A0A024RCP3_HUMAN Loading...

Tripartite motif-containing protein 26

AlphaFold DB (Q12899), UniProt , Accession A0A024RCP3, Species HUMAN (Homo sapiens, Human), Gene n/a, Length 539 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	45.7	Very low	69.1	Low	218 Å²	218	90.9 Å²	90.9	100%	1.074	53%	0.527	S	S	*	.				0	-27	0	-67.4	-61.3	-176.6	0	0	113.7	S4	M1-S4 PolarHBondContact O-OG 3.4Å
2	A	47	Very low	70.5	Confident	92 Å²	92	95.5 Å²	95.5	76%	0.76	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-20	-177.5	0	0	0	0	0	116	S4	A2-S4 PolarHBondContact O-N 2.9Å
3	T	53.1	Low	71.9	Confident	92 Å²	92	99.2 Å²	99.2	56%	0.564	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-4.9	-175	54.2	0	0	0	0	114.9
4	S	60.9	Low	73.2	Confident	61 Å²	61	92.1 Å²	92.1	43%	0.427	51%	0.511	S	S	.	.	H	α-helix	trans	-83.6	-25.6	-175.8	56.9	0	0	0	0	113.6	M1 A2 R8	M1-S4 PolarHBondContact O-OG 3.4Å; A2-S4 PolarHBondContact O-N 2.9Å; S4-R8 WeakPolarHBondContact O-CG 3.23Å; S4-R8 PolarHBondContact O-N 2.67Å
5	A	70.8	Confident	74.5	Confident	69 Å²	69	89.3 Å²	89.3	57%	0.57	50%	0.497	S	S	*	.	H	α-helix	trans	-72.2	-45.6	-178.3	0	0	0	0	0	113.5	L7 R8 S9	A5-L7 PolarHBondContact O-N 3Å; A5-R8 PolarHBondContact O-N 2.92Å; A5-S9 PolarHBondContact O-N 2.85Å; A5-S9 VanDerWaalsContact O-N 3.13Å
6	P	74.9	Confident	75.7	Confident	87 Å²	87	83.8 Å²	83.8	57%	0.565	47%	0.466	S	S	*	.	H	α-helix	trans	-66	-38.1	179.5	-20.2	32.7	0	0	0	112.8	S9 L10	P6-S9 PolarHBondContact O-N 2.54Å; P6-L10 PolarHBondContact O-N 3.42Å; P6-L10 VanDerWaalsContact O-N 3.07Å
7	L	77.6	Confident	76.7	Confident	41 Å²	41	81.7 Å²	81.7	22%	0.215	46%	0.459	C	S	.	.	H	α-helix	trans	-64.8	-44	176.9	-78.1	171.2	0	0	0	111.4	A5 S9 L10 E11 L81	A5-L7 PolarHBondContact O-N 3Å; L7-S9 PolarHBondContact O-N 3.31Å; L7-L10 PolarHBondContact O-N 3.34Å; L7-E11 WeakPolarHBondContact O-CG 3.42Å; L7-E11 PolarHBondContact O-N 3.39Å; L7-L81 HydrophobicContact CD2-CD1 4.2Å
8	R	79.2	Confident	77.5	Confident	171 Å²	171	80.6 Å²	80.6	65%	0.645	45%	0.451	S	S	*	.	H	α-helix	trans	-60.4	-43.1	176.2	-77.8	-178.4	176.1	-179.1	-1.5	112.8	S4 A5 L10 E11 E12	S4-R8 WeakPolarHBondContact O-CG 3.23Å; S4-R8 PolarHBondContact O-N 2.67Å; A5-R8 PolarHBondContact O-N 2.92Å; R8-L10 VanDerWaalsContact C-N 3.29Å; R8-L10 PolarHBondContact O-N 3.45Å; R8-E11 WeakPolarHBondContact O-CB 3.37Å; R8-E11 PolarHBondContact O-N 3.15Å; R8-E12 WeakPolarHBondContact O-CG 3.36Å; R8-E12 PolarHBondContact O-N 3.02Å; R8-E12 VanDerWaalsContact O-N 3.07Å
9	S	80.9	Confident	78.3	Confident	66 Å²	66	79.6 Å²	79.6	46%	0.462	45%	0.449	S	S	.	.	H	α-helix	trans	-59.8	-40.7	175.6	-171.1	0	0	0	0	111.9	A5 P6 L7 E13	A5-S9 PolarHBondContact O-N 2.85Å; A5-S9 VanDerWaalsContact O-N 3.13Å; P6-S9 PolarHBondContact O-N 2.54Å; L7-S9 PolarHBondContact O-N 3.31Å; S9-E13 PolarHBondContact O-N 3.45Å
10	L	83.9	Confident	79	Confident	59 Å²	59	82.5 Å²	82.5	31%	0.309	46%	0.462	S	S	.	.	H	α-helix	trans	-72.4	-35.2	178.1	-169.5	69.2	0	0	0	112.1	P6 L7 R8 E12 E13 V14 I78	P6-L10 PolarHBondContact O-N 3.42Å; P6-L10 VanDerWaalsContact O-N 3.07Å; L7-L10 PolarHBondContact O-N 3.34Å; R8-L10 VanDerWaalsContact C-N 3.29Å; R8-L10 PolarHBondContact O-N 3.45Å; L10-E12 VanDerWaalsContact C-N 3.3Å; L10-E12 PolarHBondContact O-N 2.94Å; L10-E13 PolarHBondContact O-N 3.18Å; L10-V14 WeakPolarHBondContact O-CG2 3.13Å; L10-V14 PolarHBondContact O-N 3.38Å; L10-I78 HydrophobicContact CD2-CD1 3.78Å; L10-I78 HydrophobicContact CD2-CG1 3.85Å; L10-I78 HydrophobicContact CG-CD1 3.74Å; L10-I78 HydrophobicContact CG-CG1 4.35Å
11	E	86.3	Confident	79.6	Confident	44 Å²	44	82.7 Å²	82.7	21%	0.206	46%	0.463	C	S	.	.	H	α-helix	trans	-61	-39.9	174.6	-72.2	177.1	-158.9	0	0	111.6	L7 R8 E13 V14 T15 Y22 I78 K82	L7-E11 WeakPolarHBondContact O-CG 3.42Å; L7-E11 PolarHBondContact O-N 3.39Å; R8-E11 WeakPolarHBondContact O-CB 3.37Å; R8-E11 PolarHBondContact O-N 3.15Å; E11-E13 VanDerWaalsContact C-N 3.35Å; E11-E13 PolarHBondContact O-N 3.27Å; E11-V14 WeakPolarHBondContact O-CG2 3.39Å; E11-V14 PolarHBondContact O-N 3.17Å; E11-T15 PolarHBondContact O-N 3.09Å; E11-T15 PolarHBondContact O-OG1 3.2Å; E11-Y22 HydrophobicContact CB-CE1 4.2Å; E11-Y22 VanDerWaalsContact CD-OH 3.28Å; E11-Y22 HydrophobicContact CG-CE1 4.12Å; E11-Y22 WeakPolarHBondContact CG-OH 3.28Å; E11-Y22 PolarHBondContact OE2-OH 3.35Å; E11-I78 HydrophobicContact CG-CG2 3.9Å; E11-K82 WeakPolarHBondContact OE1-CE 3.49Å; E11-K82 IonicContact OE1-NZ 2.79Å; E11-K82 PolarHBondContact OE1-NZ 2.82Å; E11-K82 VanDerWaalsContact OE1-NZ 3.11Å; E11-K82 IonicContact OE2-NZ 2.78Å; E11-K82 PolarHBondContact OE2-NZ 2.94Å
12	E	86.1	Confident	81.8	Confident	146 Å²	146	73.7 Å²	73.7	68%	0.682	42%	0.417	S	S	*	.	H	α-helix	trans	-63.5	-38.6	175.9	-71.9	171.7	-167.1	0	0	112	R8 L10 V14 T15	R8-E12 WeakPolarHBondContact O-CG 3.36Å; R8-E12 PolarHBondContact O-N 3.02Å; R8-E12 VanDerWaalsContact O-N 3.07Å; L10-E12 VanDerWaalsContact C-N 3.3Å; L10-E12 PolarHBondContact O-N 2.94Å; E12-V14 VanDerWaalsContact C-N 3.3Å; E12-V14 PolarHBondContact O-N 3.37Å; E12-T15 PolarHBondContact O-N 3.04Å
13	E	87.7	Confident	83.9	Confident	143 Å²	143	69.6 Å²	69.6	67%	0.668	38%	0.382	S	S	*	.	H	α-helix	trans	-68.4	-26.3	178.4	-71.2	-164.6	-167	0	0	114	S9 L10 E11	S9-E13 PolarHBondContact O-N 3.45Å; L10-E13 PolarHBondContact O-N 3.18Å; E11-E13 VanDerWaalsContact C-N 3.35Å; E11-E13 PolarHBondContact O-N 3.27Å
14	V	90.7	Very high	85.7	Confident	1 Å²	1	71.2 Å²	71.2	1%	0.006	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	12.6	178	-60.8	0	0	0	0	113.6	L10 E11 E12 Y22 L23 L71 L74 V75 I78	L10-V14 WeakPolarHBondContact O-CG2 3.13Å; L10-V14 PolarHBondContact O-N 3.38Å; E11-V14 WeakPolarHBondContact O-CG2 3.39Å; E11-V14 PolarHBondContact O-N 3.17Å; E12-V14 VanDerWaalsContact C-N 3.3Å; E12-V14 PolarHBondContact O-N 3.37Å; V14-Y22 HydrophobicContact CB-CD1 4.5Å; V14-Y22 HydrophobicContact CG2-CD1 3.53Å; V14-Y22 HydrophobicContact CG2-CE1 3.61Å; V14-Y22 WeakPolarHBondContact O-CA 3.39Å; V14-L23 WeakPolarHBondContact O-CG 3.34Å; V14-L23 PolarHBondContact O-N 2.92Å; V14-L71 HydrophobicContact CG1-CD2 4.32Å; V14-L74 HydrophobicContact CG1-CB 4.09Å; V14-V75 HydrophobicContact CB-CG2 3.74Å; V14-V75 HydrophobicContact CG1-CG2 4.29Å; V14-V75 HydrophobicContact CG2-CG2 4.16Å; V14-I78 HydrophobicContact CB-CD1 4.35Å; V14-I78 HydrophobicContact CG1-CD1 4.04Å; V14-I78 HydrophobicContact CG2-CD1 3.43Å; V14-I78 VanDerWaalsContact CG2-CD1 3.43Å
15	T	92.3	Very high	87.2	Confident	50 Å²	50	72.7 Å²	72.7	31%	0.307	38%	0.381	S	S	.	.	B	Isolated β-bridge	trans	-94	129.9	177.2	-63.7	0	0	0	0	110.5	E11 E12 S17	E11-T15 PolarHBondContact O-N 3.09Å; E11-T15 PolarHBondContact O-OG1 3.2Å; E12-T15 PolarHBondContact O-N 3.04Å; T15-S17 PolarHBondContact O-N 2.88Å
16	C	94.3	Very high	88.3	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	36%	0.355	C	S	.	.			trans	-72	122.6	174.2	-175.9	0	0	0	0	110.4	I18 C19 L20 D21 L23 C36	C16-I18 PolarHBondContact O-N 2.51Å; C16-C19 VanDerWaalsContact CB-SG 3.55Å; C16-L20 WeakPolarHBondContact O-CA 3.5Å; C16-L20 PolarHBondContact O-N 3.45Å; C16-D21 PolarHBondContact N-O 3.29Å; C16-L23 HydrophobicContact CB-CD2 3.77Å; C16-L23 HydrophobicContact CB-CG 4.44Å; C16-C36 WeakPolarHBondContact CB-SG 3.41Å; C16-C36 PolarHBondContact SG-N 2.91Å; C16-C36 VanDerWaalsContact SG-N 3.42Å
17	S	92.9	Very high	89.2	Confident	49 Å²	49	65.5 Å²	65.5	34%	0.343	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	3.4	179.1	79.9	0	0	0	0	114.8	T15 F35 L55	T15-S17 PolarHBondContact O-N 2.88Å; S17-F35 VanDerWaalsContact OG-CE1 3.28Å; S17-F35 WeakPolarHBondContact OG-CE1 3.36Å; S17-L55 WeakPolarHBondContact OG-CD2 3.36Å; S17-L55 WeakPolarHBondContact OG-CG 3.41Å
18	I	91.4	Very high	90.1	Very high	62 Å²	62	65.2 Å²	65.2	32%	0.318	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-55.4	175.8	-61.9	167.9	0	0	0	110.2	C16 F35 C39 V43 P54	C16-I18 PolarHBondContact O-N 2.51Å; I18-F35 HydrophobicContact CD1-CB 4Å; I18-F35 HydrophobicContact CD1-CD1 3.35Å; I18-F35 HydrophobicContact CD1-CE1 3.9Å; I18-F35 HydrophobicContact CD1-CG 3.72Å; I18-F35 HydrophobicContact CG1-CD1 3.59Å; I18-F35 HydrophobicContact CG1-CE1 3.95Å; I18-F35 HydrophobicContact CG1-CG 4.43Å; I18-C39 HydrophobicContact CB-CB 3.75Å; I18-C39 HydrophobicContact CD1-CB 3.66Å; I18-C39 HydrophobicContact CG1-CB 4.3Å; I18-C39 HydrophobicContact CG2-CB 3.73Å; I18-V43 HydrophobicContact CD1-CG2 4.42Å; I18-P54 HydrophobicContact CD1-CG 3.86Å; I18-P54 HydrophobicContact CG1-CB 4.39Å; I18-P54 HydrophobicContact CG1-CG 4.08Å
19	C	92.8	Very high	90.7	Very high	61 Å²	61	57.3 Å²	57.3	41%	0.412	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-9.1	178.8	67.1	0	0	0	0	114.1	C16 D21	C16-C19 VanDerWaalsContact CB-SG 3.55Å; C19-D21 PolarHBondContact O-N 2.95Å
20	L	92.1	Very high	91.3	Very high	137 Å²	137	57.8 Å²	57.8	72%	0.717	30%	0.297	S	S	*	.	S	Bend	trans	57.8	28.4	-178.6	-50.5	178.5	0	0	0	113.5	C16	C16-L20 WeakPolarHBondContact O-CA 3.5Å; C16-L20 PolarHBondContact O-N 3.45Å
21	D	91.4	Very high	91.8	Very high	88 Å²	88	56.6 Å²	56.6	47%	0.471	29%	0.293	S	S	.	.	S	Bend	trans	-125.4	168.7	177.6	-162.4	-1.4	0	0	0	109	C16 C19	C16-D21 PolarHBondContact N-O 3.29Å; C19-D21 PolarHBondContact O-N 2.95Å
22	Y	91	Very high	92.1	Very high	28 Å²	28	56.9 Å²	56.9	11%	0.11	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-53.1	142.2	174.6	-72.4	-54.3	0	0	0	112	E11 V14 R24 V75 I78 K82	E11-Y22 HydrophobicContact CB-CE1 4.2Å; E11-Y22 VanDerWaalsContact CD-OH 3.28Å; E11-Y22 HydrophobicContact CG-CE1 4.12Å; E11-Y22 WeakPolarHBondContact CG-OH 3.28Å; E11-Y22 PolarHBondContact OE2-OH 3.35Å; V14-Y22 HydrophobicContact CB-CD1 4.5Å; V14-Y22 HydrophobicContact CG2-CD1 3.53Å; V14-Y22 HydrophobicContact CG2-CE1 3.61Å; V14-Y22 WeakPolarHBondContact O-CA 3.39Å; Y22-R24 PolarHBondContact O-N 3.21Å; Y22-V75 HydrophobicContact CG-CG1 4.16Å; Y22-I78 HydrophobicContact CE1-CG2 4.22Å; Y22-I78 WeakPolarHBondContact OH-CG2 3.46Å; Y22-K82 WeakPolarHBondContact OH-CE 3.17Å; Y22-K82 PolarHBondContact OH-NZ 3.48Å
23	L	92	Very high	92.5	Very high	6 Å²	6	53 Å²	53	3%	0.031	29%	0.289	C	S	.	.			trans	-58	107	179.7	-73.9	164.8	0	0	0	111.3	V14 C16 P26 V34 F35 L71 V75	V14-L23 WeakPolarHBondContact O-CG 3.34Å; V14-L23 PolarHBondContact O-N 2.92Å; C16-L23 HydrophobicContact CB-CD2 3.77Å; C16-L23 HydrophobicContact CB-CG 4.44Å; L23-P26 HydrophobicContact CB-CB 4Å; L23-P26 HydrophobicContact CB-CG 4.44Å; L23-P26 HydrophobicContact CD1-CB 4.24Å; L23-P26 HydrophobicContact CD2-CB 4.46Å; L23-P26 HydrophobicContact CG-CB 4.48Å; L23-V34 HydrophobicContact CD1-CG1 4.01Å; L23-V34 HydrophobicContact CD2-CG1 4.13Å; L23-F35 VanDerWaalsContact CD2-C 3.46Å; L23-L71 HydrophobicContact CD1-CB 4.43Å; L23-L71 HydrophobicContact CD1-CD1 4.16Å; L23-V75 HydrophobicContact CB-CG2 4.23Å
24	R	91.4	Very high	92.9	Very high	127 Å²	127	48 Å²	48	48%	0.479	27%	0.268	S	S	.	.	S	Bend	trans	-93.1	118.3	169.8	-63.3	-65.8	-177.4	-159.4	-9.7	108.8	Y22 C36 E79	Y22-R24 PolarHBondContact O-N 3.21Å; R24-C36 PolarHBondContact N-SG 3.42Å; R24-C36 VanDerWaalsContact O-CA 3.27Å; R24-C36 WeakPolarHBondContact O-CA 3.23Å; R24-C36 VanDerWaalsContact O-CB 3.22Å; R24-C36 WeakPolarHBondContact O-CB 3.42Å; R24-E79 IonicContact CZ-OE1 3.97Å; R24-E79 IonicContact NH1-OE1 2.77Å; R24-E79 PolarHBondContact NH1-OE1 2.88Å; R24-E79 VanDerWaalsContact NH1-OE1 3.12Å; R24-E79 IonicContact NH1-OE2 3.99Å; R24-E79 IonicContact NH2-OE1 3.96Å; R24-E79 PolarHBondContact NH2-OE1 2.78Å
25	D	91.4	Very high	93.1	Very high	91 Å²	91	48 Å²	48	49%	0.487	27%	0.268	S	S	.	.	S	Bend	trans	52.6	64.6	-174.2	-168.2	16.3	0	0	0	111.5	V27 R37	D25-V27 PolarHBondContact O-N 3.36Å; D25-R37 HydrophobicContact CB-CB 4.03Å; D25-R37 WeakPolarHBondContact O-CB 3.34Å; D25-R37 PolarHBondContact O-N 3.18Å; D25-R37 WeakPolarHBondContact OD2-CB 3.29Å; D25-R37 WeakPolarHBondContact OD2-CD 3.43Å
26	P	93.9	Very high	93.2	Very high	3 Å²	3	45.8 Å²	45.8	2%	0.019	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	127	-176	18.7	-28.9	0	0	0	111.7	L23 V34 F35 V68 L71 A72	L23-P26 HydrophobicContact CB-CB 4Å; L23-P26 HydrophobicContact CB-CG 4.44Å; L23-P26 HydrophobicContact CD1-CB 4.24Å; L23-P26 HydrophobicContact CD2-CB 4.46Å; L23-P26 HydrophobicContact CG-CB 4.48Å; P26-V34 HydrophobicContact CB-CG1 3.8Å; P26-F35 WeakPolarHBondContact CA-O 3.38Å; P26-V68 WeakPolarHBondContact CG-O 3.38Å; P26-V68 PolarHBondContact O-N 2.97Å; P26-L71 HydrophobicContact CB-CB 4.03Å; P26-L71 HydrophobicContact CG-CB 3.93Å; P26-A72 HydrophobicContact CG-CB 3.85Å
27	V	94.6	Very high	93.1	Very high	2 Å²	2	52.5 Å²	52.5	1%	0.012	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	141.2	174.7	-63.7	0	0	0	0	110.8	D25 V34 F35 R37 T40 I65 R66	D25-V27 PolarHBondContact O-N 3.36Å; V27-V34 WeakPolarHBondContact O-CA 3.49Å; V27-V34 WeakPolarHBondContact O-CG1 3.48Å; V27-F35 WeakPolarHBondContact CG2-O 3.39Å; V27-F35 PolarHBondContact N-O 3.06Å; V27-F35 PolarHBondContact O-N 2.94Å; V27-R37 HydrophobicContact CG1-CB 3.96Å; V27-R37 HydrophobicContact CG1-CG 4.06Å; V27-R37 HydrophobicContact CG2-CB 4.36Å; V27-T40 HydrophobicContact CG2-CG2 3.55Å; V27-I65 HydrophobicContact CB-CG2 3.49Å; V27-I65 VanDerWaalsContact CB-CG2 3.49Å; V27-I65 HydrophobicContact CG1-CG2 3.81Å; V27-I65 HydrophobicContact CG2-CG2 3.6Å; V27-R66 CarbonylContact C-O 3.48Å; V27-R66 WeakPolarHBondContact CA-O 3.46Å
28	T	95.2	Very high	93.1	Very high	35 Å²	35	53.5 Å²	53.5	22%	0.215	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	147.3	169.6	-174.5	0	0	0	0	110.3	I65 R66 V68	T28-I65 WeakPolarHBondContact O-CA 3.37Å; T28-R66 HydrophobicContact CG2-CB 3.94Å; T28-R66 PolarHBondContact N-O 2.94Å; T28-R66 PolarHBondContact O-N 3.46Å; T28-R66 VanDerWaalsContact O-N 3.1Å; T28-V68 HydrophobicContact CG2-CG2 3.82Å
29	I	93.2	Very high	93.2	Very high	6 Å²	6	51 Å²	51	3%	0.031	28%	0.275	C	S	.	.			trans	-109.7	177.7	171.6	61.8	168.4	0	0	0	110.8	C31 G32 H33 F35 T40 C53 F60 I65	I29-C31 VanDerWaalsContact CD1-SG 3.57Å; I29-C31 PolarHBondContact O-N 3.45Å; I29-G32 PolarHBondContact O-N 2.84Å; I29-H33 PolarHBondContact N-O 2.93Å; I29-F35 HydrophobicContact CD1-CD2 4.38Å; I29-F35 HydrophobicContact CD1-CE2 3.69Å; I29-F35 HydrophobicContact CG1-CE2 4.1Å; I29-T40 HydrophobicContact CG2-CG2 4.02Å; I29-C53 HydrophobicContact CD1-CB 3.59Å; I29-F60 HydrophobicContact CB-CB 4.19Å; I29-F60 HydrophobicContact CB-CD2 3.97Å; I29-F60 HydrophobicContact CB-CE2 4.49Å; I29-F60 HydrophobicContact CB-CG 3.99Å; I29-F60 HydrophobicContact CD1-CB 4.45Å; I29-F60 HydrophobicContact CD1-CD1 3.71Å; I29-F60 HydrophobicContact CD1-CE1 4.02Å; I29-F60 HydrophobicContact CD1-CG 4.02Å; I29-F60 HydrophobicContact CG2-CD2 3.83Å; I29-F60 HydrophobicContact CG2-CE2 3.88Å; I29-F60 HydrophobicContact CG2-CG 4.27Å; I29-F60 HydrophobicContact CG2-CZ 4.35Å; I29-I65 HydrophobicContact CG2-CG1 4.3Å
30	D	93.2	Very high	93.1	Very high	76 Å²	76	48.2 Å²	48.2	41%	0.406	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-29.4	-174.2	-74.4	-36	0	0	0	115.5	F60 K61 N64	D30-F60 HydrophobicContact CB-CB 3.82Å; D30-F60 WeakPolarHBondContact OD2-CA 3.29Å; D30-F60 WeakPolarHBondContact OD2-CB 3.43Å; D30-K61 PolarHBondContact OD2-N 3.35Å; D30-N64 WeakPolarHBondContact OD1-CB 3.35Å; D30-N64 VanDerWaalsContact OD1-CG 3.27Å; D30-N64 PolarHBondContact OD1-ND2 3.29Å; D30-N64 PolarHBondContact OD2-ND2 3.48Å
31	C	94.1	Very high	92.8	Very high	34 Å²	34	45.4 Å²	45.4	23%	0.23	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-0.2	-179.8	66.1	0	0	0	0	114.6	I29 H33 C53 C56 K58	I29-C31 VanDerWaalsContact CD1-SG 3.57Å; I29-C31 PolarHBondContact O-N 3.45Å; C31-H33 VanDerWaalsContact C-N 3.35Å; C31-H33 PolarHBondContact SG-ND1 3.41Å; C31-C53 VanDerWaalsContact SG-CB 3.57Å; C31-C53 PolarHBondContact SG-SG 2.7Å; C31-C56 VanDerWaalsContact CB-SG 3.58Å; C31-K58 HydrophobicContact CB-CB 4.11Å; C31-K58 HydrophobicContact CB-CD 3.96Å
32	G	93.1	Very high	92.4	Very high	49 Å²	49	47.1 Å²	47.1	51%	0.505	25%	0.253	S	S	.	.	S	Bend	trans	85.6	-7.6	-179.6	0	0	0	0	0	115.8	I29	I29-G32 PolarHBondContact O-N 2.84Å
33	H	94.7	Very high	92	Very high	66 Å²	66	47 Å²	47	31%	0.306	26%	0.256	S	S	.	.			trans	-70.6	142.2	174.3	-68	97.1	0	0	0	111	I29 C31 F35 L55	I29-H33 PolarHBondContact N-O 2.93Å; C31-H33 VanDerWaalsContact C-N 3.35Å; C31-H33 PolarHBondContact SG-ND1 3.41Å; H33-F35 HydrophobicContact CB-CE2 3.6Å; H33-F35 HydrophobicContact CB-CZ 3.72Å; H33-L55 HydrophobicContact CB-CD1 4.14Å; H33-L55 WeakPolarHBondContact CD2-CD1 3.46Å
34	V	94.5	Very high	91	Very high	38 Å²	38	57.3 Å²	57.3	23%	0.23	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	135.9	-175.9	-172.9	0	0	0	0	110.8	L23 P26 V27 L71	L23-V34 HydrophobicContact CD1-CG1 4.01Å; L23-V34 HydrophobicContact CD2-CG1 4.13Å; P26-V34 HydrophobicContact CB-CG1 3.8Å; V27-V34 WeakPolarHBondContact O-CA 3.49Å; V27-V34 WeakPolarHBondContact O-CG1 3.48Å; V34-L71 HydrophobicContact CB-CD1 4.09Å; V34-L71 HydrophobicContact CG1-CD1 3.67Å; V34-L71 HydrophobicContact CG2-CD1 3.88Å
35	F	94.8	Very high	89.9	Confident	1 Å²	1	53.8 Å²	53.8	0%	0.004	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	170	177.1	-50	-86.2	0	0	0	110.7	S17 I18 L23 P26 V27 I29 H33 T40 P54 L55	S17-F35 VanDerWaalsContact OG-CE1 3.28Å; S17-F35 WeakPolarHBondContact OG-CE1 3.36Å; I18-F35 HydrophobicContact CD1-CB 4Å; I18-F35 HydrophobicContact CD1-CD1 3.35Å; I18-F35 HydrophobicContact CD1-CE1 3.9Å; I18-F35 HydrophobicContact CD1-CG 3.72Å; I18-F35 HydrophobicContact CG1-CD1 3.59Å; I18-F35 HydrophobicContact CG1-CE1 3.95Å; I18-F35 HydrophobicContact CG1-CG 4.43Å; L23-F35 VanDerWaalsContact CD2-C 3.46Å; P26-F35 WeakPolarHBondContact CA-O 3.38Å; V27-F35 WeakPolarHBondContact CG2-O 3.39Å; V27-F35 PolarHBondContact N-O 3.06Å; V27-F35 PolarHBondContact O-N 2.94Å; I29-F35 HydrophobicContact CD1-CD2 4.38Å; I29-F35 HydrophobicContact CD1-CE2 3.69Å; I29-F35 HydrophobicContact CG1-CE2 4.1Å; H33-F35 HydrophobicContact CB-CE2 3.6Å; H33-F35 HydrophobicContact CB-CZ 3.72Å; F35-T40 HydrophobicContact CB-CG2 3.73Å; F35-T40 HydrophobicContact CD2-CG2 4.04Å; F35-T40 HydrophobicContact CG-CG2 4.27Å; F35-P54 HydrophobicContact CE1-CG 4.49Å; F35-P54 HydrophobicContact CZ-CG 4.49Å; F35-L55 HydrophobicContact CE1-CD1 3.9Å; F35-L55 HydrophobicContact CE1-CG 4.05Å; F35-L55 HydrophobicContact CZ-CD1 3.88Å; F35-L55 HydrophobicContact CZ-CG 4.04Å
36	C	94.3	Very high	88.5	Confident	2 Å²	2	56.6 Å²	56.6	1%	0.014	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	144.1	167.2	-55.5	0	0	0	0	110.2	C16 R24 S38 C39 T40	C16-C36 WeakPolarHBondContact CB-SG 3.41Å; C16-C36 PolarHBondContact SG-N 2.91Å; C16-C36 VanDerWaalsContact SG-N 3.42Å; R24-C36 PolarHBondContact N-SG 3.42Å; R24-C36 VanDerWaalsContact O-CA 3.27Å; R24-C36 WeakPolarHBondContact O-CA 3.23Å; R24-C36 VanDerWaalsContact O-CB 3.22Å; R24-C36 WeakPolarHBondContact O-CB 3.42Å; C36-S38 VanDerWaalsContact C-N 3.29Å; C36-S38 PolarHBondContact O-N 2.96Å; C36-C39 HydrophobicContact CB-CB 4.01Å; C36-C39 WeakPolarHBondContact O-CB 3.39Å; C36-C39 PolarHBondContact O-N 2.98Å; C36-T40 PolarHBondContact O-N 3.01Å
37	R	93.6	Very high	86.8	Confident	141 Å²	141	62.1 Å²	62.1	53%	0.532	34%	0.34	S	S	.	.	H	α-helix	trans	-56.5	-42.1	177.4	-167.4	166.5	-155.2	-104.5	4.4	112.9	D25 V27 T40 T41	D25-R37 HydrophobicContact CB-CB 4.03Å; D25-R37 WeakPolarHBondContact O-CB 3.34Å; D25-R37 PolarHBondContact O-N 3.18Å; D25-R37 WeakPolarHBondContact OD2-CB 3.29Å; D25-R37 WeakPolarHBondContact OD2-CD 3.43Å; V27-R37 HydrophobicContact CG1-CB 3.96Å; V27-R37 HydrophobicContact CG1-CG 4.06Å; V27-R37 HydrophobicContact CG2-CB 4.36Å; R37-T40 PolarHBondContact O-N 2.85Å; R37-T40 PolarHBondContact O-OG1 3.34Å; R37-T41 PolarHBondContact O-N 3.24Å; R37-T41 PolarHBondContact O-OG1 3.44Å
38	S	92.9	Very high	85.5	Confident	71 Å²	71	66.2 Å²	66.2	50%	0.497	38%	0.383	S	S	.	.	H	α-helix	trans	-57.5	-49.9	172.7	50.2	0	0	0	0	111.4	C36 T40 T41 D42	C36-S38 VanDerWaalsContact C-N 3.29Å; C36-S38 PolarHBondContact O-N 2.96Å; S38-T40 VanDerWaalsContact C-N 3.34Å; S38-T40 PolarHBondContact O-N 3.37Å; S38-T41 WeakPolarHBondContact O-CA 3.46Å; S38-T41 VanDerWaalsContact O-CB 3.31Å; S38-T41 WeakPolarHBondContact O-CB 3.44Å; S38-T41 PolarHBondContact O-N 3.14Å; S38-D42 PolarHBondContact O-N 3.4Å; S38-D42 VanDerWaalsContact O-N 3.14Å
39	C	93.3	Very high	84.4	Confident	9 Å²	9	67.6 Å²	67.6	6%	0.061	39%	0.394	C	S	.	.	H	α-helix	trans	-61.5	-36.5	179.7	-64.1	0	0	0	0	113.5	I18 C36 T41 V43	I18-C39 HydrophobicContact CB-CB 3.75Å; I18-C39 HydrophobicContact CD1-CB 3.66Å; I18-C39 HydrophobicContact CG1-CB 4.3Å; I18-C39 HydrophobicContact CG2-CB 3.73Å; C36-C39 HydrophobicContact CB-CB 4.01Å; C36-C39 WeakPolarHBondContact O-CB 3.39Å; C36-C39 PolarHBondContact O-N 2.98Å; C39-T41 VanDerWaalsContact C-N 3.28Å; C39-T41 PolarHBondContact O-N 3.37Å; C39-V43 WeakPolarHBondContact O-CG2 3.5Å
40	T	89.8	Confident	83.8	Confident	3 Å²	3	74.6 Å²	74.6	2%	0.018	42%	0.42	C	S	.	.	H	α-helix	trans	-68.4	-27.1	173.1	61.4	0	0	0	0	113.4	V27 I29 F35 C36 R37 S38	V27-T40 HydrophobicContact CG2-CG2 3.55Å; I29-T40 HydrophobicContact CG2-CG2 4.02Å; F35-T40 HydrophobicContact CB-CG2 3.73Å; F35-T40 HydrophobicContact CD2-CG2 4.04Å; F35-T40 HydrophobicContact CG-CG2 4.27Å; C36-T40 PolarHBondContact O-N 3.01Å; R37-T40 PolarHBondContact O-N 2.85Å; R37-T40 PolarHBondContact O-OG1 3.34Å; S38-T40 VanDerWaalsContact C-N 3.34Å; S38-T40 PolarHBondContact O-N 3.37Å
41	T	86	Confident	83.5	Confident	78 Å²	78	71.6 Å²	71.6	48%	0.479	40%	0.404	S	S	.	.	H	α-helix	trans	-74.8	-34.7	179.7	-55.3	0	0	0	0	111.4	R37 S38 C39 V43	R37-T41 PolarHBondContact O-N 3.24Å; R37-T41 PolarHBondContact O-OG1 3.44Å; S38-T41 WeakPolarHBondContact O-CA 3.46Å; S38-T41 VanDerWaalsContact O-CB 3.31Å; S38-T41 WeakPolarHBondContact O-CB 3.44Å; S38-T41 PolarHBondContact O-N 3.14Å; C39-T41 VanDerWaalsContact C-N 3.28Å; C39-T41 PolarHBondContact O-N 3.37Å; T41-V43 VanDerWaalsContact C-N 3.27Å; T41-V43 PolarHBondContact O-N 3.49Å
42	D	83.6	Confident	83.4	Confident	123 Å²	123	73.2 Å²	73.2	66%	0.658	41%	0.413	S	S	*	.	S	Bend	trans	-76.4	-9.2	-179.6	-67.8	-28.8	0	0	0	114.1	S38 R44	S38-D42 PolarHBondContact O-N 3.4Å; S38-D42 VanDerWaalsContact O-N 3.14Å; D42-R44 VanDerWaalsContact C-N 3.32Å; D42-R44 PolarHBondContact O-N 3.12Å
43	V	81.9	Confident	83.4	Confident	26 Å²	26	70.9 Å²	70.9	16%	0.158	39%	0.389	C	S	.	.			trans	-69.4	88.4	172	-175.2	0	0	0	0	109.5	I18 C39 T41 P51 P54 F60	I18-V43 HydrophobicContact CD1-CG2 4.42Å; C39-V43 WeakPolarHBondContact O-CG2 3.5Å; T41-V43 VanDerWaalsContact C-N 3.27Å; T41-V43 PolarHBondContact O-N 3.49Å; V43-P51 HydrophobicContact CG1-CB 3.98Å; V43-P54 HydrophobicContact CG2-CG 4.12Å; V43-F60 HydrophobicContact CB-CZ 4.48Å; V43-F60 HydrophobicContact CG1-CE1 4.43Å
44	R	71.6	Confident	83.2	Confident	223 Å²	223	69.9 Å²	69.9	84%	0.842	39%	0.388	S	S	*	.			trans	-78.6	127.1	175.4	-73.5	-175.5	-178.2	176	1.7	110.8	D42	D42-R44 VanDerWaalsContact C-N 3.32Å; D42-R44 PolarHBondContact O-N 3.12Å
45	P	68	Low	83	Confident	52 Å²	52	72.3 Å²	72.3	34%	0.338	40%	0.399	S	S	.	.			trans	-69.4	138.1	168.6	27	-30.2	0	0	0	110.6	S47 S49	P45-S47 PolarHBondContact O-N 2.83Å; P45-S49 WeakPolarHBondContact CB-O 3.2Å; P45-S49 VanDerWaalsContact CG-O 3.3Å; P45-S49 WeakPolarHBondContact CG-O 3.38Å
46	I	61.2	Low	82.9	Confident	151 Å²	151	74.5 Å²	74.5	77%	0.774	41%	0.414	S	S	*	.	S	Bend	trans	-74.8	112.1	169.4	-56.6	169.6	0	0	0	105.9	S49	I46-S49 PolarHBondContact O-OG 3.34Å
47	S	59.9	Low	82.8	Confident	118 Å²	118	81.1 Å²	81.1	83%	0.825	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	71.3	171.7	-56.3	0	0	0	0	116.5	P45 S49	P45-S47 PolarHBondContact O-N 2.83Å; S47-S49 PolarHBondContact O-N 2.78Å
48	G	65.6	Low	82.7	Confident	89 Å²	89	80.6 Å²	80.6	92%	0.918	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.3	3	165.7	0	0	0	0	0	116.3
49	S	72.7	Confident	82.6	Confident	63 Å²	63	81 Å²	81	44%	0.441	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-77.8	165.5	176.4	55.7	0	0	0	0	112.3	P45 I46 S47	P45-S49 WeakPolarHBondContact CB-O 3.2Å; P45-S49 VanDerWaalsContact CG-O 3.3Å; P45-S49 WeakPolarHBondContact CG-O 3.38Å; I46-S49 PolarHBondContact O-OG 3.34Å; S47-S49 PolarHBondContact O-N 2.78Å
50	R	81.7	Confident	82.4	Confident	154 Å²	154	80.7 Å²	80.7	58%	0.581	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-69.6	141.8	170.6	-70.7	-176.9	-177.7	169.1	4.5	109.4	P59	R50-P59 HydrophobicContact CB-CB 4.11Å
51	P	86.6	Confident	82.4	Confident	13 Å²	13	84.5 Å²	84.5	8%	0.084	46%	0.459	C	S	.	.	P	Polyproline II helix	trans	-60.6	144.9	174	28.1	-34.2	0	0	0	110	V43 P59 F60	V43-P51 HydrophobicContact CG1-CB 3.98Å; P51-P59 CarbonylContact O-C 3.58Å; P51-P59 WeakPolarHBondContact O-CA 3.35Å; P51-F60 HydrophobicContact CB-CD1 4.37Å; P51-F60 HydrophobicContact CB-CE1 3.75Å; P51-F60 HydrophobicContact CB-CE2 4.31Å; P51-F60 HydrophobicContact CB-CZ 3.71Å; P51-F60 WeakPolarHBondContact CD-O 3.5Å; P51-F60 HydrophobicContact CG-CD1 4.38Å; P51-F60 HydrophobicContact CG-CD2 4.24Å; P51-F60 HydrophobicContact CG-CE1 4.09Å; P51-F60 HydrophobicContact CG-CE2 3.92Å; P51-F60 HydrophobicContact CG-CG 4.46Å; P51-F60 HydrophobicContact CG-CZ 3.85Å; P51-F60 WeakPolarHBondContact CG-O 3.3Å; P51-F60 VanDerWaalsContact O-CD1 3.29Å; P51-F60 WeakPolarHBondContact O-CD1 3.42Å; P51-F60 PolarHBondContact O-N 2.87Å
52	V	91.5	Very high	82.4	Confident	68 Å²	68	86.9 Å²	86.9	41%	0.412	46%	0.463	S	S	.	.	B	Isolated β-bridge	trans	-112	142.4	-178.1	-68.9	0	0	0	0	110.5	P54 P59	V52-P54 WeakPolarHBondContact O-CD 3.33Å; V52-P59 HydrophobicContact CG1-CB 4.41Å
53	C	92.9	Very high	82.6	Confident	0 Å²	0	88.4 Å²	88.4	0%	0	47%	0.466	C	S	.	.			trans	-57.5	127	175.4	174.8	0	0	0	0	110.6	I29 C31 L55 C56 K57 K58	I29-C53 HydrophobicContact CD1-CB 3.59Å; C31-C53 VanDerWaalsContact SG-CB 3.57Å; C31-C53 PolarHBondContact SG-SG 2.7Å; C53-L55 PolarHBondContact O-N 3.02Å; C53-L55 PolarHBondContact SG-N 3.41Å; C53-L55 VanDerWaalsContact SG-N 3.42Å; C53-C56 PolarHBondContact SG-N 3.5Å; C53-C56 VanDerWaalsContact SG-SG 3.7Å; C53-K57 WeakPolarHBondContact O-CA 3.4Å; C53-K57 PolarHBondContact O-N 3.26Å; C53-K58 PolarHBondContact N-O 3.39Å
54	P	89.9	Confident	83	Confident	44 Å²	44	89.8 Å²	89.8	29%	0.286	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-30.2	178.3	-29.7	39.2	0	0	0	114.4	I18 F35 V43 V52 K57	I18-P54 HydrophobicContact CD1-CG 3.86Å; I18-P54 HydrophobicContact CG1-CB 4.39Å; I18-P54 HydrophobicContact CG1-CG 4.08Å; F35-P54 HydrophobicContact CE1-CG 4.49Å; F35-P54 HydrophobicContact CZ-CG 4.49Å; V43-P54 HydrophobicContact CG2-CG 4.12Å; V52-P54 WeakPolarHBondContact O-CD 3.33Å; P54-K57 PolarHBondContact O-NZ 2.92Å
55	L	91.4	Very high	84	Confident	89 Å²	89	80.6 Å²	80.6	47%	0.466	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-57.5	-178.1	-68	173.5	0	0	0	112.6	S17 H33 F35 C53	S17-L55 WeakPolarHBondContact OG-CD2 3.36Å; S17-L55 WeakPolarHBondContact OG-CG 3.41Å; H33-L55 HydrophobicContact CB-CD1 4.14Å; H33-L55 WeakPolarHBondContact CD2-CD1 3.46Å; F35-L55 HydrophobicContact CE1-CD1 3.9Å; F35-L55 HydrophobicContact CE1-CG 4.05Å; F35-L55 HydrophobicContact CZ-CD1 3.88Å; F35-L55 HydrophobicContact CZ-CG 4.04Å; C53-L55 PolarHBondContact O-N 3.02Å; C53-L55 PolarHBondContact SG-N 3.41Å; C53-L55 VanDerWaalsContact SG-N 3.42Å
56	C	93.7	Very high	85.2	Confident	47 Å²	47	84.6 Å²	84.6	32%	0.318	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	2.2	-173.2	76.1	0	0	0	0	114.9	C31 C53 K58	C31-C56 VanDerWaalsContact CB-SG 3.58Å; C53-C56 PolarHBondContact SG-N 3.5Å; C53-C56 VanDerWaalsContact SG-SG 3.7Å; C56-K58 PolarHBondContact O-N 3.16Å
57	K	90.9	Very high	86.8	Confident	142 Å²	142	81.8 Å²	81.8	62%	0.617	44%	0.44	S	S	*	.			trans	59.6	9	179.3	-47.3	-54.3	-175.5	-165.9	0	116	C53 P54	C53-K57 WeakPolarHBondContact O-CA 3.4Å; C53-K57 PolarHBondContact O-N 3.26Å; P54-K57 PolarHBondContact O-NZ 2.92Å
58	K	91.5	Very high	88.2	Confident	130 Å²	130	77.6 Å²	77.6	57%	0.565	41%	0.409	S	S	*	.			trans	-70.3	135.1	175	-70	-179.9	-178.4	178.4	0	110.3	C31 C53 C56	C31-K58 HydrophobicContact CB-CB 4.11Å; C31-K58 HydrophobicContact CB-CD 3.96Å; C53-K58 PolarHBondContact N-O 3.39Å; C56-K58 PolarHBondContact O-N 3.16Å
59	P	90.3	Very high	89.3	Confident	78 Å²	78	82.1 Å²	82.1	51%	0.506	40%	0.399	S	S	.	.	B	Isolated β-bridge	trans	-66.4	143.4	176.2	27.9	-33.4	0	0	0	110.6	R50 P51 V52	R50-P59 HydrophobicContact CB-CB 4.11Å; P51-P59 CarbonylContact O-C 3.58Å; P51-P59 WeakPolarHBondContact O-CA 3.35Å; V52-P59 HydrophobicContact CG1-CB 4.41Å
60	F	90.7	Very high	90	Very high	3 Å²	3	83.6 Å²	83.6	1%	0.013	40%	0.398	C	S	.	.			trans	-133.4	159.3	175	70.7	-85	0	0	0	112.2	I29 D30 V43 P51 I65	I29-F60 HydrophobicContact CB-CB 4.19Å; I29-F60 HydrophobicContact CB-CD2 3.97Å; I29-F60 HydrophobicContact CB-CE2 4.49Å; I29-F60 HydrophobicContact CB-CG 3.99Å; I29-F60 HydrophobicContact CD1-CB 4.45Å; I29-F60 HydrophobicContact CD1-CD1 3.71Å; I29-F60 HydrophobicContact CD1-CE1 4.02Å; I29-F60 HydrophobicContact CD1-CG 4.02Å; I29-F60 HydrophobicContact CG2-CD2 3.83Å; I29-F60 HydrophobicContact CG2-CE2 3.88Å; I29-F60 HydrophobicContact CG2-CG 4.27Å; I29-F60 HydrophobicContact CG2-CZ 4.35Å; D30-F60 HydrophobicContact CB-CB 3.82Å; D30-F60 WeakPolarHBondContact OD2-CA 3.29Å; D30-F60 WeakPolarHBondContact OD2-CB 3.43Å; V43-F60 HydrophobicContact CB-CZ 4.48Å; V43-F60 HydrophobicContact CG1-CE1 4.43Å; P51-F60 HydrophobicContact CB-CD1 4.37Å; P51-F60 HydrophobicContact CB-CE1 3.75Å; P51-F60 HydrophobicContact CB-CE2 4.31Å; P51-F60 HydrophobicContact CB-CZ 3.71Å; P51-F60 WeakPolarHBondContact CD-O 3.5Å; P51-F60 HydrophobicContact CG-CD1 4.38Å; P51-F60 HydrophobicContact CG-CD2 4.24Å; P51-F60 HydrophobicContact CG-CE1 4.09Å; P51-F60 HydrophobicContact CG-CE2 3.92Å; P51-F60 HydrophobicContact CG-CG 4.46Å; P51-F60 HydrophobicContact CG-CZ 3.85Å; P51-F60 WeakPolarHBondContact CG-O 3.3Å; P51-F60 VanDerWaalsContact O-CD1 3.29Å; P51-F60 WeakPolarHBondContact O-CD1 3.42Å; P51-F60 PolarHBondContact O-N 2.87Å; F60-I65 HydrophobicContact CE2-CD1 4.28Å; F60-I65 HydrophobicContact CE2-CG1 4.45Å
61	K	89.3	Confident	90.4	Very high	84 Å²	84	77.8 Å²	77.8	37%	0.365	38%	0.379	S	S	.	.			trans	-98.1	138.5	174.2	-62.3	-178.2	-177.7	-179.2	0	110.5	D30 E63 N64	D30-K61 PolarHBondContact OD2-N 3.35Å; K61-E63 PolarHBondContact O-N 2.93Å; K61-N64 HydrophobicContact CB-CB 4.38Å; K61-N64 PolarHBondContact O-N 2.96Å; K61-N64 VanDerWaalsContact O-N 3.07Å
62	K	86.6	Confident	90.4	Very high	128 Å²	128	78.8 Å²	78.8	56%	0.557	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-59.1	-31.2	173.6	-72.9	-170.8	173.5	-172	0	112.6	N64 I65	K62-N64 VanDerWaalsContact C-N 3.25Å; K62-N64 PolarHBondContact O-N 3.4Å; K62-I65 HydrophobicContact CB-CD1 4.46Å; K62-I65 VanDerWaalsContact O-CG1 3.3Å; K62-I65 WeakPolarHBondContact O-CG1 3.36Å; K62-I65 PolarHBondContact O-N 2.79Å
63	E	87.3	Confident	90.2	Very high	154 Å²	154	78.2 Å²	78.2	72%	0.72	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-66.8	-22.6	177	-66.1	158.4	-155.5	0	0	113.8	K61 R66	K61-E63 PolarHBondContact O-N 2.93Å; E63-R66 PolarHBondContact O-NH1 3.3Å
64	N	90.5	Very high	89.9	Confident	55 Å²	55	81.5 Å²	81.5	29%	0.294	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-96	5.8	-177.4	-70.1	-9.9	0	0	0	113.1	D30 K61 K62 R66	D30-N64 WeakPolarHBondContact OD1-CB 3.35Å; D30-N64 VanDerWaalsContact OD1-CG 3.27Å; D30-N64 PolarHBondContact OD1-ND2 3.29Å; D30-N64 PolarHBondContact OD2-ND2 3.48Å; K61-N64 HydrophobicContact CB-CB 4.38Å; K61-N64 PolarHBondContact O-N 2.96Å; K61-N64 VanDerWaalsContact O-N 3.07Å; K62-N64 VanDerWaalsContact C-N 3.25Å; K62-N64 PolarHBondContact O-N 3.4Å; N64-R66 PolarHBondContact O-N 3.44Å
65	I	92	Very high	89.9	Confident	30 Å²	30	79.6 Å²	79.6	15%	0.154	39%	0.392	C	S	.	.			trans	-67.4	124.7	172.8	-60	176.1	0	0	0	107.8	V27 T28 I29 F60 K62	V27-I65 HydrophobicContact CB-CG2 3.49Å; V27-I65 VanDerWaalsContact CB-CG2 3.49Å; V27-I65 HydrophobicContact CG1-CG2 3.81Å; V27-I65 HydrophobicContact CG2-CG2 3.6Å; T28-I65 WeakPolarHBondContact O-CA 3.37Å; I29-I65 HydrophobicContact CG2-CG1 4.3Å; F60-I65 HydrophobicContact CE2-CD1 4.28Å; F60-I65 HydrophobicContact CE2-CG1 4.45Å; K62-I65 HydrophobicContact CB-CD1 4.46Å; K62-I65 VanDerWaalsContact O-CG1 3.3Å; K62-I65 WeakPolarHBondContact O-CG1 3.36Å; K62-I65 PolarHBondContact O-N 2.79Å
66	R	93.8	Very high	89.6	Confident	136 Å²	136	80.3 Å²	80.3	51%	0.513	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	135.9	-179.2	-64.4	-71.7	-178.8	-86.6	-2.2	110.1	V27 T28 E63 N64	V27-R66 CarbonylContact C-O 3.48Å; V27-R66 WeakPolarHBondContact CA-O 3.46Å; T28-R66 HydrophobicContact CG2-CB 3.94Å; T28-R66 PolarHBondContact N-O 2.94Å; T28-R66 PolarHBondContact O-N 3.46Å; T28-R66 VanDerWaalsContact O-N 3.1Å; E63-R66 PolarHBondContact O-NH1 3.3Å; N64-R66 PolarHBondContact O-N 3.44Å
67	P	93.2	Very high	89.1	Confident	92 Å²	92	81.3 Å²	81.3	60%	0.597	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.4	144	176	28.6	-33.7	0	0	0	111.7
68	V	91	Very high	88.9	Confident	30 Å²	30	74.6 Å²	74.6	18%	0.182	37%	0.366	C	S	.	.			trans	-119	77.8	177.2	-171.7	0	0	0	0	109	P26 T28 Q70 L71	P26-V68 WeakPolarHBondContact CG-O 3.38Å; P26-V68 PolarHBondContact O-N 2.97Å; T28-V68 HydrophobicContact CG2-CG2 3.82Å; V68-Q70 PolarHBondContact O-N 3.13Å; V68-L71 HydrophobicContact CB-CD1 4.28Å; V68-L71 HydrophobicContact CG1-CB 4.34Å; V68-L71 HydrophobicContact CG1-CD1 3.77Å; V68-L71 HydrophobicContact CG1-CG 3.94Å; V68-L71 PolarHBondContact O-N 2.88Å; V68-L71 VanDerWaalsContact O-N 3.15Å
69	W	87.2	Confident	88.5	Confident	185 Å²	185	71.1 Å²	71.1	70%	0.701	35%	0.351	S	S	*	.	H	α-helix	trans	-61.7	-26.6	-171.7	57.5	-91.1	0	0	0	113.9	L71 A72 S73	W69-L71 VanDerWaalsContact C-N 3.31Å; W69-L71 PolarHBondContact O-N 2.98Å; W69-A72 WeakPolarHBondContact O-CB 3.34Å; W69-A72 PolarHBondContact O-N 2.92Å; W69-S73 PolarHBondContact O-N 3.07Å; W69-S73 VanDerWaalsContact O-N 3.13Å
70	Q	87.5	Confident	88	Confident	93 Å²	93	74.9 Å²	74.9	44%	0.435	36%	0.356	S	S	.	.	H	α-helix	trans	-62.4	-38.1	176.9	-60.2	88.7	-19	0	0	112	V68 S73 L74	V68-Q70 PolarHBondContact O-N 3.13Å; Q70-S73 PolarHBondContact O-N 3.41Å; Q70-L74 PolarHBondContact O-N 2.88Å
71	L	91.1	Very high	87.4	Confident	33 Å²	33	79.1 Å²	79.1	17%	0.173	38%	0.378	C	S	.	.	H	α-helix	trans	-71.3	-32.4	177.3	-71.8	171.8	0	0	0	111.7	V14 L23 P26 V34 V68 W69 S73 L74 V75	V14-L71 HydrophobicContact CG1-CD2 4.32Å; L23-L71 HydrophobicContact CD1-CB 4.43Å; L23-L71 HydrophobicContact CD1-CD1 4.16Å; P26-L71 HydrophobicContact CB-CB 4.03Å; P26-L71 HydrophobicContact CG-CB 3.93Å; V34-L71 HydrophobicContact CB-CD1 4.09Å; V34-L71 HydrophobicContact CG1-CD1 3.67Å; V34-L71 HydrophobicContact CG2-CD1 3.88Å; V68-L71 HydrophobicContact CB-CD1 4.28Å; V68-L71 HydrophobicContact CG1-CB 4.34Å; V68-L71 HydrophobicContact CG1-CD1 3.77Å; V68-L71 HydrophobicContact CG1-CG 3.94Å; V68-L71 PolarHBondContact O-N 2.88Å; V68-L71 VanDerWaalsContact O-N 3.15Å; W69-L71 VanDerWaalsContact C-N 3.31Å; W69-L71 PolarHBondContact O-N 2.98Å; L71-S73 VanDerWaalsContact C-N 3.33Å; L71-L74 HydrophobicContact CD2-CD1 4.08Å; L71-L74 PolarHBondContact O-N 3.36Å; L71-V75 WeakPolarHBondContact O-CG2 3.36Å; L71-V75 PolarHBondContact O-N 3.37Å
72	A	87.2	Confident	86.6	Confident	33 Å²	33	79.6 Å²	79.6	27%	0.273	38%	0.38	S	S	.	.	H	α-helix	trans	-62.8	-43.6	173.8	0	0	0	0	0	110.8	P26 W69 L74 V75 E76	P26-A72 HydrophobicContact CG-CB 3.85Å; W69-A72 WeakPolarHBondContact O-CB 3.34Å; W69-A72 PolarHBondContact O-N 2.92Å; A72-L74 PolarHBondContact O-N 2.97Å; A72-V75 PolarHBondContact O-N 3.11Å; A72-E76 PolarHBondContact O-N 2.91Å
73	S	85.7	Confident	85.4	Confident	56 Å²	56	78.3 Å²	78.3	39%	0.392	38%	0.383	S	S	.	.	H	α-helix	trans	-62.4	-40	174.4	-176.1	0	0	0	0	112.3	W69 Q70 L71 E76 N77	W69-S73 PolarHBondContact O-N 3.07Å; W69-S73 VanDerWaalsContact O-N 3.13Å; Q70-S73 PolarHBondContact O-N 3.41Å; L71-S73 VanDerWaalsContact C-N 3.33Å; S73-E76 PolarHBondContact O-N 2.84Å; S73-N77 WeakPolarHBondContact O-CB 3.45Å; S73-N77 PolarHBondContact O-N 2.96Å; S73-N77 PolarHBondContact O-ND2 3.33Å; S73-N77 VanDerWaalsContact O-ND2 3.11Å
