A0A5K4FDY0_SCHMA Loading...

CUB domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FDY0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 502 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	35.5	Very low	32.2	Very low	238 Å²	238	147.3 Å²	147.3	100%	1.172	80%	0.797	S	S	*	*				0	91.2	0	-82.7	176	164.2	0	0	107.5	M3	M1-M3 PolarHBondContact O-N 3.11Å
2	N	32.7	Very low	32.2	Very low	163 Å²	163	145.8 Å²	145.8	87%	0.872	79%	0.788	S	S	*	*			trans	-91.9	100.9	176.4	-80.1	-7.2	0	0	0	107.9	V4	N2-V4 PolarHBondContact O-N 3.45Å; N2-V4 VanDerWaalsContact O-N 3.11Å
3	M	31.2	Very low	32	Very low	170 Å²	170	148.5 Å²	148.5	84%	0.837	79%	0.792	S	S	*	*			trans	-67.6	101.9	170.8	-131.2	178.9	-169.9	0	0	107	M1 Y5	M1-M3 PolarHBondContact O-N 3.11Å; M3-Y5 PolarHBondContact O-N 2.92Å
4	V	34.5	Very low	31.7	Very low	122 Å²	122	153.3 Å²	153.3	74%	0.739	80%	0.796	S	S	*	*			trans	-72	108.1	170.5	178.2	0	0	0	0	106.2	N2 S6	N2-V4 PolarHBondContact O-N 3.45Å; N2-V4 VanDerWaalsContact O-N 3.11Å; V4-S6 VanDerWaalsContact C-N 3.3Å; V4-S6 PolarHBondContact O-N 3.2Å
5	Y	31.6	Very low	31.6	Very low	210 Å²	210	149.7 Å²	149.7	82%	0.824	79%	0.789	S	S	*	*			trans	-64.2	94.4	167.5	-84.5	-92.9	0	0	0	107.9	M3 I7	M3-Y5 PolarHBondContact O-N 2.92Å; Y5-I7 PolarHBondContact O-N 2.91Å; Y5-I7 VanDerWaalsContact O-N 3.07Å
6	S	31.9	Very low	31.9	Very low	99 Å²	99	144.4 Å²	144.4	69%	0.692	77%	0.768	S	S	*	*			trans	-67.7	100.9	160.1	-70.4	0	0	0	0	106.9	V4 V8	V4-S6 VanDerWaalsContact C-N 3.3Å; V4-S6 PolarHBondContact O-N 3.2Å; S6-V8 VanDerWaalsContact C-N 3.28Å; S6-V8 PolarHBondContact O-N 3.07Å
7	I	32.9	Very low	32.3	Very low	143 Å²	143	142.1 Å²	142.1	73%	0.733	76%	0.763	S	S	*	*			trans	-62.1	100.4	163.9	-60.8	172.9	0	0	0	105.2	Y5 V9	Y5-I7 PolarHBondContact O-N 2.91Å; Y5-I7 VanDerWaalsContact O-N 3.07Å; I7-V9 HydrophobicContact CG2-CG2 3.97Å; I7-V9 PolarHBondContact O-N 3.29Å
8	V	29.5	Very low	32.6	Very low	129 Å²	129	141.8 Å²	141.8	78%	0.782	76%	0.761	S	S	*	*			trans	-65.9	92.6	165	179.1	0	0	0	0	104.9	S6 D10	S6-V8 VanDerWaalsContact C-N 3.28Å; S6-V8 PolarHBondContact O-N 3.07Å; V8-D10 PolarHBondContact O-N 3.47Å; V8-D10 VanDerWaalsContact O-N 3.07Å
9	V	32.5	Very low	33.2	Very low	117 Å²	117	136.3 Å²	136.3	71%	0.709	73%	0.731	S	S	*	*			trans	-67.5	105.6	167.7	-179.8	0	0	0	0	105.3	I7 S11	I7-V9 HydrophobicContact CG2-CG2 3.97Å; I7-V9 PolarHBondContact O-N 3.29Å; V9-S11 PolarHBondContact O-N 3.25Å; V9-S11 VanDerWaalsContact O-N 3.14Å
10	D	27.9	Very low	34	Very low	122 Å²	122	133.1 Å²	133.1	65%	0.652	71%	0.713	S	S	*	*			trans	-51.8	113.8	178	-154.8	-14.7	0	0	0	109.4	V8 N12	V8-D10 PolarHBondContact O-N 3.47Å; V8-D10 VanDerWaalsContact O-N 3.07Å; D10-N12 PolarHBondContact O-N 3.18Å
11	S	33.8	Very low	35.1	Very low	107 Å²	107	128 Å²	128	75%	0.748	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	18.4	-170.5	-46.4	0	0	0	0	114.5	V9	V9-S11 PolarHBondContact O-N 3.25Å; V9-S11 VanDerWaalsContact O-N 3.14Å
12	N	32	Very low	36.5	Very low	130 Å²	130	117.7 Å²	117.7	70%	0.695	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.5	10.4	-169.6	-77.3	-32.2	0	0	0	115.4	D10	D10-N12 PolarHBondContact O-N 3.18Å
13	H	30.5	Very low	38	Very low	180 Å²	180	114.4 Å²	114.4	83%	0.833	63%	0.628	S	S	*	*			trans	-114.8	66.5	167.4	-74.6	4.7	0	0	0	110.3	S15	H13-S15 PolarHBondContact O-N 3.41Å
14	Y	27.2	Very low	39.7	Very low	216 Å²	216	107 Å²	107	85%	0.847	60%	0.596	S	S	*	*			trans	-67.4	82.2	159.1	-145.4	-88.8	0	0	0	107.2	S16	Y14-S16 PolarHBondContact O-N 2.83Å
15	S	30.5	Very low	41.4	Very low	99 Å²	99	101.5 Å²	101.5	69%	0.692	56%	0.562	S	S	*	*			trans	-60.7	108.3	166.4	46.5	0	0	0	0	106.3	H13	H13-S15 PolarHBondContact O-N 3.41Å
16	S	35.8	Very low	42.7	Very low	65 Å²	65	92.7 Å²	92.7	46%	0.455	53%	0.527	S	S	.	.			trans	-45.1	136.9	170.9	59.8	0	0	0	0	108.2	Y14 N18	Y14-S16 PolarHBondContact O-N 2.83Å; S16-N18 PolarHBondContact O-N 3.37Å
17	P	38.8	Very low	43.9	Very low	105 Å²	105	88 Å²	88	68%	0.682	49%	0.494	S	S	*	.			trans	-48	120.3	-177.6	19.2	-31	0	0	0	108.2	M19	P17-M19 VanDerWaalsContact C-N 3.29Å; P17-M19 PolarHBondContact O-N 3.21Å
18	N	37.7	Very low	44.8	Very low	138 Å²	138	82 Å²	82	74%	0.738	47%	0.466	S	S	*	.			trans	-53.4	101.3	177.3	-81.5	-27	0	0	0	106.7	S16 L20	S16-N18 PolarHBondContact O-N 3.37Å; N18-L20 PolarHBondContact O-N 2.65Å
19	M	44.3	Very low	46	Very low	36 Å²	36	81.4 Å²	81.4	18%	0.177	45%	0.453	C	S	.	.			trans	-65.8	110.7	179	-76.5	163.9	44.8	0	0	106.3	P17 C21 L32 P54 C56	P17-M19 VanDerWaalsContact C-N 3.29Å; P17-M19 PolarHBondContact O-N 3.21Å; M19-C21 PolarHBondContact O-N 3.46Å; M19-L32 HydrophobicContact CB-CD1 4.35Å; M19-L32 HydrophobicContact CB-CD2 4.19Å; M19-L32 HydrophobicContact CE-CD2 4.13Å; M19-L32 HydrophobicContact CG-CD2 4.47Å; M19-L32 HydrophobicContact SD-CD2 3.84Å; M19-P54 HydrophobicContact CE-CB 4.2Å; M19-P54 HydrophobicContact CE-CG 4.48Å; M19-P54 WeakPolarHBondContact CE-O 3.14Å; M19-P54 HydrophobicContact SD-CB 4.38Å; M19-P54 HydrophobicContact SD-CG 4.06Å; M19-C56 HydrophobicContact CB-CB 4.48Å; M19-C56 HydrophobicContact CE-CB 3.24Å
20	L	48.3	Very low	46.8	Very low	72 Å²	72	77.2 Å²	77.2	38%	0.377	43%	0.427	S	S	.	.			trans	-67.4	83.8	169.8	-74.2	162.1	0	0	0	107	N18 P22 M462	N18-L20 PolarHBondContact O-N 2.65Å; L20-P22 WeakPolarHBondContact O-CD 3.47Å; L20-P22 VanDerWaalsContact O-N 3.15Å; L20-M462 HydrophobicContact CB-SD 4.25Å; L20-M462 HydrophobicContact CD1-CG 4.02Å; L20-M462 HydrophobicContact CD1-SD 3.85Å
21	C	58.7	Low	47.7	Very low	28 Å²	28	73.6 Å²	73.6	19%	0.189	41%	0.408	C	S	.	.			trans	-60.4	114.9	163	-79.9	0	0	0	0	107.1	M19 S23 A28 C56	M19-C21 PolarHBondContact O-N 3.46Å; C21-S23 PolarHBondContact O-N 3.38Å; C21-S23 VanDerWaalsContact O-N 3.08Å; C21-A28 HydrophobicContact CB-CB 4.23Å; C21-A28 WeakPolarHBondContact CB-O 3.04Å; C21-A28 PolarHBondContact SG-O 3.23Å; C21-C56 WeakPolarHBondContact CA-SG 3.44Å; C21-C56 HydrophobicContact CB-CB 4.2Å; C21-C56 WeakPolarHBondContact CB-SG 3.43Å; C21-C56 WeakPolarHBondContact SG-CB 3.26Å; C21-C56 CovalentContact SG-SG 2.02Å; C21-C56 PolarHBondContact SG-SG 2.88Å
22	P	63.5	Low	48.3	Very low	20 Å²	20	71.4 Å²	71.4	13%	0.13	39%	0.388	C	S	.	.			trans	-60.2	122.9	173	24.7	-30.7	0	0	0	107.6	L20 Y25 F58 V168	L20-P22 WeakPolarHBondContact O-CD 3.47Å; L20-P22 VanDerWaalsContact O-N 3.15Å; P22-Y25 HydrophobicContact CB-CD2 4.14Å; P22-Y25 HydrophobicContact CB-CE2 3.86Å; P22-Y25 HydrophobicContact CG-CD2 3.86Å; P22-Y25 HydrophobicContact CG-CE2 3.76Å; P22-Y25 WeakPolarHBondContact O-CD2 2.86Å; P22-F58 HydrophobicContact CB-CE2 3.85Å; P22-F58 HydrophobicContact CB-CZ 3.88Å; P22-F58 HydrophobicContact CG-CE2 4.05Å; P22-F58 HydrophobicContact CG-CZ 4.21Å; P22-V168 HydrophobicContact CG-CB 4.42Å; P22-V168 HydrophobicContact CG-CG1 3.65Å; P22-V168 HydrophobicContact CG-CG2 3.81Å
23	S	64	Low	48.8	Very low	94 Å²	94	71.1 Å²	71.1	66%	0.657	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	146.6	-179.7	-61.1	0	0	0	0	110.6	C21	C21-S23 PolarHBondContact O-N 3.38Å; C21-S23 VanDerWaalsContact O-N 3.08Å
24	G	67	Low	49.3	Very low	15 Å²	15	65 Å²	65	16%	0.155	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	99.3	0.3	172.8	0	0	0	0	0	114.8	R278 E279	G24-R278 CarbonylContact O-C 3.47Å; G24-R278 WeakPolarHBondContact O-CA 3.38Å; G24-R278 WeakPolarHBondContact O-CB 3.41Å; G24-R278 VanDerWaalsContact O-O 3.06Å; G24-E279 VanDerWaalsContact O-CA 3.28Å; G24-E279 WeakPolarHBondContact O-CA 3.47Å; G24-E279 WeakPolarHBondContact O-CG 3.44Å; G24-E279 PolarHBondContact O-N 3.47Å
25	Y	71.3	Confident	49.6	Very low	7 Å²	7	56 Å²	56	3%	0.027	35%	0.349	C	S	.	.			trans	-92.4	140.4	167.7	-62.4	-93.4	0	0	0	109.7	P22 P27 A28 D166 V168 I170 F179 Y181 R278	P22-Y25 HydrophobicContact CB-CD2 4.14Å; P22-Y25 HydrophobicContact CB-CE2 3.86Å; P22-Y25 HydrophobicContact CG-CD2 3.86Å; P22-Y25 HydrophobicContact CG-CE2 3.76Å; P22-Y25 WeakPolarHBondContact O-CD2 2.86Å; Y25-P27 VanDerWaalsContact C-CD 3.45Å; Y25-A28 WeakPolarHBondContact O-CB 3.44Å; Y25-A28 PolarHBondContact O-N 2.92Å; Y25-D166 VanDerWaalsContact OH-CB 3.29Å; Y25-D166 WeakPolarHBondContact OH-CB 3.45Å; Y25-V168 HydrophobicContact CD2-CG1 4.37Å; Y25-V168 HydrophobicContact CD2-CG2 4.42Å; Y25-V168 HydrophobicContact CE1-CB 4.17Å; Y25-V168 HydrophobicContact CE1-CG2 4.04Å; Y25-V168 HydrophobicContact CE2-CB 4.36Å; Y25-V168 HydrophobicContact CE2-CG1 4.45Å; Y25-V168 HydrophobicContact CE2-CG2 3.71Å; Y25-V168 HydrophobicContact CG-CG1 4.49Å; Y25-V168 VanDerWaalsContact CZ-CG2 3.47Å; Y25-V168 WeakPolarHBondContact OH-CG2 3.28Å; Y25-I170 HydrophobicContact CG-CD1 4.46Å; Y25-F179 HydrophobicContact CD1-CB 3.64Å; Y25-F179 HydrophobicContact CD1-CD1 4.07Å; Y25-F179 HydrophobicContact CD1-CD2 4.27Å; Y25-F179 AromaticContact CD1-CG 3.71Å; Y25-F179 HydrophobicContact CD1-CG 3.71Å; Y25-F179 HydrophobicContact CE1-CB 3.63Å; Y25-F179 HydrophobicContact CE1-CG 4.23Å; Y25-Y181 AromaticContact CE1-CD2 3.91Å; Y25-Y181 HydrophobicContact CE1-CD2 3.91Å; Y25-Y181 HydrophobicContact CE1-CE2 4.4Å; Y25-Y181 HydrophobicContact CE1-CG 4.34Å; Y25-R278 WeakPolarHBondContact CA-O 3.35Å; Y25-R278 HydrophobicContact CD1-CB 4.17Å; Y25-R278 HydrophobicContact CD1-CG 4.32Å; Y25-R278 HydrophobicContact CE1-CB 4.34Å; Y25-R278 HydrophobicContact CE1-CG 3.98Å; Y25-R278 VanDerWaalsContact OH-CZ 3.3Å; Y25-R278 PolarHBondContact OH-NH1 3.2Å; Y25-R278 VanDerWaalsContact OH-NH1 3.1Å
26	W	59.7	Low	49.5	Very low	24 Å²	24	59.9 Å²	59.9	9%	0.091	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-61.6	-32.8	-173.9	71.6	-100.6	0	0	0	115.1	A28 R41 Y177 F179 E214 Y239 R278 L281 P282 F294	W26-A28 VanDerWaalsContact C-N 3.27Å; W26-A28 PolarHBondContact O-N 3.38Å; W26-R41 PolarHBondContact O-NH2 2.76Å; W26-Y177 HydrophobicContact CH2-CD1 4.41Å; W26-Y177 HydrophobicContact CH2-CE1 4.3Å; W26-Y177 HydrophobicContact CH2-CE2 4.48Å; W26-Y177 HydrophobicContact CZ2-CD1 4.32Å; W26-F179 AromaticContact CD1-CE1 3.82Å; W26-F179 AromaticContact CE2-CE1 3.97Å; W26-F179 AromaticContact CE2-CZ 3.98Å; W26-F179 HydrophobicContact CZ2-CE1 4.46Å; W26-F179 HydrophobicContact CZ2-CZ 4.17Å; W26-F179 AromaticContact NE1-CE1 3.31Å; W26-F179 VanDerWaalsContact NE1-CE1 3.31Å; W26-F179 AromaticContact NE1-CZ 3.8Å; W26-E214 PolarHBondContact NE1-OE1 2.93Å; W26-Y239 HydrophobicContact CH2-CE1 4.38Å; W26-Y239 AromaticContact CZ2-CE1 3.77Å; W26-Y239 HydrophobicContact CZ2-CE1 3.77Å; W26-Y239 AromaticContact CZ2-CZ 3.7Å; W26-Y239 WeakPolarHBondContact CZ2-OH 3.33Å; W26-R278 PolarHBondContact N-O 3.49Å; W26-R278 VanDerWaalsContact N-O 3.1Å; W26-L281 HydrophobicContact CB-CD2 3.76Å; W26-L281 HydrophobicContact CB-CG 4.36Å; W26-L281 HydrophobicContact CD2-CD2 4.04Å; W26-L281 HydrophobicContact CE3-CD2 3.77Å; W26-L281 HydrophobicContact CG-CD2 4.06Å; W26-P282 HydrophobicContact CZ2-CG 3.98Å; W26-F294 HydrophobicContact CH2-CD1 4.18Å; W26-F294 HydrophobicContact CZ3-CB 4.37Å
27	P	55.5	Low	49.3	Very low	1 Å²	1	66.3 Å²	66.3	1%	0.006	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-84.4	3.8	173.1	14.6	1.6	0	0	0	113.1	Y25 K29 L45 I170 F179	Y25-P27 VanDerWaalsContact C-CD 3.45Å; P27-K29 VanDerWaalsContact C-N 3.26Å; P27-K29 PolarHBondContact O-N 3.07Å; P27-K29 VanDerWaalsContact O-N 3.13Å; P27-L45 HydrophobicContact CB-CD1 4.43Å; P27-I170 HydrophobicContact CB-CB 4.09Å; P27-I170 HydrophobicContact CB-CD1 4.15Å; P27-I170 HydrophobicContact CB-CG2 3.73Å; P27-I170 HydrophobicContact CG-CB 4.07Å; P27-I170 HydrophobicContact CG-CD1 3.74Å; P27-I170 HydrophobicContact CG-CG1 4.42Å; P27-I170 HydrophobicContact CG-CG2 4.27Å; P27-F179 HydrophobicContact CG-CE1 4.13Å; P27-F179 HydrophobicContact CG-CE2 3.51Å; P27-F179 HydrophobicContact CG-CZ 3.16Å
28	A	53.1	Low	48.8	Very low	16 Å²	16	71.6 Å²	71.6	13%	0.132	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-66.2	-17.3	-171.9	0	0	0	0	0	115.3	C21 Y25 W26 V30 I170	C21-A28 HydrophobicContact CB-CB 4.23Å; C21-A28 WeakPolarHBondContact CB-O 3.04Å; C21-A28 PolarHBondContact SG-O 3.23Å; Y25-A28 WeakPolarHBondContact O-CB 3.44Å; Y25-A28 PolarHBondContact O-N 2.92Å; W26-A28 VanDerWaalsContact C-N 3.27Å; W26-A28 PolarHBondContact O-N 3.38Å; A28-V30 VanDerWaalsContact C-N 3.29Å; A28-V30 PolarHBondContact O-N 2.91Å; A28-I170 HydrophobicContact CB-CD1 4.36Å
29	K	53.5	Low	48.7	Very low	118 Å²	118	67.4 Å²	67.4	51%	0.513	37%	0.369	S	S	.	.			trans	-78.8	86	168.6	-50	178.5	-176.1	173.6	0	108.2	P27 T39 D40 R41	P27-K29 VanDerWaalsContact C-N 3.26Å; P27-K29 PolarHBondContact O-N 3.07Å; P27-K29 VanDerWaalsContact O-N 3.13Å; K29-T39 HydrophobicContact CD-CG2 4.46Å; K29-D40 IonicContact NZ-OD1 3.7Å; K29-D40 PolarHBondContact NZ-OD1 2.74Å; K29-R41 PolarHBondContact O-NH1 3Å
30	V	49.4	Very low	48.3	Very low	29 Å²	29	72.7 Å²	72.7	18%	0.176	40%	0.398	C	S	.	.			trans	-95.4	126.6	172.4	-176.9	0	0	0	0	108.1	A28 L32 L45 P54 C56 I170	A28-V30 VanDerWaalsContact C-N 3.29Å; A28-V30 PolarHBondContact O-N 2.91Å; V30-L32 HydrophobicContact CG1-CD2 4.24Å; V30-L32 PolarHBondContact O-N 3.47Å; V30-L45 HydrophobicContact CG2-CD1 4.14Å; V30-P54 HydrophobicContact CG1-CB 4.31Å; V30-C56 HydrophobicContact CG2-CB 4.09Å; V30-I170 HydrophobicContact CG2-CG2 3.84Å
31	N	48.2	Very low	47.9	Very low	46 Å²	46	72.9 Å²	72.9	25%	0.246	39%	0.393	C	S	.	.			trans	-76.2	91.7	176.5	-171	-5.6	0	0	0	109.7	T33 G34 G35 E44	N31-T33 VanDerWaalsContact C-N 3.26Å; N31-T33 PolarHBondContact O-N 2.92Å; N31-T33 PolarHBondContact OD1-N 2.76Å; N31-G34 PolarHBondContact OD1-N 2.97Å; N31-G35 PolarHBondContact ND2-N 2.79Å; N31-G35 VanDerWaalsContact ND2-N 3.17Å; N31-G35 PolarHBondContact ND2-O 2.75Å; N31-G35 PolarHBondContact OD1-N 3.49Å; N31-E44 PolarHBondContact ND2-OE1 2.84Å
32	L	46.2	Very low	47	Very low	61 Å²	61	76.8 Å²	76.8	32%	0.319	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-19.6	-179.3	-64.4	174.1	0	0	0	113.2	M19 V30 P54	M19-L32 HydrophobicContact CB-CD1 4.35Å; M19-L32 HydrophobicContact CB-CD2 4.19Å; M19-L32 HydrophobicContact CE-CD2 4.13Å; M19-L32 HydrophobicContact CG-CD2 4.47Å; M19-L32 HydrophobicContact SD-CD2 3.84Å; V30-L32 HydrophobicContact CG1-CD2 4.24Å; V30-L32 PolarHBondContact O-N 3.47Å; L32-P54 HydrophobicContact CD2-CG 4.47Å
33	T	42.7	Very low	45.8	Very low	124 Å²	124	81.8 Å²	81.8	76%	0.761	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.6	0	-174.4	48.6	0	0	0	0	114.1	N31 G35	N31-T33 VanDerWaalsContact C-N 3.26Å; N31-T33 PolarHBondContact O-N 2.92Å; N31-T33 PolarHBondContact OD1-N 2.76Å; T33-G35 PolarHBondContact O-N 2.75Å
34	G	39.2	Very low	44.6	Very low	51 Å²	51	82.2 Å²	82.2	53%	0.526	43%	0.428	S	S	.	.			trans	60.2	23.2	-176.1	0	0	0	0	0	114	N31	N31-G34 PolarHBondContact OD1-N 2.97Å
35	G	35	Very low	43.5	Very low	28 Å²	28	84.1 Å²	84.1	29%	0.289	43%	0.434	S	S	.	.			trans	-100.8	149.1	-175.8	0	0	0	0	0	114.3	N31 T33 Y37	N31-G35 PolarHBondContact ND2-N 2.79Å; N31-G35 VanDerWaalsContact ND2-N 3.17Å; N31-G35 PolarHBondContact ND2-O 2.75Å; N31-G35 PolarHBondContact OD1-N 3.49Å; T33-G35 PolarHBondContact O-N 2.75Å; G35-Y37 PolarHBondContact O-N 3.3Å
36	L	28.6	Very low	42.1	Very low	179 Å²	179	87.3 Å²	87.3	94%	0.937	46%	0.456	S	S	*	.			trans	-70.2	86.2	175.4	-79.8	132.9	0	0	0	111.9
37	Y	31.1	Very low	41.1	Very low	200 Å²	200	93.4 Å²	93.4	78%	0.784	48%	0.48	S	S	*	.			trans	-93.1	132.3	154.8	-88.1	-80.9	0	0	0	110.1	G35 T39	G35-Y37 PolarHBondContact O-N 3.3Å; Y37-T39 PolarHBondContact O-N 2.78Å
38	K	27.1	Very low	40.5	Very low	216 Å²	216	98.9 Å²	98.9	94%	0.939	51%	0.508	S	S	*	.			trans	-58.1	97.9	170.2	-69.7	-179.3	177.5	-179.6	0	108.9
39	T	35.5	Very low	40	Very low	50 Å²	50	102.9 Å²	102.9	31%	0.307	54%	0.535	S	S	.	.			trans	-96.5	155.1	159.9	67.4	0	0	0	0	107.4	K29 Y37 R41	K29-T39 HydrophobicContact CD-CG2 4.46Å; Y37-T39 PolarHBondContact O-N 2.78Å; T39-R41 PolarHBondContact O-N 3.29Å; T39-R41 WeakPolarHBondContact OG1-CB 3.48Å; T39-R41 WeakPolarHBondContact OG1-CG 3.46Å; T39-R41 PolarHBondContact OG1-N 2.95Å
40	D	35.8	Very low	39.7	Very low	147 Å²	147	104.5 Å²	104.5	79%	0.786	55%	0.55	S	S	*	.	S	Bend	trans	-60.6	17.3	163.5	39	-19.3	0	0	0	113.2	K29	K29-D40 IonicContact NZ-OD1 3.7Å; K29-D40 PolarHBondContact NZ-OD1 2.74Å
41	R	41.6	Very low	39.6	Very low	77 Å²	77	104.3 Å²	104.3	29%	0.291	55%	0.551	S	S	.	*			trans	-117	131.3	-173.4	-46.2	170.6	170.8	-165.1	-8.1	109.8	W26 K29 T39	W26-R41 PolarHBondContact O-NH2 2.76Å; K29-R41 PolarHBondContact O-NH1 3Å; T39-R41 PolarHBondContact O-N 3.29Å; T39-R41 WeakPolarHBondContact OG1-CB 3.48Å; T39-R41 WeakPolarHBondContact OG1-CG 3.46Å; T39-R41 PolarHBondContact OG1-N 2.95Å
42	T	39.5	Very low	40.1	Very low	109 Å²	109	107.6 Å²	107.6	67%	0.669	56%	0.564	S	S	*	*	S	Bend	trans	-81	-16.4	168.4	40.1	0	0	0	0	113
43	F	37	Very low	41	Very low	126 Å²	126	109.5 Å²	109.5	55%	0.553	58%	0.577	S	S	*	*			trans	-126.4	115.7	177.8	-72.5	-86.8	0	0	0	111.1
44	E	39	Very low	42.1	Very low	103 Å²	103	105.2 Å²	105.2	48%	0.481	55%	0.552	S	S	.	*			trans	-65.2	148.6	160.3	-60.2	-176	137	0	0	108.4	N31 P46	N31-E44 PolarHBondContact ND2-OE1 2.84Å; E44-P46 WeakPolarHBondContact O-CD 3.39Å
45	L	44.2	Very low	43.6	Very low	54 Å²	54	103.2 Å²	103.2	28%	0.283	53%	0.529	S	S	.	.			trans	-54.8	113.9	157.2	-81.9	157.8	0	0	0	105.4	P27 V30 Y47 I170 Y177	P27-L45 HydrophobicContact CB-CD1 4.43Å; V30-L45 HydrophobicContact CG2-CD1 4.14Å; L45-Y47 PolarHBondContact O-N 3.37Å; L45-I170 HydrophobicContact CD1-CG2 4.42Å; L45-Y177 HydrophobicContact CD2-CE2 4.1Å
46	P	41.4	Very low	45.6	Very low	74 Å²	74	101.9 Å²	101.9	48%	0.481	52%	0.515	S	S	.	.			trans	-63.8	110.7	-168.1	21.5	-30.5	0	0	0	109.5	E44 L48	E44-P46 WeakPolarHBondContact O-CD 3.39Å; P46-L48 PolarHBondContact O-N 3.02Å
47	Y	40.4	Very low	48	Very low	152 Å²	152	95.6 Å²	95.6	60%	0.596	48%	0.481	S	S	*	.			trans	-69.9	90.7	158.4	-179.8	-100.6	0	0	0	106.5	L45 S49	L45-Y47 PolarHBondContact O-N 3.37Å; Y47-S49 PolarHBondContact O-N 3.14Å
48	L	41.7	Very low	50.5	Low	116 Å²	116	86.2 Å²	86.2	61%	0.607	44%	0.444	S	S	*	.			trans	-67	133.7	163.2	-64.8	142.8	0	0	0	105.8	P46 N50 A51	P46-L48 PolarHBondContact O-N 3.02Å; L48-N50 PolarHBondContact O-N 3.38Å; L48-A51 HydrophobicContact CB-CB 3.94Å; L48-A51 WeakPolarHBondContact O-CA 3.14Å; L48-A51 WeakPolarHBondContact O-CB 3.49Å; L48-A51 PolarHBondContact O-N 2.88Å
49	S	42.3	Very low	53.4	Low	100 Å²	100	76 Å²	76	70%	0.699	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-15.9	175.6	55.6	0	0	0	0	113.5	Y47	Y47-S49 PolarHBondContact O-N 3.14Å
50	N	47.5	Very low	55.5	Low	152 Å²	152	75.6 Å²	75.6	81%	0.813	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	2.7	173.8	-58.5	-5.8	0	0	0	112.6	L48	L48-N50 PolarHBondContact O-N 3.38Å
51	A	48.6	Very low	57.7	Low	26 Å²	26	71.1 Å²	71.1	22%	0.215	37%	0.374	C	S	.	.			trans	-71.4	131.7	-179.4	0	0	0	0	0	110.1	L48	L48-A51 HydrophobicContact CB-CB 3.94Å; L48-A51 WeakPolarHBondContact O-CA 3.14Å; L48-A51 WeakPolarHBondContact O-CB 3.49Å; L48-A51 PolarHBondContact O-N 2.88Å
52	K	58.8	Low	60	Low	115 Å²	115	67.7 Å²	67.7	50%	0.5	36%	0.362	S	S	.	.			trans	-53.2	157.2	166.3	-67.9	171.6	171.8	179.4	0	110.6	D174	K52-D174 VanDerWaalsContact CD-OD2 3.24Å; K52-D174 WeakPolarHBondContact CD-OD2 3.43Å; K52-D174 WeakPolarHBondContact CE-OD2 3.16Å; K52-D174 IonicContact NZ-OD1 3.45Å; K52-D174 PolarHBondContact NZ-OD1 3.34Å; K52-D174 IonicContact NZ-OD2 2.65Å; K52-D174 PolarHBondContact NZ-OD2 3.32Å
53	V	64	Low	62.4	Low	100 Å²	100	62.6 Å²	62.6	61%	0.606	33%	0.331	S	S	*	.			trans	-43.6	126.6	-177.4	-173.4	0	0	0	0	111.3
54	P	65.3	Low	65.2	Low	34 Å²	34	56.6 Å²	56.6	22%	0.221	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	150.8	174.6	25.8	-33.4	0	0	0	110.4	M19 V30 L32 G171	M19-P54 HydrophobicContact CE-CB 4.2Å; M19-P54 HydrophobicContact CE-CG 4.48Å; M19-P54 WeakPolarHBondContact CE-O 3.14Å; M19-P54 HydrophobicContact SD-CB 4.38Å; M19-P54 HydrophobicContact SD-CG 4.06Å; V30-P54 HydrophobicContact CG1-CB 4.31Å; L32-P54 HydrophobicContact CD2-CG 4.47Å; P54-G171 CarbonylContact C-O 3.51Å; P54-G171 WeakPolarHBondContact CA-O 3.25Å
55	I	71.7	Confident	67.8	Low	9 Å²	9	51.8 Å²	51.8	5%	0.046	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	138.2	172.3	-49.4	168.4	0	0	0	109.7	Q57 M169 I170 G171 N173	I55-Q57 HydrophobicContact CG2-CB 4.34Å; I55-Q57 HydrophobicContact CG2-CG 3.41Å; I55-Q57 VanDerWaalsContact CG2-CG 3.41Å; I55-M169 HydrophobicContact CD1-CE 4.15Å; I55-M169 HydrophobicContact CG2-CB 4.43Å; I55-I170 CarbonylContact O-C 3.53Å; I55-I170 VanDerWaalsContact O-CA 3.32Å; I55-I170 WeakPolarHBondContact O-CA 3.45Å; I55-G171 PolarHBondContact N-O 2.96Å; I55-G171 PolarHBondContact O-N 2.87Å; I55-N173 HydrophobicContact CD1-CB 4.28Å; I55-N173 WeakPolarHBondContact CD1-OD1 3.19Å; I55-N173 VanDerWaalsContact CG1-OD1 3.25Å; I55-N173 WeakPolarHBondContact CG1-OD1 3.28Å
56	C	76.5	Confident	70.1	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.007	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	81.5	177.5	-163.9	0	0	0	0	105.9	M19 C21 V30 M169 I170	M19-C56 HydrophobicContact CB-CB 4.48Å; M19-C56 HydrophobicContact CE-CB 3.24Å; C21-C56 WeakPolarHBondContact CA-SG 3.44Å; C21-C56 HydrophobicContact CB-CB 4.2Å; C21-C56 WeakPolarHBondContact CB-SG 3.43Å; C21-C56 WeakPolarHBondContact SG-CB 3.26Å; C21-C56 CovalentContact SG-SG 2.02Å; C21-C56 PolarHBondContact SG-SG 2.88Å; V30-C56 HydrophobicContact CG2-CB 4.09Å; C56-M169 VanDerWaalsContact CA-O 3.29Å; C56-M169 WeakPolarHBondContact CA-O 3.24Å; C56-I170 HydrophobicContact CB-CG2 4.45Å
57	Q	79.3	Confident	72.6	Confident	46 Å²	46	45.8 Å²	45.8	22%	0.215	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	167.1	-170.1	69.7	-172.5	12.4	0	0	110.7	I55 V168 M169	I55-Q57 HydrophobicContact CG2-CB 4.34Å; I55-Q57 HydrophobicContact CG2-CG 3.41Å; I55-Q57 VanDerWaalsContact CG2-CG 3.41Å; Q57-V168 WeakPolarHBondContact O-CA 3.47Å; Q57-M169 PolarHBondContact N-O 2.75Å; Q57-M169 VanDerWaalsContact N-O 3.08Å; Q57-M169 PolarHBondContact O-N 2.74Å
58	F	84.4	Confident	74.9	Confident	4 Å²	4	44.6 Å²	44.6	2%	0.018	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	145.6	165.1	-70.1	-88.7	0	0	0	110.7	P22 P60 D166 C167 V168 I456 Y457 Y460 M462	P22-F58 HydrophobicContact CB-CE2 3.85Å; P22-F58 HydrophobicContact CB-CZ 3.88Å; P22-F58 HydrophobicContact CG-CE2 4.05Å; P22-F58 HydrophobicContact CG-CZ 4.21Å; F58-P60 VanDerWaalsContact O-N 3.16Å; F58-D166 HydrophobicContact CE1-CB 4.04Å; F58-C167 CarbonylContact C-O 3.53Å; F58-C167 WeakPolarHBondContact CA-O 3.09Å; F58-C167 WeakPolarHBondContact CD1-O 3.44Å; F58-V168 HydrophobicContact CD1-CG2 3.76Å; F58-V168 HydrophobicContact CE1-CG2 3.77Å; F58-V168 HydrophobicContact CG-CG2 4.4Å; F58-V168 HydrophobicContact CZ-CG2 4.38Å; F58-I456 HydrophobicContact CD1-CG2 3.64Å; F58-I456 HydrophobicContact CE1-CG2 3.66Å; F58-I456 HydrophobicContact CG-CG2 4.14Å; F58-I456 HydrophobicContact CZ-CG2 4.2Å; F58-Y457 HydrophobicContact CB-CE1 4.2Å; F58-Y457 HydrophobicContact CD2-CE1 4.25Å; F58-Y460 HydrophobicContact CE1-CD2 4.4Å; F58-Y460 AromaticContact CE1-CE2 3.99Å; F58-Y460 HydrophobicContact CE1-CE2 3.99Å; F58-Y460 HydrophobicContact CE2-CD2 4.34Å; F58-Y460 AromaticContact CZ-CD2 3.83Å; F58-Y460 HydrophobicContact CZ-CD2 3.83Å; F58-Y460 AromaticContact CZ-CE2 3.66Å; F58-Y460 HydrophobicContact CZ-CE2 3.66Å; F58-M462 HydrophobicContact CD2-CE 3.51Å; F58-M462 HydrophobicContact CE2-CE 3.17Å; F58-M462 HydrophobicContact CE2-SD 4.34Å; F58-M462 HydrophobicContact CZ-CE 4.14Å
59	C	87.3	Confident	77.2	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.007	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-50.1	121.5	-177.9	-61.1	0	0	0	0	111.2	V62 C167 M169 W203	C59-V62 HydrophobicContact CB-CB 4.09Å; C59-C167 HydrophobicContact CB-CB 3.7Å; C59-C167 WeakPolarHBondContact CB-SG 3.32Å; C59-C167 PolarHBondContact N-O 3.43Å; C59-C167 WeakPolarHBondContact SG-CB 3.46Å; C59-C167 PolarHBondContact SG-O 2.73Å; C59-C167 VanDerWaalsContact SG-O 3.35Å; C59-C167 CovalentContact SG-SG 2.03Å; C59-C167 PolarHBondContact SG-SG 3.19Å; C59-M169 HydrophobicContact CB-SD 4.49Å; C59-W203 HydrophobicContact CB-CH2 4.42Å
60	P	78.9	Confident	79.2	Confident	42 Å²	42	38.7 Å²	38.7	27%	0.273	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	131.8	-175.7	29.9	-33.4	0	0	0	109.9	F58 V62	F58-P60 VanDerWaalsContact O-N 3.16Å; P60-V62 PolarHBondContact O-N 3.32Å
61	N	83.2	Confident	80.5	Confident	53 Å²	53	33 Å²	33	28%	0.283	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.6	8	177.5	-53.7	-21	0	0	0	116.3	H151 W152	N61-H151 WeakPolarHBondContact CB-NE2 3.38Å; N61-H151 CarbonylContact O-C 3.57Å; N61-H151 VanDerWaalsContact O-CA 3.28Å; N61-H151 WeakPolarHBondContact O-CA 3.41Å; N61-W152 VanDerWaalsContact C-CE2 3.4Å; N61-W152 HydrophobicContact CB-CD2 4.44Å; N61-W152 HydrophobicContact CB-CE3 4.31Å; N61-W152 HydrophobicContact CB-CH2 4.37Å; N61-W152 HydrophobicContact CB-CZ2 4.46Å; N61-W152 HydrophobicContact CB-CZ3 4.3Å; N61-W152 PolarHBondContact O-N 2.81Å; N61-W152 VanDerWaalsContact OD1-CH2 3.26Å; N61-W152 WeakPolarHBondContact OD1-CH2 3.45Å; N61-W152 WeakPolarHBondContact OD1-CZ3 3.46Å
62	V	89.2	Confident	81.1	Confident	5 Å²	5	37.8 Å²	37.8	3%	0.03	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	133.6	-177.8	175.7	0	0	0	0	109.5	C59 P60 C149 D150 W152 W203	C59-V62 HydrophobicContact CB-CB 4.09Å; P60-V62 PolarHBondContact O-N 3.32Å; V62-C149 HydrophobicContact CG1-CB 4.01Å; V62-D150 WeakPolarHBondContact CA-O 3.37Å; V62-W152 PolarHBondContact O-NE1 2.96Å; V62-W203 HydrophobicContact CB-CD2 4.39Å; V62-W203 HydrophobicContact CG1-CD2 4.11Å; V62-W203 HydrophobicContact CG1-CG 4.12Å; V62-W203 HydrophobicContact CG1-CZ2 4.47Å; V62-W203 HydrophobicContact CG2-CB 4.02Å; V62-W203 HydrophobicContact CG2-CD2 3.6Å; V62-W203 HydrophobicContact CG2-CE3 3.68Å; V62-W203 HydrophobicContact CG2-CG 3.75Å; V62-W203 HydrophobicContact CG2-CZ3 4.32Å
63	G	90.4	Very high	80.7	Confident	2 Å²	2	39.6 Å²	39.6	2%	0.021	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	120.9	170.7	0	0	0	0	0	109.8	F65 C149 D150	G63-F65 VanDerWaalsContact O-CD1 3.24Å; G63-F65 WeakPolarHBondContact O-CD1 3.18Å; G63-C149 WeakPolarHBondContact O-CA 3.46Å; G63-D150 PolarHBondContact N-O 3.47Å; G63-D150 PolarHBondContact O-N 2.91Å
64	C	95.1	Very high	79.5	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	130.1	165.4	-66.5	0	0	0	0	109.1	S148 C149 Y164 L165 C167 I180	C64-S148 WeakPolarHBondContact CA-O 3.38Å; C64-C149 VanDerWaalsContact CA-SG 3.59Å; C64-C149 HydrophobicContact CB-CB 4.06Å; C64-C149 WeakPolarHBondContact CB-SG 3.3Å; C64-C149 WeakPolarHBondContact SG-CB 3.41Å; C64-C149 CovalentContact SG-SG 2.04Å; C64-C149 PolarHBondContact SG-SG 3.39Å; C64-Y164 WeakPolarHBondContact O-CA 3.28Å; C64-L165 HydrophobicContact CB-CB 3.99Å; C64-L165 PolarHBondContact O-N 2.93Å; C64-C167 HydrophobicContact CB-CB 4.34Å; C64-C167 VanDerWaalsContact SG-SG 3.69Å; C64-I180 HydrophobicContact CB-CG2 4.22Å
65	F	93.5	Very high	77.9	Confident	1 Å²	1	47.9 Å²	47.9	0%	0.004	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	155.7	-171.2	55.4	-94.5	0	0	0	111.8	G63 V67 M147 S148 D150 L155 P156 I161 S163 Y164 F345	G63-F65 VanDerWaalsContact O-CD1 3.24Å; G63-F65 WeakPolarHBondContact O-CD1 3.18Å; F65-V67 HydrophobicContact CD2-CG1 3.5Å; F65-V67 HydrophobicContact CE2-CG1 3.85Å; F65-M147 WeakPolarHBondContact O-CA 3.12Å; F65-S148 PolarHBondContact N-O 2.75Å; F65-S148 PolarHBondContact O-N 3.49Å; F65-S148 VanDerWaalsContact O-N 3.15Å; F65-D150 HydrophobicContact CE1-CB 4.44Å; F65-L155 HydrophobicContact CD1-CD2 3.47Å; F65-L155 VanDerWaalsContact CD1-CD2 3.47Å; F65-L155 HydrophobicContact CE1-CD2 3.43Å; F65-L155 VanDerWaalsContact CE1-CD2 3.43Å; F65-P156 HydrophobicContact CD2-CG 4.23Å; F65-P156 HydrophobicContact CE2-CG 3.5Å; F65-P156 VanDerWaalsContact CE2-CG 3.5Å; F65-P156 HydrophobicContact CZ-CG 3.68Å; F65-I161 HydrophobicContact CB-CG2 4.24Å; F65-S163 CarbonylContact C-O 3.53Å; F65-S163 WeakPolarHBondContact CA-O 3.25Å; F65-Y164 HydrophobicContact CB-CD1 4.04Å; F65-Y164 HydrophobicContact CB-CE1 4.24Å; F65-F345 HydrophobicContact CE2-CE1 4.4Å; F65-F345 HydrophobicContact CE2-CE2 4.18Å; F65-F345 AromaticContact CE2-CZ 3.61Å; F65-F345 HydrophobicContact CE2-CZ 3.61Å; F65-F345 HydrophobicContact CZ-CE1 4.34Å; F65-F345 AromaticContact CZ-CZ 3.84Å; F65-F345 HydrophobicContact CZ-CZ 3.84Å
66	I	93.9	Very high	75.9	Confident	2 Å²	2	57 Å²	57	1%	0.01	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	126.5	169.2	-59.8	172.3	0	0	0	107.5	L145 Y146 M147 I162 S163 L165 L190 V193	I66-L145 HydrophobicContact CG2-CB 4.46Å; I66-Y146 CarbonylContact C-O 3.53Å; I66-Y146 VanDerWaalsContact CA-O 3.27Å; I66-Y146 WeakPolarHBondContact CA-O 3.17Å; I66-M147 HydrophobicContact CG1-CB 4.41Å; I66-M147 HydrophobicContact CG1-CG 4.38Å; I66-I162 HydrophobicContact CG2-CB 4.47Å; I66-I162 HydrophobicContact CG2-CD1 4.45Å; I66-I162 PolarHBondContact O-N 3.28Å; I66-S163 PolarHBondContact N-O 2.74Å; I66-S163 PolarHBondContact O-N 3.37Å; I66-L165 HydrophobicContact CD1-CD1 4.44Å; I66-L165 HydrophobicContact CD1-CD2 3.98Å; I66-L165 HydrophobicContact CD1-CG 4.39Å; I66-L165 HydrophobicContact CG1-CD1 4.21Å; I66-L165 HydrophobicContact CG1-CD2 4.43Å; I66-L165 HydrophobicContact CG1-CG 4.29Å; I66-L190 HydrophobicContact CD1-CD1 4.11Å; I66-V193 HydrophobicContact CD1-CG2 3.66Å; I66-V193 HydrophobicContact CG1-CG2 3.93Å; I66-V193 HydrophobicContact CG2-CG2 4.28Å
67	V	92.5	Very high	73.7	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.006	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	154.1	176.4	-65.1	0	0	0	0	112	F65 L69 L145 Y146 P156 D160 I161 F345	F65-V67 HydrophobicContact CD2-CG1 3.5Å; F65-V67 HydrophobicContact CE2-CG1 3.85Å; V67-L69 HydrophobicContact CG2-CD1 4.15Å; V67-L69 HydrophobicContact CG2-CG 4.03Å; V67-L145 WeakPolarHBondContact O-CA 3.39Å; V67-Y146 PolarHBondContact N-O 2.97Å; V67-Y146 PolarHBondContact O-N 3.42Å; V67-P156 HydrophobicContact CG1-CB 4.1Å; V67-P156 HydrophobicContact CG1-CG 4Å; V67-D160 CarbonylContact C-O 3.05Å; V67-D160 WeakPolarHBondContact CA-O 3.37Å; V67-D160 WeakPolarHBondContact CB-O 3.42Å; V67-I161 HydrophobicContact CG1-CB 4.43Å; V67-I161 HydrophobicContact CG1-CG1 3.77Å; V67-F345 HydrophobicContact CG2-CD2 4.04Å; V67-F345 HydrophobicContact CG2-CE2 3.58Å
