.97Å; K311-L313 VanDerWaalsContact C-N 3.34Å; K311-L313 PolarHBondContact O-N 2.63Å; L313-I316 HydrophobicContact CD2-CD1 4.48Å; L313-I316 PolarHBondContact O-N 3.1Å; L313-S317 PolarHBondContact O-N 2.76Å
314	Q	66.1	Low	58.1	Low	118 Å²	118	85.5 Å²	85.5	55%	0.551	41%	0.413	S	S	*	.	H	α-helix	trans	-66.5	-40.7	174.3	-76.6	171.9	-25.3	0	0	111.4	R310 K311 S317 N318	R310-Q314 WeakPolarHBondContact O-CB 3.11Å; R310-Q314 VanDerWaalsContact O-CG 3.28Å; R310-Q314 WeakPolarHBondContact O-CG 3.43Å; R310-Q314 PolarHBondContact O-N 3.12Å; K311-Q314 WeakPolarHBondContact O-CB 3.49Å; K311-Q314 PolarHBondContact O-N 2.95Å; K311-Q314 VanDerWaalsContact O-N 3.08Å; Q314-S317 PolarHBondContact O-N 3.17Å; Q314-N318 WeakPolarHBondContact O-CB 3.47Å; Q314-N318 VanDerWaalsContact O-CG 3.23Å; Q314-N318 PolarHBondContact O-N 3.27Å; Q314-N318 PolarHBondContact O-ND2 3.17Å
315	T	68	Low	57.3	Low	73 Å²	73	81.4 Å²	81.4	45%	0.448	41%	0.405	S	S	.	.	H	α-helix	trans	-58.6	-50.9	170.9	-54.4	0	0	0	0	110.6	K311 K312 S317 N318 D319	K311-T315 PolarHBondContact O-N 3Å; K311-T315 PolarHBondContact O-OG1 2.98Å; K312-T315 PolarHBondContact O-N 3.22Å; T315-S317 VanDerWaalsContact C-N 3.34Å; T315-S317 PolarHBondContact O-N 2.99Å; T315-N318 CarbonylContact O-C 3.51Å; T315-N318 WeakPolarHBondContact O-CA 3.33Å; T315-N318 WeakPolarHBondContact O-CB 3.42Å; T315-N318 PolarHBondContact O-N 3Å; T315-D319 VanDerWaalsContact O-CG 3.25Å; T315-D319 PolarHBondContact O-N 3.3Å
316	I	62.6	Low	56.3	Low	10 Å²	10	87.2 Å²	87.2	5%	0.051	43%	0.425	C	S	.	.	H	α-helix	trans	-57.1	-44.4	177.2	-68.6	162.1	0	0	0	111.7	N272 L275 K312 L313 N318 D319 V320	N272-I316 HydrophobicContact CB-CD1 3.78Å; N272-I316 HydrophobicContact CB-CG1 4.01Å; L275-I316 HydrophobicContact CB-CD1 4.42Å; L275-I316 HydrophobicContact CD1-CD1 3.88Å; K312-I316 HydrophobicContact CG-CD1 4.34Å; K312-I316 VanDerWaalsContact O-CG1 3.29Å; K312-I316 WeakPolarHBondContact O-CG1 3.44Å; K312-I316 PolarHBondContact O-N 3.31Å; L313-I316 HydrophobicContact CD2-CD1 4.48Å; L313-I316 PolarHBondContact O-N 3.1Å; I316-N318 PolarHBondContact O-N 3.35Å; I316-D319 PolarHBondContact O-N 2.83Å; I316-V320 HydrophobicContact CG2-CG2 4.41Å; I316-V320 WeakPolarHBondContact O-CB 3.45Å; I316-V320 WeakPolarHBondContact O-CG2 3.19Å; I316-V320 PolarHBondContact O-N 3.48Å
317	S	63.9	Low	54.9	Low	19 Å²	19	91.3 Å²	91.3	13%	0.133	43%	0.433	C	S	.	.	H	α-helix	trans	-61.8	-32.9	175.8	-173.6	0	0	0	0	112.7	L313 Q314 T315 K321	L313-S317 PolarHBondContact O-N 2.76Å; Q314-S317 PolarHBondContact O-N 3.17Å; T315-S317 VanDerWaalsContact C-N 3.34Å; T315-S317 PolarHBondContact O-N 2.99Å; S317-K321 VanDerWaalsContact O-CD 3.28Å; S317-K321 WeakPolarHBondContact O-CD 3.47Å; S317-K321 VanDerWaalsContact O-CG 3.23Å; S317-K321 WeakPolarHBondContact O-CG 3.31Å; S317-K321 PolarHBondContact O-N 2.9Å; S317-K321 PolarHBondContact OG-NZ 3.48Å
318	N	63.6	Low	53.5	Low	82 Å²	82	91.3 Å²	91.3	44%	0.439	43%	0.433	S	S	.	.	H	α-helix	trans	-79.4	-37.3	176.5	-68.5	-15.6	0	0	0	112.3	Q314 T315 I316 V320 K321 Q322	Q314-N318 WeakPolarHBondContact O-CB 3.47Å; Q314-N318 VanDerWaalsContact O-CG 3.23Å; Q314-N318 PolarHBondContact O-N 3.27Å; Q314-N318 PolarHBondContact O-ND2 3.17Å; T315-N318 CarbonylContact O-C 3.51Å; T315-N318 WeakPolarHBondContact O-CA 3.33Å; T315-N318 WeakPolarHBondContact O-CB 3.42Å; T315-N318 PolarHBondContact O-N 3Å; I316-N318 PolarHBondContact O-N 3.35Å; N318-V320 VanDerWaalsContact C-N 3.35Å; N318-K321 CarbonylContact O-C 3.6Å; N318-K321 PolarHBondContact O-N 3.41Å; N318-Q322 WeakPolarHBondContact O-CB 3.2Å; N318-Q322 WeakPolarHBondContact O-CG 3.41Å; N318-Q322 PolarHBondContact O-N 3.43Å
319	D	62.5	Low	52.2	Low	61 Å²	61	96.1 Å²	96.1	33%	0.326	44%	0.444	S	S	.	.	H	α-helix	trans	-65.3	-39.9	175.5	-65.1	-17.3	0	0	0	110.8	T315 I316 Q322 K323	T315-D319 VanDerWaalsContact O-CG 3.25Å; T315-D319 PolarHBondContact O-N 3.3Å; I316-D319 PolarHBondContact O-N 2.83Å; D319-Q322 PolarHBondContact O-N 3.2Å; D319-K323 WeakPolarHBondContact O-CB 3.43Å; D319-K323 WeakPolarHBondContact O-CG 3.41Å; D319-K323 PolarHBondContact O-N 3.31Å
320	V	57.8	Low	51.5	Low	18 Å²	18	100.2 Å²	100.2	11%	0.109	47%	0.469	C	S	.	.	H	α-helix	trans	-57.8	-51.6	169.8	168.6	0	0	0	0	109.8	Y291 V296 I316 N318 Q322 K323 G324	Y291-V320 HydrophobicContact CE1-CB 4.27Å; Y291-V320 HydrophobicContact CE1-CG1 3.82Å; Y291-V320 VanDerWaalsContact CE1-O 3.31Å; Y291-V320 WeakPolarHBondContact CE1-O 3.43Å; V296-V320 HydrophobicContact CG2-CG1 4.04Å; I316-V320 HydrophobicContact CG2-CG2 4.41Å; I316-V320 WeakPolarHBondContact O-CB 3.45Å; I316-V320 WeakPolarHBondContact O-CG2 3.19Å; I316-V320 PolarHBondContact O-N 3.48Å; N318-V320 VanDerWaalsContact C-N 3.35Å; V320-Q322 VanDerWaalsContact C-N 3.34Å; V320-Q322 PolarHBondContact O-N 3.15Å; V320-K323 PolarHBondContact O-N 3.29Å; V320-G324 PolarHBondContact O-N 3.38Å; V320-G324 VanDerWaalsContact O-N 3.1Å
321	K	56.7	Low	50.3	Low	124 Å²	124	100.1 Å²	100.1	54%	0.539	48%	0.481	S	S	.	.	H	α-helix	trans	-60.7	-40.2	177	-70.8	161.9	-171.9	157.6	0	112.3	S317 N318 G324 V325	S317-K321 VanDerWaalsContact O-CD 3.28Å; S317-K321 WeakPolarHBondContact O-CD 3.47Å; S317-K321 VanDerWaalsContact O-CG 3.23Å; S317-K321 WeakPolarHBondContact O-CG 3.31Å; S317-K321 PolarHBondContact O-N 2.9Å; S317-K321 PolarHBondContact OG-NZ 3.48Å; N318-K321 CarbonylContact O-C 3.6Å; N318-K321 PolarHBondContact O-N 3.41Å; K321-G324 CarbonylContact O-C 3.56Å; K321-G324 WeakPolarHBondContact O-CA 3.4Å; K321-G324 PolarHBondContact O-N 3.08Å; K321-V325 WeakPolarHBondContact O-CG2 3.32Å; K321-V325 PolarHBondContact O-N 2.91Å
322	Q	51.7	Low	48.6	Very low	120 Å²	120	99.1 Å²	99.1	56%	0.561	49%	0.489	S	S	*	.	H	α-helix	trans	-68.4	-37.5	178	-75.3	-171.6	18.1	0	0	112.6	N318 D319 V320 G324 V325 Y326	N318-Q322 WeakPolarHBondContact O-CB 3.2Å; N318-Q322 WeakPolarHBondContact O-CG 3.41Å; N318-Q322 PolarHBondContact O-N 3.43Å; D319-Q322 PolarHBondContact O-N 3.2Å; V320-Q322 VanDerWaalsContact C-N 3.34Å; V320-Q322 PolarHBondContact O-N 3.15Å; Q322-G324 VanDerWaalsContact C-N 3.26Å; Q322-G324 PolarHBondContact O-N 2.99Å; Q322-V325 PolarHBondContact O-N 3.32Å; Q322-V325 VanDerWaalsContact O-N 3.12Å; Q322-Y326 PolarHBondContact O-N 3.33Å
323	K	49.3	Very low	47.1	Very low	95 Å²	95	103.7 Å²	103.7	41%	0.413	52%	0.515	S	S	.	.	H	α-helix	trans	-58.8	-38.3	169.8	-78.4	177.6	175.3	-175.2	0	111.4	E269 Y291 D319 V320	E269-K323 IonicContact OE1-NZ 2.84Å; E269-K323 PolarHBondContact OE1-NZ 3.39Å; Y291-K323 HydrophobicContact CD1-CB 3.84Å; Y291-K323 HydrophobicContact CE1-CB 3.52Å; Y291-K323 HydrophobicContact CE1-CD 4.07Å; Y291-K323 HydrophobicContact CE1-CG 4.45Å; Y291-K323 HydrophobicContact CE2-CD 4.35Å; D319-K323 WeakPolarHBondContact O-CB 3.43Å; D319-K323 WeakPolarHBondContact O-CG 3.41Å; D319-K323 PolarHBondContact O-N 3.31Å; V320-K323 PolarHBondContact O-N 3.29Å