74	L	88.3	Confident	83.9	Confident	70 Å²	70	76.9 Å²	76.9	37%	0.366	38%	0.38	S	S	.	.	H	α-helix	trans	-63.8	-43	175.4	-75.8	169.3	0	0	0	112.6	V14 Q70 L71 A72 N77 I78	V14-L74 HydrophobicContact CG1-CB 4.09Å; Q70-L74 PolarHBondContact O-N 2.88Å; L71-L74 HydrophobicContact CD2-CD1 4.08Å; L71-L74 PolarHBondContact O-N 3.36Å; A72-L74 PolarHBondContact O-N 2.97Å; L74-N77 PolarHBondContact O-N 3.36Å; L74-I78 WeakPolarHBondContact O-CD1 3.47Å; L74-I78 VanDerWaalsContact O-CG1 3.25Å; L74-I78 WeakPolarHBondContact O-CG1 3.35Å; L74-I78 PolarHBondContact O-N 2.96Å
75	V	89.3	Confident	82.2	Confident	4 Å²	4	80.9 Å²	80.9	2%	0.024	40%	0.395	C	S	.	.	H	α-helix	trans	-57.8	-49.2	173.7	170.8	0	0	0	0	110.7	V14 Y22 L23 L71 A72 N77 I78 E79	V14-V75 HydrophobicContact CB-CG2 3.74Å; V14-V75 HydrophobicContact CG1-CG2 4.29Å; V14-V75 HydrophobicContact CG2-CG2 4.16Å; Y22-V75 HydrophobicContact CG-CG1 4.16Å; L23-V75 HydrophobicContact CB-CG2 4.23Å; L71-V75 WeakPolarHBondContact O-CG2 3.36Å; L71-V75 PolarHBondContact O-N 3.37Å; A72-V75 PolarHBondContact O-N 3.11Å; V75-N77 VanDerWaalsContact C-N 3.29Å; V75-N77 PolarHBondContact O-N 3.45Å; V75-I78 PolarHBondContact O-N 3.39Å; V75-E79 HydrophobicContact CG1-CG 4.36Å; V75-E79 WeakPolarHBondContact O-CB 3.32Å; V75-E79 WeakPolarHBondContact O-CG 3.37Å; V75-E79 PolarHBondContact O-N 3.4Å
76	E	85.4	Confident	80.2	Confident	103 Å²	103	82.1 Å²	82.1	48%	0.481	42%	0.415	S	S	.	.	H	α-helix	trans	-59.4	-39.8	178	-74.6	-176	-166.7	0	0	112.3	A72 S73 E79 R80	A72-E76 PolarHBondContact O-N 2.91Å; S73-E76 PolarHBondContact O-N 2.84Å; E76-E79 PolarHBondContact O-N 3.46Å; E76-R80 WeakPolarHBondContact O-CB 3.25Å; E76-R80 VanDerWaalsContact O-CG 3.3Å; E76-R80 WeakPolarHBondContact O-CG 3.4Å; E76-R80 PolarHBondContact O-N 3.15Å
77	N	83.4	Confident	77.7	Confident	68 Å²	68	85.7 Å²	85.7	36%	0.364	43%	0.429	S	S	.	.	H	α-helix	trans	-67.5	-40.5	177.8	-70.7	-30.6	0	0	0	112	S73 L74 V75 R80 L81	S73-N77 WeakPolarHBondContact O-CB 3.45Å; S73-N77 PolarHBondContact O-N 2.96Å; S73-N77 PolarHBondContact O-ND2 3.33Å; S73-N77 VanDerWaalsContact O-ND2 3.11Å; L74-N77 PolarHBondContact O-N 3.36Å; V75-N77 VanDerWaalsContact C-N 3.29Å; V75-N77 PolarHBondContact O-N 3.45Å; N77-R80 PolarHBondContact O-N 2.93Å; N77-L81 WeakPolarHBondContact O-CB 3.46Å; N77-L81 VanDerWaalsContact O-CG 3.25Å; N77-L81 WeakPolarHBondContact O-CG 3.49Å; N77-L81 PolarHBondContact O-N 3.34Å
78	I	84.8	Confident	74.9	Confident	2 Å²	2	89.7 Å²	89.7	1%	0.01	44%	0.44	C	S	.	.	H	α-helix	trans	-65.9	-43.1	175.5	-66.4	163	0	0	0	110.5	L10 E11 V14 Y22 L74 V75 R80 L81 K82	L10-I78 HydrophobicContact CD2-CD1 3.78Å; L10-I78 HydrophobicContact CD2-CG1 3.85Å; L10-I78 HydrophobicContact CG-CD1 3.74Å; L10-I78 HydrophobicContact CG-CG1 4.35Å; E11-I78 HydrophobicContact CG-CG2 3.9Å; V14-I78 HydrophobicContact CB-CD1 4.35Å; V14-I78 HydrophobicContact CG1-CD1 4.04Å; V14-I78 HydrophobicContact CG2-CD1 3.43Å; V14-I78 VanDerWaalsContact CG2-CD1 3.43Å; Y22-I78 HydrophobicContact CE1-CG2 4.22Å; Y22-I78 WeakPolarHBondContact OH-CG2 3.46Å; L74-I78 WeakPolarHBondContact O-CD1 3.47Å; L74-I78 VanDerWaalsContact O-CG1 3.25Å; L74-I78 WeakPolarHBondContact O-CG1 3.35Å; L74-I78 PolarHBondContact O-N 2.96Å; V75-I78 PolarHBondContact O-N 3.39Å; I78-R80 VanDerWaalsContact C-N 3.35Å; I78-R80 PolarHBondContact O-N 2.9Å; I78-L81 PolarHBondContact O-N 2.86Å; I78-K82 PolarHBondContact O-N 2.88Å
79	E	84	Confident	72.3	Confident	56 Å²	56	94.6 Å²	94.6	26%	0.262	47%	0.472	S	S	.	.	H	α-helix	trans	-58.5	-45.8	173.8	-74.6	-178.5	150.9	0	0	110.6	R24 V75 E76 L81 K82 V83	R24-E79 IonicContact CZ-OE1 3.97Å; R24-E79 IonicContact NH1-OE1 2.77Å; R24-E79 PolarHBondContact NH1-OE1 2.88Å; R24-E79 VanDerWaalsContact NH1-OE1 3.12Å; R24-E79 IonicContact NH1-OE2 3.99Å; R24-E79 IonicContact NH2-OE1 3.96Å; R24-E79 PolarHBondContact NH2-OE1 2.78Å; V75-E79 HydrophobicContact CG1-CG 4.36Å; V75-E79 WeakPolarHBondContact O-CB 3.32Å; V75-E79 WeakPolarHBondContact O-CG 3.37Å; V75-E79 PolarHBondContact O-N 3.4Å; E76-E79 PolarHBondContact O-N 3.46Å; E79-L81 PolarHBondContact O-N 3.06Å; E79-K82 WeakPolarHBondContact O-CB 3.45Å; E79-K82 PolarHBondContact O-N 2.79Å; E79-V83 WeakPolarHBondContact O-CG2 3.41Å; E79-V83 PolarHBondContact O-N 3.44Å
80	R	80.5	Confident	69.9	Low	158 Å²	158	89.1 Å²	89.1	60%	0.596	47%	0.473	S	S	*	.	H	α-helix	trans	-60.6	-42.8	174.9	-75.4	177.1	-173.5	-173.2	7.2	112.8	E76 N77 I78 K82 V83 D84	E76-R80 WeakPolarHBondContact O-CB 3.25Å; E76-R80 VanDerWaalsContact O-CG 3.3Å; E76-R80 WeakPolarHBondContact O-CG 3.4Å; E76-R80 PolarHBondContact O-N 3.15Å; N77-R80 PolarHBondContact O-N 2.93Å; I78-R80 VanDerWaalsContact C-N 3.35Å; I78-R80 PolarHBondContact O-N 2.9Å; R80-K82 VanDerWaalsContact C-N 3.27Å; R80-K82 PolarHBondContact O-N 2.95Å; R80-V83 PolarHBondContact O-N 3.02Å; R80-D84 PolarHBondContact O-N 3.13Å
81	L	76.5	Confident	67.3	Low	92 Å²	92	93 Å²	93	48%	0.482	49%	0.491	S	S	.	.	H	α-helix	trans	-64.5	-30.1	177.1	-72.6	169.4	0	0	0	112.6	L7 N77 I78 E79	L7-L81 HydrophobicContact CD2-CD1 4.2Å; N77-L81 WeakPolarHBondContact O-CB 3.46Å; N77-L81 VanDerWaalsContact O-CG 3.25Å; N77-L81 WeakPolarHBondContact O-CG 3.49Å; N77-L81 PolarHBondContact O-N 3.34Å; I78-L81 PolarHBondContact O-N 2.86Å; E79-L81 PolarHBondContact O-N 3.06Å
82	K	73.1	Confident	64.4	Low	93 Å²	93	98.3 Å²	98.3	40%	0.404	52%	0.524	S	S	.	.	H	α-helix	trans	-72.5	-41.3	171.8	-74.4	-172.7	173.3	-174.8	0	111.9	E11 Y22 I78 E79 R80 K85 G86	E11-K82 WeakPolarHBondContact OE1-CE 3.49Å; E11-K82 IonicContact OE1-NZ 2.79Å; E11-K82 PolarHBondContact OE1-NZ 2.82Å; E11-K82 VanDerWaalsContact OE1-NZ 3.11Å; E11-K82 IonicContact OE2-NZ 2.78Å; E11-K82 PolarHBondContact OE2-NZ 2.94Å; Y22-K82 WeakPolarHBondContact OH-CE 3.17Å; Y22-K82 PolarHBondContact OH-NZ 3.48Å; I78-K82 PolarHBondContact O-N 2.88Å; E79-K82 WeakPolarHBondContact O-CB 3.45Å; E79-K82 PolarHBondContact O-N 2.79Å; R80-K82 VanDerWaalsContact C-N 3.27Å; R80-K82 PolarHBondContact O-N 2.95Å; K82-K85 PolarHBondContact O-N 3.04Å; K82-G86 PolarHBondContact O-N 3.11Å
83	V	62.5	Low	62	Low	102 Å²	102	102.7 Å²	102.7	62%	0.618	55%	0.548	S	S	*	.	H	α-helix	trans	-65.4	-39.6	179.3	174.9	0	0	0	0	111.6	E79 R80 K85 G86 R87	E79-V83 WeakPolarHBondContact O-CG2 3.41Å; E79-V83 PolarHBondContact O-N 3.44Å; R80-V83 PolarHBondContact O-N 3.02Å; V83-K85 VanDerWaalsContact C-N 3.31Å; V83-K85 PolarHBondContact O-N 2.7Å; V83-G86 PolarHBondContact O-N 3.43Å; V83-G86 VanDerWaalsContact O-N 3.16Å; V83-R87 PolarHBondContact O-N 3.12Å
84	D	55.7	Low	59.7	Low	124 Å²	124	111 Å²	111	66%	0.663	57%	0.57	S	S	*	*	H	α-helix	trans	-71.6	-22	178.5	-89.9	-18.3	0	0	0	113.9	R80	R80-D84 PolarHBondContact O-N 3.13Å
85	K	53.8	Low	57.1	Low	138 Å²	138	115.6 Å²	115.6	60%	0.6	59%	0.59	S	S	*	*	H	α-helix	trans	-83.5	-18.1	170.8	-73.6	-176.3	-179.8	175.5	0	113.6	K82 V83	K82-K85 PolarHBondContact O-N 3.04Å; V83-K85 VanDerWaalsContact C-N 3.31Å; V83-K85 PolarHBondContact O-N 2.7Å
86	G	49.3	Very low	54.7	Low	57 Å²	57	124.4 Å²	124.4	59%	0.588	63%	0.631	S	S	*	*	H	α-helix	trans	-94.4	-3.3	-176.8	0	0	0	0	0	115.1	K82 V83 Q88	K82-G86 PolarHBondContact O-N 3.11Å; V83-G86 PolarHBondContact O-N 3.43Å; V83-G86 VanDerWaalsContact O-N 3.16Å; G86-Q88 PolarHBondContact O-N 3.11Å
87	R	41.5	Very low	52.7	Low	210 Å²	210	125.9 Å²	125.9	79%	0.792	64%	0.638	S	S	*	*			trans	-78.6	68.6	-175.1	-153.4	171.3	-166.2	-179.7	2.4	112.2	V83	V83-R87 PolarHBondContact O-N 3.12Å
88	Q	35.9	Very low	51.1	Low	177 Å²	177	130.2 Å²	130.2	83%	0.827	66%	0.661	S	S	*	*			trans	-73.8	128.4	147.4	-71.1	-156.2	7.2	0	0	108.2	G86 G90	G86-Q88 PolarHBondContact O-N 3.11Å; Q88-G90 PolarHBondContact O-N 3.36Å
89	P	35	Very low	50	Low	133 Å²	133	132 Å²	132	86%	0.864	68%	0.677	S	S	*	*	S	Bend	trans	-78.7	101	175.1	25	-19.8	0	0	0	108.8
90	G	37.9	Very low	49.6	Very low	69 Å²	69	136.7 Å²	136.7	71%	0.711	70%	0.696	S	S	*	*			trans	141.4	71.1	168.3	0	0	0	0	0	114.6	Q88	Q88-G90 PolarHBondContact O-N 3.36Å
91	E	32.5	Very low	49.9	Very low	175 Å²	175	134 Å²	134	82%	0.818	69%	0.693	S	S	*	*			trans	-138.7	105.3	154	-119.8	175.2	-179.2	0	0	109.5	T93	E91-T93 PolarHBondContact O-N 3.32Å
92	V	30.7	Very low	50.5	Low	145 Å²	145	130.1 Å²	130.1	88%	0.879	67%	0.673	S	S	*	*			trans	-74	82.6	168.6	-177.9	0	0	0	0	105.9	R94	V92-R94 PolarHBondContact O-N 3.49Å; V92-R94 VanDerWaalsContact O-N 3.08Å
93	T	36.3	Very low	51	Low	124 Å²	124	135 Å²	135	76%	0.761	70%	0.698	S	S	*	*			trans	-74.6	103.9	175	-19.4	0	0	0	0	108.2	E91 E95	E91-T93 PolarHBondContact O-N 3.32Å; T93-E95 PolarHBondContact O-N 3.32Å
94	R	36.9	Very low	52.1	Low	230 Å²	230	138.1 Å²	138.1	87%	0.868	70%	0.698	S	S	*	*			trans	-34.4	116.8	176.1	-67.9	157.7	94	160.3	4.5	111.5	V92 Q96	V92-R94 PolarHBondContact O-N 3.49Å; V92-R94 VanDerWaalsContact O-N 3.08Å; R94-Q96 PolarHBondContact O-N 2.94Å
95	E	34.5	Very low	53.5	Low	168 Å²	168	135.1 Å²	135.1	79%	0.785	68%	0.68	S	S	*	*			trans	-55.8	102.1	159.7	-66.9	179.3	158.3	0	0	107.9	T93 Q97	T93-E95 PolarHBondContact O-N 3.32Å; E95-Q97 PolarHBondContact O-N 3.46Å
96	Q	37.4	Very low	55	Low	189 Å²	189	138.6 Å²	138.6	88%	0.883	69%	0.689	S	S	*	*			trans	-65.4	93.9	156.3	-77.3	177.5	-5.8	0	0	105.5	R94 D98	R94-Q96 PolarHBondContact O-N 2.94Å; Q96-D98 VanDerWaalsContact C-N 3.28Å; Q96-D98 PolarHBondContact O-N 2.86Å
97	Q	43.5	Very low	56.7	Low	133 Å²	133	140.4 Å²	140.4	62%	0.621	68%	0.683	S	S	*	*			trans	-62.1	95	171.7	-70.6	-178.7	0.6	0	0	107.6	E95 A99	E95-Q97 PolarHBondContact O-N 3.46Å; Q97-A99 PolarHBondContact O-N 3.3Å
98	D	51.2	Low	58.9	Low	160 Å²	160	134.1 Å²	134.1	86%	0.856	66%	0.661	S	S	*	*			trans	-61.8	81.7	154.3	-120.3	-12.6	0	0	0	106.2	Q96 K100	Q96-D98 VanDerWaalsContact C-N 3.28Å; Q96-D98 PolarHBondContact O-N 2.86Å; D98-K100 PolarHBondContact O-N 2.98Å
99	A	62.2	Low	61.5	Low	40 Å²	40	126.6 Å²	126.6	33%	0.331	63%	0.626	S	S	.	*			trans	-67.1	97.6	-176.8	0	0	0	0	0	107.2	Q97 L101 K108	Q97-A99 PolarHBondContact O-N 3.3Å; A99-L101 WeakPolarHBondContact O-CG 3.46Å; A99-L101 PolarHBondContact O-N 2.99Å; A99-K108 HydrophobicContact CB-CD 4.26Å; A99-K108 HydrophobicContact CB-CG 4.46Å
100	K	74.8	Confident	64	Low	154 Å²	154	124.2 Å²	124.2	67%	0.67	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-54.1	117.4	177.2	-67.2	-174.7	173.9	-177.9	0	109	D98 L109 L119	D98-K100 PolarHBondContact O-N 2.98Å; K100-L109 HydrophobicContact CB-CD1 3.83Å; K100-L109 WeakPolarHBondContact O-CB 3.36Å; K100-L109 VanDerWaalsContact O-CG 3.31Å; K100-L109 WeakPolarHBondContact O-CG 3.34Å; K100-L109 PolarHBondContact O-N 3.1Å; K100-L109 VanDerWaalsContact O-N 3.15Å; K100-L119 HydrophobicContact CD-CD1 4.41Å
101	L	87	Confident	66.5	Low	101 Å²	101	123.2 Å²	123.2	53%	0.529	58%	0.579	S	S	.	*	B	Isolated β-bridge	trans	-92.2	149.2	178.7	-59.6	179.4	0	0	0	109.7	A99 E103	A99-L101 WeakPolarHBondContact O-CG 3.46Å; A99-L101 PolarHBondContact O-N 2.99Å; L101-E103 PolarHBondContact O-N 3.29Å
102	C	87.8	Confident	69.4	Low	11 Å²	11	117.2 Å²	117.2	7%	0.074	55%	0.549	C	S	.	.	P	Polyproline II helix	trans	-66.6	126.3	169.8	175.3	0	0	0	0	109.9	R104 H105 R106 E107 L109 C121 C124	C102-R104 PolarHBondContact O-N 3.3Å; C102-R104 PolarHBondContact SG-N 3.27Å; C102-H105 HydrophobicContact CB-CB 4.38Å; C102-H105 PolarHBondContact O-N 2.94Å; C102-H105 PolarHBondContact SG-ND1 2.93Å; C102-H105 VanDerWaalsContact SG-ND1 3.45Å; C102-R106 VanDerWaalsContact O-CA 3.28Å; C102-R106 WeakPolarHBondContact O-CA 3.32Å; C102-R106 PolarHBondContact O-N 3.04Å; C102-E107 WeakPolarHBondContact CB-O 3.42Å; C102-E107 PolarHBondContact N-O 2.93Å; C102-L109 HydrophobicContact CB-CD2 3.7Å; C102-L109 HydrophobicContact CB-CG 4.47Å; C102-C121 HydrophobicContact CB-CB 3.67Å; C102-C121 VanDerWaalsContact CB-SG 3.57Å; C102-C121 VanDerWaalsContact SG-SG 3.61Å; C102-C124 PolarHBondContact SG-SG 2.79Å
103	E	84.9	Confident	72.4	Confident	196 Å²	196	110.3 Å²	110.3	92%	0.916	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-35.2	178.9	-63.8	178.1	176.3	0	0	112.9	L101	L101-E103 PolarHBondContact O-N 3.29Å
104	R	85.3	Confident	75	Confident	166 Å²	166	109.4 Å²	109.4	63%	0.626	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-38.5	-177.7	-73.1	177.9	65.8	159.8	-1	113.9	C102 E129	C102-R104 PolarHBondContact O-N 3.3Å; C102-R104 PolarHBondContact SG-N 3.27Å; R104-E129 IonicContact CZ-OE1 2.74Å; R104-E129 IonicContact NH1-OE1 3.36Å; R104-E129 PolarHBondContact NH1-OE1 3.08Å; R104-E129 IonicContact NH1-OE2 3.71Å; R104-E129 IonicContact NH2-OE1 3.89Å
105	H	86.1	Confident	77.5	Confident	62 Å²	62	102.9 Å²	102.9	29%	0.287	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	-11.5	-169.1	-56.1	111.8	0	0	0	113.6	C102 E107 C121 M123 C124	C102-H105 HydrophobicContact CB-CB 4.38Å; C102-H105 PolarHBondContact O-N 2.94Å; C102-H105 PolarHBondContact SG-ND1 2.93Å; C102-H105 VanDerWaalsContact SG-ND1 3.45Å; H105-E107 HydrophobicContact CB-CB 4.15Å; H105-E107 HydrophobicContact CB-CG 4.04Å; H105-E107 PolarHBondContact O-N 3.41Å; H105-C121 PolarHBondContact ND1-SG 2.87Å; H105-M123 HydrophobicContact CB-CB 4.17Å; H105-M123 HydrophobicContact CB-CG 4.28Å; H105-C124 PolarHBondContact CE1-SG 3.48Å; H105-C124 PolarHBondContact ND1-SG 3.31Å
106	R	84.3	Confident	80.2	Confident	210 Å²	210	97.9 Å²	97.9	79%	0.792	46%	0.455	S	S	*	.			trans	55.1	19.4	-171	-58.1	-175	175.7	-179.6	-1.8	114.2	C102	C102-R106 VanDerWaalsContact O-CA 3.28Å; C102-R106 WeakPolarHBondContact O-CA 3.32Å; C102-R106 PolarHBondContact O-N 3.04Å
107	E	84.5	Confident	82.8	Confident	95 Å²	95	91 Å²	91	44%	0.444	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-89.7	148.9	176	-75.5	-61.5	151.8	0	0	110.8	C102 H105 L109 C121 M123	C102-E107 WeakPolarHBondContact CB-O 3.42Å; C102-E107 PolarHBondContact N-O 2.93Å; H105-E107 HydrophobicContact CB-CB 4.15Å; H105-E107 HydrophobicContact CB-CG 4.04Å; H105-E107 PolarHBondContact O-N 3.41Å; E107-L109 PolarHBondContact O-N 3.35Å; E107-C121 HydrophobicContact CB-CB 3.53Å; E107-M123 HydrophobicContact CG-CG 4.34Å
108	K	87.8	Confident	85	Confident	79 Å²	79	90.1 Å²	90.1	34%	0.343	43%	0.43	S	S	.	.	B	Isolated β-bridge	trans	-60.9	132.8	177.3	-172.7	168.6	-177.1	173	0	109.9	A99 H110 C121	A99-K108 HydrophobicContact CB-CD 4.26Å; A99-K108 HydrophobicContact CB-CG 4.46Å; K108-H110 PolarHBondContact O-CD2 3.27Å; K108-H110 PolarHBondContact O-N 3.02Å; K108-C121 WeakPolarHBondContact O-CB 3.32Å
109	L	90.6	Very high	87	Confident	18 Å²	18	86 Å²	86	9%	0.094	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	125.3	174.7	-63.8	171.3	0	0	0	108.2	K100 C102 E107 L119 L120 C121 M138	K100-L109 HydrophobicContact CB-CD1 3.83Å; K100-L109 WeakPolarHBondContact O-CB 3.36Å; K100-L109 VanDerWaalsContact O-CG 3.31Å; K100-L109 WeakPolarHBondContact O-CG 3.34Å; K100-L109 PolarHBondContact O-N 3.1Å; K100-L109 VanDerWaalsContact O-N 3.15Å; C102-L109 HydrophobicContact CB-CD2 3.7Å; C102-L109 HydrophobicContact CB-CG 4.47Å; E107-L109 PolarHBondContact O-N 3.35Å; L109-L119 HydrophobicContact CB-CB 4.23Å; L109-L119 HydrophobicContact CD1-CB 3.81Å; L109-L119 HydrophobicContact CD1-CD1 4.14Å; L109-L119 HydrophobicContact CD2-CB 4.25Å; L109-L119 WeakPolarHBondContact CD2-O 3.34Å; L109-L119 HydrophobicContact CG-CB 4.32Å; L109-L120 VanDerWaalsContact CD2-C 3.46Å; L109-C121 HydrophobicContact CD2-CB 4.23Å; L109-M138 HydrophobicContact CB-SD 4.21Å; L109-M138 WeakPolarHBondContact O-CE 3.37Å
110	H	88.3	Confident	88.4	Confident	83 Å²	83	84.2 Å²	84.2	38%	0.384	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	-23.5	-175.4	-76.8	-69.6	0	0	0	113	K108 L120 L137 M138	K108-H110 PolarHBondContact O-CD2 3.27Å; K108-H110 PolarHBondContact O-N 3.02Å; H110-L120 PolarHBondContact N-O 3.17Å; H110-L137 WeakPolarHBondContact O-CA 3.49Å; H110-M138 WeakPolarHBondContact O-CG 3.28Å; H110-M138 PolarHBondContact O-N 2.82Å
111	Y	90.8	Very high	89.2	Confident	49 Å²	49	76.9 Å²	76.9	19%	0.192	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	156.7	-173.6	-54.5	-87.7	0	0	0	110.8	L119 L120 V122 R125 V136 L137	Y111-L119 CarbonylContact O-C 3.55Å; Y111-L119 WeakPolarHBondContact O-CA 3.41Å; Y111-L120 PolarHBondContact N-O 3.17Å; Y111-L120 PolarHBondContact O-N 3.29Å; Y111-V122 HydrophobicContact CE2-CB 4.43Å; Y111-R125 HydrophobicContact CD2-CB 4.32Å; Y111-V136 CarbonylContact C-O 3.54Å; Y111-V136 WeakPolarHBondContact CA-O 3.39Å; Y111-L137 HydrophobicContact CD1-CD2 4.13Å; Y111-L137 HydrophobicContact CE1-CD2 3.84Å
112	Y	92.9	Very high	89.3	Confident	49 Å²	49	74.9 Å²	74.9	19%	0.192	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	126.6	169.8	174.1	-99.5	0	0	0	107.8	E114 G117 K118 L119 A135 V136 A141	Y112-E114 HydrophobicContact CD1-CG 4.09Å; Y112-E114 HydrophobicContact CE1-CG 4.15Å; Y112-G117 WeakPolarHBondContact OH-CA 3.37Å; Y112-K118 WeakPolarHBondContact CA-O 3.48Å; Y112-L119 HydrophobicContact CD2-CD2 4.16Å; Y112-A135 WeakPolarHBondContact O-CA 3.41Å; Y112-V136 PolarHBondContact N-O 2.91Å; Y112-V136 PolarHBondContact O-N 2.91Å; Y112-A141 HydrophobicContact CD1-CB 3.51Å; Y112-A141 HydrophobicContact CE1-CB 4.36Å; Y112-A141 HydrophobicContact CG-CB 3.76Å
113	C	92.5	Very high	89.4	Confident	0 Å²	0	79.3 Å²	79.3	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	114.1	171.3	-171.6	0	0	0	0	108.7	D115 D116 G117 K118 L120 H133	C113-D115 VanDerWaalsContact C-N 3.31Å; C113-D115 PolarHBondContact O-N 3.48Å; C113-D116 HydrophobicContact CB-CB 4.18Å; C113-D116 PolarHBondContact SG-OD2 3.03Å; C113-G117 WeakPolarHBondContact O-CA 3.37Å; C113-G117 PolarHBondContact O-N 3.24Å; C113-K118 PolarHBondContact N-O 2.8Å; C113-L120 HydrophobicContact CB-CD1 3.88Å; C113-L120 HydrophobicContact CB-CD2 4.31Å; C113-L120 HydrophobicContact CB-CG 4.11Å; C113-H133 WeakPolarHBondContact SG-CB 3.44Å; C113-H133 PolarHBondContact SG-ND1 3.06Å
114	E	91	Very high	89.7	Confident	105 Å²	105	70.6 Å²	70.6	49%	0.491	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-34.9	179	-66.8	-176.4	167	0	0	111.9	Y112 T134 V136	Y112-E114 HydrophobicContact CD1-CG 4.09Å; Y112-E114 HydrophobicContact CE1-CG 4.15Å; E114-T134 PolarHBondContact N-O 2.95Å; E114-T134 WeakPolarHBondContact OE2-CG2 3.37Å; E114-V136 HydrophobicContact CG-CG2 4.35Å
115	D	90.4	Very high	90	Very high	93 Å²	93	66.9 Å²	66.9	50%	0.497	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-41.9	-179.4	-55.1	-107.4	0	0	0	112.8	C113 H133 T134	C113-D115 VanDerWaalsContact C-N 3.31Å; C113-D115 PolarHBondContact O-N 3.48Å; D115-H133 HydrophobicContact CB-CB 4.02Å; D115-H133 WeakPolarHBondContact OD2-CA 3.4Å; D115-H133 WeakPolarHBondContact OD2-CB 3.38Å; D115-H133 IonicContact OD2-CG 2.88Å; D115-T134 PolarHBondContact OD2-N 3.32Å
116	D	91.5	Very high	90.1	Very high	62 Å²	62	69 Å²	69	33%	0.332	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-12.8	-175.2	-62.4	-65.7	0	0	0	114.4	C113 K118 H130 H133	C113-D116 HydrophobicContact CB-CB 4.18Å; C113-D116 PolarHBondContact SG-OD2 3.03Å; D116-K118 VanDerWaalsContact C-N 3.27Å; D116-K118 HydrophobicContact CB-CB 4.22Å; D116-K118 HydrophobicContact CB-CD 3.95Å; D116-K118 HydrophobicContact CB-CG 3.96Å; D116-K118 PolarHBondContact O-N 3.02Å; D116-H130 IonicContact OD2-CE1 3.93Å; D116-H130 PolarHBondContact OD2-CE1 3.35Å; D116-H130 IonicContact OD2-ND1 2.69Å; D116-H130 PolarHBondContact OD2-ND1 3.32Å; D116-H133 IonicContact OD1-CE1 3.58Å; D116-H133 IonicContact OD1-ND1 2.92Å; D116-H133 IonicContact OD2-CE1 3.57Å; D116-H133 PolarHBondContact OD2-CE1 3.38Å; D116-H133 IonicContact OD2-CG 3.87Å; D116-H133 IonicContact OD2-ND1 3.86Å; D116-H133 PolarHBondContact OD2-ND1 2.91Å
117	G	91.1	Very high	90.4	Very high	46 Å²	46	60.3 Å²	60.3	47%	0.474	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	26.9	-171.5	0	0	0	0	0	114.4	Y112 C113	Y112-G117 WeakPolarHBondContact OH-CA 3.37Å; C113-G117 WeakPolarHBondContact O-CA 3.37Å; C113-G117 PolarHBondContact O-N 3.24Å
118	K	90.6	Very high	90.6	Very high	114 Å²	114	67.1 Å²	67.1	50%	0.496	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	145.6	-173.5	-68.4	176.5	-170.3	167.5	0	112.6	Y112 C113 D116 L120	Y112-K118 WeakPolarHBondContact CA-O 3.48Å; C113-K118 PolarHBondContact N-O 2.8Å; D116-K118 VanDerWaalsContact C-N 3.27Å; D116-K118 HydrophobicContact CB-CB 4.22Å; D116-K118 HydrophobicContact CB-CD 3.95Å; D116-K118 HydrophobicContact CB-CG 3.96Å; D116-K118 PolarHBondContact O-N 3.02Å; K118-L120 HydrophobicContact CB-CD2 4.21Å
119	L	92	Very high	90.6	Very high	73 Å²	73	68.6 Å²	68.6	38%	0.382	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	130.3	169.7	-60.3	177.3	0	0	0	109.7	K100 L109 Y111 Y112 M138	K100-L119 HydrophobicContact CD-CD1 4.41Å; L109-L119 HydrophobicContact CB-CB 4.23Å; L109-L119 HydrophobicContact CD1-CB 3.81Å; L109-L119 HydrophobicContact CD1-CD1 4.14Å; L109-L119 HydrophobicContact CD2-CB 4.25Å; L109-L119 WeakPolarHBondContact CD2-O 3.34Å; L109-L119 HydrophobicContact CG-CB 4.32Å; Y111-L119 CarbonylContact O-C 3.55Å; Y111-L119 WeakPolarHBondContact O-CA 3.41Å; Y112-L119 HydrophobicContact CD2-CD2 4.16Å; L119-M138 HydrophobicContact CD1-SD 4.48Å; L119-M138 HydrophobicContact CD2-CG 3.86Å; L119-M138 HydrophobicContact CD2-SD 3.75Å
120	L	91.4	Very high	90.5	Very high	3 Å²	3	68.4 Å²	68.4	2%	0.016	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	140.3	-178.2	-45.5	-177.7	0	0	0	110.5	L109 H110 Y111 C113 K118 C124 R125 H130 A135	L109-L120 VanDerWaalsContact CD2-C 3.46Å; H110-L120 PolarHBondContact N-O 3.17Å; Y111-L120 PolarHBondContact N-O 3.17Å; Y111-L120 PolarHBondContact O-N 3.29Å; C113-L120 HydrophobicContact CB-CD1 3.88Å; C113-L120 HydrophobicContact CB-CD2 4.31Å; C113-L120 HydrophobicContact CB-CG 4.11Å; K118-L120 HydrophobicContact CB-CD2 4.21Å; L120-C124 HydrophobicContact CB-CB 3.82Å; L120-C124 HydrophobicContact CD2-CB 4.06Å; L120-C124 HydrophobicContact CG-CB 4.44Å; L120-R125 HydrophobicContact CD1-CB 4.28Å; L120-H130 HydrophobicContact CD1-CB 3.7Å; L120-H130 VanDerWaalsContact CD2-CD2 3.48Å; L120-H130 WeakPolarHBondContact CD2-CD2 3.37Å; L120-H130 VanDerWaalsContact CD2-NE2 3.31Å; L120-H130 WeakPolarHBondContact CD2-NE2 3.35Å; L120-A135 HydrophobicContact CD1-CB 4.28Å
121	C	92	Very high	90.5	Very high	0 Å²	0	73.6 Å²	73.6	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	176	159.4	69	0	0	0	0	109.9	C102 H105 E107 K108 L109 M123 C124 R125	C102-C121 HydrophobicContact CB-CB 3.67Å; C102-C121 VanDerWaalsContact CB-SG 3.57Å; C102-C121 VanDerWaalsContact SG-SG 3.61Å; H105-C121 PolarHBondContact ND1-SG 2.87Å; E107-C121 HydrophobicContact CB-CB 3.53Å; K108-C121 WeakPolarHBondContact O-CB 3.32Å; L109-C121 HydrophobicContact CD2-CB 4.23Å; C121-M123 PolarHBondContact O-N 3.34Å; C121-C124 PolarHBondContact O-N 3.26Å; C121-C124 PolarHBondContact SG-N 3.06Å; C121-C124 VanDerWaalsContact SG-N 3.43Å; C121-R125 PolarHBondContact O-N 2.97Å; C121-R125 VanDerWaalsContact O-N 3.07Å
122	V	90.1	Very high	90.5	Very high	58 Å²	58	76.1 Å²	76.1	35%	0.352	37%	0.368	S	S	.	.	H	α-helix	trans	-55.7	-39.2	178.4	72.3	0	0	0	0	112.2	Y111 E126	Y111-V122 HydrophobicContact CE2-CB 4.43Å; V122-E126 WeakPolarHBondContact O-CG 3.4Å; V122-E126 PolarHBondContact O-N 3.38Å
123	M	90.2	Very high	90.6	Very high	104 Å²	104	76.5 Å²	76.5	51%	0.512	37%	0.371	S	S	.	.	H	α-helix	trans	-72.3	-37.4	-179.8	-57.4	-56.7	-71.2	0	0	112.7	H105 E107 C121 E126 S127	H105-M123 HydrophobicContact CB-CB 4.17Å; H105-M123 HydrophobicContact CB-CG 4.28Å; E107-M123 HydrophobicContact CG-CG 4.34Å; C121-M123 PolarHBondContact O-N 3.34Å; M123-E126 PolarHBondContact O-N 3.41Å; M123-S127 PolarHBondContact O-N 3.14Å; M123-S127 VanDerWaalsContact O-N 3.13Å
124	C	90.9	Very high	90.5	Very high	14 Å²	14	79.9 Å²	79.9	10%	0.095	39%	0.392	C	S	.	.	H	α-helix	trans	-66.4	-40	176.1	-77.7	0	0	0	0	111.5	C102 H105 L120 C121 E126 S127 H130	C102-C124 PolarHBondContact SG-SG 2.79Å; H105-C124 PolarHBondContact CE1-SG 3.48Å; H105-C124 PolarHBondContact ND1-SG 3.31Å; L120-C124 HydrophobicContact CB-CB 3.82Å; L120-C124 HydrophobicContact CD2-CB 4.06Å; L120-C124 HydrophobicContact CG-CB 4.44Å; C121-C124 PolarHBondContact O-N 3.26Å; C121-C124 PolarHBondContact SG-N 3.06Å; C121-C124 VanDerWaalsContact SG-N 3.43Å; C124-E126 VanDerWaalsContact C-N 3.29Å; C124-E126 PolarHBondContact O-N 3.33Å; C124-S127 VanDerWaalsContact O-CB 3.26Å; C124-S127 WeakPolarHBondContact O-CB 3.33Å; C124-S127 PolarHBondContact O-N 3.1Å; C124-S127 VanDerWaalsContact O-N 3.12Å; C124-S127 PolarHBondContact O-OG 2.87Å; C124-H130 WeakPolarHBondContact O-CB 3.48Å
125	R	90.3	Very high	90.5	Very high	87 Å²	87	75.9 Å²	75.9	33%	0.328	38%	0.377	S	S	.	.	H	α-helix	trans	-59.3	-40.1	177.1	175.3	174.8	173.9	-107.2	5.4	112.4	Y111 L120 C121 S127 A135	Y111-R125 HydrophobicContact CD2-CB 4.32Å; L120-R125 HydrophobicContact CD1-CB 4.28Å; C121-R125 PolarHBondContact O-N 2.97Å; C121-R125 VanDerWaalsContact O-N 3.07Å; R125-S127 VanDerWaalsContact C-N 3.32Å; R125-A135 HydrophobicContact CG-CB 3.9Å
126	E	89.7	Confident	90.6	Very high	107 Å²	107	72.8 Å²	72.8	50%	0.5	36%	0.361	S	S	.	.	H	α-helix	trans	-83.8	-6.8	179.1	-58.5	-57.1	145.1	0	0	113.3	V122 M123 C124	V122-E126 WeakPolarHBondContact O-CG 3.4Å; V122-E126 PolarHBondContact O-N 3.38Å; M123-E126 PolarHBondContact O-N 3.41Å; C124-E126 VanDerWaalsContact C-N 3.29Å; C124-E126 PolarHBondContact O-N 3.33Å
127	S	89.2	Confident	90.6	Very high	27 Å²	27	74.5 Å²	74.5	19%	0.189	37%	0.37	C	S	.	.	S	Bend	trans	-64.8	152.6	179.1	75.4	0	0	0	0	111.6	M123 C124 R125 E129 H130 R131	M123-S127 PolarHBondContact O-N 3.14Å; M123-S127 VanDerWaalsContact O-N 3.13Å; C124-S127 VanDerWaalsContact O-CB 3.26Å; C124-S127 WeakPolarHBondContact O-CB 3.33Å; C124-S127 PolarHBondContact O-N 3.1Å; C124-S127 VanDerWaalsContact O-N 3.12Å; C124-S127 PolarHBondContact O-OG 2.87Å; R125-S127 VanDerWaalsContact C-N 3.32Å; S127-E129 PolarHBondContact O-N 3.1Å; S127-E129 PolarHBondContact OG-N 3.25Å; S127-H130 PolarHBondContact O-N 3.12Å; S127-H130 VanDerWaalsContact O-N 3.14Å; S127-H130 PolarHBondContact OG-N 3.01Å; S127-R131 WeakPolarHBondContact O-CB 3.38Å; S127-R131 PolarHBondContact O-N 3.01Å
128	R	88.4	Confident	90.4	Very high	239 Å²	239	75.3 Å²	75.3	90%	0.902	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-24.9	175.3	-65.5	-175.7	-177.9	-165.6	0.5	113
129	E	88.1	Confident	90.2	Very high	110 Å²	110	77.2 Å²	77.2	51%	0.514	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-45.4	178.9	-63.9	171.5	-151	0	0	111.8	R104 S127	R104-E129 IonicContact CZ-OE1 2.74Å; R104-E129 IonicContact NH1-OE1 3.36Å; R104-E129 PolarHBondContact NH1-OE1 3.08Å; R104-E129 IonicContact NH1-OE2 3.71Å; R104-E129 IonicContact NH2-OE1 3.89Å; S127-E129 PolarHBondContact O-N 3.1Å; S127-E129 PolarHBondContact OG-N 3.25Å
130	H	89.8	Confident	90.1	Very high	13 Å²	13	81 Å²	81	6%	0.06	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-6.8	-175.4	-63.1	-72.4	0	0	0	115.1	D116 L120 C124 S127 P132 H133	D116-H130 IonicContact OD2-CE1 3.93Å; D116-H130 PolarHBondContact OD2-CE1 3.35Å; D116-H130 IonicContact OD2-ND1 2.69Å; D116-H130 PolarHBondContact OD2-ND1 3.32Å; L120-H130 HydrophobicContact CD1-CB 3.7Å; L120-H130 VanDerWaalsContact CD2-CD2 3.48Å; L120-H130 WeakPolarHBondContact CD2-CD2 3.37Å; L120-H130 VanDerWaalsContact CD2-NE2 3.31Å; L120-H130 WeakPolarHBondContact CD2-NE2 3.35Å; C124-H130 WeakPolarHBondContact O-CB 3.48Å; S127-H130 PolarHBondContact O-N 3.12Å; S127-H130 VanDerWaalsContact O-N 3.14Å; S127-H130 PolarHBondContact OG-N 3.01Å; H130-P132 VanDerWaalsContact C-N 3.3Å; H130-H133 AromaticContact ND1-ND1 3.76Å; H130-H133 WeakPolarHBondContact O-CB 3.36Å; H130-H133 PolarHBondContact O-N 3.44Å
131	R	87.7	Confident	90	Very high	192 Å²	192	81.2 Å²	81.2	73%	0.725	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-35.8	176.9	-175	174.5	-178.1	175.1	1.4	114.6	S127 H133	S127-R131 WeakPolarHBondContact O-CB 3.38Å; S127-R131 PolarHBondContact O-N 3.01Å; R131-H133 VanDerWaalsContact C-N 3.34Å
132	P	91	Very high	90	Very high	102 Å²	102	82.4 Å²	82.4	66%	0.662	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-6.8	175.2	32.5	-32.9	0	0	0	113.9	H130	H130-P132 VanDerWaalsContact C-N 3.3Å
133	H	94.1	Very high	90.1	Very high	57 Å²	57	84.9 Å²	84.9	26%	0.264	41%	0.406	S	S	.	.	S	Bend	trans	-92.5	157.2	-174.5	-63	176.8	0	0	0	112.4	C113 D115 D116 H130 R131 A135	C113-H133 WeakPolarHBondContact SG-CB 3.44Å; C113-H133 PolarHBondContact SG-ND1 3.06Å; D115-H133 HydrophobicContact CB-CB 4.02Å; D115-H133 WeakPolarHBondContact OD2-CA 3.4Å; D115-H133 WeakPolarHBondContact OD2-CB 3.38Å; D115-H133 IonicContact OD2-CG 2.88Å; D116-H133 IonicContact OD1-CE1 3.58Å; D116-H133 IonicContact OD1-ND1 2.92Å; D116-H133 IonicContact OD2-CE1 3.57Å; D116-H133 PolarHBondContact OD2-CE1 3.38Å; D116-H133 IonicContact OD2-CG 3.87Å; D116-H133 IonicContact OD2-ND1 3.86Å; D116-H133 PolarHBondContact OD2-ND1 2.91Å; H130-H133 AromaticContact ND1-ND1 3.76Å; H130-H133 WeakPolarHBondContact O-CB 3.36Å; H130-H133 PolarHBondContact O-N 3.44Å; R131-H133 VanDerWaalsContact C-N 3.34Å; H133-A135 PolarHBondContact O-N 3.28Å
134	T	91.3	Very high	90.1	Very high	72 Å²	72	83 Å²	83	44%	0.442	40%	0.401	S	S	.	.			trans	-79.6	102.6	177.9	-56.9	0	0	0	0	109.5	E114 D115 V136	E114-T134 PolarHBondContact N-O 2.95Å; E114-T134 WeakPolarHBondContact OE2-CG2 3.37Å; D115-T134 PolarHBondContact OD2-N 3.32Å; T134-V136 HydrophobicContact CG2-CG1 4.37Å
135	A	91.4	Very high	90	Very high	21 Å²	21	86.5 Å²	86.5	17%	0.174	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	117.1	176.7	0	0	0	0	0	111.3	Y112 L120 R125 H133	Y112-A135 WeakPolarHBondContact O-CA 3.41Å; L120-A135 HydrophobicContact CD1-CB 4.28Å; R125-A135 HydrophobicContact CG-CB 3.9Å; H133-A135 PolarHBondContact O-N 3.28Å
136	V	91.4	Very high	90.2	Very high	28 Å²	28	88.3 Å²	88.3	17%	0.17	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	161.3	176.5	-61.4	0	0	0	0	110.7	Y111 Y112 E114 T134 A141	Y111-V136 CarbonylContact C-O 3.54Å; Y111-V136 WeakPolarHBondContact CA-O 3.39Å; Y112-V136 PolarHBondContact N-O 2.91Å; Y112-V136 PolarHBondContact O-N 2.91Å; E114-V136 HydrophobicContact CG-CG2 4.35Å; T134-V136 HydrophobicContact CG2-CG1 4.37Å; V136-A141 HydrophobicContact CG2-CB 3.64Å
137	L	92.3	Very high	90.4	Very high	97 Å²	97	89 Å²	89	51%	0.508	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	139.5	174.8	-70.7	170.4	0	0	0	110.6	H110 Y111 E139 K140 A141	H110-L137 WeakPolarHBondContact O-CA 3.49Å; Y111-L137 HydrophobicContact CD1-CD2 4.13Å; Y111-L137 HydrophobicContact CE1-CD2 3.84Å; L137-E139 PolarHBondContact O-N 3.35Å; L137-E139 VanDerWaalsContact O-N 3.15Å; L137-K140 HydrophobicContact CB-CB 4.45Å; L137-K140 WeakPolarHBondContact O-CA 3.38Å; L137-K140 WeakPolarHBondContact O-CB 3.41Å; L137-K140 PolarHBondContact O-N 3.4Å; L137-A141 PolarHBondContact O-N 3.47Å
138	M	87.6	Confident	90.7	Very high	64 Å²	64	94.6 Å²	94.6	32%	0.315	45%	0.447	S	S	.	.	H	α-helix	trans	-51.3	-42.1	-177.7	-70.7	-176.4	-48.7	0	0	112.7	L109 H110 L119 K140 A141 A142	L109-M138 HydrophobicContact CB-SD 4.21Å; L109-M138 WeakPolarHBondContact O-CE 3.37Å; H110-M138 WeakPolarHBondContact O-CG 3.28Å; H110-M138 PolarHBondContact O-N 2.82Å; L119-M138 HydrophobicContact CD1-SD 4.48Å; L119-M138 HydrophobicContact CD2-CG 3.86Å; L119-M138 HydrophobicContact CD2-SD 3.75Å; M138-K140 VanDerWaalsContact C-N 3.29Å; M138-K140 PolarHBondContact O-N 2.9Å; M138-A141 PolarHBondContact O-N 3.26Å; M138-A142 VanDerWaalsContact O-CB 3.27Å; M138-A142 WeakPolarHBondContact O-CB 3.46Å; M138-A142 PolarHBondContact O-N 2.93Å
139	E	86.5	Confident	91	Very high	154 Å²	154	88.4 Å²	88.4	72%	0.72	43%	0.431	S	S	*	.	H	α-helix	trans	-63.4	-36.8	179.1	-68.6	179.1	-179.8	0	0	112.3	L137 A142 Q143	L137-E139 PolarHBondContact O-N 3.35Å; L137-E139 VanDerWaalsContact O-N 3.15Å; E139-A142 PolarHBondContact O-N 3.34Å; E139-Q143 WeakPolarHBondContact O-CG 3.09Å; E139-Q143 PolarHBondContact O-N 2.97Å
140	K	89.1	Confident	91.4	Very high	152 Å²	152	88.3 Å²	88.3	66%	0.661	43%	0.434	S	S	*	.	H	α-helix	trans	-73.6	-42.8	177.7	-168.2	178.2	179.2	-177.1	0	111.3	L137 M138 A142 Q143 P144	L137-K140 HydrophobicContact CB-CB 4.45Å; L137-K140 WeakPolarHBondContact O-CA 3.38Å; L137-K140 WeakPolarHBondContact O-CB 3.41Å; L137-K140 PolarHBondContact O-N 3.4Å; M138-K140 VanDerWaalsContact C-N 3.29Å; M138-K140 PolarHBondContact O-N 2.9Å; K140-A142 VanDerWaalsContact C-N 3.26Å; K140-A142 PolarHBondContact O-N 3.4Å; K140-Q143 PolarHBondContact O-N 3.31Å; K140-P144 WeakPolarHBondContact O-CD 3.36Å
141	A	90.1	Very high	91.7	Very high	8 Å²	8	92 Å²	92	7%	0.066	45%	0.454	C	S	.	.	H	α-helix	trans	-59.9	-37.9	171.7	0	0	0	0	0	111.9	Y112 V136 L137 M138 Q143 P144 H145	Y112-A141 HydrophobicContact CD1-CB 3.51Å; Y112-A141 HydrophobicContact CE1-CB 4.36Å; Y112-A141 HydrophobicContact CG-CB 3.76Å; V136-A141 HydrophobicContact CG2-CB 3.64Å; L137-A141 PolarHBondContact O-N 3.47Å; M138-A141 PolarHBondContact O-N 3.26Å; A141-Q143 VanDerWaalsContact C-N 3.31Å; A141-Q143 PolarHBondContact O-N 2.88Å; A141-P144 WeakPolarHBondContact O-CD 3.25Å; A141-H145 PolarHBondContact O-CD2 3.5Å
142	A	91.7	Very high	92.1	Very high	25 Å²	25	88.5 Å²	88.5	21%	0.207	45%	0.445	C	S	.	.	H	α-helix	trans	-67.3	-27.6	-178.4	0	0	0	0	0	113.2	M138 E139 K140 H145 R146	M138-A142 VanDerWaalsContact O-CB 3.27Å; M138-A142 WeakPolarHBondContact O-CB 3.46Å; M138-A142 PolarHBondContact O-N 2.93Å; E139-A142 PolarHBondContact O-N 3.34Å; K140-A142 VanDerWaalsContact C-N 3.26Å; K140-A142 PolarHBondContact O-N 3.4Å; A142-H145 PolarHBondContact O-N 3.03Å; A142-R146 WeakPolarHBondContact O-CB 3.5Å; A142-R146 VanDerWaalsContact O-CG 3.26Å; A142-R146 WeakPolarHBondContact O-CG 3.42Å; A142-R146 PolarHBondContact O-N 2.95Å
143	Q	91.2	Very high	92.4	Very high	109 Å²	109	86.7 Å²	86.7	51%	0.509	43%	0.43	S	S	.	.	H	α-helix	trans	-61.8	-53.2	-175.7	-66.5	-59.6	-14.4	0	0	113.1	E139 K140 A141 H145 R146 E147	E139-Q143 WeakPolarHBondContact O-CG 3.09Å; E139-Q143 PolarHBondContact O-N 2.97Å; K140-Q143 PolarHBondContact O-N 3.31Å; A141-Q143 VanDerWaalsContact C-N 3.31Å; A141-Q143 PolarHBondContact O-N 2.88Å; Q143-H145 VanDerWaalsContact C-N 3.28Å; Q143-H145 PolarHBondContact O-N 3.43Å; Q143-R146 PolarHBondContact O-N 3.03Å; Q143-E147 PolarHBondContact O-N 2.93Å
144	P	90.8	Very high	92.5	Very high	65 Å²	65	87 Å²	87	42%	0.422	44%	0.438	S	S	.	.	H	α-helix	trans	-59.5	-36	175.5	-24.6	33.1	0	0	0	113.7	K140 A141 K148	K140-P144 WeakPolarHBondContact O-CD 3.36Å; A141-P144 WeakPolarHBondContact O-CD 3.25Å; P144-K148 WeakPolarHBondContact O-CB 3.39Å; P144-K148 VanDerWaalsContact O-CG 3.3Å; P144-K148 WeakPolarHBondContact O-CG 3.15Å; P144-K148 PolarHBondContact O-N 3.48Å
145	H	88.9	Confident	92.8	Very high	88 Å²	88	85.9 Å²	85.9	41%	0.407	43%	0.431	S	S	.	.	H	α-helix	trans	-68.4	-41.7	176.4	-70.4	-67.2	0	0	0	111.9	A141 A142 Q143 K148 I149	A141-H145 PolarHBondContact O-CD2 3.5Å; A142-H145 PolarHBondContact O-N 3.03Å; Q143-H145 VanDerWaalsContact C-N 3.28Å; Q143-H145 PolarHBondContact O-N 3.43Å; H145-K148 PolarHBondContact O-N 2.83Å; H145-I149 VanDerWaalsContact O-CG1 3.25Å; H145-I149 WeakPolarHBondContact O-CG1 3.41Å; H145-I149 PolarHBondContact O-N 3.28Å
146	R	93.8	Very high	93.1	Very high	124 Å²	124	89.4 Å²	89.4	47%	0.468	45%	0.447	S	S	.	.	H	α-helix	trans	-60.9	-45.5	173.8	-75.8	175.4	-175.7	135	-0.7	111	A142 Q143 I149 L150	A142-R146 WeakPolarHBondContact O-CB 3.5Å; A142-R146 VanDerWaalsContact O-CG 3.26Å; A142-R146 WeakPolarHBondContact O-CG 3.42Å; A142-R146 PolarHBondContact O-N 2.95Å; Q143-R146 PolarHBondContact O-N 3.03Å; R146-I149 PolarHBondContact O-N 3.45Å; R146-L150 WeakPolarHBondContact O-CB 3.49Å; R146-L150 VanDerWaalsContact O-CG 3.26Å; R146-L150 WeakPolarHBondContact O-CG 3.35Å; R146-L150 PolarHBondContact O-N 3.44Å
147	E	94.5	Very high	93.4	Very high	123 Å²	123	94.8 Å²	94.8	58%	0.575	46%	0.464	S	S	*	.	H	α-helix	trans	-61.3	-46	177.5	-171.1	179.5	-177.7	0	0	111.7	Q143 I149 L150 N151	Q143-E147 PolarHBondContact O-N 2.93Å; E147-I149 VanDerWaalsContact C-N 3.34Å; E147-I149 PolarHBondContact O-N 3.08Å; E147-L150 PolarHBondContact O-N 3.39Å; E147-N151 WeakPolarHBondContact O-CB 3.18Å; E147-N151 VanDerWaalsContact O-CG 3.23Å; E147-N151 PolarHBondContact O-N 3.18Å; E147-N151 PolarHBondContact O-ND2 3.47Å
148	K	94.7	Very high	93.7	Very high	143 Å²	143	96.5 Å²	96.5	62%	0.622	46%	0.464	S	S	*	.	H	α-helix	trans	-57.5	-44.6	173.7	-75.6	174.7	-177.6	178.9	0	112.3	P144 H145 N151 H152	P144-K148 WeakPolarHBondContact O-CB 3.39Å; P144-K148 VanDerWaalsContact O-CG 3.3Å; P144-K148 WeakPolarHBondContact O-CG 3.15Å; P144-K148 PolarHBondContact O-N 3.48Å; H145-K148 PolarHBondContact O-N 2.83Å; K148-N151 PolarHBondContact O-N 3.48Å; K148-H152 WeakPolarHBondContact O-CB 3.32Å; K148-H152 PolarHBondContact O-N 2.92Å
