A0A090KME2_HUMAN Loading...

HLA class I antigen

Involved in the presentation of foreign antigens to the immune system.

AlphaFold DB , UniProt , Accession A0A090KME2, Species HUMAN (Homo sapiens, Human), Gene HLA-C, Length 365 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	34.3	Very low	43.2	Very low	238 Å²	238	142.1 Å²	142.1	100%	1.172	71%	0.71	S	S	*	*				0	122.5	0	-69.9	147.3	117.5	0	0	108.1
2	R	37	Very low	43.3	Very low	250 Å²	250	140.8 Å²	140.8	94%	0.943	71%	0.706	S	S	*	*			trans	-84.1	112	168.1	-92.2	-178.7	170.5	163.3	-3.1	107.4	M4	R2-M4 PolarHBondContact O-N 3.29Å; R2-M4 VanDerWaalsContact O-N 3.12Å
3	V	38.7	Very low	42.9	Very low	140 Å²	140	137.7 Å²	137.7	85%	0.848	69%	0.692	S	S	*	*			trans	-72.3	103.5	170.7	179.4	0	0	0	0	107	A5	V3-A5 PolarHBondContact O-N 2.9Å
4	M	41.7	Very low	43	Very low	177 Å²	177	132.6 Å²	132.6	87%	0.872	68%	0.676	S	S	*	*			trans	-82.3	95.4	176.9	-168	169.1	70.3	0	0	107.7	R2	R2-M4 PolarHBondContact O-N 3.29Å; R2-M4 VanDerWaalsContact O-N 3.12Å
5	A	44.5	Very low	43.1	Very low	52 Å²	52	126.1 Å²	126.1	43%	0.43	66%	0.655	S	S	.	*			trans	-56.5	138.8	174.3	0	0	0	0	0	109.8	V3 R7 I10	V3-A5 PolarHBondContact O-N 2.9Å; A5-R7 PolarHBondContact O-N 3.5Å; A5-I10 HydrophobicContact CB-CD1 4.48Å
6	P	42.9	Very low	43	Very low	73 Å²	73	121.3 Å²	121.3	47%	0.474	64%	0.639	S	S	.	*			trans	-59.9	130.4	180	-21.3	32.2	0	0	0	110.4	T8 L9 I10	P6-T8 PolarHBondContact O-N 3.3Å; P6-T8 VanDerWaalsContact O-N 3.13Å; P6-L9 HydrophobicContact CB-CB 4.39Å; P6-L9 WeakPolarHBondContact O-CB 3.34Å; P6-L9 PolarHBondContact O-N 3.49Å; P6-I10 PolarHBondContact O-N 2.88Å
7	R	48.3	Very low	42.5	Very low	219 Å²	219	120.8 Å²	120.8	83%	0.826	64%	0.636	S	S	*	*	H	α-helix	trans	-55.9	-30.4	177	-82.4	178	163.6	151.6	-7	112.6	A5 I10 L11	A5-R7 PolarHBondContact O-N 3.5Å; R7-I10 PolarHBondContact O-N 3.37Å; R7-L11 WeakPolarHBondContact O-CG 3.46Å; R7-L11 PolarHBondContact O-N 3.39Å; R7-L11 VanDerWaalsContact O-N 3.1Å
8	T	49	Very low	42.3	Very low	96 Å²	96	117.2 Å²	117.2	59%	0.589	63%	0.627	S	S	*	*	H	α-helix	trans	-62	-37.8	171.9	36.2	0	0	0	0	113.5	P6 L11 L12	P6-T8 PolarHBondContact O-N 3.3Å; P6-T8 VanDerWaalsContact O-N 3.13Å; T8-L11 PolarHBondContact O-N 3.29Å; T8-L12 WeakPolarHBondContact O-CG 3.5Å; T8-L12 PolarHBondContact O-N 3.02Å
9	L	42.4	Very low	42.2	Very low	100 Å²	100	115.4 Å²	115.4	52%	0.524	62%	0.617	S	S	.	*	H	α-helix	trans	-68.8	-37.5	178.7	-141.8	93.6	0	0	0	111.4	P6 L13	P6-L9 HydrophobicContact CB-CB 4.39Å; P6-L9 WeakPolarHBondContact O-CB 3.34Å; P6-L9 PolarHBondContact O-N 3.49Å; L9-L13 WeakPolarHBondContact O-CG 3.3Å; L9-L13 PolarHBondContact O-N 3.35Å; L9-L13 VanDerWaalsContact O-N 3.07Å
10	I	47.1	Very low	42	Very low	92 Å²	92	114.1 Å²	114.1	47%	0.472	61%	0.613	S	S	.	*	H	α-helix	trans	-67.7	-44	177.4	-61.8	173.6	0	0	0	110.2	A5 P6 R7 L13 S14	A5-I10 HydrophobicContact CB-CD1 4.48Å; P6-I10 PolarHBondContact O-N 2.88Å; R7-I10 PolarHBondContact O-N 3.37Å; I10-L13 PolarHBondContact O-N 2.89Å; I10-S14 PolarHBondContact O-N 3.48Å; I10-S14 PolarHBondContact O-OG 2.93Å
11	L	49.8	Very low	41.8	Very low	126 Å²	126	116.6 Å²	116.6	66%	0.66	62%	0.621	S	S	*	*	H	α-helix	trans	-63.4	-40.6	176.6	-74.3	166.7	0	0	0	112.8	R7 T8 S14 G15	R7-L11 WeakPolarHBondContact O-CG 3.46Å; R7-L11 PolarHBondContact O-N 3.39Å; R7-L11 VanDerWaalsContact O-N 3.1Å; T8-L11 PolarHBondContact O-N 3.29Å; L11-S14 PolarHBondContact O-N 3.47Å; L11-G15 PolarHBondContact O-N 3.14Å
12	L	44.7	Very low	42.2	Very low	127 Å²	127	110.4 Å²	110.4	67%	0.665	60%	0.597	S	S	*	*	H	α-helix	trans	-63.2	-40.9	174.6	-75.8	166	0	0	0	112	T8 G15 A16	T8-L12 WeakPolarHBondContact O-CG 3.5Å; T8-L12 PolarHBondContact O-N 3.02Å; L12-G15 PolarHBondContact O-N 3.22Å; L12-A16 VanDerWaalsContact O-CB 3.3Å; L12-A16 WeakPolarHBondContact O-CB 3.31Å; L12-A16 PolarHBondContact O-N 2.88Å
13	L	38.2	Very low	42.8	Very low	100 Å²	100	103.4 Å²	103.4	52%	0.524	57%	0.571	S	S	.	*	H	α-helix	trans	-66.9	-35.5	173.8	-76.5	163	0	0	0	112.5	L9 I10 L17	L9-L13 WeakPolarHBondContact O-CG 3.3Å; L9-L13 PolarHBondContact O-N 3.35Å; L9-L13 VanDerWaalsContact O-N 3.07Å; I10-L13 PolarHBondContact O-N 2.89Å; L13-L17 WeakPolarHBondContact O-CB 3.48Å; L13-L17 WeakPolarHBondContact O-CG 3.39Å; L13-L17 PolarHBondContact O-N 3.46Å
14	S	43.5	Very low	43.5	Very low	67 Å²	67	98.9 Å²	98.9	47%	0.469	55%	0.548	S	S	.	.	H	α-helix	trans	-66.4	-43.5	174.1	-58	0	0	0	0	112.2	I10 L11 L17 A18	I10-S14 PolarHBondContact O-N 3.48Å; I10-S14 PolarHBondContact O-OG 2.93Å; L11-S14 PolarHBondContact O-N 3.47Å; S14-L17 PolarHBondContact O-N 3.37Å; S14-A18 WeakPolarHBondContact O-CB 3.46Å; S14-A18 PolarHBondContact O-N 2.87Å
15	G	44.3	Very low	45	Very low	35 Å²	35	93.7 Å²	93.7	36%	0.361	53%	0.529	S	S	.	.	H	α-helix	trans	-63.9	-43.6	174.4	0	0	0	0	0	112.2	L11 L12 A18 L19	L11-G15 PolarHBondContact O-N 3.14Å; L12-G15 PolarHBondContact O-N 3.22Å; G15-A18 PolarHBondContact O-N 2.94Å; G15-L19 WeakPolarHBondContact O-CB 3.4Å; G15-L19 WeakPolarHBondContact O-CD1 3.43Å; G15-L19 VanDerWaalsContact O-CG 3.31Å; G15-L19 WeakPolarHBondContact O-CG 3.41Å; G15-L19 PolarHBondContact O-N 3.4Å