68	R	90.1	Very high	71.3	Confident	126 Å²	126	65.8 Å²	65.8	48%	0.475	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	120.5	169.1	-166.9	177.7	-68.1	-170.3	2.5	109	D143 L145 D160 I162	R68-D143 WeakPolarHBondContact CD-OD2 3.34Å; R68-D143 HydrophobicContact CG-CB 3.68Å; R68-D143 IonicContact NH1-OD2 3.18Å; R68-L145 HydrophobicContact CB-CD2 4.14Å; R68-L145 HydrophobicContact CG-CD2 4.08Å; R68-D160 PolarHBondContact N-O 2.93Å; R68-I162 HydrophobicContact CB-CD1 4Å; R68-I162 HydrophobicContact CB-CG1 4.12Å
69	L	88.5	Confident	68.6	Low	18 Å²	18	70 Å²	70	9%	0.094	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	136.4	173.6	-61.5	173.2	0	0	0	110.2	V67 V144 Y146 F345 L348 T349	V67-L69 HydrophobicContact CG2-CD1 4.15Å; V67-L69 HydrophobicContact CG2-CG 4.03Å; L69-V144 PolarHBondContact N-O 3.31Å; L69-V144 PolarHBondContact O-N 3.06Å; L69-Y146 HydrophobicContact CB-CD2 3.91Å; L69-Y146 HydrophobicContact CB-CE2 3.78Å; L69-Y146 HydrophobicContact CD1-CD2 3.92Å; L69-Y146 HydrophobicContact CD1-CE2 4.24Å; L69-Y146 HydrophobicContact CD1-CG 4.47Å; L69-Y146 HydrophobicContact CG-CD2 4.1Å; L69-Y146 HydrophobicContact CG-CE2 4.42Å; L69-F345 HydrophobicContact CD1-CD2 3.83Å; L69-F345 HydrophobicContact CD1-CE2 4.12Å; L69-L348 HydrophobicContact CB-CD1 4.34Å; L69-L348 HydrophobicContact CD1-CB 3.97Å; L69-L348 HydrophobicContact CD1-CD1 4.15Å; L69-T349 HydrophobicContact CD1-CG2 4.14Å
70	P	83.9	Confident	65.8	Low	75 Å²	75	75.2 Å²	75.2	49%	0.487	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	132.4	174.6	29.4	-33.5	0	0	0	109.7	I141	P70-I141 HydrophobicContact CB-CG2 3.53Å
71	T	75.8	Confident	63.3	Low	31 Å²	31	78.1 Å²	78.1	19%	0.19	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	126.9	169.2	53.6	0	0	0	0	110.6	E73 H142 V144 Y146	T71-E73 PolarHBondContact O-N 2.86Å; T71-H142 PolarHBondContact N-O 3.35Å; T71-H142 VanDerWaalsContact N-O 3.09Å; T71-H142 PolarHBondContact OG1-O 2.94Å; T71-H142 VanDerWaalsContact OG1-O 3.06Å; T71-V144 HydrophobicContact CG2-CB 3.94Å; T71-V144 HydrophobicContact CG2-CG2 3.53Å; T71-Y146 VanDerWaalsContact CG2-OH 3.27Å; T71-Y146 WeakPolarHBondContact CG2-OH 3.15Å
72	V	61	Low	60.5	Low	128 Å²	128	81 Å²	81	78%	0.776	47%	0.466	S	S	*	.			trans	-87.3	99.4	167.1	-175.4	0	0	0	0	107.2	T74	V72-T74 PolarHBondContact O-N 3.44Å
73	E	49.7	Very low	57.7	Low	153 Å²	153	86.4 Å²	86.4	72%	0.715	50%	0.499	S	S	*	.			trans	-67.1	101.9	164.3	-72.4	-167.2	170.3	0	0	108	T71 K75	T71-E73 PolarHBondContact O-N 2.86Å; E73-K75 VanDerWaalsContact C-N 3.34Å; E73-K75 PolarHBondContact O-N 3.01Å
74	T	38.6	Very low	54.5	Low	121 Å²	121	93.7 Å²	93.7	74%	0.742	54%	0.537	S	S	*	.			trans	-69.7	102.5	162.1	-40.8	0	0	0	0	105.1	V72 K76	V72-T74 PolarHBondContact O-N 3.44Å; T74-K76 PolarHBondContact O-N 2.83Å
75	K	32	Very low	51.3	Low	187 Å²	187	101.2 Å²	101.2	81%	0.813	58%	0.576	S	S	*	*			trans	-46.5	112.4	168.9	-78.5	-178.4	177.2	176.5	0	106.6	E73 S77	E73-K75 VanDerWaalsContact C-N 3.34Å; E73-K75 PolarHBondContact O-N 3.01Å; K75-S77 VanDerWaalsContact C-N 3.3Å; K75-S77 PolarHBondContact O-N 2.77Å
76	K	31.1	Very low	48.2	Very low	201 Å²	201	105.3 Å²	105.3	87%	0.874	61%	0.61	S	S	*	*			trans	-60.3	104.1	167.6	-82	-177.5	178	177.3	0	105.1	T74 S78	T74-K76 PolarHBondContact O-N 2.83Å; K76-S78 PolarHBondContact O-N 3.22Å
77	S	29.9	Very low	44.8	Very low	102 Å²	102	114.9 Å²	114.9	71%	0.713	65%	0.651	S	S	*	*			trans	-48.3	112.3	168.2	-43.7	0	0	0	0	106.6	K75 S79	K75-S77 VanDerWaalsContact C-N 3.3Å; K75-S77 PolarHBondContact O-N 2.77Å; S77-S79 PolarHBondContact O-N 2.95Å
78	S	28	Very low	41.6	Very low	128 Å²	128	121 Å²	121	90%	0.895	69%	0.689	S	S	*	*			trans	-64.8	84.4	173.4	43	0	0	0	0	108.4	K76	K76-S78 PolarHBondContact O-N 3.22Å
79	S	27.7	Very low	38.3	Very low	92 Å²	92	121.3 Å²	121.3	64%	0.643	71%	0.705	S	S	*	*			trans	-161.1	75.1	173.4	46	0	0	0	0	111.2	S77	S77-S79 PolarHBondContact O-N 2.95Å
80	S	28	Very low	35.4	Very low	111 Å²	111	129.2 Å²	129.2	78%	0.776	74%	0.741	S	S	*	*			trans	177	105.6	136.5	34.7	0	0	0	0	111.1
81	S	26.9	Very low	32.6	Very low	103 Å²	103	130.6 Å²	130.6	72%	0.72	75%	0.753	S	S	*	*			trans	42.4	99.8	130.8	-40.2	0	0	0	0	117.9	V83	S81-V83 PolarHBondContact O-N 2.81Å; S81-V83 VanDerWaalsContact O-N 3.17Å
82	S	24.7	Very low	30.2	Very low	115 Å²	115	134.1 Å²	134.1	80%	0.804	78%	0.779	S	S	*	*			trans	-24.8	108	147.4	45.8	0	0	0	0	114.5
83	V	29.8	Very low	28.4	Very low	118 Å²	118	133 Å²	133	72%	0.715	78%	0.777	S	S	*	*			trans	-111.4	100.1	157	-178.3	0	0	0	0	107.1	S81 I85	S81-V83 PolarHBondContact O-N 2.81Å; S81-V83 VanDerWaalsContact O-N 3.17Å; V83-I85 HydrophobicContact CG1-CG1 4.05Å; V83-I85 PolarHBondContact O-N 3.49Å; V83-I85 VanDerWaalsContact O-N 3.15Å
84	N	23.9	Very low	27.3	Very low	155 Å²	155	130.5 Å²	130.5	83%	0.829	78%	0.776	S	S	*	*			trans	-63.7	105.5	168.2	-78.5	-27.2	0	0	0	108.9	A86	N84-A86 PolarHBondContact O-N 3.29Å
85	I	28.9	Very low	26.5	Very low	158 Å²	158	130 Å²	130	81%	0.81	78%	0.778	S	S	*	*			trans	-96.5	81.2	165.5	-56.2	178.4	0	0	0	107	V83	V83-I85 HydrophobicContact CG1-CG1 4.05Å; V83-I85 PolarHBondContact O-N 3.49Å; V83-I85 VanDerWaalsContact O-N 3.15Å
86	A	27.4	Very low	26.3	Very low	87 Å²	87	126.2 Å²	126.2	72%	0.719	78%	0.775	S	S	*	*			trans	-75.3	125.7	164.9	0	0	0	0	0	108.9	N84 T88	N84-A86 PolarHBondContact O-N 3.29Å; A86-T88 PolarHBondContact O-N 2.75Å
87	K	21.8	Very low	25.9	Very low	202 Å²	202	122.1 Å²	122.1	88%	0.878	77%	0.772	S	S	*	*			trans	-29.7	122.5	162.6	-85.8	167.1	165.3	171.5	0	112.9
88	T	25.9	Very low	25.9	Very low	130 Å²	130	122.3 Å²	122.3	80%	0.798	77%	0.773	S	S	*	*			trans	-148.4	111.9	143.4	-49.5	0	0	0	0	110.3	A86	A86-T88 PolarHBondContact O-N 2.75Å
89	T	21.6	Very low	25.8	Very low	132 Å²	132	121.5 Å²	121.5	81%	0.81	77%	0.767	S	S	*	*			trans	-59.5	121.9	158	4	0	0	0	0	109.6
90	Q	27.3	Very low	26	Very low	184 Å²	184	123.5 Å²	123.5	86%	0.86	78%	0.778	S	S	*	*			trans	-175	117.7	139.6	-104	165.3	18.1	0	0	112.4
91	S	23.6	Very low	26	Very low	105 Å²	105	125 Å²	125	73%	0.734	78%	0.782	S	S	*	*			trans	9.2	130.1	142.3	-43.8	0	0	0	0	120.8
92	S	25.6	Very low	25.8	Very low	104 Å²	104	124.5 Å²	124.5	73%	0.727	79%	0.785	S	S	*	*			trans	65.4	111.8	133.2	55.5	0	0	0	0	120.5
93	S	24.2	Very low	26	Very low	106 Å²	106	124.5 Å²	124.5	74%	0.741	78%	0.782	S	S	*	*				82.1	123.4	129.1	55.4	0	0	0	0	120.9
94	S	25.4	Very low	25.7	Very low	99 Å²	99	125.2 Å²	125.2	69%	0.692	79%	0.787	S	S	*	*			trans	76.5	95	140.2	52.5	0	0	0	0	119.9
95	S	22.9	Very low	25.9	Very low	111 Å²	111	125.1 Å²	125.1	78%	0.776	79%	0.785	S	S	*	*				47.5	109.7	112.3	63.2	0	0	0	0	120.5
96	S	28.2	Very low	25.7	Very low	107 Å²	107	123.2 Å²	123.2	75%	0.748	79%	0.785	S	S	*	*			trans	-179.5	107.1	133.5	51.8	0	0	0	0	107.4
97	S	23.2	Very low	25.5	Very low	116 Å²	116	125 Å²	125	81%	0.811	79%	0.787	S	S	*	*				58	96.2	76.8	74.6	0	0	0	0	115.8
98	S	29.2	Very low	25.6	Very low	106 Å²	106	121.4 Å²	121.4	74%	0.741	78%	0.783	S	S	*	*			trans	-179.2	97.1	147.8	55	0	0	0	0	108.1
99	S	26	Very low	25.6	Very low	110 Å²	110	123 Å²	123	77%	0.769	79%	0.785	S	S	*	*				81.2	134.3	93.8	64.9	0	0	0	0	114.6
100	P	31.4	Very low	25.7	Very low	134 Å²	134	121.8 Å²	121.8	87%	0.87	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-103.8	147.9	-155.2	25.1	-7.1	0	0	0	114.1
101	T	27.9	Very low	26	Very low	143 Å²	143	118.1 Å²	118.1	88%	0.877	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-103.7	120.6	177.6	-17.7	0	0	0	0	110.5
102	A	22.5	Very low	26.2	Very low	93 Å²	93	120.1 Å²	120.1	77%	0.769	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-76.5	152	165.3	0	0	0	0	0	110.8
103	P	28.3	Very low	26.2	Very low	114 Å²	114	121 Å²	121	74%	0.74	77%	0.772	S	S	*	*				-141.1	139.7	123.9	21.4	-0	0	0	0	115.3
104	T	23.7	Very low	26.2	Very low	133 Å²	133	123.9 Å²	123.9	82%	0.816	77%	0.774	S	S	*	*				71.4	109.3	128.9	-36.5	0	0	0	0	120.8
105	I	27.9	Very low	26.2	Very low	154 Å²	154	124.1 Å²	124.1	79%	0.79	77%	0.771	S	S	*	*			trans	-66.8	142.6	165.6	-65.4	156.2	0	0	0	110.5
106	S	26.1	Very low	26.3	Very low	117 Å²	117	125.4 Å²	125.4	82%	0.818	77%	0.769	S	S	*	*			trans	-127.1	129.6	156.4	-82.3	0	0	0	0	109.8
107	T	22.7	Very low	26.1	Very low	124 Å²	124	127.6 Å²	127.6	76%	0.761	77%	0.772	S	S	*	*			trans	-71.6	141.5	-177.9	35.2	0	0	0	0	114.3
108	T	24.5	Very low	26.2	Very low	128 Å²	128	125.9 Å²	125.9	79%	0.785	76%	0.764	S	S	*	*			trans	-165.2	123.1	131.9	30.9	0	0	0	0	112.7
109	L	26.2	Very low	26.1	Very low	162 Å²	162	125.7 Å²	125.7	85%	0.848	76%	0.763	S	S	*	*			trans	60.1	125.5	148.4	-68.8	100.8	0	0	0	123.9
110	S	23.8	Very low	26.3	Very low	108 Å²	108	128.2 Å²	128.2	76%	0.755	77%	0.766	S	S	*	*			trans	-55.5	-178.6	162.7	-14.1	0	0	0	0	115.9
111	P	32.4	Very low	26	Very low	106 Å²	106	129 Å²	129	69%	0.688	76%	0.763	S	S	*	*			cis	-141.5	-176.5	7.1	32.2	-7.2	0	0	0	117
112	I	28.2	Very low	26	Very low	148 Å²	148	126.9 Å²	126.9	76%	0.759	75%	0.754	S	S	*	*			trans	82.7	129.1	158.1	-42.6	172.9	0	0	0	116
113	N	24.6	Very low	26.1	Very low	122 Å²	122	129.8 Å²	129.8	65%	0.652	76%	0.757	S	S	*	*			cis	-164.4	151.4	-22.9	-108.5	8.5	0	0	0	105.6
114	E	24.8	Very low	26.2	Very low	167 Å²	167	131.5 Å²	131.5	78%	0.78	76%	0.758	S	S	*	*			trans	44.9	139.1	138.4	-68.3	178.2	179.4	0	0	120.6
115	T	25	Very low	26.3	Very low	104 Å²	104	131.6 Å²	131.6	64%	0.638	76%	0.759	S	S	*	*			cis	-171.2	153.9	-11.2	-37.2	0	0	0	0	102.9
116	D	25.6	Very low	26.2	Very low	137 Å²	137	128.2 Å²	128.2	73%	0.733	76%	0.762	S	S	*	*			trans	75.9	127.1	152.6	-69.7	-23.2	0	0	0	123.3
117	L	24.7	Very low	26.3	Very low	153 Å²	153	130.1 Å²	130.1	80%	0.801	76%	0.761	S	S	*	*			trans	76.3	104.7	142.4	-91.6	80.2	0	0	0	120.3
118	A	25	Very low	26.6	Very low	80 Å²	80	131 Å²	131	66%	0.661	76%	0.762	S	S	*	*				72.8	119	117.5	0	0	0	0	0	119.4
119	S	27.5	Very low	26.7	Very low	103 Å²	103	131.6 Å²	131.6	72%	0.72	76%	0.76	S	S	*	*			trans	55.7	106.7	137.8	53.7	0	0	0	0	119.4	N121	S119-N121 PolarHBondContact O-N 3.42Å
120	I	29.5	Very low	27.1	Very low	162 Å²	162	133 Å²	133	83%	0.831	76%	0.759	S	S	*	*				21.9	101.5	121.6	-54	170.7	0	0	0	115
121	N	25.4	Very low	27.3	Very low	151 Å²	151	135.9 Å²	135.9	81%	0.807	77%	0.766	S	S	*	*			trans	-169.7	121.8	145.8	-97.4	-15.7	0	0	0	112.4	S119	S119-N121 PolarHBondContact O-N 3.42Å
122	S	26.6	Very low	27.1	Very low	98 Å²	98	138.3 Å²	138.3	69%	0.685	77%	0.768	S	S	*	*			trans	37.5	130.1	141.7	56.9	0	0	0	0	124.5
123	N	25	Very low	27.2	Very low	155 Å²	155	136 Å²	136	83%	0.829	76%	0.761	S	S	*	*			trans	76.4	130.6	131.6	-83.6	2.8	0	0	0	123.7
124	I	30.6	Very low	27.6	Very low	149 Å²	149	138.3 Å²	138.3	76%	0.764	77%	0.773	S	S	*	*			trans	123	107.8	142.2	-70.7	156.6	0	0	0	118.3
125	T	25.3	Very low	27.9	Very low	136 Å²	136	138 Å²	138	83%	0.834	77%	0.771	S	S	*	*			trans	47.1	128.1	143	64.9	0	0	0	0	123.5
126	G	26.1	Very low	28.1	Very low	82 Å²	82	140.7 Å²	140.7	85%	0.845	78%	0.777	S	S	*	*			trans	179.2	114	154.4	0	0	0	0	0	112.4
127	I	27.8	Very low	28.5	Very low	158 Å²	158	142.2 Å²	142.2	81%	0.81	78%	0.782	S	S	*	*			trans	-63.4	138.5	177.7	-67.1	156.9	0	0	0	110.8
128	N	30.1	Very low	28.9	Very low	143 Å²	143	141.8 Å²	141.8	77%	0.765	78%	0.78	S	S	*	*			trans	-172.1	121.7	142.9	-88.8	-14	0	0	0	111.9
129	D	26.4	Very low	29.6	Very low	140 Å²	140	141.6 Å²	141.6	75%	0.749	77%	0.774	S	S	*	*			trans	23.8	109.1	147.3	-60.5	-31.4	0	0	0	120.6
130	F	35.2	Very low	30.3	Very low	191 Å²	191	141.1 Å²	141.1	84%	0.838	77%	0.767	S	S	*	*			trans	-136.7	80.3	145.4	-94.1	-83.2	0	0	0	109.8	E132	F130-E132 PolarHBondContact O-N 3.42Å
131	N	26.9	Very low	31.6	Very low	169 Å²	169	139 Å²	139	90%	0.904	76%	0.756	S	S	*	*			trans	-79.8	89.3	149.2	-97.9	-16.5	0	0	0	107.1
132	E	28.6	Very low	33.8	Very low	156 Å²	156	136.6 Å²	136.6	73%	0.729	74%	0.74	S	S	*	*			trans	-174.2	120.3	163.6	-105.4	-178.2	-165.9	0	0	105.1	F130	F130-E132 PolarHBondContact O-N 3.42Å
133	T	31.2	Very low	36.6	Very low	100 Å²	100	135.9 Å²	135.9	61%	0.613	73%	0.728	S	S	*	*			cis	-147.7	139	8.5	36.4	0	0	0	0	107.3	E135	T133-E135 PolarHBondContact O-N 3.22Å
134	L	32.3	Very low	39.8	Very low	171 Å²	171	129.9 Å²	129.9	90%	0.895	70%	0.697	S	S	*	*			trans	-64.3	62.9	156.1	-169.3	86.7	0	0	0	107.9	Q136	L134-Q136 PolarHBondContact O-N 3Å
135	E	31.2	Very low	42.8	Very low	160 Å²	160	123.4 Å²	123.4	75%	0.748	66%	0.664	S	S	*	*			trans	-70.7	83.9	157.6	-82.2	-165.5	175.1	0	0	105.8	T133 M137	T133-E135 PolarHBondContact O-N 3.22Å; E135-M137 PolarHBondContact O-N 3.24Å
136	Q	29.7	Very low	46.2	Very low	161 Å²	161	117.2 Å²	117.2	75%	0.752	63%	0.625	S	S	*	*			trans	-29.8	91.2	155.2	-167.6	165.6	10.1	0	0	108.8	L134 N138	L134-Q136 PolarHBondContact O-N 3Å; Q136-N138 PolarHBondContact O-N 2.75Å
137	M	33.9	Very low	49.5	Very low	169 Å²	169	113.3 Å²	113.3	83%	0.833	59%	0.585	S	S	*	*			trans	-58.9	94.2	166.4	-69.9	-173.9	-143.9	0	0	105.2	E135 S139	E135-M137 PolarHBondContact O-N 3.24Å; M137-S139 PolarHBondContact O-N 2.96Å; M137-S139 PolarHBondContact O-OG 3.23Å
138	N	32	Very low	52.7	Low	144 Å²	144	105.8 Å²	105.8	77%	0.77	55%	0.546	S	S	*	.			trans	-73.3	48.4	165.4	-135.2	12.7	0	0	0	107.8	Q136 T140	Q136-N138 PolarHBondContact O-N 2.75Å; N138-T140 VanDerWaalsContact C-N 3.3Å; N138-T140 PolarHBondContact O-N 3.25Å
139	S	40.7	Very low	55.8	Low	76 Å²	76	99 Å²	99	53%	0.531	51%	0.51	S	S	.	.			trans	-67.1	97.6	166	52.7	0	0	0	0	104.9	M137 I141	M137-S139 PolarHBondContact O-N 2.96Å; M137-S139 PolarHBondContact O-OG 3.23Å; S139-I141 VanDerWaalsContact C-N 3.31Å; S139-I141 PolarHBondContact O-N 2.93Å
140	T	43.1	Very low	58.9	Low	93 Å²	93	93.4 Å²	93.4	57%	0.571	48%	0.48	S	S	*	.			trans	-56.2	102.6	165.8	40.8	0	0	0	0	106.3	N138 H142	N138-T140 VanDerWaalsContact C-N 3.3Å; N138-T140 PolarHBondContact O-N 3.25Å; T140-H142 VanDerWaalsContact C-N 3.35Å; T140-H142 PolarHBondContact O-CD2 3.16Å; T140-H142 VanDerWaalsContact O-CD2 3.26Å; T140-H142 PolarHBondContact O-N 3.21Å; T140-H142 PolarHBondContact OG1-NE2 3.28Å
141	I	55.1	Low	61.5	Low	118 Å²	118	87.6 Å²	87.6	61%	0.605	46%	0.456	S	S	*	.			trans	-63.4	104.4	174.2	-64.1	170.1	0	0	0	105.1	P70 S139	P70-I141 HydrophobicContact CB-CG2 3.53Å; S139-I141 VanDerWaalsContact C-N 3.31Å; S139-I141 PolarHBondContact O-N 2.93Å
142	H	73.4	Confident	64.1	Low	100 Å²	100	82.4 Å²	82.4	46%	0.463	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	112.8	170.5	-68.6	-65.1	0	0	0	106.8	T71 T140	T71-H142 PolarHBondContact N-O 3.35Å; T71-H142 VanDerWaalsContact N-O 3.09Å; T71-H142 PolarHBondContact OG1-O 2.94Å; T71-H142 VanDerWaalsContact OG1-O 3.06Å; T140-H142 VanDerWaalsContact C-N 3.35Å; T140-H142 PolarHBondContact O-CD2 3.16Å; T140-H142 VanDerWaalsContact O-CD2 3.26Å; T140-H142 PolarHBondContact O-N 3.21Å; T140-H142 PolarHBondContact OG1-NE2 3.28Å
143	D	84.7	Confident	66.7	Low	82 Å²	82	81.4 Å²	81.4	44%	0.439	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	125.7	170.9	-74.1	-24.3	0	0	0	108.6	R68	R68-D143 WeakPolarHBondContact CD-OD2 3.34Å; R68-D143 HydrophobicContact CG-CB 3.68Å; R68-D143 IonicContact NH1-OD2 3.18Å
144	V	91.2	Very high	69.3	Low	29 Å²	29	81.5 Å²	81.5	18%	0.176	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	140.4	177.7	179.3	0	0	0	0	109.1	L69 T71 Y146 D194	L69-V144 PolarHBondContact N-O 3.31Å; L69-V144 PolarHBondContact O-N 3.06Å; T71-V144 HydrophobicContact CG2-CB 3.94Å; T71-V144 HydrophobicContact CG2-CG2 3.53Å; V144-Y146 HydrophobicContact CB-CD2 4.45Å; V144-Y146 HydrophobicContact CB-CE2 3.6Å; V144-Y146 HydrophobicContact CG1-CD2 4.26Å; V144-Y146 HydrophobicContact CG1-CE1 4.27Å; V144-Y146 HydrophobicContact CG1-CE2 3.58Å; V144-Y146 WeakPolarHBondContact O-CD2 3.35Å; V144-Y146 WeakPolarHBondContact O-CE2 3.4Å; V144-D194 HydrophobicContact CG1-CB 3.6Å
145	L	94.6	Very high	71.9	Confident	14 Å²	14	75.5 Å²	75.5	7%	0.073	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	120	-179.1	-57.7	-170.5	0	0	0	111.4	I66 V67 R68 I162 P191 D194 C195	I66-L145 HydrophobicContact CG2-CB 4.46Å; V67-L145 WeakPolarHBondContact O-CA 3.39Å; R68-L145 HydrophobicContact CB-CD2 4.14Å; R68-L145 HydrophobicContact CG-CD2 4.08Å; L145-I162 HydrophobicContact CD1-CD1 4.35Å; L145-I162 HydrophobicContact CD2-CD1 3.26Å; L145-I162 HydrophobicContact CG-CD1 4.41Å; L145-P191 HydrophobicContact CD1-CB 3.64Å; L145-P191 HydrophobicContact CD1-CG 3.35Å; L145-D194 WeakPolarHBondContact CB-OD2 3.19Å; L145-D194 PolarHBondContact N-OD2 2.93Å; L145-D194 WeakPolarHBondContact O-CB 3.45Å; L145-D194 PolarHBondContact O-N 2.99Å; L145-C195 PolarHBondContact O-N 2.73Å
146	Y	95.6	Very high	74.4	Confident	6 Å²	6	69 Å²	69	2%	0.024	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	141.8	179.8	-60.9	-92.8	0	0	0	110.2	I66 V67 L69 T71 V144 C195 P344 F345 L348	I66-Y146 CarbonylContact C-O 3.53Å; I66-Y146 VanDerWaalsContact CA-O 3.27Å; I66-Y146 WeakPolarHBondContact CA-O 3.17Å; V67-Y146 PolarHBondContact N-O 2.97Å; V67-Y146 PolarHBondContact O-N 3.42Å; L69-Y146 HydrophobicContact CB-CD2 3.91Å; L69-Y146 HydrophobicContact CB-CE2 3.78Å; L69-Y146 HydrophobicContact CD1-CD2 3.92Å; L69-Y146 HydrophobicContact CD1-CE2 4.24Å; L69-Y146 HydrophobicContact CD1-CG 4.47Å; L69-Y146 HydrophobicContact CG-CD2 4.1Å; L69-Y146 HydrophobicContact CG-CE2 4.42Å; T71-Y146 VanDerWaalsContact CG2-OH 3.27Å; T71-Y146 WeakPolarHBondContact CG2-OH 3.15Å; V144-Y146 HydrophobicContact CB-CD2 4.45Å; V144-Y146 HydrophobicContact CB-CE2 3.6Å; V144-Y146 HydrophobicContact CG1-CD2 4.26Å; V144-Y146 HydrophobicContact CG1-CE1 4.27Å; V144-Y146 HydrophobicContact CG1-CE2 3.58Å; V144-Y146 WeakPolarHBondContact O-CD2 3.35Å; V144-Y146 WeakPolarHBondContact O-CE2 3.4Å; Y146-C195 WeakPolarHBondContact CA-O 3.21Å; Y146-C195 WeakPolarHBondContact CD1-SG 3.47Å; Y146-C195 WeakPolarHBondContact CE1-SG 3.23Å; Y146-P344 HydrophobicContact CE1-CG 4.22Å; Y146-F345 HydrophobicContact CD1-CB 3.65Å; Y146-F345 HydrophobicContact CD1-CD2 4.4Å; Y146-F345 HydrophobicContact CD1-CG 4.46Å; Y146-F345 HydrophobicContact CE1-CB 4.33Å; Y146-F345 HydrophobicContact CG-CB 4.16Å; Y146-F345 HydrophobicContact CG-CD2 4.05Å; Y146-L348 HydrophobicContact CE2-CD1 4.16Å
147	M	95.4	Very high	77	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	135.1	167.6	-175.1	-75.1	-85.7	0	0	110.1	F65 I66 L165 V193 C195 I196 D197 F200 F217	F65-M147 WeakPolarHBondContact O-CA 3.12Å; I66-M147 HydrophobicContact CG1-CB 4.41Å; I66-M147 HydrophobicContact CG1-CG 4.38Å; M147-L165 HydrophobicContact CG-CD1 3.69Å; M147-L165 HydrophobicContact SD-CD1 4.48Å; M147-V193 HydrophobicContact CB-CG1 3.74Å; M147-V193 HydrophobicContact CB-CG2 4.22Å; M147-C195 PolarHBondContact N-O 3.36Å; M147-I196 HydrophobicContact CB-CG1 4.2Å; M147-I196 HydrophobicContact CE-CB 4.24Å; M147-I196 HydrophobicContact CE-CD1 4.26Å; M147-I196 HydrophobicContact CE-CG1 4.04Å; M147-I196 HydrophobicContact CE-CG2 3.25Å; M147-I196 HydrophobicContact SD-CG2 4.11Å; M147-D197 WeakPolarHBondContact O-CB 3.49Å; M147-D197 PolarHBondContact O-N 3.43Å; M147-F200 HydrophobicContact CE-CD2 4.23Å; M147-F200 HydrophobicContact CE-CG 4.49Å; M147-F217 HydrophobicContact CE-CE1 3.79Å; M147-F217 HydrophobicContact CE-CE2 4.05Å; M147-F217 HydrophobicContact CE-CZ 3.21Å; M147-F217 HydrophobicContact CG-CE2 4.27Å; M147-F217 HydrophobicContact CG-CZ 4.25Å
148	S	95.4	Very high	79.2	Confident	0 Å²	0	61 Å²	61	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	167.9	166.9	-171.1	0	0	0	0	110.5	C64 F65 D197	C64-S148 WeakPolarHBondContact CA-O 3.38Å; F65-S148 PolarHBondContact N-O 2.75Å; F65-S148 PolarHBondContact O-N 3.49Å; F65-S148 VanDerWaalsContact O-N 3.15Å; S148-D197 WeakPolarHBondContact OG-CB 3.42Å; S148-D197 PolarHBondContact OG-OD2 3.21Å
149	C	95	Very high	81.6	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.007	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	127.8	167.5	-50.4	0	0	0	0	108.4	V62 G63 C64 F200	V62-C149 HydrophobicContact CG1-CB 4.01Å; G63-C149 WeakPolarHBondContact O-CA 3.46Å; C64-C149 VanDerWaalsContact CA-SG 3.59Å; C64-C149 HydrophobicContact CB-CB 4.06Å; C64-C149 WeakPolarHBondContact CB-SG 3.3Å; C64-C149 WeakPolarHBondContact SG-CB 3.41Å; C64-C149 CovalentContact SG-SG 2.04Å; C64-C149 PolarHBondContact SG-SG 3.39Å; C149-F200 HydrophobicContact CB-CB 4.42Å; C149-F200 WeakPolarHBondContact CB-O 3.13Å
150	D	92	Very high	83.8	Confident	22 Å²	22	58 Å²	58	12%	0.118	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	168.9	177.1	-145.5	-48.6	0	0	0	110.2	V62 G63 F65 N154 R346	V62-D150 WeakPolarHBondContact CA-O 3.37Å; G63-D150 PolarHBondContact N-O 3.47Å; G63-D150 PolarHBondContact O-N 2.91Å; F65-D150 HydrophobicContact CE1-CB 4.44Å; D150-N154 HydrophobicContact CB-CB 4.21Å; D150-N154 WeakPolarHBondContact OD1-CB 3.15Å; D150-N154 PolarHBondContact OD1-ND2 3.17Å; D150-R346 IonicContact OD2-CZ 2.65Å; D150-R346 IonicContact OD2-NH1 3.49Å; D150-R346 PolarHBondContact OD2-NH1 2.63Å; D150-R346 IonicContact OD2-NH2 3.05Å; D150-R346 PolarHBondContact OD2-NH2 2.99Å
151	H	89.7	Confident	85.9	Confident	69 Å²	69	54.6 Å²	54.6	32%	0.319	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	148.9	173.1	-162	-84	0	0	0	110.3	N61 N153 N154	N61-H151 WeakPolarHBondContact CB-NE2 3.38Å; N61-H151 CarbonylContact O-C 3.57Å; N61-H151 VanDerWaalsContact O-CA 3.28Å; N61-H151 WeakPolarHBondContact O-CA 3.41Å; H151-N153 PolarHBondContact O-N 3.03Å; H151-N154 PolarHBondContact O-N 2.8Å
152	W	81.5	Confident	87.5	Confident	60 Å²	60	51.7 Å²	51.7	23%	0.227	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-55	-28.7	-176.5	-63.4	-22.7	0	0	0	115	N61 V62 N154 L155 H454	N61-W152 VanDerWaalsContact C-CE2 3.4Å; N61-W152 HydrophobicContact CB-CD2 4.44Å; N61-W152 HydrophobicContact CB-CE3 4.31Å; N61-W152 HydrophobicContact CB-CH2 4.37Å; N61-W152 HydrophobicContact CB-CZ2 4.46Å; N61-W152 HydrophobicContact CB-CZ3 4.3Å; N61-W152 PolarHBondContact O-N 2.81Å; N61-W152 VanDerWaalsContact OD1-CH2 3.26Å; N61-W152 WeakPolarHBondContact OD1-CH2 3.45Å; N61-W152 WeakPolarHBondContact OD1-CZ3 3.46Å; V62-W152 PolarHBondContact O-NE1 2.96Å; W152-N154 PolarHBondContact O-N 2.77Å; W152-L155 HydrophobicContact CB-CD1 4.35Å; W152-H454 AromaticContact CE2-CD2 3.71Å; W152-H454 AromaticContact CE2-NE2 3.84Å; W152-H454 AromaticContact CH2-CD2 3.52Å; W152-H454 AromaticContact CZ2-CD2 2.95Å; W152-H454 WeakPolarHBondContact CZ2-CD2 3.48Å; W152-H454 AromaticContact CZ2-CG 3.89Å; W152-H454 AromaticContact CZ2-NE2 3.26Å; W152-H454 VanDerWaalsContact CZ2-NE2 3.26Å; W152-H454 WeakPolarHBondContact CZ2-NE2 3.44Å; W152-H454 AromaticContact NE1-NE2 3.95Å
153	N	83.3	Confident	88.3	Confident	134 Å²	134	47.4 Å²	47.4	72%	0.717	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-72.2	-17.3	179.3	-63.1	-12	0	0	0	112.9	H151	H151-N153 PolarHBondContact O-N 3.03Å
154	N	86.3	Confident	88.6	Confident	103 Å²	103	45.3 Å²	45.3	55%	0.551	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-113.1	11.3	-175.6	-58.3	-25.7	0	0	0	112	D150 H151 W152	D150-N154 HydrophobicContact CB-CB 4.21Å; D150-N154 WeakPolarHBondContact OD1-CB 3.15Å; D150-N154 PolarHBondContact OD1-ND2 3.17Å; H151-N154 PolarHBondContact O-N 2.8Å; W152-N154 PolarHBondContact O-N 2.77Å
155	L	85.8	Confident	88.7	Confident	44 Å²	44	44 Å²	44	23%	0.23	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-65.8	142.6	178.9	-65.6	175.4	0	0	0	110.3	F65 W152 Y164	F65-L155 HydrophobicContact CD1-CD2 3.47Å; F65-L155 VanDerWaalsContact CD1-CD2 3.47Å; F65-L155 HydrophobicContact CE1-CD2 3.43Å; F65-L155 VanDerWaalsContact CE1-CD2 3.43Å; W152-L155 HydrophobicContact CB-CD1 4.35Å; L155-Y164 HydrophobicContact CD1-CE1 4.32Å
156	P	84.9	Confident	88.4	Confident	25 Å²	25	43.3 Å²	43.3	16%	0.162	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-58.7	168.7	170.5	-25.9	36.9	0	0	0	112.6	F65 V67 I161 F345	F65-P156 HydrophobicContact CD2-CG 4.23Å; F65-P156 HydrophobicContact CE2-CG 3.5Å; F65-P156 VanDerWaalsContact CE2-CG 3.5Å; F65-P156 HydrophobicContact CZ-CG 3.68Å; V67-P156 HydrophobicContact CG1-CB 4.1Å; V67-P156 HydrophobicContact CG1-CG 4Å; P156-I161 HydrophobicContact CB-CG1 4.46Å; P156-F345 HydrophobicContact CG-CZ 4.18Å
157	S	82.9	Confident	88.2	Confident	59 Å²	59	43 Å²	43	41%	0.413	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-55	136.1	173.2	178.6	0	0	0	0	110.4	S159 D160	S157-S159 WeakPolarHBondContact CB-OG 3.36Å; S157-S159 PolarHBondContact O-N 3.18Å; S157-S159 PolarHBondContact OG-N 3.35Å; S157-S159 PolarHBondContact OG-OG 3.42Å; S157-D160 PolarHBondContact O-N 2.97Å
158	P	81.7	Confident	87.8	Confident	103 Å²	103	43 Å²	43	67%	0.669	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55	-24.4	175.7	-27	34.8	0	0	0	114.4	D160	P158-D160 VanDerWaalsContact C-N 3.27Å; P158-D160 PolarHBondContact O-N 3.05Å
159	S	81.9	Confident	87.4	Confident	94 Å²	94	43.4 Å²	43.4	66%	0.657	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-30.5	175.2	55.5	0	0	0	0	113.8	S157	S157-S159 WeakPolarHBondContact CB-OG 3.36Å; S157-S159 PolarHBondContact O-N 3.18Å; S157-S159 PolarHBondContact OG-N 3.35Å; S157-S159 PolarHBondContact OG-OG 3.42Å
160	D	85.8	Confident	86.8	Confident	63 Å²	63	43.4 Å²	43.4	34%	0.337	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-17.8	-172.8	-52.4	-15.8	0	0	0	110.5	V67 R68 S157 P158 I162	V67-D160 CarbonylContact C-O 3.05Å; V67-D160 WeakPolarHBondContact CA-O 3.37Å; V67-D160 WeakPolarHBondContact CB-O 3.42Å; R68-D160 PolarHBondContact N-O 2.93Å; S157-D160 PolarHBondContact O-N 2.97Å; P158-D160 VanDerWaalsContact C-N 3.27Å; P158-D160 PolarHBondContact O-N 3.05Å; D160-I162 PolarHBondContact O-N 2.86Å
161	I	88.2	Confident	86.2	Confident	21 Å²	21	42.7 Å²	42.7	11%	0.108	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	114.6	-179	-61.6	174.5	0	0	0	109.2	F65 V67 P156 Y164	F65-I161 HydrophobicContact CB-CG2 4.24Å; V67-I161 HydrophobicContact CG1-CB 4.43Å; V67-I161 HydrophobicContact CG1-CG1 3.77Å; P156-I161 HydrophobicContact CB-CG1 4.46Å; I161-Y164 HydrophobicContact CD1-CE1 4.12Å; I161-Y164 HydrophobicContact CD1-CE2 4.38Å; I161-Y164 WeakPolarHBondContact CD1-OH 3.37Å; I161-Y164 HydrophobicContact CG2-CD2 4.19Å; I161-Y164 HydrophobicContact CG2-CE2 3.92Å
162	I	88	Confident	85.6	Confident	57 Å²	57	41.4 Å²	41.4	29%	0.292	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	-46.1	170.4	-62.6	-176.9	0	0	0	109.8	I66 R68 L145 D160 L190	I66-I162 HydrophobicContact CG2-CB 4.47Å; I66-I162 HydrophobicContact CG2-CD1 4.45Å; I66-I162 PolarHBondContact O-N 3.28Å; R68-I162 HydrophobicContact CB-CD1 4Å; R68-I162 HydrophobicContact CB-CG1 4.12Å; L145-I162 HydrophobicContact CD1-CD1 4.35Å; L145-I162 HydrophobicContact CD2-CD1 3.26Å; L145-I162 HydrophobicContact CG-CD1 4.41Å; D160-I162 PolarHBondContact O-N 2.86Å; I162-L190 HydrophobicContact CG2-CD2 4.33Å
163	S	90.4	Very high	85.4	Confident	10 Å²	10	42.1 Å²	42.1	7%	0.07	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.7	155.6	-178	-154.4	0	0	0	0	113.5	F65 I66 Q186 L190	F65-S163 CarbonylContact C-O 3.53Å; F65-S163 WeakPolarHBondContact CA-O 3.25Å; I66-S163 PolarHBondContact N-O 2.74Å; I66-S163 PolarHBondContact O-N 3.37Å; S163-Q186 PolarHBondContact OG-NE2 2.59Å; S163-L190 VanDerWaalsContact CB-CD2 3.45Å
164	Y	91.5	Very high	85.4	Confident	38 Å²	38	38.1 Å²	38.1	15%	0.149	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	134	168.8	-68.3	-83.6	0	0	0	110.3	C64 F65 L155 I161 P455 R459	C64-Y164 WeakPolarHBondContact O-CA 3.28Å; F65-Y164 HydrophobicContact CB-CD1 4.04Å; F65-Y164 HydrophobicContact CB-CE1 4.24Å; L155-Y164 HydrophobicContact CD1-CE1 4.32Å; I161-Y164 HydrophobicContact CD1-CE1 4.12Å; I161-Y164 HydrophobicContact CD1-CE2 4.38Å; I161-Y164 WeakPolarHBondContact CD1-OH 3.37Å; I161-Y164 HydrophobicContact CG2-CD2 4.19Å; I161-Y164 HydrophobicContact CG2-CE2 3.92Å; Y164-P455 HydrophobicContact CD1-CG 4.35Å; Y164-P455 HydrophobicContact CD2-CB 4.15Å; Y164-P455 HydrophobicContact CD2-CG 4.29Å; Y164-P455 HydrophobicContact CE1-CG 4.04Å; Y164-P455 HydrophobicContact CE2-CB 4.01Å; Y164-P455 HydrophobicContact CE2-CG 3.99Å; Y164-P455 HydrophobicContact CG-CG 4.45Å; Y164-R459 PolarHBondContact O-NH1 2.73Å
165	L	92.5	Very high	85.3	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	149.2	173.2	-61.6	176.5	0	0	0	110.1	C64 I66 M147 C167 I180 Y181 L190 F217 I456	C64-L165 HydrophobicContact CB-CB 3.99Å; C64-L165 PolarHBondContact O-N 2.93Å; I66-L165 HydrophobicContact CD1-CD1 4.44Å; I66-L165 HydrophobicContact CD1-CD2 3.98Å; I66-L165 HydrophobicContact CD1-CG 4.39Å; I66-L165 HydrophobicContact CG1-CD1 4.21Å; I66-L165 HydrophobicContact CG1-CD2 4.43Å; I66-L165 HydrophobicContact CG1-CG 4.29Å; M147-L165 HydrophobicContact CG-CD1 3.69Å; M147-L165 HydrophobicContact SD-CD1 4.48Å; L165-C167 PolarHBondContact O-N 2.74Å; L165-I180 HydrophobicContact CB-CG2 3.98Å; L165-I180 HydrophobicContact CD1-CG2 3.75Å; L165-Y181 WeakPolarHBondContact CA-O 3.35Å; L165-L190 HydrophobicContact CD2-CD1 4.02Å; L165-F217 HydrophobicContact CD1-CD1 3.89Å; L165-F217 HydrophobicContact CD1-CD2 4.46Å; L165-F217 HydrophobicContact CD1-CE1 4.18Å; L165-F217 HydrophobicContact CD1-CG 4.07Å; L165-F217 HydrophobicContact CD2-CB 4.25Å; L165-I456 WeakPolarHBondContact O-CD1 3.49Å
166	D	89.2	Confident	85.3	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	111.2	173.4	-74.1	-4.2	0	0	0	108.8	Y25 F58 F179 I180 Y181 R278 Y460	Y25-D166 VanDerWaalsContact OH-CB 3.29Å; Y25-D166 WeakPolarHBondContact OH-CB 3.45Å; F58-D166 HydrophobicContact CE1-CB 4.04Å; D166-F179 VanDerWaalsContact O-O 3.13Å; D166-I180 WeakPolarHBondContact O-CA 3.25Å; D166-Y181 PolarHBondContact N-O 2.88Å; D166-Y181 PolarHBondContact O-N 3.37Å; D166-R278 IonicContact OD2-CZ 3.61Å; D166-R278 VanDerWaalsContact OD2-CZ 3.27Å; D166-R278 IonicContact OD2-NH1 2.74Å; D166-R278 PolarHBondContact OD2-NH1 3.09Å; D166-R278 IonicContact OD2-NH2 2.59Å; D166-R278 PolarHBondContact OD2-NH2 2.9Å; D166-Y460 PolarHBondContact OD2-OH 2.87Å
167	C	91.6	Very high	85.4	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.007	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	114.7	172.7	-173	0	0	0	0	108.5	F58 C59 C64 L165 F179	F58-C167 CarbonylContact C-O 3.53Å; F58-C167 WeakPolarHBondContact CA-O 3.09Å; F58-C167 WeakPolarHBondContact CD1-O 3.44Å; C59-C167 HydrophobicContact CB-CB 3.7Å; C59-C167 WeakPolarHBondContact CB-SG 3.32Å; C59-C167 PolarHBondContact N-O 3.43Å; C59-C167 WeakPolarHBondContact SG-CB 3.46Å; C59-C167 PolarHBondContact SG-O 2.73Å; C59-C167 VanDerWaalsContact SG-O 3.35Å; C59-C167 CovalentContact SG-SG 2.03Å; C59-C167 PolarHBondContact SG-SG 3.19Å; C64-C167 HydrophobicContact CB-CB 4.34Å; C64-C167 VanDerWaalsContact SG-SG 3.69Å; L165-C167 PolarHBondContact O-N 2.74Å; C167-F179 CarbonylContact C-O 3.6Å; C167-F179 WeakPolarHBondContact CA-O 3.44Å