324	G	40.1	Very low	45.9	Very low	27 Å²	27	110.4 Å²	110.4	28%	0.278	55%	0.545	S	S	.	.	H	α-helix	trans	-70.2	-31.6	171.6	0	0	0	0	0	114.8	V320 K321 Q322 Y326	V320-G324 PolarHBondContact O-N 3.38Å; V320-G324 VanDerWaalsContact O-N 3.1Å; K321-G324 CarbonylContact O-C 3.56Å; K321-G324 WeakPolarHBondContact O-CA 3.4Å; K321-G324 PolarHBondContact O-N 3.08Å; Q322-G324 VanDerWaalsContact C-N 3.26Å; Q322-G324 PolarHBondContact O-N 2.99Å; G324-Y326 VanDerWaalsContact C-N 3.32Å
325	V	36.5	Very low	44.1	Very low	117 Å²	117	110.4 Å²	110.4	71%	0.709	56%	0.558	S	S	*	*	H	α-helix	trans	-78.6	-14.1	177.4	170.7	0	0	0	0	112.7	K321 Q322 K327	K321-V325 WeakPolarHBondContact O-CG2 3.32Å; K321-V325 PolarHBondContact O-N 2.91Å; Q322-V325 PolarHBondContact O-N 3.32Å; Q322-V325 VanDerWaalsContact O-N 3.12Å; V325-K327 PolarHBondContact O-N 2.94Å
326	Y	29.7	Very low	42.3	Very low	173 Å²	173	113.2 Å²	113.2	68%	0.678	58%	0.579	S	S	*	*			trans	-73.3	46	176.6	-105.9	-71.6	0	0	0	114.5	Q322 G324 R328	Q322-Y326 PolarHBondContact O-N 3.33Å; G324-Y326 VanDerWaalsContact C-N 3.32Å; Y326-R328 VanDerWaalsContact C-N 3.28Å; Y326-R328 HydrophobicContact CD1-CG 4.4Å; Y326-R328 PolarHBondContact O-N 3.27Å
327	K	31.4	Very low	40.8	Very low	161 Å²	161	118 Å²	118	70%	0.7	61%	0.613	S	S	*	*			trans	-59.8	90.6	158.9	-72.3	-169.5	176	-174.5	0	109	V325 K329	V325-K327 PolarHBondContact O-N 2.94Å; K327-K329 PolarHBondContact O-N 2.89Å
328	R	31.7	Very low	39.4	Very low	213 Å²	213	124.1 Å²	124.1	80%	0.804	64%	0.643	S	S	*	*			trans	-65.7	108	175.7	-68.6	-173.4	-174.8	166.3	5	108.8	Y326 I330	Y326-R328 VanDerWaalsContact C-N 3.28Å; Y326-R328 HydrophobicContact CD1-CG 4.4Å; Y326-R328 PolarHBondContact O-N 3.27Å; R328-I330 PolarHBondContact O-N 3.02Å
329	K	30.1	Very low	38	Very low	198 Å²	198	126.9 Å²	126.9	86%	0.861	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-50.4	122.4	166.4	-62.4	-179.6	178.9	-177.1	0	108.2	K327 P331	K327-K329 PolarHBondContact O-N 2.89Å; K329-P331 WeakPolarHBondContact O-CD 3.49Å
330	I	31.7	Very low	36.6	Very low	161 Å²	161	132.1 Å²	132.1	83%	0.826	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-71.6	120.7	168.6	-59.4	174	0	0	0	106.2	R328	R328-I330 PolarHBondContact O-N 3.02Å
331	P	34.3	Very low	35.5	Very low	96 Å²	96	139 Å²	139	62%	0.623	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-69.9	138.2	174.1	-14.8	30.5	0	0	0	109.7	K329 I333	K329-P331 WeakPolarHBondContact O-CD 3.49Å; P331-I333 PolarHBondContact O-N 3.44Å
332	P	30.9	Very low	34.4	Very low	118 Å²	118	137.4 Å²	137.4	77%	0.766	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-67.8	132	168.2	29.7	-32.8	0	0	0	109
333	I	33.2	Very low	33.7	Very low	163 Å²	163	136.7 Å²	136.7	84%	0.836	72%	0.719	S	S	*	*			trans	-109.2	129.2	173.1	-63.8	176.6	0	0	0	107.5	P331	P331-I333 PolarHBondContact O-N 3.44Å
334	H	32.3	Very low	33.1	Very low	172 Å²	172	142.2 Å²	142.2	80%	0.796	74%	0.737	S	S	*	*			trans	-72.9	140.6	-174.7	-75	-114.9	0	0	0	111.8
335	S	28.3	Very low	32.8	Very low	117 Å²	117	147.4 Å²	147.4	82%	0.818	76%	0.758	S	S	*	*			trans	-82.5	125.4	169.9	54.1	0	0	0	0	111.3
336	C	30.9	Very low	32.8	Very low	132 Å²	132	148.8 Å²	148.8	89%	0.892	76%	0.76	S	S	*	*			trans	-118	132.2	158.5	-72.5	0	0	0	0	108.3
337	S	30.2	Very low	32.8	Very low	110 Å²	110	147.4 Å²	147.4	77%	0.769	77%	0.765	S	S	*	*			trans	-96.5	163.2	-175.7	46.9	0	0	0	0	112.4
338	I	34.4	Very low	32.8	Very low	149 Å²	149	146 Å²	146	76%	0.764	77%	0.773	S	S	*	*				177.1	123.6	127.6	-90.1	154.3	0	0	0	109.1
339	N	34	Very low	32.8	Very low	140 Å²	140	143.8 Å²	143.8	75%	0.749	77%	0.772	S	S	*	*			trans	29.1	154.8	145.4	-49.5	16	0	0	0	121.6
340	E	33	Very low	32.8	Very low	170 Å²	170	141.2 Å²	141.2	79%	0.794	77%	0.767	S	S	*	*			cis	179.8	-178.1	-27.1	-154.4	168.9	-152.4	0	0	106
341	I	34.7	Very low	32.9	Very low	164 Å²	164	140.6 Å²	140.6	84%	0.841	77%	0.765	S	S	*	*			trans	74.1	142.1	173.4	-45	165.2	0	0	0	115.3
342	S	34	Very low	32.8	Very low	89 Å²	89	139.9 Å²	139.9	62%	0.622	77%	0.768	S	S	*	*			cis	-169.7	163.3	-39	-162.2	0	0	0	0	110.1
343	D	37.4	Very low	32.9	Very low	106 Å²	106	142 Å²	142	57%	0.567	77%	0.772	S	S	*	*			trans	66.3	112.9	153.4	-72.3	-74.1	0	0	0	123
344	R	36.1	Very low	32.8	Very low	210 Å²	210	139 Å²	139	79%	0.792	77%	0.765	S	S	*	*			trans	75.5	151	131	-58.9	177	-156.5	-149.9	1.7	120.4
345	L	34.9	Very low	33	Very low	136 Å²	136	138 Å²	138	71%	0.712	77%	0.766	S	S	*	*			cis	-166	155.9	-14.9	-107.2	167.9	0	0	0	110.8
346	I	35.2	Very low	33.2	Very low	147 Å²	147	140.4 Å²	140.4	75%	0.754	76%	0.764	S	S	*	*			trans	75.5	135.4	149.6	-70.7	159	0	0	0	120.2
347	D	29.4	Very low	33.4	Very low	144 Å²	144	141.3 Å²	141.3	77%	0.77	77%	0.765	S	S	*	*			trans	-70.5	161.8	171	-53.3	-95.5	0	0	0	114.5
348	C	33.1	Very low	33.5	Very low	131 Å²	131	140.9 Å²	140.9	89%	0.885	76%	0.762	S	S	*	*				-168.7	151.4	114	-100.7	0	0	0	0	115.5
349	Q	30.5	Very low	33.6	Very low	166 Å²	166	142 Å²	142	78%	0.776	77%	0.77	S	S	*	*			trans	-62.5	158.3	-179.1	-69.1	172.4	-9	0	0	116.4
350	L	31	Very low	33.6	Very low	145 Å²	145	141 Å²	141	76%	0.759	77%	0.768	S	S	*	*			trans	63.9	150.5	149.6	-63.7	161.3	0	0	0	116.2
351	D	33.7	Very low	33.6	Very low	147 Å²	147	140.8 Å²	140.8	79%	0.786	77%	0.771	S	S	*	*			cis	-153	179.8	25	-132.3	-34.7	0	0	0	112.1
352	A	31.3	Very low	33.5	Very low	82 Å²	82	139.7 Å²	139.7	68%	0.678	77%	0.766	S	S	*	*			trans	-94	139.6	177.8	0	0	0	0	0	113.8
353	N	34.2	Very low	33.2	Very low	161 Å²	161	140.6 Å²	140.6	86%	0.861	77%	0.773	S	S	*	*			trans	-162.6	159.3	141.1	-116.3	-59.2	0	0	0	114.7
354	C	31.3	Very low	33.2	Very low	100 Å²	100	141.3 Å²	141.3	68%	0.676	79%	0.786	S	S	*	*			trans	-84.1	161.9	-177.5	-56	0	0	0	0	112.5
355	N	36.5	Very low	33	Very low	152 Å²	152	140.5 Å²	140.5	81%	0.813	79%	0.788	S	S	*	*				-175.5	161.8	101.6	-95.4	-52.9	0	0	0	114.7
356	H	32.1	Very low	33	Very low	168 Å²	168	143.2 Å²	143.2	78%	0.778	80%	0.797	S	S	*	*			trans	-76.6	154.9	179.2	-57.1	-101.3	0	0	0	112.4
357	T	33.9	Very low	32.7	Very low	151 Å²	151	143.6 Å²	143.6	93%	0.926	80%	0.801	S	S	*	*				-161.7	146	116.4	10.1	0	0	0	0	111.6
358	S	32.9	Very low	32.9	Very low	100 Å²	100	145 Å²	145	70%	0.699	81%	0.807	S	S	*	*			trans	-105.2	150.5	178.7	53	0	0	0	0	111
359	N	36.2	Very low	32.6	Very low	173 Å²	173	142.8 Å²	142.8	93%	0.925	79%	0.793	S	S	*	*			trans	-148.1	153.8	151.1	-100.7	-38.7	0	0	0	111.3
360	V	33.8	Very low	32.6	Very low	119 Å²	119	142 Å²	142	72%	0.721	79%	0.794	S	S	*	*			trans	-129	150	-169	168	0	0	0	0	108.3
361	I	34.5	Very low	32.8	Very low	165 Å²	165	143.3 Å²	143.3	85%	0.846	80%	0.8	S	S	*	*			trans	-164.2	154.3	146.5	-105.3	150.4	0	0	0	112.2