149	I	95.4	Very high	94.2	Very high	109 Å²	109	96.1 Å²	96.1	56%	0.559	46%	0.463	S	S	*	.	H	α-helix	trans	-64.2	-45.3	177.7	-70	165.4	0	0	0	110.7	H145 R146 E147 N151 H152 L153	H145-I149 VanDerWaalsContact O-CG1 3.25Å; H145-I149 WeakPolarHBondContact O-CG1 3.41Å; H145-I149 PolarHBondContact O-N 3.28Å; R146-I149 PolarHBondContact O-N 3.45Å; E147-I149 VanDerWaalsContact C-N 3.34Å; E147-I149 PolarHBondContact O-N 3.08Å; I149-N151 VanDerWaalsContact C-N 3.34Å; I149-N151 PolarHBondContact O-N 2.99Å; I149-H152 PolarHBondContact O-N 3.33Å; I149-L153 WeakPolarHBondContact O-CB 3.46Å; I149-L153 PolarHBondContact O-N 3.44Å
150	L	96.7	Very high	94.7	Very high	109 Å²	109	94.8 Å²	94.8	57%	0.571	45%	0.451	S	S	*	.	H	α-helix	trans	-63.4	-39.7	178	-71	172.1	0	0	0	111.7	R146 E147 L153 S154	R146-L150 WeakPolarHBondContact O-CB 3.49Å; R146-L150 VanDerWaalsContact O-CG 3.26Å; R146-L150 WeakPolarHBondContact O-CG 3.35Å; R146-L150 PolarHBondContact O-N 3.44Å; E147-L150 PolarHBondContact O-N 3.39Å; L150-L153 PolarHBondContact O-N 2.91Å; L150-S154 WeakPolarHBondContact O-CB 3.21Å; L150-S154 PolarHBondContact O-N 3.36Å
151	N	95.8	Very high	95.1	Very high	91 Å²	91	91.3 Å²	91.3	49%	0.487	44%	0.44	S	S	.	.	H	α-helix	trans	-63.8	-45.2	174.4	-72.9	-19.4	0	0	0	111.7	E147 K148 I149 L153 S154 T155	E147-N151 WeakPolarHBondContact O-CB 3.18Å; E147-N151 VanDerWaalsContact O-CG 3.23Å; E147-N151 PolarHBondContact O-N 3.18Å; E147-N151 PolarHBondContact O-ND2 3.47Å; K148-N151 PolarHBondContact O-N 3.48Å; I149-N151 VanDerWaalsContact C-N 3.34Å; I149-N151 PolarHBondContact O-N 2.99Å; N151-L153 PolarHBondContact O-N 3.35Å; N151-S154 PolarHBondContact O-N 2.84Å; N151-S154 PolarHBondContact O-OG 3.47Å; N151-T155 PolarHBondContact O-N 3.44Å; N151-T155 PolarHBondContact O-OG1 3.15Å
152	H	96.5	Very high	95.5	Very high	117 Å²	117	95.4 Å²	95.4	54%	0.542	46%	0.456	S	S	.	.	H	α-helix	trans	-62.6	-43.5	175.4	-171.1	62.3	0	0	0	111.7	K148 I149 S154 T155 L156	K148-H152 WeakPolarHBondContact O-CB 3.32Å; K148-H152 PolarHBondContact O-N 2.92Å; I149-H152 PolarHBondContact O-N 3.33Å; H152-S154 PolarHBondContact O-N 3.02Å; H152-T155 WeakPolarHBondContact O-CB 3.48Å; H152-T155 PolarHBondContact O-N 3.41Å; H152-T155 VanDerWaalsContact O-N 3.13Å; H152-L156 WeakPolarHBondContact NE2-CD1 3.43Å; H152-L156 WeakPolarHBondContact O-CG 3.48Å; H152-L156 PolarHBondContact O-N 2.94Å
153	L	97.1	Very high	95.8	Very high	64 Å²	64	99 Å²	99	34%	0.335	47%	0.471	S	S	.	.	H	α-helix	trans	-63.7	-39.1	177.6	-176.1	155.5	0	0	0	112	I149 L150 N151 T155 L156 R157	I149-L153 WeakPolarHBondContact O-CB 3.46Å; I149-L153 PolarHBondContact O-N 3.44Å; L150-L153 PolarHBondContact O-N 2.91Å; N151-L153 PolarHBondContact O-N 3.35Å; L153-T155 VanDerWaalsContact C-N 3.32Å; L153-T155 PolarHBondContact O-N 2.97Å; L153-L156 PolarHBondContact O-N 2.94Å; L153-R157 HydrophobicContact CD2-CG 4.33Å; L153-R157 VanDerWaalsContact CD2-NE 3.29Å; L153-R157 WeakPolarHBondContact O-CB 3.36Å; L153-R157 VanDerWaalsContact O-CG 3.32Å; L153-R157 WeakPolarHBondContact O-CG 3.12Å; L153-R157 PolarHBondContact O-N 3.28Å
154	S	96.9	Very high	96.1	Very high	63 Å²	63	98.8 Å²	98.8	44%	0.441	47%	0.47	S	S	.	.	H	α-helix	trans	-63.2	-38.1	172.9	78	0	0	0	0	112.2	L150 N151 H152 R158	L150-S154 WeakPolarHBondContact O-CB 3.21Å; L150-S154 PolarHBondContact O-N 3.36Å; N151-S154 PolarHBondContact O-N 2.84Å; N151-S154 PolarHBondContact O-OG 3.47Å; H152-S154 PolarHBondContact O-N 3.02Å; S154-R158 WeakPolarHBondContact O-CB 3.31Å; S154-R158 PolarHBondContact O-N 3.11Å; S154-R158 VanDerWaalsContact O-N 3.1Å
155	T	97.1	Very high	96.4	Very high	49 Å²	49	97.8 Å²	97.8	30%	0.301	47%	0.471	S	S	.	.	H	α-helix	trans	-66.1	-50.2	176.3	-63.3	0	0	0	0	111	N151 H152 L153 R157 R158 D159	N151-T155 PolarHBondContact O-N 3.44Å; N151-T155 PolarHBondContact O-OG1 3.15Å; H152-T155 WeakPolarHBondContact O-CB 3.48Å; H152-T155 PolarHBondContact O-N 3.41Å; H152-T155 VanDerWaalsContact O-N 3.13Å; L153-T155 VanDerWaalsContact C-N 3.32Å; L153-T155 PolarHBondContact O-N 2.97Å; T155-R157 VanDerWaalsContact C-N 3.32Å; T155-R157 PolarHBondContact O-N 3.46Å; T155-R158 PolarHBondContact O-N 3.25Å; T155-D159 PolarHBondContact O-N 3.15Å
156	L	97.8	Very high	96.8	Very high	96 Å²	96	100.8 Å²	100.8	50%	0.503	48%	0.483	S	S	.	.	H	α-helix	trans	-61.6	-37.9	178.4	-69.1	-179.9	0	0	0	112.7	H152 L153 D159 R160	H152-L156 WeakPolarHBondContact NE2-CD1 3.43Å; H152-L156 WeakPolarHBondContact O-CG 3.48Å; H152-L156 PolarHBondContact O-N 2.94Å; L153-L156 PolarHBondContact O-N 2.94Å; L156-D159 PolarHBondContact O-N 3.33Å; L156-R160 WeakPolarHBondContact O-CB 3.47Å; L156-R160 PolarHBondContact O-N 3.39Å
157	R	98	Very high	97	Very high	141 Å²	141	101 Å²	101	53%	0.532	49%	0.49	S	S	.	.	H	α-helix	trans	-62.3	-47.3	174.3	-77.9	179	177.2	170.3	-0.8	111.7	L153 T155 D159 R160 D161	L153-R157 HydrophobicContact CD2-CG 4.33Å; L153-R157 VanDerWaalsContact CD2-NE 3.29Å; L153-R157 WeakPolarHBondContact O-CB 3.36Å; L153-R157 VanDerWaalsContact O-CG 3.32Å; L153-R157 WeakPolarHBondContact O-CG 3.12Å; L153-R157 PolarHBondContact O-N 3.28Å; T155-R157 VanDerWaalsContact C-N 3.32Å; T155-R157 PolarHBondContact O-N 3.46Å; R157-D159 VanDerWaalsContact C-N 3.32Å; R157-D159 PolarHBondContact O-N 3.19Å; R157-R160 WeakPolarHBondContact O-CB 3.2Å; R157-R160 PolarHBondContact O-N 3.33Å; R157-D161 PolarHBondContact O-N 3.04Å
158	R	97.5	Very high	97.1	Very high	132 Å²	132	98 Å²	98	50%	0.498	49%	0.486	S	S	.	.	H	α-helix	trans	-61.2	-40.6	176.2	176.6	179.3	54.6	127.6	3.2	111.9	S154 T155 D161 K162	S154-R158 WeakPolarHBondContact O-CB 3.31Å; S154-R158 PolarHBondContact O-N 3.11Å; S154-R158 VanDerWaalsContact O-N 3.1Å; T155-R158 PolarHBondContact O-N 3.25Å; R158-D161 PolarHBondContact O-N 3.5Å; R158-K162 WeakPolarHBondContact O-CG 3.34Å; R158-K162 PolarHBondContact O-N 3.13Å
159	D	97.8	Very high	97.3	Very high	57 Å²	57	97.5 Å²	97.5	31%	0.305	48%	0.484	S	S	.	.	H	α-helix	trans	-70.7	-36.9	178.9	-67.8	-20.9	0	0	0	112.1	T155 L156 R157 K162 I163	T155-D159 PolarHBondContact O-N 3.15Å; L156-D159 PolarHBondContact O-N 3.33Å; R157-D159 VanDerWaalsContact C-N 3.32Å; R157-D159 PolarHBondContact O-N 3.19Å; D159-K162 PolarHBondContact O-N 3.45Å; D159-K162 IonicContact OD1-NZ 2.83Å; D159-K162 PolarHBondContact OD1-NZ 3.39Å; D159-I163 VanDerWaalsContact O-CG1 3.31Å; D159-I163 WeakPolarHBondContact O-CG1 3.32Å; D159-I163 PolarHBondContact O-N 3.46Å
160	R	98.1	Very high	97.4	Very high	125 Å²	125	93.6 Å²	93.6	47%	0.472	47%	0.471	S	S	.	.	H	α-helix	trans	-57.5	-49.5	168.3	177	-157.3	64	-163.2	-4	111.3	L156 R157 K162 I163 Q164	L156-R160 WeakPolarHBondContact O-CB 3.47Å; L156-R160 PolarHBondContact O-N 3.39Å; R157-R160 WeakPolarHBondContact O-CB 3.2Å; R157-R160 PolarHBondContact O-N 3.33Å; R160-K162 VanDerWaalsContact C-N 3.29Å; R160-K162 PolarHBondContact O-N 3.36Å; R160-I163 PolarHBondContact O-N 2.86Å; R160-I163 VanDerWaalsContact O-N 3.16Å; R160-Q164 WeakPolarHBondContact O-CG 3.32Å; R160-Q164 PolarHBondContact O-N 2.96Å
161	D	97.5	Very high	97.5	Very high	79 Å²	79	94.5 Å²	94.5	42%	0.422	47%	0.472	S	S	.	.	H	α-helix	trans	-63.9	-37.3	-178	-60.6	-14.4	0	0	0	111	R157 R158 G165	R157-D161 PolarHBondContact O-N 3.04Å; R158-D161 PolarHBondContact O-N 3.5Å; D161-G165 PolarHBondContact O-N 3.12Å
162	K	97.9	Very high	97.6	Very high	94 Å²	94	92.8 Å²	92.8	41%	0.409	47%	0.471	S	S	.	.	H	α-helix	trans	-61.5	-48.5	170.8	-73.6	171.9	-172.6	163.2	0	112.1	R158 D159 R160 Q164 G165 F166	R158-K162 WeakPolarHBondContact O-CG 3.34Å; R158-K162 PolarHBondContact O-N 3.13Å; D159-K162 PolarHBondContact O-N 3.45Å; D159-K162 IonicContact OD1-NZ 2.83Å; D159-K162 PolarHBondContact OD1-NZ 3.39Å; R160-K162 VanDerWaalsContact C-N 3.29Å; R160-K162 PolarHBondContact O-N 3.36Å; K162-Q164 VanDerWaalsContact C-N 3.32Å; K162-Q164 PolarHBondContact O-N 2.93Å; K162-G165 PolarHBondContact O-N 3.09Å; K162-F166 HydrophobicContact CB-CE2 4.47Å; K162-F166 WeakPolarHBondContact O-CD2 3.35Å; K162-F166 PolarHBondContact O-N 2.95Å
163	I	97.9	Very high	97.7	Very high	101 Å²	101	91.7 Å²	91.7	52%	0.518	47%	0.469	S	S	.	.	H	α-helix	trans	-60.6	-43.6	179.7	-70.2	166.1	0	0	0	110.3	D159 R160 G165 F166 Q167	D159-I163 VanDerWaalsContact O-CG1 3.31Å; D159-I163 WeakPolarHBondContact O-CG1 3.32Å; D159-I163 PolarHBondContact O-N 3.46Å; R160-I163 PolarHBondContact O-N 2.86Å; R160-I163 VanDerWaalsContact O-N 3.16Å; I163-G165 VanDerWaalsContact C-N 3.33Å; I163-G165 PolarHBondContact O-N 3.38Å; I163-F166 PolarHBondContact O-N 3.44Å; I163-Q167 HydrophobicContact CG2-CG 4.4Å; I163-Q167 WeakPolarHBondContact O-CB 3.5Å; I163-Q167 WeakPolarHBondContact O-CG 3.22Å; I163-Q167 PolarHBondContact O-N 3.25Å
164	Q	97.4	Very high	97.8	Very high	105 Å²	105	93.8 Å²	93.8	49%	0.491	48%	0.479	S	S	.	.	H	α-helix	trans	-61.4	-41.7	175.4	-72.5	178.1	-37.5	0	0	111.9	R160 K162 Q167 A168	R160-Q164 WeakPolarHBondContact O-CG 3.32Å; R160-Q164 PolarHBondContact O-N 2.96Å; K162-Q164 VanDerWaalsContact C-N 3.32Å; K162-Q164 PolarHBondContact O-N 2.93Å; Q164-Q167 PolarHBondContact O-N 3.45Å; Q164-A168 WeakPolarHBondContact O-CB 3.3Å; Q164-A168 PolarHBondContact O-N 2.97Å
165	G	97.4	Very high	97.8	Very high	43 Å²	43	95.7 Å²	95.7	44%	0.443	48%	0.484	S	S	.	.	H	α-helix	trans	-60.9	-43.8	173.3	0	0	0	0	0	113	D161 K162 I163 K169	D161-G165 PolarHBondContact O-N 3.12Å; K162-G165 PolarHBondContact O-N 3.09Å; I163-G165 VanDerWaalsContact C-N 3.33Å; I163-G165 PolarHBondContact O-N 3.38Å; G165-K169 WeakPolarHBondContact O-CB 3.49Å; G165-K169 PolarHBondContact O-N 2.9Å
166	F	97.5	Very high	97.9	Very high	151 Å²	151	96.3 Å²	96.3	66%	0.662	49%	0.493	S	S	*	.	H	α-helix	trans	-65.6	-38.7	175.1	-77.6	-64.2	0	0	0	112.6	K162 I163 G170	K162-F166 HydrophobicContact CB-CE2 4.47Å; K162-F166 WeakPolarHBondContact O-CD2 3.35Å; K162-F166 PolarHBondContact O-N 2.95Å; I163-F166 PolarHBondContact O-N 3.44Å; F166-G170 PolarHBondContact O-N 3Å
167	Q	97.1	Very high	97.9	Very high	128 Å²	128	94.2 Å²	94.2	60%	0.598	49%	0.49	S	S	*	.	H	α-helix	trans	-63.2	-50.8	176.1	-77.4	179.5	-28.7	0	0	111.4	I163 Q164 K169 G170 E171	I163-Q167 HydrophobicContact CG2-CG 4.4Å; I163-Q167 WeakPolarHBondContact O-CB 3.5Å; I163-Q167 WeakPolarHBondContact O-CG 3.22Å; I163-Q167 PolarHBondContact O-N 3.25Å; Q164-Q167 PolarHBondContact O-N 3.45Å; Q167-K169 VanDerWaalsContact C-N 3.32Å; Q167-K169 PolarHBondContact O-N 3.34Å; Q167-G170 PolarHBondContact O-N 3.3Å; Q167-E171 WeakPolarHBondContact O-CB 3.48Å; Q167-E171 PolarHBondContact O-N 3.48Å
168	A	97.8	Very high	98	Very high	60 Å²	60	92.3 Å²	92.3	50%	0.496	49%	0.49	S	S	.	.	H	α-helix	trans	-61.8	-40.2	178.7	0	0	0	0	0	112.1	Q164 A172	Q164-A168 WeakPolarHBondContact O-CB 3.3Å; Q164-A168 PolarHBondContact O-N 2.97Å; A168-A172 WeakPolarHBondContact O-CB 3.46Å; A168-A172 PolarHBondContact O-N 3.33Å
169	K	98	Very high	98	Very high	133 Å²	133	92.7 Å²	92.7	58%	0.578	50%	0.495	S	S	*	.	H	α-helix	trans	-64.4	-48.7	174.8	-177.3	177.5	177.5	-177.2	0	111.8	G165 Q167 E171 A172 D173	G165-K169 WeakPolarHBondContact O-CB 3.49Å; G165-K169 PolarHBondContact O-N 2.9Å; Q167-K169 VanDerWaalsContact C-N 3.32Å; Q167-K169 PolarHBondContact O-N 3.34Å; K169-E171 VanDerWaalsContact C-N 3.32Å; K169-E171 PolarHBondContact O-N 2.9Å; K169-A172 PolarHBondContact O-N 2.91Å; K169-D173 VanDerWaalsContact O-CG 3.3Å; K169-D173 PolarHBondContact O-N 2.95Å
170	G	98.1	Very high	98	Very high	27 Å²	27	96.4 Å²	96.4	28%	0.278	51%	0.509	S	S	.	.	H	α-helix	trans	-61.6	-39.4	179	0	0	0	0	0	112.6	F166 Q167 D173 I174	F166-G170 PolarHBondContact O-N 3Å; Q167-G170 PolarHBondContact O-N 3.3Å; G170-D173 PolarHBondContact O-N 3.25Å; G170-I174 WeakPolarHBondContact O-CB 3.22Å; G170-I174 WeakPolarHBondContact O-CD1 3.33Å; G170-I174 VanDerWaalsContact O-CG1 3.23Å; G170-I174 WeakPolarHBondContact O-CG1 3.25Å; G170-I174 PolarHBondContact O-N 3.19Å
171	E	98.2	Very high	98	Very high	129 Å²	129	95.5 Å²	95.5	60%	0.603	51%	0.513	S	S	*	.	H	α-helix	trans	-63.1	-44.6	174.3	-174.1	174.1	-174.4	0	0	111.7	Q167 K169 I174 L175	Q167-E171 WeakPolarHBondContact O-CB 3.48Å; Q167-E171 PolarHBondContact O-N 3.48Å; K169-E171 VanDerWaalsContact C-N 3.32Å; K169-E171 PolarHBondContact O-N 2.9Å; E171-I174 PolarHBondContact O-N 3.07Å; E171-L175 HydrophobicContact CG-CD1 4.24Å; E171-L175 WeakPolarHBondContact O-CB 3.46Å; E171-L175 WeakPolarHBondContact O-CG 3.45Å; E171-L175 PolarHBondContact O-N 3.4Å
172	A	98.3	Very high	98.1	Very high	55 Å²	55	95.9 Å²	95.9	46%	0.455	51%	0.512	S	S	.	.	H	α-helix	trans	-62	-42.8	175.1	0	0	0	0	0	112.5	A168 K169 L175 A176	A168-A172 WeakPolarHBondContact O-CB 3.46Å; A168-A172 PolarHBondContact O-N 3.33Å; K169-A172 PolarHBondContact O-N 2.91Å; A172-L175 PolarHBondContact O-N 3.09Å; A172-A176 WeakPolarHBondContact O-CB 3.25Å; A172-A176 PolarHBondContact O-N 3.29Å
173	D	98.4	Very high	98.1	Very high	94 Å²	94	95.2 Å²	95.2	50%	0.503	51%	0.513	S	S	.	.	H	α-helix	trans	-63.6	-41.7	177.5	-69.3	-20.8	0	0	0	111.2	K169 G170 A176 A177	K169-D173 VanDerWaalsContact O-CG 3.3Å; K169-D173 PolarHBondContact O-N 2.95Å; G170-D173 PolarHBondContact O-N 3.25Å; D173-A176 PolarHBondContact O-N 2.85Å; D173-A177 PolarHBondContact O-N 2.72Å
174	I	98.4	Very high	98.1	Very high	107 Å²	107	94.9 Å²	94.9	55%	0.549	51%	0.509	S	S	.	.	H	α-helix	trans	-63.9	-46.9	175.2	-70.4	165	0	0	0	111	G170 E171 A176 A177 L178	G170-I174 WeakPolarHBondContact O-CB 3.22Å; G170-I174 WeakPolarHBondContact O-CD1 3.33Å; G170-I174 VanDerWaalsContact O-CG1 3.23Å; G170-I174 WeakPolarHBondContact O-CG1 3.25Å; G170-I174 PolarHBondContact O-N 3.19Å; E171-I174 PolarHBondContact O-N 3.07Å; I174-A176 VanDerWaalsContact C-N 3.31Å; I174-A176 PolarHBondContact O-N 3.41Å; I174-A177 PolarHBondContact O-N 2.84Å; I174-L178 HydrophobicContact CG2-CD1 3.98Å; I174-L178 HydrophobicContact CG2-CG 4.37Å; I174-L178 WeakPolarHBondContact O-CG 3.48Å; I174-L178 PolarHBondContact O-N 3.48Å
175	L	98.5	Very high	98.2	Very high	104 Å²	104	97.9 Å²	97.9	55%	0.545	52%	0.516	S	S	.	.	H	α-helix	trans	-62.5	-38.4	178.6	-73.2	172	0	0	0	112	E171 A172 L178 K179	E171-L175 HydrophobicContact CG-CD1 4.24Å; E171-L175 WeakPolarHBondContact O-CB 3.46Å; E171-L175 WeakPolarHBondContact O-CG 3.45Å; E171-L175 PolarHBondContact O-N 3.4Å; A172-L175 PolarHBondContact O-N 3.09Å; L175-L178 PolarHBondContact O-N 3.44Å; L175-K179 WeakPolarHBondContact O-CB 2.79Å; L175-K179 PolarHBondContact O-N 3.44Å
176	A	98.4	Very high	98.2	Very high	61 Å²	61	101.4 Å²	101.4	50%	0.504	52%	0.521	S	S	.	.	H	α-helix	trans	-64.5	-41.8	174.4	0	0	0	0	0	112	A172 D173 I174 K179 K180	A172-A176 WeakPolarHBondContact O-CB 3.25Å; A172-A176 PolarHBondContact O-N 3.29Å; D173-A176 PolarHBondContact O-N 2.85Å; I174-A176 VanDerWaalsContact C-N 3.31Å; I174-A176 PolarHBondContact O-N 3.41Å; A176-K179 PolarHBondContact O-N 3.07Å; A176-K180 PolarHBondContact O-N 3.3Å
177	A	98.5	Very high	98.2	Very high	53 Å²	53	101.2 Å²	101.2	44%	0.438	52%	0.517	S	S	.	.	H	α-helix	trans	-64.5	-43.7	175.5	0	0	0	0	0	112.2	D173 I174 K179 K180 L181	D173-A177 PolarHBondContact O-N 2.72Å; I174-A177 PolarHBondContact O-N 2.84Å; A177-K179 VanDerWaalsContact C-N 3.34Å; A177-K179 PolarHBondContact O-N 3.41Å; A177-K180 WeakPolarHBondContact O-CB 3.43Å; A177-K180 PolarHBondContact O-N 2.8Å; A177-L181 WeakPolarHBondContact O-CG 3.18Å; A177-L181 PolarHBondContact O-N 3.44Å
178	L	98.6	Very high	98.3	Very high	100 Å²	100	99.9 Å²	99.9	52%	0.524	51%	0.513	S	S	.	.	H	α-helix	trans	-62	-40.7	175.7	-71.6	173	0	0	0	112	I174 L175 L181 Q182	I174-L178 HydrophobicContact CG2-CD1 3.98Å; I174-L178 HydrophobicContact CG2-CG 4.37Å; I174-L178 WeakPolarHBondContact O-CG 3.48Å; I174-L178 PolarHBondContact O-N 3.48Å; L175-L178 PolarHBondContact O-N 3.44Å; L178-L181 PolarHBondContact O-N 2.87Å; L178-Q182 PolarHBondContact O-N 3.21Å
179	K	98.4	Very high	98.3	Very high	141 Å²	141	100.5 Å²	100.5	61%	0.613	51%	0.51	S	S	*	.	H	α-helix	trans	-60.6	-46.4	173.9	-176.5	179.5	176.9	-176.5	0	111.3	L175 A176 A177 L181 Q182 D183	L175-K179 WeakPolarHBondContact O-CB 2.79Å; L175-K179 PolarHBondContact O-N 3.44Å; A176-K179 PolarHBondContact O-N 3.07Å; A177-K179 VanDerWaalsContact C-N 3.34Å; A177-K179 PolarHBondContact O-N 3.41Å; K179-L181 VanDerWaalsContact C-N 3.32Å; K179-L181 PolarHBondContact O-N 2.89Å; K179-Q182 WeakPolarHBondContact O-CB 3.2Å; K179-Q182 PolarHBondContact O-N 3.49Å; K179-Q182 VanDerWaalsContact O-N 3.09Å; K179-D183 VanDerWaalsContact O-CG 3.28Å; K179-D183 PolarHBondContact O-N 3.48Å
180	K	98.4	Very high	98.3	Very high	134 Å²	134	95.9 Å²	95.9	58%	0.583	50%	0.497	S	S	*	.	H	α-helix	trans	-58.9	-42.5	177.2	-174.6	179.6	179	-178.3	0	112.2	A176 A177 Q182 D183 Q184	A176-K180 PolarHBondContact O-N 3.3Å; A177-K180 WeakPolarHBondContact O-CB 3.43Å; A177-K180 PolarHBondContact O-N 2.8Å; K180-Q182 VanDerWaalsContact C-N 3.31Å; K180-Q182 PolarHBondContact O-N 3.13Å; K180-D183 PolarHBondContact O-N 3.2Å; K180-Q184 WeakPolarHBondContact O-CG 3.45Å; K180-Q184 PolarHBondContact O-N 3.41Å
181	L	98.4	Very high	98.3	Very high	106 Å²	106	98.6 Å²	98.6	56%	0.555	50%	0.502	S	S	*	.	H	α-helix	trans	-63	-38.5	175.4	-70.1	174.6	0	0	0	112	A177 L178 K179 Q184 R185	A177-L181 WeakPolarHBondContact O-CG 3.18Å; A177-L181 PolarHBondContact O-N 3.44Å; L178-L181 PolarHBondContact O-N 2.87Å; K179-L181 VanDerWaalsContact C-N 3.32Å; K179-L181 PolarHBondContact O-N 2.89Å; L181-Q184 PolarHBondContact O-N 3.48Å; L181-R185 PolarHBondContact O-N 2.94Å
182	Q	98.4	Very high	98.2	Very high	88 Å²	88	97.6 Å²	97.6	41%	0.411	50%	0.496	S	S	.	.	H	α-helix	trans	-66.5	-41.3	176	-176.7	61.2	23.9	0	0	112	L178 K179 K180 R185 Q186	L178-Q182 PolarHBondContact O-N 3.21Å; K179-Q182 WeakPolarHBondContact O-CB 3.2Å; K179-Q182 PolarHBondContact O-N 3.49Å; K179-Q182 VanDerWaalsContact O-N 3.09Å; K180-Q182 VanDerWaalsContact C-N 3.31Å; K180-Q182 PolarHBondContact O-N 3.13Å; Q182-R185 WeakPolarHBondContact O-CB 3.5Å; Q182-R185 PolarHBondContact O-N 3.49Å; Q182-Q186 PolarHBondContact O-N 3.33Å; Q182-Q186 VanDerWaalsContact O-N 3.09Å
183	D	98.3	Very high	98.2	Very high	79 Å²	79	100.7 Å²	100.7	42%	0.422	50%	0.501	S	S	.	.	H	α-helix	trans	-63.2	-43.2	175.4	-62.4	-20.3	0	0	0	110.6	K179 K180 R185 Q186 Y187	K179-D183 VanDerWaalsContact O-CG 3.28Å; K179-D183 PolarHBondContact O-N 3.48Å; K180-D183 PolarHBondContact O-N 3.2Å; D183-R185 VanDerWaalsContact C-N 3.35Å; D183-R185 PolarHBondContact O-N 3.33Å; D183-Q186 PolarHBondContact O-N 3.03Å; D183-Y187 PolarHBondContact O-N 3.24Å
184	Q	98.1	Very high	98.2	Very high	95 Å²	95	102 Å²	102	44%	0.444	50%	0.504	S	S	.	.	H	α-helix	trans	-61.9	-39.4	174.6	-73.4	178.4	-51.4	0	0	112.6	K180 L181 Q186 Y187 I188	K180-Q184 WeakPolarHBondContact O-CG 3.45Å; K180-Q184 PolarHBondContact O-N 3.41Å; L181-Q184 PolarHBondContact O-N 3.48Å; Q184-Q186 VanDerWaalsContact C-N 3.34Å; Q184-Q186 PolarHBondContact O-N 3.47Å; Q184-Y187 WeakPolarHBondContact O-CB 3.43Å; Q184-Y187 PolarHBondContact O-N 3.48Å; Q184-I188 WeakPolarHBondContact O-CG1 3.3Å; Q184-I188 PolarHBondContact O-N 3.05Å
185	R	98.5	Very high	98	Very high	168 Å²	168	98.5 Å²	98.5	63%	0.634	50%	0.495	S	S	*	.	H	α-helix	trans	-60.8	-43.5	175.1	-179.4	-179.9	179	175.9	2.7	111.7	L181 Q182 D183 V189	L181-R185 PolarHBondContact O-N 2.94Å; Q182-R185 WeakPolarHBondContact O-CB 3.5Å; Q182-R185 PolarHBondContact O-N 3.49Å; D183-R185 VanDerWaalsContact C-N 3.35Å; D183-R185 PolarHBondContact O-N 3.33Å; R185-V189 WeakPolarHBondContact O-CG2 3.46Å; R185-V189 PolarHBondContact O-N 3.42Å
186	Q	98.2	Very high	98	Very high	116 Å²	116	98 Å²	98	54%	0.542	49%	0.49	S	S	.	.	H	α-helix	trans	-65.1	-40.8	177.1	-71.6	177.2	-13.6	0	0	111.5	Q182 D183 Q184 V189 A190	Q182-Q186 PolarHBondContact O-N 3.33Å; Q182-Q186 VanDerWaalsContact O-N 3.09Å; D183-Q186 PolarHBondContact O-N 3.03Å; Q184-Q186 VanDerWaalsContact C-N 3.34Å; Q184-Q186 PolarHBondContact O-N 3.47Å; Q186-V189 PolarHBondContact O-N 3.05Å; Q186-A190 WeakPolarHBondContact O-CB 3.48Å; Q186-A190 PolarHBondContact O-N 3Å
187	Y	97.8	Very high	98	Very high	148 Å²	148	99 Å²	99	58%	0.58	48%	0.484	S	S	*	.	H	α-helix	trans	-58.9	-49.7	175.9	-173.7	-93.6	0	0	0	111.8	D183 Q184 V189 A190 E191	D183-Y187 PolarHBondContact O-N 3.24Å; Q184-Y187 WeakPolarHBondContact O-CB 3.43Å; Q184-Y187 PolarHBondContact O-N 3.48Å; Y187-V189 VanDerWaalsContact C-N 3.32Å; Y187-V189 PolarHBondContact O-N 3.18Å; Y187-A190 PolarHBondContact O-N 3.47Å; Y187-A190 VanDerWaalsContact O-N 3.15Å; Y187-E191 HydrophobicContact CD1-CG 3.85Å; Y187-E191 HydrophobicContact CE1-CG 3.42Å; Y187-E191 VanDerWaalsContact CE1-CG 3.42Å; Y187-E191 HydrophobicContact CE2-CG 4.34Å; Y187-E191 HydrophobicContact CG-CG 4.46Å; Y187-E191 WeakPolarHBondContact O-CG 3.33Å; Y187-E191 PolarHBondContact O-N 3.35Å; Y187-E191 PolarHBondContact OH-OE1 3.22Å
188	I	97.8	Very high	97.9	Very high	99 Å²	99	101.8 Å²	101.8	51%	0.508	49%	0.486	S	S	.	.	H	α-helix	trans	-55.4	-48	178.2	-67.8	164.5	0	0	0	111	Q184 A190 E191 F192	Q184-I188 WeakPolarHBondContact O-CG1 3.3Å; Q184-I188 PolarHBondContact O-N 3.05Å; I188-A190 PolarHBondContact O-N 3.02Å; I188-E191 PolarHBondContact O-N 2.9Å; I188-F192 HydrophobicContact CG2-CD2 4.03Å; I188-F192 HydrophobicContact CG2-CE2 4.19Å; I188-F192 WeakPolarHBondContact O-CD2 3.37Å; I188-F192 PolarHBondContact O-N 3.45Å
189	V	98.4	Very high	97.8	Very high	73 Å²	73	100.5 Å²	100.5	44%	0.442	48%	0.48	S	S	.	.	H	α-helix	trans	-60.4	-45.6	179.1	173	0	0	0	0	111.3	R185 Q186 Y187 E191 F192 E193	R185-V189 WeakPolarHBondContact O-CG2 3.46Å; R185-V189 PolarHBondContact O-N 3.42Å; Q186-V189 PolarHBondContact O-N 3.05Å; Y187-V189 VanDerWaalsContact C-N 3.32Å; Y187-V189 PolarHBondContact O-N 3.18Å; V189-E191 PolarHBondContact O-N 3Å; V189-F192 PolarHBondContact O-N 2.96Å; V189-E193 HydrophobicContact CG1-CG 4.32Å; V189-E193 WeakPolarHBondContact O-CB 3.46Å; V189-E193 WeakPolarHBondContact O-CG 2.92Å; V189-E193 PolarHBondContact O-N 3.46Å
190	A	98.3	Very high	97.8	Very high	37 Å²	37	99.2 Å²	99.2	31%	0.306	47%	0.471	S	S	.	.	H	α-helix	trans	-65.2	-37.1	-178.8	0	0	0	0	0	113.3	Q186 Y187 I188 Q194	Q186-A190 WeakPolarHBondContact O-CB 3.48Å; Q186-A190 PolarHBondContact O-N 3Å; Y187-A190 PolarHBondContact O-N 3.47Å; Y187-A190 VanDerWaalsContact O-N 3.15Å; I188-A190 PolarHBondContact O-N 3.02Å; A190-Q194 WeakPolarHBondContact O-CG 3.41Å; A190-Q194 PolarHBondContact O-N 3.34Å; A190-Q194 PolarHBondContact O-NE2 2.98Å; A190-Q194 VanDerWaalsContact O-NE2 3.15Å
191	E	97.2	Very high	97.8	Very high	83 Å²	83	96.8 Å²	96.8	39%	0.388	46%	0.461	S	S	.	.	H	α-helix	trans	-65	-45.9	176.2	-68.9	-61.2	118.6	0	0	111.5	Y187 I188 V189 Q194 G195	Y187-E191 HydrophobicContact CD1-CG 3.85Å; Y187-E191 HydrophobicContact CE1-CG 3.42Å; Y187-E191 VanDerWaalsContact CE1-CG 3.42Å; Y187-E191 HydrophobicContact CE2-CG 4.34Å; Y187-E191 HydrophobicContact CG-CG 4.46Å; Y187-E191 WeakPolarHBondContact O-CG 3.33Å; Y187-E191 PolarHBondContact O-N 3.35Å; Y187-E191 PolarHBondContact OH-OE1 3.22Å; I188-E191 PolarHBondContact O-N 2.9Å; V189-E191 PolarHBondContact O-N 3Å; E191-Q194 PolarHBondContact O-N 3.39Å; E191-G195 PolarHBondContact O-N 3.19Å; E191-G195 VanDerWaalsContact O-N 3.08Å
192	F	97.4	Very high	97.7	Very high	108 Å²	108	97.2 Å²	97.2	47%	0.474	46%	0.456	S	S	.	.	H	α-helix	trans	-67.9	-37.5	177.6	-85.5	-82.5	0	0	0	112.5	I188 V189 Q194 G195 H196	I188-F192 HydrophobicContact CG2-CD2 4.03Å; I188-F192 HydrophobicContact CG2-CE2 4.19Å; I188-F192 WeakPolarHBondContact O-CD2 3.37Å; I188-F192 PolarHBondContact O-N 3.45Å; V189-F192 PolarHBondContact O-N 2.96Å; F192-Q194 VanDerWaalsContact C-N 3.33Å; F192-Q194 PolarHBondContact O-N 3.46Å; F192-G195 PolarHBondContact O-N 2.71Å; F192-H196 WeakPolarHBondContact O-CB 3.42Å; F192-H196 PolarHBondContact O-CD2 3.16Å; F192-H196 PolarHBondContact O-N 2.81Å
193	E	98.2	Very high	97.6	Very high	121 Å²	121	98.7 Å²	98.7	57%	0.565	46%	0.463	S	S	*	.	H	α-helix	trans	-59.5	-42.5	174.8	-79.5	177.4	175.2	0	0	112.2	V189 H196 Q197	V189-E193 HydrophobicContact CG1-CG 4.32Å; V189-E193 WeakPolarHBondContact O-CB 3.46Å; V189-E193 WeakPolarHBondContact O-CG 2.92Å; V189-E193 PolarHBondContact O-N 3.46Å; E193-H196 PolarHBondContact O-N 3.11Å; E193-Q197 WeakPolarHBondContact O-CB 3.45Å; E193-Q197 PolarHBondContact O-N 3.44Å
194	Q	97.3	Very high	97.6	Very high	120 Å²	120	101.2 Å²	101.2	56%	0.561	47%	0.472	S	S	*	.	H	α-helix	trans	-62.4	-47.1	174.4	-72.9	171.3	66.1	0	0	111.7	A190 E191 F192 H196 Q197 F198	A190-Q194 WeakPolarHBondContact O-CG 3.41Å; A190-Q194 PolarHBondContact O-N 3.34Å; A190-Q194 PolarHBondContact O-NE2 2.98Å; A190-Q194 VanDerWaalsContact O-NE2 3.15Å; E191-Q194 PolarHBondContact O-N 3.39Å; F192-Q194 VanDerWaalsContact C-N 3.33Å; F192-Q194 PolarHBondContact O-N 3.46Å; Q194-H196 PolarHBondContact O-N 3.25Å; Q194-Q197 PolarHBondContact O-N 2.92Å; Q194-F198 PolarHBondContact O-N 3.36Å
195	G	96.2	Very high	97.5	Very high	34 Å²	34	101.2 Å²	101.2	35%	0.351	47%	0.472	S	S	.	.	H	α-helix	trans	-60.7	-44.7	176.7	0	0	0	0	0	112.8	E191 F192 Q197 F198 L199	E191-G195 PolarHBondContact O-N 3.19Å; E191-G195 VanDerWaalsContact O-N 3.08Å; F192-G195 PolarHBondContact O-N 2.71Å; G195-Q197 VanDerWaalsContact C-N 3.34Å; G195-Q197 PolarHBondContact O-N 3.24Å; G195-F198 PolarHBondContact O-N 3.29Å; G195-L199 WeakPolarHBondContact O-CG 3.46Å; G195-L199 PolarHBondContact O-N 3.35Å
196	H	97.6	Very high	97.4	Very high	95 Å²	95	94.9 Å²	94.9	44%	0.44	45%	0.45	S	S	.	.	H	α-helix	trans	-63.3	-38.7	175.9	-67.9	-42.9	0	0	0	112.5	F192 E193 Q194 L199 R200	F192-H196 WeakPolarHBondContact O-CB 3.42Å; F192-H196 PolarHBondContact O-CD2 3.16Å; F192-H196 PolarHBondContact O-N 2.81Å; E193-H196 PolarHBondContact O-N 3.11Å; Q194-H196 PolarHBondContact O-N 3.25Å; H196-L199 PolarHBondContact O-N 3.5Å; H196-R200 WeakPolarHBondContact O-CG 3.45Å; H196-R200 PolarHBondContact O-N 3.39Å
197	Q	98.1	Very high	97.4	Very high	80 Å²	80	94.1 Å²	94.1	37%	0.374	45%	0.449	S	S	.	.	H	α-helix	trans	-63.8	-46.8	175.9	-177.6	60.1	24.6	0	0	111.3	E193 Q194 G195 L199 R200 E201	E193-Q197 WeakPolarHBondContact O-CB 3.45Å; E193-Q197 PolarHBondContact O-N 3.44Å; Q194-Q197 PolarHBondContact O-N 2.92Å; G195-Q197 VanDerWaalsContact C-N 3.34Å; G195-Q197 PolarHBondContact O-N 3.24Å; Q197-L199 PolarHBondContact O-N 3.47Å; Q197-R200 PolarHBondContact O-N 3.33Å; Q197-E201 WeakPolarHBondContact CG-OE1 3.25Å; Q197-E201 PolarHBondContact NE2-OE1 3.47Å; Q197-E201 WeakPolarHBondContact O-CG 3.17Å; Q197-E201 PolarHBondContact O-N 3.07Å
198	F	97.3	Very high	97.4	Very high	112 Å²	112	91.8 Å²	91.8	49%	0.491	44%	0.444	S	S	.	.	H	α-helix	trans	-56.6	-48.4	175.5	171.5	-98	0	0	0	111.9	Q194 G195 R200 E201 R202	Q194-F198 PolarHBondContact O-N 3.36Å; G195-F198 PolarHBondContact O-N 3.29Å; F198-R200 PolarHBondContact O-N 3.25Å; F198-E201 PolarHBondContact O-N 2.63Å; F198-R202 HydrophobicContact CD1-CG 4.32Å; F198-R202 HydrophobicContact CD2-CG 4.3Å; F198-R202 HydrophobicContact CE1-CG 3.88Å; F198-R202 HydrophobicContact CE2-CG 3.87Å; F198-R202 HydrophobicContact CZ-CG 3.64Å; F198-R202 WeakPolarHBondContact O-CG 3.29Å; F198-R202 PolarHBondContact O-N 3.23Å
199	L	96.4	Very high	97.3	Very high	74 Å²	74	89 Å²	89	39%	0.387	43%	0.428	S	S	.	.	H	α-helix	trans	-62.7	-42.5	-179.8	-69.7	175.5	0	0	0	112.2	G195 H196 Q197 R202 E203 L297	G195-L199 WeakPolarHBondContact O-CG 3.46Å; G195-L199 PolarHBondContact O-N 3.35Å; H196-L199 PolarHBondContact O-N 3.5Å; Q197-L199 PolarHBondContact O-N 3.47Å; L199-R202 PolarHBondContact O-N 3.08Å; L199-E203 WeakPolarHBondContact O-CB 3.39Å; L199-E203 PolarHBondContact O-N 2.74Å; L199-L297 HydrophobicContact CD2-CD2 4.01Å
200	R	98.1	Very high	97.2	Very high	113 Å²	113	89 Å²	89	43%	0.426	43%	0.426	S	S	.	.	H	α-helix	trans	-59.6	-47.5	174.5	-76.6	-171.6	-63.1	-91.9	1.2	112.2	H196 Q197 F198 R202 E203 E204	H196-R200 WeakPolarHBondContact O-CG 3.45Å; H196-R200 PolarHBondContact O-N 3.39Å; Q197-R200 PolarHBondContact O-N 3.33Å; F198-R200 PolarHBondContact O-N 3.25Å; R200-R202 VanDerWaalsContact C-N 3.32Å; R200-R202 PolarHBondContact O-N 3.28Å; R200-E203 PolarHBondContact O-N 2.87Å; R200-E204 WeakPolarHBondContact O-CG 3.47Å; R200-E204 PolarHBondContact O-N 3.31Å
201	E	97.9	Very high	97.1	Very high	83 Å²	83	89.6 Å²	89.6	39%	0.388	43%	0.431	S	S	.	.	H	α-helix	trans	-63.4	-36.9	179.2	-72.3	174.7	-168.2	0	0	112.4	Q197 F198 H205	Q197-E201 WeakPolarHBondContact CG-OE1 3.25Å; Q197-E201 PolarHBondContact NE2-OE1 3.47Å; Q197-E201 WeakPolarHBondContact O-CG 3.17Å; Q197-E201 PolarHBondContact O-N 3.07Å; F198-E201 PolarHBondContact O-N 2.63Å; E201-H205 VanDerWaalsContact O-CB 3.32Å; E201-H205 WeakPolarHBondContact O-CB 3.38Å; E201-H205 PolarHBondContact O-N 2.92Å; E201-H205 VanDerWaalsContact O-N 3.14Å
202	R	95.8	Very high	97.1	Very high	115 Å²	115	90.5 Å²	90.5	43%	0.434	43%	0.433	S	S	.	.	H	α-helix	trans	-69.1	-42.1	174.8	-68.5	-54.1	90.2	142.3	7	112	F198 L199 R200 H205 L206	F198-R202 HydrophobicContact CD1-CG 4.32Å; F198-R202 HydrophobicContact CD2-CG 4.3Å; F198-R202 HydrophobicContact CE1-CG 3.88Å; F198-R202 HydrophobicContact CE2-CG 3.87Å; F198-R202 HydrophobicContact CZ-CG 3.64Å; F198-R202 WeakPolarHBondContact O-CG 3.29Å; F198-R202 PolarHBondContact O-N 3.23Å; L199-R202 PolarHBondContact O-N 3.08Å; R200-R202 VanDerWaalsContact C-N 3.32Å; R200-R202 PolarHBondContact O-N 3.28Å; R202-H205 PolarHBondContact O-N 3.01Å; R202-L206 WeakPolarHBondContact O-CG 3.49Å; R202-L206 PolarHBondContact O-N 3.37Å
203	E	97	Very high	97	Very high	120 Å²	120	86.3 Å²	86.3	56%	0.561	42%	0.416	S	S	*	.	H	α-helix	trans	-59.3	-51.8	176	-177.9	179.5	-176	0	0	111.1	L199 R200 H205 L206 L207	L199-E203 WeakPolarHBondContact O-CB 3.39Å; L199-E203 PolarHBondContact O-N 2.74Å; R200-E203 PolarHBondContact O-N 2.87Å; E203-H205 VanDerWaalsContact C-N 3.32Å; E203-H205 PolarHBondContact O-N 2.91Å; E203-L206 PolarHBondContact O-N 2.84Å; E203-L207 HydrophobicContact CG-CD1 4.13Å; E203-L207 WeakPolarHBondContact O-CG 3.35Å; E203-L207 PolarHBondContact O-N 3.44Å
204	E	97.9	Very high	96.9	Very high	132 Å²	132	86.9 Å²	86.9	62%	0.617	42%	0.419	S	S	*	.	H	α-helix	trans	-57.8	-42.6	177.2	-72.7	176.6	179	0	0	112	R200 L206 L207 E208	R200-E204 WeakPolarHBondContact O-CG 3.47Å; R200-E204 PolarHBondContact O-N 3.31Å; E204-L206 PolarHBondContact O-N 2.8Å; E204-L207 PolarHBondContact O-N 3.49Å; E204-E208 WeakPolarHBondContact O-CB 3.3Å; E204-E208 PolarHBondContact O-N 3.05Å
205	H	96.9	Very high	96.9	Very high	94 Å²	94	86.7 Å²	86.7	44%	0.435	42%	0.418	S	S	.	.	H	α-helix	trans	-65.2	-37.3	179.2	179.7	60.1	0	0	0	113.7	E201 R202 E203 Q209	E201-H205 VanDerWaalsContact O-CB 3.32Å; E201-H205 WeakPolarHBondContact O-CB 3.38Å; E201-H205 PolarHBondContact O-N 2.92Å; E201-H205 VanDerWaalsContact O-N 3.14Å; R202-H205 PolarHBondContact O-N 3.01Å; E203-H205 VanDerWaalsContact C-N 3.32Å; E203-H205 PolarHBondContact O-N 2.91Å; H205-Q209 PolarHBondContact CD2-NE2 3.26Å; H205-Q209 PolarHBondContact NE2-NE2 3.25Å; H205-Q209 PolarHBondContact O-N 3.01Å; H205-Q209 PolarHBondContact O-NE2 2.96Å
206	L	96.7	Very high	96.8	Very high	35 Å²	35	88.3 Å²	88.3	18%	0.183	42%	0.416	C	S	.	.	H	α-helix	trans	-71.2	-40.7	176.5	-72	170.2	0	0	0	111.3	R202 E203 E204 E208 Q209 L210 F286 L293	R202-L206 WeakPolarHBondContact O-CG 3.49Å; R202-L206 PolarHBondContact O-N 3.37Å; E203-L206 PolarHBondContact O-N 2.84Å; E204-L206 PolarHBondContact O-N 2.8Å; L206-E208 VanDerWaalsContact C-N 3.34Å; L206-Q209 PolarHBondContact O-N 2.9Å; L206-L210 PolarHBondContact O-N 3.33Å; L206-F286 HydrophobicContact CB-CZ 4.4Å; L206-F286 HydrophobicContact CD2-CE2 4.2Å; L206-F286 HydrophobicContact CD2-CZ 4.27Å; L206-L293 HydrophobicContact CD1-CD2 3.72Å
207	L	97.6	Very high	96.6	Very high	100 Å²	100	87 Å²	87	52%	0.524	41%	0.412	S	S	.	.	H	α-helix	trans	-63.5	-39.3	174.6	-68.8	173.2	0	0	0	111.8	E203 E204 L210 A211	E203-L207 HydrophobicContact CG-CD1 4.13Å; E203-L207 WeakPolarHBondContact O-CG 3.35Å; E203-L207 PolarHBondContact O-N 3.44Å; E204-L207 PolarHBondContact O-N 3.49Å; L207-L210 PolarHBondContact O-N 3.5Å; L207-A211 WeakPolarHBondContact O-CB 3.5Å; L207-A211 PolarHBondContact O-N 2.85Å
208	E	97.5	Very high	96.5	Very high	100 Å²	100	86.6 Å²	86.6	47%	0.467	42%	0.415	S	S	.	.	H	α-helix	trans	-64	-39.6	175.3	-165	-164.3	160	0	0	112.1	E204 L206 A211 K212	E204-E208 WeakPolarHBondContact O-CB 3.3Å; E204-E208 PolarHBondContact O-N 3.05Å; L206-E208 VanDerWaalsContact C-N 3.34Å; E208-A211 PolarHBondContact O-N 3.38Å; E208-K212 WeakPolarHBondContact O-CG 3.42Å; E208-K212 PolarHBondContact O-N 2.94Å; E208-K212 VanDerWaalsContact O-N 3.11Å; E208-K212 VanDerWaalsContact OE1-CE 3.25Å; E208-K212 WeakPolarHBondContact OE1-CE 3.47Å; E208-K212 IonicContact OE1-NZ 3.02Å; E208-K212 PolarHBondContact OE1-NZ 3.21Å
209	Q	95.5	Very high	96.3	Very high	39 Å²	39	85.6 Å²	85.6	18%	0.182	41%	0.412	C	S	.	.	H	α-helix	trans	-63.1	-43.3	174.1	-81.3	173.4	85.6	0	0	111.9	H205 L206 K212 L213 F286	H205-Q209 PolarHBondContact CD2-NE2 3.26Å; H205-Q209 PolarHBondContact NE2-NE2 3.25Å; H205-Q209 PolarHBondContact O-N 3.01Å; H205-Q209 PolarHBondContact O-NE2 2.96Å; L206-Q209 PolarHBondContact O-N 2.9Å; Q209-K212 PolarHBondContact O-N 3.45Å; Q209-L213 PolarHBondContact O-N 3.36Å; Q209-L213 VanDerWaalsContact O-N 3.12Å; Q209-F286 HydrophobicContact CB-CD2 4.33Å; Q209-F286 HydrophobicContact CB-CE2 3.85Å
210	L	95.9	Very high	96.1	Very high	73 Å²	73	83.5 Å²	83.5	38%	0.382	41%	0.408	S	S	.	.	H	α-helix	trans	-61.2	-45.4	175	-82.5	169	0	0	0	112.1	L206 L207 K212 L213 E214 F286	L206-L210 PolarHBondContact O-N 3.33Å; L207-L210 PolarHBondContact O-N 3.5Å; L210-K212 VanDerWaalsContact C-N 3.27Å; L210-K212 PolarHBondContact O-N 3.22Å; L210-L213 PolarHBondContact O-N 2.94Å; L210-L213 VanDerWaalsContact O-N 3.11Å; L210-E214 PolarHBondContact O-N 3.37Å; L210-F286 HydrophobicContact CD1-CE1 3.58Å; L210-F286 HydrophobicContact CD1-CZ 3.62Å; L210-F286 HydrophobicContact CD2-CD1 3.55Å; L210-F286 HydrophobicContact CD2-CD2 4.46Å; L210-F286 HydrophobicContact CD2-CE1 3.34Å; L210-F286 HydrophobicContact CD2-CE2 4.29Å; L210-F286 HydrophobicContact CD2-CG 4.15Å; L210-F286 HydrophobicContact CD2-CZ 3.78Å; L210-F286 HydrophobicContact CG-CD1 4.08Å; L210-F286 HydrophobicContact CG-CE1 3.38Å; L210-F286 HydrophobicContact CG-CE2 3.88Å; L210-F286 HydrophobicContact CG-CZ 3.29Å
211	A	97.4	Very high	95.9	Very high	51 Å²	51	86.5 Å²	86.5	42%	0.421	42%	0.42	S	S	.	.	H	α-helix	trans	-59.8	-37.8	178.6	0	0	0	0	0	112.1	L207 E208 E214 Q215	L207-A211 WeakPolarHBondContact O-CB 3.5Å; L207-A211 PolarHBondContact O-N 2.85Å; E208-A211 PolarHBondContact O-N 3.38Å; A211-E214 PolarHBondContact O-N 3.06Å; A211-Q215 WeakPolarHBondContact O-CB 3.41Å; A211-Q215 PolarHBondContact O-N 2.9Å
212	K	96.3	Very high	95.7	Very high	101 Å²	101	87.2 Å²	87.2	44%	0.439	42%	0.423	S	S	.	.	H	α-helix	trans	-64.6	-43	174.2	-72.3	169.8	-174.7	164.6	0	112	E208 Q209 L210 Q215 E216	E208-K212 WeakPolarHBondContact O-CG 3.42Å; E208-K212 PolarHBondContact O-N 2.94Å; E208-K212 VanDerWaalsContact O-N 3.11Å; E208-K212 VanDerWaalsContact OE1-CE 3.25Å; E208-K212 WeakPolarHBondContact OE1-CE 3.47Å; E208-K212 IonicContact OE1-NZ 3.02Å; E208-K212 PolarHBondContact OE1-NZ 3.21Å; Q209-K212 PolarHBondContact O-N 3.45Å; L210-K212 VanDerWaalsContact C-N 3.27Å; L210-K212 PolarHBondContact O-N 3.22Å; K212-Q215 PolarHBondContact O-N 2.93Å; K212-E216 WeakPolarHBondContact O-CG 3.46Å; K212-E216 PolarHBondContact O-N 3.19Å
213	L	95.5	Very high	95.5	Very high	20 Å²	20	88.3 Å²	88.3	11%	0.105	43%	0.431	C	S	.	.	H	α-helix	trans	-65.7	-40.5	176.3	-69.2	173.9	0	0	0	112.1	Q209 L210 Q215 E216 L217 K282 F286	Q209-L213 PolarHBondContact O-N 3.36Å; Q209-L213 VanDerWaalsContact O-N 3.12Å; L210-L213 PolarHBondContact O-N 2.94Å; L210-L213 VanDerWaalsContact O-N 3.11Å; L213-Q215 VanDerWaalsContact C-N 3.33Å; L213-Q215 PolarHBondContact O-N 3.39Å; L213-E216 PolarHBondContact O-N 2.82Å; L213-L217 WeakPolarHBondContact O-CB 3.49Å; L213-L217 WeakPolarHBondContact O-CG 3.48Å; L213-L217 PolarHBondContact O-N 3.18Å; L213-K282 HydrophobicContact CD2-CB 3.56Å; L213-K282 HydrophobicContact CD2-CD 3.68Å; L213-K282 HydrophobicContact CD2-CG 4.3Å; L213-F286 HydrophobicContact CD1-CB 4.04Å; L213-F286 HydrophobicContact CD1-CD2 4.24Å; L213-F286 HydrophobicContact CD1-CG 4.23Å