168	V	87.4	Confident	85.9	Confident	0 Å²	0	31 Å²	31	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	134.8	-176.5	179.5	0	0	0	0	110.1	P22 Y25 Q57 F58 I170 F179	P22-V168 HydrophobicContact CG-CB 4.42Å; P22-V168 HydrophobicContact CG-CG1 3.65Å; P22-V168 HydrophobicContact CG-CG2 3.81Å; Y25-V168 HydrophobicContact CD2-CG1 4.37Å; Y25-V168 HydrophobicContact CD2-CG2 4.42Å; Y25-V168 HydrophobicContact CE1-CB 4.17Å; Y25-V168 HydrophobicContact CE1-CG2 4.04Å; Y25-V168 HydrophobicContact CE2-CB 4.36Å; Y25-V168 HydrophobicContact CE2-CG1 4.45Å; Y25-V168 HydrophobicContact CE2-CG2 3.71Å; Y25-V168 HydrophobicContact CG-CG1 4.49Å; Y25-V168 VanDerWaalsContact CZ-CG2 3.47Å; Y25-V168 WeakPolarHBondContact OH-CG2 3.28Å; Q57-V168 WeakPolarHBondContact O-CA 3.47Å; F58-V168 HydrophobicContact CD1-CG2 3.76Å; F58-V168 HydrophobicContact CE1-CG2 3.77Å; F58-V168 HydrophobicContact CG-CG2 4.4Å; F58-V168 HydrophobicContact CZ-CG2 4.38Å; V168-I170 HydrophobicContact CG1-CD1 4.09Å; V168-I170 HydrophobicContact CG1-CG1 3.89Å; V168-F179 HydrophobicContact CB-CB 4.28Å; V168-F179 PolarHBondContact N-O 2.99Å; V168-F179 WeakPolarHBondContact O-CD2 3.48Å; V168-F179 PolarHBondContact O-N 2.73Å
169	M	85.7	Confident	86.4	Confident	8 Å²	8	26.1 Å²	26.1	4%	0.039	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	130.1	175	-65.4	171.5	60.2	0	0	109.5	I55 C56 Q57 C59 F176 Y177 L178 W203	I55-M169 HydrophobicContact CD1-CE 4.15Å; I55-M169 HydrophobicContact CG2-CB 4.43Å; C56-M169 VanDerWaalsContact CA-O 3.29Å; C56-M169 WeakPolarHBondContact CA-O 3.24Å; Q57-M169 PolarHBondContact N-O 2.75Å; Q57-M169 VanDerWaalsContact N-O 3.08Å; Q57-M169 PolarHBondContact O-N 2.74Å; C59-M169 HydrophobicContact CB-SD 4.49Å; M169-F176 HydrophobicContact CB-CD2 4.32Å; M169-F176 HydrophobicContact CE-CD1 3.67Å; M169-F176 HydrophobicContact CE-CD2 3.85Å; M169-F176 HydrophobicContact CE-CE1 3.66Å; M169-F176 HydrophobicContact CE-CE2 3.85Å; M169-F176 HydrophobicContact CE-CG 3.77Å; M169-F176 HydrophobicContact CE-CZ 3.76Å; M169-F176 HydrophobicContact CG-CD2 4.08Å; M169-F176 HydrophobicContact CG-CE2 4.2Å; M169-Y177 WeakPolarHBondContact CA-O 3.41Å; M169-L178 HydrophobicContact CG-CD1 3.99Å; M169-W203 HydrophobicContact SD-CH2 3.97Å; M169-W203 HydrophobicContact SD-CZ3 4.17Å
170	I	82.5	Confident	87	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	127.9	175.5	-49.6	174.8	0	0	0	109.6	Y25 P27 A28 V30 L45 I55 C56 V168 F176 Y177 F179	Y25-I170 HydrophobicContact CG-CD1 4.46Å; P27-I170 HydrophobicContact CB-CB 4.09Å; P27-I170 HydrophobicContact CB-CD1 4.15Å; P27-I170 HydrophobicContact CB-CG2 3.73Å; P27-I170 HydrophobicContact CG-CB 4.07Å; P27-I170 HydrophobicContact CG-CD1 3.74Å; P27-I170 HydrophobicContact CG-CG1 4.42Å; P27-I170 HydrophobicContact CG-CG2 4.27Å; A28-I170 HydrophobicContact CB-CD1 4.36Å; V30-I170 HydrophobicContact CG2-CG2 3.84Å; L45-I170 HydrophobicContact CD1-CG2 4.42Å; I55-I170 CarbonylContact O-C 3.53Å; I55-I170 VanDerWaalsContact O-CA 3.32Å; I55-I170 WeakPolarHBondContact O-CA 3.45Å; C56-I170 HydrophobicContact CB-CG2 4.45Å; V168-I170 HydrophobicContact CG1-CD1 4.09Å; V168-I170 HydrophobicContact CG1-CG1 3.89Å; I170-F176 WeakPolarHBondContact O-CA 3.36Å; I170-Y177 PolarHBondContact N-O 2.93Å; I170-Y177 WeakPolarHBondContact O-CD2 3.45Å; I170-Y177 PolarHBondContact O-N 3.44Å; I170-F179 HydrophobicContact CB-CE2 4.18Å; I170-F179 HydrophobicContact CD1-CD2 4.17Å; I170-F179 HydrophobicContact CD1-CE2 3.89Å; I170-F179 HydrophobicContact CG1-CD2 4.3Å; I170-F179 HydrophobicContact CG1-CE2 4.03Å
171	G	79.1	Confident	87.4	Confident	7 Å²	7	18.9 Å²	18.9	7%	0.072	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	147.2	-130.4	-175.6	0	0	0	0	0	111	P54 I55	P54-G171 CarbonylContact C-O 3.51Å; P54-G171 WeakPolarHBondContact CA-O 3.25Å; I55-G171 PolarHBondContact N-O 2.96Å; I55-G171 PolarHBondContact O-N 2.87Å
172	N	78.3	Confident	87.4	Confident	43 Å²	43	19.4 Å²	19.4	23%	0.23	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	166.7	177	-62.8	-24.9	0	0	0	110.2	D174 Q175	N172-D174 PolarHBondContact O-N 3.35Å; N172-D174 VanDerWaalsContact O-N 3.08Å; N172-Q175 PolarHBondContact N-O 3.03Å; N172-Q175 CarbonylContact O-C 3.58Å; N172-Q175 PolarHBondContact O-N 3.27Å; N172-Q175 VanDerWaalsContact O-N 3.11Å; N172-Q175 VanDerWaalsContact O-O 3.04Å
173	N	76.4	Confident	87.2	Confident	74 Å²	74	17.1 Å²	17.1	40%	0.396	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49	-37.9	-178.2	-77.6	-24.9	0	0	0	115.1	I55 N208	I55-N173 HydrophobicContact CD1-CB 4.28Å; I55-N173 WeakPolarHBondContact CD1-OD1 3.19Å; I55-N173 VanDerWaalsContact CG1-OD1 3.25Å; I55-N173 WeakPolarHBondContact CG1-OD1 3.28Å; N173-N208 PolarHBondContact O-ND2 3.18Å; N173-N208 PolarHBondContact O-OD1 3.2Å
174	D	83.3	Confident	86.3	Confident	51 Å²	51	24 Å²	24	27%	0.273	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98	-19.6	-177.6	-50.7	-16.6	0	0	0	112.9	K52 N172 N208 E209	K52-D174 VanDerWaalsContact CD-OD2 3.24Å; K52-D174 WeakPolarHBondContact CD-OD2 3.43Å; K52-D174 WeakPolarHBondContact CE-OD2 3.16Å; K52-D174 IonicContact NZ-OD1 3.45Å; K52-D174 PolarHBondContact NZ-OD1 3.34Å; K52-D174 IonicContact NZ-OD2 2.65Å; K52-D174 PolarHBondContact NZ-OD2 3.32Å; N172-D174 PolarHBondContact O-N 3.35Å; N172-D174 VanDerWaalsContact O-N 3.08Å; D174-N208 CarbonylContact O-C 3.55Å; D174-N208 WeakPolarHBondContact O-CA 3.37Å; D174-E209 PolarHBondContact O-N 3.46Å
175	Q	84.1	Confident	85.4	Confident	79 Å²	79	28.9 Å²	28.9	37%	0.369	14%	0.135	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	112.9	-171.9	-70.7	-175	-20.3	0	0	109.6	N172 E209 L211	N172-Q175 PolarHBondContact N-O 3.03Å; N172-Q175 CarbonylContact O-C 3.58Å; N172-Q175 PolarHBondContact O-N 3.27Å; N172-Q175 VanDerWaalsContact O-N 3.11Å; N172-Q175 VanDerWaalsContact O-O 3.04Å; Q175-E209 WeakPolarHBondContact CA-O 3.42Å; Q175-E209 HydrophobicContact CG-CB 4.13Å; Q175-E209 HydrophobicContact CG-CG 4.36Å; Q175-E209 PolarHBondContact NE2-OE2 2.91Å; Q175-L211 HydrophobicContact CB-CD1 4.07Å; Q175-L211 HydrophobicContact CB-CD2 4.32Å; Q175-L211 HydrophobicContact CB-CG 4.18Å; Q175-L211 HydrophobicContact CG-CD2 4.46Å
176	F	85.4	Confident	84.2	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	161.2	-175.7	61	-92.5	0	0	0	113.4	M169 I170 L178 I204 N208 E209 L210 L211	M169-F176 HydrophobicContact CB-CD2 4.32Å; M169-F176 HydrophobicContact CE-CD1 3.67Å; M169-F176 HydrophobicContact CE-CD2 3.85Å; M169-F176 HydrophobicContact CE-CE1 3.66Å; M169-F176 HydrophobicContact CE-CE2 3.85Å; M169-F176 HydrophobicContact CE-CG 3.77Å; M169-F176 HydrophobicContact CE-CZ 3.76Å; M169-F176 HydrophobicContact CG-CD2 4.08Å; M169-F176 HydrophobicContact CG-CE2 4.2Å; I170-F176 WeakPolarHBondContact O-CA 3.36Å; F176-L178 HydrophobicContact CD2-CB 4.47Å; F176-L178 HydrophobicContact CE2-CB 4.28Å; F176-I204 HydrophobicContact CZ-CD1 4.29Å; F176-I204 HydrophobicContact CZ-CG1 4.42Å; F176-I204 HydrophobicContact CZ-CG2 4.18Å; F176-N208 HydrophobicContact CE1-CB 3.96Å; F176-E209 PolarHBondContact N-O 3.4Å; F176-E209 VanDerWaalsContact N-O 3.16Å; F176-L210 HydrophobicContact CD2-CD1 4.1Å; F176-L210 HydrophobicContact CE2-CD1 3.8Å; F176-L211 PolarHBondContact O-N 3.32Å
177	Y	87.9	Confident	83.3	Confident	2 Å²	2	41.9 Å²	41.9	1%	0.008	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	135.8	168	-59.3	-78.6	0	0	0	109.5	W26 L45 M169 I170 F179 L211 Y239 E293	W26-Y177 HydrophobicContact CH2-CD1 4.41Å; W26-Y177 HydrophobicContact CH2-CE1 4.3Å; W26-Y177 HydrophobicContact CH2-CE2 4.48Å; W26-Y177 HydrophobicContact CZ2-CD1 4.32Å; L45-Y177 HydrophobicContact CD2-CE2 4.1Å; M169-Y177 WeakPolarHBondContact CA-O 3.41Å; I170-Y177 PolarHBondContact N-O 2.93Å; I170-Y177 WeakPolarHBondContact O-CD2 3.45Å; I170-Y177 PolarHBondContact O-N 3.44Å; Y177-F179 VanDerWaalsContact CB-CE2 3.5Å; Y177-F179 HydrophobicContact CG-CZ 4.47Å; Y177-L211 HydrophobicContact CD1-CB 3.84Å; Y177-L211 HydrophobicContact CE1-CB 3.48Å; Y177-L211 VanDerWaalsContact CE1-CB 3.48Å; Y177-L211 HydrophobicContact CE1-CD1 4.45Å; Y177-L211 HydrophobicContact CE2-CB 4.37Å; Y177-L211 HydrophobicContact CE2-CD1 3.99Å; Y177-L211 HydrophobicContact CG-CB 4.43Å; Y177-Y239 HydrophobicContact CD1-CD1 4.34Å; Y177-Y239 AromaticContact CD1-CE1 3.42Å; Y177-Y239 HydrophobicContact CD1-CE1 3.42Å; Y177-Y239 VanDerWaalsContact CD1-CE1 3.42Å; Y177-Y239 HydrophobicContact CE1-CD1 4.07Å; Y177-Y239 AromaticContact CE1-CE1 3.49Å; Y177-Y239 HydrophobicContact CE1-CE1 3.49Å; Y177-Y239 VanDerWaalsContact CE1-CE1 3.49Å; Y177-E293 PolarHBondContact OH-OE2 3.09Å
178	L	92.6	Very high	82.6	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	126.2	-179.6	-174.1	65.4	0	0	0	111	M169 F176 I180 L201 W203 I204 L210 G212 L213 E214	M169-L178 HydrophobicContact CG-CD1 3.99Å; F176-L178 HydrophobicContact CD2-CB 4.47Å; F176-L178 HydrophobicContact CE2-CB 4.28Å; L178-I180 HydrophobicContact CD2-CD1 4.29Å; L178-I180 HydrophobicContact CG-CG1 4.33Å; L178-L201 HydrophobicContact CD2-CD2 3.64Å; L178-W203 HydrophobicContact CD1-CH2 4.15Å; L178-W203 HydrophobicContact CD1-CZ2 4.03Å; L178-W203 HydrophobicContact CD2-CZ2 4.02Å; L178-I204 HydrophobicContact CD2-CD1 4.24Å; L178-L210 HydrophobicContact CB-CD1 3.46Å; L178-L210 VanDerWaalsContact CB-CD1 3.46Å; L178-L210 HydrophobicContact CD2-CD1 4.48Å; L178-G212 PolarHBondContact N-O 2.86Å; L178-L213 HydrophobicContact CB-CD1 4.23Å; L178-L213 HydrophobicContact CD2-CD1 3.95Å; L178-L213 HydrophobicContact CG-CD1 4.28Å; L178-E214 PolarHBondContact O-N 3.3Å
179	F	92.7	Very high	82.4	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	119.8	179.3	-54	-85.7	0	0	0	109.3	Y25 W26 P27 D166 C167 V168 I170 Y177 Y181 E214	Y25-F179 HydrophobicContact CD1-CB 3.64Å; Y25-F179 HydrophobicContact CD1-CD1 4.07Å; Y25-F179 HydrophobicContact CD1-CD2 4.27Å; Y25-F179 AromaticContact CD1-CG 3.71Å; Y25-F179 HydrophobicContact CD1-CG 3.71Å; Y25-F179 HydrophobicContact CE1-CB 3.63Å; Y25-F179 HydrophobicContact CE1-CG 4.23Å; W26-F179 AromaticContact CD1-CE1 3.82Å; W26-F179 AromaticContact CE2-CE1 3.97Å; W26-F179 AromaticContact CE2-CZ 3.98Å; W26-F179 HydrophobicContact CZ2-CE1 4.46Å; W26-F179 HydrophobicContact CZ2-CZ 4.17Å; W26-F179 AromaticContact NE1-CE1 3.31Å; W26-F179 VanDerWaalsContact NE1-CE1 3.31Å; W26-F179 AromaticContact NE1-CZ 3.8Å; P27-F179 HydrophobicContact CG-CE1 4.13Å; P27-F179 HydrophobicContact CG-CE2 3.51Å; P27-F179 HydrophobicContact CG-CZ 3.16Å; D166-F179 VanDerWaalsContact O-O 3.13Å; C167-F179 CarbonylContact C-O 3.6Å; C167-F179 WeakPolarHBondContact CA-O 3.44Å; V168-F179 HydrophobicContact CB-CB 4.28Å; V168-F179 PolarHBondContact N-O 2.99Å; V168-F179 WeakPolarHBondContact O-CD2 3.48Å; V168-F179 PolarHBondContact O-N 2.73Å; I170-F179 HydrophobicContact CB-CE2 4.18Å; I170-F179 HydrophobicContact CD1-CD2 4.17Å; I170-F179 HydrophobicContact CD1-CE2 3.89Å; I170-F179 HydrophobicContact CG1-CD2 4.3Å; I170-F179 HydrophobicContact CG1-CE2 4.03Å; Y177-F179 VanDerWaalsContact CB-CE2 3.5Å; Y177-F179 HydrophobicContact CG-CZ 4.47Å; F179-Y181 HydrophobicContact CB-CD2 3.85Å; F179-Y181 HydrophobicContact CB-CE2 3.87Å; F179-Y181 AromaticContact CD1-CE2 3.98Å; F179-Y181 HydrophobicContact CD1-CE2 3.98Å; F179-Y181 HydrophobicContact CG-CE2 4.43Å; F179-E214 HydrophobicContact CD1-CB 3.85Å; F179-E214 HydrophobicContact CD1-CG 3.9Å; F179-E214 VanDerWaalsContact CD1-OE2 3.31Å; F179-E214 WeakPolarHBondContact CD1-OE2 2.91Å; F179-E214 HydrophobicContact CE1-CB 4.35Å; F179-E214 HydrophobicContact CE1-CG 3.89Å; F179-E214 WeakPolarHBondContact CE1-OE2 2.92Å
180	I	94.9	Very high	82.5	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	110.1	173.3	-57.3	173.8	0	0	0	107.6	C64 L165 D166 L178 F200 E214 L215 G216 F217	C64-I180 HydrophobicContact CB-CG2 4.22Å; L165-I180 HydrophobicContact CB-CG2 3.98Å; L165-I180 HydrophobicContact CD1-CG2 3.75Å; D166-I180 WeakPolarHBondContact O-CA 3.25Å; L178-I180 HydrophobicContact CD2-CD1 4.29Å; L178-I180 HydrophobicContact CG-CG1 4.33Å; I180-F200 HydrophobicContact CD1-CD2 3.96Å; I180-F200 HydrophobicContact CD1-CE2 3.85Å; I180-E214 PolarHBondContact N-O 2.94Å; I180-L215 HydrophobicContact CB-CD2 4.24Å; I180-L215 HydrophobicContact CD1-CD2 4.06Å; I180-G216 PolarHBondContact O-N 2.95Å; I180-F217 HydrophobicContact CB-CE1 4.35Å; I180-F217 HydrophobicContact CG2-CD1 4.05Å; I180-F217 HydrophobicContact CG2-CE1 3.84Å
181	Y	92.8	Very high	82.9	Confident	5 Å²	5	54.4 Å²	54.4	2%	0.02	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	154.4	-171	-84.6	-101.1	0	0	0	113	Y25 L165 D166 F179 E214 L276 R278	Y25-Y181 AromaticContact CE1-CD2 3.91Å; Y25-Y181 HydrophobicContact CE1-CD2 3.91Å; Y25-Y181 HydrophobicContact CE1-CE2 4.4Å; Y25-Y181 HydrophobicContact CE1-CG 4.34Å; L165-Y181 WeakPolarHBondContact CA-O 3.35Å; D166-Y181 PolarHBondContact N-O 2.88Å; D166-Y181 PolarHBondContact O-N 3.37Å; F179-Y181 HydrophobicContact CB-CD2 3.85Å; F179-Y181 HydrophobicContact CB-CE2 3.87Å; F179-Y181 AromaticContact CD1-CE2 3.98Å; F179-Y181 HydrophobicContact CD1-CE2 3.98Å; F179-Y181 HydrophobicContact CG-CE2 4.43Å; Y181-E214 HydrophobicContact CE2-CB 3.81Å; Y181-E214 PolarHBondContact OH-OE2 3.26Å; Y181-L276 HydrophobicContact CE1-CG 4.08Å; Y181-L276 VanDerWaalsContact OH-CG 3.25Å; Y181-L276 WeakPolarHBondContact OH-CG 3.32Å; Y181-R278 HydrophobicContact CD1-CB 4.4Å; Y181-R278 HydrophobicContact CD1-CG 3.38Å; Y181-R278 HydrophobicContact CD2-CG 4.35Å; Y181-R278 HydrophobicContact CE1-CB 4.22Å; Y181-R278 HydrophobicContact CE1-CG 3.67Å; Y181-R278 HydrophobicContact CG-CG 3.74Å
182	E	90	Very high	83.7	Confident	33 Å²	33	54.9 Å²	54.9	15%	0.154	27%	0.272	C	S	.	.			trans	-57.3	136.4	162.9	-60.1	-176.3	179.1	0	0	109.4	L190 G216 F217 R218 R278	E182-L190 HydrophobicContact CB-CD1 4.14Å; E182-L190 HydrophobicContact CG-CD1 3.9Å; E182-G216 PolarHBondContact N-O 2.93Å; E182-F217 HydrophobicContact CG-CB 3.57Å; E182-R218 PolarHBondContact OE1-N 2.94Å; E182-R278 PolarHBondContact O-NH2 3.02Å
183	P	83	Confident	84.5	Confident	9 Å²	9	52.9 Å²	52.9	6%	0.058	26%	0.261	C	S	.	.			trans	-65	147.8	-179.2	28.9	-36.7	0	0	0	112.3	F185 Q186 R278	P183-F185 PolarHBondContact O-N 3.39Å; P183-Q186 VanDerWaalsContact CG-CD 3.42Å; P183-Q186 HydrophobicContact CG-CG 3.74Å; P183-R278 VanDerWaalsContact CA-NH2 3.25Å
184	R	72.5	Confident	85.4	Confident	154 Å²	154	51.1 Å²	51.1	58%	0.581	25%	0.252	S	S	*	.	S	Bend	trans	-66.5	-37.7	-171.4	-173.3	178.6	-174	-179.6	5.9	113.9	R278	R184-R278 VanDerWaalsContact N-NH2 3.18Å
185	F	70.7	Confident	86	Confident	141 Å²	141	49.2 Å²	49.2	62%	0.618	24%	0.242	S	C	*	.	S	Bend	trans	-111.1	86.2	-173.7	-53.1	-67.1	0	0	0	108.9	P183 Y460	P183-F185 PolarHBondContact O-N 3.39Å; F185-Y460 HydrophobicContact CD2-CE1 4.31Å; F185-Y460 HydrophobicContact CE2-CE1 4.25Å
186	Q	68.9	Low	86.6	Confident	61 Å²	61	45.4 Å²	45.4	29%	0.285	23%	0.225	S	C	.	.			trans	-125.3	141.7	169.9	-87.9	-177.9	-6.2	0	0	110.5	S163 P183 S188 L190	S163-Q186 PolarHBondContact OG-NE2 2.59Å; P183-Q186 VanDerWaalsContact CG-CD 3.42Å; P183-Q186 HydrophobicContact CG-CG 3.74Å; Q186-S188 VanDerWaalsContact C-N 3.31Å; Q186-S188 PolarHBondContact OE1-O 2.89Å; Q186-L190 VanDerWaalsContact OE1-CG 3.23Å
187	E	68.6	Low	87	Confident	211 Å²	211	45.5 Å²	45.5	99%	0.986	23%	0.225	S	C	*	.	S	Bend	trans	-70.4	-30.7	176.5	-64.6	178.1	175.7	0	0	112
188	S	78.5	Confident	87.3	Confident	90 Å²	90	45.7 Å²	45.7	63%	0.629	23%	0.227	S	C	*	.	S	Bend	trans	-132.3	149.1	-178.6	61.1	0	0	0	0	111.6	Q186	Q186-S188 VanDerWaalsContact C-N 3.31Å; Q186-S188 PolarHBondContact OE1-O 2.89Å
189	Q	82.5	Confident	87.3	Confident	117 Å²	117	47 Å²	47	55%	0.547	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-72.1	132	178.9	-161.5	-173.7	16.1	0	0	110.7	R218	Q189-R218 VanDerWaalsContact CG-NH2 3.26Å; Q189-R218 VanDerWaalsContact NE2-CZ 3.29Å
190	L	87.9	Confident	87.4	Confident	8 Å²	8	47.1 Å²	47.1	4%	0.042	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-65.7	130.9	179.5	-73.4	169	0	0	0	112	I66 I162 S163 L165 E182 Q186 R218	I66-L190 HydrophobicContact CD1-CD1 4.11Å; I162-L190 HydrophobicContact CG2-CD2 4.33Å; S163-L190 VanDerWaalsContact CB-CD2 3.45Å; L165-L190 HydrophobicContact CD2-CD1 4.02Å; E182-L190 HydrophobicContact CB-CD1 4.14Å; E182-L190 HydrophobicContact CG-CD1 3.9Å; Q186-L190 VanDerWaalsContact OE1-CG 3.23Å; L190-R218 VanDerWaalsContact O-CZ 3.24Å; L190-R218 PolarHBondContact O-NE 3.11Å; L190-R218 VanDerWaalsContact O-NE 3.11Å; L190-R218 PolarHBondContact O-NH2 3.38Å
191	P	91.2	Very high	87.4	Confident	57 Å²	57	47.1 Å²	47.1	37%	0.37	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-59	152.5	174.7	27.4	-35.9	0	0	0	111.4	L145 V193	L145-P191 HydrophobicContact CD1-CB 3.64Å; L145-P191 HydrophobicContact CD1-CG 3.35Å; P191-V193 PolarHBondContact O-N 2.91Å
192	A	94.7	Very high	87.4	Confident	17 Å²	17	49.6 Å²	49.6	14%	0.14	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-64.6	127.5	176.8	0	0	0	0	0	110.6	R218 K220	A192-R218 WeakPolarHBondContact CA-O 3.45Å; A192-R218 HydrophobicContact CB-CB 3.96Å; A192-K220 HydrophobicContact CB-CG 3.99Å
193	V	96.2	Very high	87.4	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.006	26%	0.259	C	S	.	.	B	Isolated β-bridge	trans	-65.2	132.9	178.2	177.9	0	0	0	0	109.6	I66 M147 P191 C195 I196 F217 R218 M219 K220	I66-V193 HydrophobicContact CD1-CG2 3.66Å; I66-V193 HydrophobicContact CG1-CG2 3.93Å; I66-V193 HydrophobicContact CG2-CG2 4.28Å; M147-V193 HydrophobicContact CB-CG1 3.74Å; M147-V193 HydrophobicContact CB-CG2 4.22Å; P191-V193 PolarHBondContact O-N 2.91Å; V193-C195 WeakPolarHBondContact CG1-O 3.33Å; V193-I196 HydrophobicContact CG1-CG1 4.17Å; V193-F217 HydrophobicContact CB-CE2 4.5Å; V193-F217 HydrophobicContact CG2-CD2 3.98Å; V193-F217 HydrophobicContact CG2-CE2 4.15Å; V193-R218 PolarHBondContact N-O 2.78Å; V193-M219 CarbonylContact O-C 3.44Å; V193-M219 WeakPolarHBondContact O-CA 3.48Å; V193-K220 PolarHBondContact O-N 3.4Å
194	D	95.5	Very high	87.8	Confident	38 Å²	38	50.7 Å²	50.7	20%	0.203	26%	0.258	C	S	.	.	S	Bend	trans	-75.3	-47	-179.2	-65.3	-61.2	0	0	0	111.5	V144 L145 K220 T221	V144-D194 HydrophobicContact CG1-CB 3.6Å; L145-D194 WeakPolarHBondContact CB-OD2 3.19Å; L145-D194 PolarHBondContact N-OD2 2.93Å; L145-D194 WeakPolarHBondContact O-CB 3.45Å; L145-D194 PolarHBondContact O-N 2.99Å; D194-K220 VanDerWaalsContact OD1-CD 3.24Å; D194-K220 WeakPolarHBondContact OD1-CD 3.29Å; D194-K220 WeakPolarHBondContact OD1-CE 3.24Å; D194-K220 IonicContact OD1-NZ 2.65Å; D194-K220 PolarHBondContact OD1-NZ 2.93Å; D194-T221 PolarHBondContact O-OG1 3.37Å
195	C	94.6	Very high	88.6	Confident	10 Å²	10	49.9 Å²	49.9	7%	0.068	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	153.4	172.8	81.8	0	0	0	0	113.4	L145 Y146 M147 V193 C343	L145-C195 PolarHBondContact O-N 2.73Å; Y146-C195 WeakPolarHBondContact CA-O 3.21Å; Y146-C195 WeakPolarHBondContact CD1-SG 3.47Å; Y146-C195 WeakPolarHBondContact CE1-SG 3.23Å; M147-C195 PolarHBondContact N-O 3.36Å; V193-C195 WeakPolarHBondContact CG1-O 3.33Å; C195-C343 VanDerWaalsContact C-SG 3.53Å; C195-C343 HydrophobicContact CB-CB 3.74Å; C195-C343 WeakPolarHBondContact CB-SG 3.32Å; C195-C343 VanDerWaalsContact SG-CA 3.51Å; C195-C343 WeakPolarHBondContact SG-CB 3.42Å; C195-C343 CovalentContact SG-SG 2.06Å; C195-C343 PolarHBondContact SG-SG 3Å
196	I	96.7	Very high	89.3	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	130.1	179.5	-60	163.9	0	0	0	107.8	M147 V193 A198 F200 F217 M219 P223 P224 C343	M147-I196 HydrophobicContact CB-CG1 4.2Å; M147-I196 HydrophobicContact CE-CB 4.24Å; M147-I196 HydrophobicContact CE-CD1 4.26Å; M147-I196 HydrophobicContact CE-CG1 4.04Å; M147-I196 HydrophobicContact CE-CG2 3.25Å; M147-I196 HydrophobicContact SD-CG2 4.11Å; V193-I196 HydrophobicContact CG1-CG1 4.17Å; I196-A198 PolarHBondContact O-N 2.9Å; I196-F200 HydrophobicContact CG2-CD1 4.14Å; I196-F200 HydrophobicContact CG2-CG 4.35Å; I196-F217 HydrophobicContact CD1-CE2 3.8Å; I196-F217 HydrophobicContact CD1-CZ 3.74Å; I196-F217 HydrophobicContact CG1-CE2 4.2Å; I196-F217 HydrophobicContact CG1-CZ 4.32Å; I196-M219 HydrophobicContact CD1-CB 4.06Å; I196-M219 HydrophobicContact CD1-CE 3.77Å; I196-M219 HydrophobicContact CD1-CG 4.43Å; I196-M219 HydrophobicContact CD1-SD 3.5Å; I196-M219 VanDerWaalsContact CD1-SD 3.5Å; I196-P223 HydrophobicContact CB-CB 4.23Å; I196-P223 HydrophobicContact CB-CG 3.96Å; I196-P223 HydrophobicContact CD1-CG 3.76Å; I196-P223 HydrophobicContact CG1-CG 4.48Å; I196-P223 HydrophobicContact CG2-CB 4.11Å; I196-P223 HydrophobicContact CG2-CG 3.78Å; I196-P224 WeakPolarHBondContact O-CD 3.22Å; I196-C343 PolarHBondContact O-SG 3.12Å
197	D	94.7	Very high	90	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.005	28%	0.278	C	S	.	.			trans	-54.6	124.2	173.9	179.9	14.2	0	0	0	109.8	M147 S148 D199 F200 F345 R346	M147-D197 WeakPolarHBondContact O-CB 3.49Å; M147-D197 PolarHBondContact O-N 3.43Å; S148-D197 WeakPolarHBondContact OG-CB 3.42Å; S148-D197 PolarHBondContact OG-OD2 3.21Å; D197-D199 PolarHBondContact O-N 3.48Å; D197-D199 PolarHBondContact OD1-N 3.48Å; D197-F200 WeakPolarHBondContact O-CB 3.38Å; D197-F200 WeakPolarHBondContact O-CD1 3.25Å; D197-F200 PolarHBondContact O-N 2.81Å; D197-F345 HydrophobicContact CB-CB 4.39Å; D197-F345 HydrophobicContact CB-CD1 3.79Å; D197-F345 HydrophobicContact CB-CG 4.41Å; D197-R346 IonicContact OD1-NE 3.76Å; D197-R346 IonicContact OD2-CZ 3.06Å; D197-R346 IonicContact OD2-NE 3.53Å; D197-R346 PolarHBondContact OD2-NE 3.34Å; D197-R346 IonicContact OD2-NH2 3.27Å
198	A	93.9	Very high	91	Very high	6 Å²	6	42.8 Å²	42.8	5%	0.05	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-25.1	175.9	0	0	0	0	0	111.5	I196 F200 Y229 Y230 A339	I196-A198 PolarHBondContact O-N 2.9Å; A198-F200 VanDerWaalsContact C-N 3.33Å; A198-F200 PolarHBondContact O-N 2.97Å; A198-Y229 HydrophobicContact CB-CD1 3.97Å; A198-Y229 HydrophobicContact CB-CD2 4.45Å; A198-Y229 HydrophobicContact CB-CE1 3.89Å; A198-Y229 HydrophobicContact CB-CE2 4.39Å; A198-Y229 HydrophobicContact CB-CG 4.25Å; A198-Y229 VanDerWaalsContact O-CD1 3.28Å; A198-Y229 WeakPolarHBondContact O-CD1 3.4Å; A198-Y229 WeakPolarHBondContact O-CE1 3.45Å; A198-Y230 WeakPolarHBondContact O-CE2 3.46Å; A198-A339 HydrophobicContact CB-CB 3.63Å
199	D	93.5	Very high	91.5	Very high	29 Å²	29	41.5 Å²	41.5	16%	0.155	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	7.6	-179.7	-72.5	-31.8	0	0	0	114.7	D197 L201 A202 Y229 Y230 R346	D197-D199 PolarHBondContact O-N 3.48Å; D197-D199 PolarHBondContact OD1-N 3.48Å; D199-L201 PolarHBondContact O-N 3.37Å; D199-A202 HydrophobicContact CB-CB 4.41Å; D199-A202 WeakPolarHBondContact O-CB 3.32Å; D199-A202 PolarHBondContact O-N 2.86Å; D199-Y229 WeakPolarHBondContact OD1-CE1 3.41Å; D199-Y229 VanDerWaalsContact OD1-CZ 3.28Å; D199-Y229 PolarHBondContact OD1-OH 3.18Å; D199-Y230 VanDerWaalsContact CA-OH 3.22Å; D199-Y230 WeakPolarHBondContact CA-OH 3.47Å; D199-Y230 PolarHBondContact O-OH 3.41Å; D199-Y230 PolarHBondContact OD1-OH 2.92Å; D199-R346 IonicContact OD2-NE 2.64Å
200	F	95.2	Very high	91.9	Very high	2 Å²	2	36 Å²	36	1%	0.009	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-15.7	-174.7	82.1	-74.8	0	0	0	115.5	M147 C149 I180 I196 D197 A198 W203 L213 L215 P223 L226	M147-F200 HydrophobicContact CE-CD2 4.23Å; M147-F200 HydrophobicContact CE-CG 4.49Å; C149-F200 HydrophobicContact CB-CB 4.42Å; C149-F200 WeakPolarHBondContact CB-O 3.13Å; I180-F200 HydrophobicContact CD1-CD2 3.96Å; I180-F200 HydrophobicContact CD1-CE2 3.85Å; I196-F200 HydrophobicContact CG2-CD1 4.14Å; I196-F200 HydrophobicContact CG2-CG 4.35Å; D197-F200 WeakPolarHBondContact O-CB 3.38Å; D197-F200 WeakPolarHBondContact O-CD1 3.25Å; D197-F200 PolarHBondContact O-N 2.81Å; A198-F200 VanDerWaalsContact C-N 3.33Å; A198-F200 PolarHBondContact O-N 2.97Å; F200-W203 PolarHBondContact O-NE1 3.38Å; F200-L213 HydrophobicContact CZ-CD2 4.19Å; F200-L215 HydrophobicContact CE2-CD2 4.03Å; F200-L215 HydrophobicContact CZ-CD2 4.34Å; F200-P223 HydrophobicContact CE1-CB 4.02Å; F200-P223 HydrophobicContact CE1-CG 3.99Å; F200-P223 HydrophobicContact CZ-CG 4.35Å; F200-L226 HydrophobicContact CE1-CD1 4.27Å; F200-L226 HydrophobicContact CZ-CD1 4.32Å
201	L	94.5	Very high	91.9	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	4	175.1	-59.6	174.9	0	0	0	113.4	L178 D199 W203 I204 L213 Y230 I233 M234	L178-L201 HydrophobicContact CD2-CD2 3.64Å; D199-L201 PolarHBondContact O-N 3.37Å; L201-W203 PolarHBondContact O-N 2.64Å; L201-I204 HydrophobicContact CB-CD1 4.23Å; L201-I204 HydrophobicContact CD2-CD1 3.89Å; L201-I204 WeakPolarHBondContact O-CB 3.17Å; L201-I204 PolarHBondContact O-N 2.76Å; L201-L213 HydrophobicContact CD1-CD2 4.33Å; L201-L213 HydrophobicContact CD2-CD1 4.47Å; L201-Y230 HydrophobicContact CB-CD2 3.86Å; L201-Y230 HydrophobicContact CB-CE2 3.67Å; L201-Y230 HydrophobicContact CD1-CD2 4.21Å; L201-Y230 HydrophobicContact CG-CD2 4.48Å; L201-Y230 HydrophobicContact CG-CE2 4.49Å; L201-I233 HydrophobicContact CB-CD1 4.1Å; L201-M234 HydrophobicContact CD1-CE 3.97Å
202	A	91.8	Very high	91.8	Very high	57 Å²	57	33.4 Å²	33.4	47%	0.471	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-25.3	-174.9	0	0	0	0	0	113.6	D199 I204 Y230	D199-A202 HydrophobicContact CB-CB 4.41Å; D199-A202 WeakPolarHBondContact O-CB 3.32Å; D199-A202 PolarHBondContact O-N 2.86Å; A202-I204 VanDerWaalsContact C-N 3.28Å; A202-I204 PolarHBondContact O-N 3.33Å; A202-Y230 VanDerWaalsContact CA-OH 3.22Å; A202-Y230 WeakPolarHBondContact CA-OH 3.19Å; A202-Y230 VanDerWaalsContact CB-OH 3.24Å; A202-Y230 WeakPolarHBondContact CB-OH 3.32Å; A202-Y230 PolarHBondContact N-OH 2.02Å; A202-Y230 VanDerWaalsContact N-OH 3.09Å
203	W	90.9	Very high	91.8	Very high	55 Å²	55	32.6 Å²	32.6	21%	0.208	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-17	-179.2	64	-94.3	0	0	0	113.4	C59 V62 M169 L178 F200 L201 K205	C59-W203 HydrophobicContact CB-CH2 4.42Å; V62-W203 HydrophobicContact CB-CD2 4.39Å; V62-W203 HydrophobicContact CG1-CD2 4.11Å; V62-W203 HydrophobicContact CG1-CG 4.12Å; V62-W203 HydrophobicContact CG1-CZ2 4.47Å; V62-W203 HydrophobicContact CG2-CB 4.02Å; V62-W203 HydrophobicContact CG2-CD2 3.6Å; V62-W203 HydrophobicContact CG2-CE3 3.68Å; V62-W203 HydrophobicContact CG2-CG 3.75Å; V62-W203 HydrophobicContact CG2-CZ3 4.32Å; M169-W203 HydrophobicContact SD-CH2 3.97Å; M169-W203 HydrophobicContact SD-CZ3 4.17Å; L178-W203 HydrophobicContact CD1-CH2 4.15Å; L178-W203 HydrophobicContact CD1-CZ2 4.03Å; L178-W203 HydrophobicContact CD2-CZ2 4.02Å; F200-W203 PolarHBondContact O-NE1 3.38Å; L201-W203 PolarHBondContact O-N 2.64Å; W203-K205 PolarHBondContact O-N 3.28Å
204	I	91.2	Very high	91.7	Very high	9 Å²	9	32.6 Å²	32.6	5%	0.046	17%	0.171	C	C	.	.	S	Bend	trans	-69.9	125.4	178.2	-61.4	-179.7	0	0	0	109	F176 L178 L201 A202 N208 I233	F176-I204 HydrophobicContact CZ-CD1 4.29Å; F176-I204 HydrophobicContact CZ-CG1 4.42Å; F176-I204 HydrophobicContact CZ-CG2 4.18Å; L178-I204 HydrophobicContact CD2-CD1 4.24Å; L201-I204 HydrophobicContact CB-CD1 4.23Å; L201-I204 HydrophobicContact CD2-CD1 3.89Å; L201-I204 WeakPolarHBondContact O-CB 3.17Å; L201-I204 PolarHBondContact O-N 2.76Å; A202-I204 VanDerWaalsContact C-N 3.28Å; A202-I204 PolarHBondContact O-N 3.33Å; I204-N208 HydrophobicContact CG2-CB 4.1Å; I204-I233 HydrophobicContact CB-CD1 4.17Å; I204-I233 HydrophobicContact CD1-CD1 4.29Å; I204-I233 HydrophobicContact CG2-CD1 4.38Å
205	K	88.1	Confident	91.8	Very high	138 Å²	138	30.8 Å²	30.8	60%	0.6	16%	0.161	S	C	*	.			trans	-67.7	158.3	-174.9	-59.4	-178.4	178.8	177.8	0	113.5	W203 D207 N208 R232	W203-K205 PolarHBondContact O-N 3.28Å; K205-D207 WeakPolarHBondContact CB-OD1 3.45Å; K205-D207 PolarHBondContact O-N 3.11Å; K205-N208 PolarHBondContact O-N 3.13Å; K205-R232 PolarHBondContact O-NH1 2.96Å
206	N	85.6	Confident	91.8	Very high	141 Å²	141	30.5 Å²	30.5	75%	0.754	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-4.9	-177.6	-76.8	-20.2	0	0	0	115.9	R232	N206-R232 VanDerWaalsContact CA-CZ 3.46Å; N206-R232 PolarHBondContact O-NE 2.78Å; N206-R232 PolarHBondContact O-NH2 3.26Å
207	D	84.9	Confident	91.7	Very high	102 Å²	102	30.5 Å²	30.5	55%	0.545	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.8	-8.9	175.7	50.4	-26.5	0	0	0	112.5	K205	K205-D207 WeakPolarHBondContact CB-OD1 3.45Å; K205-D207 PolarHBondContact O-N 3.11Å
208	N	88.7	Confident	91.7	Very high	21 Å²	21	32.8 Å²	32.8	11%	0.112	17%	0.169	C	C	.	.			trans	-97.1	144.3	-176.3	-65.8	5.9	0	0	0	112.4	N173 D174 F176 I204 K205 R232	N173-N208 PolarHBondContact O-ND2 3.18Å; N173-N208 PolarHBondContact O-OD1 3.2Å; D174-N208 CarbonylContact O-C 3.55Å; D174-N208 WeakPolarHBondContact O-CA 3.37Å; F176-N208 HydrophobicContact CE1-CB 3.96Å; I204-N208 HydrophobicContact CG2-CB 4.1Å; K205-N208 PolarHBondContact O-N 3.13Å; N208-R232 PolarHBondContact O-NH1 2.92Å; N208-R232 PolarHBondContact O-NH2 2.91Å
209	E	88.7	Confident	91.7	Very high	62 Å²	62	32.5 Å²	32.5	29%	0.29	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	128.8	176.4	-46.9	-173.2	150.8	0	0	109.7	D174 Q175 F176 L236	D174-E209 PolarHBondContact O-N 3.46Å; Q175-E209 WeakPolarHBondContact CA-O 3.42Å; Q175-E209 HydrophobicContact CG-CB 4.13Å; Q175-E209 HydrophobicContact CG-CG 4.36Å; Q175-E209 PolarHBondContact NE2-OE2 2.91Å; F176-E209 PolarHBondContact N-O 3.4Å; F176-E209 VanDerWaalsContact N-O 3.16Å; E209-L236 HydrophobicContact CB-CD1 4.22Å; E209-L236 HydrophobicContact CG-CD1 3.79Å
210	L	91.3	Very high	91.9	Very high	1 Å²	1	35 Å²	35	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	112.4	172.7	-176.1	65.3	0	0	0	107.8	F176 L178 G212 L213 I233 T237	F176-L210 HydrophobicContact CD2-CD1 4.1Å; F176-L210 HydrophobicContact CE2-CD1 3.8Å; L178-L210 HydrophobicContact CB-CD1 3.46Å; L178-L210 VanDerWaalsContact CB-CD1 3.46Å; L178-L210 HydrophobicContact CD2-CD1 4.48Å; L210-G212 WeakPolarHBondContact CD1-O 3.42Å; L210-L213 HydrophobicContact CD2-CB 4.08Å; L210-L213 HydrophobicContact CD2-CD1 4.43Å; L210-I233 HydrophobicContact CB-CG2 3.55Å; L210-I233 HydrophobicContact CD2-CG2 3.53Å; L210-I233 HydrophobicContact CG-CG2 4.18Å; L210-T237 WeakPolarHBondContact O-CA 3.09Å; L210-T237 PolarHBondContact O-N 3.34Å; L210-T237 PolarHBondContact O-OG1 2.98Å