362	L	32.3	Very low	32.7	Very low	141 Å²	141	143.1 Å²	143.1	74%	0.738	80%	0.798	S	S	*	*			trans	-65.7	148.7	-175.2	-78.6	63.5	0	0	0	112.5
363	S	27.9	Very low	33	Very low	109 Å²	109	146.3 Å²	146.3	76%	0.762	80%	0.803	S	S	*	*				77.9	113.9	56.7	139.5	0	0	0	0	115.7
364	S	35.6	Very low	33.1	Very low	120 Å²	120	147 Å²	147	84%	0.839	80%	0.801	S	S	*	*			trans	-156.9	165.6	145.3	60.4	0	0	0	0	110.6
365	K	32.7	Very low	33.3	Very low	193 Å²	193	145.4 Å²	145.4	84%	0.839	80%	0.8	S	S	*	*			trans	-99.4	161.5	173.5	-58.2	170.3	-179.8	172.5	0	109.3
366	E	35	Very low	33.4	Very low	194 Å²	194	145.4 Å²	145.4	91%	0.907	80%	0.801	S	S	*	*				-174.2	162.8	113.4	-103.5	166.7	-167.7	0	0	113.6
367	N	29.4	Very low	33.8	Very low	155 Å²	155	142.4 Å²	142.4	83%	0.829	79%	0.794	S	S	*	*			trans	-90.5	149.5	172.8	-61.6	-43.9	0	0	0	109.7
368	L	32.1	Very low	34.1	Very low	174 Å²	174	142 Å²	142	91%	0.911	79%	0.787	S	S	*	*			trans	-164.1	169.5	141.7	-110.1	162.2	0	0	0	111.4
369	S	28.6	Very low	34.4	Very low	83 Å²	83	141 Å²	141	58%	0.58	78%	0.78	S	S	*	*			trans	-129.2	152	-155.8	57.9	0	0	0	0	114.6
370	N	29.3	Very low	34.7	Very low	149 Å²	149	140.1 Å²	140.1	80%	0.797	77%	0.769	S	S	*	*			trans	68.8	135	158.7	-53.7	-22	0	0	0	118.3
371	I	35.7	Very low	35	Very low	173 Å²	173	143.3 Å²	143.3	89%	0.887	77%	0.773	S	S	*	*			trans	-156	152.6	132.8	-103.5	153.8	0	0	0	107.9
372	I	31.4	Very low	35.1	Very low	144 Å²	144	138.9 Å²	138.9	74%	0.738	77%	0.769	S	S	*	*			trans	-117.1	158.9	-170.8	-66.8	166.2	0	0	0	109.1
373	L	36.9	Very low	35.3	Very low	149 Å²	149	139.8 Å²	139.8	78%	0.78	77%	0.773	S	S	*	*			trans	156	144.5	148.7	-84.3	161.8	0	0	0	106.9
374	E	36.4	Very low	35.8	Very low	176 Å²	176	140 Å²	140	82%	0.822	77%	0.771	S	S	*	*			cis	176.9	161.3	-24.4	-120.8	-177.9	-170.9	0	0	104.8
375	G	36.5	Very low	35.8	Very low	65 Å²	65	140.9 Å²	140.9	67%	0.67	77%	0.771	S	S	*	*			trans	144.1	89.4	171.4	0	0	0	0	0	117.2
376	D	39.1	Very low	35.8	Very low	153 Å²	153	135.8 Å²	135.8	82%	0.818	76%	0.76	S	S	*	*			trans	46.9	148.4	137.5	-55.8	-13.2	0	0	0	123.6
377	T	40.2	Very low	35.6	Very low	105 Å²	105	133.3 Å²	133.3	64%	0.644	75%	0.753	S	S	*	*			cis	-162.2	161.7	-32.4	41.9	0	0	0	0	108.8
378	N	39.2	Very low	36.1	Very low	143 Å²	143	134.8 Å²	134.8	77%	0.765	76%	0.755	S	S	*	*			trans	68.7	153.3	154.4	-67.4	-48.4	0	0	0	120.9
379	S	39	Very low	36	Very low	79 Å²	79	133.2 Å²	133.2	55%	0.552	75%	0.746	S	S	*	*			cis	-170	134.8	-40.5	48.5	0	0	0	0	111.9
380	H	42.4	Very low	36.5	Very low	153 Å²	153	138.5 Å²	138.5	71%	0.708	76%	0.759	S	S	*	*				153.9	130.2	127.1	-86.6	-40.2	0	0	0	116.2
381	K	41.1	Very low	36.8	Very low	186 Å²	186	137.6 Å²	137.6	81%	0.809	75%	0.754	S	S	*	*			trans	41	130.4	138.8	-56.9	166.7	-179.8	170.7	0	118.8
382	G	35.4	Very low	37	Very low	73 Å²	73	135 Å²	135	75%	0.753	74%	0.742	S	S	*	*			cis	125.1	161	17.6	0	0	0	0	0	110.1
383	I	37.6	Very low	37.4	Very low	160 Å²	160	135 Å²	135	82%	0.821	74%	0.737	S	S	*	*			cis	-152.2	140.3	2.4	-57.5	176.6	0	0	0	108.1
384	P	37.5	Very low	37.5	Very low	112 Å²	112	134.5 Å²	134.5	73%	0.727	73%	0.73	S	S	*	*			trans	-95.1	171.2	174.9	37.9	-34.5	0	0	0	113.9
385	V	35.9	Very low	37.7	Very low	139 Å²	139	133 Å²	133	84%	0.842	72%	0.722	S	S	*	*			trans	150.4	140.6	143.3	159.2	0	0	0	0	115.6
386	S	33.1	Very low	37.8	Very low	87 Å²	87	136.3 Å²	136.3	61%	0.608	72%	0.72	S	S	*	*			trans	75.4	117.2	152.3	-173.6	0	0	0	0	123.8
387	N	30.6	Very low	37.7	Very low	141 Å²	141	136 Å²	136	75%	0.754	71%	0.714	S	S	*	*				32.7	135.5	128.1	-41.8	-18.3	0	0	0	122
388	H	40.2	Very low	37.6	Very low	187 Å²	187	135.5 Å²	135.5	87%	0.866	72%	0.715	S	S	*	*				-162	162.3	110.7	-117.3	-85	0	0	0	113.3
389	I	30.7	Very low	37.2	Very low	140 Å²	140	134.7 Å²	134.7	72%	0.718	71%	0.711	S	S	*	*			trans	-111.4	143.3	177.6	-65.8	161.9	0	0	0	109
390	F	38.3	Very low	37.1	Very low	194 Å²	194	139.1 Å²	139.1	85%	0.851	72%	0.722	S	S	*	*			trans	-178.4	154.9	134.1	-110.5	-73.6	0	0	0	113.4
391	D	35.8	Very low	36.5	Very low	130 Å²	130	138 Å²	138	70%	0.695	73%	0.726	S	S	*	*			trans	-83.5	164.1	-178.8	-47.5	-93.6	0	0	0	114.5
392	D	39.6	Very low	36.2	Very low	119 Å²	119	134 Å²	134	64%	0.636	72%	0.719	S	S	*	*				-172	141.8	101.2	-119.2	6.5	0	0	0	117.6
393	K	39.8	Very low	35.8	Very low	144 Å²	144	137.5 Å²	137.5	63%	0.626	72%	0.72	S	S	*	*			trans	28.3	145.5	144	-58.5	173.1	-170.4	76.2	0	121.1
394	H	39.9	Very low	35.3	Very low	139 Å²	139	135.7 Å²	135.7	64%	0.644	71%	0.712	S	S	*	*				-164.7	146.3	57.8	-94.7	-86	0	0	0	115.9
395	H	40	Very low	34.8	Very low	143 Å²	143	136.7 Å²	136.7	66%	0.662	71%	0.711	S	S	*	*			trans	60.4	145	145	-62.7	-37.2	0	0	0	121.3
396	Q	39.3	Very low	34.3	Very low	135 Å²	135	135.3 Å²	135.3	63%	0.631	71%	0.707	S	S	*	*			cis	-155.1	150.4	-3.6	-127.5	171	-52.4	0	0	113.2
397	E	36.2	Very low	34.2	Very low	147 Å²	147	137.1 Å²	137.1	69%	0.687	72%	0.72	S	S	*	*			trans	23.6	151.4	137.7	-73.5	149.4	-147.9	0	0	121.9
398	S	37.4	Very low	34	Very low	94 Å²	94	137.5 Å²	137.5	66%	0.657	72%	0.72	S	S	*	*			cis	-178.2	173	-5.9	55.3	0	0	0	0	109.1
399	N	32.3	Very low	33.6	Very low	126 Å²	126	137.1 Å²	137.1	67%	0.674	72%	0.719	S	S	*	*			cis	-165.6	173	-30.4	-93.6	-5.7	0	0	0	109.2
400	H	36.5	Very low	33.3	Very low	173 Å²	173	139.7 Å²	139.7	80%	0.801	72%	0.721	S	S	*	*			trans	82.3	142.4	155.4	-62.9	-58.6	0	0	0	123
401	V	29.2	Very low	33.1	Very low	130 Å²	130	139.5 Å²	139.5	79%	0.788	72%	0.723	S	S	*	*			trans	-165.2	142.9	-162.9	152	0	0	0	0	103.2
402	P	35	Very low	32.8	Very low	102 Å²	102	141 Å²	141	66%	0.662	73%	0.726	S	S	*	*			cis	-150	-170.6	41.2	33.4	-7.7	0	0	0	118.2
403	L	27.8	Very low	32.3	Very low	146 Å²	146	142 Å²	142	76%	0.764	73%	0.73	S	S	*	*			trans	83.5	137	136.9	-90.1	164	0	0	0	124.4
404	N	27	Very low	31.9	Very low	122 Å²	122	141.7 Å²	141.7	65%	0.652	74%	0.735	S	S	*	*			trans	84.9	119.2	143.1	-85.7	-9.7	0	0	0	124.7
405	N	26.2	Very low	31.2	Very low	133 Å²	133	141.8 Å²	141.8	71%	0.711	74%	0.739	S	S	*	*				72.1	113	130	-67.8	-9.3	0	0	0	123.2
406	S	25.4	Very low	30.7	Very low	109 Å²	109	140.9 Å²	140.9	76%	0.762	75%	0.749	S	S	*	*			trans	54.4	117.4	131.2	67.3	0	0	0	0	121
407	S	31.3	Very low	30.1	Very low	126 Å²	126	142.1 Å²	142.1	88%	0.881	76%	0.759	S	S	*	*				-161.3	165.9	117.6	22.7	0	0	0	0	110.8
408	I	26.9	Very low	29.8	Very low	148 Å²	148	145 Å²	145	76%	0.759	77%	0.769	S	S	*	*			trans	-104.7	141.9	-178.8	-63.7	160.2	0	0	0	108	Y410	I408-Y410 HydrophobicContact CG2-CD2 3.94Å; I408-Y410 HydrophobicContact CG2-CE2 4.26Å
409	E	29.9	Very low	29.3	Very low	180 Å²	180	144.8 Å²	144.8	84%	0.841	77%	0.768	S	S	*	*			trans	-139.5	137.4	151.1	-159.5	159.8	-140.3	0	0	111.4
410	Y	25.3	Very low	29.3	Very low	194 Å²	194	146.2 Å²	146.2	76%	0.761	78%	0.776	S	S	*	*			trans	-100.7	145.9	174.7	-94.4	-105.5	0	0	0	109	I408	I408-Y410 HydrophobicContact CG2-CD2 3.94Å; I408-Y410 HydrophobicContact CG2-CE2 4.26Å