214	E	96.1	Very high	95.2	Very high	134 Å²	134	86 Å²	86	63%	0.626	42%	0.419	S	S	*	.	H	α-helix	trans	-61.6	-41.8	174.6	-174.4	-179.5	-176.5	0	0	111.5	L210 A211 L217 T218	L210-E214 PolarHBondContact O-N 3.37Å; A211-E214 PolarHBondContact O-N 3.06Å; E214-L217 PolarHBondContact O-N 3Å; E214-T218 WeakPolarHBondContact O-CB 3.33Å; E214-T218 PolarHBondContact O-N 2.89Å; E214-T218 PolarHBondContact O-OG1 3.47Å
215	Q	96.3	Very high	94.9	Very high	115 Å²	115	85.6 Å²	85.6	54%	0.537	42%	0.415	S	S	.	.	H	α-helix	trans	-62.9	-48.2	174.2	-175.4	-178.6	-8.8	0	0	111.6	A211 K212 L213 L217 T218 E219	A211-Q215 WeakPolarHBondContact O-CB 3.41Å; A211-Q215 PolarHBondContact O-N 2.9Å; K212-Q215 PolarHBondContact O-N 2.93Å; L213-Q215 VanDerWaalsContact C-N 3.33Å; L213-Q215 PolarHBondContact O-N 3.39Å; Q215-L217 VanDerWaalsContact C-N 3.3Å; Q215-L217 PolarHBondContact O-N 3.37Å; Q215-T218 PolarHBondContact O-N 3.48Å; Q215-T218 VanDerWaalsContact O-N 3.15Å; Q215-E219 HydrophobicContact CG-CG 4.42Å; Q215-E219 WeakPolarHBondContact CG-OE1 3.33Å; Q215-E219 PolarHBondContact NE2-OE1 2.83Å; Q215-E219 WeakPolarHBondContact O-CG 3.45Å; Q215-E219 PolarHBondContact O-N 3.11Å
216	E	94.3	Very high	94.7	Very high	69 Å²	69	84.7 Å²	84.7	32%	0.322	42%	0.42	S	S	.	.	H	α-helix	trans	-57.3	-42.4	177.4	-75.7	-177.9	-161.9	0	0	111.7	K212 L213 G220 V279 K282	K212-E216 WeakPolarHBondContact O-CG 3.46Å; K212-E216 PolarHBondContact O-N 3.19Å; L213-E216 PolarHBondContact O-N 2.82Å; E216-G220 PolarHBondContact O-N 3.44Å; E216-V279 HydrophobicContact CB-CG2 4.47Å; E216-K282 IonicContact OE1-NZ 3.75Å; E216-K282 PolarHBondContact OE1-NZ 2.99Å; E216-K282 IonicContact OE2-NZ 3.92Å; E216-K282 PolarHBondContact OE2-NZ 3.12Å
217	L	94.2	Very high	94.4	Very high	67 Å²	67	89.9 Å²	89.9	35%	0.351	44%	0.437	S	S	.	.	H	α-helix	trans	-66	-41.6	175.6	-78.2	168.1	0	0	0	112.3	L213 E214 Q215 G220 R221 I275 V279	L213-L217 WeakPolarHBondContact O-CB 3.49Å; L213-L217 WeakPolarHBondContact O-CG 3.48Å; L213-L217 PolarHBondContact O-N 3.18Å; E214-L217 PolarHBondContact O-N 3Å; Q215-L217 VanDerWaalsContact C-N 3.3Å; Q215-L217 PolarHBondContact O-N 3.37Å; L217-G220 PolarHBondContact O-N 2.93Å; L217-R221 WeakPolarHBondContact O-CB 3.19Å; L217-R221 PolarHBondContact O-N 3.26Å; L217-I275 HydrophobicContact CD2-CD1 4.39Å; L217-I275 HydrophobicContact CD2-CG1 4.32Å; L217-I275 HydrophobicContact CD2-CG2 4.07Å; L217-V279 HydrophobicContact CD2-CG1 3.55Å; L217-V279 HydrophobicContact CG-CG1 3.73Å
218	T	95.6	Very high	94	Very high	71 Å²	71	86 Å²	86	44%	0.436	42%	0.42	S	S	.	.	H	α-helix	trans	-66.3	-44.1	179.4	-59.4	0	0	0	0	111.2	E214 Q215 R221 E222	E214-T218 WeakPolarHBondContact O-CB 3.33Å; E214-T218 PolarHBondContact O-N 2.89Å; E214-T218 PolarHBondContact O-OG1 3.47Å; Q215-T218 PolarHBondContact O-N 3.48Å; Q215-T218 VanDerWaalsContact O-N 3.15Å; T218-R221 WeakPolarHBondContact O-CB 3.28Å; T218-R221 PolarHBondContact O-N 2.96Å; T218-E222 PolarHBondContact O-N 3.38Å; T218-E222 VanDerWaalsContact O-N 3.11Å
219	E	93.8	Very high	93.7	Very high	91 Å²	91	85.4 Å²	85.4	43%	0.425	42%	0.424	S	S	.	.	H	α-helix	trans	-64.6	-41.4	174.6	-70.5	179.6	-167.1	0	0	111.9	Q215 R221 E222 K223	Q215-E219 HydrophobicContact CG-CG 4.42Å; Q215-E219 WeakPolarHBondContact CG-OE1 3.33Å; Q215-E219 PolarHBondContact NE2-OE1 2.83Å; Q215-E219 WeakPolarHBondContact O-CG 3.45Å; Q215-E219 PolarHBondContact O-N 3.11Å; E219-R221 VanDerWaalsContact C-N 3.34Å; E219-E222 PolarHBondContact O-N 2.86Å; E219-K223 WeakPolarHBondContact O-CG 3.14Å; E219-K223 PolarHBondContact O-N 3.2Å; E219-K223 VanDerWaalsContact O-N 3.07Å
220	G	92	Very high	93.5	Very high	30 Å²	30	85.5 Å²	85.5	31%	0.309	44%	0.435	S	S	.	.	H	α-helix	trans	-59.9	-42.8	174.3	0	0	0	0	0	112.3	E216 L217 K223 F224	E216-G220 PolarHBondContact O-N 3.44Å; L217-G220 PolarHBondContact O-N 2.93Å; G220-K223 PolarHBondContact O-N 3.34Å; G220-F224 WeakPolarHBondContact O-CB 3.47Å; G220-F224 PolarHBondContact O-N 3.34Å
221	R	93.4	Very high	93.1	Very high	177 Å²	177	84.4 Å²	84.4	67%	0.668	43%	0.427	S	S	*	.	H	α-helix	trans	-60.8	-46.5	176.5	-178.7	-174.1	-179.1	-157.6	1.9	112.3	L217 T218 E219 F224 K225	L217-R221 WeakPolarHBondContact O-CB 3.19Å; L217-R221 PolarHBondContact O-N 3.26Å; T218-R221 WeakPolarHBondContact O-CB 3.28Å; T218-R221 PolarHBondContact O-N 2.96Å; E219-R221 VanDerWaalsContact C-N 3.34Å; R221-F224 PolarHBondContact O-N 2.96Å; R221-K225 WeakPolarHBondContact O-CB 3.48Å; R221-K225 PolarHBondContact O-N 3.48Å
222	E	93.5	Very high	92.8	Very high	97 Å²	97	87.8 Å²	87.8	45%	0.453	44%	0.438	S	S	.	.	H	α-helix	trans	-66.5	-38.3	178.8	-69.9	-55.3	139.1	0	0	112	T218 E219 S226	T218-E222 PolarHBondContact O-N 3.38Å; T218-E222 VanDerWaalsContact O-N 3.11Å; E219-E222 PolarHBondContact O-N 2.86Å; E222-S226 WeakPolarHBondContact O-CB 3.33Å; E222-S226 PolarHBondContact O-N 3.27Å; E222-S226 PolarHBondContact O-OG 3.05Å
223	K	91.4	Very high	92.6	Very high	139 Å²	139	85.6 Å²	85.6	60%	0.604	44%	0.438	S	S	*	.	H	α-helix	trans	-63.8	-43.6	172.8	-71.1	173.4	-171.7	168.6	0	112	E219 G220 S226 R227	E219-K223 WeakPolarHBondContact O-CG 3.14Å; E219-K223 PolarHBondContact O-N 3.2Å; E219-K223 VanDerWaalsContact O-N 3.07Å; G220-K223 PolarHBondContact O-N 3.34Å; K223-S226 WeakPolarHBondContact CA-OG 3.49Å; K223-S226 PolarHBondContact O-OG 3.05Å; K223-R227 WeakPolarHBondContact O-CB 3.4Å; K223-R227 PolarHBondContact O-N 3.13Å
224	F	91.1	Very high	92.2	Very high	71 Å²	71	90.3 Å²	90.3	31%	0.311	46%	0.455	S	S	.	.	H	α-helix	trans	-62.6	-47.3	177.5	-174.8	-92.2	0	0	0	111.5	G220 R221 R227 G228 W270 G272 P274	G220-F224 WeakPolarHBondContact O-CB 3.47Å; G220-F224 PolarHBondContact O-N 3.34Å; R221-F224 PolarHBondContact O-N 2.96Å; F224-R227 PolarHBondContact O-N 3.38Å; F224-G228 PolarHBondContact O-N 3.24Å; F224-W270 HydrophobicContact CD1-CH2 4.43Å; F224-W270 AromaticContact CD2-CH2 3.47Å; F224-W270 HydrophobicContact CD2-CH2 3.47Å; F224-W270 VanDerWaalsContact CD2-CH2 3.47Å; F224-W270 AromaticContact CD2-CZ2 3.87Å; F224-W270 HydrophobicContact CD2-CZ2 3.87Å; F224-W270 HydrophobicContact CE1-CH2 4.25Å; F224-W270 AromaticContact CE2-CH2 3.24Å; F224-W270 HydrophobicContact CE2-CH2 3.24Å; F224-W270 AromaticContact CE2-CZ2 3.72Å; F224-W270 HydrophobicContact CE2-CZ2 3.72Å; F224-W270 HydrophobicContact CE2-CZ3 4.17Å; F224-W270 HydrophobicContact CG-CH2 4.08Å; F224-W270 AromaticContact CZ-CH2 3.67Å; F224-W270 HydrophobicContact CZ-CH2 3.67Å; F224-W270 HydrophobicContact CZ-CZ3 4.18Å; F224-G272 WeakPolarHBondContact CE2-O 3.43Å; F224-P274 HydrophobicContact CD2-CB 4.42Å; F224-P274 HydrophobicContact CE2-CB 4.2Å; F224-P274 HydrophobicContact CE2-CG 4.13Å; F224-P274 HydrophobicContact CZ-CB 4.29Å; F224-P274 HydrophobicContact CZ-CG 3.99Å
225	K	92.2	Very high	91.9	Very high	124 Å²	124	85.8 Å²	85.8	54%	0.539	44%	0.435	S	S	.	.	H	α-helix	trans	-61.5	-47.6	177.9	-176.3	-178.1	176.2	-171.5	0	112	R221 R227 G228 V229	R221-K225 WeakPolarHBondContact O-CB 3.48Å; R221-K225 PolarHBondContact O-N 3.48Å; K225-R227 PolarHBondContact O-N 3.19Å; K225-G228 PolarHBondContact O-N 2.87Å; K225-V229 WeakPolarHBondContact O-CG2 2.9Å; K225-V229 PolarHBondContact O-N 3.38Å
226	S	92	Very high	91.7	Very high	75 Å²	75	82.8 Å²	82.8	52%	0.524	43%	0.43	S	S	.	.	H	α-helix	trans	-63.6	-39.3	179	52.1	0	0	0	0	112.6	E222 K223 V229 G230	E222-S226 WeakPolarHBondContact O-CB 3.33Å; E222-S226 PolarHBondContact O-N 3.27Å; E222-S226 PolarHBondContact O-OG 3.05Å; K223-S226 WeakPolarHBondContact CA-OG 3.49Å; K223-S226 PolarHBondContact O-OG 3.05Å; S226-V229 PolarHBondContact O-N 2.81Å; S226-G230 PolarHBondContact O-N 3.28Å
227	R	90.2	Very high	91.6	Very high	144 Å²	144	85 Å²	85	54%	0.543	44%	0.443	S	S	.	.	H	α-helix	trans	-63.2	-44.7	173.2	-171.9	169.6	-176.7	-175	1.7	112	K223 F224 K225 G230 E231 W270	K223-R227 WeakPolarHBondContact O-CB 3.4Å; K223-R227 PolarHBondContact O-N 3.13Å; F224-R227 PolarHBondContact O-N 3.38Å; K225-R227 PolarHBondContact O-N 3.19Å; R227-G230 PolarHBondContact O-N 3.15Å; R227-E231 PolarHBondContact O-N 2.79Å; R227-W270 HydrophobicContact CB-CH2 4.32Å; R227-W270 HydrophobicContact CB-CZ2 4.41Å; R227-W270 HydrophobicContact CG-CD2 4.18Å; R227-W270 HydrophobicContact CG-CE3 4.48Å; R227-W270 HydrophobicContact CG-CH2 4.3Å; R227-W270 HydrophobicContact CG-CZ2 4.05Å; R227-W270 VanDerWaalsContact NE-NE1 3.15Å
228	G	89.6	Confident	91.3	Very high	17 Å²	17	83.3 Å²	83.3	18%	0.175	44%	0.436	C	S	.	.	H	α-helix	trans	-59.8	-45.2	175.5	0	0	0	0	0	112.7	F224 K225 G230 E231 L232	F224-G228 PolarHBondContact O-N 3.24Å; K225-G228 PolarHBondContact O-N 2.87Å; G228-G230 PolarHBondContact O-N 2.88Å; G228-E231 PolarHBondContact O-N 3.42Å; G228-L232 WeakPolarHBondContact O-CB 3.48Å; G228-L232 VanDerWaalsContact O-CG 3.29Å; G228-L232 WeakPolarHBondContact O-CG 3.32Å; G228-L232 PolarHBondContact O-N 2.81Å
229	V	92.3	Very high	91	Very high	89 Å²	89	84.1 Å²	84.1	54%	0.539	44%	0.436	S	S	.	.	H	α-helix	trans	-61.3	-43.4	175.2	171.9	0	0	0	0	111.4	K225 S226 L232 A233	K225-V229 WeakPolarHBondContact O-CG2 2.9Å; K225-V229 PolarHBondContact O-N 3.38Å; S226-V229 PolarHBondContact O-N 2.81Å; V229-L232 PolarHBondContact O-N 3.02Å; V229-A233 WeakPolarHBondContact O-CB 3.32Å; V229-A233 PolarHBondContact O-N 2.69Å
230	G	90.6	Very high	91	Very high	40 Å²	40	83.3 Å²	83.3	41%	0.412	44%	0.441	S	S	.	.	H	α-helix	trans	-62.2	-44	177.3	0	0	0	0	0	113.1	S226 R227 G228 A233 R234	S226-G230 PolarHBondContact O-N 3.28Å; R227-G230 PolarHBondContact O-N 3.15Å; G228-G230 PolarHBondContact O-N 2.88Å; G230-A233 PolarHBondContact O-N 2.97Å; G230-R234 PolarHBondContact O-N 3.47Å
231	E	87.6	Confident	91	Very high	50 Å²	50	86.4 Å²	86.4	23%	0.234	45%	0.447	C	S	.	.	H	α-helix	trans	-66.5	-43.6	176.4	-73.5	-64.3	150.2	0	0	111.9	R227 G228 A233 R234 L235 W270	R227-E231 PolarHBondContact O-N 2.79Å; G228-E231 PolarHBondContact O-N 3.42Å; E231-A233 VanDerWaalsContact C-N 3.31Å; E231-A233 PolarHBondContact O-N 3.23Å; E231-R234 WeakPolarHBondContact O-CB 3.3Å; E231-R234 PolarHBondContact O-N 3.44Å; E231-R234 VanDerWaalsContact O-N 3.16Å; E231-R234 IonicContact OE1-NE 3.29Å; E231-R234 IonicContact OE2-CZ 3.76Å; E231-R234 VanDerWaalsContact OE2-CZ 3.29Å; E231-R234 IonicContact OE2-NE 2.67Å; E231-R234 PolarHBondContact OE2-NE 2.84Å; E231-R234 IonicContact OE2-NH2 2.91Å; E231-R234 PolarHBondContact OE2-NH2 3.09Å; E231-L235 WeakPolarHBondContact O-CG 3.4Å; E231-L235 PolarHBondContact O-N 3.19Å; E231-W270 HydrophobicContact CG-CB 3.88Å; E231-W270 HydrophobicContact CG-CG 4.38Å
232	L	90.5	Very high	90.8	Very high	123 Å²	123	81 Å²	81	64%	0.644	43%	0.431	S	S	*	.	H	α-helix	trans	-59.3	-41.6	175	-73.6	172.2	0	0	0	112	G228 V229 L235 A236	G228-L232 WeakPolarHBondContact O-CB 3.48Å; G228-L232 VanDerWaalsContact O-CG 3.29Å; G228-L232 WeakPolarHBondContact O-CG 3.32Å; G228-L232 PolarHBondContact O-N 2.81Å; V229-L232 PolarHBondContact O-N 3.02Å; L232-L235 PolarHBondContact O-N 2.87Å; L232-A236 WeakPolarHBondContact O-CB 3.38Å; L232-A236 PolarHBondContact O-N 2.97Å
233	A	92.4	Very high	90.7	Very high	54 Å²	54	82 Å²	82	45%	0.446	44%	0.436	S	S	.	.	H	α-helix	trans	-64	-40.9	175.4	0	0	0	0	0	112	V229 G230 E231 A236 L237	V229-A233 WeakPolarHBondContact O-CB 3.32Å; V229-A233 PolarHBondContact O-N 2.69Å; G230-A233 PolarHBondContact O-N 2.97Å; E231-A233 VanDerWaalsContact C-N 3.31Å; E231-A233 PolarHBondContact O-N 3.23Å; A233-A236 PolarHBondContact O-N 3.44Å; A233-L237 WeakPolarHBondContact O-CG 3.19Å; A233-L237 PolarHBondContact O-N 3.38Å; A233-L237 VanDerWaalsContact O-N 3.14Å
234	R	88	Confident	90.8	Very high	120 Å²	120	77.3 Å²	77.3	45%	0.453	43%	0.427	S	S	.	.	H	α-helix	trans	-61.6	-43.5	174.4	-172.4	-178.3	70.9	87.9	-0.6	111.5	G230 E231 L237 V238	G230-R234 PolarHBondContact O-N 3.47Å; E231-R234 WeakPolarHBondContact O-CB 3.3Å; E231-R234 PolarHBondContact O-N 3.44Å; E231-R234 VanDerWaalsContact O-N 3.16Å; E231-R234 IonicContact OE1-NE 3.29Å; E231-R234 IonicContact OE2-CZ 3.76Å; E231-R234 VanDerWaalsContact OE2-CZ 3.29Å; E231-R234 IonicContact OE2-NE 2.67Å; E231-R234 PolarHBondContact OE2-NE 2.84Å; E231-R234 IonicContact OE2-NH2 2.91Å; E231-R234 PolarHBondContact OE2-NH2 3.09Å; R234-L237 PolarHBondContact O-N 2.74Å; R234-V238 WeakPolarHBondContact O-CG2 3.38Å; R234-V238 PolarHBondContact O-N 2.9Å
235	L	88.7	Confident	90.7	Very high	38 Å²	38	75 Å²	75	20%	0.199	42%	0.417	C	S	.	.	H	α-helix	trans	-67.3	-40.8	177	-66.1	-173.7	0	0	0	112.5	E231 L232 L237 V238 I239 F269	E231-L235 WeakPolarHBondContact O-CG 3.4Å; E231-L235 PolarHBondContact O-N 3.19Å; L232-L235 PolarHBondContact O-N 2.87Å; L235-L237 VanDerWaalsContact C-N 3.29Å; L235-L237 PolarHBondContact O-N 2.83Å; L235-V238 PolarHBondContact O-N 3.43Å; L235-I239 WeakPolarHBondContact O-CB 3.34Å; L235-I239 WeakPolarHBondContact O-CD1 3.13Å; L235-I239 WeakPolarHBondContact O-CG1 3.36Å; L235-I239 PolarHBondContact O-N 2.84Å; L235-F269 HydrophobicContact CD1-CD1 3.51Å; L235-F269 HydrophobicContact CD1-CE1 3.79Å; L235-F269 HydrophobicContact CD1-CG 4.29Å; L235-F269 HydrophobicContact CD2-CD1 3.52Å; L235-F269 HydrophobicContact CD2-CE1 3.28Å; L235-F269 HydrophobicContact CD2-CZ 4.47Å; L235-F269 HydrophobicContact CG-CD1 4.11Å; L235-F269 HydrophobicContact CG-CE1 4.16Å
236	A	92.6	Very high	90.5	Very high	53 Å²	53	72.2 Å²	72.2	44%	0.438	42%	0.418	S	S	.	.	H	α-helix	trans	-57.5	-42.7	175.5	0	0	0	0	0	111.7	L232 A233 I239 S240	L232-A236 WeakPolarHBondContact O-CB 3.38Å; L232-A236 PolarHBondContact O-N 2.97Å; A233-A236 PolarHBondContact O-N 3.44Å; A236-I239 PolarHBondContact O-N 2.8Å; A236-S240 WeakPolarHBondContact O-CB 3.48Å; A236-S240 PolarHBondContact O-N 2.9Å; A236-S240 PolarHBondContact O-OG 2.55Å; A236-S240 VanDerWaalsContact O-OG 3.12Å
237	L	91.6	Very high	90.5	Very high	116 Å²	116	76.6 Å²	76.6	61%	0.607	43%	0.43	S	S	*	.	H	α-helix	trans	-61.6	-49.5	175.1	-71.4	171.3	0	0	0	112.2	A233 R234 L235 I239 S240 E241	A233-L237 WeakPolarHBondContact O-CG 3.19Å; A233-L237 PolarHBondContact O-N 3.38Å; A233-L237 VanDerWaalsContact O-N 3.14Å; R234-L237 PolarHBondContact O-N 2.74Å; L235-L237 VanDerWaalsContact C-N 3.29Å; L235-L237 PolarHBondContact O-N 2.83Å; L237-I239 VanDerWaalsContact C-N 3.34Å; L237-I239 PolarHBondContact O-N 2.85Å; L237-S240 PolarHBondContact O-N 2.85Å; L237-E241 WeakPolarHBondContact O-CG 3.5Å; L237-E241 PolarHBondContact O-N 3Å
238	V	88.8	Confident	90.5	Very high	31 Å²	31	72.9 Å²	72.9	19%	0.188	42%	0.419	C	S	.	.	H	α-helix	trans	-62.3	-41.6	179.4	172.1	0	0	0	0	111.6	R234 L235 E241 L242 Y264	R234-V238 WeakPolarHBondContact O-CG2 3.38Å; R234-V238 PolarHBondContact O-N 2.9Å; L235-V238 PolarHBondContact O-N 3.43Å; V238-E241 PolarHBondContact O-N 3.14Å; V238-L242 HydrophobicContact CG1-CD1 3.77Å; V238-L242 HydrophobicContact CG1-CG 4.44Å; V238-L242 WeakPolarHBondContact O-CB 3.26Å; V238-L242 WeakPolarHBondContact O-CG 3.34Å; V238-L242 PolarHBondContact O-N 2.84Å; V238-Y264 HydrophobicContact CB-CD1 4.33Å; V238-Y264 HydrophobicContact CB-CE1 4.29Å; V238-Y264 HydrophobicContact CG1-CD1 3.44Å; V238-Y264 VanDerWaalsContact CG1-CD1 3.44Å; V238-Y264 HydrophobicContact CG1-CE1 3.76Å; V238-Y264 HydrophobicContact CG1-CG 4.19Å; V238-Y264 HydrophobicContact CG2-CD1 4.02Å; V238-Y264 HydrophobicContact CG2-CE1 3.93Å
239	I	90	Very high	90.5	Very high	87 Å²	87	75.8 Å²	75.8	45%	0.446	43%	0.434	S	S	.	.	H	α-helix	trans	-60.6	-50.2	175.9	-70.6	165.5	0	0	0	109.8	L235 A236 L237 E241 L242 E243	L235-I239 WeakPolarHBondContact O-CB 3.34Å; L235-I239 WeakPolarHBondContact O-CD1 3.13Å; L235-I239 WeakPolarHBondContact O-CG1 3.36Å; L235-I239 PolarHBondContact O-N 2.84Å; A236-I239 PolarHBondContact O-N 2.8Å; L237-I239 VanDerWaalsContact C-N 3.34Å; L237-I239 PolarHBondContact O-N 2.85Å; I239-E241 VanDerWaalsContact C-N 3.31Å; I239-E241 PolarHBondContact O-N 3.27Å; I239-L242 PolarHBondContact O-N 3.1Å; I239-E243 HydrophobicContact CG2-CG 4.16Å; I239-E243 WeakPolarHBondContact O-CB 3.23Å; I239-E243 VanDerWaalsContact O-CG 3.3Å; I239-E243 WeakPolarHBondContact O-CG 3.39Å; I239-E243 PolarHBondContact O-N 2.93Å
240	S	93.5	Very high	90.4	Very high	74 Å²	74	75.1 Å²	75.1	52%	0.517	44%	0.438	S	S	.	.	H	α-helix	trans	-60.8	-37.4	178.2	-66	0	0	0	0	113.1	A236 L237 G244	A236-S240 WeakPolarHBondContact O-CB 3.48Å; A236-S240 PolarHBondContact O-N 2.9Å; A236-S240 PolarHBondContact O-OG 2.55Å; A236-S240 VanDerWaalsContact O-OG 3.12Å; L237-S240 PolarHBondContact O-N 2.85Å; S240-G244 PolarHBondContact O-N 3.1Å
241	E	90.3	Very high	90.2	Very high	95 Å²	95	76.7 Å²	76.7	44%	0.444	45%	0.447	S	S	.	.	H	α-helix	trans	-65.7	-44.1	175.1	-73.8	176.2	170.7	0	0	112.1	L237 V238 I239 G244 K245 F260 Y264	L237-E241 WeakPolarHBondContact O-CG 3.5Å; L237-E241 PolarHBondContact O-N 3Å; V238-E241 PolarHBondContact O-N 3.14Å; I239-E241 VanDerWaalsContact C-N 3.31Å; I239-E241 PolarHBondContact O-N 3.27Å; E241-G244 PolarHBondContact O-N 3.24Å; E241-K245 PolarHBondContact O-N 2.96Å; E241-F260 HydrophobicContact CB-CZ 4.43Å; E241-Y264 PolarHBondContact OE2-OH 2.73Å
242	L	89.4	Confident	90.1	Very high	64 Å²	64	79.2 Å²	79.2	34%	0.335	46%	0.459	S	S	.	.	H	α-helix	trans	-66.4	-44.9	177.5	-74.4	164.8	0	0	0	111.9	V238 I239 G244 K245 A246 F260 L261 Y264	V238-L242 HydrophobicContact CG1-CD1 3.77Å; V238-L242 HydrophobicContact CG1-CG 4.44Å; V238-L242 WeakPolarHBondContact O-CB 3.26Å; V238-L242 WeakPolarHBondContact O-CG 3.34Å; V238-L242 PolarHBondContact O-N 2.84Å; I239-L242 PolarHBondContact O-N 3.1Å; L242-G244 VanDerWaalsContact C-N 3.33Å; L242-K245 PolarHBondContact O-N 3.34Å; L242-A246 WeakPolarHBondContact O-CB 3.45Å; L242-A246 PolarHBondContact O-N 3.2Å; L242-F260 HydrophobicContact CD2-CE1 3.73Å; L242-F260 HydrophobicContact CD2-CZ 4.4Å; L242-L261 HydrophobicContact CD2-CD2 4.45Å; L242-Y264 HydrophobicContact CD2-CD2 4.19Å; L242-Y264 HydrophobicContact CD2-CE2 4.46Å
243	E	92.9	Very high	89.9	Confident	117 Å²	117	75.8 Å²	75.8	55%	0.547	44%	0.441	S	S	.	.	H	α-helix	trans	-60.1	-43.9	174.6	-73.6	176	154.7	0	0	111	I239 A246 Q247	I239-E243 HydrophobicContact CG2-CG 4.16Å; I239-E243 WeakPolarHBondContact O-CB 3.23Å; I239-E243 VanDerWaalsContact O-CG 3.3Å; I239-E243 WeakPolarHBondContact O-CG 3.39Å; I239-E243 PolarHBondContact O-N 2.93Å; E243-A246 PolarHBondContact O-N 2.84Å; E243-Q247 WeakPolarHBondContact O-CG 3.48Å; E243-Q247 PolarHBondContact O-N 2.79Å
244	G	92.1	Very high	89.6	Confident	42 Å²	42	80 Å²	80	43%	0.433	45%	0.453	S	S	.	.	H	α-helix	trans	-61.5	-45.5	175.8	0	0	0	0	0	113	S240 E241 L242 Q247	S240-G244 PolarHBondContact O-N 3.1Å; E241-G244 PolarHBondContact O-N 3.24Å; L242-G244 VanDerWaalsContact C-N 3.33Å; G244-Q247 PolarHBondContact O-N 2.78Å
245	K	88.9	Confident	89.2	Confident	21 Å²	21	80.8 Å²	80.8	9%	0.091	46%	0.462	C	S	.	.	H	α-helix	trans	-63.9	-40.3	176.3	-167.6	78.9	-179.1	164.2	0	111.2	E241 L242 Q247 Q248 L253 Q255 D256 F260	E241-K245 PolarHBondContact O-N 2.96Å; L242-K245 PolarHBondContact O-N 3.34Å; K245-Q247 PolarHBondContact O-N 2.85Å; K245-Q248 VanDerWaalsContact NZ-OE1 3.11Å; K245-Q248 WeakPolarHBondContact O-CB 3.11Å; K245-Q248 PolarHBondContact O-N 3.01Å; K245-Q248 VanDerWaalsContact O-N 3.15Å; K245-L253 HydrophobicContact CG-CD1 4.06Å; K245-L253 WeakPolarHBondContact O-CD1 3.42Å; K245-Q255 PolarHBondContact NZ-O 3.41Å; K245-D256 VanDerWaalsContact CE-OD1 3.23Å; K245-D256 WeakPolarHBondContact CE-OD1 3.39Å; K245-D256 IonicContact NZ-OD1 3.12Å; K245-D256 PolarHBondContact NZ-OD1 2.8Å; K245-D256 IonicContact NZ-OD2 2.8Å; K245-F260 HydrophobicContact CB-CD1 4.23Å; K245-F260 HydrophobicContact CB-CE1 3.56Å; K245-F260 HydrophobicContact CB-CE2 4.45Å; K245-F260 HydrophobicContact CB-CZ 3.7Å; K245-F260 HydrophobicContact CD-CD1 4.2Å; K245-F260 HydrophobicContact CD-CD2 4.25Å; K245-F260 HydrophobicContact CD-CE1 4.29Å; K245-F260 HydrophobicContact CD-CE2 4.36Å; K245-F260 HydrophobicContact CD-CG 4.17Å; K245-F260 HydrophobicContact CD-CZ 4.38Å; K245-F260 HydrophobicContact CG-CD1 3.74Å; K245-F260 HydrophobicContact CG-CE1 3.61Å; K245-F260 HydrophobicContact CG-CG 4.22Å; K245-F260 HydrophobicContact CG-CZ 4.04Å
246	A	88.7	Confident	88.7	Confident	67 Å²	67	82.8 Å²	82.8	55%	0.554	47%	0.473	S	S	*	.	H	α-helix	trans	-63.9	-24.3	180	0	0	0	0	0	114.2	L242 E243	L242-A246 WeakPolarHBondContact O-CB 3.45Å; L242-A246 PolarHBondContact O-N 3.2Å; E243-A246 PolarHBondContact O-N 2.84Å
247	Q	91.7	Very high	88.3	Confident	166 Å²	166	81.8 Å²	81.8	78%	0.776	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-0.8	177.3	-63.7	-65.2	-20.9	0	0	113.9	E243 G244 K245	E243-Q247 WeakPolarHBondContact O-CG 3.48Å; E243-Q247 PolarHBondContact O-N 2.79Å; G244-Q247 PolarHBondContact O-N 2.78Å; K245-Q247 PolarHBondContact O-N 2.85Å
248	Q	89.8	Confident	87.8	Confident	67 Å²	67	86 Å²	86	31%	0.313	47%	0.469	S	S	.	.	S	Bend	trans	-70.2	147.9	-179.9	-71.1	-176	-14.6	0	0	112.3	K245 E252 L253	K245-Q248 VanDerWaalsContact NZ-OE1 3.11Å; K245-Q248 WeakPolarHBondContact O-CB 3.11Å; K245-Q248 PolarHBondContact O-N 3.01Å; K245-Q248 VanDerWaalsContact O-N 3.15Å; Q248-E252 HydrophobicContact CB-CB 4.25Å; Q248-L253 HydrophobicContact CB-CB 4.31Å
249	P	90.7	Very high	87.6	Confident	77 Å²	77	89.3 Å²	89.3	50%	0.5	49%	0.486	S	S	.	.			trans	-54.5	146.1	170.6	-23.1	33	0	0	0	111.7	A251 E252 L253	P249-A251 PolarHBondContact O-N 3.47Å; P249-E252 PolarHBondContact O-N 3.18Å; P249-L253 PolarHBondContact O-N 3.43Å
250	A	88.8	Confident	87.3	Confident	75 Å²	75	86.1 Å²	86.1	62%	0.62	47%	0.469	S	S	*	.	H	α-helix	trans	-52	-35.5	-172	0	0	0	0	0	114.4	M254	A250-M254 WeakPolarHBondContact O-CB 3.35Å; A250-M254 WeakPolarHBondContact O-CG 3.5Å; A250-M254 PolarHBondContact O-N 2.88Å
251	A	88.1	Confident	86.8	Confident	73 Å²	73	87.4 Å²	87.4	60%	0.603	47%	0.469	S	S	*	.	H	α-helix	trans	-66.5	-38.9	177.5	0	0	0	0	0	113.3	P249 Q255	P249-A251 PolarHBondContact O-N 3.47Å; A251-Q255 WeakPolarHBondContact O-CG 3.34Å; A251-Q255 PolarHBondContact O-N 3.28Å
252	E	84.2	Confident	86.4	Confident	104 Å²	104	88.2 Å²	88.2	49%	0.486	48%	0.477	S	S	.	.	H	α-helix	trans	-80.1	-37.8	179.6	-67.6	174.7	-160.9	0	0	111.6	Q248 P249 M254 Q255	Q248-E252 HydrophobicContact CB-CB 4.25Å; P249-E252 PolarHBondContact O-N 3.18Å; E252-M254 VanDerWaalsContact C-N 3.28Å; E252-M254 PolarHBondContact O-N 2.95Å; E252-Q255 PolarHBondContact O-N 2.85Å; E252-Q255 VanDerWaalsContact O-O 3.09Å
253	L	87.4	Confident	86	Confident	51 Å²	51	93 Å²	93	27%	0.267	49%	0.49	S	S	.	.	H	α-helix	trans	-58.4	-44.4	175.4	175.6	61.1	0	0	0	110.7	K245 Q248 P249 T257	K245-L253 HydrophobicContact CG-CD1 4.06Å; K245-L253 WeakPolarHBondContact O-CD1 3.42Å; Q248-L253 HydrophobicContact CB-CB 4.31Å; P249-L253 PolarHBondContact O-N 3.43Å; L253-T257 HydrophobicContact CD1-CG2 4.22Å; L253-T257 WeakPolarHBondContact O-CB 3.42Å; L253-T257 PolarHBondContact O-OG1 3.21Å
254	M	85.6	Confident	85.4	Confident	141 Å²	141	90 Å²	90	70%	0.695	47%	0.474	S	S	*	.	H	α-helix	trans	-76.7	-18.5	-176.1	-67.9	-58	-60.7	0	0	113.9	A250 E252 D256 T257	A250-M254 WeakPolarHBondContact O-CB 3.35Å; A250-M254 WeakPolarHBondContact O-CG 3.5Å; A250-M254 PolarHBondContact O-N 2.88Å; E252-M254 VanDerWaalsContact C-N 3.28Å; E252-M254 PolarHBondContact O-N 2.95Å; M254-D256 PolarHBondContact O-N 2.91Å; M254-T257 WeakPolarHBondContact CA-OG1 3.43Å
255	Q	78.4	Confident	84.2	Confident	137 Å²	137	91.8 Å²	91.8	64%	0.64	48%	0.479	S	S	*	.	S	Bend	trans	-76	120.6	166.9	-73.4	175.5	10	0	0	107	K245 A251 E252 T257	K245-Q255 PolarHBondContact NZ-O 3.41Å; A251-Q255 WeakPolarHBondContact O-CG 3.34Å; A251-Q255 PolarHBondContact O-N 3.28Å; E252-Q255 PolarHBondContact O-N 2.85Å; E252-Q255 VanDerWaalsContact O-O 3.09Å; Q255-T257 PolarHBondContact O-N 3.12Å
256	D	80.3	Confident	83.1	Confident	80 Å²	80	103.1 Å²	103.1	43%	0.428	52%	0.521	S	S	.	.	S	Bend	trans	69.7	3.6	175.9	82.9	25.6	0	0	0	119.1	K245 M254 R258 D259 F260	K245-D256 VanDerWaalsContact CE-OD1 3.23Å; K245-D256 WeakPolarHBondContact CE-OD1 3.39Å; K245-D256 IonicContact NZ-OD1 3.12Å; K245-D256 PolarHBondContact NZ-OD1 2.8Å; K245-D256 IonicContact NZ-OD2 2.8Å; M254-D256 PolarHBondContact O-N 2.91Å; D256-R258 PolarHBondContact O-N 3.04Å; D256-D259 PolarHBondContact O-N 3.42Å; D256-F260 PolarHBondContact O-N 2.83Å
257	T	83.6	Confident	82	Confident	33 Å²	33	107.7 Å²	107.7	20%	0.202	53%	0.528	C	S	.	.	H	α-helix	trans	-49.8	-41.8	-176.5	-25.1	0	0	0	0	113	L253 M254 Q255 F260 L261	L253-T257 HydrophobicContact CD1-CG2 4.22Å; L253-T257 WeakPolarHBondContact O-CB 3.42Å; L253-T257 PolarHBondContact O-OG1 3.21Å; M254-T257 WeakPolarHBondContact CA-OG1 3.43Å; Q255-T257 PolarHBondContact O-N 3.12Å; T257-F260 PolarHBondContact O-N 2.95Å; T257-L261 HydrophobicContact CG2-CD1 4.21Å; T257-L261 HydrophobicContact CG2-CG 4.5Å; T257-L261 WeakPolarHBondContact O-CB 3.48Å; T257-L261 VanDerWaalsContact O-CG 3.29Å; T257-L261 WeakPolarHBondContact O-CG 3.22Å; T257-L261 PolarHBondContact O-N 3.24Å
258	R	81.4	Confident	80.7	Confident	203 Å²	203	109.4 Å²	109.4	77%	0.766	53%	0.533	S	S	*	.	H	α-helix	trans	-65.6	-43.8	-178.5	-168.4	174.9	-173.4	175.7	0.6	111.2	D256 F260 N262	D256-R258 PolarHBondContact O-N 3.04Å; R258-F260 VanDerWaalsContact C-N 3.34Å; R258-N262 WeakPolarHBondContact O-CB 3.27Å; R258-N262 PolarHBondContact O-N 3.42Å; R258-N262 PolarHBondContact O-ND2 3Å
259	D	82.8	Confident	79.6	Confident	101 Å²	101	112.5 Å²	112.5	54%	0.54	55%	0.546	S	S	.	.	H	α-helix	trans	-69.6	-35.8	178	-64.3	-21.4	0	0	0	111.1	D256 R263	D256-D259 PolarHBondContact O-N 3.42Å; D259-R263 WeakPolarHBondContact O-CG 3.32Å
260	F	84.5	Confident	78.5	Confident	21 Å²	21	111.8 Å²	111.8	9%	0.092	53%	0.533	C	S	.	.	H	α-helix	trans	-64.2	-50.2	174.4	-178.3	-100	0	0	0	111.7	E241 L242 K245 D256 T257 R258 N262 R263 Y264	E241-F260 HydrophobicContact CB-CZ 4.43Å; L242-F260 HydrophobicContact CD2-CE1 3.73Å; L242-F260 HydrophobicContact CD2-CZ 4.4Å; K245-F260 HydrophobicContact CB-CD1 4.23Å; K245-F260 HydrophobicContact CB-CE1 3.56Å; K245-F260 HydrophobicContact CB-CE2 4.45Å; K245-F260 HydrophobicContact CB-CZ 3.7Å; K245-F260 HydrophobicContact CD-CD1 4.2Å; K245-F260 HydrophobicContact CD-CD2 4.25Å; K245-F260 HydrophobicContact CD-CE1 4.29Å; K245-F260 HydrophobicContact CD-CE2 4.36Å; K245-F260 HydrophobicContact CD-CG 4.17Å; K245-F260 HydrophobicContact CD-CZ 4.38Å; K245-F260 HydrophobicContact CG-CD1 3.74Å; K245-F260 HydrophobicContact CG-CE1 3.61Å; K245-F260 HydrophobicContact CG-CG 4.22Å; K245-F260 HydrophobicContact CG-CZ 4.04Å; D256-F260 PolarHBondContact O-N 2.83Å; T257-F260 PolarHBondContact O-N 2.95Å; R258-F260 VanDerWaalsContact C-N 3.34Å; F260-N262 VanDerWaalsContact C-N 3.3Å; F260-N262 PolarHBondContact O-N 2.87Å; F260-R263 WeakPolarHBondContact O-CB 3.48Å; F260-R263 PolarHBondContact O-N 3.34Å; F260-R263 VanDerWaalsContact O-N 3.09Å; F260-Y264 HydrophobicContact CD1-CE2 4.21Å; F260-Y264 HydrophobicContact CD2-CE2 4.17Å; F260-Y264 HydrophobicContact CE1-CD2 4.49Å; F260-Y264 AromaticContact CE1-CE2 3.86Å; F260-Y264 HydrophobicContact CE1-CE2 3.86Å; F260-Y264 AromaticContact CE2-CE2 3.78Å; F260-Y264 HydrophobicContact CE2-CE2 3.78Å; F260-Y264 HydrophobicContact CG-CE2 4.37Å; F260-Y264 AromaticContact CZ-CE2 3.62Å; F260-Y264 HydrophobicContact CZ-CE2 3.62Å; F260-Y264 VanDerWaalsContact O-CD2 3.28Å; F260-Y264 WeakPolarHBondContact O-CD2 3.49Å; F260-Y264 WeakPolarHBondContact O-CE2 3.21Å
261	L	83	Confident	77.6	Confident	100 Å²	100	114.8 Å²	114.8	52%	0.524	54%	0.543	S	S	.	.	H	α-helix	trans	-63.7	-34.8	178.6	-71	174.1	0	0	0	112.3	L242 T257 R263 Y264	L242-L261 HydrophobicContact CD2-CD2 4.45Å; T257-L261 HydrophobicContact CG2-CD1 4.21Å; T257-L261 HydrophobicContact CG2-CG 4.5Å; T257-L261 WeakPolarHBondContact O-CB 3.48Å; T257-L261 VanDerWaalsContact O-CG 3.29Å; T257-L261 WeakPolarHBondContact O-CG 3.22Å; T257-L261 PolarHBondContact O-N 3.24Å; L261-R263 PolarHBondContact O-N 2.83Å; L261-R263 VanDerWaalsContact O-N 3.17Å; L261-Y264 PolarHBondContact O-N 3.1Å
262	N	82.5	Confident	77	Confident	113 Å²	113	112.4 Å²	112.4	60%	0.604	53%	0.526	S	S	*	.	H	α-helix	trans	-62.5	-19.2	175.5	-74.7	-19.4	0	0	0	113.5	R258 F260 Y264	R258-N262 WeakPolarHBondContact O-CB 3.27Å; R258-N262 PolarHBondContact O-N 3.42Å; R258-N262 PolarHBondContact O-ND2 3Å; F260-N262 VanDerWaalsContact C-N 3.3Å; F260-N262 PolarHBondContact O-N 2.87Å; N262-Y264 VanDerWaalsContact C-N 3.28Å
263	R	81.3	Confident	76.9	Confident	163 Å²	163	116.5 Å²	116.5	62%	0.615	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-18.5	174.7	-62.7	177.6	-165.9	165.1	5.6	113.3	D259 F260 L261 P265	D259-R263 WeakPolarHBondContact O-CG 3.32Å; F260-R263 WeakPolarHBondContact O-CB 3.48Å; F260-R263 PolarHBondContact O-N 3.34Å; F260-R263 VanDerWaalsContact O-N 3.09Å; L261-R263 PolarHBondContact O-N 2.83Å; L261-R263 VanDerWaalsContact O-N 3.17Å; R263-P265 VanDerWaalsContact O-CD 3.23Å; R263-P265 WeakPolarHBondContact O-CD 3.45Å
264	Y	78.6	Confident	76.8	Confident	54 Å²	54	118.2 Å²	118.2	21%	0.212	56%	0.556	C	S	.	*	S	Bend	trans	-120.1	67.6	-178	-46.6	-80.4	0	0	0	110.1	V238 E241 L242 F260 L261 N262 R266	V238-Y264 HydrophobicContact CB-CD1 4.33Å; V238-Y264 HydrophobicContact CB-CE1 4.29Å; V238-Y264 HydrophobicContact CG1-CD1 3.44Å; V238-Y264 VanDerWaalsContact CG1-CD1 3.44Å; V238-Y264 HydrophobicContact CG1-CE1 3.76Å; V238-Y264 HydrophobicContact CG1-CG 4.19Å; V238-Y264 HydrophobicContact CG2-CD1 4.02Å; V238-Y264 HydrophobicContact CG2-CE1 3.93Å; E241-Y264 PolarHBondContact OE2-OH 2.73Å; L242-Y264 HydrophobicContact CD2-CD2 4.19Å; L242-Y264 HydrophobicContact CD2-CE2 4.46Å; F260-Y264 HydrophobicContact CD1-CE2 4.21Å; F260-Y264 HydrophobicContact CD2-CE2 4.17Å; F260-Y264 HydrophobicContact CE1-CD2 4.49Å; F260-Y264 AromaticContact CE1-CE2 3.86Å; F260-Y264 HydrophobicContact CE1-CE2 3.86Å; F260-Y264 AromaticContact CE2-CE2 3.78Å; F260-Y264 HydrophobicContact CE2-CE2 3.78Å; F260-Y264 HydrophobicContact CG-CE2 4.37Å; F260-Y264 AromaticContact CZ-CE2 3.62Å; F260-Y264 HydrophobicContact CZ-CE2 3.62Å; F260-Y264 VanDerWaalsContact O-CD2 3.28Å; F260-Y264 WeakPolarHBondContact O-CD2 3.49Å; F260-Y264 WeakPolarHBondContact O-CE2 3.21Å; L261-Y264 PolarHBondContact O-N 3.1Å; N262-Y264 VanDerWaalsContact C-N 3.28Å; Y264-R266 PolarHBondContact O-N 3.34Å
265	P	67.3	Low	77	Confident	81 Å²	81	115.8 Å²	115.8	53%	0.526	55%	0.545	S	S	.	.			trans	-56	140.2	171.9	24	-31	0	0	0	108.9	R263 K267	R263-P265 VanDerWaalsContact O-CD 3.23Å; R263-P265 WeakPolarHBondContact O-CD 3.45Å; P265-K267 HydrophobicContact CB-CG 4.45Å; P265-K267 HydrophobicContact CG-CG 4.29Å; P265-K267 PolarHBondContact O-N 3.5Å
266	R	66.1	Low	77.5	Confident	259 Å²	259	112.2 Å²	112.2	98%	0.977	54%	0.539	S	S	*	.			trans	-64.7	77.3	172.8	-71.9	-177.1	176.3	-179.9	-1.6	109.3	Y264	Y264-R266 PolarHBondContact O-N 3.34Å
267	K	65.6	Low	78	Confident	162 Å²	162	117.9 Å²	117.9	70%	0.704	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-86	142.3	170.9	-72.9	-167.7	173.7	-165.4	0	109	P265 F269	P265-K267 HydrophobicContact CB-CG 4.45Å; P265-K267 HydrophobicContact CG-CG 4.29Å; P265-K267 PolarHBondContact O-N 3.5Å; K267-F269 PolarHBondContact O-N 2.85Å
268	K	64.9	Low	78.4	Confident	202 Å²	202	120.9 Å²	120.9	88%	0.878	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-55.3	130	169.6	-69.1	-179.2	179.6	175.4	0	108.3
269	F	66.2	Low	79	Confident	133 Å²	133	112 Å²	112	58%	0.583	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-65.4	154.8	174.4	-59.9	-72	0	0	0	109.9	L235 K267 V271	L235-F269 HydrophobicContact CD1-CD1 3.51Å; L235-F269 HydrophobicContact CD1-CE1 3.79Å; L235-F269 HydrophobicContact CD1-CG 4.29Å; L235-F269 HydrophobicContact CD2-CD1 3.52Å; L235-F269 HydrophobicContact CD2-CE1 3.28Å; L235-F269 HydrophobicContact CD2-CZ 4.47Å; L235-F269 HydrophobicContact CG-CD1 4.11Å; L235-F269 HydrophobicContact CG-CE1 4.16Å; K267-F269 PolarHBondContact O-N 2.85Å; F269-V271 PolarHBondContact O-N 2.8Å; F269-V271 VanDerWaalsContact O-N 3.13Å
270	W	67.8	Low	79.4	Confident	62 Å²	62	114.8 Å²	114.8	24%	0.235	55%	0.548	C	S	.	.	P	Polyproline II helix	trans	-62	118.7	177.3	175.5	72.6	0	0	0	110.6	F224 R227 E231	F224-W270 HydrophobicContact CD1-CH2 4.43Å; F224-W270 AromaticContact CD2-CH2 3.47Å; F224-W270 HydrophobicContact CD2-CH2 3.47Å; F224-W270 VanDerWaalsContact CD2-CH2 3.47Å; F224-W270 AromaticContact CD2-CZ2 3.87Å; F224-W270 HydrophobicContact CD2-CZ2 3.87Å; F224-W270 HydrophobicContact CE1-CH2 4.25Å; F224-W270 AromaticContact CE2-CH2 3.24Å; F224-W270 HydrophobicContact CE2-CH2 3.24Å; F224-W270 AromaticContact CE2-CZ2 3.72Å; F224-W270 HydrophobicContact CE2-CZ2 3.72Å; F224-W270 HydrophobicContact CE2-CZ3 4.17Å; F224-W270 HydrophobicContact CG-CH2 4.08Å; F224-W270 AromaticContact CZ-CH2 3.67Å; F224-W270 HydrophobicContact CZ-CH2 3.67Å; F224-W270 HydrophobicContact CZ-CZ3 4.18Å; R227-W270 HydrophobicContact CB-CH2 4.32Å; R227-W270 HydrophobicContact CB-CZ2 4.41Å; R227-W270 HydrophobicContact CG-CD2 4.18Å; R227-W270 HydrophobicContact CG-CE3 4.48Å; R227-W270 HydrophobicContact CG-CH2 4.3Å; R227-W270 HydrophobicContact CG-CZ2 4.05Å; R227-W270 VanDerWaalsContact NE-NE1 3.15Å; E231-W270 HydrophobicContact CG-CB 3.88Å; E231-W270 HydrophobicContact CG-CG 4.38Å
271	V	70.5	Confident	79.9	Confident	137 Å²	137	120.6 Å²	120.6	83%	0.83	57%	0.573	S	S	*	*			trans	-127.4	81.9	168.6	-175.1	0	0	0	0	107	F269	F269-V271 PolarHBondContact O-N 2.8Å; F269-V271 VanDerWaalsContact O-N 3.13Å
272	G	74.6	Confident	80.5	Confident	23 Å²	23	119 Å²	119	24%	0.237	56%	0.562	C	S	.	*			trans	-80	152.6	175.6	0	0	0	0	0	111.8	F224	F224-G272 WeakPolarHBondContact CE2-O 3.43Å
273	K	82.7	Confident	80.9	Confident	191 Å²	191	116.4 Å²	116.4	83%	0.83	55%	0.551	S	S	*	*			trans	-67.9	132.8	167.7	-67.9	-177.2	180	177.2	0	109.5	I275	K273-I275 VanDerWaalsContact C-N 3.33Å; K273-I275 PolarHBondContact O-N 2.83Å
274	P	85.2	Confident	81.5	Confident	87 Å²	87	110.2 Å²	110.2	57%	0.565	54%	0.537	S	S	*	.	S	Bend	trans	-65.1	-31.1	-178	-24.5	34	0	0	0	115	F224	F224-P274 HydrophobicContact CD2-CB 4.42Å; F224-P274 HydrophobicContact CE2-CB 4.2Å; F224-P274 HydrophobicContact CE2-CG 4.13Å; F224-P274 HydrophobicContact CZ-CB 4.29Å; F224-P274 HydrophobicContact CZ-CG 3.99Å
275	I	89.8	Confident	82.3	Confident	90 Å²	90	111.6 Å²	111.6	46%	0.462	55%	0.546	S	S	.	.	S	Bend	trans	-119.4	130.2	-177.2	-57.7	174.1	0	0	0	108.1	L217 K273 V279 K280	L217-I275 HydrophobicContact CD2-CD1 4.39Å; L217-I275 HydrophobicContact CD2-CG1 4.32Å; L217-I275 HydrophobicContact CD2-CG2 4.07Å; K273-I275 VanDerWaalsContact C-N 3.33Å; K273-I275 PolarHBondContact O-N 2.83Å; I275-V279 HydrophobicContact CG2-CB 4.07Å; I275-V279 HydrophobicContact CG2-CG1 4.2Å; I275-K280 HydrophobicContact CG2-CB 4.36Å
276	A	88.2	Confident	83.6	Confident	62 Å²	62	108.1 Å²	108.1	51%	0.512	52%	0.522	S	S	.	.			trans	-66.6	141.5	176.5	0	0	0	0	0	111	V278 V279 K280	A276-V278 PolarHBondContact O-N 3.4Å; A276-V278 VanDerWaalsContact O-N 3.13Å; A276-V279 HydrophobicContact CB-CG2 4.23Å; A276-V279 PolarHBondContact O-N 2.91Å; A276-K280 PolarHBondContact O-N 3.21Å
277	R	91.1	Very high	84.9	Confident	198 Å²	198	98.6 Å²	98.6	75%	0.747	50%	0.496	S	S	*	.	H	α-helix	trans	-50.7	-40.5	179.7	-172.9	179	-179.5	-177.4	0.7	112.3	V279 K280 K281	R277-V279 PolarHBondContact O-N 2.82Å; R277-K280 PolarHBondContact O-N 3.42Å; R277-K281 PolarHBondContact O-N 2.81Å
278	V	92.7	Very high	86.3	Confident	97 Å²	97	95.3 Å²	95.3	59%	0.588	49%	0.485	S	S	*	.	H	α-helix	trans	-61.3	-43.4	177.7	-179.6	0	0	0	0	112	A276 K281 K282	A276-V278 PolarHBondContact O-N 3.4Å; A276-V278 VanDerWaalsContact O-N 3.13Å; V278-K281 PolarHBondContact O-N 3.08Å; V278-K282 WeakPolarHBondContact O-CG 2.97Å; V278-K282 PolarHBondContact O-N 3.28Å
279	V	92.7	Very high	87.6	Confident	17 Å²	17	90 Å²	90	10%	0.103	46%	0.462	C	S	.	.	H	α-helix	trans	-69.2	-42.6	179.3	-178.8	0	0	0	0	110	E216 L217 I275 A276 R277 K281 K282 T283	E216-V279 HydrophobicContact CB-CG2 4.47Å; L217-V279 HydrophobicContact CD2-CG1 3.55Å; L217-V279 HydrophobicContact CG-CG1 3.73Å; I275-V279 HydrophobicContact CG2-CB 4.07Å; I275-V279 HydrophobicContact CG2-CG1 4.2Å; A276-V279 HydrophobicContact CB-CG2 4.23Å; A276-V279 PolarHBondContact O-N 2.91Å; R277-V279 PolarHBondContact O-N 2.82Å; V279-K281 VanDerWaalsContact C-N 3.33Å; V279-K281 PolarHBondContact O-N 2.83Å; V279-K282 PolarHBondContact O-N 2.78Å; V279-T283 PolarHBondContact O-N 2.89Å; V279-T283 PolarHBondContact O-OG1 2.85Å