211	L	88.3	Confident	91.9	Very high	11 Å²	11	37 Å²	37	6%	0.058	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	-31.4	179.3	-60.1	-175.8	0	0	0	111.8	Q175 F176 Y177 Q238 Y239	Q175-L211 HydrophobicContact CB-CD1 4.07Å; Q175-L211 HydrophobicContact CB-CD2 4.32Å; Q175-L211 HydrophobicContact CB-CG 4.18Å; Q175-L211 HydrophobicContact CG-CD2 4.46Å; F176-L211 PolarHBondContact O-N 3.32Å; Y177-L211 HydrophobicContact CD1-CB 3.84Å; Y177-L211 HydrophobicContact CE1-CB 3.48Å; Y177-L211 VanDerWaalsContact CE1-CB 3.48Å; Y177-L211 HydrophobicContact CE1-CD1 4.45Å; Y177-L211 HydrophobicContact CE2-CB 4.37Å; Y177-L211 HydrophobicContact CE2-CD1 3.99Å; Y177-L211 HydrophobicContact CG-CB 4.43Å; L211-Q238 WeakPolarHBondContact O-CA 3.02Å; L211-Q238 VanDerWaalsContact O-CB 3.24Å; L211-Q238 WeakPolarHBondContact O-CB 2.98Å; L211-Q238 PolarHBondContact O-N 2.91Å; L211-Y239 PolarHBondContact O-N 3.38Å
212	G	89.5	Confident	91.9	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	153.1	176.6	0	0	0	0	0	113.1	L178 L210 Y239	L178-G212 PolarHBondContact N-O 2.86Å; L210-G212 WeakPolarHBondContact CD1-O 3.42Å; G212-Y239 VanDerWaalsContact CA-O 3.22Å; G212-Y239 WeakPolarHBondContact CA-O 3.3Å
213	L	94	Very high	92.1	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	128.1	-176.9	179.4	63.7	0	0	0	110.6	L178 F200 L201 L210 L215 L226 M234 Y239 I240 C241	L178-L213 HydrophobicContact CB-CD1 4.23Å; L178-L213 HydrophobicContact CD2-CD1 3.95Å; L178-L213 HydrophobicContact CG-CD1 4.28Å; F200-L213 HydrophobicContact CZ-CD2 4.19Å; L201-L213 HydrophobicContact CD1-CD2 4.33Å; L201-L213 HydrophobicContact CD2-CD1 4.47Å; L210-L213 HydrophobicContact CD2-CB 4.08Å; L210-L213 HydrophobicContact CD2-CD1 4.43Å; L213-L215 HydrophobicContact CD1-CD2 4Å; L213-L215 HydrophobicContact CD2-CD2 4.48Å; L213-L215 HydrophobicContact CG-CD2 4.21Å; L213-L215 HydrophobicContact CG-CG 4.32Å; L213-L226 HydrophobicContact CD2-CD1 4.22Å; L213-M234 HydrophobicContact CD2-CE 4.24Å; L213-Y239 PolarHBondContact N-O 3.46Å; L213-Y239 VanDerWaalsContact N-O 3.09Å; L213-I240 HydrophobicContact CB-CG1 4.37Å; L213-I240 WeakPolarHBondContact O-CA 3.02Å; L213-C241 PolarHBondContact O-N 2.76Å
214	E	94.7	Very high	92.3	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	123.1	174.4	-62.9	-163.2	-176	0	0	112.1	W26 L178 F179 I180 Y181 Y239 C241 L276	W26-E214 PolarHBondContact NE1-OE1 2.93Å; L178-E214 PolarHBondContact O-N 3.3Å; F179-E214 HydrophobicContact CD1-CB 3.85Å; F179-E214 HydrophobicContact CD1-CG 3.9Å; F179-E214 VanDerWaalsContact CD1-OE2 3.31Å; F179-E214 WeakPolarHBondContact CD1-OE2 2.91Å; F179-E214 HydrophobicContact CE1-CB 4.35Å; F179-E214 HydrophobicContact CE1-CG 3.89Å; F179-E214 WeakPolarHBondContact CE1-OE2 2.92Å; I180-E214 PolarHBondContact N-O 2.94Å; Y181-E214 HydrophobicContact CE2-CB 3.81Å; Y181-E214 PolarHBondContact OH-OE2 3.26Å; E214-Y239 HydrophobicContact CG-CE2 3.76Å; E214-Y239 WeakPolarHBondContact CG-OH 3.18Å; E214-Y239 WeakPolarHBondContact OE1-CE2 3.34Å; E214-Y239 PolarHBondContact OE1-OH 2.77Å; E214-C241 WeakPolarHBondContact CA-O 3.32Å; E214-C241 HydrophobicContact CG-CB 4.1Å; E214-L276 HydrophobicContact CB-CD2 4.07Å
215	L	96.5	Very high	92.5	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	87.1	175.8	-54.1	-179.6	0	0	0	108.7	I180 F200 L213 F217 M219 P223 C241 I242 D243	I180-L215 HydrophobicContact CB-CD2 4.24Å; I180-L215 HydrophobicContact CD1-CD2 4.06Å; F200-L215 HydrophobicContact CE2-CD2 4.03Å; F200-L215 HydrophobicContact CZ-CD2 4.34Å; L213-L215 HydrophobicContact CD1-CD2 4Å; L213-L215 HydrophobicContact CD2-CD2 4.48Å; L213-L215 HydrophobicContact CG-CD2 4.21Å; L213-L215 HydrophobicContact CG-CG 4.32Å; L215-F217 HydrophobicContact CB-CE1 3.84Å; L215-F217 HydrophobicContact CB-CZ 4.29Å; L215-F217 HydrophobicContact CD2-CE1 4.05Å; L215-F217 HydrophobicContact CG-CE1 4.46Å; L215-F217 PolarHBondContact O-N 3.41Å; L215-M219 HydrophobicContact CB-CE 3.6Å; L215-M219 HydrophobicContact CD1-CE 4.11Å; L215-P223 HydrophobicContact CD1-CG 3.94Å; L215-C241 PolarHBondContact N-O 3.2Å; L215-I242 HydrophobicContact CD1-CG1 4.43Å; L215-D243 PolarHBondContact O-N 3.42Å
216	G	94.5	Very high	92.8	Very high	5 Å²	5	26.2 Å²	26.2	5%	0.052	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	48.9	-175.8	0	0	0	0	0	113.5	I180 E182	I180-G216 PolarHBondContact O-N 2.95Å; E182-G216 PolarHBondContact N-O 2.93Å
217	F	94.4	Very high	93.1	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.099	C	C	.	.	S	Bend	trans	-141.6	152.8	173.8	61	-87.1	0	0	0	109.8	M147 L165 I180 E182 V193 I196 L215 M219	M147-F217 HydrophobicContact CE-CE1 3.79Å; M147-F217 HydrophobicContact CE-CE2 4.05Å; M147-F217 HydrophobicContact CE-CZ 3.21Å; M147-F217 HydrophobicContact CG-CE2 4.27Å; M147-F217 HydrophobicContact CG-CZ 4.25Å; L165-F217 HydrophobicContact CD1-CD1 3.89Å; L165-F217 HydrophobicContact CD1-CD2 4.46Å; L165-F217 HydrophobicContact CD1-CE1 4.18Å; L165-F217 HydrophobicContact CD1-CG 4.07Å; L165-F217 HydrophobicContact CD2-CB 4.25Å; I180-F217 HydrophobicContact CB-CE1 4.35Å; I180-F217 HydrophobicContact CG2-CD1 4.05Å; I180-F217 HydrophobicContact CG2-CE1 3.84Å; E182-F217 HydrophobicContact CG-CB 3.57Å; V193-F217 HydrophobicContact CB-CE2 4.5Å; V193-F217 HydrophobicContact CG2-CD2 3.98Å; V193-F217 HydrophobicContact CG2-CE2 4.15Å; I196-F217 HydrophobicContact CD1-CE2 3.8Å; I196-F217 HydrophobicContact CD1-CZ 3.74Å; I196-F217 HydrophobicContact CG1-CE2 4.2Å; I196-F217 HydrophobicContact CG1-CZ 4.32Å; L215-F217 HydrophobicContact CB-CE1 3.84Å; L215-F217 HydrophobicContact CB-CZ 4.29Å; L215-F217 HydrophobicContact CD2-CE1 4.05Å; L215-F217 HydrophobicContact CG-CE1 4.46Å; L215-F217 PolarHBondContact O-N 3.41Å; F217-M219 HydrophobicContact CD2-CE 4.15Å; F217-M219 HydrophobicContact CE1-CE 4.12Å; F217-M219 HydrophobicContact CE2-CB 4.31Å; F217-M219 HydrophobicContact CE2-CE 3.59Å; F217-M219 HydrophobicContact CZ-CE 3.53Å; F217-M219 WeakPolarHBondContact O-CE 3.36Å; F217-M219 PolarHBondContact O-N 2.9Å
218	R	94.6	Very high	93.4	Very high	48 Å²	48	15.9 Å²	15.9	18%	0.181	8%	0.076	C	C	.	.			trans	-69.5	128.6	-176	-62.3	-170.5	-64.5	177.7	-4.6	111.3	E182 Q189 L190 A192 V193	E182-R218 PolarHBondContact OE1-N 2.94Å; Q189-R218 VanDerWaalsContact CG-NH2 3.26Å; Q189-R218 VanDerWaalsContact NE2-CZ 3.29Å; L190-R218 VanDerWaalsContact O-CZ 3.24Å; L190-R218 PolarHBondContact O-NE 3.11Å; L190-R218 VanDerWaalsContact O-NE 3.11Å; L190-R218 PolarHBondContact O-NH2 3.38Å; A192-R218 WeakPolarHBondContact CA-O 3.45Å; A192-R218 HydrophobicContact CB-CB 3.96Å; V193-R218 PolarHBondContact N-O 2.78Å
219	M	95.9	Very high	93.6	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.078	C	C	.	.	B	Isolated β-bridge	trans	-135.9	144.5	177.4	63.6	-170.6	74.9	0	0	111	V193 I196 L215 F217 I222 I242 S246 L247	V193-M219 CarbonylContact O-C 3.44Å; V193-M219 WeakPolarHBondContact O-CA 3.48Å; I196-M219 HydrophobicContact CD1-CB 4.06Å; I196-M219 HydrophobicContact CD1-CE 3.77Å; I196-M219 HydrophobicContact CD1-CG 4.43Å; I196-M219 HydrophobicContact CD1-SD 3.5Å; I196-M219 VanDerWaalsContact CD1-SD 3.5Å; L215-M219 HydrophobicContact CB-CE 3.6Å; L215-M219 HydrophobicContact CD1-CE 4.11Å; F217-M219 HydrophobicContact CD2-CE 4.15Å; F217-M219 HydrophobicContact CE1-CE 4.12Å; F217-M219 HydrophobicContact CE2-CB 4.31Å; F217-M219 HydrophobicContact CE2-CE 3.59Å; F217-M219 HydrophobicContact CZ-CE 3.53Å; F217-M219 WeakPolarHBondContact O-CE 3.36Å; F217-M219 PolarHBondContact O-N 2.9Å; M219-I222 HydrophobicContact SD-CG2 4.39Å; M219-I242 HydrophobicContact CE-CG2 4.05Å; M219-I242 HydrophobicContact SD-CG2 3.77Å; M219-S246 CarbonylContact O-C 3.54Å; M219-S246 VanDerWaalsContact O-O 3.11Å; M219-L247 HydrophobicContact CG-CD2 3.99Å; M219-L247 PolarHBondContact O-N 3.08Å
220	K	96.1	Very high	93.7	Very high	82 Å²	82	15.8 Å²	15.8	36%	0.357	7%	0.072	S	C	.	.	S	Bend	trans	-84.1	-27.9	176.2	-65.6	-171.5	-168.8	168.2	0	112.9	A192 V193 D194 S246 T248	A192-K220 HydrophobicContact CB-CG 3.99Å; V193-K220 PolarHBondContact O-N 3.4Å; D194-K220 VanDerWaalsContact OD1-CD 3.24Å; D194-K220 WeakPolarHBondContact OD1-CD 3.29Å; D194-K220 WeakPolarHBondContact OD1-CE 3.24Å; D194-K220 IonicContact OD1-NZ 2.65Å; D194-K220 PolarHBondContact OD1-NZ 2.93Å; K220-S246 WeakPolarHBondContact CA-O 3.03Å; K220-T248 WeakPolarHBondContact O-CB 3.48Å; K220-T248 PolarHBondContact O-N 2.95Å; K220-T248 PolarHBondContact O-OG1 2.95Å
221	T	95	Very high	93.7	Very high	45 Å²	45	18.6 Å²	18.6	28%	0.276	9%	0.085	S	C	.	.	S	Bend	trans	-138.6	147.1	176.3	60.2	0	0	0	0	109	D194	D194-T221 PolarHBondContact O-OG1 3.37Å
222	I	95.7	Very high	93.6	Very high	3 Å²	3	22 Å²	22	2%	0.015	10%	0.097	C	C	.	.	P	Polyproline II helix	trans	-72.8	161.6	172.1	66.7	167.2	0	0	0	110.1	M219 F227 I242 L247 I252 D256 F270	M219-I222 HydrophobicContact SD-CG2 4.39Å; I222-F227 HydrophobicContact CD1-CE2 4.43Å; I222-I242 HydrophobicContact CG2-CD1 4.16Å; I222-I242 HydrophobicContact CG2-CG2 4.36Å; I222-L247 HydrophobicContact CG2-CD1 4.27Å; I222-L247 HydrophobicContact CG2-CD2 3.83Å; I222-I252 HydrophobicContact CD1-CG2 3.4Å; I222-I252 HydrophobicContact CG1-CG2 3.95Å; I222-D256 HydrophobicContact CD1-CB 3.74Å; I222-D256 HydrophobicContact CG1-CB 4.07Å; I222-F270 HydrophobicContact CG2-CE1 4.09Å
223	P	95.7	Very high	93.7	Very high	2 Å²	2	22.5 Å²	22.5	1%	0.013	10%	0.099	C	C	.	.	P	Polyproline II helix	trans	-53.3	131	175.3	-24.4	34.4	0	0	0	110.8	I196 F200 L215 F225 L226	I196-P223 HydrophobicContact CB-CB 4.23Å; I196-P223 HydrophobicContact CB-CG 3.96Å; I196-P223 HydrophobicContact CD1-CG 3.76Å; I196-P223 HydrophobicContact CG1-CG 4.48Å; I196-P223 HydrophobicContact CG2-CB 4.11Å; I196-P223 HydrophobicContact CG2-CG 3.78Å; F200-P223 HydrophobicContact CE1-CB 4.02Å; F200-P223 HydrophobicContact CE1-CG 3.99Å; F200-P223 HydrophobicContact CZ-CG 4.35Å; L215-P223 HydrophobicContact CD1-CG 3.94Å; P223-F225 PolarHBondContact O-N 2.86Å; P223-L226 HydrophobicContact CB-CB 4.24Å; P223-L226 HydrophobicContact CB-CD1 4.02Å; P223-L226 HydrophobicContact CG-CD1 4.02Å; P223-L226 WeakPolarHBondContact O-CB 3.48Å; P223-L226 PolarHBondContact O-N 2.93Å
224	P	94.9	Very high	93.6	Very high	4 Å²	4	23 Å²	23	3%	0.026	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	127.9	-178	-26.2	33.7	0	0	0	111	I196 L226 R342 C343	I196-P224 WeakPolarHBondContact O-CD 3.22Å; P224-L226 PolarHBondContact O-N 3.13Å; P224-R342 HydrophobicContact CB-CB 4.1Å; P224-R342 HydrophobicContact CG-CB 3.93Å; P224-C343 HydrophobicContact CG-CB 4.09Å
225	F	94.8	Very high	93.3	Very high	18 Å²	18	26.3 Å²	26.3	8%	0.079	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	33.5	179.2	-45.3	-81.3	0	0	0	113.8	P223 F227 R228 Y229 E255 D256 V334 Q338 A339	P223-F225 PolarHBondContact O-N 2.86Å; F225-F227 VanDerWaalsContact C-N 3.28Å; F225-F227 PolarHBondContact O-N 3.08Å; F225-R228 CarbonylContact O-C 3.56Å; F225-R228 PolarHBondContact O-N 2.87Å; F225-Y229 WeakPolarHBondContact O-CB 3.22Å; F225-Y229 PolarHBondContact O-N 2.89Å; F225-E255 HydrophobicContact CD1-CB 4.41Å; F225-E255 HydrophobicContact CE1-CB 3.96Å; F225-D256 PolarHBondContact N-OD1 2.9Å; F225-V334 HydrophobicContact CB-CB 4.34Å; F225-V334 HydrophobicContact CB-CG1 4Å; F225-V334 HydrophobicContact CB-CG2 3.86Å; F225-V334 HydrophobicContact CD1-CG1 4.09Å; F225-V334 HydrophobicContact CD1-CG2 3.83Å; F225-V334 HydrophobicContact CD2-CG1 3.45Å; F225-V334 VanDerWaalsContact CD2-CG1 3.45Å; F225-V334 HydrophobicContact CE1-CG1 4.42Å; F225-V334 HydrophobicContact CE2-CG1 3.84Å; F225-V334 HydrophobicContact CG-CB 4.29Å; F225-V334 HydrophobicContact CG-CG1 3.57Å; F225-V334 HydrophobicContact CG-CG2 3.85Å; F225-V334 HydrophobicContact CZ-CG1 4.31Å; F225-Q338 HydrophobicContact CE2-CB 4.16Å; F225-Q338 HydrophobicContact CZ-CB 4.25Å; F225-A339 HydrophobicContact CD2-CB 4.27Å; F225-A339 HydrophobicContact CE2-CB 4.48Å
226	L	94.2	Very high	92.8	Very high	5 Å²	5	28.8 Å²	28.8	3%	0.026	13%	0.131	C	C	.	.	H	α-helix	trans	-41.5	-50.8	-173.3	178.2	62.9	0	0	0	113.6	F200 L213 P223 P224 R228 M234 I240 I242	F200-L226 HydrophobicContact CE1-CD1 4.27Å; F200-L226 HydrophobicContact CZ-CD1 4.32Å; L213-L226 HydrophobicContact CD2-CD1 4.22Å; P223-L226 HydrophobicContact CB-CB 4.24Å; P223-L226 HydrophobicContact CB-CD1 4.02Å; P223-L226 HydrophobicContact CG-CD1 4.02Å; P223-L226 WeakPolarHBondContact O-CB 3.48Å; P223-L226 PolarHBondContact O-N 2.93Å; P224-L226 PolarHBondContact O-N 3.13Å; L226-R228 PolarHBondContact O-N 3.27Å; L226-M234 HydrophobicContact CD1-CE 3.58Å; L226-M234 HydrophobicContact CG-CE 4.11Å; L226-M234 WeakPolarHBondContact O-CE 3.29Å; L226-M234 WeakPolarHBondContact O-CG 2.93Å; L226-I240 HydrophobicContact CD2-CG2 4.35Å; L226-I242 HydrophobicContact CD2-CD1 3.79Å
227	F	92.5	Very high	92.7	Very high	7 Å²	7	28.6 Å²	28.6	3%	0.031	13%	0.128	C	C	.	.	H	α-helix	trans	-78.3	-3.2	-175.3	-48.8	-72.1	0	0	0	114.8	I222 F225 I240 D256 R259 V268	I222-F227 HydrophobicContact CD1-CE2 4.43Å; F225-F227 VanDerWaalsContact C-N 3.28Å; F225-F227 PolarHBondContact O-N 3.08Å; F227-I240 HydrophobicContact CD1-CD1 3.56Å; F227-I240 HydrophobicContact CE1-CB 4.42Å; F227-I240 HydrophobicContact CE1-CD1 3.45Å; F227-I240 VanDerWaalsContact CE1-CD1 3.45Å; F227-I240 HydrophobicContact CE1-CG1 4.49Å; F227-I240 HydrophobicContact CE1-CG2 4.3Å; F227-D256 WeakPolarHBondContact CD2-O 3.41Å; F227-D256 VanDerWaalsContact CE2-O 3.3Å; F227-D256 WeakPolarHBondContact CE2-O 3.39Å; F227-R259 HydrophobicContact CB-CB 3.69Å; F227-R259 HydrophobicContact CG-CB 4.47Å; F227-V268 HydrophobicContact CE1-CG1 3.92Å; F227-V268 HydrophobicContact CE1-CG2 3.78Å; F227-V268 HydrophobicContact CZ-CG1 3.67Å; F227-V268 HydrophobicContact CZ-CG2 4.24Å
228	R	91.8	Very high	92.3	Very high	18 Å²	18	30 Å²	30	7%	0.068	14%	0.135	C	C	.	.	H	α-helix	trans	-129.3	-21	-175.3	-81.8	171	63.1	-166.2	1.2	115.6	F225 L226 E258 F260 T330 D332 V334	F225-R228 CarbonylContact O-C 3.56Å; F225-R228 PolarHBondContact O-N 2.87Å; L226-R228 PolarHBondContact O-N 3.27Å; R228-E258 VanDerWaalsContact CD-C 3.45Å; R228-E258 WeakPolarHBondContact CD-O 3.36Å; R228-E258 WeakPolarHBondContact CG-O 3.47Å; R228-E258 IonicContact CZ-OE2 3.47Å; R228-E258 IonicContact NH1-OE2 3.56Å; R228-E258 PolarHBondContact NH1-OE2 2.84Å; R228-F260 VanDerWaalsContact CA-CE2 3.44Å; R228-F260 HydrophobicContact CB-CE2 4.04Å; R228-F260 HydrophobicContact CB-CZ 4.37Å; R228-F260 HydrophobicContact CG-CD2 4.28Å; R228-F260 HydrophobicContact CG-CE2 4.1Å; R228-F260 HydrophobicContact CG-CZ 4.36Å; R228-F260 WeakPolarHBondContact O-CE2 3.47Å; R228-F260 WeakPolarHBondContact O-CZ 3.41Å; R228-T330 HydrophobicContact CG-CG2 4.27Å; R228-T330 VanDerWaalsContact CZ-CG2 3.41Å; R228-D332 PolarHBondContact NE-O 2.98Å; R228-D332 VanDerWaalsContact NE-O 3.16Å; R228-D332 PolarHBondContact NH2-O 2.87Å; R228-V334 HydrophobicContact CB-CG2 3.99Å
229	Y	93.5	Very high	92	Very high	41 Å²	41	27.7 Å²	27.7	16%	0.161	13%	0.126	C	C	.	.	H	α-helix	trans	-67.6	-52.7	-175.9	-170.9	-107.5	0	0	0	110.3	A198 D199 F225 Q231 V334 A339	A198-Y229 HydrophobicContact CB-CD1 3.97Å; A198-Y229 HydrophobicContact CB-CD2 4.45Å; A198-Y229 HydrophobicContact CB-CE1 3.89Å; A198-Y229 HydrophobicContact CB-CE2 4.39Å; A198-Y229 HydrophobicContact CB-CG 4.25Å; A198-Y229 VanDerWaalsContact O-CD1 3.28Å; A198-Y229 WeakPolarHBondContact O-CD1 3.4Å; A198-Y229 WeakPolarHBondContact O-CE1 3.45Å; D199-Y229 WeakPolarHBondContact OD1-CE1 3.41Å; D199-Y229 VanDerWaalsContact OD1-CZ 3.28Å; D199-Y229 PolarHBondContact OD1-OH 3.18Å; F225-Y229 WeakPolarHBondContact O-CB 3.22Å; F225-Y229 PolarHBondContact O-N 2.89Å; Y229-Q231 PolarHBondContact O-N 3.18Å; Y229-V334 HydrophobicContact CD2-CB 4.36Å; Y229-V334 HydrophobicContact CD2-CG1 4.05Å; Y229-A339 HydrophobicContact CD2-CB 4.02Å; Y229-A339 HydrophobicContact CE2-CB 3.68Å
230	Y	90.5	Very high	91.9	Very high	41 Å²	41	27.7 Å²	27.7	16%	0.161	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	73.4	173.6	-73.5	-67.6	0	0	0	112.3	A198 D199 L201 A202 R232 I233 M234	A198-Y230 WeakPolarHBondContact O-CE2 3.46Å; D199-Y230 VanDerWaalsContact CA-OH 3.22Å; D199-Y230 WeakPolarHBondContact CA-OH 3.47Å; D199-Y230 PolarHBondContact O-OH 3.41Å; D199-Y230 PolarHBondContact OD1-OH 2.92Å; L201-Y230 HydrophobicContact CB-CD2 3.86Å; L201-Y230 HydrophobicContact CB-CE2 3.67Å; L201-Y230 HydrophobicContact CD1-CD2 4.21Å; L201-Y230 HydrophobicContact CG-CD2 4.48Å; L201-Y230 HydrophobicContact CG-CE2 4.49Å; A202-Y230 VanDerWaalsContact CA-OH 3.22Å; A202-Y230 WeakPolarHBondContact CA-OH 3.19Å; A202-Y230 VanDerWaalsContact CB-OH 3.24Å; A202-Y230 WeakPolarHBondContact CB-OH 3.32Å; A202-Y230 PolarHBondContact N-OH 2.02Å; A202-Y230 VanDerWaalsContact N-OH 3.09Å; Y230-R232 VanDerWaalsContact C-N 3.31Å; Y230-R232 PolarHBondContact O-N 3.38Å; Y230-I233 HydrophobicContact CD1-CD1 4.11Å; Y230-I233 HydrophobicContact CG-CD1 4.05Å; Y230-I233 PolarHBondContact O-N 2.6Å; Y230-M234 WeakPolarHBondContact O-CB 3.32Å; Y230-M234 WeakPolarHBondContact O-CG 3.49Å; Y230-M234 PolarHBondContact O-N 3.39Å
231	Q	89.6	Confident	91.8	Very high	60 Å²	60	23.9 Å²	23.9	28%	0.28	11%	0.11	S	C	.	.	H	α-helix	trans	-46.9	-52	-178.4	-177.9	166.9	13	0	0	113.4	Y229 I233 M234 Q235 F260	Y229-Q231 PolarHBondContact O-N 3.18Å; Q231-I233 PolarHBondContact O-N 3.08Å; Q231-M234 PolarHBondContact O-N 2.78Å; Q231-Q235 HydrophobicContact CG-CG 4.22Å; Q231-Q235 VanDerWaalsContact NE2-NE2 3.11Å; Q231-Q235 VanDerWaalsContact O-CB 3.28Å; Q231-Q235 WeakPolarHBondContact O-CB 3.48Å; Q231-Q235 WeakPolarHBondContact O-CG 3.26Å; Q231-Q235 PolarHBondContact O-N 2.84Å; Q231-F260 VanDerWaalsContact CA-CE2 3.42Å; Q231-F260 HydrophobicContact CB-CD2 3.87Å; Q231-F260 HydrophobicContact CB-CE2 3.25Å; Q231-F260 HydrophobicContact CB-CZ 3.69Å; Q231-F260 HydrophobicContact CG-CD1 4.23Å; Q231-F260 HydrophobicContact CG-CD2 3.6Å; Q231-F260 HydrophobicContact CG-CE1 4.08Å; Q231-F260 HydrophobicContact CG-CE2 3.38Å; Q231-F260 HydrophobicContact CG-CG 4Å; Q231-F260 HydrophobicContact CG-CZ 3.66Å
232	R	87.7	Confident	91.8	Very high	83 Å²	83	21.7 Å²	21.7	31%	0.313	10%	0.096	S	C	.	.	H	α-helix	trans	-59.6	-48.2	-177.1	175.4	179.2	169.8	-85.9	-20.6	112.2	K205 N206 N208 Y230	K205-R232 PolarHBondContact O-NH1 2.96Å; N206-R232 VanDerWaalsContact CA-CZ 3.46Å; N206-R232 PolarHBondContact O-NE 2.78Å; N206-R232 PolarHBondContact O-NH2 3.26Å; N208-R232 PolarHBondContact O-NH1 2.92Å; N208-R232 PolarHBondContact O-NH2 2.91Å; Y230-R232 VanDerWaalsContact C-N 3.31Å; Y230-R232 PolarHBondContact O-N 3.38Å
233	I	91.3	Very high	91.8	Very high	9 Å²	9	21.6 Å²	21.6	5%	0.046	10%	0.096	C	C	.	.	H	α-helix	trans	-65.1	-52.9	-179	-59.4	-179.1	0	0	0	108.5	L201 I204 L210 Y230 Q231 Q235 L236 T237	L201-I233 HydrophobicContact CB-CD1 4.1Å; I204-I233 HydrophobicContact CB-CD1 4.17Å; I204-I233 HydrophobicContact CD1-CD1 4.29Å; I204-I233 HydrophobicContact CG2-CD1 4.38Å; L210-I233 HydrophobicContact CB-CG2 3.55Å; L210-I233 HydrophobicContact CD2-CG2 3.53Å; L210-I233 HydrophobicContact CG-CG2 4.18Å; Y230-I233 HydrophobicContact CD1-CD1 4.11Å; Y230-I233 HydrophobicContact CG-CD1 4.05Å; Y230-I233 PolarHBondContact O-N 2.6Å; Q231-I233 PolarHBondContact O-N 3.08Å; I233-Q235 VanDerWaalsContact C-N 3.3Å; I233-Q235 PolarHBondContact O-N 3.36Å; I233-L236 PolarHBondContact O-N 3.32Å; I233-L236 VanDerWaalsContact O-N 3.09Å; I233-T237 PolarHBondContact O-N 2.93Å; I233-T237 VanDerWaalsContact O-N 3.09Å; I233-T237 PolarHBondContact O-OG1 2.75Å
234	M	90.8	Very high	91.7	Very high	12 Å²	12	21.5 Å²	21.5	6%	0.059	10%	0.095	C	C	.	.	H	α-helix	trans	-68.3	-24.3	-173.9	-64.7	-61	167.8	0	0	114.2	L201 L213 L226 Y230 Q231 L236 I240	L201-M234 HydrophobicContact CD1-CE 3.97Å; L213-M234 HydrophobicContact CD2-CE 4.24Å; L226-M234 HydrophobicContact CD1-CE 3.58Å; L226-M234 HydrophobicContact CG-CE 4.11Å; L226-M234 WeakPolarHBondContact O-CE 3.29Å; L226-M234 WeakPolarHBondContact O-CG 2.93Å; Y230-M234 WeakPolarHBondContact O-CB 3.32Å; Y230-M234 WeakPolarHBondContact O-CG 3.49Å; Y230-M234 PolarHBondContact O-N 3.39Å; Q231-M234 PolarHBondContact O-N 2.78Å; M234-L236 VanDerWaalsContact C-N 3.27Å; M234-L236 PolarHBondContact O-N 3.48Å; M234-I240 HydrophobicContact SD-CD1 3.79Å
235	Q	88.3	Confident	91.6	Very high	70 Å²	70	25.6 Å²	25.6	33%	0.327	11%	0.11	S	C	.	.	H	α-helix	trans	-67.5	-27.2	173.6	-82.8	177.1	-18.4	0	0	113	Q231 I233 F260 S262	Q231-Q235 HydrophobicContact CG-CG 4.22Å; Q231-Q235 VanDerWaalsContact NE2-NE2 3.11Å; Q231-Q235 VanDerWaalsContact O-CB 3.28Å; Q231-Q235 WeakPolarHBondContact O-CB 3.48Å; Q231-Q235 WeakPolarHBondContact O-CG 3.26Å; Q231-Q235 PolarHBondContact O-N 2.84Å; I233-Q235 VanDerWaalsContact C-N 3.3Å; I233-Q235 PolarHBondContact O-N 3.36Å; Q235-F260 HydrophobicContact CG-CB 4.21Å; Q235-S262 WeakPolarHBondContact O-CB 3.08Å; Q235-S262 PolarHBondContact O-OG 3.05Å
236	L	87.9	Confident	91.6	Very high	52 Å²	52	26.3 Å²	26.3	27%	0.272	12%	0.117	S	C	.	.	H	α-helix	trans	-102.9	-18.1	-177.5	-61.4	171.7	0	0	0	112.8	E209 I233 M234 Q238	E209-L236 HydrophobicContact CB-CD1 4.22Å; E209-L236 HydrophobicContact CG-CD1 3.79Å; I233-L236 PolarHBondContact O-N 3.32Å; I233-L236 VanDerWaalsContact O-N 3.09Å; M234-L236 VanDerWaalsContact C-N 3.27Å; M234-L236 PolarHBondContact O-N 3.48Å; L236-Q238 PolarHBondContact O-N 3.44Å
237	T	90.4	Very high	91.6	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	12%	0.118	C	C	.	.			trans	-57.5	124.2	175	-52	0	0	0	0	111.8	L210 I233 Y239 I240 L265	L210-T237 WeakPolarHBondContact O-CA 3.09Å; L210-T237 PolarHBondContact O-N 3.34Å; L210-T237 PolarHBondContact O-OG1 2.98Å; I233-T237 PolarHBondContact O-N 2.93Å; I233-T237 VanDerWaalsContact O-N 3.09Å; I233-T237 PolarHBondContact O-OG1 2.75Å; T237-Y239 WeakPolarHBondContact CG2-O 3.43Å; T237-I240 HydrophobicContact CG2-CD1 4.16Å; T237-I240 HydrophobicContact CG2-CG1 3.74Å; T237-L265 VanDerWaalsContact O-CA 3.24Å; T237-L265 WeakPolarHBondContact O-CA 3.43Å; T237-L265 PolarHBondContact O-N 3.41Å
238	Q	87.5	Confident	91.6	Very high	29 Å²	29	29.4 Å²	29.4	14%	0.136	14%	0.137	C	C	.	.			trans	-83.9	-41.9	178.7	-54	179	10.3	0	0	111.6	L211 L236 K264 L265 T266	L211-Q238 WeakPolarHBondContact O-CA 3.02Å; L211-Q238 VanDerWaalsContact O-CB 3.24Å; L211-Q238 WeakPolarHBondContact O-CB 2.98Å; L211-Q238 PolarHBondContact O-N 2.91Å; L236-Q238 PolarHBondContact O-N 3.44Å; Q238-K264 WeakPolarHBondContact CA-O 3.05Å; Q238-L265 CarbonylContact O-C 3.53Å; Q238-L265 WeakPolarHBondContact O-CA 3.38Å; Q238-T266 PolarHBondContact O-N 3.16Å; Q238-T266 PolarHBondContact O-OG1 3.06Å
239	Y	87.9	Confident	91.7	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	152.1	-179.6	85.5	-91.2	0	0	0	112.9	W26 Y177 L211 G212 L213 E214 T237 C241 Q267 P282 F294	W26-Y239 HydrophobicContact CH2-CE1 4.38Å; W26-Y239 AromaticContact CZ2-CE1 3.77Å; W26-Y239 HydrophobicContact CZ2-CE1 3.77Å; W26-Y239 AromaticContact CZ2-CZ 3.7Å; W26-Y239 WeakPolarHBondContact CZ2-OH 3.33Å; Y177-Y239 HydrophobicContact CD1-CD1 4.34Å; Y177-Y239 AromaticContact CD1-CE1 3.42Å; Y177-Y239 HydrophobicContact CD1-CE1 3.42Å; Y177-Y239 VanDerWaalsContact CD1-CE1 3.42Å; Y177-Y239 HydrophobicContact CE1-CD1 4.07Å; Y177-Y239 AromaticContact CE1-CE1 3.49Å; Y177-Y239 HydrophobicContact CE1-CE1 3.49Å; Y177-Y239 VanDerWaalsContact CE1-CE1 3.49Å; L211-Y239 PolarHBondContact O-N 3.38Å; G212-Y239 VanDerWaalsContact CA-O 3.22Å; G212-Y239 WeakPolarHBondContact CA-O 3.3Å; L213-Y239 PolarHBondContact N-O 3.46Å; L213-Y239 VanDerWaalsContact N-O 3.09Å; E214-Y239 HydrophobicContact CG-CE2 3.76Å; E214-Y239 WeakPolarHBondContact CG-OH 3.18Å; E214-Y239 WeakPolarHBondContact OE1-CE2 3.34Å; E214-Y239 PolarHBondContact OE1-OH 2.77Å; T237-Y239 WeakPolarHBondContact CG2-O 3.43Å; Y239-C241 HydrophobicContact CE2-CB 4.39Å; Y239-Q267 WeakPolarHBondContact CA-O 3.4Å; Y239-P282 HydrophobicContact CD2-CB 4.37Å; Y239-P282 HydrophobicContact CD2-CG 4.19Å; Y239-P282 HydrophobicContact CE1-CG 4.4Å; Y239-P282 HydrophobicContact CE2-CB 4.49Å; Y239-P282 HydrophobicContact CE2-CG 3.87Å; Y239-F294 AromaticContact CD1-CE1 3.84Å; Y239-F294 HydrophobicContact CD1-CE1 3.84Å; Y239-F294 HydrophobicContact CD1-CZ 4.16Å; Y239-F294 HydrophobicContact CE1-CE1 4.31Å; Y239-F294 HydrophobicContact CG-CE1 4.48Å; Y239-F294 HydrophobicContact CG-CZ 4.35Å
240	I	93.3	Very high	91.7	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	129	174.7	-63.6	170.9	0	0	0	108.5	L213 L226 F227 M234 T237 I242 L265 Q267 V268 V269	L213-I240 HydrophobicContact CB-CG1 4.37Å; L213-I240 WeakPolarHBondContact O-CA 3.02Å; L226-I240 HydrophobicContact CD2-CG2 4.35Å; F227-I240 HydrophobicContact CD1-CD1 3.56Å; F227-I240 HydrophobicContact CE1-CB 4.42Å; F227-I240 HydrophobicContact CE1-CD1 3.45Å; F227-I240 VanDerWaalsContact CE1-CD1 3.45Å; F227-I240 HydrophobicContact CE1-CG1 4.49Å; F227-I240 HydrophobicContact CE1-CG2 4.3Å; M234-I240 HydrophobicContact SD-CD1 3.79Å; T237-I240 HydrophobicContact CG2-CD1 4.16Å; T237-I240 HydrophobicContact CG2-CG1 3.74Å; I240-I242 HydrophobicContact CG2-CD1 4.04Å; I240-I242 HydrophobicContact CG2-CG1 3.99Å; I240-L265 HydrophobicContact CD1-CD1 4.37Å; I240-L265 HydrophobicContact CG1-CD1 4.47Å; I240-Q267 PolarHBondContact N-O 3.27Å; I240-Q267 VanDerWaalsContact N-O 3.11Å; I240-V268 HydrophobicContact CB-CG2 4.42Å; I240-V268 WeakPolarHBondContact O-CA 2.98Å; I240-V269 PolarHBondContact O-N 2.74Å
241	C	93.6	Very high	91.9	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.007	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	130.3	173.7	-67.4	0	0	0	0	110.5	L213 E214 L215 Y239 V269 L276	L213-C241 PolarHBondContact O-N 2.76Å; E214-C241 WeakPolarHBondContact CA-O 3.32Å; E214-C241 HydrophobicContact CG-CB 4.1Å; L215-C241 PolarHBondContact N-O 3.2Å; Y239-C241 HydrophobicContact CE2-CB 4.39Å; C241-V269 WeakPolarHBondContact CA-O 3.42Å; C241-L276 HydrophobicContact CB-CD1 4.22Å; C241-L276 HydrophobicContact CB-CD2 3.99Å
242	I	95.7	Very high	92.2	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	137.9	-175.8	-61.9	172.6	0	0	0	109.2	L215 M219 I222 L226 I240 G244 V269 F270 R271	L215-I242 HydrophobicContact CD1-CG1 4.43Å; M219-I242 HydrophobicContact CE-CG2 4.05Å; M219-I242 HydrophobicContact SD-CG2 3.77Å; I222-I242 HydrophobicContact CG2-CD1 4.16Å; I222-I242 HydrophobicContact CG2-CG2 4.36Å; L226-I242 HydrophobicContact CD2-CD1 3.79Å; I240-I242 HydrophobicContact CG2-CD1 4.04Å; I240-I242 HydrophobicContact CG2-CG1 3.99Å; I242-G244 PolarHBondContact O-N 3.23Å; I242-G244 VanDerWaalsContact O-N 3.16Å; I242-V269 PolarHBondContact N-O 2.8Å; I242-F270 HydrophobicContact CB-CD1 3.99Å; I242-F270 HydrophobicContact CB-CE1 3.87Å; I242-F270 HydrophobicContact CD1-CE1 3.77Å; I242-F270 HydrophobicContact CD1-CZ 3.93Å; I242-F270 HydrophobicContact CG1-CE1 4.36Å; I242-F270 HydrophobicContact CG2-CD1 4.18Å; I242-F270 HydrophobicContact CG2-CE1 4Å; I242-R271 PolarHBondContact O-N 3.06Å
243	D	94.9	Very high	92.5	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	106.8	165.9	-166.7	-28.4	0	0	0	110.1	L215 R245 L276	L215-D243 PolarHBondContact O-N 3.42Å; D243-R245 VanDerWaalsContact OD1-CB 3.29Å; D243-R245 WeakPolarHBondContact OD1-CB 3.41Å; D243-R245 VanDerWaalsContact OD1-CG 3.32Å; D243-R245 WeakPolarHBondContact OD1-CG 3.38Å; D243-R245 IonicContact OD1-CZ 2.69Å; D243-R245 PolarHBondContact OD1-N 3.02Å; D243-R245 VanDerWaalsContact OD1-N 3.13Å; D243-R245 IonicContact OD1-NE 3.04Å; D243-R245 PolarHBondContact OD1-NE 3.45Å; D243-R245 IonicContact OD1-NH2 3.89Å; D243-R245 IonicContact OD2-CZ 3.68Å; D243-R245 IonicContact OD2-NE 3.57Å; D243-R245 PolarHBondContact OD2-NE 3.44Å; D243-R245 IonicContact OD2-NH2 2.76Å; D243-R245 PolarHBondContact OD2-NH2 3.48Å; D243-L276 HydrophobicContact CB-CB 4.04Å
244	G	93.8	Very high	92.6	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.158	C	C	.	.			trans	-88.9	-4.1	-175.6	0	0	0	0	0	114.4	I242 S246 L247 R271	I242-G244 PolarHBondContact O-N 3.23Å; I242-G244 VanDerWaalsContact O-N 3.16Å; G244-S246 PolarHBondContact O-N 3.24Å; G244-S246 VanDerWaalsContact O-N 3.12Å; G244-L247 PolarHBondContact O-N 3.01Å; G244-R271 PolarHBondContact N-O 3.33Å
245	R	93.3	Very high	92.7	Very high	91 Å²	91	33.2 Å²	33.2	34%	0.343	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-26.8	-168.8	-76.2	-176	-68.7	-176.2	0.6	115.7	D243 S272 N274 G275	D243-R245 VanDerWaalsContact OD1-CB 3.29Å; D243-R245 WeakPolarHBondContact OD1-CB 3.41Å; D243-R245 VanDerWaalsContact OD1-CG 3.32Å; D243-R245 WeakPolarHBondContact OD1-CG 3.38Å; D243-R245 IonicContact OD1-CZ 2.69Å; D243-R245 PolarHBondContact OD1-N 3.02Å; D243-R245 VanDerWaalsContact OD1-N 3.13Å; D243-R245 IonicContact OD1-NE 3.04Å; D243-R245 PolarHBondContact OD1-NE 3.45Å; D243-R245 IonicContact OD1-NH2 3.89Å; D243-R245 IonicContact OD2-CZ 3.68Å; D243-R245 IonicContact OD2-NE 3.57Å; D243-R245 PolarHBondContact OD2-NE 3.44Å; D243-R245 IonicContact OD2-NH2 2.76Å; D243-R245 PolarHBondContact OD2-NH2 3.48Å; R245-S272 VanDerWaalsContact CG-O 3.32Å; R245-S272 WeakPolarHBondContact CG-O 3.28Å; R245-N274 PolarHBondContact NH1-O 3.3Å; R245-G275 VanDerWaalsContact CD-N 3.27Å
246	S	94.6	Very high	93	Very high	33 Å²	33	29.9 Å²	29.9	23%	0.231	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.2	9.7	-170.4	-60.3	0	0	0	0	112.9	M219 K220 G244 T248	M219-S246 CarbonylContact O-C 3.54Å; M219-S246 VanDerWaalsContact O-O 3.11Å; K220-S246 WeakPolarHBondContact CA-O 3.03Å; G244-S246 PolarHBondContact O-N 3.24Å; G244-S246 VanDerWaalsContact O-N 3.12Å; S246-T248 PolarHBondContact O-N 3.29Å
247	L	94.8	Very high	93.2	Very high	8 Å²	8	27.4 Å²	27.4	4%	0.042	15%	0.145	C	C	.	.			trans	-63.4	135.5	177.4	-71	177.2	0	0	0	110.6	M219 I222 G244 N249 N250 I252 F270 I314	M219-L247 HydrophobicContact CG-CD2 3.99Å; M219-L247 PolarHBondContact O-N 3.08Å; I222-L247 HydrophobicContact CG2-CD1 4.27Å; I222-L247 HydrophobicContact CG2-CD2 3.83Å; G244-L247 PolarHBondContact O-N 3.01Å; L247-N249 PolarHBondContact O-N 3.31Å; L247-N250 PolarHBondContact O-N 3.24Å; L247-I252 HydrophobicContact CD1-CG1 4.42Å; L247-F270 HydrophobicContact CD1-CD1 3.88Å; L247-F270 HydrophobicContact CD1-CE1 4Å; L247-I314 HydrophobicContact CB-CD1 4.36Å; L247-I314 HydrophobicContact CD1-CD1 3.62Å; L247-I314 HydrophobicContact CD1-CG1 4.44Å; L247-I314 HydrophobicContact CG-CD1 4.48Å