16	A	41.8	Very low	47.2	Very low	48 Å²	48	94.7 Å²	94.7	40%	0.397	53%	0.532	S	S	.	.	H	α-helix	trans	-64.9	-38.8	176.9	0	0	0	0	0	113	L12 L19 T20	L12-A16 VanDerWaalsContact O-CB 3.3Å; L12-A16 WeakPolarHBondContact O-CB 3.31Å; L12-A16 PolarHBondContact O-N 2.88Å; A16-L19 PolarHBondContact O-N 3.37Å; A16-T20 PolarHBondContact O-N 3.35Å; A16-T20 PolarHBondContact O-OG1 3.43Å
17	L	35.3	Very low	49.7	Very low	113 Å²	113	92.9 Å²	92.9	59%	0.592	52%	0.517	S	S	*	.	H	α-helix	trans	-67.9	-42.6	176.2	-79.6	164.2	0	0	0	112.1	L13 S14 L19 T20 E21	L13-L17 WeakPolarHBondContact O-CB 3.48Å; L13-L17 WeakPolarHBondContact O-CG 3.39Å; L13-L17 PolarHBondContact O-N 3.46Å; S14-L17 PolarHBondContact O-N 3.37Å; L17-L19 VanDerWaalsContact C-N 3.33Å; L17-L19 PolarHBondContact O-N 2.92Å; L17-T20 WeakPolarHBondContact CA-OG1 3.35Å; L17-T20 PolarHBondContact O-N 2.94Å; L17-T20 VanDerWaalsContact O-N 3.15Å; L17-T20 PolarHBondContact O-OG1 3.4Å; L17-E21 PolarHBondContact O-N 2.95Å
18	A	38.6	Very low	52	Low	56 Å²	56	83.6 Å²	83.6	46%	0.463	49%	0.486	S	S	.	.	H	α-helix	trans	-61.7	-40.6	172.8	0	0	0	0	0	111.9	S14 G15 T20 E21 T22	S14-A18 WeakPolarHBondContact O-CB 3.46Å; S14-A18 PolarHBondContact O-N 2.87Å; G15-A18 PolarHBondContact O-N 2.94Å; A18-T20 VanDerWaalsContact C-N 3.34Å; A18-T20 PolarHBondContact O-N 3.29Å; A18-E21 PolarHBondContact O-N 2.92Å; A18-T22 PolarHBondContact O-N 3.47Å; A18-T22 PolarHBondContact O-OG1 2.88Å
19	L	40	Very low	54.4	Low	83 Å²	83	79 Å²	79	44%	0.435	46%	0.458	S	S	.	.	H	α-helix	trans	-61.9	-36.9	172.4	-79.7	161.4	0	0	0	112.3	G15 A16 L17 T22	G15-L19 WeakPolarHBondContact O-CB 3.4Å; G15-L19 WeakPolarHBondContact O-CD1 3.43Å; G15-L19 VanDerWaalsContact O-CG 3.31Å; G15-L19 WeakPolarHBondContact O-CG 3.41Å; G15-L19 PolarHBondContact O-N 3.4Å; A16-L19 PolarHBondContact O-N 3.37Å; L17-L19 VanDerWaalsContact C-N 3.33Å; L17-L19 PolarHBondContact O-N 2.92Å; L19-T22 PolarHBondContact O-OG1 2.93Å; L19-T22 VanDerWaalsContact O-OG1 3.09Å
20	T	38	Very low	57	Low	90 Å²	90	76.5 Å²	76.5	55%	0.552	44%	0.442	S	S	*	.	H	α-helix	trans	-74.8	-29.7	176.9	50.2	0	0	0	0	114	A16 L17 A18 W23	A16-T20 PolarHBondContact O-N 3.35Å; A16-T20 PolarHBondContact O-OG1 3.43Å; L17-T20 WeakPolarHBondContact CA-OG1 3.35Å; L17-T20 PolarHBondContact O-N 2.94Å; L17-T20 VanDerWaalsContact O-N 3.15Å; L17-T20 PolarHBondContact O-OG1 3.4Å; A18-T20 VanDerWaalsContact C-N 3.34Å; A18-T20 PolarHBondContact O-N 3.29Å; T20-W23 PolarHBondContact O-N 3.35Å
21	E	37.8	Very low	59.5	Low	166 Å²	166	72.5 Å²	72.5	78%	0.776	42%	0.42	S	S	*	.	H	α-helix	trans	-72.6	-32.6	175.5	-81.7	-171.5	144.2	0	0	112.5	L17 A18 W23	L17-E21 PolarHBondContact O-N 2.95Å; A18-E21 PolarHBondContact O-N 2.92Å; E21-W23 PolarHBondContact O-N 2.92Å
22	T	42.5	Very low	61.8	Low	109 Å²	109	70.5 Å²	70.5	67%	0.669	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-4.3	176.1	53.2	0	0	0	0	114.4	A18 L19	A18-T22 PolarHBondContact O-N 3.47Å; A18-T22 PolarHBondContact O-OG1 2.88Å; L19-T22 PolarHBondContact O-OG1 2.93Å; L19-T22 VanDerWaalsContact O-OG1 3.09Å
23	W	50.1	Low	64.4	Low	102 Å²	102	64.6 Å²	64.6	39%	0.386	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.1	2.3	-175.2	-85.8	65.9	0	0	0	114.3	T20 E21 C25 H287 E288 L290	T20-W23 PolarHBondContact O-N 3.35Å; E21-W23 PolarHBondContact O-N 2.92Å; W23-C25 PolarHBondContact O-N 2.92Å; W23-H287 VanDerWaalsContact CH2-O 3.23Å; W23-H287 WeakPolarHBondContact CH2-O 3.47Å; W23-H287 VanDerWaalsContact CZ2-O 3.31Å; W23-H287 WeakPolarHBondContact CZ2-O 3.34Å; W23-E288 VanDerWaalsContact CH2-C 3.43Å; W23-E288 VanDerWaalsContact CH2-CA 3.47Å; W23-E288 WeakPolarHBondContact CH2-O 3.35Å; W23-E288 WeakPolarHBondContact CZ3-O 3.41Å; W23-L290 WeakPolarHBondContact CH2-O 3.42Å; W23-L290 WeakPolarHBondContact CZ2-O 3.19Å
24	A	54.4	Low	67.3	Low	45 Å²	45	61.8 Å²	61.8	37%	0.372	36%	0.363	S	S	.	.	S	Bend	trans	-86.7	103.5	177.7	0	0	0	0	0	108.9	S26 P129	A24-S26 PolarHBondContact O-N 3.41Å; A24-P129 HydrophobicContact CB-CB 3.99Å; A24-P129 HydrophobicContact CB-CG 3.27Å
25	C	72	Confident	69.9	Low	69 Å²	69	58.7 Å²	58.7	47%	0.466	34%	0.341	S	S	.	.			trans	-49.9	103.4	-172.4	-61.8	0	0	0	0	112.8	W23	W23-C25 PolarHBondContact O-N 2.92Å
26	S	90.4	Very high	72.5	Confident	73 Å²	73	59 Å²	59	51%	0.51	34%	0.336	S	S	.	.			trans	-89.4	144.5	166.2	56.7	0	0	0	0	109.6	A24 L127	A24-S26 PolarHBondContact O-N 3.41Å; S26-L127 VanDerWaalsContact CA-O 3.24Å; S26-L127 WeakPolarHBondContact CA-O 3.42Å; S26-L127 WeakPolarHBondContact CB-O 3.23Å
27	H	95.2	Very high	75.2	Confident	34 Å²	34	57.5 Å²	57.5	16%	0.157	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	149.6	177.1	-69.4	-74.2	0	0	0	110.8	D53 D126 L127 L192 L196	H27-D53 VanDerWaalsContact CA-OD1 3.23Å; H27-D53 WeakPolarHBondContact CA-OD1 3.39Å; H27-D53 IonicContact CE1-OD2 2.84Å; H27-D53 IonicContact CG-OD2 2.76Å; H27-D53 IonicContact ND1-OD1 3.51Å; H27-D53 IonicContact ND1-OD2 3.57Å; H27-D53 PolarHBondContact ND1-OD2 2.71Å; H27-D126 CarbonylContact O-C 3.55Å; H27-D126 WeakPolarHBondContact O-CA 3.38Å; H27-L127 PolarHBondContact N-O 2.85Å; H27-L127 PolarHBondContact O-N 3.03Å; H27-L192 HydrophobicContact CB-CD1 4.43Å; H27-L196 HydrophobicContact CB-CD1 3.65Å; H27-L196 HydrophobicContact CB-CD2 3.93Å; H27-L196 HydrophobicContact CB-CG 4.38Å; H27-L196 VanDerWaalsContact CG-CD2 3.49Å; H27-L196 WeakPolarHBondContact ND1-CD2 3.38Å