280	K	92.9	Very high	89	Confident	159 Å²	159	87 Å²	87	69%	0.691	45%	0.452	S	S	*	.	H	α-helix	trans	-57.2	-45.6	174.7	-170.4	-175.8	178.6	-168.1	0	111.4	I275 A276 R277 T283 G284	I275-K280 HydrophobicContact CG2-CB 4.36Å; A276-K280 PolarHBondContact O-N 3.21Å; R277-K280 PolarHBondContact O-N 3.42Å; K280-T283 PolarHBondContact O-N 2.95Å; K280-G284 PolarHBondContact O-N 2.7Å; K280-G284 VanDerWaalsContact O-N 3.1Å
281	K	94.7	Very high	90.1	Very high	142 Å²	142	89 Å²	89	62%	0.617	47%	0.467	S	S	*	.	H	α-helix	trans	-60.4	-49.8	176.5	-172.6	178.8	-178.4	176.9	0	111.7	R277 V278 V279 T283 G284 E285	R277-K281 PolarHBondContact O-N 2.81Å; V278-K281 PolarHBondContact O-N 3.08Å; V279-K281 VanDerWaalsContact C-N 3.33Å; V279-K281 PolarHBondContact O-N 2.83Å; K281-T283 VanDerWaalsContact C-N 3.26Å; K281-T283 PolarHBondContact O-N 3.02Å; K281-G284 PolarHBondContact O-N 2.85Å; K281-G284 VanDerWaalsContact O-N 3.08Å; K281-E285 WeakPolarHBondContact CE-OE1 3.37Å; K281-E285 HydrophobicContact CG-CG 4.46Å; K281-E285 WeakPolarHBondContact O-CG 3.44Å; K281-E285 PolarHBondContact O-N 2.99Å
282	K	94.5	Very high	91.1	Very high	67 Å²	67	85.1 Å²	85.1	29%	0.291	45%	0.446	S	S	.	.	H	α-helix	trans	-60.1	-34.2	177.4	-69.9	179.1	-176.2	173.8	0	113	L213 E216 V278 V279 F286	L213-K282 HydrophobicContact CD2-CB 3.56Å; L213-K282 HydrophobicContact CD2-CD 3.68Å; L213-K282 HydrophobicContact CD2-CG 4.3Å; E216-K282 IonicContact OE1-NZ 3.75Å; E216-K282 PolarHBondContact OE1-NZ 2.99Å; E216-K282 IonicContact OE2-NZ 3.92Å; E216-K282 PolarHBondContact OE2-NZ 3.12Å; V278-K282 WeakPolarHBondContact O-CG 2.97Å; V278-K282 PolarHBondContact O-N 3.28Å; V279-K282 PolarHBondContact O-N 2.78Å; K282-F286 WeakPolarHBondContact O-CB 3.29Å; K282-F286 PolarHBondContact O-N 3.25Å
283	T	92.6	Very high	92	Very high	59 Å²	59	87.2 Å²	87.2	36%	0.362	45%	0.451	S	S	.	.	H	α-helix	trans	-65.8	-42.3	174.4	-56.6	0	0	0	0	111.4	V279 K280 K281 F286 S287	V279-T283 PolarHBondContact O-N 2.89Å; V279-T283 PolarHBondContact O-OG1 2.85Å; K280-T283 PolarHBondContact O-N 2.95Å; K281-T283 VanDerWaalsContact C-N 3.26Å; K281-T283 PolarHBondContact O-N 3.02Å; T283-F286 PolarHBondContact O-N 2.59Å; T283-S287 PolarHBondContact O-N 2.9Å; T283-S287 VanDerWaalsContact O-N 3.12Å; T283-S287 PolarHBondContact O-OG 2.85Å
284	G	93.1	Very high	92.4	Very high	32 Å²	32	84 Å²	84	33%	0.33	44%	0.439	S	S	.	.	H	α-helix	trans	-59.9	-53.9	172.8	0	0	0	0	0	112.1	K280 K281 F286 S287 D288	K280-G284 PolarHBondContact O-N 2.7Å; K280-G284 VanDerWaalsContact O-N 3.1Å; K281-G284 PolarHBondContact O-N 2.85Å; K281-G284 VanDerWaalsContact O-N 3.08Å; G284-F286 PolarHBondContact O-N 3.41Å; G284-S287 WeakPolarHBondContact O-CA 3.4Å; G284-S287 VanDerWaalsContact O-CB 3.28Å; G284-S287 WeakPolarHBondContact O-CB 3.09Å; G284-S287 PolarHBondContact O-N 2.78Å; G284-D288 PolarHBondContact O-N 2.9Å; G284-D288 VanDerWaalsContact O-N 3.1Å
285	E	94.5	Very high	92.6	Very high	83 Å²	83	85.5 Å²	85.5	39%	0.388	43%	0.434	S	S	.	.	H	α-helix	trans	-55.7	-31.3	177.2	-68.3	171.6	-173.5	0	0	112.7	K281 K289	K281-E285 WeakPolarHBondContact CE-OE1 3.37Å; K281-E285 HydrophobicContact CG-CG 4.46Å; K281-E285 WeakPolarHBondContact O-CG 3.44Å; K281-E285 PolarHBondContact O-N 2.99Å; E285-K289 WeakPolarHBondContact O-CG 3.11Å; E285-K289 PolarHBondContact O-N 2.8Å
286	F	95.2	Very high	92.8	Very high	9 Å²	9	82.8 Å²	82.8	4%	0.039	43%	0.428	C	S	.	.	H	α-helix	trans	-73.7	-37.4	175.4	-164.7	-83.8	0	0	0	112.3	L206 Q209 L210 L213 K282 T283 G284 D288 K289 L290	L206-F286 HydrophobicContact CB-CZ 4.4Å; L206-F286 HydrophobicContact CD2-CE2 4.2Å; L206-F286 HydrophobicContact CD2-CZ 4.27Å; Q209-F286 HydrophobicContact CB-CD2 4.33Å; Q209-F286 HydrophobicContact CB-CE2 3.85Å; L210-F286 HydrophobicContact CD1-CE1 3.58Å; L210-F286 HydrophobicContact CD1-CZ 3.62Å; L210-F286 HydrophobicContact CD2-CD1 3.55Å; L210-F286 HydrophobicContact CD2-CD2 4.46Å; L210-F286 HydrophobicContact CD2-CE1 3.34Å; L210-F286 HydrophobicContact CD2-CE2 4.29Å; L210-F286 HydrophobicContact CD2-CG 4.15Å; L210-F286 HydrophobicContact CD2-CZ 3.78Å; L210-F286 HydrophobicContact CG-CD1 4.08Å; L210-F286 HydrophobicContact CG-CE1 3.38Å; L210-F286 HydrophobicContact CG-CE2 3.88Å; L210-F286 HydrophobicContact CG-CZ 3.29Å; L213-F286 HydrophobicContact CD1-CB 4.04Å; L213-F286 HydrophobicContact CD1-CD2 4.24Å; L213-F286 HydrophobicContact CD1-CG 4.23Å; K282-F286 WeakPolarHBondContact O-CB 3.29Å; K282-F286 PolarHBondContact O-N 3.25Å; T283-F286 PolarHBondContact O-N 2.59Å; G284-F286 PolarHBondContact O-N 3.41Å; F286-D288 VanDerWaalsContact C-N 3.33Å; F286-K289 WeakPolarHBondContact O-CB 3.5Å; F286-K289 PolarHBondContact O-N 3.46Å; F286-L290 HydrophobicContact CD1-CD1 4.12Å; F286-L290 HydrophobicContact CD1-CG 4.05Å; F286-L290 HydrophobicContact CE1-CD1 3.84Å; F286-L290 HydrophobicContact CE1-CD2 3.78Å; F286-L290 HydrophobicContact CE1-CG 3.67Å; F286-L290 HydrophobicContact CZ-CD2 4.3Å; F286-L290 PolarHBondContact O-N 3.39Å; F286-L290 VanDerWaalsContact O-N 3.1Å
287	S	94.6	Very high	93	Very high	59 Å²	59	82.7 Å²	82.7	41%	0.413	42%	0.418	S	S	.	.	H	α-helix	trans	-60.1	-42.6	172.5	-60.5	0	0	0	0	111.6	T283 G284 K289 L290 L291	T283-S287 PolarHBondContact O-N 2.9Å; T283-S287 VanDerWaalsContact O-N 3.12Å; T283-S287 PolarHBondContact O-OG 2.85Å; G284-S287 WeakPolarHBondContact O-CA 3.4Å; G284-S287 VanDerWaalsContact O-CB 3.28Å; G284-S287 WeakPolarHBondContact O-CB 3.09Å; G284-S287 PolarHBondContact O-N 2.78Å; S287-K289 VanDerWaalsContact C-N 3.31Å; S287-K289 PolarHBondContact O-N 2.93Å; S287-L290 WeakPolarHBondContact O-CB 3.19Å; S287-L290 PolarHBondContact O-N 3.44Å; S287-L291 PolarHBondContact O-N 2.97Å
288	D	93.7	Very high	92.9	Very high	92 Å²	92	79.6 Å²	79.6	49%	0.492	41%	0.407	S	S	.	.	H	α-helix	trans	-65.2	-36.9	179	-52	-29.1	0	0	0	111.7	G284 F286 L290 L291 S292	G284-D288 PolarHBondContact O-N 2.9Å; G284-D288 VanDerWaalsContact O-N 3.1Å; F286-D288 VanDerWaalsContact C-N 3.33Å; D288-L290 VanDerWaalsContact C-N 3.32Å; D288-L290 PolarHBondContact O-N 2.81Å; D288-L291 PolarHBondContact O-N 2.83Å; D288-S292 WeakPolarHBondContact O-CB 3.37Å; D288-S292 PolarHBondContact O-N 2.83Å; D288-S292 PolarHBondContact O-OG 3.38Å
289	K	93.1	Very high	92.9	Very high	91 Å²	91	78.4 Å²	78.4	40%	0.396	40%	0.395	S	S	.	.	H	α-helix	trans	-61.7	-38.6	171.3	-74.2	171.1	-178.2	171.7	0	112	E285 F286 S287 L293	E285-K289 WeakPolarHBondContact O-CG 3.11Å; E285-K289 PolarHBondContact O-N 2.8Å; F286-K289 WeakPolarHBondContact O-CB 3.5Å; F286-K289 PolarHBondContact O-N 3.46Å; S287-K289 VanDerWaalsContact C-N 3.31Å; S287-K289 PolarHBondContact O-N 2.93Å; K289-L293 VanDerWaalsContact O-CB 3.32Å; K289-L293 WeakPolarHBondContact O-CB 3.46Å; K289-L293 PolarHBondContact O-N 3.4Å
290	L	94.1	Very high	92.9	Very high	70 Å²	70	83.2 Å²	83.2	37%	0.366	42%	0.415	S	S	.	.	H	α-helix	trans	-67.9	-42.7	177.3	-70.1	-178.7	0	0	0	111.7	F286 S287 D288 L293 Q294	F286-L290 HydrophobicContact CD1-CD1 4.12Å; F286-L290 HydrophobicContact CD1-CG 4.05Å; F286-L290 HydrophobicContact CE1-CD1 3.84Å; F286-L290 HydrophobicContact CE1-CD2 3.78Å; F286-L290 HydrophobicContact CE1-CG 3.67Å; F286-L290 HydrophobicContact CZ-CD2 4.3Å; F286-L290 PolarHBondContact O-N 3.39Å; F286-L290 VanDerWaalsContact O-N 3.1Å; S287-L290 WeakPolarHBondContact O-CB 3.19Å; S287-L290 PolarHBondContact O-N 3.44Å; D288-L290 VanDerWaalsContact C-N 3.32Å; D288-L290 PolarHBondContact O-N 2.81Å; L290-L293 PolarHBondContact O-N 3.39Å; L290-Q294 WeakPolarHBondContact O-CG 3.39Å; L290-Q294 PolarHBondContact O-N 3.33Å
291	L	91.6	Very high	92.8	Very high	103 Å²	103	81.7 Å²	81.7	54%	0.539	41%	0.41	S	S	.	.	H	α-helix	trans	-61.6	-45.2	174.4	-68.8	173.5	0	0	0	111	S287 D288 L293 Q294 R295	S287-L291 PolarHBondContact O-N 2.97Å; D288-L291 PolarHBondContact O-N 2.83Å; L291-L293 VanDerWaalsContact C-N 3.34Å; L291-L293 PolarHBondContact O-N 3.24Å; L291-Q294 PolarHBondContact O-N 2.88Å; L291-R295 WeakPolarHBondContact O-CB 3.38Å; L291-R295 PolarHBondContact O-N 2.91Å
292	S	91.2	Very high	92.6	Very high	56 Å²	56	75.7 Å²	75.7	39%	0.392	39%	0.389	S	S	.	.	H	α-helix	trans	-61	-40.2	175.6	-64.2	0	0	0	0	112.7	D288 R295 G296	D288-S292 WeakPolarHBondContact O-CB 3.37Å; D288-S292 PolarHBondContact O-N 2.83Å; D288-S292 PolarHBondContact O-OG 3.38Å; S292-R295 PolarHBondContact OG-NH2 2.96Å; S292-G296 PolarHBondContact O-N 3.16Å
293	L	93.6	Very high	92.6	Very high	67 Å²	67	78 Å²	78	35%	0.351	40%	0.399	S	S	.	.	H	α-helix	trans	-63.9	-47.8	175	175.6	68.7	0	0	0	111.5	L206 K289 L290 L291 G296 L297	L206-L293 HydrophobicContact CD1-CD2 3.72Å; K289-L293 VanDerWaalsContact O-CB 3.32Å; K289-L293 WeakPolarHBondContact O-CB 3.46Å; K289-L293 PolarHBondContact O-N 3.4Å; L290-L293 PolarHBondContact O-N 3.39Å; L291-L293 VanDerWaalsContact C-N 3.34Å; L291-L293 PolarHBondContact O-N 3.24Å; L293-G296 PolarHBondContact O-N 2.89Å; L293-L297 HydrophobicContact CD1-CD1 3.81Å; L293-L297 HydrophobicContact CD1-CG 4.01Å; L293-L297 HydrophobicContact CG-CD1 4Å; L293-L297 HydrophobicContact CG-CG 4.47Å; L293-L297 WeakPolarHBondContact O-CB 3.46Å; L293-L297 WeakPolarHBondContact O-CG 3.34Å; L293-L297 PolarHBondContact O-N 2.78Å
294	Q	91.5	Very high	92.6	Very high	123 Å²	123	78.1 Å²	78.1	58%	0.575	40%	0.396	S	S	*	.	H	α-helix	trans	-60.8	-45.4	179.6	-74.8	177.3	-10	0	0	111.4	L290 L291 R298	L290-Q294 WeakPolarHBondContact O-CG 3.39Å; L290-Q294 PolarHBondContact O-N 3.33Å; L291-Q294 PolarHBondContact O-N 2.88Å; Q294-R298 WeakPolarHBondContact O-CB 3.23Å; Q294-R298 PolarHBondContact O-N 3.45Å; Q294-R298 VanDerWaalsContact O-N 3.11Å
295	R	90	Very high	92.5	Very high	120 Å²	120	81 Å²	81	45%	0.453	40%	0.404	S	S	.	.	H	α-helix	trans	-60.3	-55.2	175	177.5	172.7	59.7	-137.6	-2.4	111.2	L291 S292 L297 R298 E299	L291-R295 WeakPolarHBondContact O-CB 3.38Å; L291-R295 PolarHBondContact O-N 2.91Å; S292-R295 PolarHBondContact OG-NH2 2.96Å; R295-L297 PolarHBondContact O-N 3.1Å; R295-R298 WeakPolarHBondContact O-CB 3.34Å; R295-R298 PolarHBondContact O-N 2.94Å; R295-R298 VanDerWaalsContact O-N 3.12Å; R295-E299 WeakPolarHBondContact CG-OE1 3.45Å; R295-E299 WeakPolarHBondContact O-CG 3.44Å; R295-E299 PolarHBondContact O-N 2.92Å
296	G	92.3	Very high	92.4	Very high	33 Å²	33	78.2 Å²	78.2	34%	0.34	39%	0.39	S	S	.	.	H	α-helix	trans	-62	-37.3	-177.7	0	0	0	0	0	114.1	S292 L293 F300	S292-G296 PolarHBondContact O-N 3.16Å; L293-G296 PolarHBondContact O-N 2.89Å; G296-F300 VanDerWaalsContact O-CB 3.25Å; G296-F300 WeakPolarHBondContact O-CB 3.3Å; G296-F300 PolarHBondContact O-N 2.96Å
297	L	92.7	Very high	92.3	Very high	60 Å²	60	82.2 Å²	82.2	31%	0.314	41%	0.412	S	S	.	.	H	α-helix	trans	-68.9	-38	175	-75.1	177.7	0	0	0	112.3	L199 L293 R295 Q301	L199-L297 HydrophobicContact CD2-CD2 4.01Å; L293-L297 HydrophobicContact CD1-CD1 3.81Å; L293-L297 HydrophobicContact CD1-CG 4.01Å; L293-L297 HydrophobicContact CG-CD1 4Å; L293-L297 HydrophobicContact CG-CG 4.47Å; L293-L297 WeakPolarHBondContact O-CB 3.46Å; L293-L297 WeakPolarHBondContact O-CG 3.34Å; L293-L297 PolarHBondContact O-N 2.78Å; R295-L297 PolarHBondContact O-N 3.1Å; L297-Q301 VanDerWaalsContact O-CB 3.32Å; L297-Q301 WeakPolarHBondContact O-CB 3.34Å; L297-Q301 WeakPolarHBondContact O-CG 3.31Å; L297-Q301 PolarHBondContact O-N 2.66Å
298	R	90.2	Very high	92.3	Very high	133 Å²	133	85.2 Å²	85.2	50%	0.502	42%	0.423	S	S	.	.	H	α-helix	trans	-65.9	-46.6	176.8	-173.8	-179.1	-61.2	-143.8	1.5	111.2	Q294 R295 Q301 G302	Q294-R298 WeakPolarHBondContact O-CB 3.23Å; Q294-R298 PolarHBondContact O-N 3.45Å; Q294-R298 VanDerWaalsContact O-N 3.11Å; R295-R298 WeakPolarHBondContact O-CB 3.34Å; R295-R298 PolarHBondContact O-N 2.94Å; R295-R298 VanDerWaalsContact O-N 3.12Å; R298-Q301 PolarHBondContact O-N 3.44Å; R298-G302 PolarHBondContact O-N 2.85Å
299	E	91.7	Very high	92.3	Very high	71 Å²	71	85 Å²	85	33%	0.332	42%	0.419	S	S	.	.	H	α-helix	trans	-56.1	-51.1	173.7	-72.5	173.3	-164.9	0	0	111.7	R295 Q301 G302 K303	R295-E299 WeakPolarHBondContact CG-OE1 3.45Å; R295-E299 WeakPolarHBondContact O-CG 3.44Å; R295-E299 PolarHBondContact O-N 2.92Å; E299-Q301 PolarHBondContact O-N 3.04Å; E299-G302 PolarHBondContact O-N 2.9Å; E299-K303 WeakPolarHBondContact O-CB 3.42Å; E299-K303 PolarHBondContact O-N 3.06Å
300	F	92.8	Very high	92.5	Very high	119 Å²	119	82.3 Å²	82.3	52%	0.522	41%	0.406	S	S	.	.	H	α-helix	trans	-58.2	-49.8	177.1	172.2	-102.8	0	0	0	112.1	G296 K303 L304	G296-F300 VanDerWaalsContact O-CB 3.25Å; G296-F300 WeakPolarHBondContact O-CB 3.3Å; G296-F300 PolarHBondContact O-N 2.96Å; F300-K303 PolarHBondContact O-N 2.86Å; F300-L304 HydrophobicContact CE1-CD2 4Å; F300-L304 HydrophobicContact CZ-CD2 3.81Å; F300-L304 WeakPolarHBondContact O-CB 3.2Å; F300-L304 PolarHBondContact O-N 3.45Å
301	Q	91.6	Very high	92.5	Very high	126 Å²	126	85.2 Å²	85.2	59%	0.589	42%	0.416	S	S	*	.	H	α-helix	trans	-61	-49.3	-178.6	-77.8	173.4	4.2	0	0	111.7	L297 R298 E299 L304 L305	L297-Q301 VanDerWaalsContact O-CB 3.32Å; L297-Q301 WeakPolarHBondContact O-CB 3.34Å; L297-Q301 WeakPolarHBondContact O-CG 3.31Å; L297-Q301 PolarHBondContact O-N 2.66Å; R298-Q301 PolarHBondContact O-N 3.44Å; E299-Q301 PolarHBondContact O-N 3.04Å; Q301-L304 PolarHBondContact O-N 3.08Å; Q301-L305 WeakPolarHBondContact O-CB 3.13Å; Q301-L305 PolarHBondContact O-N 3.31Å
302	G	91	Very high	92.7	Very high	17 Å²	17	83.7 Å²	83.7	18%	0.175	41%	0.411	C	S	.	.	H	α-helix	trans	-68	-39.5	-178.6	0	0	0	0	0	111.8	R298 E299 L305 R306 Q508	R298-G302 PolarHBondContact O-N 2.85Å; E299-G302 PolarHBondContact O-N 2.9Å; G302-L305 PolarHBondContact O-N 2.96Å; G302-R306 VanDerWaalsContact O-CG 3.3Å; G302-R306 WeakPolarHBondContact O-CG 3.44Å; G302-R306 PolarHBondContact O-N 2.77Å; G302-R306 PolarHBondContact O-NH1 2.74Å; G302-Q508 VanDerWaalsContact CA-CG 3.46Å
303	K	92.6	Very high	92.9	Very high	116 Å²	116	82.1 Å²	82.1	50%	0.504	40%	0.399	S	S	.	.	H	α-helix	trans	-63.4	-47.8	175.1	-172	171.6	179.9	175.6	0	111.7	E299 F300 L305 R306 D307	E299-K303 WeakPolarHBondContact O-CB 3.42Å; E299-K303 PolarHBondContact O-N 3.06Å; F300-K303 PolarHBondContact O-N 2.86Å; K303-L305 VanDerWaalsContact C-N 3.33Å; K303-L305 PolarHBondContact O-N 3.09Å; K303-R306 PolarHBondContact O-N 3.49Å; K303-D307 WeakPolarHBondContact O-CB 3.35Å; K303-D307 PolarHBondContact O-N 2.8Å
304	L	93.3	Very high	93	Very high	60 Å²	60	82.8 Å²	82.8	31%	0.314	41%	0.409	S	S	.	.	H	α-helix	trans	-59.4	-44.4	177.9	-175.8	66.6	0	0	0	111.5	F300 Q301 D307 L308	F300-L304 HydrophobicContact CE1-CD2 4Å; F300-L304 HydrophobicContact CZ-CD2 3.81Å; F300-L304 WeakPolarHBondContact O-CB 3.2Å; F300-L304 PolarHBondContact O-N 3.45Å; Q301-L304 PolarHBondContact O-N 3.08Å; L304-D307 PolarHBondContact O-N 3.04Å; L304-L308 HydrophobicContact CD1-CD1 3.73Å; L304-L308 HydrophobicContact CD1-CG 4.1Å; L304-L308 HydrophobicContact CG-CD1 3.85Å; L304-L308 HydrophobicContact CG-CG 4.46Å; L304-L308 WeakPolarHBondContact O-CB 3.32Å; L304-L308 VanDerWaalsContact O-CG 3.22Å; L304-L308 WeakPolarHBondContact O-CG 3.33Å; L304-L308 PolarHBondContact O-N 3.23Å
305	L	92.3	Very high	93.2	Very high	94 Å²	94	77.4 Å²	77.4	49%	0.492	39%	0.385	S	S	.	.	H	α-helix	trans	-61.2	-45.8	177	-172.2	69.9	0	0	0	111.2	Q301 G302 K303 L308 E309	Q301-L305 WeakPolarHBondContact O-CB 3.13Å; Q301-L305 PolarHBondContact O-N 3.31Å; G302-L305 PolarHBondContact O-N 2.96Å; K303-L305 VanDerWaalsContact C-N 3.33Å; K303-L305 PolarHBondContact O-N 3.09Å; L305-L308 PolarHBondContact O-N 3.14Å; L305-E309 HydrophobicContact CD1-CG 4.01Å; L305-E309 WeakPolarHBondContact CD1-OE1 3.21Å; L305-E309 HydrophobicContact CG-CG 4.49Å; L305-E309 VanDerWaalsContact O-CB 3.29Å; L305-E309 WeakPolarHBondContact O-CB 3.02Å; L305-E309 WeakPolarHBondContact O-CG 3.35Å; L305-E309 PolarHBondContact O-N 3.32Å
306	R	92.3	Very high	93.6	Very high	23 Å²	23	73.7 Å²	73.7	9%	0.087	38%	0.376	C	S	.	.	H	α-helix	trans	-61.8	-50	177.8	-71.6	-162.1	-38.7	-67.6	10.3	112.2	G302 K303 L308 E309 Y310 Y369 Q508	G302-R306 VanDerWaalsContact O-CG 3.3Å; G302-R306 WeakPolarHBondContact O-CG 3.44Å; G302-R306 PolarHBondContact O-N 2.77Å; G302-R306 PolarHBondContact O-NH1 2.74Å; K303-R306 PolarHBondContact O-N 3.49Å; R306-L308 VanDerWaalsContact C-N 3.26Å; R306-L308 PolarHBondContact O-N 2.95Å; R306-E309 PolarHBondContact O-N 2.96Å; R306-Y310 WeakPolarHBondContact O-CB 3.35Å; R306-Y310 PolarHBondContact O-N 3.46Å; R306-Y369 VanDerWaalsContact CD-CZ 3.43Å; R306-Y369 PolarHBondContact NE-OH 3.4Å; R306-Q508 VanDerWaalsContact CZ-CD 3.44Å; R306-Q508 VanDerWaalsContact NH2-CD 3.33Å
307	D	92.7	Very high	93.8	Very high	94 Å²	94	72.3 Å²	72.3	50%	0.503	36%	0.36	S	S	.	.	H	α-helix	trans	-65.8	-28.8	-176.5	-70.9	-11.6	0	0	0	112.7	K303 L304	K303-D307 WeakPolarHBondContact O-CB 3.35Å; K303-D307 PolarHBondContact O-N 2.8Å; L304-D307 PolarHBondContact O-N 3.04Å
308	L	93.9	Very high	93.9	Very high	122 Å²	122	71.3 Å²	71.3	64%	0.639	36%	0.355	S	S	*	.	H	α-helix	trans	-89.5	-31.7	179.5	-67.1	-179.5	0	0	0	113.8	L304 L305 R306	L304-L308 HydrophobicContact CD1-CD1 3.73Å; L304-L308 HydrophobicContact CD1-CG 4.1Å; L304-L308 HydrophobicContact CG-CD1 3.85Å; L304-L308 HydrophobicContact CG-CG 4.46Å; L304-L308 WeakPolarHBondContact O-CB 3.32Å; L304-L308 VanDerWaalsContact O-CG 3.22Å; L304-L308 WeakPolarHBondContact O-CG 3.33Å; L304-L308 PolarHBondContact O-N 3.23Å; L305-L308 PolarHBondContact O-N 3.14Å; R306-L308 VanDerWaalsContact C-N 3.26Å; R306-L308 PolarHBondContact O-N 2.95Å
309	E	94.4	Very high	94.1	Very high	88 Å²	88	67.9 Å²	67.9	41%	0.411	35%	0.35	S	S	.	.	H	α-helix	trans	-100.5	-30.7	-174.9	-66	-161	-179.9	0	0	114.6	L305 R306 K367	L305-E309 HydrophobicContact CD1-CG 4.01Å; L305-E309 WeakPolarHBondContact CD1-OE1 3.21Å; L305-E309 HydrophobicContact CG-CG 4.49Å; L305-E309 VanDerWaalsContact O-CB 3.29Å; L305-E309 WeakPolarHBondContact O-CB 3.02Å; L305-E309 WeakPolarHBondContact O-CG 3.35Å; L305-E309 PolarHBondContact O-N 3.32Å; R306-E309 PolarHBondContact O-N 2.96Å; E309-K367 HydrophobicContact CB-CD 4.35Å; E309-K367 WeakPolarHBondContact O-CB 3.27Å; E309-K367 WeakPolarHBondContact O-CD 3.34Å; E309-K367 IonicContact OE2-NZ 3.56Å; E309-K367 PolarHBondContact OE2-NZ 3.19Å
310	Y	96.1	Very high	94.2	Very high	33 Å²	33	70 Å²	70	13%	0.129	36%	0.36	C	S	.	.	S	Bend	trans	-112.2	145.4	-172.5	-65.4	-96.8	0	0	0	111.3	R306 K367 A492	R306-Y310 WeakPolarHBondContact O-CB 3.35Å; R306-Y310 PolarHBondContact O-N 3.46Å; Y310-K367 HydrophobicContact CD1-CB 3.57Å; Y310-K367 HydrophobicContact CD1-CD 4.5Å; Y310-K367 HydrophobicContact CD1-CG 4.32Å; Y310-K367 HydrophobicContact CE1-CB 3.86Å; Y310-K367 HydrophobicContact CE1-CD 4.19Å; Y310-K367 HydrophobicContact CE1-CG 4.1Å; Y310-K367 HydrophobicContact CG-CB 4.13Å; Y310-A492 HydrophobicContact CD1-CB 3.93Å; Y310-A492 HydrophobicContact CE1-CB 3.6Å; Y310-A492 HydrophobicContact CE2-CB 4.45Å
311	K	95.6	Very high	94.2	Very high	132 Å²	132	64.4 Å²	64.4	57%	0.574	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.9	111.9	167.9	-177.6	177.5	178.7	178.9	0	109.7	V313 K367 V368 Y369	K311-V313 HydrophobicContact CG-CG1 4.33Å; K311-V313 PolarHBondContact O-N 2.82Å; K311-K367 PolarHBondContact N-O 3.1Å; K311-V368 WeakPolarHBondContact O-CA 3.33Å; K311-Y369 PolarHBondContact O-N 3.38Å
312	T	95.5	Very high	94.4	Very high	71 Å²	71	58.8 Å²	58.8	44%	0.436	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	127.1	169.8	-50.5	0	0	0	0	110.7	Y369 P539	T312-Y369 CarbonylContact C-O 3.46Å; T312-Y369 WeakPolarHBondContact CA-O 3.48Å; T312-P539 WeakPolarHBondContact CG2-OXT 3.4Å
313	V	95.4	Very high	94.5	Very high	22 Å²	22	58 Å²	58	13%	0.133	30%	0.303	C	S	.	.			trans	-127.6	130.7	-174.5	-70.5	0	0	0	0	112.4	K311 V315 F363 V368 Y369 W370	K311-V313 HydrophobicContact CG-CG1 4.33Å; K311-V313 PolarHBondContact O-N 2.82Å; V313-V315 HydrophobicContact CG2-CG2 4.18Å; V313-V315 PolarHBondContact O-N 3.38Å; V313-V315 VanDerWaalsContact O-N 3.12Å; V313-F363 HydrophobicContact CB-CZ 4.5Å; V313-F363 HydrophobicContact CG1-CE1 4.33Å; V313-F363 HydrophobicContact CG2-CE1 4.22Å; V313-F363 HydrophobicContact CG2-CZ 3.82Å; V313-V368 HydrophobicContact CG1-CB 4.29Å; V313-V368 HydrophobicContact CG1-CG1 4.09Å; V313-V368 HydrophobicContact CG2-CB 4.09Å; V313-Y369 WeakPolarHBondContact CG2-O 3.38Å; V313-Y369 PolarHBondContact N-O 2.91Å; V313-W370 HydrophobicContact CG2-CB 4.38Å; V313-W370 HydrophobicContact CG2-CE3 3.93Å
314	S	95.3	Very high	94.5	Very high	82 Å²	82	52.8 Å²	52.8	57%	0.573	28%	0.281	S	S	*	.			trans	-76.3	102.5	171.4	-172.5	0	0	0	0	110.4	K333	S314-K333 PolarHBondContact OG-NZ 2.88Å
315	V	95.6	Very high	94.4	Very high	10 Å²	10	53.1 Å²	53.1	6%	0.061	28%	0.279	C	S	.	.			trans	-84.5	142.3	177.6	176.9	0	0	0	0	111.2	V313 K333 W370 P524 L537	V313-V315 HydrophobicContact CG2-CG2 4.18Å; V313-V315 PolarHBondContact O-N 3.38Å; V313-V315 VanDerWaalsContact O-N 3.12Å; V315-K333 WeakPolarHBondContact O-CD 2.9Å; V315-K333 WeakPolarHBondContact O-CE 3.34Å; V315-K333 PolarHBondContact O-NZ 3.38Å; V315-W370 HydrophobicContact CB-CG 4.49Å; V315-W370 HydrophobicContact CG2-CB 3.84Å; V315-W370 HydrophobicContact CG2-CD2 3.77Å; V315-W370 HydrophobicContact CG2-CE3 4.17Å; V315-W370 HydrophobicContact CG2-CG 3.6Å; V315-P524 HydrophobicContact CB-CG 4.43Å; V315-P524 HydrophobicContact CG1-CB 3.79Å; V315-P524 HydrophobicContact CG1-CG 3.56Å; V315-P524 HydrophobicContact CG2-CG 3.93Å; V315-L537 HydrophobicContact CB-CD1 4.25Å; V315-L537 HydrophobicContact CB-CD2 4.17Å; V315-L537 HydrophobicContact CG1-CD1 3.8Å; V315-L537 HydrophobicContact CG1-CD2 4.02Å
316	T	97.5	Very high	94.5	Very high	42 Å²	42	49.4 Å²	49.4	26%	0.258	26%	0.26	S	S	.	.			trans	-130.7	146.3	170.6	46.1	0	0	0	0	109.9	K333 G359 S360	T316-K333 HydrophobicContact CG2-CD 4.24Å; T316-G359 CarbonylContact O-C 3.31Å; T316-G359 WeakPolarHBondContact O-CA 3.3Å; T316-S360 WeakPolarHBondContact O-CB 3.39Å; T316-S360 PolarHBondContact O-N 2.73Å; T316-S360 PolarHBondContact O-OG 2.82Å; T316-S360 PolarHBondContact OG1-OG 3.41Å
317	L	97.4	Very high	94.5	Very high	3 Å²	3	53.2 Å²	53.2	2%	0.016	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-76	150	-179.4	-60.7	174	0	0	0	111.9	P319 L328 W332 V335 V357 L526 L537	L317-P319 WeakPolarHBondContact O-CD 3.3Å; L317-L328 HydrophobicContact CB-CD1 4.15Å; L317-L328 HydrophobicContact CD1-CD2 3.72Å; L317-W332 HydrophobicContact CB-CB 4.45Å; L317-W332 WeakPolarHBondContact CB-O 3.32Å; L317-W332 WeakPolarHBondContact CG-O 3.31Å; L317-W332 PolarHBondContact N-O 3.31Å; L317-V335 HydrophobicContact CD1-CB 3.93Å; L317-V335 HydrophobicContact CD1-CG1 4.26Å; L317-V357 HydrophobicContact CB-CG2 4.07Å; L317-V357 HydrophobicContact CD1-CG1 4.3Å; L317-V357 HydrophobicContact CD2-CG1 4.02Å; L317-V357 HydrophobicContact CD2-CG2 4.2Å; L317-L526 HydrophobicContact CD1-CD1 4.32Å; L317-L526 HydrophobicContact CD2-CD1 3.81Å; L317-L526 HydrophobicContact CD2-CG 4.35Å; L317-L537 HydrophobicContact CD1-CD1 4.41Å; L317-L537 HydrophobicContact CD2-CD1 3.74Å; L317-L537 HydrophobicContact CG-CD1 3.69Å
318	D	95.5	Very high	94.7	Very high	40 Å²	40	50.2 Å²	50.2	21%	0.214	26%	0.262	C	S	.	.			trans	-92.5	107.4	173.6	176	14.9	0	0	0	110.5	Q320 S321 A322 L358	D318-Q320 PolarHBondContact O-N 2.84Å; D318-Q320 PolarHBondContact OD1-N 3.4Å; D318-S321 PolarHBondContact O-N 2.85Å; D318-S321 PolarHBondContact O-OG 3.08Å; D318-A322 PolarHBondContact O-N 2.51Å; D318-L358 PolarHBondContact N-O 3.37Å
319	P	94.4	Very high	94.7	Very high	60 Å²	60	46 Å²	46	39%	0.39	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-31	177.7	13	-24.6	0	0	0	114.8	L317 S321 A322 L328 W332	L317-P319 WeakPolarHBondContact O-CD 3.3Å; P319-S321 PolarHBondContact O-N 3.07Å; P319-A322 PolarHBondContact O-N 3.25Å; P319-L328 HydrophobicContact CB-CD1 4.45Å; P319-W332 HydrophobicContact CB-CE3 3.95Å; P319-W332 HydrophobicContact CB-CH2 3.62Å; P319-W332 HydrophobicContact CB-CZ2 4.38Å; P319-W332 HydrophobicContact CB-CZ3 3.4Å; P319-W332 HydrophobicContact CG-CD2 4.24Å; P319-W332 HydrophobicContact CG-CE3 3.98Å; P319-W332 HydrophobicContact CG-CH2 3.78Å; P319-W332 HydrophobicContact CG-CZ2 4.04Å; P319-W332 HydrophobicContact CG-CZ3 3.78Å
320	Q	92.6	Very high	94.7	Very high	117 Å²	117	50.9 Å²	50.9	55%	0.547	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-20.6	-177.7	-62.1	-175.2	1.2	0	0	112.2	D318 Q349 Q350	D318-Q320 PolarHBondContact O-N 2.84Å; D318-Q320 PolarHBondContact OD1-N 3.4Å; Q320-Q349 CarbonylContact O-C 3.54Å; Q320-Q350 WeakPolarHBondContact O-CA 3.15Å; Q320-Q350 PolarHBondContact O-N 3.39Å
321	S	94.4	Very high	94.7	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-27.2	176.3	75.9	0	0	0	0	112.9	D318 P319 S323 Q349 Q350 F351 L358	D318-S321 PolarHBondContact O-N 2.85Å; D318-S321 PolarHBondContact O-OG 3.08Å; P319-S321 PolarHBondContact O-N 3.07Å; S321-S323 PolarHBondContact O-N 3.25Å; S321-Q349 WeakPolarHBondContact CA-O 3.16Å; S321-Q350 WeakPolarHBondContact O-CA 3.47Å; S321-F351 WeakPolarHBondContact O-CD2 3.13Å; S321-F351 PolarHBondContact O-N 3Å; S321-F351 VanDerWaalsContact O-N 3.09Å; S321-L358 PolarHBondContact OG-N 3.27Å
322	A	94.2	Very high	94.7	Very high	8 Å²	8	52.6 Å²	52.6	7%	0.066	28%	0.275	C	S	.	.	S	Bend	trans	-63	132.4	-170.1	0	0	0	0	0	112.6	D318 P319 L328 Q350 V357	D318-A322 PolarHBondContact O-N 2.51Å; P319-A322 PolarHBondContact O-N 3.25Å; A322-L328 HydrophobicContact CB-CD1 3.93Å; A322-L328 HydrophobicContact CB-CG 4.31Å; A322-Q350 VanDerWaalsContact O-CG 3.29Å; A322-Q350 WeakPolarHBondContact O-CG 3.36Å; A322-Q350 PolarHBondContact O-NE2 3.31Å; A322-V357 HydrophobicContact CB-CB 4.12Å; A322-V357 HydrophobicContact CB-CG2 3.74Å
323	S	93.8	Very high	94.8	Very high	2 Å²	2	50.8 Å²	50.8	1%	0.014	26%	0.262	C	S	.	.			trans	-57	150.8	172.6	-174.2	0	0	0	0	112.7	S321 Y325 L326 F351 E354 G356	S321-S323 PolarHBondContact O-N 3.25Å; S323-Y325 PolarHBondContact O-N 2.95Å; S323-L326 WeakPolarHBondContact O-CB 3.25Å; S323-L326 PolarHBondContact O-N 3.34Å; S323-F351 WeakPolarHBondContact CA-O 3.49Å; S323-E354 WeakPolarHBondContact CB-O 3.48Å; S323-E354 PolarHBondContact OG-O 2.98Å; S323-G356 PolarHBondContact N-O 3.14Å
324	G	92	Very high	94.8	Very high	5 Å²	5	50.1 Å²	50.1	5%	0.052	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-14	175.9	0	0	0	0	0	114	L326 K342	G324-L326 VanDerWaalsContact C-N 3.3Å; G324-K342 PolarHBondContact O-N 3.23Å
325	Y	92	Very high	94.8	Very high	68 Å²	68	46.2 Å²	46.2	27%	0.267	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-6.9	172.1	-64.8	-69.1	0	0	0	113.9	S323 Y337 T338 S339 Y341 C353	S323-Y325 PolarHBondContact O-N 2.95Å; Y325-Y337 HydrophobicContact CD1-CE2 4.48Å; Y325-Y337 HydrophobicContact CG-CE2 4.22Å; Y325-T338 PolarHBondContact O-N 3.48Å; Y325-T338 PolarHBondContact O-OG1 2.87Å; Y325-S339 WeakPolarHBondContact CD1-O 3.3Å; Y325-Y341 HydrophobicContact CD1-CD2 4.08Å; Y325-Y341 AromaticContact CD2-CD2 3.75Å; Y325-Y341 HydrophobicContact CD2-CD2 3.75Å; Y325-Y341 HydrophobicContact CD2-CE2 4.26Å; Y325-Y341 AromaticContact CE1-CD2 3.92Å; Y325-Y341 HydrophobicContact CE1-CD2 3.92Å; Y325-Y341 HydrophobicContact CE1-CG 4.31Å; Y325-Y341 AromaticContact CE2-CD2 3.58Å; Y325-Y341 HydrophobicContact CE2-CD2 3.58Å; Y325-Y341 HydrophobicContact CE2-CE2 4.14Å; Y325-Y341 AromaticContact CG-CD2 3.99Å; Y325-Y341 HydrophobicContact CG-CD2 3.99Å; Y325-Y341 AromaticContact CZ-CD2 3.66Å; Y325-C353 WeakPolarHBondContact CE2-O 3.46Å
326	L	93.7	Very high	94.8	Very high	16 Å²	16	47.6 Å²	47.6	8%	0.084	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	145.2	-175.8	-62.4	178.3	0	0	0	111.4	S323 G324 V335 T336 Y337 P355 G356 V357 L528	S323-L326 WeakPolarHBondContact O-CB 3.25Å; S323-L326 PolarHBondContact O-N 3.34Å; G324-L326 VanDerWaalsContact C-N 3.3Å; L326-V335 HydrophobicContact CB-CG2 3.99Å; L326-V335 HydrophobicContact CD1-CG2 3.89Å; L326-V335 HydrophobicContact CD2-CG2 3.76Å; L326-V335 HydrophobicContact CG-CG2 4.09Å; L326-T336 WeakPolarHBondContact CA-O 3.22Å; L326-Y337 HydrophobicContact CD2-CD2 4.37Å; L326-P355 WeakPolarHBondContact CD1-O 3.47Å; L326-P355 HydrophobicContact CD2-CB 3.98Å; L326-P355 HydrophobicContact CG-CB 4.29Å; L326-G356 VanDerWaalsContact CD1-O 3.3Å; L326-G356 WeakPolarHBondContact CD1-O 3.24Å; L326-V357 HydrophobicContact CD1-CB 3.9Å; L326-V357 HydrophobicContact CD1-CG1 4.03Å; L326-L528 HydrophobicContact CD2-CB 4.18Å
327	Q	93.6	Very high	94.5	Very high	102 Å²	102	47.4 Å²	47.4	48%	0.477	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	129.2	169.4	-179.1	171.3	-34.8	0	0	109.4	V335 T336 T338	Q327-V335 WeakPolarHBondContact O-CA 3.5Å; Q327-T336 PolarHBondContact N-O 2.79Å; Q327-T336 PolarHBondContact O-N 2.82Å; Q327-T338 HydrophobicContact CB-CG2 3.57Å
328	L	94.9	Very high	94	Very high	32 Å²	32	48.3 Å²	48.3	17%	0.168	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	148.7	178.3	-55.1	-173	0	0	0	110.5	L317 P319 A322 W332 C334 V335 V357	L317-L328 HydrophobicContact CB-CD1 4.15Å; L317-L328 HydrophobicContact CD1-CD2 3.72Å; P319-L328 HydrophobicContact CB-CD1 4.45Å; A322-L328 HydrophobicContact CB-CD1 3.93Å; A322-L328 HydrophobicContact CB-CG 4.31Å; L328-W332 HydrophobicContact CB-CE3 3.74Å; L328-W332 HydrophobicContact CB-CZ3 3.81Å; L328-W332 HydrophobicContact CD1-CE3 3.57Å; L328-W332 HydrophobicContact CD1-CZ3 3.79Å; L328-W332 HydrophobicContact CG-CE3 4.31Å; L328-W332 HydrophobicContact CG-CZ3 4.37Å; L328-C334 WeakPolarHBondContact CA-O 3.36Å; L328-V335 HydrophobicContact CD2-CB 3.66Å; L328-V335 HydrophobicContact CD2-CG2 3.7Å; L328-V357 HydrophobicContact CD1-CG2 4.38Å; L328-V357 HydrophobicContact CD2-CG2 4.5Å
329	S	95.2	Very high	93.3	Very high	32 Å²	32	50 Å²	50	22%	0.224	26%	0.255	C	S	.	.			trans	-70.8	161.9	168.9	54.9	0	0	0	0	112.2	D331 W332 K333 C334	S329-D331 VanDerWaalsContact CB-OD1 3.3Å; S329-D331 WeakPolarHBondContact CB-OD1 3.44Å; S329-D331 PolarHBondContact O-N 2.95Å; S329-D331 PolarHBondContact OG-OD1 3.03Å; S329-W332 PolarHBondContact O-N 2.89Å; S329-K333 PolarHBondContact OG-N 3.01Å; S329-C334 PolarHBondContact N-O 2.97Å; S329-C334 VanDerWaalsContact N-O 3.08Å; S329-C334 WeakPolarHBondContact OG-CB 3.31Å; S329-C334 PolarHBondContact OG-N 2.97Å
330	E	94.9	Very high	92.8	Very high	192 Å²	192	53.3 Å²	53.3	90%	0.897	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-29.6	-179.6	-63.5	-174.6	169.1	0	0	113.8	W332	E330-W332 VanDerWaalsContact C-N 3.32Å; E330-W332 PolarHBondContact O-NE1 3.45Å
331	D	95	Very high	92.4	Very high	96 Å²	96	51.3 Å²	51.3	51%	0.513	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-2.1	177.1	68.8	-8.9	0	0	0	113.6	S329 K333	S329-D331 VanDerWaalsContact CB-OD1 3.3Å; S329-D331 WeakPolarHBondContact CB-OD1 3.44Å; S329-D331 PolarHBondContact O-N 2.95Å; S329-D331 PolarHBondContact OG-OD1 3.03Å; D331-K333 HydrophobicContact CB-CG 4.34Å; D331-K333 PolarHBondContact O-N 2.76Å; D331-K333 WeakPolarHBondContact OD1-CB 3.01Å; D331-K333 PolarHBondContact OD1-N 3.32Å; D331-K333 VanDerWaalsContact OD1-N 3.08Å
332	W	96.4	Very high	91.8	Very high	105 Å²	105	57.2 Å²	57.2	40%	0.398	28%	0.282	S	S	.	.	S	Bend	trans	59.8	28.7	-178.5	-44.4	98.2	0	0	0	113.8	L317 P319 L328 S329 E330	L317-W332 HydrophobicContact CB-CB 4.45Å; L317-W332 WeakPolarHBondContact CB-O 3.32Å; L317-W332 WeakPolarHBondContact CG-O 3.31Å; L317-W332 PolarHBondContact N-O 3.31Å; P319-W332 HydrophobicContact CB-CE3 3.95Å; P319-W332 HydrophobicContact CB-CH2 3.62Å; P319-W332 HydrophobicContact CB-CZ2 4.38Å; P319-W332 HydrophobicContact CB-CZ3 3.4Å; P319-W332 HydrophobicContact CG-CD2 4.24Å; P319-W332 HydrophobicContact CG-CE3 3.98Å; P319-W332 HydrophobicContact CG-CH2 3.78Å; P319-W332 HydrophobicContact CG-CZ2 4.04Å; P319-W332 HydrophobicContact CG-CZ3 3.78Å; L328-W332 HydrophobicContact CB-CE3 3.74Å; L328-W332 HydrophobicContact CB-CZ3 3.81Å; L328-W332 HydrophobicContact CD1-CE3 3.57Å; L328-W332 HydrophobicContact CD1-CZ3 3.79Å; L328-W332 HydrophobicContact CG-CE3 4.31Å; L328-W332 HydrophobicContact CG-CZ3 4.37Å; S329-W332 PolarHBondContact O-N 2.89Å; E330-W332 VanDerWaalsContact C-N 3.32Å; E330-W332 PolarHBondContact O-NE1 3.45Å
333	K	96.5	Very high	91.1	Very high	33 Å²	33	58.4 Å²	58.4	14%	0.143	29%	0.29	C	S	.	.			trans	-104.7	-20.2	179.6	-69.4	-73.8	-167.8	163	0	113.8	S314 V315 T316 S329 D331 L537	S314-K333 PolarHBondContact OG-NZ 2.88Å; V315-K333 WeakPolarHBondContact O-CD 2.9Å; V315-K333 WeakPolarHBondContact O-CE 3.34Å; V315-K333 PolarHBondContact O-NZ 3.38Å; T316-K333 HydrophobicContact CG2-CD 4.24Å; S329-K333 PolarHBondContact OG-N 3.01Å; D331-K333 HydrophobicContact CB-CG 4.34Å; D331-K333 PolarHBondContact O-N 2.76Å; D331-K333 WeakPolarHBondContact OD1-CB 3.01Å; D331-K333 PolarHBondContact OD1-N 3.32Å; D331-K333 VanDerWaalsContact OD1-N 3.08Å; K333-L537 HydrophobicContact CD-CB 3.92Å; K333-L537 PolarHBondContact O-N 3.13Å
334	C	96	Very high	90.1	Very high	7 Å²	7	62.4 Å²	62.4	5%	0.047	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	143.1	-177.7	-178.9	0	0	0	0	110.3	L328 S329 R534 L535 L536	L328-C334 WeakPolarHBondContact CA-O 3.36Å; S329-C334 PolarHBondContact N-O 2.97Å; S329-C334 VanDerWaalsContact N-O 3.08Å; S329-C334 WeakPolarHBondContact OG-CB 3.31Å; S329-C334 PolarHBondContact OG-N 2.97Å; C334-R534 PolarHBondContact SG-NE 3.12Å; C334-R534 VanDerWaalsContact SG-NE 3.4Å; C334-R534 PolarHBondContact SG-NH2 2.93Å; C334-L535 VanDerWaalsContact CA-O 3.3Å; C334-L535 WeakPolarHBondContact CA-O 3.47Å; C334-L536 HydrophobicContact CB-CG 4.36Å
335	V	95.8	Very high	89.3	Confident	1 Å²	1	70.7 Å²	70.7	1%	0.006	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	141.3	170.5	57.8	0	0	0	0	110.6	L317 L326 Q327 L328 V357 L526 R534 L535	L317-V335 HydrophobicContact CD1-CB 3.93Å; L317-V335 HydrophobicContact CD1-CG1 4.26Å; L326-V335 HydrophobicContact CB-CG2 3.99Å; L326-V335 HydrophobicContact CD1-CG2 3.89Å; L326-V335 HydrophobicContact CD2-CG2 3.76Å; L326-V335 HydrophobicContact CG-CG2 4.09Å; Q327-V335 WeakPolarHBondContact O-CA 3.5Å; L328-V335 HydrophobicContact CD2-CB 3.66Å; L328-V335 HydrophobicContact CD2-CG2 3.7Å; V335-V357 HydrophobicContact CG2-CG1 4.3Å; V335-L526 HydrophobicContact CG1-CD1 3.76Å; V335-R534 WeakPolarHBondContact O-CA 3.46Å; V335-L535 HydrophobicContact CG1-CB 3.71Å; V335-L535 HydrophobicContact CG1-CD1 4.27Å; V335-L535 HydrophobicContact CG1-CG 4.32Å; V335-L535 PolarHBondContact N-O 3.37Å; V335-L535 PolarHBondContact O-N 3.45Å
336	T	94.4	Very high	88.6	Confident	39 Å²	39	73 Å²	73	24%	0.239	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	142	179.1	-53.8	0	0	0	0	109.6	L326 Q327 R534	L326-T336 WeakPolarHBondContact CA-O 3.22Å; Q327-T336 PolarHBondContact N-O 2.79Å; Q327-T336 PolarHBondContact O-N 2.82Å; T336-R534 HydrophobicContact CG2-CG 4.22Å
337	Y	92.4	Very high	88	Confident	37 Å²	37	77 Å²	77	15%	0.145	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	134.6	175.8	-179	-111	0	0	0	110.9	Y325 L326 P355 L528 K529 P531	Y325-Y337 HydrophobicContact CD1-CE2 4.48Å; Y325-Y337 HydrophobicContact CG-CE2 4.22Å; L326-Y337 HydrophobicContact CD2-CD2 4.37Å; Y337-P355 HydrophobicContact CD2-CB 3.96Å; Y337-P355 HydrophobicContact CE2-CB 3.94Å; Y337-P355 HydrophobicContact CE2-CG 4.28Å; Y337-L528 WeakPolarHBondContact CD2-O 3.46Å; Y337-K529 HydrophobicContact CE1-CG 4.45Å; Y337-K529 HydrophobicContact CE2-CG 4.24Å; Y337-P531 HydrophobicContact CD1-CG 4.28Å; Y337-P531 HydrophobicContact CE1-CG 4.38Å
338	T	85.5	Confident	87.7	Confident	23 Å²	23	77.1 Å²	77.1	14%	0.141	40%	0.398	C	S	.	.			trans	-114.2	6.1	-172.5	64.4	0	0	0	0	115.6	Y325 Q327 L340 K342	Y325-T338 PolarHBondContact O-N 3.48Å; Y325-T338 PolarHBondContact O-OG1 2.87Å; Q327-T338 HydrophobicContact CB-CG2 3.57Å; T338-L340 PolarHBondContact O-N 2.85Å; T338-L340 PolarHBondContact OG1-O 2.99Å; T338-L340 VanDerWaalsContact OG1-O 3.12Å; T338-K342 WeakPolarHBondContact OG1-CE 3.38Å
339	S	80.7	Confident	87.4	Confident	76 Å²	76	79.6 Å²	79.6	53%	0.531	41%	0.408	S	S	.	.	S	Bend	trans	52.1	-39.9	-175.2	66.5	0	0	0	0	116.6	Y325	Y325-S339 WeakPolarHBondContact CD1-O 3.3Å