248	T	93.3	Very high	93.4	Very high	68 Å²	68	29.1 Å²	29.1	42%	0.417	15%	0.153	S	C	.	.	G	3₁₀ helix	trans	-64.6	126	-176.4	-59.7	0	0	0	0	109.4	K220 S246 N250 S251	K220-T248 WeakPolarHBondContact O-CB 3.48Å; K220-T248 PolarHBondContact O-N 2.95Å; K220-T248 PolarHBondContact O-OG1 2.95Å; S246-T248 PolarHBondContact O-N 3.29Å; T248-N250 PolarHBondContact O-N 3.47Å; T248-S251 PolarHBondContact O-N 3.22Å; T248-S251 VanDerWaalsContact O-N 3.16Å; T248-S251 PolarHBondContact O-OG 2.71Å; T248-S251 VanDerWaalsContact O-OG 3.13Å
249	N	93	Very high	93.5	Very high	138 Å²	138	28.8 Å²	28.8	74%	0.738	15%	0.15	S	C	*	.	G	3₁₀ helix	trans	55.7	18.9	-175	-56	-34.8	0	0	0	114.5	L247 S251	L247-N249 PolarHBondContact O-N 3.31Å; N249-S251 PolarHBondContact O-N 3.16Å
250	N	94.1	Very high	93.5	Very high	50 Å²	50	29.2 Å²	29.2	27%	0.267	15%	0.152	S	C	.	.	G	3₁₀ helix	trans	50.6	42.3	-173.2	-56.1	-59.6	0	0	0	111.4	L247 T248 I314 S316	L247-N250 PolarHBondContact O-N 3.24Å; T248-N250 PolarHBondContact O-N 3.47Å; N250-I314 VanDerWaalsContact C-CG1 3.43Å; N250-I314 HydrophobicContact CB-CG1 3.95Å; N250-I314 WeakPolarHBondContact O-CG1 3.33Å; N250-I314 PolarHBondContact O-N 2.94Å; N250-S316 VanDerWaalsContact ND2-CB 3.29Å; N250-S316 WeakPolarHBondContact ND2-CB 3.37Å
251	S	94.4	Very high	93	Very high	24 Å²	24	32.8 Å²	32.8	17%	0.168	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	157.4	-173.3	70.7	0	0	0	0	112	T248 N249 A312	T248-S251 PolarHBondContact O-N 3.22Å; T248-S251 VanDerWaalsContact O-N 3.16Å; T248-S251 PolarHBondContact O-OG 2.71Å; T248-S251 VanDerWaalsContact O-OG 3.13Å; N249-S251 PolarHBondContact O-N 3.16Å; S251-A312 CarbonylContact C-O 3.46Å; S251-A312 VanDerWaalsContact CA-O 3.25Å; S251-A312 WeakPolarHBondContact CA-O 3.47Å
252	I	94.7	Very high	92.5	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.01	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	129.4	179.6	-58.2	163.1	0	0	0	107.3	I222 L247 F254 D256 T257 F270 P311 A312 I314	I222-I252 HydrophobicContact CD1-CG2 3.4Å; I222-I252 HydrophobicContact CG1-CG2 3.95Å; L247-I252 HydrophobicContact CD1-CG1 4.42Å; I252-F254 PolarHBondContact O-N 2.79Å; I252-D256 HydrophobicContact CG2-CB 3.89Å; I252-T257 HydrophobicContact CB-CG2 4.08Å; I252-T257 HydrophobicContact CG2-CG2 3.66Å; I252-F270 HydrophobicContact CD1-CD1 4.34Å; I252-F270 HydrophobicContact CD1-CD2 4.43Å; I252-F270 HydrophobicContact CD1-CE1 3.55Å; I252-F270 HydrophobicContact CD1-CE2 3.66Å; I252-F270 HydrophobicContact CD1-CZ 3.17Å; I252-F270 HydrophobicContact CG1-CE1 4.44Å; I252-F270 HydrophobicContact CG1-CZ 4.4Å; I252-P311 CarbonylContact O-C 3.52Å; I252-P311 VanDerWaalsContact O-CA 3.23Å; I252-P311 WeakPolarHBondContact O-CA 3.39Å; I252-A312 HydrophobicContact CB-CB 4.46Å; I252-A312 PolarHBondContact N-O 3.2Å; I252-A312 PolarHBondContact O-N 3.4Å; I252-I314 HydrophobicContact CD1-CG2 3.96Å
253	P	94.6	Very high	92	Very high	39 Å²	39	39.9 Å²	39.9	25%	0.253	22%	0.221	S	C	.	.			trans	-53.8	140.5	173.4	-28	38.5	0	0	0	111.3	E255 D256 T257	P253-E255 PolarHBondContact O-N 3.02Å; P253-D256 WeakPolarHBondContact CB-OD2 3.39Å; P253-D256 WeakPolarHBondContact CD-OD2 3.3Å; P253-D256 WeakPolarHBondContact CG-OD2 3.41Å; P253-D256 PolarHBondContact O-N 2.89Å; P253-T257 PolarHBondContact O-N 2.85Å
254	F	94.3	Very high	91.6	Very high	8 Å²	8	44.9 Å²	44.9	4%	0.035	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-54.7	-43	-174	175.5	-101.9	0	0	0	111.7	I252 D256 T257 E258 I306 Q308 K310 P328	I252-F254 PolarHBondContact O-N 2.79Å; F254-D256 PolarHBondContact O-N 2.03Å; F254-T257 WeakPolarHBondContact O-CB 3.43Å; F254-T257 PolarHBondContact O-N 3.04Å; F254-T257 PolarHBondContact O-OG1 2.99Å; F254-E258 HydrophobicContact CD1-CG 4.49Å; F254-E258 HydrophobicContact CE1-CG 3.97Å; F254-E258 HydrophobicContact CZ-CG 4.2Å; F254-E258 PolarHBondContact O-N 3.1Å; F254-I306 HydrophobicContact CD2-CG2 3.91Å; F254-I306 HydrophobicContact CE2-CG2 3.97Å; F254-Q308 HydrophobicContact CE1-CG 4.22Å; F254-Q308 HydrophobicContact CE2-CB 4.34Å; F254-Q308 HydrophobicContact CE2-CG 4.02Å; F254-Q308 HydrophobicContact CZ-CB 4.4Å; F254-Q308 HydrophobicContact CZ-CG 3.6Å; F254-K310 WeakPolarHBondContact CB-O 3.16Å; F254-P328 HydrophobicContact CE2-CB 4.26Å; F254-P328 HydrophobicContact CE2-CG 3.81Å; F254-P328 HydrophobicContact CZ-CB 4.15Å; F254-P328 HydrophobicContact CZ-CG 4.04Å
255	E	93.1	Very high	91.3	Very high	83 Å²	83	45.2 Å²	45.2	39%	0.388	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-61.6	-26.8	-178.3	-58	75.2	-164.1	0	0	112.5	F225 P253	F225-E255 HydrophobicContact CD1-CB 4.41Å; F225-E255 HydrophobicContact CE1-CB 3.96Å; P253-E255 PolarHBondContact O-N 3.02Å
256	D	94.2	Very high	90.9	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-86.2	-8.3	176.5	-57.2	-39	0	0	0	113.3	I222 F225 F227 I252 P253 F254 R342	I222-D256 HydrophobicContact CD1-CB 3.74Å; I222-D256 HydrophobicContact CG1-CB 4.07Å; F225-D256 PolarHBondContact N-OD1 2.9Å; F227-D256 WeakPolarHBondContact CD2-O 3.41Å; F227-D256 VanDerWaalsContact CE2-O 3.3Å; F227-D256 WeakPolarHBondContact CE2-O 3.39Å; I252-D256 HydrophobicContact CG2-CB 3.89Å; P253-D256 WeakPolarHBondContact CB-OD2 3.39Å; P253-D256 WeakPolarHBondContact CD-OD2 3.3Å; P253-D256 WeakPolarHBondContact CG-OD2 3.41Å; P253-D256 PolarHBondContact O-N 2.89Å; F254-D256 PolarHBondContact O-N 2.03Å; D256-R342 IonicContact OD1-CZ 3.19Å; D256-R342 IonicContact OD1-NH1 2.9Å; D256-R342 PolarHBondContact OD1-NH1 3.35Å; D256-R342 IonicContact OD1-NH2 2.66Å; D256-R342 IonicContact OD2-CZ 3.5Å; D256-R342 IonicContact OD2-NH1 3Å; D256-R342 PolarHBondContact OD2-NH1 3.05Å; D256-R342 IonicContact OD2-NH2 2.7Å; D256-R342 PolarHBondContact OD2-NH2 2.91Å
257	T	92.9	Very high	90.5	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.006	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-16.5	173.4	69.3	0	0	0	0	113	I252 P253 F254 R259 I306 A312 P328	I252-T257 HydrophobicContact CB-CG2 4.08Å; I252-T257 HydrophobicContact CG2-CG2 3.66Å; P253-T257 PolarHBondContact O-N 2.85Å; F254-T257 WeakPolarHBondContact O-CB 3.43Å; F254-T257 PolarHBondContact O-N 3.04Å; F254-T257 PolarHBondContact O-OG1 2.99Å; T257-R259 PolarHBondContact O-N 3.37Å; T257-I306 HydrophobicContact CG2-CD1 4.17Å; T257-A312 HydrophobicContact CG2-CB 3.6Å; T257-P328 WeakPolarHBondContact OG1-CG 3.47Å
258	E	93.1	Very high	90.4	Very high	36 Å²	36	39.3 Å²	39.3	17%	0.168	22%	0.218	C	C	.	.			trans	-65.1	133.3	175.7	-63.7	-173.8	116.2	0	0	109.9	R228 F254 P328 T330	R228-E258 VanDerWaalsContact CD-C 3.45Å; R228-E258 WeakPolarHBondContact CD-O 3.36Å; R228-E258 WeakPolarHBondContact CG-O 3.47Å; R228-E258 IonicContact CZ-OE2 3.47Å; R228-E258 IonicContact NH1-OE2 3.56Å; R228-E258 PolarHBondContact NH1-OE2 2.84Å; F254-E258 HydrophobicContact CD1-CG 4.49Å; F254-E258 HydrophobicContact CE1-CG 3.97Å; F254-E258 HydrophobicContact CZ-CG 4.2Å; F254-E258 PolarHBondContact O-N 3.1Å; E258-P328 CarbonylContact C-O 3.45Å; E258-P328 WeakPolarHBondContact CA-O 3.26Å; E258-P328 HydrophobicContact CG-CB 4.41Å; E258-P328 HydrophobicContact CG-CG 4.05Å; E258-T330 HydrophobicContact CB-CG2 3.84Å
259	R	91.2	Very high	90.4	Very high	21 Å²	21	36.1 Å²	36.1	8%	0.079	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-127.8	163.3	-179.2	68.8	171.9	-171.5	106.3	-5.5	111.8	F227 T257 S262 P324 L327 P328 T329 T330	F227-R259 HydrophobicContact CB-CB 3.69Å; F227-R259 HydrophobicContact CG-CB 4.47Å; T257-R259 PolarHBondContact O-N 3.37Å; R259-S262 PolarHBondContact NH1-O 2.61Å; R259-S262 VanDerWaalsContact NH1-O 3.14Å; R259-P324 PolarHBondContact NE-O 3.31Å; R259-P324 VanDerWaalsContact NH2-C 3.3Å; R259-P324 PolarHBondContact NH2-O 2.99Å; R259-L327 HydrophobicContact CG-CB 4.11Å; R259-P328 PolarHBondContact N-O 3.44Å; R259-T329 HydrophobicContact CG-CG2 4.25Å; R259-T329 CarbonylContact O-C 3.6Å; R259-T329 VanDerWaalsContact O-CA 3.27Å; R259-T329 WeakPolarHBondContact O-CA 3.25Å; R259-T330 PolarHBondContact O-N 3.47Å
260	F	86.2	Confident	90.4	Very high	10 Å²	10	29.6 Å²	29.6	4%	0.044	16%	0.163	C	C	.	.			trans	-72.6	147	162.2	-63.7	-71.6	0	0	0	111	R228 Q231 Q235 S262 T330	R228-F260 VanDerWaalsContact CA-CE2 3.44Å; R228-F260 HydrophobicContact CB-CE2 4.04Å; R228-F260 HydrophobicContact CB-CZ 4.37Å; R228-F260 HydrophobicContact CG-CD2 4.28Å; R228-F260 HydrophobicContact CG-CE2 4.1Å; R228-F260 HydrophobicContact CG-CZ 4.36Å; R228-F260 WeakPolarHBondContact O-CE2 3.47Å; R228-F260 WeakPolarHBondContact O-CZ 3.41Å; Q231-F260 VanDerWaalsContact CA-CE2 3.42Å; Q231-F260 HydrophobicContact CB-CD2 3.87Å; Q231-F260 HydrophobicContact CB-CE2 3.25Å; Q231-F260 HydrophobicContact CB-CZ 3.69Å; Q231-F260 HydrophobicContact CG-CD1 4.23Å; Q231-F260 HydrophobicContact CG-CD2 3.6Å; Q231-F260 HydrophobicContact CG-CE1 4.08Å; Q231-F260 HydrophobicContact CG-CE2 3.38Å; Q231-F260 HydrophobicContact CG-CG 4Å; Q231-F260 HydrophobicContact CG-CZ 3.66Å; Q235-F260 HydrophobicContact CG-CB 4.21Å; F260-S262 PolarHBondContact O-N 2.93Å; F260-S262 VanDerWaalsContact O-N 3.1Å; F260-T330 WeakPolarHBondContact CD1-O 3.2Å
261	A	83.6	Confident	90.4	Very high	76 Å²	76	27.2 Å²	27.2	63%	0.628	15%	0.151	S	C	*	.			trans	-61.5	115.3	167.5	0	0	0	0	0	109	T329	A261-T329 HydrophobicContact CB-CG2 4.43Å
262	S	84.1	Confident	90.3	Very high	22 Å²	22	26.3 Å²	26.3	15%	0.154	15%	0.145	C	C	.	.			trans	-140.9	142.4	174	170	0	0	0	0	108.6	Q235 R259 F260 K264	Q235-S262 WeakPolarHBondContact O-CB 3.08Å; Q235-S262 PolarHBondContact O-OG 3.05Å; R259-S262 PolarHBondContact NH1-O 2.61Å; R259-S262 VanDerWaalsContact NH1-O 3.14Å; F260-S262 PolarHBondContact O-N 2.93Å; F260-S262 VanDerWaalsContact O-N 3.1Å; S262-K264 PolarHBondContact OG-N 3.09Å
263	N	83.7	Confident	90	Very high	127 Å²	127	28.4 Å²	28.4	68%	0.679	16%	0.159	S	C	*	.	S	Bend	trans	-91.7	-3.9	172.1	65.4	-19.3	0	0	0	113
264	K	86.2	Confident	89.6	Confident	106 Å²	106	31.3 Å²	31.3	46%	0.461	17%	0.173	S	C	.	.	S	Bend	trans	-87.6	-38.9	180	-63.1	-60.4	-173.4	173.9	0	112.4	Q238 S262 T266	Q238-K264 WeakPolarHBondContact CA-O 3.05Å; S262-K264 PolarHBondContact OG-N 3.09Å; K264-T266 VanDerWaalsContact O-CG2 3.29Å; K264-T266 WeakPolarHBondContact O-CG2 3.28Å; K264-T266 PolarHBondContact O-N 3.33Å; K264-T266 VanDerWaalsContact O-N 3.15Å
265	L	87.8	Confident	89.3	Confident	7 Å²	7	31 Å²	31	4%	0.037	17%	0.171	C	C	.	.			trans	-64	115.8	177.1	-174.5	68.6	0	0	0	109.2	T237 Q238 I240 V268 P324 L327	T237-L265 VanDerWaalsContact O-CA 3.24Å; T237-L265 WeakPolarHBondContact O-CA 3.43Å; T237-L265 PolarHBondContact O-N 3.41Å; Q238-L265 CarbonylContact O-C 3.53Å; Q238-L265 WeakPolarHBondContact O-CA 3.38Å; I240-L265 HydrophobicContact CD1-CD1 4.37Å; I240-L265 HydrophobicContact CG1-CD1 4.47Å; L265-V268 HydrophobicContact CD1-CG2 4.15Å; L265-V268 HydrophobicContact CD2-CG2 4.05Å; L265-V268 HydrophobicContact CG-CG2 4.43Å; L265-P324 HydrophobicContact CG-CG 4.46Å; L265-P324 VanDerWaalsContact O-CB 3.29Å; L265-P324 WeakPolarHBondContact O-CB 3.45Å; L265-P324 WeakPolarHBondContact O-CG 3.47Å; L265-L327 HydrophobicContact CD2-CD1 4.38Å
266	T	84.9	Confident	89.1	Confident	8 Å²	8	27.4 Å²	27.4	5%	0.049	16%	0.155	C	C	.	.			trans	-103.2	-28.7	-178	64.8	0	0	0	0	112.2	Q238 K264 H290 T292 P324	Q238-T266 PolarHBondContact O-N 3.16Å; Q238-T266 PolarHBondContact O-OG1 3.06Å; K264-T266 VanDerWaalsContact O-CG2 3.29Å; K264-T266 WeakPolarHBondContact O-CG2 3.28Å; K264-T266 PolarHBondContact O-N 3.33Å; K264-T266 VanDerWaalsContact O-N 3.15Å; T266-H290 HydrophobicContact CG2-CB 3.62Å; T266-T292 HydrophobicContact CG2-CG2 4.16Å; T266-P324 WeakPolarHBondContact O-CD 3.26Å; T266-P324 WeakPolarHBondContact O-CG 3.21Å
267	Q	85.9	Confident	88.6	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161	149.4	178.5	61.2	-173.8	2.9	0	0	115.1	Y239 I240 V269 P283 Q321	Y239-Q267 WeakPolarHBondContact CA-O 3.4Å; I240-Q267 PolarHBondContact N-O 3.27Å; I240-Q267 VanDerWaalsContact N-O 3.11Å; Q267-V269 HydrophobicContact CB-CG2 4.4Å; Q267-V269 HydrophobicContact CG-CG2 4.3Å; Q267-P283 PolarHBondContact NE2-O 3.33Å; Q267-P283 PolarHBondContact OE1-O 2.68Å; Q267-Q321 HydrophobicContact CB-CG 4.32Å
268	V	92.7	Very high	88	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	122.4	167.2	-179.7	0	0	0	0	108.6	F227 I240 L265 F270 Q321 F322 L327	F227-V268 HydrophobicContact CE1-CG1 3.92Å; F227-V268 HydrophobicContact CE1-CG2 3.78Å; F227-V268 HydrophobicContact CZ-CG1 3.67Å; F227-V268 HydrophobicContact CZ-CG2 4.24Å; I240-V268 HydrophobicContact CB-CG2 4.42Å; I240-V268 WeakPolarHBondContact O-CA 2.98Å; L265-V268 HydrophobicContact CD1-CG2 4.15Å; L265-V268 HydrophobicContact CD2-CG2 4.05Å; L265-V268 HydrophobicContact CG-CG2 4.43Å; V268-F270 HydrophobicContact CG1-CD2 4.48Å; V268-F270 HydrophobicContact CG1-CE2 3.69Å; V268-F270 HydrophobicContact CG1-CZ 4.22Å; V268-Q321 CarbonylContact O-C 3.58Å; V268-Q321 WeakPolarHBondContact O-CA 3.31Å; V268-F322 HydrophobicContact CB-CB 4.46Å; V268-F322 PolarHBondContact N-O 2.97Å; V268-F322 PolarHBondContact O-N 3.43Å; V268-L327 HydrophobicContact CB-CD1 4.23Å; V268-L327 HydrophobicContact CG2-CD1 3.63Å
269	V	93.3	Very high	87.2	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	133.4	-169.7	-178.4	0	0	0	0	110.7	I240 C241 I242 Q267 R271 P283 Q321	I240-V269 PolarHBondContact O-N 2.74Å; C241-V269 WeakPolarHBondContact CA-O 3.42Å; I242-V269 PolarHBondContact N-O 2.8Å; Q267-V269 HydrophobicContact CB-CG2 4.4Å; Q267-V269 HydrophobicContact CG-CG2 4.3Å; V269-R271 HydrophobicContact CG1-CG 4.37Å; V269-P283 HydrophobicContact CB-CG 4.34Å; V269-P283 HydrophobicContact CG1-CG 3.88Å; V269-P283 HydrophobicContact CG2-CG 3.55Å; V269-Q321 HydrophobicContact CG2-CB 4.23Å; V269-Q321 HydrophobicContact CG2-CG 4.03Å
270	F	94.9	Very high	86.6	Confident	1 Å²	1	41.2 Å²	41.2	0%	0.004	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	119.1	173.5	-69.7	-87.5	0	0	0	109.5	I222 I242 L247 I252 V268 I314 D319 C320 F322	I222-F270 HydrophobicContact CG2-CE1 4.09Å; I242-F270 HydrophobicContact CB-CD1 3.99Å; I242-F270 HydrophobicContact CB-CE1 3.87Å; I242-F270 HydrophobicContact CD1-CE1 3.77Å; I242-F270 HydrophobicContact CD1-CZ 3.93Å; I242-F270 HydrophobicContact CG1-CE1 4.36Å; I242-F270 HydrophobicContact CG2-CD1 4.18Å; I242-F270 HydrophobicContact CG2-CE1 4Å; L247-F270 HydrophobicContact CD1-CD1 3.88Å; L247-F270 HydrophobicContact CD1-CE1 4Å; I252-F270 HydrophobicContact CD1-CD1 4.34Å; I252-F270 HydrophobicContact CD1-CD2 4.43Å; I252-F270 HydrophobicContact CD1-CE1 3.55Å; I252-F270 HydrophobicContact CD1-CE2 3.66Å; I252-F270 HydrophobicContact CD1-CZ 3.17Å; I252-F270 HydrophobicContact CG1-CE1 4.44Å; I252-F270 HydrophobicContact CG1-CZ 4.4Å; V268-F270 HydrophobicContact CG1-CD2 4.48Å; V268-F270 HydrophobicContact CG1-CE2 3.69Å; V268-F270 HydrophobicContact CG1-CZ 4.22Å; F270-I314 HydrophobicContact CB-CB 4.46Å; F270-I314 HydrophobicContact CB-CD1 4.3Å; F270-I314 HydrophobicContact CB-CG2 4.09Å; F270-I314 HydrophobicContact CD1-CD1 4.45Å; F270-I314 HydrophobicContact CD1-CG2 4.22Å; F270-I314 HydrophobicContact CD2-CG2 3.88Å; F270-I314 HydrophobicContact CE2-CG2 4.43Å; F270-I314 HydrophobicContact CG-CG2 3.78Å; F270-D319 WeakPolarHBondContact O-CA 3.28Å; F270-C320 PolarHBondContact N-O 3.38Å; F270-C320 PolarHBondContact O-N 2.98Å; F270-F322 HydrophobicContact CD2-CD2 4.04Å; F270-F322 AromaticContact CD2-CE2 4Å; F270-F322 HydrophobicContact CD2-CE2 4Å; F270-F322 AromaticContact CE2-CD2 3.8Å; F270-F322 HydrophobicContact CE2-CD2 3.8Å; F270-F322 AromaticContact CE2-CE2 3.82Å; F270-F322 HydrophobicContact CE2-CE2 3.82Å
271	R	93.5	Very high	86	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	99.9	-179.8	-58.9	-62.8	-162.7	160.1	6.6	109.8	I242 G244 V269 G275 L276 L281 E298 D319	I242-R271 PolarHBondContact O-N 3.06Å; G244-R271 PolarHBondContact N-O 3.33Å; V269-R271 HydrophobicContact CG1-CG 4.37Å; R271-G275 WeakPolarHBondContact O-CA 2.95Å; R271-L276 HydrophobicContact CB-CB 4.17Å; R271-L276 HydrophobicContact CG-CB 4.15Å; R271-L276 HydrophobicContact CG-CD1 3.87Å; R271-L281 PolarHBondContact NH2-O 3.42Å; R271-E298 IonicContact CZ-OE1 2.69Å; R271-E298 IonicContact CZ-OE2 3.97Å; R271-E298 VanDerWaalsContact NH1-CD 3.33Å; R271-E298 IonicContact NH1-OE1 3.83Å; R271-E298 PolarHBondContact NH1-OE1 3.24Å; R271-E298 IonicContact NH1-OE2 3.03Å; R271-E298 PolarHBondContact NH1-OE2 2.79Å; R271-E298 IonicContact NH2-OE1 3.84Å; R271-E298 IonicContact NH2-OE2 3.94Å; R271-E298 PolarHBondContact NH2-OE2 2.54Å; R271-D319 WeakPolarHBondContact CA-OD1 3.34Å; R271-D319 VanDerWaalsContact CD-OD2 3.22Å; R271-D319 WeakPolarHBondContact CD-OD2 3.45Å; R271-D319 IonicContact CZ-OD2 3.67Å; R271-D319 IonicContact NH1-OD2 2.93Å; R271-D319 PolarHBondContact NH1-OD2 3.15Å
272	S	92.4	Very high	85.7	Confident	6 Å²	6	40.4 Å²	40.4	4%	0.042	20%	0.2	C	C	.	.			trans	-104.3	-28.9	-174.8	-50.6	0	0	0	0	113.7	R245 T315 S316 D319	R245-S272 VanDerWaalsContact CG-O 3.32Å; R245-S272 WeakPolarHBondContact CG-O 3.28Å; S272-T315 WeakPolarHBondContact CB-O 3.33Å; S272-T315 PolarHBondContact OG-O 3.1Å; S272-S316 WeakPolarHBondContact CB-O 3.1Å; S272-D319 PolarHBondContact N-OD1 3.05Å
273	S	87.2	Confident	85.7	Confident	46 Å²	46	39.4 Å²	39.4	32%	0.322	19%	0.193	S	C	.	.	S	Bend	trans	-66	-57	-173.2	56.4	0	0	0	0	112.7	N317 D319	S273-N317 WeakPolarHBondContact CB-O 2.9Å; S273-D319 WeakPolarHBondContact CB-OD1 2.96Å; S273-D319 PolarHBondContact N-OD1 2.66Å; S273-D319 PolarHBondContact OG-OD1 2.65Å; S273-D319 PolarHBondContact OG-OD2 2.85Å
274	N	86.9	Confident	85.5	Confident	100 Å²	100	38.4 Å²	38.4	54%	0.535	18%	0.183	S	C	.	.	S	Bend	trans	-124.8	8.5	-178.3	-71.7	-41.4	0	0	0	112.6	R245	R245-N274 PolarHBondContact NH1-O 3.3Å
275	G	87	Confident	85	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.166	C	C	.	.			trans	74.7	-179.4	-174.1	0	0	0	0	0	113.5	R245 R271 R280	R245-G275 VanDerWaalsContact CD-N 3.27Å; R271-G275 WeakPolarHBondContact O-CA 2.95Å; G275-R280 PolarHBondContact O-NH1 3.44Å
276	L	89.7	Confident	84.4	Confident	9 Å²	9	37.8 Å²	37.8	5%	0.047	19%	0.185	C	C	.	.			trans	-87.3	126.6	174.5	-176.2	60.8	0	0	0	109.2	Y181 E214 C241 D243 R271	Y181-L276 HydrophobicContact CE1-CG 4.08Å; Y181-L276 VanDerWaalsContact OH-CG 3.25Å; Y181-L276 WeakPolarHBondContact OH-CG 3.32Å; E214-L276 HydrophobicContact CB-CD2 4.07Å; C241-L276 HydrophobicContact CB-CD1 4.22Å; C241-L276 HydrophobicContact CB-CD2 3.99Å; D243-L276 HydrophobicContact CB-CB 4.04Å; R271-L276 HydrophobicContact CB-CB 4.17Å; R271-L276 HydrophobicContact CG-CB 4.15Å; R271-L276 HydrophobicContact CG-CD1 3.87Å
277	K	84.8	Confident	83.7	Confident	119 Å²	119	40.1 Å²	40.1	52%	0.517	20%	0.197	S	C	.	.			trans	-119.3	142.1	-179.3	-63.6	-178.5	-179.3	179	0	108.6	E279 R280	K277-E279 VanDerWaalsContact C-N 3.28Å; K277-E279 PolarHBondContact O-N 3.46Å; K277-R280 HydrophobicContact CB-CB 4.29Å; K277-R280 VanDerWaalsContact O-CB 3.26Å; K277-R280 WeakPolarHBondContact O-CB 3.41Å; K277-R280 PolarHBondContact O-N 3.26Å
278	R	79.7	Confident	82.6	Confident	31 Å²	31	47.8 Å²	47.8	12%	0.117	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-39.1	-173.3	-56.7	174.8	-175.4	-155.7	-4.6	114	G24 Y25 W26 D166 Y181 E182 P183 R184 R280	G24-R278 CarbonylContact O-C 3.47Å; G24-R278 WeakPolarHBondContact O-CA 3.38Å; G24-R278 WeakPolarHBondContact O-CB 3.41Å; G24-R278 VanDerWaalsContact O-O 3.06Å; Y25-R278 WeakPolarHBondContact CA-O 3.35Å; Y25-R278 HydrophobicContact CD1-CB 4.17Å; Y25-R278 HydrophobicContact CD1-CG 4.32Å; Y25-R278 HydrophobicContact CE1-CB 4.34Å; Y25-R278 HydrophobicContact CE1-CG 3.98Å; Y25-R278 VanDerWaalsContact OH-CZ 3.3Å; Y25-R278 PolarHBondContact OH-NH1 3.2Å; Y25-R278 VanDerWaalsContact OH-NH1 3.1Å; W26-R278 PolarHBondContact N-O 3.49Å; W26-R278 VanDerWaalsContact N-O 3.1Å; D166-R278 IonicContact OD2-CZ 3.61Å; D166-R278 VanDerWaalsContact OD2-CZ 3.27Å; D166-R278 IonicContact OD2-NH1 2.74Å; D166-R278 PolarHBondContact OD2-NH1 3.09Å; D166-R278 IonicContact OD2-NH2 2.59Å; D166-R278 PolarHBondContact OD2-NH2 2.9Å; Y181-R278 HydrophobicContact CD1-CB 4.4Å; Y181-R278 HydrophobicContact CD1-CG 3.38Å; Y181-R278 HydrophobicContact CD2-CG 4.35Å; Y181-R278 HydrophobicContact CE1-CB 4.22Å; Y181-R278 HydrophobicContact CE1-CG 3.67Å; Y181-R278 HydrophobicContact CG-CG 3.74Å; E182-R278 PolarHBondContact O-NH2 3.02Å; P183-R278 VanDerWaalsContact CA-NH2 3.25Å; R184-R278 VanDerWaalsContact N-NH2 3.18Å; R278-R280 VanDerWaalsContact C-N 3.26Å; R278-R280 PolarHBondContact O-N 2.99Å
279	E	75.6	Confident	81	Confident	140 Å²	140	55.5 Å²	55.5	65%	0.654	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-9.8	-175.7	-67.2	176.9	-168.4	0	0	112.5	G24 K277	G24-E279 VanDerWaalsContact O-CA 3.28Å; G24-E279 WeakPolarHBondContact O-CA 3.47Å; G24-E279 WeakPolarHBondContact O-CG 3.44Å; G24-E279 PolarHBondContact O-N 3.47Å; K277-E279 VanDerWaalsContact C-N 3.28Å; K277-E279 PolarHBondContact O-N 3.46Å
280	R	78.3	Confident	79.5	Confident	57 Å²	57	58.2 Å²	58.2	22%	0.215	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-83.6	124.4	-174.9	-164.9	178.6	-171.3	179	3.1	109.1	G275 K277 R278 E298 D319	G275-R280 PolarHBondContact O-NH1 3.44Å; K277-R280 HydrophobicContact CB-CB 4.29Å; K277-R280 VanDerWaalsContact O-CB 3.26Å; K277-R280 WeakPolarHBondContact O-CB 3.41Å; K277-R280 PolarHBondContact O-N 3.26Å; R278-R280 VanDerWaalsContact C-N 3.26Å; R278-R280 PolarHBondContact O-N 2.99Å; R280-E298 IonicContact CZ-OE1 3.98Å; R280-E298 IonicContact NE-OE1 3.18Å; R280-E298 PolarHBondContact NE-OE1 3.06Å; R280-E298 IonicContact NE-OE2 3Å; R280-E298 IonicContact NH2-OE1 3.33Å; R280-E298 PolarHBondContact NH2-OE1 2.81Å; R280-D319 IonicContact CZ-OD2 3.53Å; R280-D319 IonicContact NH1-OD2 3.35Å; R280-D319 PolarHBondContact NH1-OD2 2.91Å; R280-D319 IonicContact NH2-OD2 3.05Å; R280-D319 PolarHBondContact NH2-OD2 2.81Å
281	L	74.8	Confident	77.7	Confident	69 Å²	69	64.8 Å²	64.8	36%	0.361	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-65.5	153.9	175.3	-70.6	162.2	0	0	0	110.6	W26 R271	W26-L281 HydrophobicContact CB-CD2 3.76Å; W26-L281 HydrophobicContact CB-CG 4.36Å; W26-L281 HydrophobicContact CD2-CD2 4.04Å; W26-L281 HydrophobicContact CE3-CD2 3.77Å; W26-L281 HydrophobicContact CG-CD2 4.06Å; R271-L281 PolarHBondContact NH2-O 3.42Å
282	P	77.4	Confident	75.9	Confident	1 Å²	1	65.9 Å²	65.9	1%	0.006	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-57.5	145.2	160.4	-18.6	31.4	0	0	0	109.1	W26 Y239 F294 S296	W26-P282 HydrophobicContact CZ2-CG 3.98Å; Y239-P282 HydrophobicContact CD2-CB 4.37Å; Y239-P282 HydrophobicContact CD2-CG 4.19Å; Y239-P282 HydrophobicContact CE1-CG 4.4Å; Y239-P282 HydrophobicContact CE2-CB 4.49Å; Y239-P282 HydrophobicContact CE2-CG 3.87Å; P282-F294 HydrophobicContact CB-CD2 4.29Å; P282-F294 HydrophobicContact CB-CE2 3.62Å; P282-F294 HydrophobicContact CB-CZ 3.91Å; P282-F294 HydrophobicContact CG-CD2 4.41Å; P282-F294 HydrophobicContact CG-CE2 4.05Å; P282-F294 HydrophobicContact CG-CZ 4.15Å; P282-S296 WeakPolarHBondContact O-CB 3.32Å; P282-S296 PolarHBondContact O-OG 2.91Å; P282-S296 VanDerWaalsContact O-OG 3.06Å
283	P	82.4	Confident	74.1	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-71.1	172.5	178.3	34.3	-34.9	0	0	0	111.1	Q267 V269 E298 V300	Q267-P283 PolarHBondContact NE2-O 3.33Å; Q267-P283 PolarHBondContact OE1-O 2.68Å; V269-P283 HydrophobicContact CB-CG 4.34Å; V269-P283 HydrophobicContact CG1-CG 3.88Å; V269-P283 HydrophobicContact CG2-CG 3.55Å; P283-E298 WeakPolarHBondContact CA-O 3.29Å; P283-E298 HydrophobicContact CB-CB 4.48Å; P283-E298 HydrophobicContact CB-CG 4.46Å; P283-E298 VanDerWaalsContact CB-O 3.28Å; P283-E298 WeakPolarHBondContact CB-O 3.35Å; P283-V300 HydrophobicContact CB-CB 4.22Å; P283-V300 HydrophobicContact CB-CG1 3.54Å; P283-V300 HydrophobicContact CB-CG2 3.66Å; P283-V300 HydrophobicContact CG-CB 4.47Å; P283-V300 HydrophobicContact CG-CG1 3.97Å; P283-V300 HydrophobicContact CG-CG2 3.66Å
284	K	80.4	Confident	72.8	Confident	107 Å²	107	67.9 Å²	67.9	47%	0.465	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-61.9	133	173.5	-164.3	175.4	176.1	178.3	0	110.6	S296 E298 Q321	K284-S296 VanDerWaalsContact CB-O 3.28Å; K284-S296 WeakPolarHBondContact CB-O 3.37Å; K284-E298 PolarHBondContact N-O 2.93Å; K284-Q321 PolarHBondContact O-OE1 3.13Å
285	P	76.7	Confident	71.5	Confident	18 Å²	18	69.5 Å²	69.5	12%	0.117	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-57.8	140.5	170.7	-23.4	33.1	0	0	0	112.2	D287 T292	P285-D287 PolarHBondContact O-N 3.38Å; P285-T292 HydrophobicContact CG-CG2 3.52Å
286	L	73.8	Confident	70.8	Confident	82 Å²	82	70 Å²	70	43%	0.429	34%	0.343	S	S	.	.	S	Bend	trans	-65	-24.7	175.5	-71	170.6	0	0	0	113.3	P302 Q321	L286-P302 HydrophobicContact CD1-CB 4.45Å; L286-Q321 HydrophobicContact CD1-CB 4.36Å; L286-Q321 HydrophobicContact CD1-CG 3.97Å; L286-Q321 HydrophobicContact CG-CG 4.19Å
287	D	70.3	Confident	70	Confident	56 Å²	56	77 Å²	77	30%	0.299	38%	0.38	S	S	.	.			trans	-109.3	127.8	-177.3	-167	-15.7	0	0	0	111	P285 H289	P285-D287 PolarHBondContact O-N 3.38Å; D287-H289 VanDerWaalsContact C-N 3.25Å; D287-H289 PolarHBondContact O-N 3.41Å; D287-H289 WeakPolarHBondContact OD1-CB 3.39Å; D287-H289 IonicContact OD1-CD2 2.89Å; D287-H289 PolarHBondContact OD1-CD2 3.47Å; D287-H289 IonicContact OD1-CG 3.27Å; D287-H289 PolarHBondContact OD1-N 2.84Å
288	I	63.8	Low	69.9	Low	162 Å²	162	73.7 Å²	73.7	83%	0.831	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-19.8	-178.3	-57.9	163.8	0	0	0	111	H290	I288-H290 PolarHBondContact O-N 2.79Å
289	H	58.7	Low	69.9	Low	162 Å²	162	80 Å²	80	75%	0.75	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-13.8	-177.4	-63.6	-56.1	0	0	0	114.2	D287	D287-H289 VanDerWaalsContact C-N 3.25Å; D287-H289 PolarHBondContact O-N 3.41Å; D287-H289 WeakPolarHBondContact OD1-CB 3.39Å; D287-H289 IonicContact OD1-CD2 2.89Å; D287-H289 PolarHBondContact OD1-CD2 3.47Å; D287-H289 IonicContact OD1-CG 3.27Å; D287-H289 PolarHBondContact OD1-N 2.84Å
290	H	61.7	Low	70.4	Confident	56 Å²	56	74.4 Å²	74.4	26%	0.259	37%	0.373	S	S	.	.			trans	-96.3	108	178.2	-67.6	-57.8	0	0	0	110.5	T266 I288 T292	T266-H290 HydrophobicContact CG2-CB 3.62Å; I288-H290 PolarHBondContact O-N 2.79Å; H290-T292 PolarHBondContact O-N 3.04Å; H290-T292 VanDerWaalsContact O-N 3.13Å
291	T	55.9	Low	70.9	Confident	140 Å²	140	76.9 Å²	76.9	86%	0.859	39%	0.387	S	S	*	.			trans	-69	106.8	165.3	48	0	0	0	0	108.8
292	T	57.4	Low	71.7	Confident	23 Å²	23	77.8 Å²	77.8	14%	0.141	40%	0.397	C	S	.	.			trans	-86.7	145	165.7	47.3	0	0	0	0	109.8	T266 P285 H290 F294	T266-T292 HydrophobicContact CG2-CG2 4.16Å; P285-T292 HydrophobicContact CG-CG2 3.52Å; H290-T292 PolarHBondContact O-N 3.04Å; H290-T292 VanDerWaalsContact O-N 3.13Å; T292-F294 WeakPolarHBondContact CB-O 3.43Å; T292-F294 HydrophobicContact CG2-CE1 4.29Å; T292-F294 HydrophobicContact CG2-CE2 4.4Å; T292-F294 HydrophobicContact CG2-CZ 3.99Å; T292-F294 PolarHBondContact O-N 3.46Å; T292-F294 PolarHBondContact OG1-O 3.06Å
293	E	54.4	Low	72.5	Confident	77 Å²	77	78.4 Å²	78.4	36%	0.36	40%	0.401	S	S	.	.	S	Bend	trans	-63.4	-21	174.1	-71.6	176.4	-156.4	0	0	112.4	Y177	Y177-E293 PolarHBondContact OH-OE2 3.09Å
294	F	58.8	Low	72.9	Confident	17 Å²	17	80.9 Å²	80.9	8%	0.075	42%	0.417	C	S	.	.	S	Bend	trans	-111.1	146.8	176.9	57.6	-89.6	0	0	0	111.1	W26 Y239 P282 T292	W26-F294 HydrophobicContact CH2-CD1 4.18Å; W26-F294 HydrophobicContact CZ3-CB 4.37Å; Y239-F294 AromaticContact CD1-CE1 3.84Å; Y239-F294 HydrophobicContact CD1-CE1 3.84Å; Y239-F294 HydrophobicContact CD1-CZ 4.16Å; Y239-F294 HydrophobicContact CE1-CE1 4.31Å; Y239-F294 HydrophobicContact CG-CE1 4.48Å; Y239-F294 HydrophobicContact CG-CZ 4.35Å; P282-F294 HydrophobicContact CB-CD2 4.29Å; P282-F294 HydrophobicContact CB-CE2 3.62Å; P282-F294 HydrophobicContact CB-CZ 3.91Å; P282-F294 HydrophobicContact CG-CD2 4.41Å; P282-F294 HydrophobicContact CG-CE2 4.05Å; P282-F294 HydrophobicContact CG-CZ 4.15Å; T292-F294 WeakPolarHBondContact CB-O 3.43Å; T292-F294 HydrophobicContact CG2-CE1 4.29Å; T292-F294 HydrophobicContact CG2-CE2 4.4Å; T292-F294 HydrophobicContact CG2-CZ 3.99Å; T292-F294 PolarHBondContact O-N 3.46Å; T292-F294 PolarHBondContact OG1-O 3.06Å
295	Q	60.5	Low	73.4	Confident	133 Å²	133	84.1 Å²	84.1	62%	0.621	43%	0.432	S	S	*	.			trans	-117.3	126.8	170.6	-65.5	-176.1	-6.8	0	0	108.3
296	S	71.9	Confident	74.2	Confident	11 Å²	11	83.8 Å²	83.8	8%	0.077	43%	0.429	C	S	.	.			trans	-125	136.1	174.2	-179.7	0	0	0	0	107.7	P282 K284 E298	P282-S296 WeakPolarHBondContact O-CB 3.32Å; P282-S296 PolarHBondContact O-OG 2.91Å; P282-S296 VanDerWaalsContact O-OG 3.06Å; K284-S296 VanDerWaalsContact CB-O 3.28Å; K284-S296 WeakPolarHBondContact CB-O 3.37Å; S296-E298 WeakPolarHBondContact OG-CB 3.35Å; S296-E298 PolarHBondContact OG-N 3.05Å
297	D	73.9	Confident	75	Confident	156 Å²	156	83.4 Å²	83.4	83%	0.834	43%	0.43	S	S	*	.			trans	-86.2	0.3	172.3	-62.9	-37.4	0	0	0	111.6	E299	D297-E299 PolarHBondContact O-N 2.71Å; D297-E299 VanDerWaalsContact O-N 3.15Å
298	E	82.4	Confident	75.9	Confident	50 Å²	50	87.2 Å²	87.2	23%	0.234	45%	0.446	C	S	.	.			trans	-72.1	108.1	177.2	-172.7	-177.6	-173.4	0	0	110.2	R271 R280 P283 K284 S296	R271-E298 IonicContact CZ-OE1 2.69Å; R271-E298 IonicContact CZ-OE2 3.97Å; R271-E298 VanDerWaalsContact NH1-CD 3.33Å; R271-E298 IonicContact NH1-OE1 3.83Å; R271-E298 PolarHBondContact NH1-OE1 3.24Å; R271-E298 IonicContact NH1-OE2 3.03Å; R271-E298 PolarHBondContact NH1-OE2 2.79Å; R271-E298 IonicContact NH2-OE1 3.84Å; R271-E298 IonicContact NH2-OE2 3.94Å; R271-E298 PolarHBondContact NH2-OE2 2.54Å; R280-E298 IonicContact CZ-OE1 3.98Å; R280-E298 IonicContact NE-OE1 3.18Å; R280-E298 PolarHBondContact NE-OE1 3.06Å; R280-E298 IonicContact NE-OE2 3Å; R280-E298 IonicContact NH2-OE1 3.33Å; R280-E298 PolarHBondContact NH2-OE1 2.81Å; P283-E298 WeakPolarHBondContact CA-O 3.29Å; P283-E298 HydrophobicContact CB-CB 4.48Å; P283-E298 HydrophobicContact CB-CG 4.46Å; P283-E298 VanDerWaalsContact CB-O 3.28Å; P283-E298 WeakPolarHBondContact CB-O 3.35Å; K284-E298 PolarHBondContact N-O 2.93Å; S296-E298 WeakPolarHBondContact OG-CB 3.35Å; S296-E298 PolarHBondContact OG-N 3.05Å