28	S	97.4	Very high	78	Confident	24 Å²	24	55.8 Å²	55.8	17%	0.168	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	151.2	-178.9	65.9	0	0	0	0	112	V52 D53 C125 D126	S28-V52 CarbonylContact O-C 3.59Å; S28-V52 VanDerWaalsContact O-CA 3.3Å; S28-V52 WeakPolarHBondContact O-CA 3.48Å; S28-D53 PolarHBondContact N-OD1 2.95Å; S28-D53 PolarHBondContact O-N 3.14Å; S28-C125 CarbonylContact C-O 3.58Å; S28-C125 WeakPolarHBondContact CA-O 3.38Å; S28-D126 WeakPolarHBondContact CB-OD1 3.48Å
29	M	98.6	Very high	80.5	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.005	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	118.7	166.2	-178.5	175.1	60	0	0	108.1	Y31 Y51 V52 F57 G124 C125 C188 W191 L192 Y195	M29-Y31 HydrophobicContact CE-CE2 4.2Å; M29-Y31 HydrophobicContact CG-CE2 3.98Å; M29-Y31 HydrophobicContact SD-CE2 3.91Å; M29-Y51 WeakPolarHBondContact CA-O 3.02Å; M29-V52 HydrophobicContact CB-CG2 4.45Å; M29-V52 HydrophobicContact CG-CG2 4.27Å; M29-F57 HydrophobicContact CG-CE1 4.4Å; M29-F57 HydrophobicContact SD-CZ 4.29Å; M29-G124 CarbonylContact O-C 3.54Å; M29-G124 WeakPolarHBondContact O-CA 3.4Å; M29-C125 PolarHBondContact N-O 2.78Å; M29-C125 PolarHBondContact O-N 2.76Å; M29-C188 HydrophobicContact CE-CB 4.18Å; M29-C188 VanDerWaalsContact CE-O 3.23Å; M29-C188 WeakPolarHBondContact CE-O 3.38Å; M29-C188 WeakPolarHBondContact CE-SG 3.35Å; M29-W191 HydrophobicContact CE-CB 4.09Å; M29-W191 HydrophobicContact SD-CB 4.38Å; M29-L192 HydrophobicContact CB-CB 4.01Å; M29-L192 HydrophobicContact CB-CD1 4.04Å; M29-L192 HydrophobicContact CB-CD2 3.92Å; M29-L192 HydrophobicContact CB-CG 4.21Å; M29-L192 HydrophobicContact CE-CB 4.31Å; M29-L192 HydrophobicContact SD-CB 4.5Å; M29-Y195 HydrophobicContact SD-CD2 3.76Å; M29-Y195 HydrophobicContact SD-CE2 3.53Å; M29-Y195 VanDerWaalsContact SD-CE2 3.53Å
30	R	98.6	Very high	82.9	Confident	47 Å²	47	56 Å²	56	18%	0.177	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	136.1	-176.5	-53.8	-60.6	-174.8	76	5.4	110.1	F32 G50 Y51 M122 D126 Y137	R30-F32 HydrophobicContact CB-CD2 4.44Å; R30-F32 HydrophobicContact CB-CE2 3.63Å; R30-F32 HydrophobicContact CB-CZ 3.94Å; R30-G50 WeakPolarHBondContact O-CA 3.26Å; R30-Y51 PolarHBondContact N-O 3.33Å; R30-Y51 PolarHBondContact O-N 2.94Å; R30-M122 HydrophobicContact CB-SD 4.48Å; R30-D126 IonicContact CZ-OD1 2.78Å; R30-D126 VanDerWaalsContact CZ-OD1 3.27Å; R30-D126 IonicContact CZ-OD2 3.62Å; R30-D126 IonicContact NE-OD1 2.67Å; R30-D126 PolarHBondContact NE-OD1 3.15Å; R30-D126 IonicContact NH2-OD1 3.21Å; R30-D126 PolarHBondContact NH2-OD1 3.2Å; R30-D126 IonicContact NH2-OD2 3.38Å; R30-D126 PolarHBondContact NH2-OD2 3.24Å; R30-Y137 VanDerWaalsContact NH2-CZ 3.31Å; R30-Y137 PolarHBondContact NH2-OH 3.04Å
31	Y	98.8	Very high	85.5	Confident	7 Å²	7	62.3 Å²	62.3	3%	0.027	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	140.9	168.5	-68	-97.7	0	0	0	108.8	M29 V49 F57 V58 M122 Y123	M29-Y31 HydrophobicContact CE-CE2 4.2Å; M29-Y31 HydrophobicContact CG-CE2 3.98Å; M29-Y31 HydrophobicContact SD-CE2 3.91Å; Y31-V49 WeakPolarHBondContact CA-O 3.45Å; Y31-F57 HydrophobicContact CE1-CZ 4.16Å; Y31-F57 AromaticContact CZ-CZ 3.84Å; Y31-F57 WeakPolarHBondContact OH-CZ 3.4Å; Y31-V58 HydrophobicContact CE1-CG2 4.06Å; Y31-M122 WeakPolarHBondContact O-CA 3.39Å; Y31-Y123 HydrophobicContact CD2-CD2 4.14Å; Y31-Y123 AromaticContact CD2-CE2 3.4Å; Y31-Y123 HydrophobicContact CD2-CE2 3.4Å; Y31-Y123 AromaticContact CD2-CZ 3.83Å; Y31-Y123 HydrophobicContact CE2-CE2 4.17Å; Y31-Y123 HydrophobicContact CG-CE1 4.41Å; Y31-Y123 AromaticContact CG-CE2 3.71Å; Y31-Y123 HydrophobicContact CG-CE2 3.71Å; Y31-Y123 AromaticContact CG-CZ 3.62Å; Y31-Y123 PolarHBondContact N-O 3Å; Y31-Y123 PolarHBondContact O-N 3.06Å
32	F	98.8	Very high	88	Confident	85 Å²	85	57.1 Å²	57.1	37%	0.373	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	111.9	177.4	-56.5	-97.2	0	0	0	108.7	R30 S48 V49 Y51 W121 M122	R30-F32 HydrophobicContact CB-CD2 4.44Å; R30-F32 HydrophobicContact CB-CE2 3.63Å; R30-F32 HydrophobicContact CB-CZ 3.94Å; F32-S48 WeakPolarHBondContact O-CA 3.34Å; F32-V49 HydrophobicContact CB-CG2 3.88Å; F32-V49 HydrophobicContact CD2-CG2 4.37Å; F32-V49 PolarHBondContact N-O 3.39Å; F32-V49 PolarHBondContact O-N 3Å; F32-Y51 HydrophobicContact CD2-CD2 4.17Å; F32-Y51 HydrophobicContact CE2-CD2 4.19Å; F32-W121 WeakPolarHBondContact CA-O 3.45Å; F32-M122 HydrophobicContact CD1-CB 4.07Å; F32-M122 HydrophobicContact CD1-CG 3.53Å; F32-M122 HydrophobicContact CE1-CB 4.28Å; F32-M122 HydrophobicContact CE1-CG 3.35Å; F32-M122 HydrophobicContact CG-CG 4.34Å; F32-M122 HydrophobicContact CZ-CG 4.02Å