411	Q	34.1	Very low	28.7	Very low	189 Å²	189	145.9 Å²	145.9	88%	0.883	78%	0.779	S	S	*	*			trans	-127.7	152.2	148.4	-68.8	-165.5	-1.7	0	0	109.9
412	Q	29.7	Very low	28.7	Very low	161 Å²	161	145.6 Å²	145.6	75%	0.752	78%	0.783	S	S	*	*			trans	-142.6	179.3	-154.9	-174.4	175	-12.6	0	0	109.3
413	L	29.2	Very low	28.2	Very low	141 Å²	141	144.9 Å²	144.9	74%	0.738	79%	0.785	S	S	*	*			trans	88.2	145	171.8	-49.3	173.1	0	0	0	114.2
414	D	30.8	Very low	28.4	Very low	137 Å²	137	147.9 Å²	147.9	73%	0.733	79%	0.792	S	S	*	*			cis	-145.1	174	0.3	-137.1	-30.8	0	0	0	114.8
415	I	25.7	Very low	28.4	Very low	141 Å²	141	148.9 Å²	148.9	72%	0.723	80%	0.797	S	S	*	*			trans	-105.4	137.7	-168	-62.1	161.4	0	0	0	111.7
416	S	29.8	Very low	28.7	Very low	125 Å²	125	149 Å²	149	87%	0.874	80%	0.798	S	S	*	*			trans	-157	123	146.2	-98.3	0	0	0	0	114.8
417	L	25.3	Very low	28.9	Very low	160 Å²	160	150 Å²	150	84%	0.838	79%	0.794	S	S	*	*			trans	-89.6	134.1	160.6	-84.3	149.6	0	0	0	109.3
418	K	32	Very low	29	Very low	207 Å²	207	150.5 Å²	150.5	90%	0.9	79%	0.792	S	S	*	*			trans	-158.8	142.6	143.7	-114.3	155.5	-169.3	171.7	0	113.5
419	S	26.5	Very low	29.1	Very low	91 Å²	91	149 Å²	149	64%	0.636	79%	0.79	S	S	*	*			trans	-65.4	158.1	171.7	52.1	0	0	0	0	112.2
420	N	30.7	Very low	29.2	Very low	155 Å²	155	150.1 Å²	150.1	83%	0.829	79%	0.793	S	S	*	*				-166	150.6	114.9	-92	-18.2	0	0	0	112.1
421	L	25	Very low	29.3	Very low	167 Å²	167	147 Å²	147	87%	0.874	79%	0.789	S	S	*	*			trans	-83.5	145.4	166.8	-60.7	84.3	0	0	0	109.2
422	S	28.6	Very low	29.5	Very low	123 Å²	123	146.3 Å²	146.3	86%	0.86	79%	0.788	S	S	*	*			trans	-162.1	145.4	136.9	-164.7	0	0	0	0	110.1
423	A	25.6	Very low	29.3	Very low	87 Å²	87	146.7 Å²	146.7	72%	0.719	79%	0.79	S	S	*	*			trans	-95.4	157.6	173.6	0	0	0	0	0	110.8
424	K	31	Very low	29.7	Very low	209 Å²	209	149.4 Å²	149.4	91%	0.909	79%	0.791	S	S	*	*			trans	-154.9	141.8	142.9	-114.8	170.5	-173.6	-177.5	0	111.1
425	L	27.2	Very low	29.8	Very low	144 Å²	144	149 Å²	149	75%	0.754	79%	0.79	S	S	*	*			trans	-71.2	162.4	164.1	-79.9	64.4	0	0	0	109
426	N	32.9	Very low	29.9	Very low	135 Å²	135	148 Å²	148	72%	0.722	79%	0.79	S	S	*	*				-173.8	140.5	106	-87.8	8.3	0	0	0	110.7
427	D	29.5	Very low	30.3	Very low	130 Å²	130	148.6 Å²	148.6	70%	0.695	79%	0.789	S	S	*	*			trans	18	137.3	139.8	-38.3	-35.3	0	0	0	118.3
428	T	33.2	Very low	30.6	Very low	136 Å²	136	147.8 Å²	147.8	83%	0.834	79%	0.785	S	S	*	*				-159.8	151.9	63.7	31.2	0	0	0	0	114
429	T	28.4	Very low	31	Very low	116 Å²	116	146.7 Å²	146.7	71%	0.712	79%	0.785	S	S	*	*			trans	-82.9	150.1	170.6	-43.3	0	0	0	0	111.1
430	F	32.6	Very low	31.3	Very low	205 Å²	205	149.7 Å²	149.7	90%	0.899	79%	0.794	S	S	*	*			trans	-140.6	104.3	161.2	-124.3	-82.6	0	0	0	110.1
431	D	28.5	Very low	31.7	Very low	129 Å²	129	148.4 Å²	148.4	69%	0.69	79%	0.792	S	S	*	*			trans	-86.2	151	169.7	-82.8	-62.3	0	0	0	110.7
432	M	36.9	Very low	32.1	Very low	173 Å²	173	147.6 Å²	147.6	85%	0.852	79%	0.788	S	S	*	*			trans	-146.1	93.4	160.3	-153.5	178.9	83.4	0	0	110.7
433	Q	26.9	Very low	32.6	Very low	169 Å²	169	149.2 Å²	149.2	79%	0.79	79%	0.787	S	S	*	*			trans	-86.4	145.9	167.8	-63.7	-179.9	-10.2	0	0	110.1
434	Y	36.4	Very low	32.9	Very low	198 Å²	198	152.7 Å²	152.7	78%	0.776	79%	0.794	S	S	*	*			trans	-153.2	123.5	150.5	-93.7	-67.2	0	0	0	111
435	N	33.4	Very low	33.2	Very low	130 Å²	130	148.8 Å²	148.8	70%	0.695	79%	0.787	S	S	*	*			trans	41	125.4	150.6	-52.7	0.4	0	0	0	119.3
436	T	28.6	Very low	33.4	Very low	120 Å²	120	148.7 Å²	148.7	74%	0.736	79%	0.786	S	S	*	*			cis	56.4	105.6	49.2	74.6	0	0	0	0	116.1
437	T	36.3	Very low	33.8	Very low	137 Å²	137	151.3 Å²	151.3	84%	0.84	79%	0.791	S	S	*	*				-166.9	157.3	113.4	25.3	0	0	0	0	111.9
438	D	32.2	Very low	34	Very low	142 Å²	142	151.7 Å²	151.7	76%	0.759	79%	0.793	S	S	*	*			trans	-61.8	162.1	-174	-41.2	-80	0	0	0	115.9
439	M	41.8	Very low	34.3	Very low	184 Å²	184	152.8 Å²	152.8	91%	0.906	79%	0.794	S	S	*	*				-167.5	153.4	117.7	-95.5	-55.4	163.4	0	0	111
440	N	32.3	Very low	34.8	Very low	155 Å²	155	154.1 Å²	154.1	83%	0.829	80%	0.797	S	S	*	*			trans	-98	176.7	178.5	-96	-20.8	0	0	0	112.4
441	V	39.5	Very low	35.1	Very low	127 Å²	127	151 Å²	151	77%	0.77	79%	0.788	S	S	*	*			trans	118.2	119.5	150.9	179.2	0	0	0	0	114.7
442	D	33.3	Very low	35.6	Very low	151 Å²	151	152.5 Å²	152.5	81%	0.807	79%	0.794	S	S	*	*			trans	-72.7	154.3	172	-48.7	-83.4	0	0	0	112.8
443	N	38.3	Very low	35.7	Very low	157 Å²	157	148.6 Å²	148.6	84%	0.84	78%	0.784	S	S	*	*			trans	-161.8	125	151.3	-90.6	-60.7	0	0	0	110.2
444	D	32.7	Very low	36.1	Very low	160 Å²	160	147.4 Å²	147.4	86%	0.856	78%	0.783	S	S	*	*			trans	-77.8	147.3	156.7	-74.6	-55.6	0	0	0	109.8
445	V	36.4	Very low	36	Very low	127 Å²	127	143.3 Å²	143.3	77%	0.77	78%	0.779	S	S	*	*			trans	-169.6	148.5	144.9	132.7	0	0	0	0	110.6	F447	V445-F447 HydrophobicContact CG1-CD2 4.11Å; V445-F447 HydrophobicContact CG1-CE2 3.87Å
446	I	31.1	Very low	35.9	Very low	142 Å²	142	143.1 Å²	143.1	73%	0.728	79%	0.786	S	S	*	*			trans	-89.1	146.4	-178.6	-62.1	160.4	0	0	0	110.5
447	F	41.3	Very low	36	Very low	190 Å²	190	146 Å²	146	83%	0.833	79%	0.791	S	S	*	*			trans	-136.7	136.1	155.4	-86.8	-82.6	0	0	0	110.7	V445	V445-F447 HydrophobicContact CG1-CD2 4.11Å; V445-F447 HydrophobicContact CG1-CE2 3.87Å
448	D	34.7	Very low	35.9	Very low	138 Å²	138	148 Å²	148	74%	0.738	79%	0.788	S	S	*	*			trans	-94.7	-163.4	172.2	-83.3	-59.8	0	0	0	110.6
449	D	39.1	Very low	35.8	Very low	158 Å²	158	148.4 Å²	148.4	85%	0.845	79%	0.787	S	S	*	*			trans	95.3	138.5	171	-57.6	-14.2	0	0	0	117.4
450	D	38.8	Very low	35.2	Very low	144 Å²	144	146 Å²	146	77%	0.77	78%	0.777	S	S	*	*			cis	-167.3	-168.4	-30.4	-167.5	12.2	0	0	0	108.2
451	I	39.5	Very low	35.2	Very low	139 Å²	139	145.8 Å²	145.8	71%	0.713	78%	0.776	S	S	*	*			trans	86	136.8	152.7	-22.7	-176.9	0	0	0	119.1
452	I	38.6	Very low	34.7	Very low	161 Å²	161	145.8 Å²	145.8	83%	0.826	77%	0.771	S	S	*	*			trans	86	126.2	162.4	-44.5	-177.5	0	0	0	116.9
453	S	37.9	Very low	34.6	Very low	91 Å²	91	144.8 Å²	144.8	64%	0.636	77%	0.766	S	S	*	*				175.7	147.4	-50.4	173.9	0	0	0	0	109.6
454	N	36.6	Very low	34.3	Very low	145 Å²	145	144.9 Å²	144.9	78%	0.775	76%	0.762	S	S	*	*			trans	66.8	160.5	167.3	-73.7	-47.5	0	0	0	119.4
455	T	33.8	Very low	34.1	Very low	111 Å²	111	143.2 Å²	143.2	68%	0.681	75%	0.751	S	S	*	*			cis	-178.7	129.8	-38.7	-91.6	0	0	0	0	107.2
456	C	32	Very low	33.6	Very low	126 Å²	126	144.2 Å²	144.2	85%	0.851	75%	0.752	S	S	*	*			trans	172.3	152.1	142.5	-100.4	0	0	0	0	112.5
457	Q	29.8	Very low	33.5	Very low	180 Å²	180	142.4 Å²	142.4	84%	0.841	75%	0.752	S	S	*	*			trans	-136.4	178.9	-178.7	-67.4	169.4	-54.8	0	0	110.5