340	L	83.9	Confident	87.2	Confident	128 Å²	128	78.7 Å²	78.7	67%	0.67	40%	0.401	S	S	*	.	S	Bend	trans	-82.1	131.3	169.9	-58.6	175.4	0	0	0	111	T338 K342	T338-L340 PolarHBondContact O-N 2.85Å; T338-L340 PolarHBondContact OG1-O 2.99Å; T338-L340 VanDerWaalsContact OG1-O 3.12Å; L340-K342 PolarHBondContact O-N 3.43Å
341	Y	84.8	Confident	87.1	Confident	76 Å²	76	69.6 Å²	69.6	30%	0.298	36%	0.358	S	S	.	.			trans	-73.6	117.5	172.6	-165.7	-96.3	0	0	0	110.7	Y325 S343 L346 D352	Y325-Y341 HydrophobicContact CD1-CD2 4.08Å; Y325-Y341 AromaticContact CD2-CD2 3.75Å; Y325-Y341 HydrophobicContact CD2-CD2 3.75Å; Y325-Y341 HydrophobicContact CD2-CE2 4.26Å; Y325-Y341 AromaticContact CE1-CD2 3.92Å; Y325-Y341 HydrophobicContact CE1-CD2 3.92Å; Y325-Y341 HydrophobicContact CE1-CG 4.31Å; Y325-Y341 AromaticContact CE2-CD2 3.58Å; Y325-Y341 HydrophobicContact CE2-CD2 3.58Å; Y325-Y341 HydrophobicContact CE2-CE2 4.14Å; Y325-Y341 AromaticContact CG-CD2 3.99Å; Y325-Y341 HydrophobicContact CG-CD2 3.99Å; Y325-Y341 AromaticContact CZ-CD2 3.66Å; Y341-S343 VanDerWaalsContact CE1-O 3.3Å; Y341-S343 WeakPolarHBondContact CE1-O 2.9Å; Y341-L346 WeakPolarHBondContact OH-CD2 3.37Å; Y341-D352 WeakPolarHBondContact CE2-O 3.47Å
342	K	81.4	Confident	86.8	Confident	123 Å²	123	66.7 Å²	66.7	54%	0.535	34%	0.343	S	S	.	.			trans	-100.9	-5.3	-173.6	-63.2	-177.4	-176.9	179.5	0	114.6	G324 T338 L340	G324-K342 PolarHBondContact O-N 3.23Å; T338-K342 WeakPolarHBondContact OG1-CE 3.38Å; L340-K342 PolarHBondContact O-N 3.43Å
343	S	79.3	Confident	86.2	Confident	33 Å²	33	65 Å²	65	23%	0.231	35%	0.346	C	S	.	.			trans	-82.9	123.1	-176.6	-163.7	0	0	0	0	111.8	Y341 Y345 Q350	Y341-S343 VanDerWaalsContact CE1-O 3.3Å; Y341-S343 WeakPolarHBondContact CE1-O 2.9Å; S343-Y345 PolarHBondContact OG-O 2.81Å; S343-Q350 PolarHBondContact OG-OE1 2.87Å
344	A	72.9	Confident	85.7	Confident	86 Å²	86	65.4 Å²	65.4	71%	0.711	35%	0.348	S	S	*	.	S	Bend	trans	-76.9	-23.6	175.7	0	0	0	0	0	113
345	Y	76.1	Confident	85.6	Confident	180 Å²	180	65.3 Å²	65.3	71%	0.706	35%	0.348	S	S	*	.	S	Bend	trans	-139	132.2	-177.5	-57.2	-76.7	0	0	0	110.5	S343 H347 Q350	S343-Y345 PolarHBondContact OG-O 2.81Å; Y345-H347 PolarHBondContact O-N 3.36Å; Y345-Q350 PolarHBondContact O-OE1 2.83Å
346	L	78.1	Confident	85.5	Confident	115 Å²	115	65.2 Å²	65.2	60%	0.602	35%	0.347	S	S	*	.			trans	-77.1	107.4	176.4	-79.6	155.1	0	0	0	110.4	Y341 D352	Y341-L346 WeakPolarHBondContact OH-CD2 3.37Å; L346-D352 HydrophobicContact CD2-CB 3.69Å
347	H	81.1	Confident	85.6	Confident	101 Å²	101	63.4 Å²	63.4	47%	0.468	34%	0.336	S	S	.	.			trans	-75.7	148.5	173.1	-69	-65.8	0	0	0	111.5	Y345 Q349 Q350 K449	Y345-H347 PolarHBondContact O-N 3.36Å; H347-Q349 VanDerWaalsContact C-N 3.28Å; H347-Q349 PolarHBondContact O-N 2.83Å; H347-Q350 HydrophobicContact CB-CB 3.97Å; H347-Q350 PolarHBondContact O-N 2.96Å; H347-K449 PolarHBondContact O-NZ 3.31Å
348	P	85.9	Confident	85.8	Confident	104 Å²	104	61.9 Å²	61.9	68%	0.675	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-36	178.3	-25.3	34.7	0	0	0	113.5
349	Q	88.6	Confident	86.3	Confident	84 Å²	84	61 Å²	61	39%	0.393	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-15.6	179.3	-67.8	100.2	-4	0	0	114.2	Q320 S321 H347 R448	Q320-Q349 CarbonylContact O-C 3.54Å; S321-Q349 WeakPolarHBondContact CA-O 3.16Å; H347-Q349 VanDerWaalsContact C-N 3.28Å; H347-Q349 PolarHBondContact O-N 2.83Å; Q349-R448 VanDerWaalsContact CB-NH1 3.34Å; Q349-R448 WeakPolarHBondContact O-CD 3.3Å; Q349-R448 PolarHBondContact O-NH1 3.5Å
350	Q	91.9	Very high	87	Confident	14 Å²	14	60.1 Å²	60.1	7%	0.065	32%	0.32	C	S	.	.	S	Bend	trans	-78.8	144.3	-172.9	166.5	167.5	57.6	0	0	111.7	Q320 S321 A322 S343 Y345 H347 K449	Q320-Q350 WeakPolarHBondContact O-CA 3.15Å; Q320-Q350 PolarHBondContact O-N 3.39Å; S321-Q350 WeakPolarHBondContact O-CA 3.47Å; A322-Q350 VanDerWaalsContact O-CG 3.29Å; A322-Q350 WeakPolarHBondContact O-CG 3.36Å; A322-Q350 PolarHBondContact O-NE2 3.31Å; S343-Q350 PolarHBondContact OG-OE1 2.87Å; Y345-Q350 PolarHBondContact O-OE1 2.83Å; H347-Q350 HydrophobicContact CB-CB 3.97Å; H347-Q350 PolarHBondContact O-N 2.96Å; Q350-K449 WeakPolarHBondContact O-CE 3.44Å; Q350-K449 PolarHBondContact O-NZ 2.95Å
351	F	92.4	Very high	87.5	Confident	1 Å²	1	61.1 Å²	61.1	0%	0.004	32%	0.319	C	S	.	.			trans	-68.2	128.7	164.8	-70.2	-80	0	0	0	110.6	S321 S323 E354 G356 L358 V446 R448 L452 F525	S321-F351 WeakPolarHBondContact O-CD2 3.13Å; S321-F351 PolarHBondContact O-N 3Å; S321-F351 VanDerWaalsContact O-N 3.09Å; S323-F351 WeakPolarHBondContact CA-O 3.49Å; F351-E354 WeakPolarHBondContact CB-O 3.36Å; F351-G356 VanDerWaalsContact CD2-C 3.41Å; F351-G356 WeakPolarHBondContact CD2-O 3.45Å; F351-L358 HydrophobicContact CE2-CD1 4.48Å; F351-L358 HydrophobicContact CE2-CD2 4.26Å; F351-L358 HydrophobicContact CE2-CG 3.94Å; F351-L358 HydrophobicContact CZ-CD2 4.2Å; F351-L358 HydrophobicContact CZ-CG 4.27Å; F351-V446 HydrophobicContact CE1-CG1 4.48Å; F351-V446 HydrophobicContact CZ-CG1 4.06Å; F351-R448 WeakPolarHBondContact CA-O 3.3Å; F351-R448 HydrophobicContact CD1-CB 3.75Å; F351-R448 HydrophobicContact CD1-CG 4.19Å; F351-R448 HydrophobicContact CE1-CB 3.92Å; F351-R448 HydrophobicContact CE1-CG 3.86Å; F351-R448 HydrophobicContact CG-CB 4.3Å; F351-R448 HydrophobicContact CZ-CG 4.16Å; F351-L452 HydrophobicContact CD1-CD1 3.56Å; F351-L452 HydrophobicContact CE1-CD1 3.6Å; F351-F525 HydrophobicContact CE2-CE2 4.37Å; F351-F525 HydrophobicContact CZ-CD2 4.49Å; F351-F525 AromaticContact CZ-CE2 3.95Å; F351-F525 HydrophobicContact CZ-CE2 3.95Å
352	D	87.9	Confident	88	Confident	35 Å²	35	58.1 Å²	58.1	19%	0.187	31%	0.311	C	S	.	.	S	Bend	trans	-88.2	-55	-174.1	58.9	-7.3	0	0	0	113.8	Y341 L346 R448 K449 G450	Y341-D352 WeakPolarHBondContact CE2-O 3.47Å; L346-D352 HydrophobicContact CD2-CB 3.69Å; D352-R448 PolarHBondContact N-O 3.35Å; D352-K449 HydrophobicContact CB-CD 3.86Å; D352-K449 VanDerWaalsContact OD1-CA 3.24Å; D352-K449 WeakPolarHBondContact OD1-CA 3.3Å; D352-K449 VanDerWaalsContact OD2-CA 3.28Å; D352-K449 WeakPolarHBondContact OD2-CA 3.48Å; D352-K449 VanDerWaalsContact OD2-CD 3.31Å; D352-K449 WeakPolarHBondContact OD2-CD 3.23Å; D352-G450 PolarHBondContact OD1-N 3.48Å; D352-G450 PolarHBondContact OD2-N 3.44Å
353	C	83.9	Confident	88.8	Confident	69 Å²	69	53.7 Å²	53.7	47%	0.466	29%	0.291	S	S	.	.	S	Bend	trans	-96.4	-45.9	-177.6	-59.4	0	0	0	0	111.1	Y325	Y325-C353 WeakPolarHBondContact CE2-O 3.46Å
354	E	87.5	Confident	89.6	Confident	41 Å²	41	55 Å²	55	19%	0.192	30%	0.299	C	S	.	.	S	Bend	trans	-78.6	136	-174.3	-66.8	-52.1	128.4	0	0	112.2	S323 F351 G356 L452 W527	S323-E354 WeakPolarHBondContact CB-O 3.48Å; S323-E354 PolarHBondContact OG-O 2.98Å; F351-E354 WeakPolarHBondContact CB-O 3.36Å; E354-G356 PolarHBondContact O-N 2.84Å; E354-L452 HydrophobicContact CB-CD1 3.78Å; E354-L452 HydrophobicContact CB-CG 4.43Å; E354-L452 HydrophobicContact CG-CB 3.95Å; E354-L452 HydrophobicContact CG-CD1 3.58Å; E354-L452 HydrophobicContact CG-CG 3.69Å; E354-W527 PolarHBondContact OE2-NE1 2.88Å
355	P	92.2	Very high	90.7	Very high	5 Å²	5	58.7 Å²	58.7	3%	0.032	29%	0.294	C	S	.	.			trans	-78.2	58.4	176.1	33.7	-37.4	0	0	0	112.1	L326 Y337 W527 L528 K529	L326-P355 WeakPolarHBondContact CD1-O 3.47Å; L326-P355 HydrophobicContact CD2-CB 3.98Å; L326-P355 HydrophobicContact CG-CB 4.29Å; Y337-P355 HydrophobicContact CD2-CB 3.96Å; Y337-P355 HydrophobicContact CE2-CB 3.94Å; Y337-P355 HydrophobicContact CE2-CG 4.28Å; P355-W527 HydrophobicContact CG-CD2 4.15Å; P355-W527 HydrophobicContact CG-CZ2 3.85Å; P355-W527 WeakPolarHBondContact O-CA 3.44Å; P355-L528 VanDerWaalsContact CB-O 3.23Å; P355-L528 WeakPolarHBondContact CB-O 3.5Å; P355-L528 WeakPolarHBondContact CG-O 3.37Å; P355-L528 PolarHBondContact O-N 3.5Å; P355-K529 HydrophobicContact CG-CB 3.74Å; P355-K529 HydrophobicContact CG-CG 4.23Å
356	G	94.4	Very high	91.5	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	158	177.9	0	0	0	0	0	114.2	S323 L326 F351 E354 L526	S323-G356 PolarHBondContact N-O 3.14Å; L326-G356 VanDerWaalsContact CD1-O 3.3Å; L326-G356 WeakPolarHBondContact CD1-O 3.24Å; F351-G356 VanDerWaalsContact CD2-C 3.41Å; F351-G356 WeakPolarHBondContact CD2-O 3.45Å; E354-G356 PolarHBondContact O-N 2.84Å; G356-L526 CarbonylContact C-O 3.55Å; G356-L526 WeakPolarHBondContact CA-O 3.5Å
357	V	96.2	Very high	92.5	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	144.7	171	60.6	0	0	0	0	110.5	L317 A322 L326 L328 V335 L526	L317-V357 HydrophobicContact CB-CG2 4.07Å; L317-V357 HydrophobicContact CD1-CG1 4.3Å; L317-V357 HydrophobicContact CD2-CG1 4.02Å; L317-V357 HydrophobicContact CD2-CG2 4.2Å; A322-V357 HydrophobicContact CB-CB 4.12Å; A322-V357 HydrophobicContact CB-CG2 3.74Å; L326-V357 HydrophobicContact CD1-CB 3.9Å; L326-V357 HydrophobicContact CD1-CG1 4.03Å; L328-V357 HydrophobicContact CD1-CG2 4.38Å; L328-V357 HydrophobicContact CD2-CG2 4.5Å; V335-V357 HydrophobicContact CG2-CG1 4.3Å; V357-L526 HydrophobicContact CG1-CB 3.87Å; V357-L526 PolarHBondContact N-O 3.07Å; V357-L526 PolarHBondContact O-N 3.26Å
358	L	97.1	Very high	93.2	Very high	5 Å²	5	44 Å²	44	3%	0.026	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	157.5	176.9	-58.3	172.8	0	0	0	111.5	D318 S321 F351 A442 V446 V523 P524 F525	D318-L358 PolarHBondContact N-O 3.37Å; S321-L358 PolarHBondContact OG-N 3.27Å; F351-L358 HydrophobicContact CE2-CD1 4.48Å; F351-L358 HydrophobicContact CE2-CD2 4.26Å; F351-L358 HydrophobicContact CE2-CG 3.94Å; F351-L358 HydrophobicContact CZ-CD2 4.2Å; F351-L358 HydrophobicContact CZ-CG 4.27Å; L358-A442 HydrophobicContact CD2-CB 4.2Å; L358-V446 HydrophobicContact CD1-CG1 4.32Å; L358-V446 HydrophobicContact CD2-CG1 4.14Å; L358-V523 HydrophobicContact CB-CG2 4.15Å; L358-V523 HydrophobicContact CD1-CG2 4.29Å; L358-V523 HydrophobicContact CD2-CG2 3.74Å; L358-V523 HydrophobicContact CG-CG2 4.26Å; L358-P524 CarbonylContact C-O 3.51Å; L358-P524 WeakPolarHBondContact CA-O 3.38Å; L358-F525 HydrophobicContact CD2-CB 4.38Å; L358-F525 HydrophobicContact CD2-CD2 3.72Å
359	G	97	Very high	93.8	Very high	4 Å²	4	39.3 Å²	39.3	4%	0.041	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-71.4	143	165.3	0	0	0	0	0	112	T316 K361 P524	T316-G359 CarbonylContact O-C 3.31Å; T316-G359 WeakPolarHBondContact O-CA 3.3Å; G359-K361 VanDerWaalsContact C-N 3.27Å; G359-K361 PolarHBondContact O-N 2.9Å; G359-P524 PolarHBondContact N-O 3.02Å
360	S	95.1	Very high	94.2	Very high	59 Å²	59	35.3 Å²	35.3	41%	0.413	18%	0.182	S	C	.	.	S	Bend	trans	-66.8	-22.9	177.9	58.5	0	0	0	0	114.5	T316	T316-S360 WeakPolarHBondContact O-CB 3.39Å; T316-S360 PolarHBondContact O-N 2.73Å; T316-S360 PolarHBondContact O-OG 2.82Å; T316-S360 PolarHBondContact OG1-OG 3.41Å
361	K	94.5	Very high	94.5	Very high	149 Å²	149	35.8 Å²	35.8	65%	0.648	18%	0.184	S	C	*	.	S	Bend	trans	-122.1	130.4	178	-67.5	-178.5	-175.8	170.6	0	109.6	G359 P524	G359-K361 VanDerWaalsContact C-N 3.27Å; G359-K361 PolarHBondContact O-N 2.9Å; K361-P524 WeakPolarHBondContact O-CD 3.42Å
362	G	95.2	Very high	94.7	Very high	13 Å²	13	35.8 Å²	35.8	13%	0.134	18%	0.184	C	C	.	.			trans	-112	162.8	172.4	0	0	0	0	0	113.1	R521 L522	G362-R521 PolarHBondContact O-NH1 3.4Å; G362-L522 CarbonylContact C-O 3.45Å; G362-L522 VanDerWaalsContact C-O 3.31Å; G362-L522 WeakPolarHBondContact CA-O 3.29Å
363	F	97	Very high	95.1	Very high	29 Å²	29	35.3 Å²	35.3	13%	0.127	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-114.5	142.1	-173.4	-49.7	-80.2	0	0	0	110.3	V313 V368 W370 L493 R521 L522 P524	V313-F363 HydrophobicContact CB-CZ 4.5Å; V313-F363 HydrophobicContact CG1-CE1 4.33Å; V313-F363 HydrophobicContact CG2-CE1 4.22Å; V313-F363 HydrophobicContact CG2-CZ 3.82Å; F363-V368 HydrophobicContact CB-CG2 4.49Å; F363-V368 HydrophobicContact CD1-CB 4.38Å; F363-V368 HydrophobicContact CD1-CG1 3.91Å; F363-V368 HydrophobicContact CD1-CG2 3.91Å; F363-V368 HydrophobicContact CD2-CG2 4.03Å; F363-V368 HydrophobicContact CE1-CB 4.31Å; F363-V368 HydrophobicContact CE1-CG1 4.02Å; F363-V368 HydrophobicContact CE1-CG2 4.11Å; F363-V368 HydrophobicContact CE2-CG2 4.23Å; F363-V368 HydrophobicContact CG-CG2 3.87Å; F363-V368 HydrophobicContact CZ-CG2 4.27Å; F363-W370 HydrophobicContact CD2-CZ3 4.47Å; F363-W370 HydrophobicContact CE2-CE3 4.49Å; F363-W370 HydrophobicContact CE2-CH2 4.39Å; F363-W370 AromaticContact CE2-CZ3 3.93Å; F363-W370 HydrophobicContact CE2-CZ3 3.93Å; F363-L493 HydrophobicContact CB-CD2 3.91Å; F363-L493 HydrophobicContact CD2-CD2 4.13Å; F363-L493 HydrophobicContact CG-CD2 4.32Å; F363-R521 WeakPolarHBondContact O-CA 3.43Å; F363-L522 PolarHBondContact N-O 2.69Å; F363-L522 PolarHBondContact O-N 3.17Å; F363-P524 HydrophobicContact CE2-CG 4.09Å
364	T	96.5	Very high	95.5	Very high	62 Å²	62	32.8 Å²	32.8	38%	0.38	16%	0.163	S	C	.	.	S	Bend	trans	-133.2	11.8	176	60.9	0	0	0	0	111.4	Y495 R521	T364-Y495 VanDerWaalsContact C-CD1 3.44Å; T364-Y495 WeakPolarHBondContact O-CD1 3.27Å; T364-Y495 VanDerWaalsContact O-CE1 3.24Å; T364-Y495 WeakPolarHBondContact O-CE1 3.44Å; T364-R521 HydrophobicContact CG2-CB 3.64Å; T364-R521 HydrophobicContact CG2-CG 3.99Å
365	W	95.4	Very high	95.6	Very high	162 Å²	162	34.2 Å²	34.2	61%	0.614	17%	0.17	S	C	*	.	S	Bend	trans	-168.2	157.9	-172.9	66.7	-85.8	0	0	0	110.4	E496	W365-E496 WeakPolarHBondContact CA-OE1 3.46Å; W365-E496 WeakPolarHBondContact CB-OE1 2.99Å
366	G	94.4	Very high	95	Very high	13 Å²	13	35.8 Å²	35.8	13%	0.134	18%	0.175	C	C	.	.	S	Bend	trans	74.7	177.3	170	0	0	0	0	0	115.4	Y495 E496	G366-Y495 PolarHBondContact O-N 3.01Å; G366-Y495 VanDerWaalsContact O-N 3.1Å; G366-E496 VanDerWaalsContact CA-OE2 3.25Å; G366-E496 WeakPolarHBondContact CA-OE2 3.24Å; G366-E496 PolarHBondContact N-OE1 3.39Å; G366-E496 PolarHBondContact N-OE2 3.2Å
367	K	97.5	Very high	93.7	Very high	67 Å²	67	43.7 Å²	43.7	29%	0.291	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	115.9	170.2	-70.7	-172.5	174.8	-169.1	0	109.5	E309 Y310 K311 L493 D494	E309-K367 HydrophobicContact CB-CD 4.35Å; E309-K367 WeakPolarHBondContact O-CB 3.27Å; E309-K367 WeakPolarHBondContact O-CD 3.34Å; E309-K367 IonicContact OE2-NZ 3.56Å; E309-K367 PolarHBondContact OE2-NZ 3.19Å; Y310-K367 HydrophobicContact CD1-CB 3.57Å; Y310-K367 HydrophobicContact CD1-CD 4.5Å; Y310-K367 HydrophobicContact CD1-CG 4.32Å; Y310-K367 HydrophobicContact CE1-CB 3.86Å; Y310-K367 HydrophobicContact CE1-CD 4.19Å; Y310-K367 HydrophobicContact CE1-CG 4.1Å; Y310-K367 HydrophobicContact CG-CB 4.13Å; K311-K367 PolarHBondContact N-O 3.1Å; K367-L493 CarbonylContact C-O 3.5Å; K367-L493 VanDerWaalsContact CA-O 3.27Å; K367-L493 WeakPolarHBondContact CA-O 3.3Å; K367-D494 WeakPolarHBondContact CE-OD2 3.26Å; K367-D494 HydrophobicContact CG-CB 4.07Å; K367-D494 IonicContact NZ-OD2 2.69Å
368	V	97	Very high	91.5	Very high	8 Å²	8	47.3 Å²	47.3	5%	0.048	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	150.3	179.7	-65.3	0	0	0	0	111.4	K311 V313 F363 W370 A492 L493	K311-V368 WeakPolarHBondContact O-CA 3.33Å; V313-V368 HydrophobicContact CG1-CB 4.29Å; V313-V368 HydrophobicContact CG1-CG1 4.09Å; V313-V368 HydrophobicContact CG2-CB 4.09Å; F363-V368 HydrophobicContact CB-CG2 4.49Å; F363-V368 HydrophobicContact CD1-CB 4.38Å; F363-V368 HydrophobicContact CD1-CG1 3.91Å; F363-V368 HydrophobicContact CD1-CG2 3.91Å; F363-V368 HydrophobicContact CD2-CG2 4.03Å; F363-V368 HydrophobicContact CE1-CB 4.31Å; F363-V368 HydrophobicContact CE1-CG1 4.02Å; F363-V368 HydrophobicContact CE1-CG2 4.11Å; F363-V368 HydrophobicContact CE2-CG2 4.23Å; F363-V368 HydrophobicContact CG-CG2 3.87Å; F363-V368 HydrophobicContact CZ-CG2 4.27Å; V368-W370 HydrophobicContact CG2-CZ3 3.97Å; V368-A492 WeakPolarHBondContact O-CA 3.4Å; V368-L493 HydrophobicContact CG2-CB 3.9Å; V368-L493 HydrophobicContact CG2-CD2 4.1Å; V368-L493 HydrophobicContact CG2-CG 4.29Å; V368-L493 PolarHBondContact N-O 2.67Å; V368-L493 PolarHBondContact O-N 3.33Å
369	Y	97.4	Very high	89.2	Confident	5 Å²	5	52.5 Å²	52.5	2%	0.02	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	142.2	-178	178.2	-100.6	0	0	0	111.3	R306 K311 T312 V313 E371 G490 I491 A492	R306-Y369 VanDerWaalsContact CD-CZ 3.43Å; R306-Y369 PolarHBondContact NE-OH 3.4Å; K311-Y369 PolarHBondContact O-N 3.38Å; T312-Y369 CarbonylContact C-O 3.46Å; T312-Y369 WeakPolarHBondContact CA-O 3.48Å; V313-Y369 WeakPolarHBondContact CG2-O 3.38Å; V313-Y369 PolarHBondContact N-O 2.91Å; Y369-E371 HydrophobicContact CE1-CG 3.61Å; Y369-E371 WeakPolarHBondContact CE1-OE1 3.26Å; Y369-E371 WeakPolarHBondContact OH-CG 3.34Å; Y369-E371 PolarHBondContact OH-OE1 3.46Å; Y369-E371 VanDerWaalsContact OH-OE1 3.08Å; Y369-G490 WeakPolarHBondContact OH-CA 3.19Å; Y369-I491 WeakPolarHBondContact CA-O 3.03Å; Y369-I491 VanDerWaalsContact CD2-O 3.3Å; Y369-I491 WeakPolarHBondContact CD2-O 3.46Å; Y369-A492 HydrophobicContact CD2-CB 3.9Å
370	W	97.3	Very high	86.5	Confident	1 Å²	1	56.1 Å²	56.1	0%	0.004	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	168	167.5	65.5	92.9	0	0	0	109.5	V313 V315 F363 V368 V441 I491 L493 P524	V313-W370 HydrophobicContact CG2-CB 4.38Å; V313-W370 HydrophobicContact CG2-CE3 3.93Å; V315-W370 HydrophobicContact CB-CG 4.49Å; V315-W370 HydrophobicContact CG2-CB 3.84Å; V315-W370 HydrophobicContact CG2-CD2 3.77Å; V315-W370 HydrophobicContact CG2-CE3 4.17Å; V315-W370 HydrophobicContact CG2-CG 3.6Å; F363-W370 HydrophobicContact CD2-CZ3 4.47Å; F363-W370 HydrophobicContact CE2-CE3 4.49Å; F363-W370 HydrophobicContact CE2-CH2 4.39Å; F363-W370 AromaticContact CE2-CZ3 3.93Å; F363-W370 HydrophobicContact CE2-CZ3 3.93Å; V368-W370 HydrophobicContact CG2-CZ3 3.97Å; W370-V441 HydrophobicContact CH2-CG1 3.43Å; W370-V441 VanDerWaalsContact CH2-CG1 3.43Å; W370-V441 HydrophobicContact CZ2-CG1 3.65Å; W370-I491 HydrophobicContact CD2-CB 4.36Å; W370-I491 HydrophobicContact CH2-CG2 3.92Å; W370-I491 HydrophobicContact CZ2-CB 4.01Å; W370-I491 HydrophobicContact CZ2-CD1 4.33Å; W370-I491 HydrophobicContact CZ2-CG2 3.56Å; W370-I491 PolarHBondContact N-O 3.3Å; W370-I491 VanDerWaalsContact N-O 3.14Å; W370-I491 PolarHBondContact O-N 2.85Å; W370-L493 HydrophobicContact CZ3-CB 4.45Å; W370-P524 HydrophobicContact CH2-CG 4.08Å; W370-P524 HydrophobicContact CZ2-CB 3.88Å; W370-P524 HydrophobicContact CZ2-CG 3.77Å
371	E	97.5	Very high	83.9	Confident	24 Å²	24	61.1 Å²	61.1	11%	0.112	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	148.1	-177.8	-70.4	175.5	-170.4	0	0	111	Y369 R488 V489 A505 R538	Y369-E371 HydrophobicContact CE1-CG 3.61Å; Y369-E371 WeakPolarHBondContact CE1-OE1 3.26Å; Y369-E371 WeakPolarHBondContact OH-CG 3.34Å; Y369-E371 PolarHBondContact OH-OE1 3.46Å; Y369-E371 VanDerWaalsContact OH-OE1 3.08Å; E371-R488 HydrophobicContact CB-CG 4.07Å; E371-R488 WeakPolarHBondContact OE2-CD 3.36Å; E371-R488 IonicContact OE2-NE 3.67Å; E371-R488 IonicContact OE2-NH1 2.81Å; E371-R488 PolarHBondContact OE2-NH1 2.83Å; E371-V489 CarbonylContact C-O 3.59Å; E371-V489 WeakPolarHBondContact CA-O 3.42Å; E371-A505 HydrophobicContact CG-CB 3.94Å; E371-R538 HydrophobicContact CB-CB 3.84Å; E371-R538 PolarHBondContact N-O 3.49Å; E371-R538 VanDerWaalsContact N-O 3.09Å; E371-R538 PolarHBondContact O-N 3.41Å
372	V	97.5	Very high	81.4	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	118.7	171.8	-173.1	0	0	0	0	108.4	V439 R488 V489 I491 L526 L535 L536 L537	V372-V439 HydrophobicContact CB-CB 4.47Å; V372-V439 HydrophobicContact CB-CG1 4.09Å; V372-V439 HydrophobicContact CG1-CG1 3.71Å; V372-V439 HydrophobicContact CG2-CB 4.42Å; V372-V439 HydrophobicContact CG2-CG1 4.42Å; V372-R488 CarbonylContact O-C 3.36Å; V372-R488 WeakPolarHBondContact O-CA 3.2Å; V372-V489 PolarHBondContact N-O 3.49Å; V372-V489 PolarHBondContact O-N 3.42Å; V372-I491 HydrophobicContact CG2-CD1 3.73Å; V372-L526 HydrophobicContact CG1-CD2 4.06Å; V372-L526 HydrophobicContact CG2-CD2 4.03Å; V372-L535 HydrophobicContact CG1-CB 4.09Å; V372-L535 HydrophobicContact CG1-CD2 4.46Å; V372-L536 CarbonylContact C-O 3.56Å; V372-L536 WeakPolarHBondContact CA-O 3.18Å; V372-L537 HydrophobicContact CG2-CD2 4.02Å
373	E	96.3	Very high	78.9	Confident	25 Å²	25	68 Å²	68	12%	0.117	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	137.3	175.7	-178.5	168.2	-122.9	0	0	110	R487 R488 L535 L536 R538	E373-R487 WeakPolarHBondContact CA-O 3.42Å; E373-R488 HydrophobicContact CB-CG 4.13Å; E373-R488 IonicContact OE1-CZ 2.82Å; E373-R488 IonicContact OE1-NE 3.11Å; E373-R488 IonicContact OE1-NH2 2.7Å; E373-R488 PolarHBondContact OE1-NH2 3.34Å; E373-L535 CarbonylContact O-C 3.55Å; E373-L535 WeakPolarHBondContact O-CA 3.46Å; E373-L536 HydrophobicContact CB-CB 4.29Å; E373-L536 PolarHBondContact N-O 2.84Å; E373-L536 PolarHBondContact O-N 3.39Å; E373-R538 HydrophobicContact CB-CG 4.25Å; E373-R538 IonicContact OE2-CZ 2.92Å; E373-R538 IonicContact OE2-NE 3.53Å; E373-R538 PolarHBondContact OE2-NE 3.03Å; E373-R538 IonicContact OE2-NH2 3.47Å; E373-R538 PolarHBondContact OE2-NH2 2.92Å
374	V	92.6	Very high	76.3	Confident	16 Å²	16	75.2 Å²	75.2	10%	0.097	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	103.4	-179.4	-173	0	0	0	0	107.7	R376 L465 R487 T533 L535	V374-R376 HydrophobicContact CG1-CG 4.32Å; V374-L465 HydrophobicContact CG2-CD1 3.91Å; V374-R487 PolarHBondContact N-O 2.97Å; V374-T533 HydrophobicContact CG1-CG2 3.9Å; V374-L535 HydrophobicContact CB-CD2 4.26Å; V374-L535 HydrophobicContact CG1-CD2 4.09Å; V374-L535 HydrophobicContact CG2-CD2 3.81Å
375	E	89.8	Confident	73.7	Confident	72 Å²	72	79.3 Å²	79.3	34%	0.336	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	130.5	174.3	-78.1	178.5	-174.4	0	0	109.4	T533 R534 L536	E375-T533 CarbonylContact O-C 3.26Å; E375-T533 WeakPolarHBondContact O-CA 3.26Å; E375-T533 WeakPolarHBondContact O-CG2 3.48Å; E375-R534 HydrophobicContact CB-CB 4.28Å; E375-R534 PolarHBondContact N-O 2.9Å; E375-R534 PolarHBondContact O-N 2.63Å; E375-R534 IonicContact OE2-NH1 3.92Å; E375-L536 HydrophobicContact CB-CD1 3.88Å; E375-L536 VanDerWaalsContact CD-CD1 3.42Å; E375-L536 HydrophobicContact CG-CD1 3.65Å; E375-L536 WeakPolarHBondContact OE1-CD2 3.42Å; E375-L536 WeakPolarHBondContact OE2-CD1 3.23Å
376	R	79.8	Confident	70.7	Confident	37 Å²	37	75.6 Å²	75.6	14%	0.14	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	131.5	178.5	-63.8	180	-172.3	-179.7	10.6	109.9	V374 G378 W379 T533	V374-R376 HydrophobicContact CG1-CG 4.32Å; R376-G378 PolarHBondContact O-N 2.92Å; R376-W379 HydrophobicContact CB-CB 4.27Å; R376-W379 HydrophobicContact CB-CD2 4.16Å; R376-W379 HydrophobicContact CB-CG 3.6Å; R376-W379 HydrophobicContact CG-CD2 4.47Å; R376-W379 HydrophobicContact CG-CG 4.4Å; R376-W379 PolarHBondContact O-N 2.9Å; R376-T533 HydrophobicContact CG-CG2 3.97Å
377	E	65.5	Low	68.1	Low	166 Å²	166	80.7 Å²	80.7	78%	0.776	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	126.1	170.7	-74.7	-177.6	167.5	0	0	109.6	G532	E377-G532 PolarHBondContact N-O 3.42Å
378	G	51.5	Low	65.5	Low	76 Å²	76	86.4 Å²	86.4	78%	0.784	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.9	-1.8	-179.9	0	0	0	0	0	116	R376 S380	R376-G378 PolarHBondContact O-N 2.92Å; G378-S380 VanDerWaalsContact C-N 3.3Å; G378-S380 PolarHBondContact O-N 3.29Å
379	W	48.5	Very low	62.8	Low	115 Å²	115	94 Å²	94	44%	0.436	49%	0.493	S	S	.	.			trans	-83.4	78.1	171.6	-74	49.4	0	0	0	108.4	R376	R376-W379 HydrophobicContact CB-CB 4.27Å; R376-W379 HydrophobicContact CB-CD2 4.16Å; R376-W379 HydrophobicContact CB-CG 3.6Å; R376-W379 HydrophobicContact CG-CD2 4.47Å; R376-W379 HydrophobicContact CG-CG 4.4Å; R376-W379 PolarHBondContact O-N 2.9Å
380	S	39.1	Very low	60.2	Low	80 Å²	80	102.7 Å²	102.7	56%	0.559	53%	0.534	S	S	*	.			trans	-70.3	159.1	166.8	56.2	0	0	0	0	110.3	G378 D382	G378-S380 VanDerWaalsContact C-N 3.3Å; G378-S380 PolarHBondContact O-N 3.29Å; S380-D382 WeakPolarHBondContact CB-OD2 3.44Å; S380-D382 PolarHBondContact O-N 3.03Å; S380-D382 PolarHBondContact OG-OD2 3.29Å
381	E	42.4	Very low	57.6	Low	164 Å²	164	111 Å²	111	77%	0.766	57%	0.573	S	S	*	*	S	Bend	trans	-70.8	26.7	-163.6	-63.8	170	148.8	0	0	115.1
382	D	41	Very low	54.6	Low	132 Å²	132	112 Å²	112	71%	0.706	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.4	27.8	-158.3	-53.6	-51.1	0	0	0	115.8	S380	S380-D382 WeakPolarHBondContact CB-OD2 3.44Å; S380-D382 PolarHBondContact O-N 3.03Å; S380-D382 PolarHBondContact OG-OD2 3.29Å
383	E	43.4	Very low	51.8	Low	175 Å²	175	119.7 Å²	119.7	82%	0.818	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.5	9.4	171.7	-71	-172.2	178	0	0	114	E385	E383-E385 PolarHBondContact O-N 3.08Å
384	E	41.1	Very low	49	Very low	180 Å²	180	127.8 Å²	127.8	84%	0.841	66%	0.664	S	S	*	*	S	Bend	trans	-83.5	107	165.5	-75.2	-172.4	174.5	0	0	109.7
385	E	42.2	Very low	46.4	Very low	147 Å²	147	135 Å²	135	69%	0.687	70%	0.697	S	S	*	*			trans	70.8	87.9	159.9	-59	-177.9	170.4	0	0	115.6	E383 D387	E383-E385 PolarHBondContact O-N 3.08Å; E385-D387 PolarHBondContact O-N 2.92Å
386	G	32.6	Very low	44	Very low	84 Å²	84	139.7 Å²	139.7	87%	0.866	72%	0.718	S	S	*	*			trans	-64.5	76.3	152.6	0	0	0	0	0	110.3	E388	G386-E388 PolarHBondContact O-N 2.85Å
387	D	40.5	Very low	41.8	Very low	120 Å²	120	147.6 Å²	147.6	64%	0.642	76%	0.757	S	S	*	*			trans	-81.9	101	160.3	-83.3	-18.4	0	0	0	107.2	E385 E389	E385-D387 PolarHBondContact O-N 2.92Å; D387-E389 PolarHBondContact O-N 2.86Å
388	E	42.2	Very low	40.5	Very low	188 Å²	188	148 Å²	148	88%	0.879	76%	0.759	S	S	*	*			trans	-61.9	86.4	159.1	-70.3	179.9	170.6	0	0	107.6	G386 E390	G386-E388 PolarHBondContact O-N 2.85Å; E388-E390 PolarHBondContact O-N 2.65Å
389	E	40.3	Very low	39.8	Very low	166 Å²	166	153.7 Å²	153.7	78%	0.776	77%	0.765	S	S	*	*			trans	-65.7	88.7	162.6	-70	-165.7	162.3	0	0	107.7	D387 E391	D387-E389 PolarHBondContact O-N 2.86Å; E389-E391 PolarHBondContact O-N 2.77Å
390	E	43.9	Very low	39.3	Very low	188 Å²	188	157.5 Å²	157.5	88%	0.879	79%	0.788	S	S	*	*			trans	-58.3	95.8	154.8	-85.2	-171.2	160.7	0	0	106.9	E388 G392	E388-E390 PolarHBondContact O-N 2.65Å; E390-G392 VanDerWaalsContact C-N 3.28Å; E390-G392 PolarHBondContact O-N 3.36Å
391	E	41.1	Very low	39.1	Very low	175 Å²	175	158.6 Å²	158.6	82%	0.818	80%	0.801	S	S	*	*			trans	-54.3	95.9	164.7	-73.5	-168.9	162	0	0	107.9	E389 E393	E389-E391 PolarHBondContact O-N 2.77Å; E391-E393 PolarHBondContact O-N 2.8Å
392	G	35.7	Very low	38.9	Very low	46 Å²	46	154.5 Å²	154.5	47%	0.474	80%	0.803	S	S	.	*			trans	-68	100.7	176.8	0	0	0	0	0	109.5	E390 E394	E390-G392 VanDerWaalsContact C-N 3.28Å; E390-G392 PolarHBondContact O-N 3.36Å; G392-E394 PolarHBondContact O-N 2.79Å
393	E	38.7	Very low	39	Very low	162 Å²	162	159.9 Å²	159.9	76%	0.757	82%	0.815	S	S	*	*			trans	-47.2	126	162.7	-67.8	-177.2	156.4	0	0	109.4	E391 E395	E391-E393 PolarHBondContact O-N 2.8Å; E393-E395 PolarHBondContact O-N 2.76Å
394	E	36.8	Very low	38.8	Very low	194 Å²	194	155.1 Å²	155.1	91%	0.907	81%	0.814	S	S	*	*			trans	-67.6	81	169	-67.5	-176.2	153.2	0	0	108.3	G392 E396	G392-E394 PolarHBondContact O-N 2.79Å; E394-E396 PolarHBondContact O-N 2.92Å
395	E	38.3	Very low	38.6	Very low	169 Å²	169	153.9 Å²	153.9	79%	0.79	81%	0.813	S	S	*	*			trans	-76	94.1	168.6	-74.1	-167.9	160	0	0	109.3	E393	E393-E395 PolarHBondContact O-N 2.76Å
396	E	39	Very low	38.5	Very low	169 Å²	169	150.4 Å²	150.4	79%	0.79	82%	0.816	S	S	*	*			trans	-55.6	128.8	151.4	-67.1	-170.6	151.3	0	0	108.4	E394 E398	E394-E396 PolarHBondContact O-N 2.92Å; E396-E398 PolarHBondContact O-N 3Å
397	E	34.8	Very low	38.9	Very low	203 Å²	203	156.5 Å²	156.5	95%	0.949	82%	0.815	S	S	*	*			trans	-61.7	91.7	178.2	-68.3	-178.5	161	0	0	110.4
398	E	38.1	Very low	39	Very low	176 Å²	176	158 Å²	158	82%	0.822	82%	0.823	S	S	*	*			trans	-115.9	123	164.9	-70	-159	158.2	0	0	111.3	E396 E400	E396-E398 PolarHBondContact O-N 3Å; E398-E400 PolarHBondContact O-N 2.84Å
399	E	35.6	Very low	38.8	Very low	194 Å²	194	154.4 Å²	154.4	91%	0.907	81%	0.809	S	S	*	*			trans	-65.3	120.1	173.6	-60.2	-179.6	146.5	0	0	110
400	E	38.6	Very low	39.2	Very low	196 Å²	196	157.7 Å²	157.7	92%	0.916	82%	0.815	S	S	*	*			trans	-150.1	147.3	146.2	-81.6	-141.3	163.4	0	0	112.6	E398	E398-E400 PolarHBondContact O-N 2.84Å
401	A	33.9	Very low	39	Very low	102 Å²	102	155.9 Å²	155.9	84%	0.843	81%	0.806	S	S	*	*			trans	-109	131.6	-178	0	0	0	0	0	109.2
402	G	38.7	Very low	38.8	Very low	78 Å²	78	153.1 Å²	153.1	80%	0.804	80%	0.801	S	S	*	*			trans	-157.3	120	173	0	0	0	0	0	111.2
403	Y	42.4	Very low	39.1	Very low	245 Å²	245	157.8 Å²	157.8	96%	0.961	82%	0.815	S	S	*	*			trans	-76.9	152	178.3	-86.3	-102	0	0	0	112.2
404	G	39.9	Very low	39.3	Very low	76 Å²	76	157.8 Å²	157.8	78%	0.784	82%	0.816	S	S	*	*			trans	160.9	102.6	153.7	0	0	0	0	0	113.4
405	D	38.1	Very low	39.3	Very low	154 Å²	154	156.8 Å²	156.8	82%	0.824	82%	0.817	S	S	*	*			trans	-78.7	154.7	167.3	90.9	68.9	0	0	0	111
406	G	38.4	Very low	39.6	Very low	73 Å²	73	157.5 Å²	157.5	75%	0.753	82%	0.82	S	S	*	*			trans	-169.3	91.7	169.5	0	0	0	0	0	109.8
407	Y	40.9	Very low	39.6	Very low	213 Å²	213	158.9 Å²	158.9	84%	0.835	83%	0.826	S	S	*	*			trans	-65.8	137.2	162.7	-85.8	-97.7	0	0	0	109.4
408	D	42.9	Very low	40	Very low	152 Å²	152	152.6 Å²	152.6	81%	0.813	81%	0.805	S	S	*	*			trans	-147.3	134.4	141.8	-103	-25.9	0	0	0	110.9
409	D	37.8	Very low	40.4	Very low	112 Å²	112	153.3 Å²	153.3	60%	0.599	81%	0.813	S	S	*	*			trans	-100	137.5	-174.5	169.4	39.7	0	0	0	107.5
410	W	49.9	Very low	40.9	Very low	235 Å²	235	145 Å²	145	89%	0.89	78%	0.779	S	S	*	*			trans	-138.9	102.9	160.9	-73.2	102.1	0	0	0	109.3
411	E	39.7	Very low	41.3	Very low	150 Å²	150	140 Å²	140	70%	0.701	76%	0.759	S	S	*	*			trans	-52.6	140.2	165.8	-79.3	-177.1	153.6	0	0	113.4
412	T	37.1	Very low	41.8	Very low	116 Å²	116	143 Å²	143	71%	0.712	76%	0.755	S	S	*	*			trans	33.2	133.5	135.7	61.1	0	0	0	0	120.8
413	D	41.7	Very low	42.1	Very low	144 Å²	144	146.5 Å²	146.5	77%	0.77	75%	0.751	S	S	*	*			trans	-170.7	139.4	137.6	-81.7	-27.4	0	0	0	104.7
414	E	43.7	Very low	42.1	Very low	163 Å²	163	140.4 Å²	140.4	76%	0.762	73%	0.731	S	S	*	*			cis	-167.1	124.6	2.9	-95.7	166.8	165.8	0	0	103.4	E416	E414-E416 PolarHBondContact O-N 2.85Å
415	D	36.3	Very low	42.5	Very low	173 Å²	173	142.3 Å²	142.3	93%	0.925	72%	0.72	S	S	*	*			trans	-87.2	98.8	170.5	-65	-43.6	0	0	0	108
416	E	45.1	Very low	42.8	Very low	184 Å²	184	141.4 Å²	141.4	86%	0.86	71%	0.711	S	S	*	*			trans	-91.8	112.7	162.8	-87.4	-158.5	155.9	0	0	109.6	E414 S418	E414-E416 PolarHBondContact O-N 2.85Å; E416-S418 PolarHBondContact O-N 2.84Å
417	E	37.9	Very low	43.1	Very low	197 Å²	197	144.6 Å²	144.6	92%	0.921	71%	0.706	S	S	*	*			trans	-52.6	111.9	170.5	-62.9	-178.9	161.1	0	0	111
418	S	43.7	Very low	43.3	Very low	72 Å²	72	140.4 Å²	140.4	50%	0.503	69%	0.694	S	S	.	*			trans	-99.1	112.4	170.6	-175.6	0	0	0	0	109.8	E416 G420	E416-S418 PolarHBondContact O-N 2.84Å; S418-G420 PolarHBondContact O-N 2.96Å; S418-G420 PolarHBondContact OG-N 2.98Å
419	L	46.2	Very low	43.6	Very low	191 Å²	191	139.6 Å²	139.6	100%	1	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	36.6	167.5	-70.6	162.4	0	0	0	111.5
420	G	45.8	Very low	44.1	Very low	18 Å²	18	141.4 Å²	141.4	19%	0.186	69%	0.69	C	S	.	*	T	Hydrogen-bonded Turn	trans	-114.2	-11.2	-179.3	0	0	0	0	0	114.2	S418 E422 E423 E424	S418-G420 PolarHBondContact O-N 2.96Å; S418-G420 PolarHBondContact OG-N 2.98Å; G420-E422 VanDerWaalsContact C-N 3.31Å; G420-E422 PolarHBondContact O-N 2.79Å; G420-E423 PolarHBondContact O-N 3.34Å; G420-E424 PolarHBondContact O-N 3.02Å; G420-E424 VanDerWaalsContact O-N 3.14Å
421	D	47.3	Very low	44	Very low	93 Å²	93	136.8 Å²	136.8	50%	0.497	68%	0.678	S	S	.	*	H	α-helix	trans	-63.5	-31.9	-172.3	-60.9	-7.7	0	0	0	112.9	E425	D421-E425 WeakPolarHBondContact O-CB 3.29Å; D421-E425 WeakPolarHBondContact O-CG 3.15Å; D421-E425 PolarHBondContact O-N 2.83Å
422	E	44.5	Very low	44.5	Very low	163 Å²	163	133.7 Å²	133.7	76%	0.762	66%	0.664	S	S	*	*	H	α-helix	trans	-71.8	-33.6	179.5	-67.9	-175.9	176.9	0	0	113.2	G420 E426	G420-E422 VanDerWaalsContact C-N 3.31Å; G420-E422 PolarHBondContact O-N 2.79Å; E422-E426 WeakPolarHBondContact O-CB 3.4Å; E422-E426 WeakPolarHBondContact O-CG 3.45Å; E422-E426 PolarHBondContact O-N 3.32Å; E422-E426 VanDerWaalsContact O-N 3.17Å
423	E	44.1	Very low	45.4	Very low	152 Å²	152	131.8 Å²	131.8	71%	0.71	65%	0.652	S	S	*	*	H	α-helix	trans	-79.8	-34.8	177	-73.5	-175.3	175.4	0	0	111.2	G420 E427	G420-E423 PolarHBondContact O-N 3.34Å; E423-E427 WeakPolarHBondContact O-CG 3.44Å; E423-E427 PolarHBondContact O-N 3.22Å
424	E	43.8	Very low	46.3	Very low	117 Å²	117	128.7 Å²	128.7	55%	0.547	64%	0.635	S	S	.	*	H	α-helix	trans	-70.1	-40.4	173.6	-71.1	-175.7	178	0	0	111.6	G420 E427 E428	G420-E424 PolarHBondContact O-N 3.02Å; G420-E424 VanDerWaalsContact O-N 3.14Å; E424-E427 PolarHBondContact O-N 2.71Å; E424-E428 WeakPolarHBondContact O-CB 3.48Å; E424-E428 VanDerWaalsContact O-CG 3.32Å; E424-E428 WeakPolarHBondContact O-CG 3.32Å; E424-E428 PolarHBondContact O-N 3.5Å
425	E	47.4	Very low	48.2	Very low	117 Å²	117	125 Å²	125	55%	0.547	62%	0.618	S	S	.	*	H	α-helix	trans	-62.6	-40.3	172.4	-77.2	178.3	-177.8	0	0	111.6	D421 E429	D421-E425 WeakPolarHBondContact O-CB 3.29Å; D421-E425 WeakPolarHBondContact O-CG 3.15Å; D421-E425 PolarHBondContact O-N 2.83Å; E425-E429 VanDerWaalsContact O-CB 3.3Å; E425-E429 WeakPolarHBondContact O-CB 3.3Å; E425-E429 VanDerWaalsContact O-CG 3.29Å; E425-E429 WeakPolarHBondContact O-CG 3.46Å; E425-E429 PolarHBondContact O-N 3.35Å
426	E	45.1	Very low	50.8	Low	135 Å²	135	116.9 Å²	116.9	63%	0.631	57%	0.574	S	S	*	*	H	α-helix	trans	-66.8	-40	174.9	-79.4	-173.7	179.6	0	0	112.5	E422 E430	E422-E426 WeakPolarHBondContact O-CB 3.4Å; E422-E426 WeakPolarHBondContact O-CG 3.45Å; E422-E426 PolarHBondContact O-N 3.32Å; E422-E426 VanDerWaalsContact O-N 3.17Å; E426-E430 WeakPolarHBondContact O-CB 3.37Å; E426-E430 WeakPolarHBondContact O-CG 3.48Å; E426-E430 PolarHBondContact O-N 3.15Å
427	E	43.3	Very low	53.1	Low	139 Å²	139	108.1 Å²	108.1	65%	0.65	53%	0.533	S	S	*	.	H	α-helix	trans	-69.2	-39.4	175.6	-76.2	-170.4	174.4	0	0	112.3	E423 E424 E430 E431	E423-E427 WeakPolarHBondContact O-CG 3.44Å; E423-E427 PolarHBondContact O-N 3.22Å; E424-E427 PolarHBondContact O-N 2.71Å; E427-E430 PolarHBondContact O-N 3.05Å; E427-E431 WeakPolarHBondContact O-CB 3.31Å; E427-E431 PolarHBondContact O-N 3.49Å
428	E	47.1	Very low	55.8	Low	125 Å²	125	98.9 Å²	98.9	58%	0.584	49%	0.49	S	S	*	.	H	α-helix	trans	-66.7	-41.9	174.2	-75.2	-173.3	175.4	0	0	111.5	E424 E430 E431 E432	E424-E428 WeakPolarHBondContact O-CB 3.48Å; E424-E428 VanDerWaalsContact O-CG 3.32Å; E424-E428 WeakPolarHBondContact O-CG 3.32Å; E424-E428 PolarHBondContact O-N 3.5Å; E428-E430 PolarHBondContact O-N 3.13Å; E428-E431 PolarHBondContact O-N 3.44Å; E428-E432 WeakPolarHBondContact O-CB 3.24Å; E428-E432 WeakPolarHBondContact O-CG 3.35Å; E428-E432 PolarHBondContact O-N 3.46Å
429	E	48.5	Very low	58.4	Low	136 Å²	136	95.5 Å²	95.5	64%	0.636	47%	0.466	S	S	*	.	H	α-helix	trans	-63.1	-40.1	173.2	-78.6	-171	178.4	0	0	111.7	E425 V433	E425-E429 VanDerWaalsContact O-CB 3.3Å; E425-E429 WeakPolarHBondContact O-CB 3.3Å; E425-E429 VanDerWaalsContact O-CG 3.29Å; E425-E429 WeakPolarHBondContact O-CG 3.46Å; E425-E429 PolarHBondContact O-N 3.35Å; E429-V433 VanDerWaalsContact O-CG2 3.23Å; E429-V433 WeakPolarHBondContact O-CG2 3.45Å; E429-V433 PolarHBondContact O-N 3.1Å
430	E	48.5	Very low	60.8	Low	149 Å²	149	86.4 Å²	86.4	70%	0.696	42%	0.419	S	S	*	.	H	α-helix	trans	-67.3	-42	174.6	-78.9	-163.3	171.2	0	0	112.1	E426 E427 E428 V433 L434	E426-E430 WeakPolarHBondContact O-CB 3.37Å; E426-E430 WeakPolarHBondContact O-CG 3.48Å; E426-E430 PolarHBondContact O-N 3.15Å; E427-E430 PolarHBondContact O-N 3.05Å; E428-E430 PolarHBondContact O-N 3.13Å; E430-V433 PolarHBondContact O-N 2.98Å; E430-L434 WeakPolarHBondContact O-CG 2.91Å; E430-L434 PolarHBondContact O-N 3.27Å
431	E	47.5	Very low	63.3	Low	139 Å²	139	85.6 Å²	85.6	65%	0.65	41%	0.41	S	S	*	.	H	α-helix	trans	-67.6	-38.5	176	-79.3	-159.1	158.7	0	0	112.6	E427 E428 V433 L434	E427-E431 WeakPolarHBondContact O-CB 3.31Å; E427-E431 PolarHBondContact O-N 3.49Å; E428-E431 PolarHBondContact O-N 3.44Å; E431-V433 VanDerWaalsContact C-N 3.29Å; E431-V433 PolarHBondContact O-N 3.24Å; E431-L434 HydrophobicContact CG-CD1 4.5Å; E431-L434 WeakPolarHBondContact O-CA 3.42Å; E431-L434 WeakPolarHBondContact O-CB 3.47Å; E431-L434 PolarHBondContact O-N 3.35Å