33	D	98.8	Very high	90.5	Very high	3 Å²	3	56.6 Å²	56.6	2%	0.016	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	141.9	177.9	-72.1	0.7	0	0	0	109.2	F46 I47 S48 Q94 Q120 W121	D33-F46 HydrophobicContact CB-CE2 3.83Å; D33-F46 HydrophobicContact CB-CZ 4.01Å; D33-F46 WeakPolarHBondContact OD2-CZ 3.26Å; D33-I47 CarbonylContact C-O 3.5Å; D33-I47 WeakPolarHBondContact CA-O 3.42Å; D33-S48 WeakPolarHBondContact OD1-CB 3.34Å; D33-S48 PolarHBondContact OD1-OG 3.33Å; D33-Q94 WeakPolarHBondContact OD2-CG 3.4Å; D33-Q120 WeakPolarHBondContact O-CA 3.14Å; D33-W121 HydrophobicContact CB-CB 4.26Å; D33-W121 HydrophobicContact CB-CE3 4.3Å; D33-W121 PolarHBondContact N-O 2.9Å; D33-W121 PolarHBondContact O-N 2.94Å
34	T	98.9	Very high	92.7	Very high	41 Å²	41	53 Å²	53	25%	0.252	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	117.6	179.5	-64.6	0	0	0	0	110.2	V36 F46 I47 T118 L119 Q120	T34-V36 HydrophobicContact CG2-CG2 4.04Å; T34-F46 WeakPolarHBondContact O-CA 3.38Å; T34-I47 PolarHBondContact N-O 3.41Å; T34-I47 PolarHBondContact O-N 3.31Å; T34-T118 HydrophobicContact CG2-CG2 4.05Å; T34-L119 WeakPolarHBondContact CA-O 3.31Å; T34-Q120 HydrophobicContact CG2-CG 4.2Å
35	A	98.7	Very high	94.8	Very high	2 Å²	2	53.9 Å²	53.9	2%	0.017	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	120.3	176.2	0	0	0	0	0	110.5	R45 F46 D98 L102 T118 L119	A35-R45 CarbonylContact C-O 3.52Å; A35-R45 VanDerWaalsContact CA-O 3.29Å; A35-R45 WeakPolarHBondContact CA-O 3.35Å; A35-F46 HydrophobicContact CB-CD2 4.32Å; A35-D98 HydrophobicContact CB-CB 3.63Å; A35-L102 HydrophobicContact CB-CD1 3.88Å; A35-T118 WeakPolarHBondContact O-CA 2.92Å; A35-L119 HydrophobicContact CB-CB 4.48Å; A35-L119 PolarHBondContact N-O 3.23Å; A35-L119 PolarHBondContact O-N 3.23Å
36	V	98.5	Very high	96.1	Very high	40 Å²	40	50.8 Å²	50.8	24%	0.242	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	114.7	-179.2	-173.7	0	0	0	0	109.5	T34 P44 R45 H117 T118	T34-V36 HydrophobicContact CG2-CG2 4.04Å; V36-P44 CarbonylContact O-C 3.57Å; V36-P44 WeakPolarHBondContact O-CA 3.49Å; V36-P44 WeakPolarHBondContact O-CB 3.46Å; V36-R45 PolarHBondContact N-O 3.03Å; V36-R45 PolarHBondContact O-N 3.36Å; V36-H117 CarbonylContact C-O 3.55Å; V36-H117 WeakPolarHBondContact CA-O 3.4Å; V36-T118 HydrophobicContact CG2-CG2 4.19Å
37	S	97.5	Very high	96.5	Very high	18 Å²	18	49.5 Å²	49.5	13%	0.126	27%	0.271	C	S	.	.			trans	-68.2	148.7	174.5	79.4	0	0	0	0	111.2	G115 S116 H117	S37-G115 PolarHBondContact OG-O 3.12Å; S37-S116 PolarHBondContact O-OG 3.41Å; S37-S116 VanDerWaalsContact O-OG 3.06Å; S37-H117 PolarHBondContact N-O 3.48Å; S37-H117 PolarHBondContact OG-N 2.85Å; S37-H117 PolarHBondContact OG-O 2.83Å
38	R	95.4	Very high	96.6	Very high	76 Å²	76	47.9 Å²	47.9	29%	0.287	26%	0.263	S	S	.	.			trans	-140.8	73.4	-174.2	-63.1	174.6	172.7	-178.1	-8.1	111.5	G40 R41 R45 D63	R38-G40 PolarHBondContact O-N 3.45Å; R38-R41 HydrophobicContact CB-CB 4.13Å; R38-R41 PolarHBondContact O-N 3.3Å; R38-R45 VanDerWaalsContact CZ-CB 3.42Å; R38-D63 IonicContact CZ-OD2 3.61Å; R38-D63 IonicContact NH1-OD1 3.12Å; R38-D63 IonicContact NH1-OD2 3.6Å; R38-D63 PolarHBondContact NH1-OD2 3Å; R38-D63 IonicContact NH2-OD2 3.55Å
39	P	91.1	Very high	96.7	Very high	51 Å²	51	48 Å²	48	33%	0.331	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.4	131.9	-179.6	-28	36.7	0	0	0	112.2	R41 E113 G115	P39-R41 PolarHBondContact O-N 3.34Å; P39-R41 VanDerWaalsContact O-N 3.16Å; P39-E113 WeakPolarHBondContact CB-O 3.12Å; P39-E113 WeakPolarHBondContact CG-O 3.49Å; P39-G115 VanDerWaalsContact CG-O 3.22Å; P39-G115 WeakPolarHBondContact CG-O 3.37Å
40	G	90.1	Very high	96.7	Very high	92 Å²	92	47.9 Å²	47.9	95%	0.948	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.2	1.1	-177.5	0	0	0	0	0	116.7	R38	R38-G40 PolarHBondContact O-N 3.45Å
41	R	92.1	Very high	96.7	Very high	223 Å²	223	49 Å²	49	84%	0.842	27%	0.267	S	S	*	.	S	Bend	trans	-123.8	22.8	-177.6	-57.3	-175.9	-178.5	-169.8	0.8	114.2	R38 P39	R38-R41 HydrophobicContact CB-CB 4.13Å; R38-R41 PolarHBondContact O-N 3.3Å; P39-R41 PolarHBondContact O-N 3.34Å; P39-R41 VanDerWaalsContact O-N 3.16Å
42	G	90.7	Very high	96.7	Very high	58 Å²	58	48.7 Å²	48.7	60%	0.598	27%	0.266	S	S	*	.	S	Bend	trans	101	-153.7	178.3	0	0	0	0	0	113.2
43	E	94	Very high	96.5	Very high	97 Å²	97	45.9 Å²	45.9	45%	0.453	26%	0.255	S	S	.	.	S	Bend	trans	-78.5	161.3	-179.8	-64.8	-59.1	169.6	0	0	112.3	R45 R99 R103	E43-R45 PolarHBondContact O-N 2.94Å; E43-R99 VanDerWaalsContact CD-NH2 3.28Å; E43-R99 IonicContact OE1-CZ 3.86Å; E43-R99 IonicContact OE1-NE 3.54Å; E43-R99 PolarHBondContact OE1-NE 2.61Å; E43-R99 IonicContact OE1-NH2 3.66Å; E43-R99 PolarHBondContact OE1-NH2 2.89Å; E43-R99 IonicContact OE2-CZ 3.46Å; E43-R99 IonicContact OE2-NE 2.76Å; E43-R99 PolarHBondContact OE2-NE 3.44Å; E43-R99 IonicContact OE2-NH2 3.63Å; E43-R99 PolarHBondContact OE2-NH2 2.96Å; E43-R103 IonicContact OE2-NH2 3.85Å
44	P	96.9	Very high	96.4	Very high	27 Å²	27	48.7 Å²	48.7	18%	0.175	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-56.3	133.2	170.9	-23.7	34.6	0	0	0	111.1	V36 R99 L102	V36-P44 CarbonylContact O-C 3.57Å; V36-P44 WeakPolarHBondContact O-CA 3.49Å; V36-P44 WeakPolarHBondContact O-CB 3.46Å; P44-R99 HydrophobicContact CG-CB 4.38Å; P44-R99 HydrophobicContact CG-CG 4.26Å; P44-L102 HydrophobicContact CB-CD1 3.66Å; P44-L102 HydrophobicContact CG-CD1 3.83Å