458	K	34	Very low	32.9	Very low	180 Å²	180	141.3 Å²	141.3	78%	0.783	75%	0.754	S	S	*	*			trans	81.8	150.8	176.2	-53.7	165.6	-179.8	174.4	0	113.6
459	M	30.3	Very low	32.5	Very low	150 Å²	150	141.2 Å²	141.2	74%	0.739	75%	0.753	S	S	*	*			cis	-141.8	139.9	1.7	-111.3	130.3	175	0	0	107.2
460	I	30	Very low	31.9	Very low	134 Å²	134	139.7 Å²	139.7	69%	0.687	75%	0.754	S	S	*	*				78.2	133.9	74.4	-68.5	176.6	0	0	0	114.5
461	N	32	Very low	31.2	Very low	150 Å²	150	143.4 Å²	143.4	80%	0.802	76%	0.758	S	S	*	*			trans	67.6	165.6	174.3	-66.3	-5.6	0	0	0	117.7
462	N	28.4	Very low	30.6	Very low	127 Å²	127	141.2 Å²	141.2	68%	0.679	76%	0.755	S	S	*	*			cis	-169.5	-176.1	-48	-153.4	51.7	0	0	0	106.3
463	D	31.5	Very low	29.9	Very low	131 Å²	131	138.1 Å²	138.1	70%	0.701	75%	0.746	S	S	*	*			trans	66.2	157.1	164.4	-47.6	-30.2	0	0	0	115.9
464	Q	31.2	Very low	29.2	Very low	158 Å²	158	139 Å²	139	74%	0.738	75%	0.752	S	S	*	*			cis	-175.4	132.2	-45	-113.3	-165.6	7.7	0	0	104.6
465	I	28.3	Very low	28.8	Very low	125 Å²	125	140.2 Å²	140.2	64%	0.641	75%	0.751	S	S	*	*			trans	74	136.4	138.1	-65	176.5	0	0	0	120.6
466	N	27.7	Very low	28.4	Very low	148 Å²	148	142 Å²	142	79%	0.791	76%	0.755	S	S	*	*			trans	66.9	108.8	158.3	-68.9	-6.3	0	0	0	123.3
467	S	28.8	Very low	28.2	Very low	104 Å²	104	145 Å²	145	73%	0.727	75%	0.753	S	S	*	*				49.8	114	109.5	-169.9	0	0	0	0	120.6
468	I	28.3	Very low	27.9	Very low	168 Å²	168	142.4 Å²	142.4	86%	0.862	75%	0.753	S	S	*	*			trans	-156.7	146.7	137.5	-109.6	157.6	0	0	0	110.1
469	D	25.5	Very low	27.5	Very low	135 Å²	135	140.6 Å²	140.6	72%	0.722	75%	0.75	S	S	*	*			trans	-75.4	151.6	-171.6	-65.9	-85.6	0	0	0	115.6
470	C	27.2	Very low	27.3	Very low	127 Å²	127	141.9 Å²	141.9	86%	0.858	75%	0.754	S	S	*	*			trans	-143	71.3	164.5	-90.3	0	0	0	0	111.8
471	Y	24.7	Very low	27	Very low	221 Å²	221	141 Å²	141	87%	0.867	76%	0.759	S	S	*	*			trans	40.1	109.7	154.8	-75.5	-88.8	0	0	0	120.5
472	S	25	Very low	26.7	Very low	93 Å²	93	140.6 Å²	140.6	65%	0.65	76%	0.757	S	S	*	*			trans	-71.3	173.1	154.8	-154.9	0	0	0	0	110.6	S474	S472-S474 PolarHBondContact OG-N 3.29Å
473	P	25.2	Very low	26.7	Very low	96 Å²	96	142.6 Å²	142.6	62%	0.623	76%	0.762	S	S	*	*				-141.7	137.7	75.4	36.2	-19.1	0	0	0	116.2	F475	P473-F475 HydrophobicContact CB-CD2 3.69Å; P473-F475 HydrophobicContact CB-CE2 3.48Å; P473-F475 VanDerWaalsContact CB-CE2 3.48Å; P473-F475 HydrophobicContact CB-CZ 4.32Å; P473-F475 HydrophobicContact CG-CD2 3.92Å; P473-F475 HydrophobicContact CG-CE2 3.88Å
474	S	23.7	Very low	26.5	Very low	109 Å²	109	144 Å²	144	76%	0.762	77%	0.769	S	S	*	*			trans	-76.4	117.3	161.2	-52.1	0	0	0	0	111.1	S472	S472-S474 PolarHBondContact OG-N 3.29Å
475	F	26.6	Very low	26.2	Very low	172 Å²	172	144.8 Å²	144.8	75%	0.754	77%	0.774	S	S	*	*			trans	-145.1	140.4	170	-70.7	-57.4	0	0	0	108.2	P473	P473-F475 HydrophobicContact CB-CD2 3.69Å; P473-F475 HydrophobicContact CB-CE2 3.48Å; P473-F475 VanDerWaalsContact CB-CE2 3.48Å; P473-F475 HydrophobicContact CB-CZ 4.32Å; P473-F475 HydrophobicContact CG-CD2 3.92Å; P473-F475 HydrophobicContact CG-CE2 3.88Å
476	L	26.5	Very low	26.1	Very low	149 Å²	149	148 Å²	148	78%	0.78	78%	0.784	S	S	*	*			cis	-129.2	165.5	7.2	-68.4	168.8	0	0	0	111.5
477	K	26.6	Very low	26	Very low	187 Å²	187	150 Å²	150	81%	0.813	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-65.5	159.8	162.9	-68.3	177.9	177.5	179.8	0	110.8	I479	K477-I479 PolarHBondContact O-N 3.05Å
478	P	25.1	Very low	25.9	Very low	127 Å²	127	153.2 Å²	153.2	83%	0.825	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-56.2	137.3	161.4	-18.7	31.9	0	0	0	110
479	I	25.5	Very low	25.6	Very low	141 Å²	141	152.6 Å²	152.6	72%	0.723	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-92.6	126.6	171.2	-62.4	174.4	0	0	0	106.9	K477	K477-I479 PolarHBondContact O-N 3.05Å
480	E	24.8	Very low	25.6	Very low	177 Å²	177	151.9 Å²	151.9	83%	0.827	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-66.8	147.5	175.4	-68.9	174.9	130.9	0	0	110.7	D482	E480-D482 VanDerWaalsContact C-N 3.26Å; E480-D482 PolarHBondContact O-N 2.86Å; E480-D482 VanDerWaalsContact O-N 3.14Å
481	C	24.3	Very low	25.5	Very low	117 Å²	117	151 Å²	151	79%	0.791	79%	0.79	S	S	*	*	G	3₁₀ helix	trans	-82.1	2	-154.9	-152.5	0	0	0	0	115.2
482	D	26.3	Very low	25.6	Very low	141 Å²	141	148.1 Å²	148.1	75%	0.754	79%	0.788	S	S	*	*	G	3₁₀ helix	trans	-94.4	-4.4	-159.8	-64	-1.4	0	0	0	114	E480	E480-D482 VanDerWaalsContact C-N 3.26Å; E480-D482 PolarHBondContact O-N 2.86Å; E480-D482 VanDerWaalsContact O-N 3.14Å
483	Q	28.6	Very low	25.8	Very low	169 Å²	169	150.8 Å²	150.8	79%	0.79	80%	0.795	S	S	*	*	G	3₁₀ helix	trans	-99	-3.3	-171.1	-135.2	70.7	18.6	0	0	116
484	L	26.3	Very low	25.7	Very low	161 Å²	161	153.2 Å²	153.2	84%	0.843	80%	0.801	S	S	*	*			trans	-115.1	27.8	-171.5	-72.3	175.8	0	0	0	115.2
485	M	24.9	Very low	26	Very low	174 Å²	174	154.5 Å²	154.5	86%	0.857	81%	0.808	S	S	*	*	S	Bend	trans	-104.2	31.4	178.2	-82.1	-68.6	-65.9	0	0	113.9
486	K	27.1	Very low	26.1	Very low	193 Å²	193	151.1 Å²	151.1	84%	0.839	81%	0.806	S	S	*	*	S	Bend	trans	-133.4	-4.8	-173.5	-81.1	-168.1	173.6	-179.7	0	118.9
487	E	25.2	Very low	26.3	Very low	190 Å²	190	151.5 Å²	151.5	89%	0.888	81%	0.809	S	S	*	*	S	Bend	trans	-127.4	83.7	175.5	-70.7	-168.7	179.8	0	0	112
488	L	25.9	Very low	26.5	Very low	171 Å²	171	147.1 Å²	147.1	90%	0.895	80%	0.8	S	S	*	*			trans	-176.7	62.7	149.8	-102.7	164.8	0	0	0	109.9
489	I	23.4	Very low	26.9	Very low	155 Å²	155	147.5 Å²	147.5	80%	0.795	80%	0.795	S	S	*	*			trans	-114.6	113.3	167.3	-59.2	176.2	0	0	0	107.4
490	C	25.3	Very low	27.3	Very low	120 Å²	120	147.4 Å²	147.4	81%	0.811	79%	0.794	S	S	*	*			trans	-112.1	128.5	161.6	-75.5	0	0	0	0	108.2
491	P	24.8	Very low	27.5	Very low	108 Å²	108	146.3 Å²	146.3	70%	0.701	79%	0.789	S	S	*	*			trans	-84.2	164.5	178.4	35.9	-35.7	0	0	0	111.6
492	I	27	Very low	27.8	Very low	161 Å²	161	146.8 Å²	146.8	83%	0.826	79%	0.789	S	S	*	*			trans	-146.1	113.4	140.8	-94.7	136.7	0	0	0	108.1
493	D	28.3	Very low	28	Very low	148 Å²	148	146 Å²	146	79%	0.791	79%	0.789	S	S	*	*			trans	43.5	124.6	149.3	-52	-33	0	0	0	123.3
494	I	24.2	Very low	27.8	Very low	147 Å²	147	145 Å²	145	75%	0.754	79%	0.789	S	S	*	*			trans	-82.1	129.9	164	-62.4	161.5	0	0	0	108.6	S496	I494-S496 WeakPolarHBondContact CG2-OG 3.17Å
495	C	30	Very low	28	Very low	136 Å²	136	143 Å²	143	92%	0.919	79%	0.787	S	S	*	*			trans	-132.6	81	160.1	-125.8	0	0	0	0	110.1
496	S	27.5	Very low	28.1	Very low	101 Å²	101	142.7 Å²	142.7	71%	0.706	78%	0.784	S	S	*	*			trans	-71.8	134.1	177.4	-55.7	0	0	0	0	111.6	I494	I494-S496 WeakPolarHBondContact CG2-OG 3.17Å
497	N	31.7	Very low	28.1	Very low	157 Å²	157	140.3 Å²	140.3	84%	0.84	78%	0.779	S	S	*	*			trans	-150.4	115.1	143.1	-148.7	6.1	0	0	0	109.9