299	E	78.5	Confident	77.2	Confident	163 Å²	163	86 Å²	86	76%	0.762	44%	0.436	S	S	*	.			trans	-84.1	135.1	170.6	-65	-173.7	168.8	0	0	110.7	D297	D297-E299 PolarHBondContact O-N 2.71Å; D297-E299 VanDerWaalsContact O-N 3.15Å
300	V	86.7	Confident	78.9	Confident	22 Å²	22	84.4 Å²	84.4	13%	0.133	43%	0.427	C	S	.	.			trans	-124.1	156.1	175.8	-67.5	0	0	0	0	110.1	P283 D319 Q321	P283-V300 HydrophobicContact CB-CB 4.22Å; P283-V300 HydrophobicContact CB-CG1 3.54Å; P283-V300 HydrophobicContact CB-CG2 3.66Å; P283-V300 HydrophobicContact CG-CB 4.47Å; P283-V300 HydrophobicContact CG-CG1 3.97Å; P283-V300 HydrophobicContact CG-CG2 3.66Å; V300-D319 HydrophobicContact CG1-CB 4.11Å; V300-Q321 HydrophobicContact CG2-CB 3.59Å; V300-Q321 HydrophobicContact CG2-CG 4.46Å
301	Q	89.8	Confident	80.4	Confident	109 Å²	109	85.3 Å²	85.3	51%	0.509	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	149	-179.7	-67.5	-170.2	-3.7	0	0	110.9	C303 D319 C320 Q321	Q301-C303 PolarHBondContact O-N 2.88Å; Q301-D319 PolarHBondContact N-O 2.9Å; Q301-C320 CarbonylContact O-C 3.37Å; Q301-C320 WeakPolarHBondContact O-CA 3.36Å; Q301-C320 WeakPolarHBondContact O-CB 3.34Å; Q301-Q321 PolarHBondContact O-N 3.45Å
302	P	90.9	Very high	82.2	Confident	88 Å²	88	78.7 Å²	78.7	57%	0.571	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65	137.3	168	28	-33.3	0	0	0	109.8	L286 Q321	L286-P302 HydrophobicContact CD1-CB 4.45Å; P302-Q321 WeakPolarHBondContact CA-O 3.4Å
303	C	92.9	Very high	83.9	Confident	14 Å²	14	81.9 Å²	81.9	10%	0.095	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-66.1	153.1	171.5	-66.1	0	0	0	0	110.5	Q301 C320 Q321 F322	Q301-C303 PolarHBondContact O-N 2.88Å; C303-C320 VanDerWaalsContact CA-SG 3.57Å; C303-C320 HydrophobicContact CB-CB 3.86Å; C303-C320 WeakPolarHBondContact CB-SG 3.24Å; C303-C320 WeakPolarHBondContact SG-CB 3.41Å; C303-C320 CovalentContact SG-SG 2.05Å; C303-C320 PolarHBondContact SG-SG 2.93Å; C303-Q321 PolarHBondContact N-O 2.04Å; C303-Q321 VanDerWaalsContact SG-C 3.51Å; C303-Q321 PolarHBondContact SG-N 3.06Å; C303-F322 HydrophobicContact CB-CD1 3.61Å; C303-F322 HydrophobicContact CB-CD2 3.96Å; C303-F322 HydrophobicContact CB-CE1 3.34Å; C303-F322 HydrophobicContact CB-CE2 3.72Å; C303-F322 HydrophobicContact CB-CG 3.91Å; C303-F322 HydrophobicContact CB-CZ 3.4Å; C303-F322 VanDerWaalsContact SG-CE2 3.59Å
304	P	92.6	Very high	85.7	Confident	52 Å²	52	78.6 Å²	78.6	34%	0.338	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-51.2	144.8	172.9	-26.8	33.5	0	0	0	112.9	N313 F322	P304-N313 HydrophobicContact CB-CB 4.41Å; P304-N313 WeakPolarHBondContact CD-O 3.31Å; P304-N313 HydrophobicContact CG-CB 4.31Å; P304-F322 WeakPolarHBondContact O-CE1 3.08Å
305	F	91.1	Very high	87.1	Confident	175 Å²	175	79.2 Å²	79.2	77%	0.768	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-61.4	139.7	179.6	-174.6	-94.6	0	0	0	112	V307	F305-V307 PolarHBondContact O-N 2.99Å
306	I	92.5	Very high	88.2	Confident	12 Å²	12	75.4 Å²	75.4	6%	0.062	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-81.2	116.6	-179.6	-58.1	-176.7	0	0	0	109.6	F254 T257 A312 F322 L327	F254-I306 HydrophobicContact CD2-CG2 3.91Å; F254-I306 HydrophobicContact CE2-CG2 3.97Å; T257-I306 HydrophobicContact CG2-CD1 4.17Å; I306-A312 HydrophobicContact CD1-CB 4Å; I306-A312 HydrophobicContact CG1-CB 3.81Å; I306-A312 HydrophobicContact CG2-CB 4.25Å; I306-F322 HydrophobicContact CD1-CD1 4.09Å; I306-F322 HydrophobicContact CD1-CE1 3.77Å; I306-F322 HydrophobicContact CD1-CZ 4.24Å; I306-F322 HydrophobicContact CG1-CD1 4.28Å; I306-F322 HydrophobicContact CG1-CE1 3.65Å; I306-F322 HydrophobicContact CG1-CZ 4.27Å; I306-L327 HydrophobicContact CD1-CD2 3.74Å
307	V	91.2	Very high	88.9	Confident	74 Å²	74	81 Å²	81	45%	0.448	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-88.2	127.4	171.6	-178.6	0	0	0	0	108.8	F305 H309 K310	F305-V307 PolarHBondContact O-N 2.99Å; V307-H309 PolarHBondContact O-N 3.37Å; V307-K310 HydrophobicContact CB-CB 4.19Å; V307-K310 HydrophobicContact CB-CD 4.17Å; V307-K310 HydrophobicContact CB-CG 4.41Å; V307-K310 HydrophobicContact CG1-CB 4.45Å; V307-K310 HydrophobicContact CG1-CD 3.85Å; V307-K310 HydrophobicContact CG1-CG 4.14Å; V307-K310 PolarHBondContact O-N 3.46Å
308	Q	89.4	Confident	89.7	Confident	136 Å²	136	76.1 Å²	76.1	64%	0.636	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	135.8	-177.1	-156.2	-179.6	-1	0	0	111.9	F254 K310	F254-Q308 HydrophobicContact CE1-CG 4.22Å; F254-Q308 HydrophobicContact CE2-CB 4.34Å; F254-Q308 HydrophobicContact CE2-CG 4.02Å; F254-Q308 HydrophobicContact CZ-CB 4.4Å; F254-Q308 HydrophobicContact CZ-CG 3.6Å; Q308-K310 PolarHBondContact O-N 2.86Å; Q308-K310 VanDerWaalsContact O-N 3.12Å
309	H	90.6	Very high	90.2	Very high	135 Å²	135	74.2 Å²	74.2	63%	0.625	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	11.1	-177.3	-50.4	-64	0	0	0	115.7	V307	V307-H309 PolarHBondContact O-N 3.37Å
310	K	93.2	Very high	90.9	Very high	129 Å²	129	66.5 Å²	66.5	56%	0.561	35%	0.352	S	S	*	.	S	Bend	trans	-112	148.9	169.2	-64.5	-169.6	-179.8	-179.1	0	109.9	F254 V307 Q308 A312	F254-K310 WeakPolarHBondContact CB-O 3.16Å; V307-K310 HydrophobicContact CB-CB 4.19Å; V307-K310 HydrophobicContact CB-CD 4.17Å; V307-K310 HydrophobicContact CB-CG 4.41Å; V307-K310 HydrophobicContact CG1-CB 4.45Å; V307-K310 HydrophobicContact CG1-CD 3.85Å; V307-K310 HydrophobicContact CG1-CG 4.14Å; V307-K310 PolarHBondContact O-N 3.46Å; Q308-K310 PolarHBondContact O-N 2.86Å; Q308-K310 VanDerWaalsContact O-N 3.12Å; K310-A312 PolarHBondContact O-N 3.02Å
311	P	94.2	Very high	91.2	Very high	75 Å²	75	65.5 Å²	65.5	49%	0.487	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-52.9	133.3	171.8	-25.1	34.3	0	0	0	111	I252	I252-P311 CarbonylContact O-C 3.52Å; I252-P311 VanDerWaalsContact O-CA 3.23Å; I252-P311 WeakPolarHBondContact O-CA 3.39Å
312	A	93.7	Very high	91.3	Very high	1 Å²	1	60.8 Å²	60.8	1%	0.008	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	121.3	173.4	0	0	0	0	0	109.2	S251 I252 T257 I306 K310 F322	S251-A312 CarbonylContact C-O 3.46Å; S251-A312 VanDerWaalsContact CA-O 3.25Å; S251-A312 WeakPolarHBondContact CA-O 3.47Å; I252-A312 HydrophobicContact CB-CB 4.46Å; I252-A312 PolarHBondContact N-O 3.2Å; I252-A312 PolarHBondContact O-N 3.4Å; T257-A312 HydrophobicContact CG2-CB 3.6Å; I306-A312 HydrophobicContact CD1-CB 4Å; I306-A312 HydrophobicContact CG1-CB 3.81Å; I306-A312 HydrophobicContact CG2-CB 4.25Å; K310-A312 PolarHBondContact O-N 3.02Å; A312-F322 HydrophobicContact CB-CZ 4.33Å
313	N	93.5	Very high	91	Very high	91 Å²	91	58.4 Å²	58.4	49%	0.487	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	141.7	179.1	-64.6	-31	0	0	0	110.3	P304	P304-N313 HydrophobicContact CB-CB 4.41Å; P304-N313 WeakPolarHBondContact CD-O 3.31Å; P304-N313 HydrophobicContact CG-CB 4.31Å
314	I	92	Very high	90.5	Very high	8 Å²	8	58 Å²	58	4%	0.041	31%	0.307	C	S	.	.			trans	-107.9	156.5	163.6	59.9	152.8	0	0	0	108.8	L247 N250 I252 F270 F322	L247-I314 HydrophobicContact CB-CD1 4.36Å; L247-I314 HydrophobicContact CD1-CD1 3.62Å; L247-I314 HydrophobicContact CD1-CG1 4.44Å; L247-I314 HydrophobicContact CG-CD1 4.48Å; N250-I314 VanDerWaalsContact C-CG1 3.43Å; N250-I314 HydrophobicContact CB-CG1 3.95Å; N250-I314 WeakPolarHBondContact O-CG1 3.33Å; N250-I314 PolarHBondContact O-N 2.94Å; I252-I314 HydrophobicContact CD1-CG2 3.96Å; F270-I314 HydrophobicContact CB-CB 4.46Å; F270-I314 HydrophobicContact CB-CD1 4.3Å; F270-I314 HydrophobicContact CB-CG2 4.09Å; F270-I314 HydrophobicContact CD1-CD1 4.45Å; F270-I314 HydrophobicContact CD1-CG2 4.22Å; F270-I314 HydrophobicContact CD2-CG2 3.88Å; F270-I314 HydrophobicContact CE2-CG2 4.43Å; F270-I314 HydrophobicContact CG-CG2 3.78Å; I314-F322 HydrophobicContact CG2-CE2 4.17Å
315	T	87.7	Confident	90.1	Very high	29 Å²	29	59 Å²	59	18%	0.178	33%	0.325	C	S	.	.			trans	-73.3	133.7	175.6	45.6	0	0	0	0	110.3	S272 V318 C320	S272-T315 WeakPolarHBondContact CB-O 3.33Å; S272-T315 PolarHBondContact OG-O 3.1Å; T315-V318 VanDerWaalsContact CB-CG2 3.44Å; T315-V318 HydrophobicContact CG2-CG2 3.8Å; T315-V318 WeakPolarHBondContact OG1-CG2 3.22Å; T315-V318 PolarHBondContact OG1-O 3.3Å; T315-C320 HydrophobicContact CG2-CB 4.4Å; T315-C320 VanDerWaalsContact OG1-CB 3.27Å; T315-C320 WeakPolarHBondContact OG1-CB 3.44Å
316	S	83.2	Confident	89.9	Confident	53 Å²	53	52 Å²	52	37%	0.371	30%	0.303	S	S	.	.	S	Bend	trans	-76.8	-32.3	-176.7	63.6	0	0	0	0	113.5	N250 S272	N250-S316 VanDerWaalsContact ND2-CB 3.29Å; N250-S316 WeakPolarHBondContact ND2-CB 3.37Å; S272-S316 WeakPolarHBondContact CB-O 3.1Å
317	N	87	Confident	89.8	Confident	130 Å²	130	51.7 Å²	51.7	70%	0.695	30%	0.302	S	S	*	.	S	Bend	trans	-111.5	-12	-167.1	-58.4	-8.2	0	0	0	113.3	S273	S273-N317 WeakPolarHBondContact CB-O 2.9Å
318	V	90.9	Very high	89.9	Confident	52 Å²	52	49.7 Å²	49.7	32%	0.315	29%	0.29	S	S	.	.	S	Bend	trans	-132	151.1	-177.3	-67	0	0	0	0	108.5	T315	T315-V318 VanDerWaalsContact CB-CG2 3.44Å; T315-V318 HydrophobicContact CG2-CG2 3.8Å; T315-V318 WeakPolarHBondContact OG1-CG2 3.22Å; T315-V318 PolarHBondContact OG1-O 3.3Å
319	D	93.2	Very high	90	Very high	11 Å²	11	47.3 Å²	47.3	6%	0.059	29%	0.285	C	S	.	.			trans	-74.2	137.5	174.5	-59.7	-10.9	0	0	0	108.7	F270 R271 S272 S273 R280 V300 Q301	F270-D319 WeakPolarHBondContact O-CA 3.28Å; R271-D319 WeakPolarHBondContact CA-OD1 3.34Å; R271-D319 VanDerWaalsContact CD-OD2 3.22Å; R271-D319 WeakPolarHBondContact CD-OD2 3.45Å; R271-D319 IonicContact CZ-OD2 3.67Å; R271-D319 IonicContact NH1-OD2 2.93Å; R271-D319 PolarHBondContact NH1-OD2 3.15Å; S272-D319 PolarHBondContact N-OD1 3.05Å; S273-D319 WeakPolarHBondContact CB-OD1 2.96Å; S273-D319 PolarHBondContact N-OD1 2.66Å; S273-D319 PolarHBondContact OG-OD1 2.65Å; S273-D319 PolarHBondContact OG-OD2 2.85Å; R280-D319 IonicContact CZ-OD2 3.53Å; R280-D319 IonicContact NH1-OD2 3.35Å; R280-D319 PolarHBondContact NH1-OD2 2.91Å; R280-D319 IonicContact NH2-OD2 3.05Å; R280-D319 PolarHBondContact NH2-OD2 2.81Å; V300-D319 HydrophobicContact CG1-CB 4.11Å; Q301-D319 PolarHBondContact N-O 2.9Å
320	C	93.3	Very high	90	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	158.6	177.2	79.9	0	0	0	0	113	F270 Q301 C303 T315	F270-C320 PolarHBondContact N-O 3.38Å; F270-C320 PolarHBondContact O-N 2.98Å; Q301-C320 CarbonylContact O-C 3.37Å; Q301-C320 WeakPolarHBondContact O-CA 3.36Å; Q301-C320 WeakPolarHBondContact O-CB 3.34Å; C303-C320 VanDerWaalsContact CA-SG 3.57Å; C303-C320 HydrophobicContact CB-CB 3.86Å; C303-C320 WeakPolarHBondContact CB-SG 3.24Å; C303-C320 WeakPolarHBondContact SG-CB 3.41Å; C303-C320 CovalentContact SG-SG 2.05Å; C303-C320 PolarHBondContact SG-SG 2.93Å; T315-C320 HydrophobicContact CG2-CB 4.4Å; T315-C320 VanDerWaalsContact OG1-CB 3.27Å; T315-C320 WeakPolarHBondContact OG1-CB 3.44Å
321	Q	92.3	Very high	89.5	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.009	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	132.6	-179	174.9	176.6	3.2	0	0	111.4	Q267 V268 V269 K284 L286 V300 Q301 P302 C303	Q267-Q321 HydrophobicContact CB-CG 4.32Å; V268-Q321 CarbonylContact O-C 3.58Å; V268-Q321 WeakPolarHBondContact O-CA 3.31Å; V269-Q321 HydrophobicContact CG2-CB 4.23Å; V269-Q321 HydrophobicContact CG2-CG 4.03Å; K284-Q321 PolarHBondContact O-OE1 3.13Å; L286-Q321 HydrophobicContact CD1-CB 4.36Å; L286-Q321 HydrophobicContact CD1-CG 3.97Å; L286-Q321 HydrophobicContact CG-CG 4.19Å; V300-Q321 HydrophobicContact CG2-CB 3.59Å; V300-Q321 HydrophobicContact CG2-CG 4.46Å; Q301-Q321 PolarHBondContact O-N 3.45Å; P302-Q321 WeakPolarHBondContact CA-O 3.4Å; C303-Q321 PolarHBondContact N-O 2.04Å; C303-Q321 VanDerWaalsContact SG-C 3.51Å; C303-Q321 PolarHBondContact SG-N 3.06Å
322	F	91.1	Very high	89.2	Confident	9 Å²	9	41.7 Å²	41.7	4%	0.039	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	130.8	163	-68.5	-74.3	0	0	0	109.5	V268 F270 C303 P304 I306 A312 I314 L327	V268-F322 HydrophobicContact CB-CB 4.46Å; V268-F322 PolarHBondContact N-O 2.97Å; V268-F322 PolarHBondContact O-N 3.43Å; F270-F322 HydrophobicContact CD2-CD2 4.04Å; F270-F322 AromaticContact CD2-CE2 4Å; F270-F322 HydrophobicContact CD2-CE2 4Å; F270-F322 AromaticContact CE2-CD2 3.8Å; F270-F322 HydrophobicContact CE2-CD2 3.8Å; F270-F322 AromaticContact CE2-CE2 3.82Å; F270-F322 HydrophobicContact CE2-CE2 3.82Å; C303-F322 HydrophobicContact CB-CD1 3.61Å; C303-F322 HydrophobicContact CB-CD2 3.96Å; C303-F322 HydrophobicContact CB-CE1 3.34Å; C303-F322 HydrophobicContact CB-CE2 3.72Å; C303-F322 HydrophobicContact CB-CG 3.91Å; C303-F322 HydrophobicContact CB-CZ 3.4Å; C303-F322 VanDerWaalsContact SG-CE2 3.59Å; P304-F322 WeakPolarHBondContact O-CE1 3.08Å; I306-F322 HydrophobicContact CD1-CD1 4.09Å; I306-F322 HydrophobicContact CD1-CE1 3.77Å; I306-F322 HydrophobicContact CD1-CZ 4.24Å; I306-F322 HydrophobicContact CG1-CD1 4.28Å; I306-F322 HydrophobicContact CG1-CE1 3.65Å; I306-F322 HydrophobicContact CG1-CZ 4.27Å; A312-F322 HydrophobicContact CB-CZ 4.33Å; I314-F322 HydrophobicContact CG2-CE2 4.17Å; F322-L327 HydrophobicContact CB-CD2 4.04Å; F322-L327 HydrophobicContact CB-CG 4.09Å; F322-L327 HydrophobicContact CD1-CD2 4.4Å; F322-L327 HydrophobicContact CD2-CD2 4.3Å; F322-L327 HydrophobicContact CG-CD2 4Å
323	S	84.9	Confident	88.7	Confident	39 Å²	39	49.3 Å²	49.3	27%	0.273	30%	0.303	S	S	.	.			trans	-66.3	143.9	160.7	170.8	0	0	0	0	108.9	G325 G326 L327	S323-G325 PolarHBondContact O-N 3.28Å; S323-G325 PolarHBondContact OG-N 2.89Å; S323-G326 WeakPolarHBondContact O-CA 3.44Å; S323-G326 PolarHBondContact O-N 2.94Å; S323-L327 PolarHBondContact O-N 3.09Å
324	P	82.7	Confident	88.6	Confident	6 Å²	6	45.9 Å²	45.9	4%	0.039	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-52.3	-37.1	172.3	-23.9	31.4	0	0	0	112.5	R259 L265 T266 G326 L327	R259-P324 PolarHBondContact NE-O 3.31Å; R259-P324 VanDerWaalsContact NH2-C 3.3Å; R259-P324 PolarHBondContact NH2-O 2.99Å; L265-P324 HydrophobicContact CG-CG 4.46Å; L265-P324 VanDerWaalsContact O-CB 3.29Å; L265-P324 WeakPolarHBondContact O-CB 3.45Å; L265-P324 WeakPolarHBondContact O-CG 3.47Å; T266-P324 WeakPolarHBondContact O-CD 3.26Å; T266-P324 WeakPolarHBondContact O-CG 3.21Å; P324-G326 PolarHBondContact O-N 2.64Å; P324-L327 PolarHBondContact O-N 3.14Å
325	G	84.4	Confident	88.5	Confident	71 Å²	71	48 Å²	48	73%	0.732	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-69.3	-19	175.5	0	0	0	0	0	114.1	S323	S323-G325 PolarHBondContact O-N 3.28Å; S323-G325 PolarHBondContact OG-N 2.89Å
326	G	86.4	Confident	88.6	Confident	29 Å²	29	49.2 Å²	49.2	30%	0.299	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-85.3	-11.8	175.5	0	0	0	0	0	114.3	S323 P324	S323-G326 WeakPolarHBondContact O-CA 3.44Å; S323-G326 PolarHBondContact O-N 2.94Å; P324-G326 PolarHBondContact O-N 2.64Å
327	L	90.9	Very high	89	Confident	6 Å²	6	51.6 Å²	51.6	3%	0.031	32%	0.316	C	S	.	.	S	Bend	trans	-89.3	131	175.2	-67.8	172	0	0	0	110.2	R259 L265 V268 I306 F322 S323 P324 T329	R259-L327 HydrophobicContact CG-CB 4.11Å; L265-L327 HydrophobicContact CD2-CD1 4.38Å; V268-L327 HydrophobicContact CB-CD1 4.23Å; V268-L327 HydrophobicContact CG2-CD1 3.63Å; I306-L327 HydrophobicContact CD1-CD2 3.74Å; F322-L327 HydrophobicContact CB-CD2 4.04Å; F322-L327 HydrophobicContact CB-CG 4.09Å; F322-L327 HydrophobicContact CD1-CD2 4.4Å; F322-L327 HydrophobicContact CD2-CD2 4.3Å; F322-L327 HydrophobicContact CG-CD2 4Å; S323-L327 PolarHBondContact O-N 3.09Å; P324-L327 PolarHBondContact O-N 3.14Å; L327-T329 PolarHBondContact O-N 2.88Å
328	P	92.8	Very high	89.2	Confident	32 Å²	32	49.6 Å²	49.6	21%	0.208	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-62.1	137.5	179.7	24	-31.1	0	0	0	111	F254 T257 E258 R259	F254-P328 HydrophobicContact CE2-CB 4.26Å; F254-P328 HydrophobicContact CE2-CG 3.81Å; F254-P328 HydrophobicContact CZ-CB 4.15Å; F254-P328 HydrophobicContact CZ-CG 4.04Å; T257-P328 WeakPolarHBondContact OG1-CG 3.47Å; E258-P328 CarbonylContact C-O 3.45Å; E258-P328 WeakPolarHBondContact CA-O 3.26Å; E258-P328 HydrophobicContact CG-CB 4.41Å; E258-P328 HydrophobicContact CG-CG 4.05Å; R259-P328 PolarHBondContact N-O 3.44Å
329	T	91.7	Very high	89.3	Confident	85 Å²	85	47.2 Å²	47.2	52%	0.521	29%	0.288	S	S	.	.	B	Isolated β-bridge	trans	-101.7	140.8	178.7	55.8	0	0	0	0	111.5	R259 A261 L327	R259-T329 HydrophobicContact CG-CG2 4.25Å; R259-T329 CarbonylContact O-C 3.6Å; R259-T329 VanDerWaalsContact O-CA 3.27Å; R259-T329 WeakPolarHBondContact O-CA 3.25Å; A261-T329 HydrophobicContact CB-CG2 4.43Å; L327-T329 PolarHBondContact O-N 2.88Å
330	T	90	Very high	89.1	Confident	22 Å²	22	48 Å²	48	14%	0.135	29%	0.292	C	S	.	.			trans	-141.9	155.2	172.7	179.8	0	0	0	0	111	R228 E258 R259 F260 D332	R228-T330 HydrophobicContact CG-CG2 4.27Å; R228-T330 VanDerWaalsContact CZ-CG2 3.41Å; E258-T330 HydrophobicContact CB-CG2 3.84Å; R259-T330 PolarHBondContact O-N 3.47Å; F260-T330 WeakPolarHBondContact CD1-O 3.2Å; T330-D332 WeakPolarHBondContact OG1-CB 3.32Å; T330-D332 PolarHBondContact OG1-N 3.17Å; T330-D332 VanDerWaalsContact OG1-N 3.08Å; T330-D332 PolarHBondContact OG1-OD2 3.22Å
331	S	84.6	Confident	89	Confident	101 Å²	101	53.7 Å²	53.7	71%	0.706	32%	0.319	S	S	*	.			trans	-91.8	-8.8	170.8	50.9	0	0	0	0	113.2	K333	S331-K333 PolarHBondContact O-N 3.32Å
332	D	86.3	Confident	88.9	Confident	98 Å²	98	57.7 Å²	57.7	52%	0.524	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-74.2	127.8	-168.7	-65	-21.5	0	0	0	111.6	R228 T330	R228-D332 PolarHBondContact NE-O 2.98Å; R228-D332 VanDerWaalsContact NE-O 3.16Å; R228-D332 PolarHBondContact NH2-O 2.87Å; T330-D332 WeakPolarHBondContact OG1-CB 3.32Å; T330-D332 PolarHBondContact OG1-N 3.17Å; T330-D332 VanDerWaalsContact OG1-N 3.08Å; T330-D332 PolarHBondContact OG1-OD2 3.22Å
333	K	84.9	Confident	89	Confident	161 Å²	161	57.3 Å²	57.3	70%	0.7	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-76.5	140.1	173.4	-67.2	-172.6	177.7	-176.2	0	110.5	S331	S331-K333 PolarHBondContact O-N 3.32Å
334	V	90.5	Very high	89.3	Confident	20 Å²	20	57.3 Å²	57.3	12%	0.121	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-89.7	131.1	174.6	177.3	0	0	0	0	108.7	F225 R228 Y229 Q338	F225-V334 HydrophobicContact CB-CB 4.34Å; F225-V334 HydrophobicContact CB-CG1 4Å; F225-V334 HydrophobicContact CB-CG2 3.86Å; F225-V334 HydrophobicContact CD1-CG1 4.09Å; F225-V334 HydrophobicContact CD1-CG2 3.83Å; F225-V334 HydrophobicContact CD2-CG1 3.45Å; F225-V334 VanDerWaalsContact CD2-CG1 3.45Å; F225-V334 HydrophobicContact CE1-CG1 4.42Å; F225-V334 HydrophobicContact CE2-CG1 3.84Å; F225-V334 HydrophobicContact CG-CB 4.29Å; F225-V334 HydrophobicContact CG-CG1 3.57Å; F225-V334 HydrophobicContact CG-CG2 3.85Å; F225-V334 HydrophobicContact CZ-CG1 4.31Å; R228-V334 HydrophobicContact CB-CG2 3.99Å; Y229-V334 HydrophobicContact CD2-CB 4.36Å; Y229-V334 HydrophobicContact CD2-CG1 4.05Å; V334-Q338 HydrophobicContact CG1-CB 4.49Å
335	S	90	Very high	89.5	Confident	52 Å²	52	57.3 Å²	57.3	36%	0.364	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-79	143.9	174.8	66.3	0	0	0	0	110.7	H337 Q338 A339	S335-H337 PolarHBondContact O-N 3.34Å; S335-Q338 PolarHBondContact O-N 3.03Å; S335-Q338 VanDerWaalsContact O-N 3.11Å; S335-Q338 VanDerWaalsContact OG-CG 3.29Å; S335-Q338 WeakPolarHBondContact OG-CG 3.5Å; S335-Q338 PolarHBondContact OG-N 3.42Å; S335-A339 PolarHBondContact O-N 2.75Å
336	S	90.1	Very high	89.5	Confident	55 Å²	55	56.8 Å²	56.8	39%	0.385	31%	0.306	S	S	.	.	H	α-helix	trans	-54	-35	172.8	176.5	0	0	0	0	112	Q338 A339 L340	S336-Q338 PolarHBondContact O-N 3.09Å; S336-A339 PolarHBondContact O-N 3.03Å; S336-L340 WeakPolarHBondContact O-CB 3.33Å; S336-L340 VanDerWaalsContact O-CG 3.26Å; S336-L340 WeakPolarHBondContact O-CG 3.29Å; S336-L340 PolarHBondContact O-N 3.42Å
337	H	91	Very high	89.2	Confident	103 Å²	103	59.7 Å²	59.7	48%	0.477	31%	0.308	S	S	.	.	H	α-helix	trans	-58.1	-46.5	176.4	-171.5	-83.6	0	0	0	113.3	S335 A339 L340 E341 R347	S335-H337 PolarHBondContact O-N 3.34Å; H337-A339 VanDerWaalsContact C-N 3.33Å; H337-A339 PolarHBondContact O-N 3.11Å; H337-L340 PolarHBondContact O-N 3.2Å; H337-E341 VanDerWaalsContact CE1-CD 3.48Å; H337-E341 IonicContact CE1-OE1 2.63Å; H337-E341 PolarHBondContact CE1-OE1 3.19Å; H337-E341 IonicContact ND1-OE1 3.53Å; H337-E341 IonicContact ND1-OE2 2.99Å; H337-E341 WeakPolarHBondContact O-CG 3.19Å; H337-E341 PolarHBondContact O-N 3.31Å; H337-R347 PolarHBondContact CD2-NH2 2.78Å; H337-R347 PolarHBondContact NE2-NH2 3.48Å; H337-R347 VanDerWaalsContact NE2-NH2 3.11Å
338	Q	91.5	Very high	88.7	Confident	88 Å²	88	62.3 Å²	62.3	41%	0.411	32%	0.322	S	S	.	.	H	α-helix	trans	-64.3	-38.6	179.2	-74.6	168.2	-10.1	0	0	111.9	F225 V334 S335 S336 E341	F225-Q338 HydrophobicContact CE2-CB 4.16Å; F225-Q338 HydrophobicContact CZ-CB 4.25Å; V334-Q338 HydrophobicContact CG1-CB 4.49Å; S335-Q338 PolarHBondContact O-N 3.03Å; S335-Q338 VanDerWaalsContact O-N 3.11Å; S335-Q338 VanDerWaalsContact OG-CG 3.29Å; S335-Q338 WeakPolarHBondContact OG-CG 3.5Å; S335-Q338 PolarHBondContact OG-N 3.42Å; S336-Q338 PolarHBondContact O-N 3.09Å; Q338-E341 PolarHBondContact O-N 3.21Å
339	A	91.9	Very high	87.7	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.008	32%	0.322	C	S	.	.	H	α-helix	trans	-65.6	-43.5	176.3	0	0	0	0	0	111.5	A198 F225 Y229 S335 S336 H337 E341 R342 C343	A198-A339 HydrophobicContact CB-CB 3.63Å; F225-A339 HydrophobicContact CD2-CB 4.27Å; F225-A339 HydrophobicContact CE2-CB 4.48Å; Y229-A339 HydrophobicContact CD2-CB 4.02Å; Y229-A339 HydrophobicContact CE2-CB 3.68Å; S335-A339 PolarHBondContact O-N 2.75Å; S336-A339 PolarHBondContact O-N 3.03Å; H337-A339 VanDerWaalsContact C-N 3.33Å; H337-A339 PolarHBondContact O-N 3.11Å; A339-E341 VanDerWaalsContact C-N 3.29Å; A339-E341 PolarHBondContact O-N 2.89Å; A339-R342 PolarHBondContact O-N 2.91Å; A339-R342 VanDerWaalsContact O-N 3.12Å; A339-C343 PolarHBondContact O-N 2.99Å
340	L	90.7	Very high	86.5	Confident	29 Å²	29	62.5 Å²	62.5	15%	0.152	32%	0.323	C	S	.	.	H	α-helix	trans	-65.6	-27.6	177.3	-70.3	171.1	0	0	0	113.7	S336 H337 R342 C343 P344 R346	S336-L340 WeakPolarHBondContact O-CB 3.33Å; S336-L340 VanDerWaalsContact O-CG 3.26Å; S336-L340 WeakPolarHBondContact O-CG 3.29Å; S336-L340 PolarHBondContact O-N 3.42Å; H337-L340 PolarHBondContact O-N 3.2Å; L340-R342 VanDerWaalsContact C-N 3.3Å; L340-C343 CarbonylContact O-C 3.49Å; L340-P344 VanDerWaalsContact O-CA 3.25Å; L340-P344 WeakPolarHBondContact O-CA 3.24Å; L340-R346 HydrophobicContact CD2-CB 3.82Å; L340-R346 HydrophobicContact CD2-CG 4.44Å
341	E	90.4	Very high	84.8	Confident	119 Å²	119	67.2 Å²	67.2	56%	0.556	35%	0.347	S	S	*	.	H	α-helix	trans	-68.3	-30.9	173.2	-76.2	-178.3	150	0	0	112.5	H337 Q338 A339	H337-E341 VanDerWaalsContact CE1-CD 3.48Å; H337-E341 IonicContact CE1-OE1 2.63Å; H337-E341 PolarHBondContact CE1-OE1 3.19Å; H337-E341 IonicContact ND1-OE1 3.53Å; H337-E341 IonicContact ND1-OE2 2.99Å; H337-E341 WeakPolarHBondContact O-CG 3.19Å; H337-E341 PolarHBondContact O-N 3.31Å; Q338-E341 PolarHBondContact O-N 3.21Å; A339-E341 VanDerWaalsContact C-N 3.29Å; A339-E341 PolarHBondContact O-N 2.89Å
342	R	91	Very high	83.3	Confident	85 Å²	85	67.5 Å²	67.5	32%	0.321	35%	0.345	S	S	.	.	H	α-helix	trans	-87	-32.5	179.7	-66.4	-169.4	62.6	-169.3	-12.5	113.2	P224 D256 A339 L340	P224-R342 HydrophobicContact CB-CB 4.1Å; P224-R342 HydrophobicContact CG-CB 3.93Å; D256-R342 IonicContact OD1-CZ 3.19Å; D256-R342 IonicContact OD1-NH1 2.9Å; D256-R342 PolarHBondContact OD1-NH1 3.35Å; D256-R342 IonicContact OD1-NH2 2.66Å; D256-R342 IonicContact OD2-CZ 3.5Å; D256-R342 IonicContact OD2-NH1 3Å; D256-R342 PolarHBondContact OD2-NH1 3.05Å; D256-R342 IonicContact OD2-NH2 2.7Å; D256-R342 PolarHBondContact OD2-NH2 2.91Å; A339-R342 PolarHBondContact O-N 2.91Å; A339-R342 VanDerWaalsContact O-N 3.12Å; L340-R342 VanDerWaalsContact C-N 3.3Å
343	C	93.3	Very high	81.5	Confident	1 Å²	1	70 Å²	70	1%	0.007	36%	0.357	C	S	.	.			trans	-135.5	96.2	171.4	-166.4	0	0	0	0	110	C195 I196 P224 A339 L340 F345	C195-C343 VanDerWaalsContact C-SG 3.53Å; C195-C343 HydrophobicContact CB-CB 3.74Å; C195-C343 WeakPolarHBondContact CB-SG 3.32Å; C195-C343 VanDerWaalsContact SG-CA 3.51Å; C195-C343 WeakPolarHBondContact SG-CB 3.42Å; C195-C343 CovalentContact SG-SG 2.06Å; C195-C343 PolarHBondContact SG-SG 3Å; I196-C343 PolarHBondContact O-SG 3.12Å; P224-C343 HydrophobicContact CG-CB 4.09Å; A339-C343 PolarHBondContact O-N 2.99Å; L340-C343 CarbonylContact O-C 3.49Å; C343-F345 PolarHBondContact O-N 2.93Å
344	P	89.7	Confident	79.5	Confident	39 Å²	39	70.3 Å²	70.3	25%	0.253	36%	0.361	S	S	.	.			trans	-78.4	16.3	-172.7	32.2	-38.3	0	0	0	114.4	Y146 L340 R346 R347 L348	Y146-P344 HydrophobicContact CE1-CG 4.22Å; L340-P344 VanDerWaalsContact O-CA 3.25Å; L340-P344 WeakPolarHBondContact O-CA 3.24Å; P344-R346 PolarHBondContact O-N 2.93Å; P344-R347 WeakPolarHBondContact O-CB 3.46Å; P344-R347 PolarHBondContact O-N 2.7Å; P344-L348 HydrophobicContact CG-CD1 4.35Å; P344-L348 WeakPolarHBondContact O-CG 3.29Å; P344-L348 PolarHBondContact O-N 3Å
345	F	88.5	Confident	77.3	Confident	6 Å²	6	75.3 Å²	75.3	3%	0.026	39%	0.392	C	S	.	.	H	α-helix	trans	-45.6	-55.7	-176.3	171.9	-111.6	0	0	0	112.5	F65 V67 L69 Y146 P156 D197 C343 R347 L348 T349	F65-F345 HydrophobicContact CE2-CE1 4.4Å; F65-F345 HydrophobicContact CE2-CE2 4.18Å; F65-F345 AromaticContact CE2-CZ 3.61Å; F65-F345 HydrophobicContact CE2-CZ 3.61Å; F65-F345 HydrophobicContact CZ-CE1 4.34Å; F65-F345 AromaticContact CZ-CZ 3.84Å; F65-F345 HydrophobicContact CZ-CZ 3.84Å; V67-F345 HydrophobicContact CG2-CD2 4.04Å; V67-F345 HydrophobicContact CG2-CE2 3.58Å; L69-F345 HydrophobicContact CD1-CD2 3.83Å; L69-F345 HydrophobicContact CD1-CE2 4.12Å; Y146-F345 HydrophobicContact CD1-CB 3.65Å; Y146-F345 HydrophobicContact CD1-CD2 4.4Å; Y146-F345 HydrophobicContact CD1-CG 4.46Å; Y146-F345 HydrophobicContact CE1-CB 4.33Å; Y146-F345 HydrophobicContact CG-CB 4.16Å; Y146-F345 HydrophobicContact CG-CD2 4.05Å; P156-F345 HydrophobicContact CG-CZ 4.18Å; D197-F345 HydrophobicContact CB-CB 4.39Å; D197-F345 HydrophobicContact CB-CD1 3.79Å; D197-F345 HydrophobicContact CB-CG 4.41Å; C343-F345 PolarHBondContact O-N 2.93Å; F345-R347 VanDerWaalsContact C-N 3.32Å; F345-R347 PolarHBondContact O-N 2.65Å; F345-L348 PolarHBondContact O-N 3.38Å; F345-L348 VanDerWaalsContact O-N 3.14Å; F345-T349 HydrophobicContact CD2-CG2 4.05Å; F345-T349 HydrophobicContact CE2-CG2 3.47Å; F345-T349 VanDerWaalsContact CE2-CG2 3.47Å; F345-T349 HydrophobicContact CZ-CG2 3.78Å; F345-T349 PolarHBondContact O-N 3.15Å; F345-T349 VanDerWaalsContact O-N 3.08Å; F345-T349 PolarHBondContact O-OG1 2.83Å
346	R	83.8	Confident	74.9	Confident	60 Å²	60	84.2 Å²	84.2	23%	0.226	42%	0.417	C	S	.	.	H	α-helix	trans	-63.6	-34.1	-178.7	-64.9	-129.1	176.4	-147.9	-0.2	113.2	D150 D197 D199 L340 P344 L348 T349 T350	D150-R346 IonicContact OD2-CZ 2.65Å; D150-R346 IonicContact OD2-NH1 3.49Å; D150-R346 PolarHBondContact OD2-NH1 2.63Å; D150-R346 IonicContact OD2-NH2 3.05Å; D150-R346 PolarHBondContact OD2-NH2 2.99Å; D197-R346 IonicContact OD1-NE 3.76Å; D197-R346 IonicContact OD2-CZ 3.06Å; D197-R346 IonicContact OD2-NE 3.53Å; D197-R346 PolarHBondContact OD2-NE 3.34Å; D197-R346 IonicContact OD2-NH2 3.27Å; D199-R346 IonicContact OD2-NE 2.64Å; L340-R346 HydrophobicContact CD2-CB 3.82Å; L340-R346 HydrophobicContact CD2-CG 4.44Å; P344-R346 PolarHBondContact O-N 2.93Å; R346-L348 VanDerWaalsContact C-N 3.32Å; R346-L348 PolarHBondContact O-N 2.98Å; R346-T349 WeakPolarHBondContact CA-OG1 3.19Å; R346-T349 PolarHBondContact O-N 3.2Å; R346-T349 PolarHBondContact O-OG1 2.91Å; R346-T350 WeakPolarHBondContact O-CB 2.91Å; R346-T350 VanDerWaalsContact O-CG2 3.24Å; R346-T350 WeakPolarHBondContact O-CG2 3.46Å; R346-T350 PolarHBondContact O-N 2.76Å; R346-T350 PolarHBondContact O-OG1 3.47Å
347	R	80.1	Confident	72.4	Confident	90 Å²	90	91.5 Å²	91.5	34%	0.34	44%	0.437	S	S	.	.	H	α-helix	trans	-65.6	-37.7	175.8	-68.9	-178	178.3	179.4	0.3	111.6	H337 P344 F345 T350 N351	H337-R347 PolarHBondContact CD2-NH2 2.78Å; H337-R347 PolarHBondContact NE2-NH2 3.48Å; H337-R347 VanDerWaalsContact NE2-NH2 3.11Å; P344-R347 WeakPolarHBondContact O-CB 3.46Å; P344-R347 PolarHBondContact O-N 2.7Å; F345-R347 VanDerWaalsContact C-N 3.32Å; F345-R347 PolarHBondContact O-N 2.65Å; R347-T350 PolarHBondContact O-OG1 3.39Å; R347-N351 PolarHBondContact O-ND2 2.96Å
348	L	79.2	Confident	70.1	Confident	61 Å²	61	97.6 Å²	97.6	32%	0.319	46%	0.455	S	S	.	.	H	α-helix	trans	-72.8	-32.9	-180	-63.6	173.4	0	0	0	111.7	L69 Y146 P344 F345 R346	L69-L348 HydrophobicContact CB-CD1 4.34Å; L69-L348 HydrophobicContact CD1-CB 3.97Å; L69-L348 HydrophobicContact CD1-CD1 4.15Å; Y146-L348 HydrophobicContact CE2-CD1 4.16Å; P344-L348 HydrophobicContact CG-CD1 4.35Å; P344-L348 WeakPolarHBondContact O-CG 3.29Å; P344-L348 PolarHBondContact O-N 3Å; F345-L348 PolarHBondContact O-N 3.38Å; F345-L348 VanDerWaalsContact O-N 3.14Å; R346-L348 VanDerWaalsContact C-N 3.32Å; R346-L348 PolarHBondContact O-N 2.98Å
349	T	72.2	Confident	67.6	Low	34 Å²	34	102.7 Å²	102.7	21%	0.209	48%	0.476	C	S	.	.	H	α-helix	trans	-88.5	-29.8	-179	55	0	0	0	0	114.4	L69 F345 R346 N351 T352	L69-T349 HydrophobicContact CD1-CG2 4.14Å; F345-T349 HydrophobicContact CD2-CG2 4.05Å; F345-T349 HydrophobicContact CE2-CG2 3.47Å; F345-T349 VanDerWaalsContact CE2-CG2 3.47Å; F345-T349 HydrophobicContact CZ-CG2 3.78Å; F345-T349 PolarHBondContact O-N 3.15Å; F345-T349 VanDerWaalsContact O-N 3.08Å; F345-T349 PolarHBondContact O-OG1 2.83Å; R346-T349 WeakPolarHBondContact CA-OG1 3.19Å; R346-T349 PolarHBondContact O-N 3.2Å; R346-T349 PolarHBondContact O-OG1 2.91Å; T349-N351 VanDerWaalsContact C-N 3.3Å; T349-N351 PolarHBondContact O-N 2.8Å; T349-T352 PolarHBondContact O-OG1 2.87Å
350	T	67.7	Low	65.2	Low	88 Å²	88	108 Å²	108	54%	0.54	51%	0.509	S	S	.	.	H	α-helix	trans	-68.4	-30.3	177.3	52.6	0	0	0	0	112.8	R346 R347 T352	R346-T350 WeakPolarHBondContact O-CB 2.91Å; R346-T350 VanDerWaalsContact O-CG2 3.24Å; R346-T350 WeakPolarHBondContact O-CG2 3.46Å; R346-T350 PolarHBondContact O-N 2.76Å; R346-T350 PolarHBondContact O-OG1 3.47Å; R347-T350 PolarHBondContact O-OG1 3.39Å; T350-T352 VanDerWaalsContact C-N 3.33Å; T350-T352 PolarHBondContact O-N 3.18Å