45	R	98.3	Very high	96.3	Very high	64 Å²	64	47.9 Å²	47.9	24%	0.242	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	132.3	170.1	178.9	-173.5	-165.6	156.8	-21.4	108.7	A35 V36 R38 E43 I47 D61 S62 D63	A35-R45 CarbonylContact C-O 3.52Å; A35-R45 VanDerWaalsContact CA-O 3.29Å; A35-R45 WeakPolarHBondContact CA-O 3.35Å; V36-R45 PolarHBondContact N-O 3.03Å; V36-R45 PolarHBondContact O-N 3.36Å; R38-R45 VanDerWaalsContact CZ-CB 3.42Å; E43-R45 PolarHBondContact O-N 2.94Å; R45-I47 HydrophobicContact CG-CG1 4.13Å; R45-D61 IonicContact CZ-OD1 2.65Å; R45-D61 VanDerWaalsContact CZ-OD1 3.29Å; R45-D61 IonicContact CZ-OD2 2.77Å; R45-D61 IonicContact NE-OD1 3.47Å; R45-D61 PolarHBondContact NE-OD1 2.92Å; R45-D61 IonicContact NE-OD2 3.71Å; R45-D61 VanDerWaalsContact NH2-CG 3.34Å; R45-D61 IonicContact NH2-OD1 2.78Å; R45-D61 PolarHBondContact NH2-OD1 2.8Å; R45-D61 IonicContact NH2-OD2 3.75Å; R45-D61 PolarHBondContact NH2-OD2 3.42Å; R45-S62 WeakPolarHBondContact CA-OG 3.32Å; R45-S62 WeakPolarHBondContact CG-OG 3.37Å; R45-D63 WeakPolarHBondContact CD-OD2 3.39Å; R45-D63 HydrophobicContact CG-CB 4.44Å; R45-D63 WeakPolarHBondContact CG-OD1 3.37Å; R45-D63 IonicContact CZ-OD2 2.68Å; R45-D63 IonicContact NE-OD2 3.7Å; R45-D63 PolarHBondContact NE-OD2 2.69Å; R45-D63 IonicContact NH1-OD2 3.46Å; R45-D63 PolarHBondContact NH1-OD2 2.95Å
46	F	98.7	Very high	96.2	Very high	3 Å²	3	50.3 Å²	50.3	1%	0.013	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	126.9	172.5	176.8	-93	0	0	0	109.6	D33 T34 A35 F60 S62 Y91 Q94 A95 D98	D33-F46 HydrophobicContact CB-CE2 3.83Å; D33-F46 HydrophobicContact CB-CZ 4.01Å; D33-F46 WeakPolarHBondContact OD2-CZ 3.26Å; T34-F46 WeakPolarHBondContact O-CA 3.38Å; A35-F46 HydrophobicContact CB-CD2 4.32Å; F46-F60 AromaticContact CD1-CD1 3.69Å; F46-F60 HydrophobicContact CD1-CD1 3.69Å; F46-F60 AromaticContact CD1-CE1 3.83Å; F46-F60 HydrophobicContact CD1-CE1 3.83Å; F46-F60 AromaticContact CE1-CD1 3.94Å; F46-F60 HydrophobicContact CE1-CD1 3.94Å; F46-F60 HydrophobicContact CE1-CE1 4.36Å; F46-S62 PolarHBondContact N-OG 3.43Å; F46-S62 PolarHBondContact O-N 2.89Å; F46-S62 PolarHBondContact O-OG 2.88Å; F46-Y91 HydrophobicContact CE1-CD1 4.46Å; F46-Q94 HydrophobicContact CE2-CB 4.18Å; F46-Q94 HydrophobicContact CE2-CG 3.67Å; F46-Q94 HydrophobicContact CZ-CB 3.9Å; F46-Q94 HydrophobicContact CZ-CG 3.72Å; F46-A95 HydrophobicContact CB-CB 3.61Å; F46-A95 HydrophobicContact CD1-CB 3.79Å; F46-A95 HydrophobicContact CD2-CB 4.19Å; F46-A95 HydrophobicContact CG-CB 3.6Å; F46-D98 WeakPolarHBondContact CE2-OD2 3.45Å
47	I	98.8	Very high	96.2	Very high	46 Å²	46	48.4 Å²	48.4	24%	0.236	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	134.6	171.2	-57.2	176.5	0	0	0	107	D33 T34 R45 V49 F60	D33-I47 CarbonylContact C-O 3.5Å; D33-I47 WeakPolarHBondContact CA-O 3.42Å; T34-I47 PolarHBondContact N-O 3.41Å; T34-I47 PolarHBondContact O-N 3.31Å; R45-I47 HydrophobicContact CG-CG1 4.13Å; I47-V49 HydrophobicContact CG2-CG1 4.37Å; I47-F60 WeakPolarHBondContact CA-O 3.13Å
48	S	98.8	Very high	96.3	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	139.3	168.6	-179.5	0	0	0	0	109.3	F32 D33 R59 F60 Y91	F32-S48 WeakPolarHBondContact O-CA 3.34Å; D33-S48 WeakPolarHBondContact OD1-CB 3.34Å; D33-S48 PolarHBondContact OD1-OG 3.33Å; S48-R59 CarbonylContact O-C 3.6Å; S48-R59 WeakPolarHBondContact O-CA 3.5Å; S48-F60 PolarHBondContact N-O 2.95Å; S48-F60 PolarHBondContact O-N 3.01Å; S48-Y91 WeakPolarHBondContact OG-CE1 3.45Å
49	V	98.8	Very high	96.4	Very high	26 Å²	26	47.3 Å²	47.3	16%	0.158	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	139.3	171.3	-63.6	0	0	0	0	110.1	Y31 F32 I47 Y51 Q56 V58 R59	Y31-V49 WeakPolarHBondContact CA-O 3.45Å; F32-V49 HydrophobicContact CB-CG2 3.88Å; F32-V49 HydrophobicContact CD2-CG2 4.37Å; F32-V49 PolarHBondContact N-O 3.39Å; F32-V49 PolarHBondContact O-N 3Å; I47-V49 HydrophobicContact CG2-CG1 4.37Å; V49-Y51 HydrophobicContact CB-CE2 4.1Å; V49-Y51 HydrophobicContact CG2-CD2 4.36Å; V49-Y51 HydrophobicContact CG2-CE2 3.84Å; V49-Q56 VanDerWaalsContact CG1-NE2 3.27Å; V49-V58 WeakPolarHBondContact CA-O 3.42Å; V49-R59 HydrophobicContact CG1-CG 4.27Å
50	G	98.6	Very high	96.8	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	137.2	177.2	0	0	0	0	0	111	R30 F57 V58	R30-G50 WeakPolarHBondContact O-CA 3.26Å; G50-F57 WeakPolarHBondContact O-CD1 3.41Å; G50-F57 PolarHBondContact O-N 3.22Å; G50-V58 PolarHBondContact N-O 3.45Å; G50-V58 PolarHBondContact O-N 2.89Å
51	Y	98.6	Very high	97.2	Very high	70 Å²	70	41.5 Å²	41.5	28%	0.275	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	142.5	180	-77.1	-103.3	0	0	0	110.6	M29 R30 F32 V49 T55 Q56	M29-Y51 WeakPolarHBondContact CA-O 3.02Å; R30-Y51 PolarHBondContact N-O 3.33Å; R30-Y51 PolarHBondContact O-N 2.94Å; F32-Y51 HydrophobicContact CD2-CD2 4.17Å; F32-Y51 HydrophobicContact CE2-CD2 4.19Å; V49-Y51 HydrophobicContact CB-CE2 4.1Å; V49-Y51 HydrophobicContact CG2-CD2 4.36Å; V49-Y51 HydrophobicContact CG2-CE2 3.84Å; Y51-T55 WeakPolarHBondContact CA-O 3.39Å; Y51-Q56 HydrophobicContact CD1-CB 4.08Å; Y51-Q56 HydrophobicContact CD2-CG 4.31Å; Y51-Q56 HydrophobicContact CE1-CB 3.6Å; Y51-Q56 HydrophobicContact CE1-CG 4.31Å; Y51-Q56 HydrophobicContact CE2-CB 4.07Å; Y51-Q56 HydrophobicContact CE2-CG 3.84Å; Y51-Q56 HydrophobicContact CG-CB 4.49Å