498	P	29.5	Very low	28.1	Very low	95 Å²	95	135.3 Å²	135.3	62%	0.617	77%	0.765	S	S	*	*			trans	-82.7	153.6	177	34.4	-34.3	0	0	0	111.3
499	N	35.1	Very low	28.2	Very low	136 Å²	136	133.6 Å²	133.6	73%	0.727	76%	0.757	S	S	*	*				171.7	134.9	128.7	-88.8	-24.6	0	0	0	112.1
500	I	32.6	Very low	28.3	Very low	138 Å²	138	131.2 Å²	131.2	71%	0.708	75%	0.749	S	S	*	*			trans	60.1	129.5	136.2	-58.6	170	0	0	0	117.9
501	E	30.4	Very low	28.4	Very low	155 Å²	155	134 Å²	134	72%	0.724	75%	0.75	S	S	*	*			cis	-179.6	137.1	-20.7	-121.3	171.9	176.2	0	0	107.3
502	T	28.9	Very low	28.5	Very low	127 Å²	127	134.6 Å²	134.6	78%	0.779	76%	0.756	S	S	*	*			trans	60.2	160.9	160.3	65.4	0	0	0	0	117.7
503	T	31.6	Very low	28.4	Very low	125 Å²	125	132.3 Å²	132.3	77%	0.767	75%	0.754	S	S	*	*			cis	-149.8	175.9	-1	-12.4	0	0	0	0	109.8
504	D	25.2	Very low	28.3	Very low	147 Å²	147	128.9 Å²	128.9	79%	0.786	75%	0.754	S	S	*	*			trans	-69.4	140.7	-176.5	-51.1	-97.3	0	0	0	117
505	C	29.3	Very low	28.7	Very low	118 Å²	118	131.3 Å²	131.3	80%	0.797	76%	0.762	S	S	*	*			trans	-178	124.2	131.6	-92.1	0	0	0	0	108.4
506	Q	27.1	Very low	28.5	Very low	169 Å²	169	131.7 Å²	131.7	79%	0.79	76%	0.755	S	S	*	*				73.7	145.7	69.9	-76.4	-135.9	17	0	0	115.9
507	I	28.3	Very low	28.5	Very low	142 Å²	142	133.6 Å²	133.6	73%	0.728	76%	0.757	S	S	*	*			trans	79.2	89.3	167	-59.8	152.6	0	0	0	117.2
508	S	24.8	Very low	28.2	Very low	86 Å²	86	133.3 Å²	133.3	60%	0.601	76%	0.755	S	S	*	*			trans	3.8	145	135.3	57.9	0	0	0	0	121.1
509	N	27	Very low	28.2	Very low	135 Å²	135	133.3 Å²	133.3	72%	0.722	76%	0.757	S	S	*	*				179.7	157.8	100.5	-93.2	-38.7	0	0	0	115.7
510	T	27	Very low	27.8	Very low	105 Å²	105	133.3 Å²	133.3	64%	0.644	76%	0.756	S	S	*	*			trans	33.9	112.8	147.2	59.1	0	0	0	0	120.5
511	E	26	Very low	27.7	Very low	178 Å²	178	133 Å²	133	83%	0.832	76%	0.755	S	S	*	*				96.3	178.6	85.3	-80.4	-178	153.7	0	0	113.8
512	C	26.6	Very low	27.6	Very low	120 Å²	120	132.6 Å²	132.6	81%	0.811	75%	0.753	S	S	*	*			trans	70.1	115	-173.8	-63.1	0	0	0	0	115.1
513	S	24.9	Very low	27.9	Very low	114 Å²	114	137 Å²	137	80%	0.797	76%	0.757	S	S	*	*			cis	102.8	124.8	19.9	81	0	0	0	0	114.6
514	G	26.7	Very low	27.7	Very low	76 Å²	76	138.5 Å²	138.5	78%	0.784	76%	0.755	S	S	*	*			trans	91.7	155	176.1	0	0	0	0	0	113.7
515	Q	33.5	Very low	28	Very low	197 Å²	197	138.3 Å²	138.3	92%	0.921	76%	0.755	S	S	*	*			cis	-137.8	174.3	0.6	-73.7	-173.9	-35.2	0	0	111.7
516	N	24.9	Very low	28.2	Very low	145 Å²	145	140.5 Å²	140.5	78%	0.775	76%	0.758	S	S	*	*			trans	-98.5	157.4	-169.5	-64.8	-32.9	0	0	0	114.4
517	N	26.6	Very low	28.3	Very low	140 Å²	140	139.7 Å²	139.7	75%	0.749	76%	0.755	S	S	*	*			trans	81.2	138.3	139.3	-73.1	-6.3	0	0	0	122.8
518	L	26.7	Very low	28.5	Very low	151 Å²	151	138.1 Å²	138.1	79%	0.791	75%	0.753	S	S	*	*			trans	72	142.7	155.5	-62	154.9	0	0	0	115.8
519	S	28.2	Very low	28.5	Very low	95 Å²	95	142.6 Å²	142.6	66%	0.664	76%	0.762	S	S	*	*			cis	-144.1	159.2	15.7	-32	0	0	0	0	110.6
520	I	28.3	Very low	28.6	Very low	137 Å²	137	141.1 Å²	141.1	70%	0.703	76%	0.762	S	S	*	*				52.1	119.8	95.8	-53.6	176.4	0	0	0	111.7
521	D	29.5	Very low	28.5	Very low	130 Å²	130	144.8 Å²	144.8	70%	0.695	78%	0.778	S	S	*	*			cis	-155.6	173.6	18.7	-120.6	-17.4	0	0	0	114.6
522	H	29.6	Very low	28.6	Very low	147 Å²	147	143.8 Å²	143.8	68%	0.681	78%	0.778	S	S	*	*			trans	24.1	128.3	156.7	-76	-85.2	0	0	0	122.2
523	Y	33.4	Very low	28.5	Very low	220 Å²	220	145.2 Å²	145.2	86%	0.863	78%	0.782	S	S	*	*				-164.6	172.6	99.7	-112.2	-79.1	0	0	0	111.6
524	E	28.5	Very low	28.5	Very low	156 Å²	156	143.1 Å²	143.1	73%	0.729	78%	0.778	S	S	*	*			trans	-94.4	-179.8	-164.8	-64.5	173.8	119.2	0	0	114.7
525	D	30.9	Very low	28.4	Very low	144 Å²	144	146.5 Å²	146.5	77%	0.77	78%	0.778	S	S	*	*			trans	62.1	106.2	168.9	-63.4	-25	0	0	0	119.3
526	N	33.8	Very low	28	Very low	163 Å²	163	144.3 Å²	144.3	87%	0.872	77%	0.768	S	S	*	*				179.7	128.3	103	-95.8	-79.6	0	0	0	111
527	E	29.7	Very low	28	Very low	153 Å²	153	144.3 Å²	144.3	72%	0.715	77%	0.768	S	S	*	*			trans	-80.8	146	168.4	-148.7	-151.1	-113.6	0	0	110	K529	E527-K529 WeakPolarHBondContact OE2-CG 3.44Å; E527-K529 PolarHBondContact OE2-N 3.14Å
528	P	30.9	Very low	27.9	Very low	108 Å²	108	146 Å²	146	70%	0.701	77%	0.765	S	S	*	*				-149.1	133.9	102.8	35.1	-17.8	0	0	0	116.6
529	K	26.1	Very low	27.9	Very low	181 Å²	181	147.5 Å²	147.5	79%	0.787	77%	0.766	S	S	*	*			trans	36.5	100.5	133.9	-58.5	169.3	-174.8	164.5	0	119.3	E527	E527-K529 WeakPolarHBondContact OE2-CG 3.44Å; E527-K529 PolarHBondContact OE2-N 3.14Å
530	S	29.3	Very low	27.8	Very low	104 Å²	104	152.4 Å²	152.4	73%	0.727	78%	0.775	S	S	*	*			trans	-154.5	92.9	139.8	48.5	0	0	0	0	113.1	L532	S530-L532 PolarHBondContact O-N 2.97Å; S530-L532 VanDerWaalsContact O-N 3.08Å
531	N	24.9	Very low	27.7	Very low	181 Å²	181	151.3 Å²	151.3	97%	0.968	77%	0.77	S	S	*	*			trans	-75	96.9	173.9	-78.9	-18.9	0	0	0	110.5
532	L	27.1	Very low	27.7	Very low	158 Å²	158	148.7 Å²	148.7	83%	0.827	76%	0.759	S	S	*	*			trans	-122	45.5	-175.7	-138.8	171.8	0	0	0	112.2	S530	S530-L532 PolarHBondContact O-N 2.97Å; S530-L532 VanDerWaalsContact O-N 3.08Å
533	V	24.9	Very low	27.8	Very low	150 Å²	150	146.8 Å²	146.8	91%	0.909	75%	0.746	S	S	*	*			trans	-125.8	108.7	177	-175.9	0	0	0	0	109.4
534	G	25.3	Very low	27.9	Very low	69 Å²	69	139.8 Å²	139.8	71%	0.711	72%	0.724	S	S	*	*			trans	-141.6	90.3	-177.1	0	0	0	0	0	112.6
535	N	24.7	Very low	28.1	Very low	147 Å²	147	133.7 Å²	133.7	79%	0.786	70%	0.696	S	S	*	*			trans	36.7	83.1	160.9	-61.4	-7.7	0	0	0	117.6	N537	N535-N537 PolarHBondContact O-N 3.35Å
536	Q	25.9	Very low	28.1	Very low	152 Å²	152	130.3 Å²	130.3	71%	0.71	68%	0.678	S	S	*	*			trans	-74.1	108.8	154.7	-69.4	-173.2	-0	0	0	109.2	Y538	Q536-Y538 HydrophobicContact CB-CD2 4.36Å; Q536-Y538 HydrophobicContact CB-CE2 3.95Å; Q536-Y538 VanDerWaalsContact O-CD2 3.32Å; Q536-Y538 WeakPolarHBondContact O-CD2 3.4Å; Q536-Y538 PolarHBondContact O-N 3.08Å; Q536-Y538 VanDerWaalsContact O-N 3.1Å; Q536-Y538 PolarHBondContact OE1-OH 3.19Å
537	N	24.4	Very low	28	Very low	145 Å²	145	124.5 Å²	124.5	78%	0.775	65%	0.65	S	S	*	*			trans	-75.7	94.5	175.6	-79.3	-26.3	0	0	0	110.4	N535 F539	N535-N537 PolarHBondContact O-N 3.35Å; N537-F539 PolarHBondContact O-N 3.19Å
538	Y	24.7	Very low	28.2	Very low	176 Å²	176	120.7 Å²	120.7	69%	0.69	63%	0.634	S	S	*	*			trans	-66.3	128.8	175.8	-77.6	-93.7	0	0	0	111.6	Q536 K540	Q536-Y538 HydrophobicContact CB-CD2 4.36Å; Q536-Y538 HydrophobicContact CB-CE2 3.95Å; Q536-Y538 VanDerWaalsContact O-CD2 3.32Å; Q536-Y538 WeakPolarHBondContact O-CD2 3.4Å; Q536-Y538 PolarHBondContact O-N 3.08Å; Q536-Y538 VanDerWaalsContact O-N 3.1Å; Q536-Y538 PolarHBondContact OE1-OH 3.19Å; Y538-K540 PolarHBondContact O-N 3.4Å