432	E	50	Low	65.7	Low	85 Å²	85	81.1 Å²	81.1	40%	0.397	39%	0.387	S	S	.	.	H	α-helix	trans	-64.1	-33.8	175.5	-80.9	-158.8	167.7	0	0	112.4	E428 L434 E435 S468	E428-E432 WeakPolarHBondContact O-CB 3.24Å; E428-E432 WeakPolarHBondContact O-CG 3.35Å; E428-E432 PolarHBondContact O-N 3.46Å; E432-L434 PolarHBondContact O-N 3.07Å; E432-E435 PolarHBondContact O-N 3.22Å; E432-S468 VanDerWaalsContact OE1-CB 3.26Å; E432-S468 WeakPolarHBondContact OE1-CB 3.48Å; E432-S468 PolarHBondContact OE1-OG 3.46Å; E432-S468 WeakPolarHBondContact OE2-CB 3.39Å; E432-S468 PolarHBondContact OE2-OG 3.09Å
433	V	55.1	Low	68.1	Low	75 Å²	75	76.7 Å²	76.7	46%	0.455	36%	0.363	S	S	.	.	H	α-helix	trans	-64.8	-24.5	171.6	174.5	0	0	0	0	111.1	E429 E430 E431	E429-V433 VanDerWaalsContact O-CG2 3.23Å; E429-V433 WeakPolarHBondContact O-CG2 3.45Å; E429-V433 PolarHBondContact O-N 3.1Å; E430-V433 PolarHBondContact O-N 2.98Å; E431-V433 VanDerWaalsContact C-N 3.29Å; E431-V433 PolarHBondContact O-N 3.24Å
434	L	60.8	Low	70.5	Confident	79 Å²	79	72.2 Å²	72.2	41%	0.414	34%	0.344	S	S	.	.	H	α-helix	trans	-76.7	-21.1	178.4	-57.4	177	0	0	0	114.1	E430 E431 E432 K529	E430-L434 WeakPolarHBondContact O-CG 2.91Å; E430-L434 PolarHBondContact O-N 3.27Å; E431-L434 HydrophobicContact CG-CD1 4.5Å; E431-L434 WeakPolarHBondContact O-CA 3.42Å; E431-L434 WeakPolarHBondContact O-CB 3.47Å; E431-L434 PolarHBondContact O-N 3.35Å; E432-L434 PolarHBondContact O-N 3.07Å; L434-K529 CarbonylContact C-O 3.52Å; L434-K529 WeakPolarHBondContact O-CG 3.15Å
435	E	84.2	Confident	72.8	Confident	86 Å²	86	69.7 Å²	69.7	40%	0.402	34%	0.339	S	S	.	.	S	Bend	trans	-115	72.3	-176.9	-67.9	-153.4	169.3	0	0	113	E432 K529 W530	E432-E435 PolarHBondContact O-N 3.22Å; E435-K529 WeakPolarHBondContact CA-O 3.42Å; E435-W530 PolarHBondContact OE2-NE1 3.25Å
436	S	91	Very high	74.9	Confident	2 Å²	2	64.8 Å²	64.8	1%	0.014	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	163.2	178.7	63.2	0	0	0	0	113.5	L465 W527 K529	S436-L465 WeakPolarHBondContact CA-O 3.2Å; S436-L465 WeakPolarHBondContact CB-O 3.5Å; S436-W527 VanDerWaalsContact O-CZ3 3.24Å; S436-W527 WeakPolarHBondContact O-CZ3 3.32Å; S436-W527 WeakPolarHBondContact OG-CZ3 3.45Å; S436-K529 PolarHBondContact N-O 3.19Å; S436-K529 CarbonylContact O-C 3.51Å; S436-K529 VanDerWaalsContact O-C 3.26Å; S436-K529 PolarHBondContact O-N 3.07Å
437	C	94	Very high	77.1	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	157.2	168.5	71.8	0	0	0	0	109.9	R464 L465 W527 L528 W530 L535	C437-R464 CarbonylContact O-C 3.55Å; C437-R464 WeakPolarHBondContact O-CA 3.35Å; C437-L465 PolarHBondContact N-O 3.06Å; C437-L465 PolarHBondContact O-N 2.73Å; C437-W527 CarbonylContact C-O 3.59Å; C437-W527 VanDerWaalsContact CA-O 3.29Å; C437-W527 WeakPolarHBondContact CA-O 3.28Å; C437-L528 HydrophobicContact CB-CD1 3.44Å; C437-L528 VanDerWaalsContact CB-CD1 3.44Å; C437-W530 HydrophobicContact CB-CE3 4.31Å; C437-L535 HydrophobicContact CB-CD1 4.17Å; C437-L535 HydrophobicContact CB-CD2 4.2Å
438	M	95.1	Very high	79.4	Confident	4 Å²	4	60.1 Å²	60.1	2%	0.02	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	141.4	175.3	-50	175.1	59.8	0	0	111.1	L454 A462 L463 R464 N473 L526 W527	M438-L454 HydrophobicContact CE-CB 3.96Å; M438-L454 HydrophobicContact CE-CD1 4.16Å; M438-L454 HydrophobicContact SD-CB 4.32Å; M438-L454 HydrophobicContact SD-CD1 3.42Å; M438-L454 WeakPolarHBondContact SD-CD1 3.45Å; M438-A462 HydrophobicContact CB-CB 4.43Å; M438-A462 HydrophobicContact CE-CB 3.81Å; M438-L463 CarbonylContact C-O 3.6Å; M438-L463 WeakPolarHBondContact CA-O 3.34Å; M438-L463 WeakPolarHBondContact CB-O 3.46Å; M438-R464 HydrophobicContact CG-CB 4.06Å; M438-R464 HydrophobicContact CG-CG 4.31Å; M438-N473 HydrophobicContact CE-CB 4.29Å; M438-N473 VanDerWaalsContact CE-CG 3.48Å; M438-N473 WeakPolarHBondContact CE-ND2 3.41Å; M438-L526 WeakPolarHBondContact O-CA 3.4Å; M438-W527 HydrophobicContact CB-CB 4Å; M438-W527 HydrophobicContact CG-CB 4.28Å; M438-W527 HydrophobicContact CG-CE3 4.07Å; M438-W527 PolarHBondContact N-O 2.67Å; M438-W527 PolarHBondContact O-N 3.15Å; M438-W527 HydrophobicContact SD-CB 4.37Å; M438-W527 HydrophobicContact SD-CD2 4.42Å; M438-W527 HydrophobicContact SD-CE3 4.43Å; M438-W527 HydrophobicContact SD-CG 4.44Å
439	V	97.1	Very high	81.4	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	133.1	178.5	-57.9	0	0	0	0	109.1	V372 A462 L463 L465 V489 I491 F502 L526 L535	V372-V439 HydrophobicContact CB-CB 4.47Å; V372-V439 HydrophobicContact CB-CG1 4.09Å; V372-V439 HydrophobicContact CG1-CG1 3.71Å; V372-V439 HydrophobicContact CG2-CB 4.42Å; V372-V439 HydrophobicContact CG2-CG1 4.42Å; V439-A462 VanDerWaalsContact O-CA 3.3Å; V439-A462 WeakPolarHBondContact O-CA 3.35Å; V439-A462 WeakPolarHBondContact O-CB 3.44Å; V439-L463 HydrophobicContact CG2-CB 4.48Å; V439-L463 PolarHBondContact N-O 2.82Å; V439-L463 PolarHBondContact O-N 2.5Å; V439-L465 HydrophobicContact CG1-CD1 4.45Å; V439-L465 HydrophobicContact CG2-CD1 4.25Å; V439-V489 HydrophobicContact CG2-CB 4.13Å; V439-V489 HydrophobicContact CG2-CG1 3.92Å; V439-V489 HydrophobicContact CG2-CG2 4.29Å; V439-I491 HydrophobicContact CB-CD1 4.17Å; V439-I491 HydrophobicContact CG2-CD1 4.47Å; V439-F502 HydrophobicContact CG2-CE1 4.4Å; V439-F502 WeakPolarHBondContact O-CE1 3.33Å; V439-L526 HydrophobicContact CB-CD2 4.27Å; V439-L526 HydrophobicContact CG1-CD2 3.99Å; V439-L535 HydrophobicContact CG1-CD1 4.35Å
440	G	97.6	Very high	83.2	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.01	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.3	-145.9	178.8	0	0	0	0	0	114.7	W461 F525	G440-W461 WeakPolarHBondContact CA-O 3.49Å; G440-F525 PolarHBondContact N-O 2.77Å; G440-F525 PolarHBondContact O-N 2.8Å
441	V	97.8	Very high	84.6	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	148.6	177.8	-61.4	0	0	0	0	111	W370 W461 I491 V500 L522 V523	W370-V441 HydrophobicContact CH2-CG1 3.43Å; W370-V441 VanDerWaalsContact CH2-CG1 3.43Å; W370-V441 HydrophobicContact CZ2-CG1 3.65Å; V441-W461 HydrophobicContact CG2-CB 3.96Å; V441-W461 HydrophobicContact CG2-CE3 4.08Å; V441-W461 PolarHBondContact N-O 3.04Å; V441-W461 PolarHBondContact O-N 2.84Å; V441-I491 HydrophobicContact CG1-CG2 4.46Å; V441-V500 HydrophobicContact CG2-CB 4.39Å; V441-V500 HydrophobicContact CG2-CG1 4.01Å; V441-V500 HydrophobicContact CG2-CG2 3.52Å; V441-L522 HydrophobicContact CG2-CD1 4.27Å; V441-V523 CarbonylContact C-O 3.59Å; V441-V523 VanDerWaalsContact CA-O 3.26Å; V441-V523 WeakPolarHBondContact CA-O 3.43Å
442	A	96.8	Very high	86.2	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	160.1	173.3	0	0	0	0	0	110.4	L358 V446 G459 V460 L522 V523 F525	L358-A442 HydrophobicContact CD2-CB 4.2Å; A442-V446 HydrophobicContact CB-CB 4.31Å; A442-V446 HydrophobicContact CB-CG1 4.27Å; A442-G459 CarbonylContact C-O 3.44Å; A442-G459 VanDerWaalsContact CA-O 3.25Å; A442-G459 WeakPolarHBondContact CA-O 3.43Å; A442-V460 HydrophobicContact CB-CG2 4.08Å; A442-L522 CarbonylContact O-C 3.44Å; A442-L522 WeakPolarHBondContact O-CA 3.38Å; A442-V523 PolarHBondContact N-O 2.92Å; A442-V523 WeakPolarHBondContact O-CG2 3.45Å; A442-V523 PolarHBondContact O-N 3.17Å; A442-F525 HydrophobicContact CB-CB 3.77Å; A442-F525 HydrophobicContact CB-CD2 4.27Å; A442-F525 HydrophobicContact CB-CG 4Å
443	R	96.3	Very high	87.8	Confident	70 Å²	70	43.5 Å²	43.5	26%	0.264	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	142	164.3	-67.9	179.2	-179.7	154.4	3.6	109.3	S445 V446 G459 W461 L522	R443-S445 PolarHBondContact O-N 3.25Å; R443-S445 VanDerWaalsContact O-N 3.13Å; R443-V446 VanDerWaalsContact O-CB 3.3Å; R443-V446 WeakPolarHBondContact O-CB 3.1Å; R443-V446 WeakPolarHBondContact O-CG1 3.43Å; R443-V446 PolarHBondContact O-N 3.39Å; R443-G459 PolarHBondContact N-O 3.26Å; R443-W461 HydrophobicContact CG-CH2 4.26Å; R443-W461 HydrophobicContact CG-CZ3 4.07Å; R443-L522 HydrophobicContact CG-CD2 3.94Å
444	D	93.7	Very high	89.4	Confident	57 Å²	57	40.9 Å²	40.9	31%	0.305	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-28.5	173.7	66.5	-12	0	0	0	112.8	V446 R448 R521 V523	D444-V446 VanDerWaalsContact C-N 3.34Å; D444-R448 PolarHBondContact O-NH2 2.85Å; D444-R521 HydrophobicContact CB-CB 4.41Å; D444-R521 HydrophobicContact CB-CG 4.44Å; D444-R521 PolarHBondContact N-O 3.22Å; D444-R521 IonicContact OD2-NE 3.12Å; D444-V523 HydrophobicContact CB-CG1 4.15Å
445	S	92	Very high	90.9	Very high	64 Å²	64	42.2 Å²	42.2	45%	0.448	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	15.1	176.1	72.5	0	0	0	0	114.7	R443	R443-S445 PolarHBondContact O-N 3.25Å; R443-S445 VanDerWaalsContact O-N 3.13Å
446	V	92	Very high	91.4	Very high	14 Å²	14	39.1 Å²	39.1	9%	0.085	20%	0.198	C	C	.	.			trans	-55.3	143.4	177.5	67.9	0	0	0	0	110.7	F351 L358 A442 R443 D444 R448 V460	F351-V446 HydrophobicContact CE1-CG1 4.48Å; F351-V446 HydrophobicContact CZ-CG1 4.06Å; L358-V446 HydrophobicContact CD1-CG1 4.32Å; L358-V446 HydrophobicContact CD2-CG1 4.14Å; A442-V446 HydrophobicContact CB-CB 4.31Å; A442-V446 HydrophobicContact CB-CG1 4.27Å; R443-V446 VanDerWaalsContact O-CB 3.3Å; R443-V446 WeakPolarHBondContact O-CB 3.1Å; R443-V446 WeakPolarHBondContact O-CG1 3.43Å; R443-V446 PolarHBondContact O-N 3.39Å; D444-V446 VanDerWaalsContact C-N 3.34Å; V446-R448 VanDerWaalsContact O-CG 3.23Å; V446-R448 WeakPolarHBondContact O-CG 3.37Å; V446-V460 HydrophobicContact CG2-CG2 3.71Å
447	K	91.2	Very high	91.4	Very high	128 Å²	128	44.8 Å²	44.8	56%	0.557	23%	0.225	S	C	*	.			trans	-60.7	138.9	174.2	-173.5	-175.4	175.8	-154	0	108.7	K449 D451 L452	K447-K449 WeakPolarHBondContact CE-O 3.42Å; K447-D451 PolarHBondContact NZ-O 2.89Å; K447-L452 HydrophobicContact CB-CD2 3.9Å; K447-L452 HydrophobicContact CD-CD2 4.03Å; K447-L452 HydrophobicContact CG-CD2 3.74Å; K447-L452 WeakPolarHBondContact O-CD2 3.45Å
448	R	90.6	Very high	91.3	Very high	48 Å²	48	48.6 Å²	48.6	18%	0.181	25%	0.245	C	C	.	.			trans	-126.8	1.7	-175.3	-45.8	-174.3	-170.1	177.3	-2	113.8	Q349 F351 D352 D444 V446	Q349-R448 VanDerWaalsContact CB-NH1 3.34Å; Q349-R448 WeakPolarHBondContact O-CD 3.3Å; Q349-R448 PolarHBondContact O-NH1 3.5Å; F351-R448 WeakPolarHBondContact CA-O 3.3Å; F351-R448 HydrophobicContact CD1-CB 3.75Å; F351-R448 HydrophobicContact CD1-CG 4.19Å; F351-R448 HydrophobicContact CE1-CB 3.92Å; F351-R448 HydrophobicContact CE1-CG 3.86Å; F351-R448 HydrophobicContact CG-CB 4.3Å; F351-R448 HydrophobicContact CZ-CG 4.16Å; D352-R448 PolarHBondContact N-O 3.35Å; D444-R448 PolarHBondContact O-NH2 2.85Å; V446-R448 VanDerWaalsContact O-CG 3.23Å; V446-R448 WeakPolarHBondContact O-CG 3.37Å
449	K	90.4	Very high	91.3	Very high	72 Å²	72	48.4 Å²	48.4	31%	0.313	24%	0.244	S	C	.	.	S	Bend	trans	-125.3	133.3	-170.9	-58.6	-60.5	-179.5	-169.2	0	111.6	H347 Q350 D352 K447	H347-K449 PolarHBondContact O-NZ 3.31Å; Q350-K449 WeakPolarHBondContact O-CE 3.44Å; Q350-K449 PolarHBondContact O-NZ 2.95Å; D352-K449 HydrophobicContact CB-CD 3.86Å; D352-K449 VanDerWaalsContact OD1-CA 3.24Å; D352-K449 WeakPolarHBondContact OD1-CA 3.3Å; D352-K449 VanDerWaalsContact OD2-CA 3.28Å; D352-K449 WeakPolarHBondContact OD2-CA 3.48Å; D352-K449 VanDerWaalsContact OD2-CD 3.31Å; D352-K449 WeakPolarHBondContact OD2-CD 3.23Å; K447-K449 WeakPolarHBondContact CE-O 3.42Å
450	G	85.1	Confident	91.2	Very high	26 Å²	26	48.4 Å²	48.4	27%	0.268	24%	0.244	S	C	.	.	S	Bend	trans	63.5	-158.4	-176.2	0	0	0	0	0	112.4	D352 L452	D352-G450 PolarHBondContact OD1-N 3.48Å; D352-G450 PolarHBondContact OD2-N 3.44Å; G450-L452 WeakPolarHBondContact O-CG 3.37Å; G450-L452 PolarHBondContact O-N 2.85Å
451	D	78.9	Confident	91.2	Very high	135 Å²	135	48.7 Å²	48.7	72%	0.722	25%	0.245	S	C	*	.	S	Bend	trans	-61.2	126.8	-176.1	-170	12.2	0	0	0	112.1	K447	K447-D451 PolarHBondContact NZ-O 2.89Å
452	L	80.9	Confident	91.2	Very high	17 Å²	17	48.7 Å²	48.7	9%	0.089	25%	0.245	C	C	.	.			trans	-112.4	120.1	-175.1	-59.2	-173.7	0	0	0	110.2	F351 E354 K447 G450 L454	F351-L452 HydrophobicContact CD1-CD1 3.56Å; F351-L452 HydrophobicContact CE1-CD1 3.6Å; E354-L452 HydrophobicContact CB-CD1 3.78Å; E354-L452 HydrophobicContact CB-CG 4.43Å; E354-L452 HydrophobicContact CG-CB 3.95Å; E354-L452 HydrophobicContact CG-CD1 3.58Å; E354-L452 HydrophobicContact CG-CG 3.69Å; K447-L452 HydrophobicContact CB-CD2 3.9Å; K447-L452 HydrophobicContact CD-CD2 4.03Å; K447-L452 HydrophobicContact CG-CD2 3.74Å; K447-L452 WeakPolarHBondContact O-CD2 3.45Å; G450-L452 WeakPolarHBondContact O-CG 3.37Å; G450-L452 PolarHBondContact O-N 2.85Å; L452-L454 HydrophobicContact CB-CD2 4Å; L452-L454 HydrophobicContact CB-CG 4.49Å; L452-L454 HydrophobicContact CD1-CD2 4.46Å; L452-L454 PolarHBondContact O-N 3.41Å
453	S	83.9	Confident	91.2	Very high	36 Å²	36	48.7 Å²	48.7	25%	0.252	25%	0.245	S	C	.	.			trans	-77.6	111.5	163.1	177.1	0	0	0	0	108.5	R455 D458	S453-R455 PolarHBondContact O-N 2.87Å; S453-R455 PolarHBondContact OG-NE 3.17Å; S453-R455 PolarHBondContact OG-NH2 2.77Å; S453-D458 WeakPolarHBondContact CB-OD2 3.42Å; S453-D458 WeakPolarHBondContact O-CB 3.4Å; S453-D458 PolarHBondContact OG-OD2 3.12Å
454	L	88	Confident	91.1	Very high	20 Å²	20	47.3 Å²	47.3	11%	0.105	24%	0.24	C	C	.	.			trans	-90.3	45.2	-179.8	-58.4	-179.9	0	0	0	111.5	M438 L452 V460 N473 F525 W527	M438-L454 HydrophobicContact CE-CB 3.96Å; M438-L454 HydrophobicContact CE-CD1 4.16Å; M438-L454 HydrophobicContact SD-CB 4.32Å; M438-L454 HydrophobicContact SD-CD1 3.42Å; M438-L454 WeakPolarHBondContact SD-CD1 3.45Å; L452-L454 HydrophobicContact CB-CD2 4Å; L452-L454 HydrophobicContact CB-CG 4.49Å; L452-L454 HydrophobicContact CD1-CD2 4.46Å; L452-L454 PolarHBondContact O-N 3.41Å; L454-V460 HydrophobicContact CB-CG1 4.47Å; L454-V460 HydrophobicContact CD2-CG2 4.5Å; L454-N473 WeakPolarHBondContact O-CB 3.09Å; L454-F525 HydrophobicContact CD2-CE1 4.32Å; L454-F525 HydrophobicContact CD2-CZ 3.89Å; L454-W527 HydrophobicContact CD1-CG 4.3Å
455	R	92.1	Very high	91	Very high	107 Å²	107	44.9 Å²	44.9	40%	0.404	23%	0.227	S	C	.	.	S	Bend	trans	-111.2	158.4	-174.5	-68	-177.7	-75.5	-156	-8.2	113	S453 E457 D458 G459 V460	S453-R455 PolarHBondContact O-N 2.87Å; S453-R455 PolarHBondContact OG-NE 3.17Å; S453-R455 PolarHBondContact OG-NH2 2.77Å; R455-E457 WeakPolarHBondContact CB-OE2 2.95Å; R455-E457 PolarHBondContact O-N 3.15Å; R455-D458 PolarHBondContact O-N 3Å; R455-D458 VanDerWaalsContact O-N 3.07Å; R455-G459 PolarHBondContact O-N 3.42Å; R455-V460 CarbonylContact C-O 3.58Å; R455-V460 PolarHBondContact O-N 3.17Å; R455-V460 VanDerWaalsContact O-N 3.1Å
456	P	94.9	Very high	90.9	Very high	20 Å²	20	42 Å²	42	13%	0.13	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-52.4	-37.8	176.1	-33.9	37.5	0	0	0	114.6	D458 G459 V460 N473 F514	P456-D458 PolarHBondContact O-N 3.43Å; P456-G459 WeakPolarHBondContact O-CA 3.42Å; P456-G459 PolarHBondContact O-N 3.01Å; P456-V460 WeakPolarHBondContact CA-O 3.32Å; P456-V460 WeakPolarHBondContact CD-O 3.25Å; P456-N473 WeakPolarHBondContact CD-O 3.38Å; P456-F514 HydrophobicContact CG-CD1 3.84Å; P456-F514 HydrophobicContact CG-CE1 3.74Å
457	E	92	Very high	90.5	Very high	122 Å²	122	43.9 Å²	43.9	57%	0.57	22%	0.22	S	C	*	.	G	3₁₀ helix	trans	-62.8	-34.6	-179.3	-62.8	70.8	-149.9	0	0	111.7	R455 G459	R455-E457 WeakPolarHBondContact CB-OE2 2.95Å; R455-E457 PolarHBondContact O-N 3.15Å; E457-G459 VanDerWaalsContact C-N 3.27Å
458	D	92	Very high	90.3	Very high	80 Å²	80	40.3 Å²	40.3	43%	0.428	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-86.8	0.2	176.6	-62.8	-69.5	0	0	0	112.9	S453 R455 P456	S453-D458 WeakPolarHBondContact CB-OD2 3.42Å; S453-D458 WeakPolarHBondContact O-CB 3.4Å; S453-D458 PolarHBondContact OG-OD2 3.12Å; R455-D458 PolarHBondContact O-N 3Å; R455-D458 VanDerWaalsContact O-N 3.07Å; P456-D458 PolarHBondContact O-N 3.43Å
459	G	94	Very high	90.2	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.8	30.9	175.1	0	0	0	0	0	114.2	A442 R443 R455 P456 E457 W461	A442-G459 CarbonylContact C-O 3.44Å; A442-G459 VanDerWaalsContact CA-O 3.25Å; A442-G459 WeakPolarHBondContact CA-O 3.43Å; R443-G459 PolarHBondContact N-O 3.26Å; R455-G459 PolarHBondContact O-N 3.42Å; P456-G459 WeakPolarHBondContact O-CA 3.42Å; P456-G459 PolarHBondContact O-N 3.01Å; E457-G459 VanDerWaalsContact C-N 3.27Å; G459-W461 WeakPolarHBondContact O-CZ3 3.43Å
460	V	95.7	Very high	90.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	122.8	172.1	-177	0	0	0	0	109.4	A442 V446 L454 R455 P456 A462 F525	A442-V460 HydrophobicContact CB-CG2 4.08Å; V446-V460 HydrophobicContact CG2-CG2 3.71Å; L454-V460 HydrophobicContact CB-CG1 4.47Å; L454-V460 HydrophobicContact CD2-CG2 4.5Å; R455-V460 CarbonylContact C-O 3.58Å; R455-V460 PolarHBondContact O-N 3.17Å; R455-V460 VanDerWaalsContact O-N 3.1Å; P456-V460 WeakPolarHBondContact CA-O 3.32Å; P456-V460 WeakPolarHBondContact CD-O 3.25Å; V460-A462 HydrophobicContact CG1-CB 4.09Å; V460-F525 HydrophobicContact CG1-CD1 3.82Å; V460-F525 HydrophobicContact CG1-CE1 3.83Å
461	W	97.4	Very high	90.9	Very high	7 Å²	7	36 Å²	36	3%	0.027	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	98.6	175.8	-59.6	-89.8	0	0	0	107.9	G440 V441 R443 G459 V500 F514 A516 F518 L522	G440-W461 WeakPolarHBondContact CA-O 3.49Å; V441-W461 HydrophobicContact CG2-CB 3.96Å; V441-W461 HydrophobicContact CG2-CE3 4.08Å; V441-W461 PolarHBondContact N-O 3.04Å; V441-W461 PolarHBondContact O-N 2.84Å; R443-W461 HydrophobicContact CG-CH2 4.26Å; R443-W461 HydrophobicContact CG-CZ3 4.07Å; G459-W461 WeakPolarHBondContact O-CZ3 3.43Å; W461-V500 HydrophobicContact CB-CB 4.49Å; W461-V500 HydrophobicContact CB-CG2 4.33Å; W461-F514 HydrophobicContact CB-CB 4.34Å; W461-F514 HydrophobicContact CB-CD1 4.45Å; W461-F514 HydrophobicContact CB-CD2 4.18Å; W461-F514 HydrophobicContact CB-CG 4.07Å; W461-F514 AromaticContact CD1-CD1 3.77Å; W461-F514 AromaticContact CD1-CG 3.8Å; W461-F514 HydrophobicContact CG-CB 4.3Å; W461-F514 HydrophobicContact CG-CG 4.35Å; W461-A516 HydrophobicContact CZ2-CB 3.84Å; W461-F518 HydrophobicContact CD2-CE1 4.18Å; W461-F518 AromaticContact CE2-CE1 3.85Å; W461-F518 HydrophobicContact CE3-CE1 4.43Å; W461-F518 AromaticContact CH2-CD1 3.97Å; W461-F518 HydrophobicContact CH2-CD1 3.97Å; W461-F518 HydrophobicContact CH2-CE1 4.03Å; W461-F518 HydrophobicContact CZ2-CD1 4.03Å; W461-F518 AromaticContact CZ2-CE1 3.77Å; W461-F518 HydrophobicContact CZ2-CE1 3.77Å; W461-F518 HydrophobicContact CZ3-CD1 4.47Å; W461-F518 HydrophobicContact CZ3-CE1 4.37Å; W461-L522 HydrophobicContact CE3-CD2 4.23Å; W461-L522 HydrophobicContact CH2-CD2 4.1Å; W461-L522 HydrophobicContact CZ3-CD1 4.42Å; W461-L522 HydrophobicContact CZ3-CD2 3.43Å; W461-L522 VanDerWaalsContact CZ3-CD2 3.43Å
462	A	97.3	Very high	91.7	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	153.2	-171.4	0	0	0	0	0	111.5	M438 V439 V460 N473 F514 F525	M438-A462 HydrophobicContact CB-CB 4.43Å; M438-A462 HydrophobicContact CE-CB 3.81Å; V439-A462 VanDerWaalsContact O-CA 3.3Å; V439-A462 WeakPolarHBondContact O-CA 3.35Å; V439-A462 WeakPolarHBondContact O-CB 3.44Å; V460-A462 HydrophobicContact CG1-CB 4.09Å; A462-N473 PolarHBondContact O-N 2.83Å; A462-F514 WeakPolarHBondContact O-CZ 3.4Å; A462-F525 HydrophobicContact CB-CD1 4.4Å
463	L	96	Very high	92.2	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	137.2	165.9	-66.3	-175.1	0	0	0	109.5	M438 V439 I470 W471 A472 L480 F502 I511 Y512 F514	M438-L463 CarbonylContact C-O 3.6Å; M438-L463 WeakPolarHBondContact CA-O 3.34Å; M438-L463 WeakPolarHBondContact CB-O 3.46Å; V439-L463 HydrophobicContact CG2-CB 4.48Å; V439-L463 PolarHBondContact N-O 2.82Å; V439-L463 PolarHBondContact O-N 2.5Å; L463-I470 HydrophobicContact CD1-CG2 4.4Å; L463-W471 CarbonylContact C-O 3.58Å; L463-W471 WeakPolarHBondContact CA-O 3.48Å; L463-A472 HydrophobicContact CD2-CB 3.98Å; L463-L480 HydrophobicContact CD2-CD1 3.7Å; L463-F502 HydrophobicContact CD1-CB 3.42Å; L463-F502 VanDerWaalsContact CD1-CB 3.42Å; L463-F502 HydrophobicContact CD1-CD1 3.7Å; L463-F502 HydrophobicContact CD1-CD2 4.27Å; L463-F502 HydrophobicContact CD1-CG 3.53Å; L463-F502 HydrophobicContact CD2-CD2 4.44Å; L463-F502 HydrophobicContact CD2-CG 4.48Å; L463-F502 HydrophobicContact CG-CB 4.1Å; L463-F502 HydrophobicContact CG-CD1 3.76Å; L463-F502 HydrophobicContact CG-CD2 3.98Å; L463-F502 HydrophobicContact CG-CE1 4.14Å; L463-F502 HydrophobicContact CG-CE2 4.35Å; L463-F502 HydrophobicContact CG-CG 3.66Å; L463-F502 HydrophobicContact CG-CZ 4.42Å; L463-I511 HydrophobicContact CD1-CB 4.21Å; L463-I511 HydrophobicContact CD1-CG2 3.54Å; L463-Y512 HydrophobicContact CD2-CG 4.49Å; L463-F514 HydrophobicContact CD2-CE2 4.37Å
464	R	94.1	Very high	92.7	Very high	41 Å²	41	28.8 Å²	28.8	16%	0.155	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	131.4	165.6	179.3	170.6	65.6	151.8	0.8	109.2	C437 M438 I470 W471 N473 E477	C437-R464 CarbonylContact O-C 3.55Å; C437-R464 WeakPolarHBondContact O-CA 3.35Å; M438-R464 HydrophobicContact CG-CB 4.06Å; M438-R464 HydrophobicContact CG-CG 4.31Å; R464-I470 CarbonylContact O-C 3.59Å; R464-I470 WeakPolarHBondContact O-CA 3.43Å; R464-W471 HydrophobicContact CB-CB 4.5Å; R464-W471 HydrophobicContact CG-CE3 4.46Å; R464-W471 PolarHBondContact N-O 3.13Å; R464-W471 PolarHBondContact O-N 3.4Å; R464-N473 VanDerWaalsContact CB-OD1 3.31Å; R464-N473 WeakPolarHBondContact CB-OD1 3.26Å; R464-E477 IonicContact CZ-OE2 3.15Å; R464-E477 IonicContact NH2-OE1 3.93Å; R464-E477 IonicContact NH2-OE2 2.67Å; R464-E477 PolarHBondContact NH2-OE2 3.4Å
465	L	92.5	Very high	92.7	Very high	6 Å²	6	31.5 Å²	31.5	3%	0.031	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	114.7	177.7	-50.9	167.6	0	0	0	106.5	V374 S436 C437 V439 I470 V489 W530	V374-L465 HydrophobicContact CG2-CD1 3.91Å; S436-L465 WeakPolarHBondContact CA-O 3.2Å; S436-L465 WeakPolarHBondContact CB-O 3.5Å; C437-L465 PolarHBondContact N-O 3.06Å; C437-L465 PolarHBondContact O-N 2.73Å; V439-L465 HydrophobicContact CG1-CD1 4.45Å; V439-L465 HydrophobicContact CG2-CD1 4.25Å; L465-I470 HydrophobicContact CD2-CB 4.25Å; L465-I470 HydrophobicContact CD2-CD1 3.82Å; L465-I470 HydrophobicContact CD2-CG1 3.74Å; L465-I470 HydrophobicContact CD2-CG2 3.72Å; L465-V489 HydrophobicContact CD1-CG2 4.16Å; L465-W530 VanDerWaalsContact O-CZ3 3.23Å; L465-W530 WeakPolarHBondContact O-CZ3 3.48Å
466	S	89.5	Confident	92.6	Very high	4 Å²	4	31.8 Å²	31.8	3%	0.028	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	-176.8	171.5	78.3	0	0	0	0	109.5	S468 G469 W471 R485 W530	S466-S468 PolarHBondContact OG-N 2.99Å; S466-S468 VanDerWaalsContact OG-N 3.1Å; S466-S468 PolarHBondContact OG-OG 2.95Å; S466-G469 PolarHBondContact N-O 2.97Å; S466-G469 VanDerWaalsContact N-O 3.1Å; S466-G469 PolarHBondContact OG-N 2.8Å; S466-W471 WeakPolarHBondContact OG-CH2 3.2Å; S466-W471 WeakPolarHBondContact OG-CZ3 3.38Å; S466-R485 PolarHBondContact O-NH2 2.83Å; S466-W530 WeakPolarHBondContact O-CH2 3.45Å
467	S	85	Confident	92.3	Very high	53 Å²	53	35.1 Å²	35.1	37%	0.371	20%	0.2	S	C	.	.	S	Bend	trans	-61	-44	168.9	45.1	0	0	0	0	112	R485 W530	S467-R485 VanDerWaalsContact C-NH2 3.3Å; S467-R485 VanDerWaalsContact O-CZ 3.29Å; S467-R485 PolarHBondContact O-NH1 2.98Å; S467-R485 PolarHBondContact O-NH2 3.49Å; S467-W530 VanDerWaalsContact N-CH2 3.27Å
468	S	85.7	Confident	92.4	Very high	52 Å²	52	30.7 Å²	30.7	36%	0.364	18%	0.184	S	C	.	.	S	Bend	trans	-73.9	-25.9	-176.4	41.5	0	0	0	0	114.7	E432 S466 W471	E432-S468 VanDerWaalsContact OE1-CB 3.26Å; E432-S468 WeakPolarHBondContact OE1-CB 3.48Å; E432-S468 PolarHBondContact OE1-OG 3.46Å; E432-S468 WeakPolarHBondContact OE2-CB 3.39Å; E432-S468 PolarHBondContact OE2-OG 3.09Å; S466-S468 PolarHBondContact OG-N 2.99Å; S466-S468 VanDerWaalsContact OG-N 3.1Å; S466-S468 PolarHBondContact OG-OG 2.95Å; S468-W471 WeakPolarHBondContact OG-CH2 3.32Å
469	G	89.8	Confident	92.5	Very high	15 Å²	15	31.5 Å²	31.5	16%	0.155	19%	0.185	C	C	.	.			trans	174.6	-159.8	-176.2	0	0	0	0	0	115.8	S466 W471	S466-G469 PolarHBondContact N-O 2.97Å; S466-G469 VanDerWaalsContact N-O 3.1Å; S466-G469 PolarHBondContact OG-N 2.8Å; G469-W471 VanDerWaalsContact C-CH2 3.48Å; G469-W471 WeakPolarHBondContact O-CZ3 3.29Å
470	I	93.7	Very high	92.5	Very high	7 Å²	7	32.7 Å²	32.7	4%	0.036	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	133.2	177.4	-55	-178.9	0	0	0	108.5	L463 R464 L465 L480 P482 P486 I511	L463-I470 HydrophobicContact CD1-CG2 4.4Å; R464-I470 CarbonylContact O-C 3.59Å; R464-I470 WeakPolarHBondContact O-CA 3.43Å; L465-I470 HydrophobicContact CD2-CB 4.25Å; L465-I470 HydrophobicContact CD2-CD1 3.82Å; L465-I470 HydrophobicContact CD2-CG1 3.74Å; L465-I470 HydrophobicContact CD2-CG2 3.72Å; I470-L480 HydrophobicContact CB-CB 4.33Å; I470-L480 HydrophobicContact CG2-CB 4.31Å; I470-L480 HydrophobicContact CG2-CD1 4.12Å; I470-L480 WeakPolarHBondContact O-CB 3.42Å; I470-L480 PolarHBondContact O-N 2.95Å; I470-P482 HydrophobicContact CD1-CG 3.78Å; I470-P486 VanDerWaalsContact CD1-CD 3.46Å; I470-P486 HydrophobicContact CD1-CG 3.79Å; I470-I511 HydrophobicContact CG2-CG2 4.37Å
471	W	95	Very high	92.2	Very high	33 Å²	33	40.4 Å²	40.4	13%	0.125	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	141.7	178.3	-60.4	-102.4	0	0	0	110.9	L463 R464 S466 S468 G469 A478 E479	L463-W471 CarbonylContact C-O 3.58Å; L463-W471 WeakPolarHBondContact CA-O 3.48Å; R464-W471 HydrophobicContact CB-CB 4.5Å; R464-W471 HydrophobicContact CG-CE3 4.46Å; R464-W471 PolarHBondContact N-O 3.13Å; R464-W471 PolarHBondContact O-N 3.4Å; S466-W471 WeakPolarHBondContact OG-CH2 3.2Å; S466-W471 WeakPolarHBondContact OG-CZ3 3.38Å; S468-W471 WeakPolarHBondContact OG-CH2 3.32Å; G469-W471 VanDerWaalsContact C-CH2 3.48Å; G469-W471 WeakPolarHBondContact O-CZ3 3.29Å; W471-A478 CarbonylContact C-O 3.04Å; W471-A478 VanDerWaalsContact CA-O 3.3Å; W471-A478 WeakPolarHBondContact CA-O 3.49Å; W471-E479 HydrophobicContact CZ2-CG 4.45Å
472	A	96.1	Very high	91.7	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	126.5	157.1	0	0	0	0	0	108.6	L463 T474 A478 L480 Y512 F514	L463-A472 HydrophobicContact CD2-CB 3.98Å; A472-T474 HydrophobicContact CB-CG2 4.44Å; A472-T474 PolarHBondContact O-N 3.3Å; A472-T474 PolarHBondContact O-OG1 3.18Å; A472-A478 HydrophobicContact CB-CB 4.37Å; A472-A478 PolarHBondContact N-O 3.39Å; A472-A478 PolarHBondContact O-N 2.92Å; A472-L480 HydrophobicContact CB-CD1 4.17Å; A472-Y512 HydrophobicContact CB-CD1 3.74Å; A472-Y512 HydrophobicContact CB-CD2 4.02Å; A472-Y512 HydrophobicContact CB-CE1 3.69Å; A472-Y512 HydrophobicContact CB-CE2 3.95Å; A472-Y512 HydrophobicContact CB-CG 3.91Å; A472-F514 HydrophobicContact CB-CE1 4.34Å; A472-F514 HydrophobicContact CB-CE2 4.46Å; A472-F514 HydrophobicContact CB-CZ 3.79Å
473	N	91.9	Very high	91.1	Very high	11 Å²	11	45.5 Å²	45.5	6%	0.059	27%	0.266	C	S	.	.			trans	-74.6	49.2	-178.7	-76.8	50.2	0	0	0	113	M438 L454 P456 A462 R464	M438-N473 HydrophobicContact CE-CB 4.29Å; M438-N473 VanDerWaalsContact CE-CG 3.48Å; M438-N473 WeakPolarHBondContact CE-ND2 3.41Å; L454-N473 WeakPolarHBondContact O-CB 3.09Å; P456-N473 WeakPolarHBondContact CD-O 3.38Å; A462-N473 PolarHBondContact O-N 2.83Å; R464-N473 VanDerWaalsContact CB-OD1 3.31Å; R464-N473 WeakPolarHBondContact CB-OD1 3.26Å
474	T	93.5	Very high	90.5	Very high	27 Å²	27	50.3 Å²	50.3	17%	0.166	29%	0.292	C	S	.	.			trans	-78.7	177.4	172.7	49.4	0	0	0	0	111.7	A472 P476 E477 A478 Y512 F514	A472-T474 HydrophobicContact CB-CG2 4.44Å; A472-T474 PolarHBondContact O-N 3.3Å; A472-T474 PolarHBondContact O-OG1 3.18Å; T474-P476 CarbonylContact C-O 3.55Å; T474-P476 VanDerWaalsContact CB-O 3.31Å; T474-P476 WeakPolarHBondContact CB-O 3.46Å; T474-P476 CarbonylContact O-C 3.59Å; T474-P476 PolarHBondContact OG1-O 3.37Å; T474-E477 WeakPolarHBondContact O-CA 3.36Å; T474-E477 PolarHBondContact O-N 3.43Å; T474-E477 VanDerWaalsContact O-N 3.09Å; T474-A478 PolarHBondContact OG1-N 3.34Å; T474-Y512 HydrophobicContact CG2-CE1 4.43Å; T474-Y512 WeakPolarHBondContact CG2-OH 3.21Å; T474-F514 HydrophobicContact CG2-CD1 4.21Å; T474-F514 HydrophobicContact CG2-CE1 3.67Å
475	S	88.4	Confident	90.1	Very high	77 Å²	77	52.9 Å²	52.9	54%	0.538	30%	0.301	S	S	.	.	S	Bend	trans	-119.6	109.8	168.2	-170.5	0	0	0	0	109.9
476	P	90	Very high	90	Very high	112 Å²	112	53 Å²	53	73%	0.727	30%	0.303	S	S	*	.	S	Bend	cis	-65.1	161.9	-6	31.1	-36.2	0	0	0	112.5	T474	T474-P476 CarbonylContact C-O 3.55Å; T474-P476 VanDerWaalsContact CB-O 3.31Å; T474-P476 WeakPolarHBondContact CB-O 3.46Å; T474-P476 CarbonylContact O-C 3.59Å; T474-P476 PolarHBondContact OG1-O 3.37Å
477	E	88.5	Confident	90.1	Very high	90 Å²	90	58.1 Å²	58.1	42%	0.421	32%	0.322	S	S	.	.			trans	-61.2	142.9	173	-68.5	-164.1	160.5	0	0	109.8	R464 T474	R464-E477 IonicContact CZ-OE2 3.15Å; R464-E477 IonicContact NH2-OE1 3.93Å; R464-E477 IonicContact NH2-OE2 2.67Å; R464-E477 PolarHBondContact NH2-OE2 3.4Å; T474-E477 WeakPolarHBondContact O-CA 3.36Å; T474-E477 PolarHBondContact O-N 3.43Å; T474-E477 VanDerWaalsContact O-N 3.09Å
478	A	93.3	Very high	90.6	Very high	29 Å²	29	58.7 Å²	58.7	24%	0.24	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	111.6	-179.4	0	0	0	0	0	109.2	W471 A472 T474	W471-A478 CarbonylContact C-O 3.04Å; W471-A478 VanDerWaalsContact CA-O 3.3Å; W471-A478 WeakPolarHBondContact CA-O 3.49Å; A472-A478 HydrophobicContact CB-CB 4.37Å; A472-A478 PolarHBondContact N-O 3.39Å; A472-A478 PolarHBondContact O-N 2.92Å; T474-A478 PolarHBondContact OG1-N 3.34Å
479	E	94.5	Very high	91.1	Very high	97 Å²	97	56.2 Å²	56.2	45%	0.453	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	141.2	170.9	-168.8	176.2	-176.6	0	0	110.8	W471 F481	W471-E479 HydrophobicContact CZ2-CG 4.45Å; E479-F481 HydrophobicContact CB-CE2 4.37Å; E479-F481 HydrophobicContact CB-CZ 4.27Å; E479-F481 VanDerWaalsContact CD-CZ 3.41Å; E479-F481 HydrophobicContact CG-CE1 4.1Å; E479-F481 HydrophobicContact CG-CE2 4.11Å; E479-F481 HydrophobicContact CG-CZ 3.65Å
480	L	93.9	Very high	91.4	Very high	25 Å²	25	55.5 Å²	55.5	13%	0.131	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	134.9	-171.2	-54.5	178.8	0	0	0	110.5	L463 I470 A472 P482 I511 Y512	L463-L480 HydrophobicContact CD2-CD1 3.7Å; I470-L480 HydrophobicContact CB-CB 4.33Å; I470-L480 HydrophobicContact CG2-CB 4.31Å; I470-L480 HydrophobicContact CG2-CD1 4.12Å; I470-L480 WeakPolarHBondContact O-CB 3.42Å; I470-L480 PolarHBondContact O-N 2.95Å; A472-L480 HydrophobicContact CB-CD1 4.17Å; L480-P482 VanDerWaalsContact C-CD 3.49Å; L480-P482 VanDerWaalsContact O-CD 3.25Å; L480-P482 WeakPolarHBondContact O-CD 3.3Å; L480-I511 HydrophobicContact CD1-CG2 3.82Å; L480-Y512 HydrophobicContact CD1-CD2 4.06Å; L480-Y512 HydrophobicContact CD1-CG 4.14Å; L480-Y512 HydrophobicContact CD2-CD2 3.61Å; L480-Y512 HydrophobicContact CD2-CE2 4.16Å; L480-Y512 HydrophobicContact CD2-CG 4.47Å
481	F	91	Very high	91.6	Very high	163 Å²	163	55.2 Å²	55.2	72%	0.715	29%	0.289	S	S	*	.			trans	-119.8	71.5	-175.9	-54.7	-81.4	0	0	0	110.7	E479	E479-F481 HydrophobicContact CB-CE2 4.37Å; E479-F481 HydrophobicContact CB-CZ 4.27Å; E479-F481 VanDerWaalsContact CD-CZ 3.41Å; E479-F481 HydrophobicContact CG-CE1 4.1Å; E479-F481 HydrophobicContact CG-CE2 4.11Å; E479-F481 HydrophobicContact CG-CZ 3.65Å
482	P	86.4	Confident	91.7	Very high	29 Å²	29	53.8 Å²	53.8	19%	0.188	29%	0.285	C	S	.	.			trans	-65.6	151	173.7	31.2	-35.7	0	0	0	110.5	I470 L480 L484	I470-P482 HydrophobicContact CD1-CG 3.78Å; L480-P482 VanDerWaalsContact C-CD 3.49Å; L480-P482 VanDerWaalsContact O-CD 3.25Å; L480-P482 WeakPolarHBondContact O-CD 3.3Å; P482-L484 PolarHBondContact O-N 3.4Å
483	A	83.6	Confident	91.8	Very high	84 Å²	84	53.8 Å²	53.8	69%	0.694	29%	0.285	S	S	*	.	S	Bend	trans	-63.5	-32.3	178.6	0	0	0	0	0	112.5	E509	A483-E509 WeakPolarHBondContact CB-OE1 3.45Å; A483-E509 PolarHBondContact N-OE1 3.39Å; A483-E509 PolarHBondContact N-OE2 2.96Å
484	L	84	Confident	92.1	Very high	102 Å²	102	54.4 Å²	54.4	53%	0.534	29%	0.288	S	S	.	.	S	Bend	trans	-127.7	133.9	175.6	-67.8	172.4	0	0	0	110.4	P482 N504	P482-L484 PolarHBondContact O-N 3.4Å; L484-N504 PolarHBondContact O-ND2 3.15Å
485	R	86.6	Confident	92.3	Very high	94 Å²	94	54.6 Å²	54.6	36%	0.355	29%	0.286	S	S	.	.			trans	-66	122.8	174.8	-167.2	170.9	-171.9	152	-3.4	109.9	S466 S467 R487	S466-R485 PolarHBondContact O-NH2 2.83Å; S467-R485 VanDerWaalsContact C-NH2 3.3Å; S467-R485 VanDerWaalsContact O-CZ 3.29Å; S467-R485 PolarHBondContact O-NH1 2.98Å; S467-R485 PolarHBondContact O-NH2 3.49Å; R485-R487 PolarHBondContact O-N 3.03Å
486	P	90.5	Very high	92.7	Very high	10 Å²	10	56.9 Å²	56.9	7%	0.065	29%	0.288	C	S	.	.			trans	-76	118.8	-173.3	30.2	-33.3	0	0	0	110.9	I470 R488 V489 N504 I511	I470-P486 VanDerWaalsContact CD1-CD 3.46Å; I470-P486 HydrophobicContact CD1-CG 3.79Å; P486-R488 VanDerWaalsContact C-N 3.27Å; P486-V489 HydrophobicContact CB-CG2 4.01Å; P486-V489 HydrophobicContact CG-CG2 4.01Å; P486-N504 HydrophobicContact CB-CB 4.16Å; P486-I511 HydrophobicContact CB-CD1 4.15Å; P486-I511 HydrophobicContact CG-CD1 3.91Å
487	R	90.4	Very high	93	Very high	111 Å²	111	53.8 Å²	53.8	42%	0.419	28%	0.276	S	S	.	.	S	Bend	trans	-72.5	-27.9	162.4	-68	-176.1	175.1	-161.6	-2.2	111.3	E373 V374 R485	E373-R487 WeakPolarHBondContact CA-O 3.42Å; V374-R487 PolarHBondContact N-O 2.97Å; R485-R487 PolarHBondContact O-N 3.03Å
488	R	94.8	Very high	93.5	Very high	65 Å²	65	49.8 Å²	49.8	25%	0.245	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	128.3	177.4	-164.8	-179.3	-55.3	157.5	6.2	111.4	E371 V372 E373 P486 A505	E371-R488 HydrophobicContact CB-CG 4.07Å; E371-R488 WeakPolarHBondContact OE2-CD 3.36Å; E371-R488 IonicContact OE2-NE 3.67Å; E371-R488 IonicContact OE2-NH1 2.81Å; E371-R488 PolarHBondContact OE2-NH1 2.83Å; V372-R488 CarbonylContact O-C 3.36Å; V372-R488 WeakPolarHBondContact O-CA 3.2Å; E373-R488 HydrophobicContact CB-CG 4.13Å; E373-R488 IonicContact OE1-CZ 2.82Å; E373-R488 IonicContact OE1-NE 3.11Å; E373-R488 IonicContact OE1-NH2 2.7Å; E373-R488 PolarHBondContact OE1-NH2 3.34Å; P486-R488 VanDerWaalsContact C-N 3.27Å; R488-A505 HydrophobicContact CB-CB 3.96Å; R488-A505 HydrophobicContact CG-CB 3.76Å; R488-A505 WeakPolarHBondContact O-CB 3.11Å; R488-A505 PolarHBondContact O-N 2.86Å
489	V	96.8	Very high	93.7	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	119.3	-179.9	-177.6	0	0	0	0	109.3	E371 V372 V439 L465 P486 I491 F502 T503 I511	E371-V489 CarbonylContact C-O 3.59Å; E371-V489 WeakPolarHBondContact CA-O 3.42Å; V372-V489 PolarHBondContact N-O 3.49Å; V372-V489 PolarHBondContact O-N 3.42Å; V439-V489 HydrophobicContact CG2-CB 4.13Å; V439-V489 HydrophobicContact CG2-CG1 3.92Å; V439-V489 HydrophobicContact CG2-CG2 4.29Å; L465-V489 HydrophobicContact CD1-CG2 4.16Å; P486-V489 HydrophobicContact CB-CG2 4.01Å; P486-V489 HydrophobicContact CG-CG2 4.01Å; V489-I491 HydrophobicContact CG1-CG1 4.33Å; V489-F502 HydrophobicContact CG1-CB 4.46Å; V489-F502 HydrophobicContact CG1-CD1 3.87Å; V489-T503 CarbonylContact C-O 3.57Å; V489-T503 WeakPolarHBondContact CA-O 3.24Å; V489-I511 HydrophobicContact CG1-CD1 4.43Å
490	G	97	Very high	93.8	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	128.9	171	0	0	0	0	0	111	Y369 F502 T503	Y369-G490 WeakPolarHBondContact OH-CA 3.19Å; G490-F502 CarbonylContact O-C 3.57Å; G490-F502 WeakPolarHBondContact O-CA 3.38Å; G490-T503 PolarHBondContact N-O 3.15Å; G490-T503 PolarHBondContact O-N 2.89Å; G490-T503 PolarHBondContact O-OG1 2.86Å
491	I	97.9	Very high	94	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	113.3	-177.8	-54.1	174.2	0	0	0	108.6	Y369 W370 V372 V439 V441 V489 V500 F502	Y369-I491 WeakPolarHBondContact CA-O 3.03Å; Y369-I491 VanDerWaalsContact CD2-O 3.3Å; Y369-I491 WeakPolarHBondContact CD2-O 3.46Å; W370-I491 HydrophobicContact CD2-CB 4.36Å; W370-I491 HydrophobicContact CH2-CG2 3.92Å; W370-I491 HydrophobicContact CZ2-CB 4.01Å; W370-I491 HydrophobicContact CZ2-CD1 4.33Å; W370-I491 HydrophobicContact CZ2-CG2 3.56Å; W370-I491 PolarHBondContact N-O 3.3Å; W370-I491 VanDerWaalsContact N-O 3.14Å; W370-I491 PolarHBondContact O-N 2.85Å; V372-I491 HydrophobicContact CG2-CD1 3.73Å; V439-I491 HydrophobicContact CB-CD1 4.17Å; V439-I491 HydrophobicContact CG2-CD1 4.47Å; V441-I491 HydrophobicContact CG1-CG2 4.46Å; V489-I491 HydrophobicContact CG1-CG1 4.33Å; I491-V500 HydrophobicContact CG2-CG1 4.21Å; I491-F502 HydrophobicContact CD1-CE1 4.12Å; I491-F502 HydrophobicContact CG1-CD1 3.96Å; I491-F502 HydrophobicContact CG1-CE1 3.85Å; I491-F502 HydrophobicContact CG2-CE1 4.18Å; I491-F502 HydrophobicContact CG2-CZ 4.5Å