351	N	53.6	Low	62.7	Low	121 Å²	121	113.8 Å²	113.8	65%	0.647	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-77.1	-16.5	-175.7	-70.1	-21.1	0	0	0	113.6	R347 T349	R347-N351 PolarHBondContact O-ND2 2.96Å; T349-N351 VanDerWaalsContact C-N 3.3Å; T349-N351 PolarHBondContact O-N 2.8Å
352	T	54	Low	60.1	Low	106 Å²	106	114.5 Å²	114.5	65%	0.65	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-79.8	-21.6	-178.1	54.9	0	0	0	0	113.5	T349 T350 Q354	T349-T352 PolarHBondContact O-OG1 2.87Å; T350-T352 VanDerWaalsContact C-N 3.33Å; T350-T352 PolarHBondContact O-N 3.18Å; T352-Q354 VanDerWaalsContact C-N 3.27Å; T352-Q354 PolarHBondContact O-N 3.03Å
353	L	48.5	Very low	58	Low	151 Å²	151	116.4 Å²	116.4	79%	0.791	57%	0.571	S	S	*	*	G	3₁₀ helix	trans	-75.1	-11.9	178.1	-75	173.7	0	0	0	114	T355	L353-T355 PolarHBondContact O-N 3.46Å
354	Q	42.5	Very low	55.1	Low	167 Å²	167	124.6 Å²	124.6	78%	0.78	61%	0.611	S	S	*	*	S	Bend	trans	-79.8	82.2	164.1	-70.1	-170.9	0.5	0	0	108.3	T352 R356	T352-Q354 VanDerWaalsContact C-N 3.27Å; T352-Q354 PolarHBondContact O-N 3.03Å; Q354-R356 PolarHBondContact O-N 2.78Å
355	T	45.1	Very low	52.6	Low	125 Å²	125	130.5 Å²	130.5	77%	0.767	64%	0.636	S	S	*	*			trans	-49.3	108.6	168.9	-41.1	0	0	0	0	107.7	L353 R357	L353-T355 PolarHBondContact O-N 3.46Å; T355-R357 PolarHBondContact O-N 3.27Å
356	R	38.1	Very low	50.3	Low	239 Å²	239	139.3 Å²	139.3	90%	0.902	68%	0.677	S	S	*	*			trans	-56.9	85.4	173.1	-162.2	-177.3	-167.5	-170	4.6	107	Q354 R358	Q354-R356 PolarHBondContact O-N 2.78Å; R356-R358 PolarHBondContact O-N 3.1Å
357	R	39	Very low	48.5	Very low	209 Å²	209	143.6 Å²	143.6	79%	0.789	70%	0.699	S	S	*	*			trans	-53.8	118.7	164.6	-85.5	-171.4	177.6	-175.3	0	104.7	T355 K359	T355-R357 PolarHBondContact O-N 3.27Å; R357-K359 PolarHBondContact O-N 2.84Å
358	R	42	Very low	47.1	Very low	230 Å²	230	145.7 Å²	145.7	87%	0.868	72%	0.716	S	S	*	*			trans	-47.9	118.8	174.6	-92.2	178.8	169.5	172.8	-3.6	106.9	R356 T360	R356-R358 PolarHBondContact O-N 3.1Å; R358-T360 PolarHBondContact O-N 3.19Å
359	K	37.8	Very low	45.6	Very low	195 Å²	195	152.4 Å²	152.4	85%	0.848	74%	0.738	S	S	*	*			trans	-60.5	94.8	164.9	-131.6	-179.1	-177.1	-176.4	0	105.4	R357 N361	R357-K359 PolarHBondContact O-N 2.84Å; K359-N361 PolarHBondContact O-N 3.34Å
360	T	42.4	Very low	44.6	Very low	114 Å²	114	154.7 Å²	154.7	70%	0.699	75%	0.749	S	S	*	*			trans	-67.7	115.2	165.5	44	0	0	0	0	105.3	R358 N362	R358-T360 PolarHBondContact O-N 3.19Å; T360-N362 PolarHBondContact O-N 3.33Å
361	N	37.6	Very low	44.2	Very low	149 Å²	149	153.3 Å²	153.3	80%	0.797	74%	0.741	S	S	*	*			trans	-69.5	67.8	175.8	-74.4	-21.3	0	0	0	110.1	K359	K359-N361 PolarHBondContact O-N 3.34Å
362	N	36	Very low	44.9	Very low	134 Å²	134	152.2 Å²	152.2	72%	0.717	74%	0.741	S	S	*	*			trans	-113.7	104.2	160.1	-87.5	-5.1	0	0	0	106.7	T360 M364	T360-N362 PolarHBondContact O-N 3.33Å; N362-M364 PolarHBondContact O-N 3.39Å
363	P	46.9	Very low	45.8	Very low	126 Å²	126	151 Å²	151	82%	0.818	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	37.3	-173.9	32.5	-34.7	0	0	0	113.4
364	M	33	Very low	47.2	Very low	172 Å²	172	146.5 Å²	146.5	85%	0.847	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.3	8.5	-179.7	-89.3	-81	98.5	0	0	115.1	N362	N362-M364 PolarHBondContact O-N 3.39Å
365	E	36.3	Very low	48.8	Very low	164 Å²	164	143.4 Å²	143.4	77%	0.766	70%	0.704	S	S	*	*			trans	-131.6	87	168.8	-65.4	-176.7	-177	0	0	108.2	E367	E365-E367 PolarHBondContact O-N 2.75Å
366	E	41.9	Very low	50.5	Low	191 Å²	191	140.6 Å²	140.6	89%	0.893	69%	0.689	S	S	*	*			trans	-59.2	86.1	148.3	-82.8	-177.2	150.8	0	0	106.2	I368	E366-I368 PolarHBondContact O-N 2.95Å
367	E	45.1	Very low	52.5	Low	149 Å²	149	131.4 Å²	131.4	70%	0.696	66%	0.664	S	S	*	*			trans	-66.8	90.4	174.7	-154.4	176.9	-168	0	0	106	E365 Y369	E365-E367 PolarHBondContact O-N 2.75Å; E367-Y369 PolarHBondContact O-N 3.32Å
368	I	51.5	Low	54.7	Low	135 Å²	135	124.4 Å²	124.4	69%	0.692	65%	0.647	S	S	*	*			trans	-53.9	107.6	172.3	-60.8	168.8	0	0	0	105.6	E366 L370	E366-I368 PolarHBondContact O-N 2.95Å; I368-L370 VanDerWaalsContact C-N 3.28Å; I368-L370 HydrophobicContact CB-CD1 4Å; I368-L370 HydrophobicContact CG2-CD1 3.48Å; I368-L370 VanDerWaalsContact CG2-CD1 3.48Å; I368-L370 HydrophobicContact CG2-CG 4.31Å; I368-L370 PolarHBondContact O-N 2.78Å
369	Y	47.4	Very low	56.8	Low	202 Å²	202	118.9 Å²	118.9	79%	0.792	63%	0.634	S	S	*	*			trans	-69.3	89.2	176.2	-173.7	-96.3	0	0	0	108.2	E367	E367-Y369 PolarHBondContact O-N 3.32Å
370	L	51.2	Low	59.2	Low	82 Å²	82	114.7 Å²	114.7	43%	0.429	62%	0.62	S	S	.	*			trans	-79.9	121.4	169.5	-85	99.4	0	0	0	108.7	I368 V374	I368-L370 VanDerWaalsContact C-N 3.28Å; I368-L370 HydrophobicContact CB-CD1 4Å; I368-L370 HydrophobicContact CG2-CD1 3.48Å; I368-L370 VanDerWaalsContact CG2-CD1 3.48Å; I368-L370 HydrophobicContact CG2-CG 4.31Å; I368-L370 PolarHBondContact O-N 2.78Å; L370-V374 HydrophobicContact CD2-CB 3.96Å; L370-V374 HydrophobicContact CD2-CG1 3.51Å
371	P	59.2	Low	61.3	Low	58 Å²	58	114 Å²	114	38%	0.377	61%	0.611	S	S	.	*			trans	-59.3	149.5	177	21.5	-29	0	0	0	110.7	S373 V374	P371-S373 PolarHBondContact O-N 3.28Å; P371-V374 HydrophobicContact CG-CG2 4.01Å; P371-V374 PolarHBondContact O-N 2.84Å
372	P	68.5	Low	63.8	Low	98 Å²	98	110.6 Å²	110.6	64%	0.636	60%	0.596	S	S	*	*	H	α-helix	trans	-58.1	-21.9	-173.8	18.8	-30.3	0	0	0	114	V374 S376	P372-V374 VanDerWaalsContact C-N 3.34Å; P372-S376 WeakPolarHBondContact O-CB 3.24Å; P372-S376 PolarHBondContact O-N 2.63Å
373	S	72.5	Confident	66.4	Low	82 Å²	82	108.2 Å²	108.2	57%	0.573	59%	0.585	S	S	*	*	H	α-helix	trans	-62.8	-36.3	172.3	52	0	0	0	0	113.1	P371 A377	P371-S373 PolarHBondContact O-N 3.28Å; S373-A377 WeakPolarHBondContact O-CB 3.28Å; S373-A377 PolarHBondContact O-N 2.88Å
374	V	76.5	Confident	68.4	Low	56 Å²	56	107.1 Å²	107.1	34%	0.339	57%	0.572	S	S	.	*	H	α-helix	trans	-78.4	-39.4	-180	-172.9	0	0	0	0	110.8	L370 P371 P372 S376 A377 C378	L370-V374 HydrophobicContact CD2-CB 3.96Å; L370-V374 HydrophobicContact CD2-CG1 3.51Å; P371-V374 HydrophobicContact CG-CG2 4.01Å; P371-V374 PolarHBondContact O-N 2.84Å; P372-V374 VanDerWaalsContact C-N 3.34Å; V374-S376 VanDerWaalsContact C-N 3.31Å; V374-S376 PolarHBondContact O-N 2.84Å; V374-A377 PolarHBondContact O-N 3.27Å; V374-C378 WeakPolarHBondContact O-CB 3.35Å; V374-C378 PolarHBondContact O-N 3.18Å; V374-C378 PolarHBondContact O-SG 3.06Å; V374-C378 VanDerWaalsContact O-SG 3.33Å
375	L	76.8	Confident	71.2	Confident	102 Å²	102	104.3 Å²	104.3	53%	0.534	56%	0.56	S	S	.	*	H	α-helix	trans	-60.1	-42.9	171.9	-84.7	164.7	0	0	0	111.5	C378 L379	L375-C378 PolarHBondContact O-N 2.95Å; L375-L379 WeakPolarHBondContact O-CB 3.13Å; L375-L379 VanDerWaalsContact O-CG 3.31Å; L375-L379 WeakPolarHBondContact O-CG 3.32Å; L375-L379 PolarHBondContact O-N 2.71Å
376	S	80.8	Confident	73.9	Confident	66 Å²	66	101.7 Å²	101.7	46%	0.462	55%	0.551	S	S	.	*	H	α-helix	trans	-61.6	-45.4	175	179.9	0	0	0	0	112	P372 V374 L379 L380	P372-S376 WeakPolarHBondContact O-CB 3.24Å; P372-S376 PolarHBondContact O-N 2.63Å; V374-S376 VanDerWaalsContact C-N 3.31Å; V374-S376 PolarHBondContact O-N 2.84Å; S376-L379 PolarHBondContact O-N 2.86Å; S376-L380 WeakPolarHBondContact O-CG 3.47Å; S376-L380 PolarHBondContact O-N 3.25Å
377	A	79.7	Confident	76.1	Confident	46 Å²	46	95.5 Å²	95.5	38%	0.38	53%	0.526	S	S	.	.	H	α-helix	trans	-64.3	-42.8	176.7	0	0	0	0	0	112.5	S373 V374 L380 I381	S373-A377 WeakPolarHBondContact O-CB 3.28Å; S373-A377 PolarHBondContact O-N 2.88Å; V374-A377 PolarHBondContact O-N 3.27Å; A377-L380 PolarHBondContact O-N 2.86Å; A377-I381 VanDerWaalsContact O-CG1 3.32Å; A377-I381 WeakPolarHBondContact O-CG1 3.36Å; A377-I381 PolarHBondContact O-N 2.97Å
378	C	85.1	Confident	78.2	Confident	62 Å²	62	92.4 Å²	92.4	42%	0.419	51%	0.513	S	S	.	.	H	α-helix	trans	-62.7	-43.4	176.2	-75.9	0	0	0	0	111.9	V374 L375 L380 I381 V382	V374-C378 WeakPolarHBondContact O-CB 3.35Å; V374-C378 PolarHBondContact O-N 3.18Å; V374-C378 PolarHBondContact O-SG 3.06Å; V374-C378 VanDerWaalsContact O-SG 3.33Å; L375-C378 PolarHBondContact O-N 2.95Å; C378-L380 VanDerWaalsContact C-N 3.34Å; C378-L380 PolarHBondContact O-N 3.02Å; C378-I381 PolarHBondContact O-N 3.16Å; C378-V382 WeakPolarHBondContact O-CG2 3.39Å; C378-V382 PolarHBondContact O-N 3.15Å
379	L	87.1	Confident	80	Confident	113 Å²	113	87.8 Å²	87.8	59%	0.592	50%	0.5	S	S	*	.	H	α-helix	trans	-62.7	-41.1	175.9	-75.3	172.8	0	0	0	111.6	L375 S376 I381 V382 V383	L375-L379 WeakPolarHBondContact O-CB 3.13Å; L375-L379 VanDerWaalsContact O-CG 3.31Å; L375-L379 WeakPolarHBondContact O-CG 3.32Å; L375-L379 PolarHBondContact O-N 2.71Å; S376-L379 PolarHBondContact O-N 2.86Å; L379-I381 VanDerWaalsContact C-N 3.33Å; L379-I381 PolarHBondContact O-N 2.82Å; L379-V382 PolarHBondContact O-N 3Å; L379-V383 VanDerWaalsContact O-CG2 3.3Å; L379-V383 WeakPolarHBondContact O-CG2 3.21Å; L379-V383 PolarHBondContact O-N 3.34Å
380	L	86.9	Confident	82	Confident	108 Å²	108	83.5 Å²	83.5	57%	0.565	49%	0.489	S	S	*	.	H	α-helix	trans	-61.3	-40.7	174.6	-74.7	172.4	0	0	0	112.2	S376 A377 C378 V383 L384	S376-L380 WeakPolarHBondContact O-CG 3.47Å; S376-L380 PolarHBondContact O-N 3.25Å; A377-L380 PolarHBondContact O-N 2.86Å; C378-L380 VanDerWaalsContact C-N 3.34Å; C378-L380 PolarHBondContact O-N 3.02Å; L380-V383 PolarHBondContact O-N 2.93Å; L380-L384 WeakPolarHBondContact O-CB 3.24Å; L380-L384 PolarHBondContact O-N 3.39Å
381	I	88.2	Confident	83.7	Confident	100 Å²	100	84.7 Å²	84.7	51%	0.513	50%	0.495	S	S	.	.	H	α-helix	trans	-64.5	-44.1	176.1	-67.8	164.9	0	0	0	110.9	A377 C378 L379 V383 L384 L385	A377-I381 VanDerWaalsContact O-CG1 3.32Å; A377-I381 WeakPolarHBondContact O-CG1 3.36Å; A377-I381 PolarHBondContact O-N 2.97Å; C378-I381 PolarHBondContact O-N 3.16Å; L379-I381 VanDerWaalsContact C-N 3.33Å; L379-I381 PolarHBondContact O-N 2.82Å; I381-V383 VanDerWaalsContact C-N 3.35Å; I381-V383 PolarHBondContact O-N 3.19Å; I381-L384 PolarHBondContact O-N 3.46Å; I381-L385 HydrophobicContact CG2-CD1 4.08Å; I381-L385 HydrophobicContact CG2-CG 4.46Å; I381-L385 WeakPolarHBondContact O-CG 3.28Å; I381-L385 PolarHBondContact O-N 2.96Å
382	V	89.1	Confident	84.9	Confident	77 Å²	77	86.2 Å²	86.2	47%	0.467	50%	0.499	S	S	.	.	H	α-helix	trans	-62.7	-42	177.9	172.6	0	0	0	0	111.2	C378 L379 L385 L386	C378-V382 WeakPolarHBondContact O-CG2 3.39Å; C378-V382 PolarHBondContact O-N 3.15Å; L379-V382 PolarHBondContact O-N 3Å; V382-L385 PolarHBondContact O-N 2.97Å; V382-L386 HydrophobicContact CG1-CD1 4.07Å; V382-L386 WeakPolarHBondContact O-CB 3.41Å; V382-L386 WeakPolarHBondContact O-CG 3.39Å; V382-L386 PolarHBondContact O-N 2.67Å
383	V	90.2	Very high	85.6	Confident	83 Å²	83	83.7 Å²	83.7	50%	0.503	49%	0.486	S	S	.	.	H	α-helix	trans	-64.5	-40.8	175.9	172.7	0	0	0	0	111.3	L379 L380 I381 L386 T387	L379-V383 VanDerWaalsContact O-CG2 3.3Å; L379-V383 WeakPolarHBondContact O-CG2 3.21Å; L379-V383 PolarHBondContact O-N 3.34Å; L380-V383 PolarHBondContact O-N 2.93Å; I381-V383 VanDerWaalsContact C-N 3.35Å; I381-V383 PolarHBondContact O-N 3.19Å; V383-L386 PolarHBondContact O-N 3.41Å; V383-T387 HydrophobicContact CG1-CG2 4.42Å; V383-T387 WeakPolarHBondContact O-CB 3.4Å; V383-T387 WeakPolarHBondContact O-CG2 3.41Å; V383-T387 PolarHBondContact O-N 2.93Å; V383-T387 PolarHBondContact O-OG1 3.03Å
384	L	90.2	Very high	86.2	Confident	103 Å²	103	86.2 Å²	86.2	54%	0.539	49%	0.487	S	S	.	.	H	α-helix	trans	-62.1	-43.7	174.5	-96.1	161.8	0	0	0	112.1	L380 I381 T387 I388	L380-L384 WeakPolarHBondContact O-CB 3.24Å; L380-L384 PolarHBondContact O-N 3.39Å; I381-L384 PolarHBondContact O-N 3.46Å; L384-T387 WeakPolarHBondContact CA-OG1 3.09Å; L384-T387 PolarHBondContact O-N 2.72Å; L384-T387 PolarHBondContact O-OG1 2.99Å; L384-I388 HydrophobicContact CD2-CD1 4.49Å; L384-I388 WeakPolarHBondContact O-CB 3.22Å; L384-I388 WeakPolarHBondContact O-CD1 3.17Å; L384-I388 VanDerWaalsContact O-CG1 3.22Å; L384-I388 WeakPolarHBondContact O-CG1 3.22Å; L384-I388 PolarHBondContact O-N 3.48Å
385	L	91.6	Very high	86.4	Confident	114 Å²	114	86.8 Å²	86.8	60%	0.597	49%	0.493	S	S	*	.	H	α-helix	trans	-66.6	-39.8	177.9	-70.8	173.7	0	0	0	112.1	I381 V382 G389	I381-L385 HydrophobicContact CG2-CD1 4.08Å; I381-L385 HydrophobicContact CG2-CG 4.46Å; I381-L385 WeakPolarHBondContact O-CG 3.28Å; I381-L385 PolarHBondContact O-N 2.96Å; V382-L385 PolarHBondContact O-N 2.97Å; L385-G389 PolarHBondContact O-N 3.4Å
386	L	92.1	Very high	86.6	Confident	108 Å²	108	87.8 Å²	87.8	57%	0.565	50%	0.497	S	S	*	.	H	α-helix	trans	-64.9	-45.2	175.8	-77.9	170.7	0	0	0	111.9	V382 V383 G389 I390	V382-L386 HydrophobicContact CG1-CD1 4.07Å; V382-L386 WeakPolarHBondContact O-CB 3.41Å; V382-L386 WeakPolarHBondContact O-CG 3.39Å; V382-L386 PolarHBondContact O-N 2.67Å; V383-L386 PolarHBondContact O-N 3.41Å; L386-G389 PolarHBondContact O-N 2.84Å; L386-I390 WeakPolarHBondContact O-CD1 3.4Å; L386-I390 WeakPolarHBondContact O-CG1 3.42Å; L386-I390 PolarHBondContact O-N 2.93Å
387	T	89.4	Confident	86.5	Confident	62 Å²	62	91 Å²	91	38%	0.38	51%	0.508	S	S	.	.	H	α-helix	trans	-64.3	-44.3	178.7	50.3	0	0	0	0	111.8	V383 L384 I390 I391	V383-T387 HydrophobicContact CG1-CG2 4.42Å; V383-T387 WeakPolarHBondContact O-CB 3.4Å; V383-T387 WeakPolarHBondContact O-CG2 3.41Å; V383-T387 PolarHBondContact O-N 2.93Å; V383-T387 PolarHBondContact O-OG1 3.03Å; L384-T387 WeakPolarHBondContact CA-OG1 3.09Å; L384-T387 PolarHBondContact O-N 2.72Å; L384-T387 PolarHBondContact O-OG1 2.99Å; T387-I390 PolarHBondContact O-N 3.13Å; T387-I391 WeakPolarHBondContact O-CD1 3.36Å; T387-I391 VanDerWaalsContact O-CG1 3.25Å; T387-I391 WeakPolarHBondContact O-CG1 3.42Å; T387-I391 PolarHBondContact O-N 3.46Å
388	I	89.3	Confident	86.2	Confident	83 Å²	83	90.2 Å²	90.2	43%	0.426	50%	0.497	S	S	.	.	H	α-helix	trans	-62.6	-43.7	174.6	-67.9	168.1	0	0	0	110.8	L384 I390 I391 I392	L384-I388 HydrophobicContact CD2-CD1 4.49Å; L384-I388 WeakPolarHBondContact O-CB 3.22Å; L384-I388 WeakPolarHBondContact O-CD1 3.17Å; L384-I388 VanDerWaalsContact O-CG1 3.22Å; L384-I388 WeakPolarHBondContact O-CG1 3.22Å; L384-I388 PolarHBondContact O-N 3.48Å; I388-I390 PolarHBondContact O-N 2.99Å; I388-I391 PolarHBondContact O-N 3.18Å; I388-I392 HydrophobicContact CG2-CD1 3.69Å; I388-I392 HydrophobicContact CG2-CG1 4.36Å; I388-I392 WeakPolarHBondContact O-CG1 3.28Å; I388-I392 PolarHBondContact O-N 3.27Å
389	G	89.5	Confident	85.2	Confident	39 Å²	39	93.2 Å²	93.2	40%	0.402	51%	0.505	S	S	.	.	H	α-helix	trans	-60.2	-42.9	177.2	0	0	0	0	0	113	L385 L386 I392 A393	L385-G389 PolarHBondContact O-N 3.4Å; L386-G389 PolarHBondContact O-N 2.84Å; G389-I392 PolarHBondContact O-N 2.83Å; G389-A393 WeakPolarHBondContact O-CB 3.05Å; G389-A393 PolarHBondContact O-N 2.9Å
390	I	88.8	Confident	84.1	Confident	112 Å²	112	95.5 Å²	95.5	57%	0.574	51%	0.513	S	S	*	.	H	α-helix	trans	-63.8	-44.1	176	-68.6	163.1	0	0	0	110.7	L386 T387 I388 A393 F394	L386-I390 WeakPolarHBondContact O-CD1 3.4Å; L386-I390 WeakPolarHBondContact O-CG1 3.42Å; L386-I390 PolarHBondContact O-N 2.93Å; T387-I390 PolarHBondContact O-N 3.13Å; I388-I390 PolarHBondContact O-N 2.99Å; I390-A393 PolarHBondContact O-N 3.44Å; I390-F394 WeakPolarHBondContact O-CB 3.36Å; I390-F394 PolarHBondContact O-N 2.63Å
391	I	86.4	Confident	82.7	Confident	106 Å²	106	97.2 Å²	97.2	54%	0.544	52%	0.515	S	S	.	.	H	α-helix	trans	-62	-46.3	178.4	-68.1	164.7	0	0	0	110.6	T387 I388 F394 C395	T387-I391 WeakPolarHBondContact O-CD1 3.36Å; T387-I391 VanDerWaalsContact O-CG1 3.25Å; T387-I391 WeakPolarHBondContact O-CG1 3.42Å; T387-I391 PolarHBondContact O-N 3.46Å; I388-I391 PolarHBondContact O-N 3.18Å; I391-F394 PolarHBondContact O-N 2.69Å; I391-C395 WeakPolarHBondContact O-CB 3.34Å; I391-C395 PolarHBondContact O-N 3.08Å; I391-C395 PolarHBondContact O-SG 2.84Å
392	I	84.3	Confident	81	Confident	91 Å²	91	97.4 Å²	97.4	47%	0.467	52%	0.517	S	S	.	.	H	α-helix	trans	-63.7	-45	178.7	-67.2	169.9	0	0	0	110.7	I388 G389 F394 C395 I396	I388-I392 HydrophobicContact CG2-CD1 3.69Å; I388-I392 HydrophobicContact CG2-CG1 4.36Å; I388-I392 WeakPolarHBondContact O-CG1 3.28Å; I388-I392 PolarHBondContact O-N 3.27Å; G389-I392 PolarHBondContact O-N 2.83Å; I392-F394 VanDerWaalsContact C-N 3.3Å; I392-F394 PolarHBondContact O-N 3.41Å; I392-C395 PolarHBondContact O-N 2.91Å; I392-I396 HydrophobicContact CG2-CD1 3.76Å; I392-I396 HydrophobicContact CG2-CG1 4.39Å; I392-I396 WeakPolarHBondContact O-CG1 3.37Å; I392-I396 PolarHBondContact O-N 3.16Å
393	A	84.4	Confident	79.5	Confident	44 Å²	44	100.7 Å²	100.7	36%	0.364	53%	0.529	S	S	.	.	H	α-helix	trans	-59.6	-42	176.6	0	0	0	0	0	111.7	G389 I390 I396 I397	G389-A393 WeakPolarHBondContact O-CB 3.05Å; G389-A393 PolarHBondContact O-N 2.9Å; I390-A393 PolarHBondContact O-N 3.44Å; A393-I396 PolarHBondContact O-N 3.46Å; A393-I397 WeakPolarHBondContact O-CB 3.5Å; A393-I397 WeakPolarHBondContact O-CD1 3.47Å; A393-I397 VanDerWaalsContact O-CG1 3.23Å; A393-I397 WeakPolarHBondContact O-CG1 3.46Å; A393-I397 PolarHBondContact O-N 3.43Å
394	F	84	Confident	77.6	Confident	135 Å²	135	103 Å²	103	59%	0.592	54%	0.538	S	S	*	.	H	α-helix	trans	-65.6	-39.8	177.3	-152.1	-92.7	0	0	0	112.1	I390 I391 I392 N398	I390-F394 WeakPolarHBondContact O-CB 3.36Å; I390-F394 PolarHBondContact O-N 2.63Å; I391-F394 PolarHBondContact O-N 2.69Å; I392-F394 VanDerWaalsContact C-N 3.3Å; I392-F394 PolarHBondContact O-N 3.41Å; F394-N398 WeakPolarHBondContact CD1-ND2 3.46Å; F394-N398 WeakPolarHBondContact CE1-ND2 3.41Å; F394-N398 WeakPolarHBondContact CZ-ND2 3.45Å; F394-N398 VanDerWaalsContact O-CB 3.3Å; F394-N398 WeakPolarHBondContact O-CB 3.49Å; F394-N398 PolarHBondContact O-N 2.84Å; F394-N398 PolarHBondContact O-ND2 3.45Å
395	C	80.2	Confident	75.9	Confident	68 Å²	68	101.7 Å²	101.7	46%	0.459	54%	0.536	S	S	.	.	H	α-helix	trans	-64.8	-39.6	175.6	-73.3	0	0	0	0	112.5	I391 I392 H399	I391-C395 WeakPolarHBondContact O-CB 3.34Å; I391-C395 PolarHBondContact O-N 3.08Å; I391-C395 PolarHBondContact O-SG 2.84Å; I392-C395 PolarHBondContact O-N 2.91Å; C395-H399 PolarHBondContact O-N 3.11Å; C395-H399 VanDerWaalsContact O-N 3.16Å
396	I	82	Confident	74.1	Confident	124 Å²	124	104.9 Å²	104.9	64%	0.636	55%	0.545	S	S	*	.	H	α-helix	trans	-71.8	-50.7	178.8	-66.2	169.4	0	0	0	110.6	I392 A393 N398 H399	I392-I396 HydrophobicContact CG2-CD1 3.76Å; I392-I396 HydrophobicContact CG2-CG1 4.39Å; I392-I396 WeakPolarHBondContact O-CG1 3.37Å; I392-I396 PolarHBondContact O-N 3.16Å; A393-I396 PolarHBondContact O-N 3.46Å; I396-N398 VanDerWaalsContact C-N 3.26Å; I396-N398 PolarHBondContact O-N 3.48Å; I396-H399 PolarHBondContact O-N 3.35Å
397	I	78.9	Confident	72.3	Confident	134 Å²	134	104.8 Å²	104.8	69%	0.687	55%	0.554	S	S	*	*	H	α-helix	trans	-62.5	-36	-177.3	-68	166.4	0	0	0	111.2	A393	A393-I397 WeakPolarHBondContact O-CB 3.5Å; A393-I397 WeakPolarHBondContact O-CD1 3.47Å; A393-I397 VanDerWaalsContact O-CG1 3.23Å; A393-I397 WeakPolarHBondContact O-CG1 3.46Å; A393-I397 PolarHBondContact O-N 3.43Å
398	N	71.8	Confident	70.5	Confident	28 Å²	28	112.3 Å²	112.3	15%	0.15	58%	0.575	C	S	.	*	T	Hydrogen-bonded Turn	trans	-100.1	12.8	-178	-68	-51.9	0	0	0	114.2	F394 I396 E400 K401 L402	F394-N398 WeakPolarHBondContact CD1-ND2 3.46Å; F394-N398 WeakPolarHBondContact CE1-ND2 3.41Å; F394-N398 WeakPolarHBondContact CZ-ND2 3.45Å; F394-N398 VanDerWaalsContact O-CB 3.3Å; F394-N398 WeakPolarHBondContact O-CB 3.49Å; F394-N398 PolarHBondContact O-N 2.84Å; F394-N398 PolarHBondContact O-ND2 3.45Å; I396-N398 VanDerWaalsContact C-N 3.26Å; I396-N398 PolarHBondContact O-N 3.48Å; N398-E400 VanDerWaalsContact C-N 3.26Å; N398-E400 PolarHBondContact O-N 2.89Å; N398-K401 HydrophobicContact CB-CB 4.46Å; N398-K401 PolarHBondContact O-N 3.47Å; N398-L402 HydrophobicContact CB-CD1 4.41Å; N398-L402 WeakPolarHBondContact O-CB 3.09Å; N398-L402 PolarHBondContact O-N 3.17Å
399	H	65.6	Low	69	Low	125 Å²	125	110 Å²	110	58%	0.579	57%	0.566	S	S	*	*	H	α-helix	trans	-54.2	-42.4	-178.4	-177.3	-92.9	0	0	0	112.3	C395 I396	C395-H399 PolarHBondContact O-N 3.11Å; C395-H399 VanDerWaalsContact O-N 3.16Å; I396-H399 PolarHBondContact O-N 3.35Å
400	E	63.1	Low	67.6	Low	162 Å²	162	117.6 Å²	117.6	76%	0.757	58%	0.583	S	S	*	*	H	α-helix	trans	-70.8	-34.9	177.2	-67.4	-170	155.8	0	0	113.2	N398	N398-E400 VanDerWaalsContact C-N 3.26Å; N398-E400 PolarHBondContact O-N 2.89Å
401	K	58	Low	66.1	Low	143 Å²	143	120.5 Å²	120.5	62%	0.622	59%	0.591	S	S	*	*	H	α-helix	trans	-75.9	-30.2	179	-68.9	-177	-179.1	172.5	0	112.5	N398 M403 L404 C405	N398-K401 HydrophobicContact CB-CB 4.46Å; N398-K401 PolarHBondContact O-N 3.47Å; K401-M403 VanDerWaalsContact C-N 3.3Å; K401-M403 PolarHBondContact O-N 3.42Å; K401-L404 PolarHBondContact O-N 2.93Å; K401-C405 WeakPolarHBondContact O-CB 3.4Å; K401-C405 PolarHBondContact O-N 3.49Å; K401-C405 PolarHBondContact O-SG 3.21Å; K401-C405 VanDerWaalsContact O-SG 3.32Å
402	L	53.1	Low	65.1	Low	105 Å²	105	123.7 Å²	123.7	55%	0.55	60%	0.597	S	S	.	*	H	α-helix	trans	-64.2	-34.1	176.1	-102	145.8	0	0	0	112.2	N398	N398-L402 HydrophobicContact CB-CD1 4.41Å; N398-L402 WeakPolarHBondContact O-CB 3.09Å; N398-L402 PolarHBondContact O-N 3.17Å
403	M	56	Low	64.2	Low	145 Å²	145	127.7 Å²	127.7	71%	0.714	61%	0.606	S	S	*	*	H	α-helix	trans	-72.1	-38	176.3	-69.8	-64.5	-114	0	0	112.5	K401	K401-M403 VanDerWaalsContact C-N 3.3Å; K401-M403 PolarHBondContact O-N 3.42Å
404	L	51.9	Low	63.6	Low	132 Å²	132	131.8 Å²	131.8	69%	0.691	62%	0.617	S	S	*	*	H	α-helix	trans	-75.7	-28.8	177.3	-90.2	148.8	0	0	0	113.4	K401	K401-L404 PolarHBondContact O-N 2.93Å
405	C	52.7	Low	63	Low	75 Å²	75	134.9 Å²	134.9	51%	0.507	63%	0.625	S	S	.	*	H	α-helix	trans	-73.2	-23.8	178.8	-77.3	0	0	0	0	113.5	K401 S407 S409	K401-C405 WeakPolarHBondContact O-CB 3.4Å; K401-C405 PolarHBondContact O-N 3.49Å; K401-C405 PolarHBondContact O-SG 3.21Å; K401-C405 VanDerWaalsContact O-SG 3.32Å; C405-S407 VanDerWaalsContact C-N 3.29Å; C405-S407 PolarHBondContact O-N 2.76Å; C405-S409 WeakPolarHBondContact O-CA 3.34Å; C405-S409 WeakPolarHBondContact O-CB 3.11Å; C405-S409 PolarHBondContact O-N 3.07Å
406	K	55.2	Low	62.5	Low	181 Å²	181	136.1 Å²	136.1	79%	0.787	62%	0.624	S	S	*	*	H	α-helix	trans	-63.4	-29.9	-174.6	-161.8	172.7	179.2	177.1	0	113.8
407	S	53.2	Low	62.1	Low	106 Å²	106	132.7 Å²	132.7	74%	0.741	61%	0.614	S	S	*	*	H	α-helix	trans	-90.3	-32.1	-177.8	65.4	0	0	0	0	114.3	C405	C405-S407 VanDerWaalsContact C-N 3.29Å; C405-S407 PolarHBondContact O-N 2.76Å
408	R	52.3	Low	62.1	Low	221 Å²	221	129.1 Å²	129.1	83%	0.834	61%	0.605	S	S	*	*	H	α-helix	trans	-91	-18.9	176.6	-93.5	-179.2	163.4	-174.9	-4.3	114.1	R410	R408-R410 PolarHBondContact O-N 3.22Å
409	S	57.3	Low	62.4	Low	33 Å²	33	132.9 Å²	132.9	23%	0.231	62%	0.624	C	S	.	*	H	α-helix	trans	-67.1	-27	-174.6	172.2	0	0	0	0	114	C405 K411 R412 R413	C405-S409 WeakPolarHBondContact O-CA 3.34Å; C405-S409 WeakPolarHBondContact O-CB 3.11Å; C405-S409 PolarHBondContact O-N 3.07Å; S409-K411 PolarHBondContact O-N 3.31Å; S409-R412 PolarHBondContact O-N 3.26Å; S409-R413 WeakPolarHBondContact O-CA 3.39Å; S409-R413 WeakPolarHBondContact O-CB 3.41Å; S409-R413 WeakPolarHBondContact O-CG 3.19Å; S409-R413 PolarHBondContact O-N 3.41Å; S409-R413 WeakPolarHBondContact OG-CD 3.48Å; S409-R413 WeakPolarHBondContact OG-CG 3.46Å; S409-R413 PolarHBondContact OG-NE 2.89Å
410	R	60.9	Low	62.9	Low	199 Å²	199	129 Å²	129	75%	0.751	61%	0.614	S	S	*	*	H	α-helix	trans	-65.1	-46.2	-172.6	-152.9	177	-174.7	-170.1	0.6	113.2	R408 E414	R408-R410 PolarHBondContact O-N 3.22Å; R410-E414 PolarHBondContact O-N 2.95Å
411	K	57.6	Low	63.6	Low	173 Å²	173	128.2 Å²	128.2	75%	0.752	61%	0.61	S	S	*	*	H	α-helix	trans	-74.4	-27.4	177.9	-82.6	-175	175.1	-179.2	0	113.9	S409	S409-K411 PolarHBondContact O-N 3.31Å
412	R	64.9	Low	64.6	Low	174 Å²	174	127.7 Å²	127.7	66%	0.657	61%	0.61	S	S	*	*	H	α-helix	trans	-78.3	-37.1	174.9	-161.3	-179.7	174.1	171.7	4.9	111.2	S409 E414 R415 E416	S409-R412 PolarHBondContact O-N 3.26Å; R412-E414 VanDerWaalsContact C-N 3.32Å; R412-E414 PolarHBondContact O-N 2.82Å; R412-R415 PolarHBondContact O-N 3.5Å; R412-E416 WeakPolarHBondContact CD-OE1 3.46Å; R412-E416 HydrophobicContact CG-CG 4.33Å; R412-E416 WeakPolarHBondContact CG-OE1 3.24Å; R412-E416 IonicContact CZ-OE1 2.78Å; R412-E416 IonicContact NE-OE1 3Å; R412-E416 PolarHBondContact NE-OE1 2.87Å; R412-E416 IonicContact NH2-OE1 3.91Å; R412-E416 WeakPolarHBondContact O-CB 3.28Å; R412-E416 WeakPolarHBondContact O-CG 3.43Å; R412-E416 PolarHBondContact O-N 3.47Å
413	R	65.7	Low	65.8	Low	175 Å²	175	128.5 Å²	128.5	66%	0.66	61%	0.612	S	S	*	*	H	α-helix	trans	-59.7	-37.2	173.3	-92	-179	172.9	-178.5	-0.9	112.6	S409 R415 A417	S409-R413 WeakPolarHBondContact O-CA 3.39Å; S409-R413 WeakPolarHBondContact O-CB 3.41Å; S409-R413 WeakPolarHBondContact O-CG 3.19Å; S409-R413 PolarHBondContact O-N 3.41Å; S409-R413 WeakPolarHBondContact OG-CD 3.48Å; S409-R413 WeakPolarHBondContact OG-CG 3.46Å; S409-R413 PolarHBondContact OG-NE 2.89Å; R413-R415 VanDerWaalsContact C-N 3.34Å; R413-A417 WeakPolarHBondContact O-CA 3.38Å; R413-A417 WeakPolarHBondContact O-CB 3.49Å; R413-A417 PolarHBondContact O-N 2.05Å
414	E	71.3	Confident	66.7	Low	129 Å²	129	126.8 Å²	126.8	60%	0.603	61%	0.606	S	S	*	*	H	α-helix	trans	-65.2	-39.6	176.7	-74.9	169.9	-174.2	0	0	111.8	R410 R412 A418	R410-E414 PolarHBondContact O-N 2.95Å; R412-E414 VanDerWaalsContact C-N 3.32Å; R412-E414 PolarHBondContact O-N 2.82Å; E414-A418 PolarHBondContact O-N 3.12Å
415	R	71.4	Confident	68	Low	201 Å²	201	125.8 Å²	125.8	76%	0.758	60%	0.598	S	S	*	*	H	α-helix	trans	-75.2	-37.7	176.4	-67	-174.1	-176	-177.1	-0.6	113	R412 R413 L419	R412-R415 PolarHBondContact O-N 3.5Å; R413-R415 VanDerWaalsContact C-N 3.34Å; R415-L419 PolarHBondContact O-N 3.35Å
416	E	70.6	Confident	69.3	Low	94 Å²	94	128 Å²	128	44%	0.439	60%	0.599	S	S	.	*	H	α-helix	trans	-72.1	-32.6	176.1	-75.2	172.7	178.4	0	0	111.8	R412 L419 A420	R412-E416 WeakPolarHBondContact CD-OE1 3.46Å; R412-E416 HydrophobicContact CG-CG 4.33Å; R412-E416 WeakPolarHBondContact CG-OE1 3.24Å; R412-E416 IonicContact CZ-OE1 2.78Å; R412-E416 IonicContact NE-OE1 3Å; R412-E416 PolarHBondContact NE-OE1 2.87Å; R412-E416 IonicContact NH2-OE1 3.91Å; R412-E416 WeakPolarHBondContact O-CB 3.28Å; R412-E416 WeakPolarHBondContact O-CG 3.43Å; R412-E416 PolarHBondContact O-N 3.47Å; E416-L419 PolarHBondContact O-N 2.98Å; E416-A420 WeakPolarHBondContact O-CB 3.46Å; E416-A420 PolarHBondContact O-N 3.3Å
417	A	73.3	Confident	70.3	Confident	51 Å²	51	121.7 Å²	121.7	42%	0.421	58%	0.581	S	S	.	*	H	α-helix	trans	-68.1	-37.7	173.8	0	0	0	0	0	111.8	R413 A420 Q421	R413-A417 WeakPolarHBondContact O-CA 3.38Å; R413-A417 WeakPolarHBondContact O-CB 3.49Å; R413-A417 PolarHBondContact O-N 2.05Å; A417-A420 PolarHBondContact O-N 3.05Å; A417-Q421 WeakPolarHBondContact O-CB 3.44Å; A417-Q421 WeakPolarHBondContact O-CG 3.45Å; A417-Q421 PolarHBondContact O-N 3.03Å
418	A	77.3	Confident	71.5	Confident	60 Å²	60	119.6 Å²	119.6	50%	0.496	57%	0.57	S	S	.	*	H	α-helix	trans	-64.8	-44.6	174.5	0	0	0	0	0	111.9	E414 Q421 E422	E414-A418 PolarHBondContact O-N 3.12Å; A418-Q421 PolarHBondContact O-N 3.37Å; A418-E422 PolarHBondContact O-N 2.94Å
419	L	78.1	Confident	72.7	Confident	107 Å²	107	115.3 Å²	115.3	56%	0.56	56%	0.557	S	S	*	*	H	α-helix	trans	-69.6	-35.7	175.5	-83.7	166.2	0	0	0	112.9	R415 E416 E422 M423	R415-L419 PolarHBondContact O-N 3.35Å; E416-L419 PolarHBondContact O-N 2.98Å; L419-E422 PolarHBondContact O-N 3Å; L419-M423 WeakPolarHBondContact O-CB 3.41Å; L419-M423 VanDerWaalsContact O-CG 3.26Å; L419-M423 WeakPolarHBondContact O-CG 3.22Å; L419-M423 PolarHBondContact O-N 3.49Å
420	A	77.1	Confident	73.6	Confident	44 Å²	44	119.3 Å²	119.3	36%	0.364	57%	0.572	S	S	.	*	H	α-helix	trans	-66	-40	175.4	0	0	0	0	0	111.1	E416 A417 E422 M423 D424	E416-A420 WeakPolarHBondContact O-CB 3.46Å; E416-A420 PolarHBondContact O-N 3.3Å; A417-A420 PolarHBondContact O-N 3.05Å; A420-E422 VanDerWaalsContact C-N 3.34Å; A420-E422 PolarHBondContact O-N 3.06Å; A420-M423 PolarHBondContact O-N 3.42Å; A420-D424 VanDerWaalsContact O-CB 3.25Å; A420-D424 WeakPolarHBondContact O-CB 3.29Å; A420-D424 PolarHBondContact O-N 3.49Å
421	Q	77.8	Confident	74.2	Confident	144 Å²	144	112.7 Å²	112.7	67%	0.673	56%	0.56	S	S	*	*	H	α-helix	trans	-62.6	-39.8	174.3	-78.3	-178.8	-18.4	0	0	112.4	A417 A418 E425	A417-Q421 WeakPolarHBondContact O-CB 3.44Å; A417-Q421 WeakPolarHBondContact O-CG 3.45Å; A417-Q421 PolarHBondContact O-N 3.03Å; A418-Q421 PolarHBondContact O-N 3.37Å; Q421-E425 WeakPolarHBondContact O-CB 3.35Å; Q421-E425 PolarHBondContact O-N 3.43Å
422	E	78.5	Confident	75.1	Confident	133 Å²	133	107.1 Å²	107.1	62%	0.621	55%	0.546	S	S	*	.	H	α-helix	trans	-67.3	-40.3	175.9	-167.6	179.9	175.6	0	0	112	A418 L419 A420 K426	A418-E422 PolarHBondContact O-N 2.94Å; L419-E422 PolarHBondContact O-N 3Å; A420-E422 VanDerWaalsContact C-N 3.34Å; A420-E422 PolarHBondContact O-N 3.06Å; E422-K426 WeakPolarHBondContact O-CB 3.16Å; E422-K426 PolarHBondContact O-N 3.05Å
423	M	78.5	Confident	75.5	Confident	122 Å²	122	101.6 Å²	101.6	60%	0.601	54%	0.537	S	S	*	.	H	α-helix	trans	-71	-36.2	176.4	-69.9	-66.4	-67.7	0	0	112.6	L419 A420 K426 A427	L419-M423 WeakPolarHBondContact O-CB 3.41Å; L419-M423 VanDerWaalsContact O-CG 3.26Å; L419-M423 WeakPolarHBondContact O-CG 3.22Å; L419-M423 PolarHBondContact O-N 3.49Å; A420-M423 PolarHBondContact O-N 3.42Å; M423-K426 PolarHBondContact O-N 3.14Å; M423-A427 WeakPolarHBondContact O-CB 3.32Å; M423-A427 PolarHBondContact O-N 3.23Å
424	D	75.5	Confident	75.9	Confident	108 Å²	108	96 Å²	96	58%	0.578	53%	0.528	S	S	*	.	H	α-helix	trans	-68.7	-37.9	175.4	-73.8	-19.2	0	0	0	110.6	A420 A427 A428	A420-D424 VanDerWaalsContact O-CB 3.25Å; A420-D424 WeakPolarHBondContact O-CB 3.29Å; A420-D424 PolarHBondContact O-N 3.49Å; D424-A427 PolarHBondContact O-N 2.83Å; D424-A428 WeakPolarHBondContact O-CB 3.27Å; D424-A428 PolarHBondContact O-N 2.65Å
425	E	79.5	Confident	76	Confident	111 Å²	111	92.4 Å²	92.4	52%	0.519	52%	0.521	S	S	.	.	H	α-helix	trans	-65.5	-40.8	173.2	-167.2	-173.8	149.8	0	0	111.3	Q421 K429	Q421-E425 WeakPolarHBondContact O-CB 3.35Å; Q421-E425 PolarHBondContact O-N 3.43Å; E425-K429 HydrophobicContact CG-CD 4.49Å; E425-K429 WeakPolarHBondContact O-CB 3.06Å; E425-K429 WeakPolarHBondContact O-CG 3.16Å; E425-K429 PolarHBondContact O-N 3.08Å; E425-K429 WeakPolarHBondContact OE1-CE 3.42Å; E425-K429 IonicContact OE1-NZ 2.65Å; E425-K429 PolarHBondContact OE1-NZ 2.06Å