52	V	98.3	Very high	97.5	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	119	157.3	175.8	0	0	0	0	106	S28 M29 D54 T55 F57 W75 L192 Y195 L196 L203	S28-V52 CarbonylContact O-C 3.59Å; S28-V52 VanDerWaalsContact O-CA 3.3Å; S28-V52 WeakPolarHBondContact O-CA 3.48Å; M29-V52 HydrophobicContact CB-CG2 4.45Å; M29-V52 HydrophobicContact CG-CG2 4.27Å; V52-D54 PolarHBondContact O-N 3.1Å; V52-T55 PolarHBondContact N-O 3.15Å; V52-T55 WeakPolarHBondContact O-CB 3.39Å; V52-T55 PolarHBondContact O-N 3.18Å; V52-F57 HydrophobicContact CG2-CD1 3.94Å; V52-F57 HydrophobicContact CG2-CE1 3.93Å; V52-W75 HydrophobicContact CB-CH2 4.23Å; V52-W75 HydrophobicContact CB-CZ2 4.34Å; V52-W75 HydrophobicContact CG2-CH2 3.83Å; V52-W75 HydrophobicContact CG2-CZ2 4.43Å; V52-L192 HydrophobicContact CG1-CD1 3.58Å; V52-L192 HydrophobicContact CG2-CD1 4.27Å; V52-Y195 HydrophobicContact CG2-CD2 3.87Å; V52-Y195 HydrophobicContact CG2-CG 4.41Å; V52-L196 HydrophobicContact CG1-CD2 4.13Å; V52-L203 HydrophobicContact CB-CD1 4.28Å; V52-L203 HydrophobicContact CB-CD2 4.22Å; V52-L203 HydrophobicContact CG1-CD1 3.82Å; V52-L203 HydrophobicContact CG1-CD2 4.11Å; V52-L203 HydrophobicContact CG1-CG 4.48Å
53	D	95.8	Very high	97.8	Very high	26 Å²	26	33.6 Å²	33.6	14%	0.139	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.2	-131.2	-164.7	-50.4	-42.8	0	0	0	110.1	H27 S28 T55	H27-D53 VanDerWaalsContact CA-OD1 3.23Å; H27-D53 WeakPolarHBondContact CA-OD1 3.39Å; H27-D53 IonicContact CE1-OD2 2.84Å; H27-D53 IonicContact CG-OD2 2.76Å; H27-D53 IonicContact ND1-OD1 3.51Å; H27-D53 IonicContact ND1-OD2 3.57Å; H27-D53 PolarHBondContact ND1-OD2 2.71Å; S28-D53 PolarHBondContact N-OD1 2.95Å; S28-D53 PolarHBondContact O-N 3.14Å; D53-T55 VanDerWaalsContact C-N 3.28Å; D53-T55 PolarHBondContact O-N 3.14Å
54	D	95.8	Very high	97.9	Very high	63 Å²	63	30.7 Å²	30.7	34%	0.337	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	2.6	177.3	-62.4	-60.2	0	0	0	114.2	V52 Y233 P234 A235 F265	V52-D54 PolarHBondContact O-N 3.1Å; D54-Y233 HydrophobicContact CB-CE2 4Å; D54-P234 VanDerWaalsContact OD2-CB 3.22Å; D54-P234 WeakPolarHBondContact OD2-CB 3.44Å; D54-A235 HydrophobicContact CB-CB 4.36Å; D54-A235 VanDerWaalsContact CG-CB 3.48Å; D54-A235 WeakPolarHBondContact OD1-CB 3.24Å; D54-A235 WeakPolarHBondContact OD2-CB 3.42Å; D54-A235 PolarHBondContact OD2-N 3.42Å; D54-F265 HydrophobicContact CB-CE2 3.71Å; D54-F265 HydrophobicContact CB-CZ 3.72Å
55	T	96.7	Very high	97.9	Very high	24 Å²	24	35 Å²	35	15%	0.147	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	111.6	-176.6	-63.3	0	0	0	0	111.9	Y51 V52 D53 F57 A73 W75 L203 Y233	Y51-T55 WeakPolarHBondContact CA-O 3.39Å; V52-T55 PolarHBondContact N-O 3.15Å; V52-T55 WeakPolarHBondContact O-CB 3.39Å; V52-T55 PolarHBondContact O-N 3.18Å; D53-T55 VanDerWaalsContact C-N 3.28Å; D53-T55 PolarHBondContact O-N 3.14Å; T55-F57 PolarHBondContact O-N 3.48Å; T55-A73 HydrophobicContact CG2-CB 4.27Å; T55-W75 HydrophobicContact CG2-CZ2 4.36Å; T55-L203 HydrophobicContact CG2-CD2 4.05Å; T55-Y233 WeakPolarHBondContact OG1-CE2 3.45Å; T55-Y233 PolarHBondContact OG1-OH 2.79Å
56	Q	97.7	Very high	97.8	Very high	52 Å²	52	35.9 Å²	35.9	24%	0.243	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	127.2	170.8	-165.8	-177	2.8	0	0	110.5	V49 Y51 V58 R72	V49-Q56 VanDerWaalsContact CG1-NE2 3.27Å; Y51-Q56 HydrophobicContact CD1-CB 4.08Å; Y51-Q56 HydrophobicContact CD2-CG 4.31Å; Y51-Q56 HydrophobicContact CE1-CB 3.6Å; Y51-Q56 HydrophobicContact CE1-CG 4.31Å; Y51-Q56 HydrophobicContact CE2-CB 4.07Å; Y51-Q56 HydrophobicContact CE2-CG 3.84Å; Y51-Q56 HydrophobicContact CG-CB 4.49Å; Q56-V58 PolarHBondContact NE2-O 3.08Å; Q56-R72 HydrophobicContact CB-CB 4.49Å; Q56-R72 HydrophobicContact CG-CB 4.12Å; Q56-R72 HydrophobicContact CG-CG 4.38Å; Q56-R72 CarbonylContact O-C 3.55Å
57	F	98.1	Very high	97.7	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	-23.6	179.8	76.9	-82.7	0	0	0	114.5	M29 Y31 G50 V52 T55 R72 A73 W75 V76 Y195	M29-F57 HydrophobicContact CG-CE1 4.4Å; M29-F57 HydrophobicContact SD-CZ 4.29Å; Y31-F57 HydrophobicContact CE1-CZ 4.16Å; Y31-F57 AromaticContact CZ-CZ 3.84Å; Y31-F57 WeakPolarHBondContact OH-CZ 3.4Å; G50-F57 WeakPolarHBondContact O-CD1 3.41Å; G50-F57 PolarHBondContact O-N 3.22Å; V52-F57 HydrophobicContact CG2-CD1 3.94Å; V52-F57 HydrophobicContact CG2-CE1 3.93Å; T55-F57 PolarHBondContact O-N 3.48Å; F57-R72 PolarHBondContact O-N 2.91Å; F57-A73 HydrophobicContact CB-CB 4.08Å; F57-W75 HydrophobicContact CB-CH2 3.15Å; F57-W75 HydrophobicContact CB-CZ2 3.41Å; F57-W75 VanDerWaalsContact CB-CZ2 3.41Å; F57-W75 HydrophobicContact CB-CZ3 3.88Å; F57-W75 AromaticContact CD1-CH2 3.98Å; F57-W75 HydrophobicContact CD1-CH2 3.98Å; F57-W75 AromaticContact CD2-CH2 3.81Å; F57-W75 HydrophobicContact CD2-CH2 3.81Å; F57-W75 AromaticContact CD2-CZ3 3.98Å; F57-W75 