492	A	97.5	Very high	94.3	Very high	4 Å²	4	37.2 Å²	37.2	3%	0.033	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	120	178.7	0	0	0	0	0	109.8	Y310 V368 Y369 V500 T501	Y310-A492 HydrophobicContact CD1-CB 3.93Å; Y310-A492 HydrophobicContact CE1-CB 3.6Å; Y310-A492 HydrophobicContact CE2-CB 4.45Å; V368-A492 WeakPolarHBondContact O-CA 3.4Å; Y369-A492 HydrophobicContact CD2-CB 3.9Å; A492-V500 CarbonylContact O-C 3.57Å; A492-V500 WeakPolarHBondContact O-CA 3.25Å; A492-T501 PolarHBondContact N-O 3.21Å; A492-T501 PolarHBondContact O-N 2.76Å
493	L	97.8	Very high	94.8	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	118.5	174.9	167.7	65.3	0	0	0	109	F363 K367 V368 W370 V500 F518 L522	F363-L493 HydrophobicContact CB-CD2 3.91Å; F363-L493 HydrophobicContact CD2-CD2 4.13Å; F363-L493 HydrophobicContact CG-CD2 4.32Å; K367-L493 CarbonylContact C-O 3.5Å; K367-L493 VanDerWaalsContact CA-O 3.27Å; K367-L493 WeakPolarHBondContact CA-O 3.3Å; V368-L493 HydrophobicContact CG2-CB 3.9Å; V368-L493 HydrophobicContact CG2-CD2 4.1Å; V368-L493 HydrophobicContact CG2-CG 4.29Å; V368-L493 PolarHBondContact N-O 2.67Å; V368-L493 PolarHBondContact O-N 3.33Å; W370-L493 HydrophobicContact CZ3-CB 4.45Å; L493-V500 HydrophobicContact CD1-CG2 3.82Å; L493-F518 HydrophobicContact CD1-CD2 4.19Å; L493-F518 HydrophobicContact CD1-CE2 3.71Å; L493-F518 HydrophobicContact CD1-CZ 4.26Å; L493-L522 HydrophobicContact CD1-CD1 3.71Å; L493-L522 HydrophobicContact CD2-CB 4.24Å; L493-L522 HydrophobicContact CD2-CD1 4.22Å
494	D	97.6	Very high	95.3	Very high	23 Å²	23	32.8 Å²	32.8	12%	0.123	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	98.7	165.2	-175.9	-6.3	0	0	0	108.5	K367 G497 G498 T499	K367-D494 WeakPolarHBondContact CE-OD2 3.26Å; K367-D494 HydrophobicContact CG-CB 4.07Å; K367-D494 IonicContact NZ-OD2 2.69Å; D494-G497 WeakPolarHBondContact OD1-CA 3.47Å; D494-G497 PolarHBondContact OD1-N 3.35Å; D494-G498 PolarHBondContact O-N 2.92Å; D494-T499 WeakPolarHBondContact CB-OG1 3.31Å; D494-T499 PolarHBondContact N-O 2.94Å; D494-T499 PolarHBondContact O-N 3.23Å
495	Y	97.8	Very high	95.7	Very high	32 Å²	32	28.3 Å²	28.3	13%	0.125	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-45.9	-172.3	-171.4	-84.4	0	0	0	112	T364 G366 F518 R520 L522	T364-Y495 VanDerWaalsContact C-CD1 3.44Å; T364-Y495 WeakPolarHBondContact O-CD1 3.27Å; T364-Y495 VanDerWaalsContact O-CE1 3.24Å; T364-Y495 WeakPolarHBondContact O-CE1 3.44Å; G366-Y495 PolarHBondContact O-N 3.01Å; G366-Y495 VanDerWaalsContact O-N 3.1Å; Y495-F518 HydrophobicContact CD2-CB 4.01Å; Y495-F518 HydrophobicContact CD2-CD2 4.3Å; Y495-F518 HydrophobicContact CD2-CG 4.49Å; Y495-F518 HydrophobicContact CE1-CB 4.32Å; Y495-F518 HydrophobicContact CE2-CB 3.61Å; Y495-F518 HydrophobicContact CE2-CG 4.48Å; Y495-F518 WeakPolarHBondContact O-CD2 3.18Å; Y495-F518 PolarHBondContact OH-O 2.96Å; Y495-R520 WeakPolarHBondContact CE2-O 3.22Å; Y495-R520 PolarHBondContact OH-N 2.79Å; Y495-R520 PolarHBondContact OH-O 3.41Å; Y495-L522 HydrophobicContact CE2-CG 4.39Å
496	E	96.6	Very high	95.9	Very high	125 Å²	125	28 Å²	28	58%	0.584	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-35.8	179.3	-66.7	82.2	178.4	0	0	112.3	W365 G366 G498	W365-E496 WeakPolarHBondContact CA-OE1 3.46Å; W365-E496 WeakPolarHBondContact CB-OE1 2.99Å; G366-E496 VanDerWaalsContact CA-OE2 3.25Å; G366-E496 WeakPolarHBondContact CA-OE2 3.24Å; G366-E496 PolarHBondContact N-OE1 3.39Å; G366-E496 PolarHBondContact N-OE2 3.2Å; E496-G498 PolarHBondContact O-N 3.33Å
497	G	96.9	Very high	95.9	Very high	46 Å²	46	28.2 Å²	28.2	47%	0.474	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-16.8	174.6	0	0	0	0	0	113.6	D494	D494-G497 WeakPolarHBondContact OD1-CA 3.47Å; D494-G497 PolarHBondContact OD1-N 3.35Å
498	G	97.6	Very high	95.9	Very high	7 Å²	7	23.9 Å²	23.9	7%	0.072	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.6	34.5	175.4	0	0	0	0	0	113.3	D494 E496 T515 A516 F518	D494-G498 PolarHBondContact O-N 2.92Å; E496-G498 PolarHBondContact O-N 3.33Å; G498-T515 CarbonylContact O-C 3.6Å; G498-T515 VanDerWaalsContact O-CA 3.32Å; G498-T515 WeakPolarHBondContact O-CA 3.44Å; G498-A516 CarbonylContact C-O 3.1Å; G498-A516 WeakPolarHBondContact CA-O 3.41Å; G498-A516 PolarHBondContact O-N 3.45Å; G498-F518 VanDerWaalsContact CA-CE2 3.48Å
499	T	98.1	Very high	95.8	Very high	28 Å²	28	22.2 Å²	22.2	17%	0.172	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	146.5	-179.5	62.9	0	0	0	0	113.4	D494 T513 F514 T515	D494-T499 WeakPolarHBondContact CB-OG1 3.31Å; D494-T499 PolarHBondContact N-O 2.94Å; D494-T499 PolarHBondContact O-N 3.23Å; T499-T513 HydrophobicContact CG2-CG2 4.15Å; T499-F514 CarbonylContact C-O 3.04Å; T499-F514 VanDerWaalsContact CA-O 3.24Å; T499-F514 WeakPolarHBondContact CA-O 3.34Å; T499-T515 HydrophobicContact CG2-CG2 4.43Å
500	V	98	Very high	95.6	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	110.6	165.5	-177.9	0	0	0	0	107.1	V441 W461 I491 A492 L493 F502 T513 F514 F518	V441-V500 HydrophobicContact CG2-CB 4.39Å; V441-V500 HydrophobicContact CG2-CG1 4.01Å; V441-V500 HydrophobicContact CG2-CG2 3.52Å; W461-V500 HydrophobicContact CB-CB 4.49Å; W461-V500 HydrophobicContact CB-CG2 4.33Å; I491-V500 HydrophobicContact CG2-CG1 4.21Å; A492-V500 CarbonylContact O-C 3.57Å; A492-V500 WeakPolarHBondContact O-CA 3.25Å; L493-V500 HydrophobicContact CD1-CG2 3.82Å; V500-F502 HydrophobicContact CB-CE2 4.37Å; V500-F502 HydrophobicContact CG1-CD2 4.31Å; V500-F502 HydrophobicContact CG1-CE2 3.51Å; V500-F502 HydrophobicContact CG1-CZ 3.76Å; V500-T513 CarbonylContact O-C 3.52Å; V500-T513 WeakPolarHBondContact O-CA 2.91Å; V500-F514 HydrophobicContact CB-CB 4.41Å; V500-F514 PolarHBondContact N-O 3.49Å; V500-F514 PolarHBondContact O-N 3.41Å; V500-F518 HydrophobicContact CG2-CE1 4.5Å; V500-F518 HydrophobicContact CG2-CE2 4.46Å; V500-F518 HydrophobicContact CG2-CZ 3.79Å
501	T	97.7	Very high	95.5	Very high	22 Å²	22	28 Å²	28	14%	0.135	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	132.4	-176	-62.9	0	0	0	0	110.4	A492 T503 L510 Y512 T513	A492-T501 PolarHBondContact N-O 3.21Å; A492-T501 PolarHBondContact O-N 2.76Å; T501-T503 HydrophobicContact CG2-CG2 4.24Å; T501-L510 HydrophobicContact CG2-CD1 3.47Å; T501-L510 VanDerWaalsContact CG2-CD1 3.47Å; T501-Y512 WeakPolarHBondContact CA-O 3.23Å; T501-T513 WeakPolarHBondContact CB-OG1 3.45Å; T501-T513 WeakPolarHBondContact CG2-OG1 3.3Å; T501-T513 WeakPolarHBondContact OG1-CG2 3.31Å; T501-T513 PolarHBondContact OG1-OG1 3.07Å
502	F	97.4	Very high	95.4	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	132.2	177.5	-65.7	-91.7	0	0	0	109.5	V439 L463 V489 G490 I491 V500 I511 Y512 F514	V439-F502 HydrophobicContact CG2-CE1 4.4Å; V439-F502 WeakPolarHBondContact O-CE1 3.33Å; L463-F502 HydrophobicContact CD1-CB 3.42Å; L463-F502 VanDerWaalsContact CD1-CB 3.42Å; L463-F502 HydrophobicContact CD1-CD1 3.7Å; L463-F502 HydrophobicContact CD1-CD2 4.27Å; L463-F502 HydrophobicContact CD1-CG 3.53Å; L463-F502 HydrophobicContact CD2-CD2 4.44Å; L463-F502 HydrophobicContact CD2-CG 4.48Å; L463-F502 HydrophobicContact CG-CB 4.1Å; L463-F502 HydrophobicContact CG-CD1 3.76Å; L463-F502 HydrophobicContact CG-CD2 3.98Å; L463-F502 HydrophobicContact CG-CE1 4.14Å; L463-F502 HydrophobicContact CG-CE2 4.35Å; L463-F502 HydrophobicContact CG-CG 3.66Å; L463-F502 HydrophobicContact CG-CZ 4.42Å; V489-F502 HydrophobicContact CG1-CB 4.46Å; V489-F502 HydrophobicContact CG1-CD1 3.87Å; G490-F502 CarbonylContact O-C 3.57Å; G490-F502 WeakPolarHBondContact O-CA 3.38Å; I491-F502 HydrophobicContact CD1-CE1 4.12Å; I491-F502 HydrophobicContact CG1-CD1 3.96Å; I491-F502 HydrophobicContact CG1-CE1 3.85Å; I491-F502 HydrophobicContact CG2-CE1 4.18Å; I491-F502 HydrophobicContact CG2-CZ 4.5Å; V500-F502 HydrophobicContact CB-CE2 4.37Å; V500-F502 HydrophobicContact CG1-CD2 4.31Å; V500-F502 HydrophobicContact CG1-CE2 3.51Å; V500-F502 HydrophobicContact CG1-CZ 3.76Å; F502-I511 HydrophobicContact CB-CB 4.26Å; F502-I511 PolarHBondContact O-N 3.43Å; F502-Y512 PolarHBondContact N-O 2.9Å; F502-Y512 PolarHBondContact O-N 2.8Å; F502-F514 HydrophobicContact CD2-CD2 4.05Å; F502-F514 HydrophobicContact CD2-CE2 4.02Å; F502-F514 AromaticContact CE2-CD2 3.54Å; F502-F514 HydrophobicContact CE2-CD2 3.54Å; F502-F514 AromaticContact CE2-CE2 3.51Å; F502-F514 HydrophobicContact CE2-CE2 3.51Å; F502-F514 HydrophobicContact CZ-CE2 4.39Å
503	T	95.8	Very high	95.4	Very high	18 Å²	18	32.9 Å²	32.9	11%	0.11	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	150.7	-178.8	48.6	0	0	0	0	110.1	V489 G490 T501 A505 E509 I511	V489-T503 CarbonylContact C-O 3.57Å; V489-T503 WeakPolarHBondContact CA-O 3.24Å; G490-T503 PolarHBondContact N-O 3.15Å; G490-T503 PolarHBondContact O-N 2.89Å; G490-T503 PolarHBondContact O-OG1 2.86Å; T501-T503 HydrophobicContact CG2-CG2 4.24Å; T503-A505 PolarHBondContact O-N 3.45Å; T503-E509 CarbonylContact C-O 3.55Å; T503-E509 WeakPolarHBondContact CA-O 3.46Å; T503-E509 WeakPolarHBondContact CB-O 3.28Å; T503-I511 VanDerWaalsContact C-CD1 3.4Å
504	N	94.3	Very high	95.4	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	114.9	160.5	-178.4	-33.1	0	0	0	106.6	L484 P486 E506 S507 Q508 E509 I511	L484-N504 PolarHBondContact O-ND2 3.15Å; P486-N504 HydrophobicContact CB-CB 4.16Å; N504-E506 PolarHBondContact O-N 3.16Å; N504-E506 WeakPolarHBondContact OD1-CB 3.2Å; N504-E506 PolarHBondContact OD1-N 3.39Å; N504-S507 VanDerWaalsContact CB-OG 3.31Å; N504-S507 WeakPolarHBondContact CB-OG 3.44Å; N504-S507 VanDerWaalsContact CG-OG 3.23Å; N504-S507 PolarHBondContact ND2-OG 2.78Å; N504-S507 PolarHBondContact OD1-N 3.42Å; N504-Q508 WeakPolarHBondContact O-CA 3.4Å; N504-Q508 PolarHBondContact O-N 2.78Å; N504-Q508 PolarHBondContact O-NE2 2.85Å; N504-E509 HydrophobicContact CB-CB 4.28Å; N504-E509 PolarHBondContact N-O 2.93Å; N504-I511 HydrophobicContact CB-CD1 4.35Å
505	A	93.4	Very high	95.4	Very high	9 Å²	9	37.6 Å²	37.6	7%	0.074	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-17.3	-173.2	0	0	0	0	0	112.9	E371 R488 T503 Q508	E371-A505 HydrophobicContact CG-CB 3.94Å; R488-A505 HydrophobicContact CB-CB 3.96Å; R488-A505 HydrophobicContact CG-CB 3.76Å; R488-A505 WeakPolarHBondContact O-CB 3.11Å; R488-A505 PolarHBondContact O-N 2.86Å; T503-A505 PolarHBondContact O-N 3.45Å; A505-Q508 PolarHBondContact O-NE2 2.96Å
506	E	89.8	Confident	95.3	Very high	87 Å²	87	37.3 Å²	37.3	41%	0.407	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-60.7	176.2	-65.7	165.1	174.1	0	0	109.9	N504 Q508	N504-E506 PolarHBondContact O-N 3.16Å; N504-E506 WeakPolarHBondContact OD1-CB 3.2Å; N504-E506 PolarHBondContact OD1-N 3.39Å; E506-Q508 VanDerWaalsContact C-N 3.33Å; E506-Q508 PolarHBondContact O-N 3.15Å
507	S	90.1	Very high	95.2	Very high	14 Å²	14	37.2 Å²	37.2	10%	0.098	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-11.6	-175.2	72.7	0	0	0	0	114.5	N504 E509	N504-S507 VanDerWaalsContact CB-OG 3.31Å; N504-S507 WeakPolarHBondContact CB-OG 3.44Å; N504-S507 VanDerWaalsContact CG-OG 3.23Å; N504-S507 PolarHBondContact ND2-OG 2.78Å; N504-S507 PolarHBondContact OD1-N 3.42Å; S507-E509 PolarHBondContact O-N 3.26Å; S507-E509 VanDerWaalsContact O-N 3.13Å; S507-E509 VanDerWaalsContact OG-CB 3.32Å; S507-E509 WeakPolarHBondContact OG-CB 3.45Å; S507-E509 PolarHBondContact OG-N 3.06Å
508	Q	91.4	Very high	95.2	Very high	21 Å²	21	35.9 Å²	35.9	10%	0.098	20%	0.202	C	C	.	.			trans	63	12.3	-175	-108.4	67	133.3	0	0	115.3	G302 R306 N504 A505 E506 L510	G302-Q508 VanDerWaalsContact CA-CG 3.46Å; R306-Q508 VanDerWaalsContact CZ-CD 3.44Å; R306-Q508 VanDerWaalsContact NH2-CD 3.33Å; N504-Q508 WeakPolarHBondContact O-CA 3.4Å; N504-Q508 PolarHBondContact O-N 2.78Å; N504-Q508 PolarHBondContact O-NE2 2.85Å; A505-Q508 PolarHBondContact O-NE2 2.96Å; E506-Q508 VanDerWaalsContact C-N 3.33Å; E506-Q508 PolarHBondContact O-N 3.15Å; Q508-L510 PolarHBondContact O-N 2.96Å
509	E	91.3	Very high	94.9	Very high	29 Å²	29	40.4 Å²	40.4	14%	0.136	23%	0.229	C	C	.	.			trans	-62.8	133.7	172.9	-175	174.8	-154.3	0	0	110.6	A483 T503 N504 S507 I511	A483-E509 WeakPolarHBondContact CB-OE1 3.45Å; A483-E509 PolarHBondContact N-OE1 3.39Å; A483-E509 PolarHBondContact N-OE2 2.96Å; T503-E509 CarbonylContact C-O 3.55Å; T503-E509 WeakPolarHBondContact CA-O 3.46Å; T503-E509 WeakPolarHBondContact CB-O 3.28Å; N504-E509 HydrophobicContact CB-CB 4.28Å; N504-E509 PolarHBondContact N-O 2.93Å; S507-E509 PolarHBondContact O-N 3.26Å; S507-E509 VanDerWaalsContact O-N 3.13Å; S507-E509 VanDerWaalsContact OG-CB 3.32Å; S507-E509 WeakPolarHBondContact OG-CB 3.45Å; S507-E509 PolarHBondContact OG-N 3.06Å; E509-I511 PolarHBondContact O-N 3.27Å
510	L	93	Very high	94.8	Very high	106 Å²	106	46 Å²	46	56%	0.555	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-68.7	121.9	169.4	174.1	66.8	0	0	0	108.8	T501 Q508	T501-L510 HydrophobicContact CG2-CD1 3.47Å; T501-L510 VanDerWaalsContact CG2-CD1 3.47Å; Q508-L510 PolarHBondContact O-N 2.96Å
511	I	95.1	Very high	94.7	Very high	16 Å²	16	51.3 Å²	51.3	8%	0.082	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	-55.1	173.6	-59.4	167.6	0	0	0	109.1	L463 I470 L480 P486 V489 F502 T503 N504 E509	L463-I511 HydrophobicContact CD1-CB 4.21Å; L463-I511 HydrophobicContact CD1-CG2 3.54Å; I470-I511 HydrophobicContact CG2-CG2 4.37Å; L480-I511 HydrophobicContact CD1-CG2 3.82Å; P486-I511 HydrophobicContact CB-CD1 4.15Å; P486-I511 HydrophobicContact CG-CD1 3.91Å; V489-I511 HydrophobicContact CG1-CD1 4.43Å; F502-I511 HydrophobicContact CB-CB 4.26Å; F502-I511 PolarHBondContact O-N 3.43Å; T503-I511 VanDerWaalsContact C-CD1 3.4Å; N504-I511 HydrophobicContact CB-CD1 4.35Å; E509-I511 PolarHBondContact O-N 3.27Å
512	Y	96.5	Very high	94.8	Very high	60 Å²	60	50.3 Å²	50.3	24%	0.235	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	159.5	-178.4	-163.4	-103.8	0	0	0	112.5	L463 A472 T474 L480 T501 F502 F514	L463-Y512 HydrophobicContact CD2-CG 4.49Å; A472-Y512 HydrophobicContact CB-CD1 3.74Å; A472-Y512 HydrophobicContact CB-CD2 4.02Å; A472-Y512 HydrophobicContact CB-CE1 3.69Å; A472-Y512 HydrophobicContact CB-CE2 3.95Å; A472-Y512 HydrophobicContact CB-CG 3.91Å; T474-Y512 HydrophobicContact CG2-CE1 4.43Å; T474-Y512 WeakPolarHBondContact CG2-OH 3.21Å; L480-Y512 HydrophobicContact CD1-CD2 4.06Å; L480-Y512 HydrophobicContact CD1-CG 4.14Å; L480-Y512 HydrophobicContact CD2-CD2 3.61Å; L480-Y512 HydrophobicContact CD2-CE2 4.16Å; L480-Y512 HydrophobicContact CD2-CG 4.47Å; T501-Y512 WeakPolarHBondContact CA-O 3.23Å; F502-Y512 PolarHBondContact N-O 2.9Å; F502-Y512 PolarHBondContact O-N 2.8Å; Y512-F514 HydrophobicContact CD1-CD1 4.43Å; Y512-F514 AromaticContact CD1-CD2 3.66Å; Y512-F514 HydrophobicContact CD1-CD2 3.66Å; Y512-F514 HydrophobicContact CD1-CE1 4.35Å; Y512-F514 AromaticContact CD1-CE2 3.58Å; Y512-F514 HydrophobicContact CD1-CE2 3.58Å; Y512-F514 HydrophobicContact CD1-CG 4.12Å; Y512-F514 AromaticContact CD1-CZ 3.95Å; Y512-F514 HydrophobicContact CD1-CZ 3.95Å; Y512-F514 AromaticContact CE1-CD1 3.83Å; Y512-F514 HydrophobicContact CE1-CD1 3.83Å; Y512-F514 AromaticContact CE1-CD2 3.89Å; Y512-F514 HydrophobicContact CE1-CD2 3.89Å; Y512-F514 AromaticContact CE1-CE1 3.83Å; Y512-F514 HydrophobicContact CE1-CE1 3.83Å; Y512-F514 AromaticContact CE1-CE2 3.91Å; Y512-F514 HydrophobicContact CE1-CE2 3.91Å; Y512-F514 AromaticContact CE1-CG 3.88Å; Y512-F514 HydrophobicContact CE1-CG 3.88Å; Y512-F514 AromaticContact CE1-CZ 3.88Å; Y512-F514 HydrophobicContact CE1-CZ 3.88Å
513	T	97.6	Very high	94.8	Very high	46 Å²	46	50.7 Å²	50.7	28%	0.282	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	120.2	168.8	-65.8	0	0	0	0	110.8	T499 V500 T501	T499-T513 HydrophobicContact CG2-CG2 4.15Å; V500-T513 CarbonylContact O-C 3.52Å; V500-T513 WeakPolarHBondContact O-CA 2.91Å; T501-T513 WeakPolarHBondContact CB-OG1 3.45Å; T501-T513 WeakPolarHBondContact CG2-OG1 3.3Å; T501-T513 WeakPolarHBondContact OG1-CG2 3.31Å; T501-T513 PolarHBondContact OG1-OG1 3.07Å
514	F	97.7	Very high	94.9	Very high	8 Å²	8	50 Å²	50	4%	0.035	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	141.1	165.9	-65.1	-92.5	0	0	0	109.8	P456 W461 A462 L463 A472 T474 T499 V500 F502 Y512	P456-F514 HydrophobicContact CG-CD1 3.84Å; P456-F514 HydrophobicContact CG-CE1 3.74Å; W461-F514 HydrophobicContact CB-CB 4.34Å; W461-F514 HydrophobicContact CB-CD1 4.45Å; W461-F514 HydrophobicContact CB-CD2 4.18Å; W461-F514 HydrophobicContact CB-CG 4.07Å; W461-F514 AromaticContact CD1-CD1 3.77Å; W461-F514 AromaticContact CD1-CG 3.8Å; W461-F514 HydrophobicContact CG-CB 4.3Å; W461-F514 HydrophobicContact CG-CG 4.35Å; A462-F514 WeakPolarHBondContact O-CZ 3.4Å; L463-F514 HydrophobicContact CD2-CE2 4.37Å; A472-F514 HydrophobicContact CB-CE1 4.34Å; A472-F514 HydrophobicContact CB-CE2 4.46Å; A472-F514 HydrophobicContact CB-CZ 3.79Å; T474-F514 HydrophobicContact CG2-CD1 4.21Å; T474-F514 HydrophobicContact CG2-CE1 3.67Å; T499-F514 CarbonylContact C-O 3.04Å; T499-F514 VanDerWaalsContact CA-O 3.24Å; T499-F514 WeakPolarHBondContact CA-O 3.34Å; V500-F514 HydrophobicContact CB-CB 4.41Å; V500-F514 PolarHBondContact N-O 3.49Å; V500-F514 PolarHBondContact O-N 3.41Å; F502-F514 HydrophobicContact CD2-CD2 4.05Å; F502-F514 HydrophobicContact CD2-CE2 4.02Å; F502-F514 AromaticContact CE2-CD2 3.54Å; F502-F514 HydrophobicContact CE2-CD2 3.54Å; F502-F514 AromaticContact CE2-CE2 3.51Å; F502-F514 HydrophobicContact CE2-CE2 3.51Å; F502-F514 HydrophobicContact CZ-CE2 4.39Å; Y512-F514 HydrophobicContact CD1-CD1 4.43Å; Y512-F514 AromaticContact CD1-CD2 3.66Å; Y512-F514 HydrophobicContact CD1-CD2 3.66Å; Y512-F514 HydrophobicContact CD1-CE1 4.35Å; Y512-F514 AromaticContact CD1-CE2 3.58Å; Y512-F514 HydrophobicContact CD1-CE2 3.58Å; Y512-F514 HydrophobicContact CD1-CG 4.12Å; Y512-F514 AromaticContact CD1-CZ 3.95Å; Y512-F514 HydrophobicContact CD1-CZ 3.95Å; Y512-F514 AromaticContact CE1-CD1 3.83Å; Y512-F514 HydrophobicContact CE1-CD1 3.83Å; Y512-F514 AromaticContact CE1-CD2 3.89Å; Y512-F514 HydrophobicContact CE1-CD2 3.89Å; Y512-F514 AromaticContact CE1-CE1 3.83Å; Y512-F514 HydrophobicContact CE1-CE1 3.83Å; Y512-F514 AromaticContact CE1-CE2 3.91Å; Y512-F514 HydrophobicContact CE1-CE2 3.91Å; Y512-F514 AromaticContact CE1-CG 3.88Å; Y512-F514 HydrophobicContact CE1-CG 3.88Å; Y512-F514 AromaticContact CE1-CZ 3.88Å; Y512-F514 HydrophobicContact CE1-CZ 3.88Å
515	T	97.1	Very high	95	Very high	114 Å²	114	50 Å²	50	70%	0.699	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.4	127.6	172.2	-54.9	0	0	0	0	109.4	G498 T499	G498-T515 CarbonylContact O-C 3.6Å; G498-T515 VanDerWaalsContact O-CA 3.32Å; G498-T515 WeakPolarHBondContact O-CA 3.44Å; T499-T515 HydrophobicContact CG2-CG2 4.43Å
516	A	95.4	Very high	95.2	Very high	26 Å²	26	49.7 Å²	49.7	22%	0.215	26%	0.256	C	S	.	.			trans	-157.7	161.9	-179.9	0	0	0	0	0	111.7	W461 G498 F518	W461-A516 HydrophobicContact CZ2-CB 3.84Å; G498-A516 CarbonylContact C-O 3.1Å; G498-A516 WeakPolarHBondContact CA-O 3.41Å; G498-A516 PolarHBondContact O-N 3.45Å; A516-F518 HydrophobicContact CB-CD1 4.26Å; A516-F518 HydrophobicContact CB-CE1 3.69Å; A516-F518 HydrophobicContact CB-CZ 4.27Å
517	T	95.9	Very high	95.4	Very high	123 Å²	123	46.3 Å²	46.3	76%	0.755	24%	0.239	S	C	*	.			trans	-92.1	110.5	171.5	-54.5	0	0	0	0	110.2	T519	T517-T519 HydrophobicContact CG2-CG2 4.47Å
518	F	95.2	Very high	95.6	Very high	18 Å²	18	45.7 Å²	45.7	8%	0.079	24%	0.235	C	C	.	.			trans	-86	121.1	-179.9	-49.9	-50.6	0	0	0	111.5	W461 L493 Y495 G498 V500 A516 L522	W461-F518 HydrophobicContact CD2-CE1 4.18Å; W461-F518 AromaticContact CE2-CE1 3.85Å; W461-F518 HydrophobicContact CE3-CE1 4.43Å; W461-F518 AromaticContact CH2-CD1 3.97Å; W461-F518 HydrophobicContact CH2-CD1 3.97Å; W461-F518 HydrophobicContact CH2-CE1 4.03Å; W461-F518 HydrophobicContact CZ2-CD1 4.03Å; W461-F518 AromaticContact CZ2-CE1 3.77Å; W461-F518 HydrophobicContact CZ2-CE1 3.77Å; W461-F518 HydrophobicContact CZ3-CD1 4.47Å; W461-F518 HydrophobicContact CZ3-CE1 4.37Å; L493-F518 HydrophobicContact CD1-CD2 4.19Å; L493-F518 HydrophobicContact CD1-CE2 3.71Å; L493-F518 HydrophobicContact CD1-CZ 4.26Å; Y495-F518 HydrophobicContact CD2-CB 4.01Å; Y495-F518 HydrophobicContact CD2-CD2 4.3Å; Y495-F518 HydrophobicContact CD2-CG 4.49Å; Y495-F518 HydrophobicContact CE1-CB 4.32Å; Y495-F518 HydrophobicContact CE2-CB 3.61Å; Y495-F518 HydrophobicContact CE2-CG 4.48Å; Y495-F518 WeakPolarHBondContact O-CD2 3.18Å; Y495-F518 PolarHBondContact OH-O 2.96Å; G498-F518 VanDerWaalsContact CA-CE2 3.48Å; V500-F518 HydrophobicContact CG2-CE1 4.5Å; V500-F518 HydrophobicContact CG2-CE2 4.46Å; V500-F518 HydrophobicContact CG2-CZ 3.79Å; A516-F518 HydrophobicContact CB-CD1 4.26Å; A516-F518 HydrophobicContact CB-CE1 3.69Å; A516-F518 HydrophobicContact CB-CZ 4.27Å; F518-L522 HydrophobicContact CB-CD1 4.41Å; F518-L522 HydrophobicContact CD1-CD1 3.63Å; F518-L522 HydrophobicContact CD1-CG 4.46Å; F518-L522 HydrophobicContact CD2-CD1 4.07Å; F518-L522 HydrophobicContact CE1-CD1 3.82Å; F518-L522 HydrophobicContact CE2-CD1 4.24Å; F518-L522 HydrophobicContact CG-CD1 3.77Å; F518-L522 HydrophobicContact CZ-CD1 4.16Å
519	T	92.9	Very high	95.5	Very high	103 Å²	103	47.6 Å²	47.6	63%	0.632	24%	0.243	S	C	*	.			trans	-115.9	-11.7	179.9	54.8	0	0	0	0	113.2	T517	T517-T519 HydrophobicContact CG2-CG2 4.47Å
520	R	94.7	Very high	95.3	Very high	144 Å²	144	46.9 Å²	46.9	54%	0.543	24%	0.239	S	C	.	.	S	Bend	trans	-129.8	161.8	-177	-63.5	-162.7	177.3	-144.5	0	109.8	Y495 L522	Y495-R520 WeakPolarHBondContact CE2-O 3.22Å; Y495-R520 PolarHBondContact OH-N 2.79Å; Y495-R520 PolarHBondContact OH-O 3.41Å; R520-L522 PolarHBondContact O-N 2.81Å
521	R	97.2	Very high	94.9	Very high	112 Å²	112	45.1 Å²	45.1	42%	0.423	23%	0.234	S	C	.	.			trans	-57.3	129	175.8	-179.2	-173.2	-62.8	-95.4	2.8	110.1	G362 F363 T364 D444	G362-R521 PolarHBondContact O-NH1 3.4Å; F363-R521 WeakPolarHBondContact O-CA 3.43Å; T364-R521 HydrophobicContact CG2-CB 3.64Å; T364-R521 HydrophobicContact CG2-CG 3.99Å; D444-R521 HydrophobicContact CB-CB 4.41Å; D444-R521 HydrophobicContact CB-CG 4.44Å; D444-R521 PolarHBondContact N-O 3.22Å; D444-R521 IonicContact OD2-NE 3.12Å
522	L	98	Very high	94.4	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	141.2	171	-59.8	-173.1	0	0	0	109.8	G362 F363 V441 A442 R443 W461 L493 Y495 F518 R520	G362-L522 CarbonylContact C-O 3.45Å; G362-L522 VanDerWaalsContact C-O 3.31Å; G362-L522 WeakPolarHBondContact CA-O 3.29Å; F363-L522 PolarHBondContact N-O 2.69Å; F363-L522 PolarHBondContact O-N 3.17Å; V441-L522 HydrophobicContact CG2-CD1 4.27Å; A442-L522 CarbonylContact O-C 3.44Å; A442-L522 WeakPolarHBondContact O-CA 3.38Å; R443-L522 HydrophobicContact CG-CD2 3.94Å; W461-L522 HydrophobicContact CE3-CD2 4.23Å; W461-L522 HydrophobicContact CH2-CD2 4.1Å; W461-L522 HydrophobicContact CZ3-CD1 4.42Å; W461-L522 HydrophobicContact CZ3-CD2 3.43Å; W461-L522 VanDerWaalsContact CZ3-CD2 3.43Å; L493-L522 HydrophobicContact CD1-CD1 3.71Å; L493-L522 HydrophobicContact CD2-CB 4.24Å; L493-L522 HydrophobicContact CD2-CD1 4.22Å; Y495-L522 HydrophobicContact CE2-CG 4.39Å; F518-L522 HydrophobicContact CB-CD1 4.41Å; F518-L522 HydrophobicContact CD1-CD1 3.63Å; F518-L522 HydrophobicContact CD1-CG 4.46Å; F518-L522 HydrophobicContact CD2-CD1 4.07Å; F518-L522 HydrophobicContact CE1-CD1 3.82Å; F518-L522 HydrophobicContact CE2-CD1 4.24Å; F518-L522 HydrophobicContact CG-CD1 3.77Å; F518-L522 HydrophobicContact CZ-CD1 4.16Å; R520-L522 PolarHBondContact O-N 2.81Å
523	V	97.5	Very high	94	Very high	8 Å²	8	43.1 Å²	43.1	5%	0.048	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	147.8	176.2	-70.7	0	0	0	0	108.6	L358 V441 A442 D444 F525	L358-V523 HydrophobicContact CB-CG2 4.15Å; L358-V523 HydrophobicContact CD1-CG2 4.29Å; L358-V523 HydrophobicContact CD2-CG2 3.74Å; L358-V523 HydrophobicContact CG-CG2 4.26Å; V441-V523 CarbonylContact C-O 3.59Å; V441-V523 VanDerWaalsContact CA-O 3.26Å; V441-V523 WeakPolarHBondContact CA-O 3.43Å; A442-V523 PolarHBondContact N-O 2.92Å; A442-V523 WeakPolarHBondContact O-CG2 3.45Å; A442-V523 PolarHBondContact O-N 3.17Å; D444-V523 HydrophobicContact CB-CG1 4.15Å; V523-F525 PolarHBondContact O-N 3.5Å
524	P	97.8	Very high	93.8	Very high	3 Å²	3	45.6 Å²	45.6	2%	0.019	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.1	140.7	166.2	-27.4	37.8	0	0	0	110.1	V315 L358 G359 K361 F363 W370	V315-P524 HydrophobicContact CB-CG 4.43Å; V315-P524 HydrophobicContact CG1-CB 3.79Å; V315-P524 HydrophobicContact CG1-CG 3.56Å; V315-P524 HydrophobicContact CG2-CG 3.93Å; L358-P524 CarbonylContact C-O 3.51Å; L358-P524 WeakPolarHBondContact CA-O 3.38Å; G359-P524 PolarHBondContact N-O 3.02Å; K361-P524 WeakPolarHBondContact O-CD 3.42Å; F363-P524 HydrophobicContact CE2-CG 4.09Å; W370-P524 HydrophobicContact CH2-CG 4.08Å; W370-P524 HydrophobicContact CZ2-CB 3.88Å; W370-P524 HydrophobicContact CZ2-CG 3.77Å
525	F	97.4	Very high	93.7	Very high	1 Å²	1	45.2 Å²	45.2	0%	0.004	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	129.7	-178.4	172.6	-109.5	0	0	0	108.8	F351 L358 G440 A442 L454 V460 A462 V523 W527	F351-F525 HydrophobicContact CE2-CE2 4.37Å; F351-F525 HydrophobicContact CZ-CD2 4.49Å; F351-F525 AromaticContact CZ-CE2 3.95Å; F351-F525 HydrophobicContact CZ-CE2 3.95Å; L358-F525 HydrophobicContact CD2-CB 4.38Å; L358-F525 HydrophobicContact CD2-CD2 3.72Å; G440-F525 PolarHBondContact N-O 2.77Å; G440-F525 PolarHBondContact O-N 2.8Å; A442-F525 HydrophobicContact CB-CB 3.77Å; A442-F525 HydrophobicContact CB-CD2 4.27Å; A442-F525 HydrophobicContact CB-CG 4Å; L454-F525 HydrophobicContact CD2-CE1 4.32Å; L454-F525 HydrophobicContact CD2-CZ 3.89Å; V460-F525 HydrophobicContact CG1-CD1 3.82Å; V460-F525 HydrophobicContact CG1-CE1 3.83Å; A462-F525 HydrophobicContact CB-CD1 4.4Å; V523-F525 PolarHBondContact O-N 3.5Å; F525-W527 HydrophobicContact CE1-CB 4.05Å; F525-W527 HydrophobicContact CZ-CB 3.86Å
526	L	97.1	Very high	93.6	Very high	4 Å²	4	40.9 Å²	40.9	2%	0.021	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	143.5	171.3	-55.6	179.8	0	0	0	108.7	L317 V335 G356 V357 V372 M438 V439 L535	L317-L526 HydrophobicContact CD1-CD1 4.32Å; L317-L526 HydrophobicContact CD2-CD1 3.81Å; L317-L526 HydrophobicContact CD2-CG 4.35Å; V335-L526 HydrophobicContact CG1-CD1 3.76Å; G356-L526 CarbonylContact C-O 3.55Å; G356-L526 WeakPolarHBondContact CA-O 3.5Å; V357-L526 HydrophobicContact CG1-CB 3.87Å; V357-L526 PolarHBondContact N-O 3.07Å; V357-L526 PolarHBondContact O-N 3.26Å; V372-L526 HydrophobicContact CG1-CD2 4.06Å; V372-L526 HydrophobicContact CG2-CD2 4.03Å; M438-L526 WeakPolarHBondContact O-CA 3.4Å; V439-L526 HydrophobicContact CB-CD2 4.27Å; V439-L526 HydrophobicContact CG1-CD2 3.99Å; L526-L535 HydrophobicContact CB-CD1 4.16Å; L526-L535 HydrophobicContact CD1-CB 4.27Å; L526-L535 HydrophobicContact CD1-CD1 4.4Å; L526-L535 HydrophobicContact CD2-CD1 4.29Å
527	W	95	Very high	93.7	Very high	15 Å²	15	40.1 Å²	40.1	6%	0.057	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	137.8	171.3	-176.2	105.1	0	0	0	107.8	E354 P355 S436 C437 M438 L454 F525 K529	E354-W527 PolarHBondContact OE2-NE1 2.88Å; P355-W527 HydrophobicContact CG-CD2 4.15Å; P355-W527 HydrophobicContact CG-CZ2 3.85Å; P355-W527 WeakPolarHBondContact O-CA 3.44Å; S436-W527 VanDerWaalsContact O-CZ3 3.24Å; S436-W527 WeakPolarHBondContact O-CZ3 3.32Å; S436-W527 WeakPolarHBondContact OG-CZ3 3.45Å; C437-W527 CarbonylContact C-O 3.59Å; C437-W527 VanDerWaalsContact CA-O 3.29Å; C437-W527 WeakPolarHBondContact CA-O 3.28Å; M438-W527 HydrophobicContact CB-CB 4Å; M438-W527 HydrophobicContact CG-CB 4.28Å; M438-W527 HydrophobicContact CG-CE3 4.07Å; M438-W527 PolarHBondContact N-O 2.67Å; M438-W527 PolarHBondContact O-N 3.15Å; M438-W527 HydrophobicContact SD-CB 4.37Å; M438-W527 HydrophobicContact SD-CD2 4.42Å; M438-W527 HydrophobicContact SD-CE3 4.43Å; M438-W527 HydrophobicContact SD-CG 4.44Å; L454-W527 HydrophobicContact CD1-CG 4.3Å; F525-W527 HydrophobicContact CE1-CB 4.05Å; F525-W527 HydrophobicContact CZ-CB 3.86Å; W527-K529 HydrophobicContact CE3-CB 4.31Å; W527-K529 HydrophobicContact CH2-CB 3.2Å; W527-K529 HydrophobicContact CH2-CD 3.83Å; W527-K529 HydrophobicContact CH2-CG 4.18Å; W527-K529 HydrophobicContact CZ2-CB 3.8Å; W527-K529 HydrophobicContact CZ2-CD 4.1Å; W527-K529 HydrophobicContact CZ3-CB 3.49Å; W527-K529 VanDerWaalsContact CZ3-CB 3.49Å
528	L	93.6	Very high	93.6	Very high	1 Å²	1	39 Å²	39	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	104.6	-173.3	-179.1	65.5	0	0	0	110.5	L326 Y337 P355 C437 W530 T533 L535	L326-L528 HydrophobicContact CD2-CB 4.18Å; Y337-L528 WeakPolarHBondContact CD2-O 3.46Å; P355-L528 VanDerWaalsContact CB-O 3.23Å; P355-L528 WeakPolarHBondContact CB-O 3.5Å; P355-L528 WeakPolarHBondContact CG-O 3.37Å; P355-L528 PolarHBondContact O-N 3.5Å; C437-L528 HydrophobicContact CB-CD1 3.44Å; C437-L528 VanDerWaalsContact CB-CD1 3.44Å; L528-W530 HydrophobicContact CD1-CB 3.83Å; L528-T533 HydrophobicContact CD1-CG2 4.02Å; L528-L535 HydrophobicContact CB-CD1 4.27Å; L528-L535 HydrophobicContact CD1-CD1 4.37Å; L528-L535 HydrophobicContact CD1-CG 4.22Å; L528-L535 HydrophobicContact CD2-CG 4.38Å
529	K	90.5	Very high	92.8	Very high	61 Å²	61	42.1 Å²	42.1	27%	0.265	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	67.3	167.7	-162.4	-177.8	178.2	-177.6	0	106.4	Y337 P355 L434 E435 S436 W527	Y337-K529 HydrophobicContact CE1-CG 4.45Å; Y337-K529 HydrophobicContact CE2-CG 4.24Å; P355-K529 HydrophobicContact CG-CB 3.74Å; P355-K529 HydrophobicContact CG-CG 4.23Å; L434-K529 CarbonylContact C-O 3.52Å; L434-K529 WeakPolarHBondContact O-CG 3.15Å; E435-K529 WeakPolarHBondContact CA-O 3.42Å; S436-K529 PolarHBondContact N-O 3.19Å; S436-K529 CarbonylContact O-C 3.51Å; S436-K529 VanDerWaalsContact O-C 3.26Å; S436-K529 PolarHBondContact O-N 3.07Å; W527-K529 HydrophobicContact CE3-CB 4.31Å; W527-K529 HydrophobicContact CH2-CB 3.2Å; W527-K529 HydrophobicContact CH2-CD 3.83Å; W527-K529 HydrophobicContact CH2-CG 4.18Å; W527-K529 HydrophobicContact CZ2-CB 3.8Å; W527-K529 HydrophobicContact CZ2-CD 4.1Å; W527-K529 HydrophobicContact CZ3-CB 3.49Å; W527-K529 VanDerWaalsContact CZ3-CB 3.49Å
530	W	86.3	Confident	92.7	Very high	14 Å²	14	39.1 Å²	39.1	5%	0.053	19%	0.185	C	C	.	.			trans	-143.7	101.4	-179.3	-159.1	-8.3	0	0	0	109.1	E435 C437 L465 S466 S467 L528 T533	E435-W530 PolarHBondContact OE2-NE1 3.25Å; C437-W530 HydrophobicContact CB-CE3 4.31Å; L465-W530 VanDerWaalsContact O-CZ3 3.23Å; L465-W530 WeakPolarHBondContact O-CZ3 3.48Å; S466-W530 WeakPolarHBondContact O-CH2 3.45Å; S467-W530 VanDerWaalsContact N-CH2 3.27Å; L528-W530 HydrophobicContact CD1-CB 3.83Å; W530-T533 HydrophobicContact CB-CG2 4.48Å; W530-T533 HydrophobicContact CD2-CG2 4.48Å; W530-T533 HydrophobicContact CE3-CG2 4.34Å; W530-T533 WeakPolarHBondContact O-CB 3.31Å; W530-T533 PolarHBondContact O-N 3.42Å
531	P	84.9	Confident	92.6	Very high	70 Å²	70	33.6 Å²	33.6	46%	0.455	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54	145.1	176.3	-25.6	35.6	0	0	0	111.8	Y337 T533	Y337-P531 HydrophobicContact CD1-CG 4.28Å; Y337-P531 HydrophobicContact CE1-CG 4.38Å; P531-T533 PolarHBondContact O-N 3.31Å; P531-T533 VanDerWaalsContact O-N 3.08Å
532	G	83.9	Confident	92.4	Very high	31 Å²	31	29.2 Å²	29.2	32%	0.32	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.8	0.7	-179.7	0	0	0	0	0	115.6	E377	E377-G532 PolarHBondContact N-O 3.42Å
533	T	88.2	Confident	92.1	Very high	3 Å²	3	30.9 Å²	30.9	2%	0.018	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	147.2	-178.5	-58.3	0	0	0	0	111.9	V374 E375 R376 L528 W530 P531	V374-T533 HydrophobicContact CG1-CG2 3.9Å; E375-T533 CarbonylContact O-C 3.26Å; E375-T533 WeakPolarHBondContact O-CA 3.26Å; E375-T533 WeakPolarHBondContact O-CG2 3.48Å; R376-T533 HydrophobicContact CG-CG2 3.97Å; L528-T533 HydrophobicContact CD1-CG2 4.02Å; W530-T533 HydrophobicContact CB-CG2 4.48Å; W530-T533 HydrophobicContact CD2-CG2 4.48Å; W530-T533 HydrophobicContact CE3-CG2 4.34Å; W530-T533 WeakPolarHBondContact O-CB 3.31Å; W530-T533 PolarHBondContact O-N 3.42Å; P531-T533 PolarHBondContact O-N 3.31Å; P531-T533 VanDerWaalsContact O-N 3.08Å
534	R	92.9	Very high	91.7	Very high	97 Å²	97	32.3 Å²	32.3	37%	0.366	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	139.8	176.6	-51.5	176.7	63.6	-164	-2.8	109.5	C334 V335 T336 E375 L536	C334-R534 PolarHBondContact SG-NE 3.12Å; C334-R534 VanDerWaalsContact SG-NE 3.4Å; C334-R534 PolarHBondContact SG-NH2 2.93Å; V335-R534 WeakPolarHBondContact O-CA 3.46Å; T336-R534 HydrophobicContact CG2-CG 4.22Å; E375-R534 HydrophobicContact CB-CB 4.28Å; E375-R534 PolarHBondContact N-O 2.9Å; E375-R534 PolarHBondContact O-N 2.63Å; E375-R534 IonicContact OE2-NH1 3.92Å; R534-L536 HydrophobicContact CB-CD1 3.96Å
535	L	95.9	Very high	91.3	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	126.8	170.7	-54.9	176.2	0	0	0	109.6	C334 V335 V372 E373 V374 C437 V439 L526 L528	C334-L535 VanDerWaalsContact CA-O 3.3Å; C334-L535 WeakPolarHBondContact CA-O 3.47Å; V335-L535 HydrophobicContact CG1-CB 3.71Å; V335-L535 HydrophobicContact CG1-CD1 4.27Å; V335-L535 HydrophobicContact CG1-CG 4.32Å; V335-L535 PolarHBondContact N-O 3.37Å; V335-L535 PolarHBondContact O-N 3.45Å; V372-L535 HydrophobicContact CG1-CB 4.09Å; V372-L535 HydrophobicContact CG1-CD2 4.46Å; E373-L535 CarbonylContact O-C 3.55Å; E373-L535 WeakPolarHBondContact O-CA 3.46Å; V374-L535 HydrophobicContact CB-CD2 4.26Å; V374-L535 HydrophobicContact CG1-CD2 4.09Å; V374-L535 HydrophobicContact CG2-CD2 3.81Å; C437-L535 HydrophobicContact CB-CD1 4.17Å; C437-L535 HydrophobicContact CB-CD2 4.2Å; V439-L535 HydrophobicContact CG1-CD1 4.35Å; L526-L535 HydrophobicContact CB-CD1 4.16Å; L526-L535 HydrophobicContact CD1-CB 4.27Å; L526-L535 HydrophobicContact CD1-CD1 4.4Å; L526-L535 HydrophobicContact CD2-CD1 4.29Å; L528-L535 HydrophobicContact CB-CD1 4.27Å; L528-L535 HydrophobicContact CD1-CD1 4.37Å; L528-L535 HydrophobicContact CD1-CG 4.22Å; L528-L535 HydrophobicContact CD2-CG 4.38Å
536	L	96.3	Very high	90.9	Very high	24 Å²	24	36.6 Å²	36.6	13%	0.126	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	124.8	-176.4	-64.4	84.1	0	0	0	110.7	C334 V372 E373 E375 R534 R538	C334-L536 HydrophobicContact CB-CG 4.36Å; V372-L536 CarbonylContact C-O 3.56Å; V372-L536 WeakPolarHBondContact CA-O 3.18Å; E373-L536 HydrophobicContact CB-CB 4.29Å; E373-L536 PolarHBondContact N-O 2.84Å; E373-L536 PolarHBondContact O-N 3.39Å; E375-L536 HydrophobicContact CB-CD1 3.88Å; E375-L536 VanDerWaalsContact CD-CD1 3.42Å; E375-L536 HydrophobicContact CG-CD1 3.65Å; E375-L536 WeakPolarHBondContact OE1-CD2 3.42Å; E375-L536 WeakPolarHBondContact OE2-CD1 3.23Å; R534-L536 HydrophobicContact CB-CD1 3.96Å; L536-R538 PolarHBondContact O-N 3.14Å
537	L	96.8	Very high	90.4	Very high	9 Å²	9	39.2 Å²	39.2	5%	0.047	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	115.3	175.1	-71.1	165.5	0	0	0	110.7	V315 L317 K333 V372	V315-L537 HydrophobicContact CB-CD1 4.25Å; V315-L537 HydrophobicContact CB-CD2 4.17Å; V315-L537 HydrophobicContact CG1-CD1 3.8Å; V315-L537 HydrophobicContact CG1-CD2 4.02Å; L317-L537 HydrophobicContact CD1-CD1 4.41Å; L317-L537 HydrophobicContact CD2-CD1 3.74Å; L317-L537 HydrophobicContact CG-CD1 3.69Å; K333-L537 HydrophobicContact CD-CB 3.92Å; K333-L537 PolarHBondContact O-N 3.13Å; V372-L537 HydrophobicContact CG2-CD2 4.02Å
538	R	92.6	Very high	90	Very high	99 Å²	99	41.2 Å²	41.2	37%	0.374	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	143.5	173.8	-62.1	-62.8	-172.9	165.5	-0.2	109.6	E371 E373 L536	E371-R538 HydrophobicContact CB-CB 3.84Å; E371-R538 PolarHBondContact N-O 3.49Å; E371-R538 VanDerWaalsContact N-O 3.09Å; E371-R538 PolarHBondContact O-N 3.41Å; E373-R538 HydrophobicContact CB-CG 4.25Å; E373-R538 IonicContact OE2-CZ 2.92Å; E373-R538 IonicContact OE2-NE 3.53Å; E373-R538 PolarHBondContact OE2-NE 3.03Å; E373-R538 IonicContact OE2-NH2 3.47Å; E373-R538 PolarHBondContact OE2-NH2 2.92Å; L536-R538 PolarHBondContact O-N 3.14Å
539	P	78.4	Confident	89.7	Confident	85 Å²	85	44.8 Å²	44.8	55%	0.552	23%	0.234	S	C	*	.			trans	-59.1	0	-179.6	24.7	-31.9	0	0	0	111.8	T312	T312-P539 WeakPolarHBondContact CG2-OXT 3.4Å

Retrieved 539 of 539 residues in 1289.8 ms (Link to these results)

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