426	K	78.6	Confident	76.1	Confident	123 Å²	123	87.2 Å²	87.2	54%	0.535	51%	0.512	S	S	.	.	H	α-helix	trans	-68.7	-41.7	176	-167.8	176.4	177.9	-175.5	0	112.1	E422 M423 K429 E430	E422-K426 WeakPolarHBondContact O-CB 3.16Å; E422-K426 PolarHBondContact O-N 3.05Å; M423-K426 PolarHBondContact O-N 3.14Å; K426-K429 PolarHBondContact O-N 2.84Å; K426-E430 VanDerWaalsContact CE-OE1 3.28Å; K426-E430 WeakPolarHBondContact CE-OE1 3.07Å; K426-E430 WeakPolarHBondContact O-CB 3.27Å; K426-E430 WeakPolarHBondContact O-CG 3.48Å; K426-E430 PolarHBondContact O-N 3.06Å
427	A	77.3	Confident	76.2	Confident	48 Å²	48	85 Å²	85	40%	0.397	51%	0.509	S	S	.	.	H	α-helix	trans	-67.8	-35.8	176	0	0	0	0	0	111.8	M423 D424 E430 A431	M423-A427 WeakPolarHBondContact O-CB 3.32Å; M423-A427 PolarHBondContact O-N 3.23Å; D424-A427 PolarHBondContact O-N 2.83Å; A427-E430 PolarHBondContact O-N 2.75Å; A427-A431 WeakPolarHBondContact O-CB 3.34Å; A427-A431 PolarHBondContact O-N 3.4Å
428	A	77.3	Confident	76	Confident	62 Å²	62	84.6 Å²	84.6	51%	0.512	51%	0.506	S	S	.	.	H	α-helix	trans	-66.7	-39.2	172.9	0	0	0	0	0	111.5	D424 A432	D424-A428 WeakPolarHBondContact O-CB 3.27Å; D424-A428 PolarHBondContact O-N 2.65Å; A428-A432 VanDerWaalsContact O-CB 3.25Å; A428-A432 WeakPolarHBondContact O-CB 3.47Å; A428-A432 PolarHBondContact O-N 3.26Å
429	K	77.7	Confident	75.6	Confident	131 Å²	131	87.7 Å²	87.7	57%	0.57	51%	0.51	S	S	*	.	H	α-helix	trans	-66.1	-41.7	173.3	-76.4	169.5	174.4	166.7	0	112.1	E425 K426 A433	E425-K429 HydrophobicContact CG-CD 4.49Å; E425-K429 WeakPolarHBondContact O-CB 3.06Å; E425-K429 WeakPolarHBondContact O-CG 3.16Å; E425-K429 PolarHBondContact O-N 3.08Å; E425-K429 WeakPolarHBondContact OE1-CE 3.42Å; E425-K429 IonicContact OE1-NZ 2.65Å; E425-K429 PolarHBondContact OE1-NZ 2.06Å; K426-K429 PolarHBondContact O-N 2.84Å; K429-A433 WeakPolarHBondContact O-CB 3.26Å; K429-A433 PolarHBondContact O-N 3.26Å
430	E	77.1	Confident	75.2	Confident	117 Å²	117	84.8 Å²	84.8	55%	0.547	50%	0.502	S	S	.	.	H	α-helix	trans	-70.6	-37.3	176.2	-74.9	176.6	-168.9	0	0	112.2	K426 A427 A433 A434	K426-E430 VanDerWaalsContact CE-OE1 3.28Å; K426-E430 WeakPolarHBondContact CE-OE1 3.07Å; K426-E430 WeakPolarHBondContact O-CB 3.27Å; K426-E430 WeakPolarHBondContact O-CG 3.48Å; K426-E430 PolarHBondContact O-N 3.06Å; A427-E430 PolarHBondContact O-N 2.75Å; E430-A433 PolarHBondContact O-N 2.95Å; E430-A434 WeakPolarHBondContact O-CB 3.3Å; E430-A434 PolarHBondContact O-N 3.01Å
431	A	73.8	Confident	74.6	Confident	60 Å²	60	88.2 Å²	88.2	50%	0.496	51%	0.511	S	S	.	.	H	α-helix	trans	-69.6	-36.1	174.5	0	0	0	0	0	111.7	A427 A435	A427-A431 WeakPolarHBondContact O-CB 3.34Å; A427-A431 PolarHBondContact O-N 3.4Å; A431-A435 WeakPolarHBondContact O-CB 3.02Å; A431-A435 PolarHBondContact O-N 3.12Å
432	A	75.2	Confident	73.7	Confident	56 Å²	56	90.1 Å²	90.1	46%	0.463	51%	0.512	S	S	.	.	H	α-helix	trans	-65.4	-43.3	170.9	0	0	0	0	0	111.1	A428 A435 T436	A428-A432 VanDerWaalsContact O-CB 3.25Å; A428-A432 WeakPolarHBondContact O-CB 3.47Å; A428-A432 PolarHBondContact O-N 3.26Å; A432-A435 PolarHBondContact O-N 2.8Å; A432-T436 WeakPolarHBondContact O-CG2 3.17Å; A432-T436 PolarHBondContact O-N 2.88Å; A432-T436 PolarHBondContact O-OG1 3.11Å
433	A	74.1	Confident	72.6	Confident	57 Å²	57	89.3 Å²	89.3	47%	0.471	51%	0.508	S	S	.	.	H	α-helix	trans	-64.4	-42.9	175.1	0	0	0	0	0	112.1	K429 E430 T436 A437	K429-A433 WeakPolarHBondContact O-CB 3.26Å; K429-A433 PolarHBondContact O-N 3.26Å; E430-A433 PolarHBondContact O-N 2.95Å; A433-T436 WeakPolarHBondContact CA-OG1 3.44Å; A433-T436 PolarHBondContact O-N 2.94Å; A433-T436 PolarHBondContact O-OG1 3.35Å; A433-A437 WeakPolarHBondContact O-CB 3.47Å; A433-A437 PolarHBondContact O-N 3.04Å
434	A	73.4	Confident	71.2	Confident	57 Å²	57	89 Å²	89	47%	0.471	51%	0.505	S	S	.	.	H	α-helix	trans	-68.4	-35.2	176.5	0	0	0	0	0	112	E430 A437 A438	E430-A434 WeakPolarHBondContact O-CB 3.3Å; E430-A434 PolarHBondContact O-N 3.01Å; A434-A437 PolarHBondContact O-N 2.79Å; A434-A438 WeakPolarHBondContact O-CB 3.36Å; A434-A438 PolarHBondContact O-N 3.39Å
435	A	73.6	Confident	69.9	Low	55 Å²	55	89.9 Å²	89.9	46%	0.455	51%	0.505	S	S	.	.	H	α-helix	trans	-64.1	-46.6	171.6	0	0	0	0	0	110.2	A431 A432 A437 A438 E439	A431-A435 WeakPolarHBondContact O-CB 3.02Å; A431-A435 PolarHBondContact O-N 3.12Å; A432-A435 PolarHBondContact O-N 2.8Å; A435-A437 VanDerWaalsContact C-N 3.33Å; A435-A437 PolarHBondContact O-N 2.99Å; A435-A438 PolarHBondContact O-N 2.68Å; A435-E439 WeakPolarHBondContact O-CB 3.46Å; A435-E439 PolarHBondContact O-N 3Å
436	T	73.2	Confident	68.3	Low	91 Å²	91	91.6 Å²	91.6	56%	0.558	51%	0.514	S	S	*	.	H	α-helix	trans	-64.2	-35.9	175.4	54.7	0	0	0	0	113	A432 A433 A440	A432-T436 WeakPolarHBondContact O-CG2 3.17Å; A432-T436 PolarHBondContact O-N 2.88Å; A432-T436 PolarHBondContact O-OG1 3.11Å; A433-T436 WeakPolarHBondContact CA-OG1 3.44Å; A433-T436 PolarHBondContact O-N 2.94Å; A433-T436 PolarHBondContact O-OG1 3.35Å; T436-A440 WeakPolarHBondContact O-CB 3.14Å; T436-A440 PolarHBondContact O-N 2.84Å
437	A	72.9	Confident	66.7	Low	47 Å²	47	91.2 Å²	91.2	39%	0.388	51%	0.514	S	S	.	.	H	α-helix	trans	-70.3	-41.4	174.9	0	0	0	0	0	111.6	A433 A434 A435 E439 A440 E441	A433-A437 WeakPolarHBondContact O-CB 3.47Å; A433-A437 PolarHBondContact O-N 3.04Å; A434-A437 PolarHBondContact O-N 2.79Å; A435-A437 VanDerWaalsContact C-N 3.33Å; A435-A437 PolarHBondContact O-N 2.99Å; A437-E439 VanDerWaalsContact C-N 3.32Å; A437-E439 PolarHBondContact O-N 3.2Å; A437-A440 CarbonylContact O-C 3.42Å; A437-A440 WeakPolarHBondContact O-CB 3.22Å; A437-A440 PolarHBondContact O-N 3.43Å; A437-E441 WeakPolarHBondContact O-CB 3.48Å; A437-E441 WeakPolarHBondContact O-CG 3.12Å; A437-E441 PolarHBondContact O-N 2.64Å
438	A	70	Confident	64.9	Low	43 Å²	43	95.1 Å²	95.1	36%	0.355	52%	0.524	S	S	.	.	H	α-helix	trans	-68.4	-31.7	175.4	0	0	0	0	0	111.9	A434 A435 R442	A434-A438 WeakPolarHBondContact O-CB 3.36Å; A434-A438 PolarHBondContact O-N 3.39Å; A435-A438 PolarHBondContact O-N 2.68Å; A438-R442 VanDerWaalsContact O-CB 3.24Å; A438-R442 WeakPolarHBondContact O-CB 3.11Å; A438-R442 VanDerWaalsContact O-CG 3.28Å; A438-R442 WeakPolarHBondContact O-CG 3.27Å; A438-R442 PolarHBondContact O-N 3.19Å
439	E	68.7	Low	63.3	Low	125 Å²	125	95.5 Å²	95.5	58%	0.584	53%	0.527	S	S	*	.	H	α-helix	trans	-69.8	-39.6	171.9	-132.2	153	-159.3	0	0	110.8	A435 A437 R442 Q443	A435-E439 WeakPolarHBondContact O-CB 3.46Å; A435-E439 PolarHBondContact O-N 3Å; A437-E439 VanDerWaalsContact C-N 3.32Å; A437-E439 PolarHBondContact O-N 3.2Å; E439-R442 PolarHBondContact O-N 3.48Å; E439-Q443 WeakPolarHBondContact O-CB 3.12Å; E439-Q443 VanDerWaalsContact O-CG 3.28Å; E439-Q443 WeakPolarHBondContact O-CG 3.41Å; E439-Q443 PolarHBondContact O-N 2.69Å
440	A	69	Low	61.5	Low	47 Å²	47	91.6 Å²	91.6	39%	0.388	52%	0.516	S	S	.	.	H	α-helix	trans	-66.3	-40.7	171.8	0	0	0	0	0	112.5	T436 A437 Q443 Q444	T436-A440 WeakPolarHBondContact O-CB 3.14Å; T436-A440 PolarHBondContact O-N 2.84Å; A437-A440 CarbonylContact O-C 3.42Å; A437-A440 WeakPolarHBondContact O-CB 3.22Å; A437-A440 PolarHBondContact O-N 3.43Å; A440-Q443 PolarHBondContact O-N 3.23Å; A440-Q444 WeakPolarHBondContact O-CG 3.16Å; A440-Q444 PolarHBondContact O-N 2.81Å
441	E	65.9	Low	59.6	Low	116 Å²	116	90.5 Å²	90.5	54%	0.542	52%	0.518	S	S	.	.	H	α-helix	trans	-69.1	-36.7	175.1	-76.2	-177.3	175.3	0	0	111.8	A437 Q444 Q445	A437-E441 WeakPolarHBondContact O-CB 3.48Å; A437-E441 WeakPolarHBondContact O-CG 3.12Å; A437-E441 PolarHBondContact O-N 2.64Å; E441-Q444 CarbonylContact O-C 3.56Å; E441-Q444 PolarHBondContact O-N 2.78Å; E441-Q445 WeakPolarHBondContact O-CB 3.16Å; E441-Q445 WeakPolarHBondContact O-CG 3.36Å; E441-Q445 PolarHBondContact O-N 3.03Å
442	R	57.5	Low	58.1	Low	183 Å²	183	93.7 Å²	93.7	69%	0.691	53%	0.525	S	S	*	.	H	α-helix	trans	-66.5	-38.8	172.1	-82.6	-177.4	175.3	-174.5	0.6	111.7	A438 E439 Q445 Q446	A438-R442 VanDerWaalsContact O-CB 3.24Å; A438-R442 WeakPolarHBondContact O-CB 3.11Å; A438-R442 VanDerWaalsContact O-CG 3.28Å; A438-R442 WeakPolarHBondContact O-CG 3.27Å; A438-R442 PolarHBondContact O-N 3.19Å; E439-R442 PolarHBondContact O-N 3.48Å; R442-Q445 PolarHBondContact O-N 3.11Å; R442-Q446 WeakPolarHBondContact O-CB 3.41Å; R442-Q446 WeakPolarHBondContact O-CG 3.49Å; R442-Q446 PolarHBondContact O-N 2.66Å
443	Q	55	Low	56.7	Low	116 Å²	116	100.7 Å²	100.7	54%	0.542	54%	0.539	S	S	.	.	H	α-helix	trans	-64.2	-40.7	171.5	-74.1	177.7	14.8	0	0	111.1	E439 A440 Q447	E439-Q443 WeakPolarHBondContact O-CB 3.12Å; E439-Q443 VanDerWaalsContact O-CG 3.28Å; E439-Q443 WeakPolarHBondContact O-CG 3.41Å; E439-Q443 PolarHBondContact O-N 2.69Å; A440-Q443 PolarHBondContact O-N 3.23Å; Q443-Q447 WeakPolarHBondContact O-CB 3.47Å; Q443-Q447 WeakPolarHBondContact O-CG 3.08Å; Q443-Q447 PolarHBondContact O-N 3.04Å
444	Q	49.5	Very low	55.5	Low	115 Å²	115	98.3 Å²	98.3	54%	0.537	52%	0.518	S	S	.	.	H	α-helix	trans	-69.4	-36.8	175	-77.8	-175.1	0.4	0	0	113.7	A440 E441 Q447 Q448	A440-Q444 WeakPolarHBondContact O-CG 3.16Å; A440-Q444 PolarHBondContact O-N 2.81Å; E441-Q444 CarbonylContact O-C 3.56Å; E441-Q444 PolarHBondContact O-N 2.78Å; Q444-Q447 CarbonylContact O-C 3.57Å; Q444-Q447 WeakPolarHBondContact O-CB 3.35Å; Q444-Q447 PolarHBondContact O-N 3.24Å; Q444-Q448 WeakPolarHBondContact O-CB 3.32Å; Q444-Q448 WeakPolarHBondContact O-CG 3.47Å; Q444-Q448 PolarHBondContact O-N 2.87Å
445	Q	48.3	Very low	54.7	Low	127 Å²	127	97.7 Å²	97.7	59%	0.593	51%	0.51	S	S	*	.	H	α-helix	trans	-72.6	-34.5	176	-77.9	-178.5	9.8	0	0	111.8	E441 R442 Q447 Q448 A449	E441-Q445 WeakPolarHBondContact O-CB 3.16Å; E441-Q445 WeakPolarHBondContact O-CG 3.36Å; E441-Q445 PolarHBondContact O-N 3.03Å; R442-Q445 PolarHBondContact O-N 3.11Å; Q445-Q447 VanDerWaalsContact C-N 3.33Å; Q445-Q448 PolarHBondContact O-N 2.93Å; Q445-A449 WeakPolarHBondContact O-CB 3.4Å; Q445-A449 PolarHBondContact O-N 3.49Å
446	Q	47	Very low	53.9	Low	148 Å²	148	95.2 Å²	95.2	69%	0.692	49%	0.489	S	S	*	.	H	α-helix	trans	-66.2	-36.2	167.8	-78.7	-178.5	-11.2	0	0	111.6	R442 S450	R442-Q446 WeakPolarHBondContact O-CB 3.41Å; R442-Q446 WeakPolarHBondContact O-CG 3.49Å; R442-Q446 PolarHBondContact O-N 2.66Å; Q446-S450 PolarHBondContact O-N 2.9Å; Q446-S450 PolarHBondContact O-OG 2.8Å
447	Q	43.8	Very low	53	Low	114 Å²	114	91.3 Å²	91.3	53%	0.533	46%	0.464	S	S	.	.	H	α-helix	trans	-66.8	-39.5	171.5	-74.2	168.9	10.4	0	0	112.3	Q443 Q444 Q445 S450	Q443-Q447 WeakPolarHBondContact O-CB 3.47Å; Q443-Q447 WeakPolarHBondContact O-CG 3.08Å; Q443-Q447 PolarHBondContact O-N 3.04Å; Q444-Q447 CarbonylContact O-C 3.57Å; Q444-Q447 WeakPolarHBondContact O-CB 3.35Å; Q444-Q447 PolarHBondContact O-N 3.24Å; Q445-Q447 VanDerWaalsContact C-N 3.33Å; Q447-S450 WeakPolarHBondContact CA-OG 3.39Å; Q447-S450 PolarHBondContact O-N 3.16Å; Q447-S450 PolarHBondContact O-OG 3.01Å
448	Q	40.1	Very low	52.1	Low	130 Å²	130	91.9 Å²	91.9	61%	0.607	47%	0.469	S	S	*	.	H	α-helix	trans	-72.5	-38.5	177.4	-78.8	179.7	-3.7	0	0	112.5	Q444 Q445 S450 T451	Q444-Q448 WeakPolarHBondContact O-CB 3.32Å; Q444-Q448 WeakPolarHBondContact O-CG 3.47Å; Q444-Q448 PolarHBondContact O-N 2.87Å; Q445-Q448 PolarHBondContact O-N 2.93Å; Q448-S450 PolarHBondContact O-N 2.85Å; Q448-T451 WeakPolarHBondContact O-CB 3.48Å; Q448-T451 PolarHBondContact O-N 2.65Å; Q448-T451 PolarHBondContact O-OG1 3.04Å
449	A	43	Very low	51.4	Low	70 Å²	70	94.6 Å²	94.6	58%	0.579	47%	0.47	S	S	*	.	H	α-helix	trans	-63	-26.9	172.7	0	0	0	0	0	112.2	Q445 T451	Q445-A449 WeakPolarHBondContact O-CB 3.4Å; Q445-A449 PolarHBondContact O-N 3.49Å; A449-T451 PolarHBondContact O-N 3.09Å
450	S	41.3	Very low	50.7	Low	49 Å²	49	91 Å²	91	34%	0.343	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-6.6	172.6	66.5	0	0	0	0	114.4	Q446 Q447 Q448 I452 M467	Q446-S450 PolarHBondContact O-N 2.9Å; Q446-S450 PolarHBondContact O-OG 2.8Å; Q447-S450 WeakPolarHBondContact CA-OG 3.39Å; Q447-S450 PolarHBondContact O-N 3.16Å; Q447-S450 PolarHBondContact O-OG 3.01Å; Q448-S450 PolarHBondContact O-N 2.85Å; S450-I452 PolarHBondContact O-N 3.28Å; S450-M467 VanDerWaalsContact CB-CE 3.45Å; S450-M467 WeakPolarHBondContact O-CE 3.48Å; S450-M467 WeakPolarHBondContact OG-CE 3.2Å; S450-M467 PolarHBondContact OG-SD 2.86Å; S450-M467 VanDerWaalsContact OG-SD 3.37Å
451	T	36.6	Very low	49.7	Very low	95 Å²	95	89.4 Å²	89.4	58%	0.583	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	9	172.5	61.7	0	0	0	0	114.5	Q448 A449 R453 M467	Q448-T451 WeakPolarHBondContact O-CB 3.48Å; Q448-T451 PolarHBondContact O-N 2.65Å; Q448-T451 PolarHBondContact O-OG1 3.04Å; A449-T451 PolarHBondContact O-N 3.09Å; T451-R453 PolarHBondContact O-N 3.26Å; T451-M467 HydrophobicContact CG2-CE 4.17Å
452	I	43.1	Very low	48.8	Very low	126 Å²	126	85.4 Å²	85.4	65%	0.646	42%	0.421	S	S	*	.	S	Bend	trans	-60.3	91	155.3	-60.8	172.1	0	0	0	106.4	S450 H454	S450-I452 PolarHBondContact O-N 3.28Å; I452-H454 PolarHBondContact O-N 2.77Å
453	R	45.5	Very low	48.3	Very low	204 Å²	204	80.7 Å²	80.7	77%	0.77	41%	0.409	S	S	*	.			trans	-49.8	110.9	177.9	-75.1	-173.6	-178	179.1	0.9	107.9	T451	T451-R453 PolarHBondContact O-N 3.26Å
454	H	48.8	Very low	48	Very low	6 Å²	6	76.4 Å²	76.4	3%	0.028	39%	0.392	C	S	.	.			trans	-52.4	124.7	174.2	-178	-32.2	0	0	0	109	W152 I452 I456 Y457 A458	W152-H454 AromaticContact CE2-CD2 3.71Å; W152-H454 AromaticContact CE2-NE2 3.84Å; W152-H454 AromaticContact CH2-CD2 3.52Å; W152-H454 AromaticContact CZ2-CD2 2.95Å; W152-H454 WeakPolarHBondContact CZ2-CD2 3.48Å; W152-H454 AromaticContact CZ2-CG 3.89Å; W152-H454 AromaticContact CZ2-NE2 3.26Å; W152-H454 VanDerWaalsContact CZ2-NE2 3.26Å; W152-H454 WeakPolarHBondContact CZ2-NE2 3.44Å; W152-H454 AromaticContact NE1-NE2 3.95Å; I452-H454 PolarHBondContact O-N 2.77Å; H454-I456 VanDerWaalsContact C-N 3.29Å; H454-I456 WeakPolarHBondContact CE1-CB 3.29Å; H454-I456 WeakPolarHBondContact CE1-CG1 3.5Å; H454-I456 WeakPolarHBondContact ND1-CB 3.36Å; H454-I456 PolarHBondContact ND1-N 3.12Å; H454-I456 PolarHBondContact O-N 3.42Å; H454-Y457 HydrophobicContact CB-CD2 3.34Å; H454-Y457 HydrophobicContact CB-CE2 4.25Å; H454-Y457 HydrophobicContact CB-CG 3.97Å; H454-Y457 AromaticContact CD2-CD2 2.98Å; H454-Y457 WeakPolarHBondContact CD2-CD2 3.23Å; H454-Y457 AromaticContact CD2-CE2 3.02Å; H454-Y457 WeakPolarHBondContact CD2-CE2 3.49Å; H454-Y457 AromaticContact CD2-CG 3.91Å; H454-Y457 AromaticContact CG-CD2 3.2Å; H454-Y457 AromaticContact CG-CE2 3.78Å; H454-Y457 AromaticContact CG-CG 3.83Å; H454-Y457 PolarHBondContact ND1-N 3.06Å; H454-Y457 AromaticContact NE2-CD2 3.88Å; H454-Y457 AromaticContact NE2-CE2 3.67Å; H454-Y457 PolarHBondContact O-N 3.13Å; H454-Y457 VanDerWaalsContact O-N 3.16Å; H454-A458 WeakPolarHBondContact O-CB 3.34Å; H454-A458 PolarHBondContact O-N 2.97Å
455	P	55.6	Low	48	Very low	45 Å²	45	74.5 Å²	74.5	29%	0.292	39%	0.389	S	S	.	.	H	α-helix	trans	-60.8	-38.2	-174.7	17.9	-29	0	0	0	112.3	Y164 R459	Y164-P455 HydrophobicContact CD1-CG 4.35Å; Y164-P455 HydrophobicContact CD2-CB 4.15Å; Y164-P455 HydrophobicContact CD2-CG 4.29Å; Y164-P455 HydrophobicContact CE1-CG 4.04Å; Y164-P455 HydrophobicContact CE2-CB 4.01Å; Y164-P455 HydrophobicContact CE2-CG 3.99Å; Y164-P455 HydrophobicContact CG-CG 4.45Å; P455-R459 WeakPolarHBondContact O-CB 3.5Å; P455-R459 PolarHBondContact O-N 2.91Å
456	I	56.4	Low	47.9	Very low	2 Å²	2	74.4 Å²	74.4	1%	0.01	39%	0.393	C	S	.	.	H	α-helix	trans	-66.2	-50.4	172.3	-47.9	-179.7	0	0	0	112.3	F58 L165 H454 A458 R459 Y460	F58-I456 HydrophobicContact CD1-CG2 3.64Å; F58-I456 HydrophobicContact CE1-CG2 3.66Å; F58-I456 HydrophobicContact CG-CG2 4.14Å; F58-I456 HydrophobicContact CZ-CG2 4.2Å; L165-I456 WeakPolarHBondContact O-CD1 3.49Å; H454-I456 VanDerWaalsContact C-N 3.29Å; H454-I456 WeakPolarHBondContact CE1-CB 3.29Å; H454-I456 WeakPolarHBondContact CE1-CG1 3.5Å; H454-I456 WeakPolarHBondContact ND1-CB 3.36Å; H454-I456 PolarHBondContact ND1-N 3.12Å; H454-I456 PolarHBondContact O-N 3.42Å; I456-A458 VanDerWaalsContact C-N 3.27Å; I456-A458 PolarHBondContact O-N 3.43Å; I456-R459 WeakPolarHBondContact O-CB 3.25Å; I456-R459 PolarHBondContact O-N 3.33Å; I456-R459 VanDerWaalsContact O-N 3.09Å; I456-Y460 HydrophobicContact CG2-CD2 3.68Å; I456-Y460 HydrophobicContact CG2-CE2 3.79Å; I456-Y460 WeakPolarHBondContact O-CD2 3.25Å; I456-Y460 PolarHBondContact O-N 3.03Å
457	Y	54.9	Low	47.5	Very low	9 Å²	9	69.7 Å²	69.7	4%	0.035	37%	0.371	C	S	.	.	H	α-helix	trans	-62.2	-36.8	177.9	-64.7	-55.2	0	0	0	111.6	F58 H454 R459 Y460 G461 M462 P464 P465	F58-Y457 HydrophobicContact CB-CE1 4.2Å; F58-Y457 HydrophobicContact CD2-CE1 4.25Å; H454-Y457 HydrophobicContact CB-CD2 3.34Å; H454-Y457 HydrophobicContact CB-CE2 4.25Å; H454-Y457 HydrophobicContact CB-CG 3.97Å; H454-Y457 AromaticContact CD2-CD2 2.98Å; H454-Y457 WeakPolarHBondContact CD2-CD2 3.23Å; H454-Y457 AromaticContact CD2-CE2 3.02Å; H454-Y457 WeakPolarHBondContact CD2-CE2 3.49Å; H454-Y457 AromaticContact CD2-CG 3.91Å; H454-Y457 AromaticContact CG-CD2 3.2Å; H454-Y457 AromaticContact CG-CE2 3.78Å; H454-Y457 AromaticContact CG-CG 3.83Å; H454-Y457 PolarHBondContact ND1-N 3.06Å; H454-Y457 AromaticContact NE2-CD2 3.88Å; H454-Y457 AromaticContact NE2-CE2 3.67Å; H454-Y457 PolarHBondContact O-N 3.13Å; H454-Y457 VanDerWaalsContact O-N 3.16Å; Y457-R459 PolarHBondContact O-N 3.42Å; Y457-Y460 CarbonylContact O-C 3.56Å; Y457-Y460 PolarHBondContact O-N 3.06Å; Y457-G461 CarbonylContact O-C 2.84Å; Y457-G461 WeakPolarHBondContact O-CA 3.12Å; Y457-G461 PolarHBondContact O-N 3.02Å; Y457-M462 WeakPolarHBondContact CB-O 3.29Å; Y457-M462 HydrophobicContact CD1-CB 3.58Å; Y457-M462 HydrophobicContact CD1-CE 3.79Å; Y457-M462 HydrophobicContact CE1-CB 4.41Å; Y457-M462 HydrophobicContact CE1-CE 4.21Å; Y457-M462 HydrophobicContact CG-CB 4.27Å; Y457-M462 PolarHBondContact O-N 2.98Å; Y457-P464 HydrophobicContact CD2-CB 3.67Å; Y457-P464 HydrophobicContact CD2-CG 4.05Å; Y457-P464 HydrophobicContact CE2-CB 3.44Å; Y457-P464 VanDerWaalsContact CE2-CB 3.44Å; Y457-P464 HydrophobicContact CE2-CG 4.32Å; Y457-P465 VanDerWaalsContact OH-CD 3.3Å; Y457-P465 WeakPolarHBondContact OH-CD 3.24Å
458	A	54.2	Low	47	Very low	60 Å²	60	68.7 Å²	68.7	50%	0.496	39%	0.391	S	S	.	.	H	α-helix	trans	-62.1	-41	172.5	0	0	0	0	0	112.6	H454 I456 Y460 G461	H454-A458 WeakPolarHBondContact O-CB 3.34Å; H454-A458 PolarHBondContact O-N 2.97Å; I456-A458 VanDerWaalsContact C-N 3.27Å; I456-A458 PolarHBondContact O-N 3.43Å; A458-Y460 VanDerWaalsContact C-N 3.31Å; A458-Y460 PolarHBondContact O-N 3.26Å; A458-G461 PolarHBondContact O-N 2.88Å
459	R	55.6	Low	46.5	Very low	100 Å²	100	65.1 Å²	65.1	38%	0.377	39%	0.389	S	S	.	.	H	α-helix	trans	-63	-35.7	177.1	-176.4	-177	-69.6	170.9	-4.3	112.7	Y164 P455 I456 Y457	Y164-R459 PolarHBondContact O-NH1 2.73Å; P455-R459 WeakPolarHBondContact O-CB 3.5Å; P455-R459 PolarHBondContact O-N 2.91Å; I456-R459 WeakPolarHBondContact O-CB 3.25Å; I456-R459 PolarHBondContact O-N 3.33Å; I456-R459 VanDerWaalsContact O-N 3.09Å; Y457-R459 PolarHBondContact O-N 3.42Å
460	Y	53	Low	46.1	Very low	48 Å²	48	66.6 Å²	66.6	19%	0.188	40%	0.402	C	S	.	.	H	α-helix	trans	-99.9	3.7	180	-70.7	-73	0	0	0	113.7	F58 D166 F185 I456 Y457 A458 M462	F58-Y460 HydrophobicContact CE1-CD2 4.4Å; F58-Y460 AromaticContact CE1-CE2 3.99Å; F58-Y460 HydrophobicContact CE1-CE2 3.99Å; F58-Y460 HydrophobicContact CE2-CD2 4.34Å; F58-Y460 AromaticContact CZ-CD2 3.83Å; F58-Y460 HydrophobicContact CZ-CD2 3.83Å; F58-Y460 AromaticContact CZ-CE2 3.66Å; F58-Y460 HydrophobicContact CZ-CE2 3.66Å; D166-Y460 PolarHBondContact OD2-OH 2.87Å; F185-Y460 HydrophobicContact CD2-CE1 4.31Å; F185-Y460 HydrophobicContact CE2-CE1 4.25Å; I456-Y460 HydrophobicContact CG2-CD2 3.68Å; I456-Y460 HydrophobicContact CG2-CE2 3.79Å; I456-Y460 WeakPolarHBondContact O-CD2 3.25Å; I456-Y460 PolarHBondContact O-N 3.03Å; Y457-Y460 CarbonylContact O-C 3.56Å; Y457-Y460 PolarHBondContact O-N 3.06Å; A458-Y460 VanDerWaalsContact C-N 3.31Å; A458-Y460 PolarHBondContact O-N 3.26Å; Y460-M462 VanDerWaalsContact C-N 3.29Å; Y460-M462 HydrophobicContact CD2-CE 4.17Å; Y460-M462 HydrophobicContact CG-CE 3.98Å; Y460-M462 PolarHBondContact O-N 3.05Å
461	G	49.7	Very low	45.5	Very low	15 Å²	15	71.8 Å²	71.8	16%	0.155	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.3	22.5	-177.4	0	0	0	0	0	114.9	Y457 A458 F474 A475	Y457-G461 CarbonylContact O-C 2.84Å; Y457-G461 WeakPolarHBondContact O-CA 3.12Å; Y457-G461 PolarHBondContact O-N 3.02Å; A458-G461 PolarHBondContact O-N 2.88Å; G461-F474 CarbonylContact O-C 3.5Å; G461-F474 VanDerWaalsContact O-CA 3.22Å; G461-F474 WeakPolarHBondContact O-CA 3.27Å; G461-A475 PolarHBondContact O-N 2.76Å
462	M	45.7	Very low	45.3	Very low	31 Å²	31	70 Å²	70	15%	0.153	42%	0.419	C	S	.	.			trans	-97	169.9	-177	-67	-176.1	-65.7	0	0	112.3	L20 F58 Y457 Y460	L20-M462 HydrophobicContact CB-SD 4.25Å; L20-M462 HydrophobicContact CD1-CG 4.02Å; L20-M462 HydrophobicContact CD1-SD 3.85Å; F58-M462 HydrophobicContact CD2-CE 3.51Å; F58-M462 HydrophobicContact CE2-CE 3.17Å; F58-M462 HydrophobicContact CE2-SD 4.34Å; F58-M462 HydrophobicContact CZ-CE 4.14Å; Y457-M462 WeakPolarHBondContact CB-O 3.29Å; Y457-M462 HydrophobicContact CD1-CB 3.58Å; Y457-M462 HydrophobicContact CD1-CE 3.79Å; Y457-M462 HydrophobicContact CE1-CB 4.41Å; Y457-M462 HydrophobicContact CE1-CE 4.21Å; Y457-M462 HydrophobicContact CG-CB 4.27Å; Y457-M462 PolarHBondContact O-N 2.98Å; Y460-M462 VanDerWaalsContact C-N 3.29Å; Y460-M462 HydrophobicContact CD2-CE 4.17Å; Y460-M462 HydrophobicContact CG-CE 3.98Å; Y460-M462 PolarHBondContact O-N 3.05Å
463	I	48.1	Very low	44.6	Very low	85 Å²	85	66.3 Å²	66.3	44%	0.436	41%	0.407	S	S	.	.			trans	-117.2	136.1	173.4	-61.3	172.7	0	0	0	107.5	M467	I463-M467 HydrophobicContact CG2-CB 3.62Å; I463-M467 HydrophobicContact CG2-CG 4.23Å
464	P	48.8	Very low	43.9	Very low	26 Å²	26	64 Å²	64	17%	0.169	40%	0.403	C	S	.	.			trans	-57.8	142.1	177.1	15.4	-24.8	0	0	0	112.1	Y457 N466 M467	Y457-P464 HydrophobicContact CD2-CB 3.67Å; Y457-P464 HydrophobicContact CD2-CG 4.05Å; Y457-P464 HydrophobicContact CE2-CB 3.44Å; Y457-P464 VanDerWaalsContact CE2-CB 3.44Å; Y457-P464 HydrophobicContact CE2-CG 4.32Å; P464-N466 PolarHBondContact O-N 3.48Å; P464-N466 VanDerWaalsContact O-N 3.12Å; P464-M467 HydrophobicContact CG-CB 4.4Å; P464-M467 HydrophobicContact CG-CG 3.73Å; P464-M467 WeakPolarHBondContact O-CB 3.34Å; P464-M467 PolarHBondContact O-N 3.39Å
465	P	48.1	Very low	42.9	Very low	74 Å²	74	66.1 Å²	66.1	48%	0.481	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-22.9	-177.1	22.3	-32.1	0	0	0	114	Y457 M467	Y457-P465 VanDerWaalsContact OH-CD 3.3Å; Y457-P465 WeakPolarHBondContact OH-CD 3.24Å; P465-M467 VanDerWaalsContact C-N 3.27Å; P465-M467 PolarHBondContact O-N 3Å
466	N	46.3	Very low	41.5	Very low	126 Å²	126	69 Å²	69	67%	0.674	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-4.4	175.9	-73.7	-0.4	0	0	0	114	P464 G468	P464-N466 PolarHBondContact O-N 3.48Å; P464-N466 VanDerWaalsContact O-N 3.12Å; N466-G468 PolarHBondContact O-N 2.83Å
467	M	38.6	Very low	40.2	Very low	48 Å²	48	75 Å²	75	24%	0.236	48%	0.477	C	S	.	.	S	Bend	trans	-90.2	98	168.7	-74.6	-83.5	-163.3	0	0	108.1	S450 T451 I463 P464 P465 G469	S450-M467 VanDerWaalsContact CB-CE 3.45Å; S450-M467 WeakPolarHBondContact O-CE 3.48Å; S450-M467 WeakPolarHBondContact OG-CE 3.2Å; S450-M467 PolarHBondContact OG-SD 2.86Å; S450-M467 VanDerWaalsContact OG-SD 3.37Å; T451-M467 HydrophobicContact CG2-CE 4.17Å; I463-M467 HydrophobicContact CG2-CB 3.62Å; I463-M467 HydrophobicContact CG2-CG 4.23Å; P464-M467 HydrophobicContact CG-CB 4.4Å; P464-M467 HydrophobicContact CG-CG 3.73Å; P464-M467 WeakPolarHBondContact O-CB 3.34Å; P464-M467 PolarHBondContact O-N 3.39Å; P465-M467 VanDerWaalsContact C-N 3.27Å; P465-M467 PolarHBondContact O-N 3Å; M467-G469 PolarHBondContact O-N 2.94Å
468	G	32.8	Very low	38.7	Very low	93 Å²	93	84.9 Å²	84.9	96%	0.959	52%	0.516	S	S	*	.			trans	-65.2	65.9	-178.6	0	0	0	0	0	115.2	N466	N466-G468 PolarHBondContact O-N 2.83Å
469	G	30.3	Very low	37.4	Very low	55 Å²	55	90 Å²	90	57%	0.567	53%	0.53	S	S	*	.			trans	-116.2	125.4	164.9	0	0	0	0	0	109.2	M467 F471	M467-G469 PolarHBondContact O-N 2.94Å; G469-F471 PolarHBondContact O-N 2.74Å
470	A	35.2	Very low	35.9	Very low	102 Å²	102	90.5 Å²	90.5	84%	0.843	54%	0.544	S	S	*	.	S	Bend	trans	-65.1	31.2	-175.3	0	0	0	0	0	115.9
471	F	27.7	Very low	34.4	Very low	158 Å²	158	96.4 Å²	96.4	69%	0.693	58%	0.575	S	S	*	*			trans	-140.3	96.9	176.4	-76.3	-87.6	0	0	0	108.9	G469 A473	G469-F471 PolarHBondContact O-N 2.74Å; F471-A473 HydrophobicContact CB-CB 4Å; F471-A473 HydrophobicContact CD1-CB 4.18Å; F471-A473 PolarHBondContact O-N 2.78Å
472	G	32.2	Very low	33.3	Very low	57 Å²	57	101.5 Å²	101.5	59%	0.588	60%	0.604	S	S	*	*			trans	-68.2	39.9	155.2	0	0	0	0	0	111.6
473	A	29.7	Very low	32.4	Very low	49 Å²	49	106.4 Å²	106.4	41%	0.405	64%	0.635	S	S	.	*			trans	-96.6	131	-177	0	0	0	0	0	109	F471 A475	F471-A473 HydrophobicContact CB-CB 4Å; F471-A473 HydrophobicContact CD1-CB 4.18Å; F471-A473 PolarHBondContact O-N 2.78Å; A473-A475 PolarHBondContact O-N 3.49Å
474	F	29.9	Very low	31.2	Very low	154 Å²	154	108.4 Å²	108.4	68%	0.675	65%	0.647	S	S	*	*			trans	-33.3	118.9	169.6	-64.9	-91.2	0	0	0	111.7	G461 P476	G461-F474 CarbonylContact O-C 3.5Å; G461-F474 VanDerWaalsContact O-CA 3.22Å; G461-F474 WeakPolarHBondContact O-CA 3.27Å; F474-P476 VanDerWaalsContact O-CD 3.29Å; F474-P476 WeakPolarHBondContact O-CD 3.48Å
475	A	28.2	Very low	30.2	Very low	52 Å²	52	114.7 Å²	114.7	43%	0.43	68%	0.676	S	S	.	*			trans	-61.9	117.4	165.9	0	0	0	0	0	107.1	G461 A473 T477	G461-A475 PolarHBondContact O-N 2.76Å; A473-A475 PolarHBondContact O-N 3.49Å; A475-T477 PolarHBondContact O-N 2.84Å; A475-T477 VanDerWaalsContact O-N 3.11Å
476	P	26.5	Very low	29.1	Very low	105 Å²	105	117.7 Å²	117.7	68%	0.682	69%	0.688	S	S	*	*			trans	-58.8	123.6	178.5	21.6	-29.8	0	0	0	108.8	F474 Y478	F474-P476 VanDerWaalsContact O-CD 3.29Å; F474-P476 WeakPolarHBondContact O-CD 3.48Å; P476-Y478 PolarHBondContact O-N 3.44Å; P476-Y478 VanDerWaalsContact O-N 3.13Å
477	T	27.9	Very low	28.3	Very low	127 Å²	127	118.5 Å²	118.5	78%	0.779	69%	0.691	S	S	*	*			trans	-55.4	114.2	173.9	37.6	0	0	0	0	109.3	A475 Q479	A475-T477 PolarHBondContact O-N 2.84Å; A475-T477 VanDerWaalsContact O-N 3.11Å; T477-Q479 PolarHBondContact O-N 3.15Å
478	Y	24.9	Very low	27.9	Very low	217 Å²	217	121.6 Å²	121.6	85%	0.851	71%	0.714	S	S	*	*			trans	-71	82.1	163.9	-69.9	-85.4	0	0	0	108.6	P476	P476-Y478 PolarHBondContact O-N 3.44Å; P476-Y478 VanDerWaalsContact O-N 3.13Å
479	Q	25.8	Very low	27.6	Very low	168 Å²	168	122.3 Å²	122.3	79%	0.785	70%	0.704	S	S	*	*			trans	-97.5	102.8	154.1	-88.1	-175.3	-16	0	0	108.2	T477	T477-Q479 PolarHBondContact O-N 3.15Å
480	T	24	Very low	27.6	Very low	111 Å²	111	127.1 Å²	127.1	68%	0.681	72%	0.717	S	S	*	*			trans	58.2	116.4	137.3	51.8	0	0	0	0	119.6
481	M	22.4	Very low	27.1	Very low	171 Å²	171	128.1 Å²	128.1	84%	0.842	71%	0.712	S	S	*	*				55.4	129.5	128.2	-61.2	-172.6	-175.3	0	0	116.9
482	T	25.4	Very low	27.2	Very low	123 Å²	123	126.6 Å²	126.6	76%	0.755	72%	0.716	S	S	*	*			cis	-178.4	120.9	17.6	19	0	0	0	0	102.8
483	V	26.8	Very low	26.9	Very low	134 Å²	134	134.5 Å²	134.5	81%	0.812	73%	0.728	S	S	*	*			trans	-132.7	94.3	155.6	-174.9	0	0	0	0	107.6	M485	V483-M485 HydrophobicContact CG1-CG 4.27Å; V483-M485 PolarHBondContact O-N 3.49Å
484	N	22.8	Very low	26.7	Very low	127 Å²	127	140.1 Å²	140.1	68%	0.679	75%	0.746	S	S	*	*			trans	-54	108.2	161.7	-176.6	12	0	0	0	108.9	N486	N484-N486 PolarHBondContact OD1-N 2.83Å
485	M	29.3	Very low	26.7	Very low	157 Å²	157	141 Å²	141	77%	0.773	76%	0.758	S	S	*	*			trans	-116.1	76.8	160.3	-80	-74	-138	0	0	107.6	V483 I487	V483-M485 HydrophobicContact CG1-CG 4.27Å; V483-M485 PolarHBondContact O-N 3.49Å; M485-I487 PolarHBondContact O-N 3.17Å
486	N	23.6	Very low	26.6	Very low	137 Å²	137	147.2 Å²	147.2	73%	0.733	78%	0.778	S	S	*	*			trans	-49.6	112	146.3	-90	-17.5	0	0	0	108.8	N484	N484-N486 PolarHBondContact OD1-N 2.83Å
487	I	30.8	Very low	26.5	Very low	144 Å²	144	145.5 Å²	145.5	74%	0.738	78%	0.779	S	S	*	*			trans	-135.3	129.5	148.3	-63.4	-175.2	0	0	0	108.3	M485	M485-I487 PolarHBondContact O-N 3.17Å
488	P	30.8	Very low	26.8	Very low	113 Å²	113	149.2 Å²	149.2	73%	0.734	79%	0.785	S	S	*	*			trans	-98.4	167.3	-159.3	38.5	-31.8	0	0	0	113.9
489	S	26.6	Very low	26.9	Very low	107 Å²	107	147.2 Å²	147.2	75%	0.748	79%	0.789	S	S	*	*			trans	-9.9	124.6	155.9	-50.3	0	0	0	0	118.5
490	N	29.1	Very low	27	Very low	157 Å²	157	142.3 Å²	142.3	84%	0.84	78%	0.783	S	S	*	*			trans	-158.1	98.7	140.3	-105	-23.9	0	0	0	105.6
491	V	25.8	Very low	27.2	Very low	122 Å²	122	143 Å²	143	74%	0.739	79%	0.79	S	S	*	*				25.4	108.2	84.9	-170	0	0	0	0	112.5
492	V	28.8	Very low	27.7	Very low	126 Å²	126	147.5 Å²	147.5	76%	0.764	81%	0.812	S	S	*	*				-166.7	113.6	125.7	165.5	0	0	0	0	110.1
493	R	26.6	Very low	27.9	Very low	223 Å²	223	148.8 Å²	148.8	84%	0.842	82%	0.815	S	S	*	*			trans	51.3	115.5	140.9	-66.7	-179.3	171.3	174.7	-3	122.1
494	Q	24.6	Very low	27.9	Very low	168 Å²	168	149.5 Å²	149.5	79%	0.785	82%	0.815	S	S	*	*				13.8	117.3	115.9	-75.7	176	-28.3	0	0	116.8
495	N	30.7	Very low	28.2	Very low	173 Å²	173	150.8 Å²	150.8	93%	0.925	82%	0.822	S	S	*	*			trans	-122.6	95.8	141.8	-98.5	-22.1	0	0	0	107.9
496	Q	25.6	Very low	28.1	Very low	182 Å²	182	150.4 Å²	150.4	85%	0.85	83%	0.825	S	S	*	*			trans	-92.8	135.4	152.4	-82.6	-177.7	-20.3	0	0	107.2
497	G	25.3	Very low	28.4	Very low	68 Å²	68	151.3 Å²	151.3	70%	0.701	83%	0.831	S	S	*	*			trans	130.3	102.6	162.6	0	0	0	0	0	113.2
498	F	33.8	Very low	28.3	Very low	206 Å²	206	151.7 Å²	151.7	90%	0.904	84%	0.837	S	S	*	*				-165.2	94.2	119.1	-117.1	-86.5	0	0	0	108.6
499	N	27.4	Very low	28.1	Very low	174 Å²	174	154.5 Å²	154.5	93%	0.93	85%	0.845	S	S	*	*			trans	-77.1	126.9	147.1	-96.4	-14.4	0	0	0	106.3
500	G	26.1	Very low	28.2	Very low	65 Å²	65	158.2 Å²	158.2	67%	0.67	85%	0.852	S	S	*	*			trans	-138.1	127.1	169.2	0	0	0	0	0	109.1
501	P	28.8	Very low	28.1	Very low	126 Å²	126	158.3 Å²	158.3	82%	0.818	85%	0.853	S	S	*	*			trans	-93.4	149.2	-178.6	36.1	-30.9	0	0	0	111.9
502	M	34	Very low	28.3	Very low	266 Å²	266	161.5 Å²	161.5	100%	1.31	86%	0.864	S	S	*	*			trans	-173.8	0	144.8	-93.6	-84.2	177.8	0	0	108

Retrieved 502 of 502 residues in 453.1 ms (Link to these results)

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