HydrophobicContact CD2-CZ3 3.98Å; F57-W75 AromaticContact CG-CH2 3.39Å; F57-W75 HydrophobicContact CG-CH2 3.39Å; F57-W75 HydrophobicContact CG-CZ2 4.13Å; F57-W75 HydrophobicContact CG-CZ3 4.04Å; F57-V76 HydrophobicContact CB-CG1 4.35Å; F57-V76 HydrophobicContact CD2-CB 4.34Å; F57-V76 HydrophobicContact CD2-CG1 4.38Å; F57-V76 HydrophobicContact CD2-CG2 4.16Å; F57-V76 VanDerWaalsContact O-CG1 3.26Å; F57-V76 WeakPolarHBondContact O-CG1 3.25Å; F57-Y195 HydrophobicContact CD2-CE2 4.38Å; F57-Y195 HydrophobicContact CE2-CD2 4.22Å; F57-Y195 HydrophobicContact CE2-CE1 4.45Å; F57-Y195 AromaticContact CE2-CE2 3.54Å; F57-Y195 HydrophobicContact CE2-CE2 3.54Å; F57-Y195 AromaticContact CE2-CZ 3.68Å; F57-Y195 HydrophobicContact CZ-CD2 4.24Å; F57-Y195 AromaticContact CZ-CE2 3.65Å; F57-Y195 HydrophobicContact CZ-CE2 3.65Å
58	V	98.3	Very high	97.6	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	153.8	175.3	-73.6	0	0	0	0	113.2	Y31 V49 G50 Q56 E70 W84 Y91	Y31-V58 HydrophobicContact CE1-CG2 4.06Å; V49-V58 WeakPolarHBondContact CA-O 3.42Å; G50-V58 PolarHBondContact N-O 3.45Å; G50-V58 PolarHBondContact O-N 2.89Å; Q56-V58 PolarHBondContact NE2-O 3.08Å; V58-E70 WeakPolarHBondContact CA-O 3.32Å; V58-W84 HydrophobicContact CG1-CH2 3.92Å; V58-W84 HydrophobicContact CG1-CZ3 3.85Å; V58-Y91 WeakPolarHBondContact CG2-OH 3.4Å
59	R	98.4	Very high	97.6	Very high	72 Å²	72	42.7 Å²	42.7	27%	0.272	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	146.1	168.6	-177.3	179	175.3	109	4.9	110.6	S48 V49 D61 E70 R72	S48-R59 CarbonylContact O-C 3.6Å; S48-R59 WeakPolarHBondContact O-CA 3.5Å; V49-R59 HydrophobicContact CG1-CG 4.27Å; R59-D61 IonicContact CZ-OD2 3.56Å; R59-D61 IonicContact NE-OD2 2.71Å; R59-D61 IonicContact NH2-OD2 3.07Å; R59-D61 PolarHBondContact NH2-OD2 3.02Å; R59-E70 PolarHBondContact N-O 3.37Å; R59-E70 PolarHBondContact O-N 2.85Å; R59-R72 HydrophobicContact CB-CG 3.95Å
60	F	98.8	Very high	97.5	Very high	4 Å²	4	44.1 Å²	44.1	2%	0.018	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	145.9	161	178.6	-84.7	0	0	0	109.4	F46 I47 S48 P67 R68 Y91 K92	F46-F60 AromaticContact CD1-CD1 3.69Å; F46-F60 HydrophobicContact CD1-CD1 3.69Å; F46-F60 AromaticContact CD1-CE1 3.83Å; F46-F60 HydrophobicContact CD1-CE1 3.83Å; F46-F60 AromaticContact CE1-CD1 3.94Å; F46-F60 HydrophobicContact CE1-CD1 3.94Å; F46-F60 HydrophobicContact CE1-CE1 4.36Å; I47-F60 WeakPolarHBondContact CA-O 3.13Å; S48-F60 PolarHBondContact N-O 2.95Å; S48-F60 PolarHBondContact O-N 3.01Å; F60-P67 HydrophobicContact CE1-CB 4.47Å; F60-P67 HydrophobicContact CE2-CB 3.86Å; F60-P67 HydrophobicContact CZ-CB 3.62Å; F60-R68 VanDerWaalsContact CD2-C 3.49Å; F60-R68 WeakPolarHBondContact CD2-O 3.39Å; F60-Y91 HydrophobicContact CB-CD1 4.22Å; F60-Y91 HydrophobicContact CB-CD2 3.58Å; F60-Y91 HydrophobicContact CB-CE2 4.05Å; F60-Y91 HydrophobicContact CB-CG 3.69Å; F60-Y91 HydrophobicContact CD1-CG 4.43Å; F60-Y91 AromaticContact CD2-CD2 3.67Å; F60-Y91 HydrophobicContact CD2-CD2 3.67Å; F60-Y91 AromaticContact CD2-CG 3.9Å; F60-Y91 HydrophobicContact CD2-CG 3.9Å; F60-Y91 AromaticContact CG-CD2 3.83Å; F60-Y91 HydrophobicContact CG-CD2 3.83Å; F60-Y91 AromaticContact CG-CG 3.76Å; F60-Y91 HydrophobicContact CG-CG 3.76Å; F60-K92 HydrophobicContact CE2-CG 4.22Å; F60-K92 HydrophobicContact CZ-CG 4.02Å
61	D	98.6	Very high	97.5	Very high	17 Å²	17	46.5 Å²	46.5	9%	0.091	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	120.6	177	-158	-36.2	0	0	0	109.9	R45 R59 D63 A64	R45-D61 IonicContact CZ-OD1 2.65Å; R45-D61 VanDerWaalsContact CZ-OD1 3.29Å; R45-D61 IonicContact CZ-OD2 2.77Å; R45-D61 IonicContact NE-OD1 3.47Å; R45-D61 PolarHBondContact NE-OD1 2.92Å; R45-D61 IonicContact NE-OD2 3.71Å; R45-D61 VanDerWaalsContact NH2-CG 3.34Å; R45-D61 IonicContact NH2-OD1 2.78Å; R45-D61 PolarHBondContact NH2-OD1 2.8Å; R45-D61 IonicContact NH2-OD2 3.75Å; R45-D61 PolarHBondContact NH2-OD2 3.42Å; R59-D61 IonicContact CZ-OD2 3.56Å; R59-D61 IonicContact NE-OD2 2.71Å; R59-D61 IonicContact NH2-OD2 3.07Å; R59-D61 PolarHBondContact NH2-OD2 3.02Å; D61-D63 PolarHBondContact O-N 2.72Å; D61-D63 PolarHBondContact OD1-N 2.67Å; D61-A64 HydrophobicContact CB-CB 4.44Å; D61-A64 WeakPolarHBondContact O-CB 3.3Å; D61-A64 PolarHBondContact O-N 2.92Å
62	S	98.2	Very high	97.4	Very high	37 Å²	37	49 Å²	49	26%	0.259	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-23.1	-178.7	67.1	0	0	0	0	113.7	R45 F46 A64	R45-S62 WeakPolarHBondContact CA-OG 3.32Å; R45-S62 WeakPolarHBondContact CG-OG 3.37Å; F46-S62 PolarHBondContact N-OG 3.43Å; F46-S62 PolarHBondContact O-N 2.89Å; F46-S62 PolarHBondContact O-OG 2.88Å; S62-A64 VanDerWaalsContact C-N 3.27Å
63	D	97.2	Very high	97.3	Very high	78 Å²	78	49.2 Å²	49.2	42%	0.417	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-4.1	178.9	-72	6.6	0	0	0	112.1	R38 R45 D61	R38-D63 IonicContact CZ-OD2 3.61Å; R38-D63 IonicContact NH1-OD1 3.12Å; R38-D63 IonicContact NH1-OD2 3.6Å; R38-D63 PolarHBondContact NH1-OD2 3Å; R38-D63 IonicContact NH2-OD2 3.55Å; R45-D63 WeakPolarHBondContact CD-OD2 3.39Å; R45-D63 HydrophobicContact CG-CB 4.44Å; R45-D63 WeakPolarHBondContact CG-OD1 3.37Å; R45-D63 IonicContact CZ-OD2 2.68Å; R45-D63 IonicContact NE-OD2 3.7Å; R45-D63 PolarHBondContact NE-OD2 2.69Å; R45-D63 IonicContact NH1-OD2 3.46Å; R45-D63 PolarHBondContact NH1-OD2 2.95Å; D61-D63 PolarHBondContact O-N 2.72Å; D61-D63 PolarHBondContact OD1-N 2.67Å