539	F	26.4	Very low	28.1	Very low	181 Å²	181	123 Å²	123	79%	0.794	63%	0.63	S	S	*	*			trans	-68.3	125.3	-177.3	-90	-97.1	0	0	0	112.1	N537 L541	N537-F539 PolarHBondContact O-N 3.19Å; F539-L541 PolarHBondContact O-N 3.29Å; F539-L541 VanDerWaalsContact O-N 3.07Å
540	K	25.5	Very low	28.3	Very low	198 Å²	198	119 Å²	119	86%	0.861	63%	0.625	S	S	*	*			trans	-81.3	83.7	175.4	-170.3	174	-175.3	173.2	0	110.5	Y538	Y538-K540 PolarHBondContact O-N 3.4Å
541	L	27.2	Very low	28.3	Very low	115 Å²	115	117.6 Å²	117.6	60%	0.602	62%	0.615	S	S	*	*			trans	-52.4	137.7	172	-68.9	172.3	0	0	0	110.7	F539 D545	F539-L541 PolarHBondContact O-N 3.29Å; F539-L541 VanDerWaalsContact O-N 3.07Å; L541-D545 HydrophobicContact CD2-CB 4.01Å
542	T	29.2	Very low	28.5	Very low	74 Å²	74	115.1 Å²	115.1	45%	0.454	60%	0.602	S	S	.	*			trans	-97.2	163.7	176.1	75.4	0	0	0	0	110.8	N544 D545 L546	T542-N544 PolarHBondContact O-N 2.97Å; T542-D545 WeakPolarHBondContact CA-OD2 3.27Å; T542-D545 WeakPolarHBondContact CB-OD2 3.49Å; T542-D545 PolarHBondContact N-OD2 2.87Å; T542-D545 WeakPolarHBondContact O-CB 3.48Å; T542-D545 PolarHBondContact O-N 3.22Å; T542-D545 PolarHBondContact OG1-OD2 3.35Å; T542-L546 PolarHBondContact O-N 2.95Å
543	Y	30.3	Very low	28.5	Very low	107 Å²	107	114 Å²	114	42%	0.42	60%	0.601	S	S	.	*	H	α-helix	trans	-56.4	-32.6	177.7	-177.9	-99.9	0	0	0	113.1	L32 L546 S547	L32-Y543 WeakPolarHBondContact CD1-OH 3.37Å; L32-Y543 WeakPolarHBondContact CG-OH 3.26Å; Y543-L546 PolarHBondContact O-N 3.42Å; Y543-S547 WeakPolarHBondContact O-CB 3.45Å; Y543-S547 PolarHBondContact O-N 2.69Å
544	N	35.4	Very low	28.5	Very low	74 Å²	74	114 Å²	114	40%	0.396	60%	0.602	S	S	.	*	H	α-helix	trans	-64.3	-41.8	176.4	-71.4	2.7	0	0	0	111.7	T542 L546 S547	T542-N544 PolarHBondContact O-N 2.97Å; N544-L546 VanDerWaalsContact C-N 3.35Å; N544-L546 PolarHBondContact O-N 3.18Å; N544-S547 PolarHBondContact O-N 2.97Å; N544-S547 PolarHBondContact O-OG 3.48Å
545	D	34.4	Very low	28.6	Very low	27 Å²	27	116.8 Å²	116.8	14%	0.144	60%	0.604	C	S	.	*	H	α-helix	trans	-60.2	-45.8	178.5	-54.8	-70.6	0	0	0	110.7	Y135 L541 T542 Y549	Y135-D545 PolarHBondContact OH-OD1 2.91Å; L541-D545 HydrophobicContact CD2-CB 4.01Å; T542-D545 WeakPolarHBondContact CA-OD2 3.27Å; T542-D545 WeakPolarHBondContact CB-OD2 3.49Å; T542-D545 PolarHBondContact N-OD2 2.87Å; T542-D545 WeakPolarHBondContact O-CB 3.48Å; T542-D545 PolarHBondContact O-N 3.22Å; T542-D545 PolarHBondContact OG1-OD2 3.35Å; D545-Y549 WeakPolarHBondContact O-CD2 3.14Å
546	L	30.7	Very low	28.7	Very low	73 Å²	73	115.6 Å²	115.6	38%	0.382	60%	0.598	S	S	.	*	H	α-helix	trans	-68.7	-38.8	179.3	-67.4	170.5	0	0	0	113	T542 Y543 N544 I548 Y549 S550	T542-L546 PolarHBondContact O-N 2.95Å; Y543-L546 PolarHBondContact O-N 3.42Å; N544-L546 VanDerWaalsContact C-N 3.35Å; N544-L546 PolarHBondContact O-N 3.18Å; L546-I548 PolarHBondContact O-N 2.97Å; L546-Y549 PolarHBondContact O-N 3.45Å; L546-S550 PolarHBondContact O-N 2.81Å
547	S	31.2	Very low	28.7	Very low	42 Å²	42	114.8 Å²	114.8	29%	0.294	60%	0.603	S	S	.	*	H	α-helix	trans	-61.1	-26.6	-178.5	71	0	0	0	0	113.9	Y543 N544 Y549 S551	Y543-S547 WeakPolarHBondContact O-CB 3.45Å; Y543-S547 PolarHBondContact O-N 2.69Å; N544-S547 PolarHBondContact O-N 2.97Å; N544-S547 PolarHBondContact O-OG 3.48Å; S547-Y549 VanDerWaalsContact C-N 3.34Å; S547-S551 PolarHBondContact O-OG 2.9Å
548	I	33.5	Very low	28.9	Very low	73 Å²	73	114.3 Å²	114.3	37%	0.374	60%	0.6	S	S	.	*	H	α-helix	trans	-72.1	-29	176.9	-66.7	166.9	0	0	0	111.3	Y135 A137 L546	Y135-I548 HydrophobicContact CE2-CD1 3.68Å; A137-I548 HydrophobicContact CB-CD1 4.44Å; L546-I548 PolarHBondContact O-N 2.97Å
549	Y	30.3	Very low	29.1	Very low	156 Å²	156	112.8 Å²	112.8	61%	0.612	60%	0.604	S	S	*	*	H	α-helix	trans	-85	-36.7	179.9	-75	-77.6	0	0	0	113.6	F114 D545 L546 S547 S551	F114-Y549 WeakPolarHBondContact CE1-OH 3.23Å; D545-Y549 WeakPolarHBondContact O-CD2 3.14Å; L546-Y549 PolarHBondContact O-N 3.45Å; S547-Y549 VanDerWaalsContact C-N 3.34Å; Y549-S551 VanDerWaalsContact C-N 3.3Å; Y549-S551 PolarHBondContact O-N 2.68Å
550	S	28.7	Very low	29.3	Very low	98 Å²	98	112.3 Å²	112.3	69%	0.685	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	0.1	-178	68.5	0	0	0	0	115.2	L546 N552	L546-S550 PolarHBondContact O-N 2.81Å; S550-N552 VanDerWaalsContact C-N 3.31Å; S550-N552 PolarHBondContact O-N 2.87Å
551	S	29.1	Very low	29.5	Very low	73 Å²	73	110.7 Å²	110.7	51%	0.51	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.4	9.4	-176	-66.7	0	0	0	0	115	S547 Y549	S547-S551 PolarHBondContact O-OG 2.9Å; Y549-S551 VanDerWaalsContact C-N 3.3Å; Y549-S551 PolarHBondContact O-N 2.68Å
552	N	29.3	Very low	29.4	Very low	130 Å²	130	112.8 Å²	112.8	70%	0.695	62%	0.618	S	S	*	*	S	Bend	trans	-114.3	142.8	177.9	-71	-55.9	0	0	0	111.4	S550	S550-N552 VanDerWaalsContact C-N 3.31Å; S550-N552 PolarHBondContact O-N 2.87Å
553	V	26.8	Very low	29.5	Very low	135 Å²	135	115.1 Å²	115.1	82%	0.818	64%	0.637	S	S	*	*			trans	73.9	76.8	174	-162.8	0	0	0	0	116.3
554	T	25.5	Very low	29.3	Very low	150 Å²	150	114.4 Å²	114.4	92%	0.92	65%	0.648	S	S	*	*			trans	-135.5	70.7	148.2	38	0	0	0	0	110.1
555	V	27.6	Very low	29.1	Very low	127 Å²	127	118 Å²	118	77%	0.77	67%	0.668	S	S	*	*			trans	-83.2	129.3	172.7	-179.8	0	0	0	0	109	V557	V555-V557 PolarHBondContact O-N 3Å
556	N	26.9	Very low	28.8	Very low	122 Å²	122	124.4 Å²	124.4	65%	0.652	70%	0.696	S	S	*	*			trans	-66.4	118.8	-176.7	-175.6	10.6	0	0	0	111.4	N558	N556-N558 PolarHBondContact O-N 3.23Å; N556-N558 PolarHBondContact OD1-ND2 3.33Å
557	V	26.3	Very low	28.9	Very low	135 Å²	135	127.9 Å²	127.9	82%	0.818	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.3	85.7	-179.6	-176.3	0	0	0	0	109.5	V555	V555-V557 PolarHBondContact O-N 3Å
558	N	28	Very low	28.7	Very low	134 Å²	134	133.1 Å²	133.1	72%	0.717	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-148	-27.9	171.2	-86.9	-67.3	0	0	0	114.7	N556	N556-N558 PolarHBondContact O-N 3.23Å; N556-N558 PolarHBondContact OD1-ND2 3.33Å
559	D	28.9	Very low	28.4	Very low	144 Å²	144	138.1 Å²	138.1	77%	0.77	76%	0.764	S	S	*	*			trans	-103.8	99.1	-176	-66.9	-60.5	0	0	0	113.2
560	I	30.3	Very low	28.2	Very low	171 Å²	171	138.4 Å²	138.4	88%	0.877	78%	0.777	S	S	*	*	S	Bend	trans	166.1	144.9	132.8	-86.2	161.6	0	0	0	109.9
561	L	30.6	Very low	28.1	Very low	165 Å²	165	140.3 Å²	140.3	86%	0.864	78%	0.784	S	S	*	*			trans	-73.3	150	-164.2	-147.9	73.5	0	0	0	114.4
562	I	25.4	Very low	27.9	Very low	159 Å²	159	145 Å²	145	82%	0.815	80%	0.801	S	S	*	*			trans	-66.4	130.8	175.4	-61.8	161.6	0	0	0	110.5
563	S	29.4	Very low	27.8	Very low	122 Å²	122	147 Å²	147	85%	0.853	81%	0.807	S	S	*	*			trans	-135.7	127.3	150.3	-172	0	0	0	0	108.3
564	S	28	Very low	27.8	Very low	92 Å²	92	145.9 Å²	145.9	64%	0.643	79%	0.793	S	S	*	*			trans	-94.9	131.3	-175.1	52.5	0	0	0	0	111.3
565	D	30.5	Very low	27.7	Very low	150 Å²	150	143.7 Å²	143.7	80%	0.802	78%	0.775	S	S	*	*				-155	166	125.6	-129.8	-39.4	0	0	0	113.7
566	H	28.7	Very low	27.6	Very low	162 Å²	162	142.2 Å²	142.2	75%	0.75	77%	0.77	S	S	*	*			trans	-90.4	121	-164.1	-65.6	-99.3	0	0	0	114.3
567	T	32.8	Very low	27.5	Very low	146 Å²	146	140.9 Å²	140.9	90%	0.896	76%	0.763	S	S	*	*				174.4	134.6	115.7	31	0	0	0	0	110
568	N	27	Very low	27.5	Very low	151 Å²	151	141 Å²	141	81%	0.807	76%	0.758	S	S	*	*			trans	-143.5	122.3	-163.7	-177.5	-2.5	0	0	0	112.4
569	K	25.8	Very low	27.3	Very low	179 Å²	179	145.3 Å²	145.3	78%	0.778	77%	0.766	S	S	*	*			trans	169.9	151.8	146.8	-90.8	149.7	-168	178.5	0	110.7
570	N	27.2	Very low	27.1	Very low	162 Å²	162	146.4 Å²	146.4	87%	0.866	77%	0.772	S	S	*	*	S	Bend	trans	88.1	31	159.5	-53.3	-17.1	0	0	0	122.9
571	T	26.9	Very low	26.8	Very low	137 Å²	137	147.6 Å²	147.6	84%	0.84	77%	0.771	S	S	*	*			trans	-142.5	26.6	177.1	-15.5	0	0	0	0	120.1
572	I	25.2	Very low	26.4	Very low	171 Å²	171	148.9 Å²	148.9	88%	0.877	77%	0.77	S	S	*	*			trans	-122.8	80.3	-178.9	-49.4	179.7	0	0	0	112.5
573	Q	25.9	Very low	26.4	Very low	172 Å²	172	148.1 Å²	148.1	80%	0.804	77%	0.766	S	S	*	*			trans	-164.8	21.8	176.3	-126	-177.3	38.7	0	0	118.9	K71	K71-Q573 WeakPolarHBondContact CE-O 3.4Å; K71-Q573 PolarHBondContact NZ-O 3.32Å
574	Q	26	Very low	26.1	Very low	112 Å²	112	148.5 Å²	148.5	52%	0.523	76%	0.758	S	S	.	*			trans	-139	44.7	-164.8	-69.7	-88.9	-6.6	0	0	116.1	K71	K71-Q574 VanDerWaalsContact CE-CD 3.41Å; K71-Q574 VanDerWaalsContact NZ-CD 3.31Å
575	L	24.4	Very low	25.8	Very low	104 Å²	104	153.8 Å²	153.8	55%	0.545	77%	0.765	S	S	.	*			trans	-138.1	70.4	-176.8	-71.4	178.8	0	0	0	117.6	N69	N69-L575 HydrophobicContact CB-CD2 3.97Å; N69-L575 VanDerWaalsContact CG-C 3.45Å; N69-L575 VanDerWaalsContact ND2-CA 3.32Å; N69-L575 WeakPolarHBondContact ND2-CA 3.43Å; N69-L575 WeakPolarHBondContact ND2-CB 3.49Å; N69-L575 PolarHBondContact ND2-O 3.41Å
576	S	24.9	Very low	25.5	Very low	97 Å²	97	154.2 Å²	154.2	68%	0.678	76%	0.762	S	S	*	*			trans	-164.9	101.7	152.8	50	0	0	0	0	113.4	N69	N69-S576 VanDerWaalsContact CG-N 3.33Å; N69-S576 PolarHBondContact ND2-N 2.85Å; N69-S576 WeakPolarHBondContact OD1-CA 3.25Å
577	L	25.7	Very low	25.4	Very low	94 Å²	94	153.9 Å²	153.9	49%	0.492	77%	0.766	S	S	.	*			trans	176.4	152.6	162.2	-107.1	161.3	0	0	0	114.9	N69 R70	N69-L577 PolarHBondContact OD1-N 2.91Å; R70-L577 WeakPolarHBondContact O-CB 3.39Å
578	N	25.4	Very low	25	Very low	136 Å²	136	153.4 Å²	153.4	73%	0.727	76%	0.756	S	S	*	*			trans	69.7	93.8	170.9	-88.6	-9.6	0	0	0	119.3
579	Y	24.5	Very low	25.1	Very low	225 Å²	225	151.6 Å²	151.6	88%	0.882	75%	0.753	S	S	*	*			trans	-163.4	130.1	132.4	-117.7	-75.5	0	0	0	111.4
580	N	24.5	Very low	25	Very low	168 Å²	168	149.8 Å²	149.8	90%	0.898	75%	0.745	S	S	*	*			trans	-173	127.7	156.9	-111.2	-20.7	0	0	0	110.5
581	K	24	Very low	24.9	Very low	196 Å²	196	153.5 Å²	153.5	85%	0.852	75%	0.749	S	S	*	*			trans	-163.2	104	176.2	-146.8	176.6	-172.8	-179.5	0	115.2
582	K	23.2	Very low	24.7	Very low	191 Å²	191	156 Å²	156	83%	0.83	74%	0.744	S	S	*	*			trans	72.1	163.2	149.6	-139.6	-178.7	-175.8	-175.8	0	119
583	I	24.7	Very low	24.6	Very low	143 Å²	143	155.5 Å²	155.5	73%	0.733	74%	0.738	S	S	*	*			trans	82.4	135.8	162.5	-64.6	161.7	0	0	0	116.5
584	L	22	Very low	24.6	Very low	131 Å²	131	157 Å²	157	69%	0.686	74%	0.738	S	S	*	*			cis	-161.1	140.9	-24.6	-91.9	178.5	0	0	0	109.4
585	Y	22.8	Very low	24.7	Very low	202 Å²	202	160.2 Å²	160.2	79%	0.792	75%	0.75	S	S	*	*			trans	64.2	159.9	141.2	-83.7	-116.7	0	0	0	124.8
586	E	23.8	Very low	24.7	Very low	159 Å²	159	158.1 Å²	158.1	74%	0.743	75%	0.754	S	S	*	*			trans	68.3	94.9	156.5	-77.3	167.6	-146.9	0	0	121.1
587	N	25.9	Very low	25.1	Very low	156 Å²	156	159.1 Å²	159.1	83%	0.834	76%	0.761	S	S	*	*				176.7	157.6	97.2	-91.8	-66.9	0	0	0	114.5
588	I	24.5	Very low	25.3	Very low	135 Å²	135	161.9 Å²	161.9	69%	0.692	78%	0.777	S	S	*	*			trans	-118.7	141.7	-169.5	-75.2	170.4	0	0	0	107.6	F590	I588-F590 HydrophobicContact CG2-CD2 4.12Å; I588-F590 HydrophobicContact CG2-CE2 3.66Å; I588-F590 HydrophobicContact CG2-CZ 4.07Å
589	P	28.9	Very low	25.5	Very low	114 Å²	114	164.3 Å²	164.3	74%	0.74	78%	0.783	S	S	*	*				-153.1	149.7	75.6	37	-13.9	0	0	0	121.4
590	F	23.8	Very low	26.1	Very low	140 Å²	140	163.3 Å²	163.3	61%	0.614	80%	0.804	S	S	*	*			trans	12.4	139.1	145	-50	-71.2	0	0	0	123.3	I588 Y592	I588-F590 HydrophobicContact CG2-CD2 4.12Å; I588-F590 HydrophobicContact CG2-CE2 3.66Å; I588-F590 HydrophobicContact CG2-CZ 4.07Å; F590-Y592 AromaticContact CD1-CD2 3.9Å; F590-Y592 HydrophobicContact CD1-CD2 3.9Å; F590-Y592 AromaticContact CD1-CE2 3.69Å; F590-Y592 HydrophobicContact CD1-CE2 3.69Å; F590-Y592 AromaticContact CE1-CE2 3.93Å; F590-Y592 HydrophobicContact CE1-CE2 3.93Å
591	Y	24.8	Very low	26.2	Very low	240 Å²	240	163.1 Å²	163.1	94%	0.941	80%	0.8	S	S	*	*				-130.3	123.6	127.8	-89.3	-90.9	0	0	0	109.3
592	Y	24.2	Very low	26.3	Very low	190 Å²	190	161.3 Å²	161.3	75%	0.745	80%	0.797	S	S	*	*			trans	-103.5	148.9	168.1	-92.7	-84.7	0	0	0	109.3	F590	F590-Y592 AromaticContact CD1-CD2 3.9Å; F590-Y592 HydrophobicContact CD1-CD2 3.9Å; F590-Y592 AromaticContact CD1-CE2 3.69Å; F590-Y592 HydrophobicContact CD1-CE2 3.69Å; F590-Y592 AromaticContact CE1-CE2 3.93Å; F590-Y592 HydrophobicContact CE1-CE2 3.93Å
593	Q	23.6	Very low	26.5	Very low	160 Å²	160	159.7 Å²	159.7	75%	0.748	80%	0.795	S	S	*	*			trans	-124.6	107.6	158.8	-169.5	166.9	1.8	0	0	109.2	F595	Q593-F595 HydrophobicContact CG-CD2 4.32Å; Q593-F595 HydrophobicContact CG-CE2 3.83Å
594	Y	24.4	Very low	26.6	Very low	205 Å²	205	160.6 Å²	160.6	80%	0.804	80%	0.799	S	S	*	*			trans	-94.5	123.5	-175.2	-157.8	-90	0	0	0	109.4
595	F	28.4	Very low	26.8	Very low	178 Å²	178	162.5 Å²	162.5	78%	0.781	81%	0.806	S	S	*	*			trans	-116	106.3	167.6	-77.6	-77.9	0	0	0	108.1	Q593	Q593-F595 HydrophobicContact CG-CD2 4.32Å; Q593-F595 HydrophobicContact CG-CE2 3.83Å
596	G	23.7	Very low	27.1	Very low	60 Å²	60	159.9 Å²	159.9	62%	0.619	81%	0.807	S	S	*	*			trans	-93.7	150.6	-178.9	0	0	0	0	0	113
597	S	33.2	Very low	27.3	Very low	119 Å²	119	159.9 Å²	159.9	83%	0.832	81%	0.811	S	S	*	*			trans	-136.4	132	160.6	54.6	0	0	0	0	107.5
598	N	30.2	Very low	27.5	Very low	152 Å²	152	160.2 Å²	160.2	81%	0.813	81%	0.809	S	S	*	*			trans	-86.9	-179.7	-167.1	-61.2	-29.3	0	0	0	113.3
599	E	29.7	Very low	27.7	Very low	186 Å²	186	162.3 Å²	162.3	87%	0.869	82%	0.819	S	S	*	*			trans	86.7	127.6	162.1	-55.3	179.9	-173.1	0	0	117.5
600	P	37.6	Very low	27.6	Very low	204 Å²	204	166.7 Å²	166.7	100%	1.325	83%	0.826	S	S	*	*			cis	-121.5	0	-32.5	37.9	-26.1	0	0	0	114.1

Retrieved 600 of 600 residues in 124.9 ms (Link to these results)

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