64	A	97.1	Very high	97.3	Very high	36 Å²	36	52.9 Å²	52.9	30%	0.298	30%	0.297	S	S	.	.	S	Bend	trans	-66.2	148.3	177	0	0	0	0	0	111.6	D61 S62 S66 P67	D61-A64 HydrophobicContact CB-CB 4.44Å; D61-A64 WeakPolarHBondContact O-CB 3.3Å; D61-A64 PolarHBondContact O-N 2.92Å; S62-A64 VanDerWaalsContact C-N 3.27Å; A64-S66 PolarHBondContact O-N 2.83Å; A64-S66 VanDerWaalsContact O-N 3.12Å; A64-P67 VanDerWaalsContact O-CD 3.23Å; A64-P67 WeakPolarHBondContact O-CD 3.42Å; A64-P67 VanDerWaalsContact O-CG 3.3Å; A64-P67 WeakPolarHBondContact O-CG 3.17Å
65	A	96.4	Very high	97.4	Very high	117 Å²	117	50.5 Å²	50.5	97%	0.967	28%	0.283	S	S	*	.	S	Bend	trans	-61.3	-24.3	-179.7	0	0	0	0	0	113.8
66	S	95.9	Very high	97.4	Very high	83 Å²	83	49.4 Å²	49.4	58%	0.58	28%	0.276	S	S	*	.	S	Bend	trans	-140.4	89.4	169.8	-173.5	0	0	0	0	109	A64 R68	A64-S66 PolarHBondContact O-N 2.83Å; A64-S66 VanDerWaalsContact O-N 3.12Å; S66-R68 PolarHBondContact O-N 2.91Å; S66-R68 VanDerWaalsContact O-N 3.14Å
67	P	96.9	Very high	97.3	Very high	36 Å²	36	52.5 Å²	52.5	23%	0.234	29%	0.291	C	S	.	.			trans	-65.1	114.6	-174.3	-24.2	35.6	0	0	0	111.8	F60 A64 K92	F60-P67 HydrophobicContact CE1-CB 4.47Å; F60-P67 HydrophobicContact CE2-CB 3.86Å; F60-P67 HydrophobicContact CZ-CB 3.62Å; A64-P67 VanDerWaalsContact O-CD 3.23Å; A64-P67 WeakPolarHBondContact O-CD 3.42Å; A64-P67 VanDerWaalsContact O-CG 3.3Å; A64-P67 WeakPolarHBondContact O-CG 3.17Å; P67-K92 WeakPolarHBondContact O-CE 3.48Å; P67-K92 PolarHBondContact O-NZ 3.03Å
68	R	97.6	Very high	97.1	Very high	151 Å²	151	58.5 Å²	58.5	57%	0.57	32%	0.319	S	S	*	.			trans	-148.1	162.1	177.4	63.2	-177.3	176.1	173	0.6	110.1	F60 S66 E70 T88	F60-R68 VanDerWaalsContact CD2-C 3.49Å; F60-R68 WeakPolarHBondContact CD2-O 3.39Å; S66-R68 PolarHBondContact O-N 2.91Å; S66-R68 VanDerWaalsContact O-N 3.14Å; R68-E70 HydrophobicContact CG-CG 4.34Å; R68-T88 HydrophobicContact CB-CG2 4.2Å
69	G	97.3	Very high	97	Very high	5 Å²	5	59.1 Å²	59.1	5%	0.052	32%	0.322	C	S	.	.			trans	-65.4	131.7	166.8	0	0	0	0	0	109.6	T88	G69-T88 PolarHBondContact N-OG1 2.8Å
70	E	97.6	Very high	96.9	Very high	56 Å²	56	57.4 Å²	57.4	26%	0.262	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	133.2	-179.6	-62.7	-178.6	150.8	0	0	110.1	V58 R59 R68 R72	V58-E70 WeakPolarHBondContact CA-O 3.32Å; R59-E70 PolarHBondContact N-O 3.37Å; R59-E70 PolarHBondContact O-N 2.85Å; R68-E70 HydrophobicContact CG-CG 4.34Å; E70-R72 IonicContact OE2-CZ 3.35Å; E70-R72 IonicContact OE2-NH2 2.82Å; E70-R72 PolarHBondContact OE2-NH2 3.31Å
71	P	97.9	Very high	96.8	Very high	50 Å²	50	61.9 Å²	61.9	33%	0.325	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	146	172.1	28	-34.1	0	0	0	110.9	V76 E77 W84	P71-V76 HydrophobicContact CB-CG1 3.88Å; P71-E77 HydrophobicContact CB-CG 3.66Å; P71-E77 HydrophobicContact CG-CG 3.92Å; P71-W84 HydrophobicContact CB-CH2 3.64Å; P71-W84 HydrophobicContact CB-CZ2 3.87Å; P71-W84 HydrophobicContact CG-CH2 4.24Å; P71-W84 HydrophobicContact CG-CZ2 4.3Å
72	R	97.4	Very high	96.8	Very high	123 Å²	123	69 Å²	69	46%	0.464	39%	0.388	S	S	.	.			trans	-128.6	-4.5	175	-60.4	-65.9	167.2	173.9	-4.7	113.3	Q56 F57 R59 E70	Q56-R72 HydrophobicContact CB-CB 4.49Å; Q56-R72 HydrophobicContact CG-CB 4.12Å; Q56-R72 HydrophobicContact CG-CG 4.38Å; Q56-R72 CarbonylContact O-C 3.55Å; F57-R72 PolarHBondContact O-N 2.91Å; R59-R72 HydrophobicContact CB-CG 3.95Å; E70-R72 IonicContact OE2-CZ 3.35Å; E70-R72 IonicContact OE2-NH2 2.82Å; E70-R72 PolarHBondContact OE2-NH2 3.31Å
73	A	96.1	Very high	96.7	Very high	4 Å²	4	67.5 Å²	67.5	3%	0.033	38%	0.377	C	S	.	.	S	Bend	trans	-134.7	141.7	171.5	0	0	0	0	0	111.2	T55 F57 W75 V76	T55-A73 HydrophobicContact CG2-CB 4.27Å; F57-A73 HydrophobicContact CB-CB 4.08Å; A73-W75 HydrophobicContact CB-CD2 4.17Å; A73-W75 HydrophobicContact CB-CG 4.36Å; A73-W75 HydrophobicContact CB-CZ2 4.04Å; A73-W75 PolarHBondContact O-N 2.86Å; A73-W75 VanDerWaalsContact O-N 3.13Å; A73-V76 VanDerWaalsContact O-CG1 3.3Å; A73-V76 WeakPolarHBondContact O-CG1 3.45Å; A73-V76 PolarHBondContact O-N 3.44Å
74	P	96.1	Very high	96.8	Very high	102 Å²	102	65.8 Å²	65.8	66%	0.662	37%	0.365	S	S	*	.	H	α-helix	trans	-58.9	-30.4	-176.4	-27.1	35.3	0	0	0	114.6	V76 E77	P74-V76 VanDerWaalsContact C-N 3.26Å; P74-V76 PolarHBondContact O-N 2.65Å; P74-E77 WeakPolarHBondContact O-CB 3.33Å; P74-E77 PolarHBondContact O-N 2.93Å
75	W	95.9	Very high	96.8	Very high	14 Å²	14	69.1 Å²	69.1	5%	0.053	38%	0.378	C	S	.	.	H	α-helix	trans	-74.1	-10.9	-176.9	54.5	-108.2	0	0	0	114.6	V52 T55 F57 A73 Q78 Y195 N198 G199 L203	V52-W75 HydrophobicContact CB-CH2 4.23Å; V52-W75 HydrophobicContact CB-CZ2 4.34Å; V52-W75 HydrophobicContact CG2-CH2 3.83Å; V52-W75 HydrophobicContact CG2-CZ2 4.43Å; T55-W75 HydrophobicContact CG2-CZ2 4.36Å; F57-W75 HydrophobicContact CB-CH2 3.15Å; F57-W75 HydrophobicContact CB-CZ2 3.41Å; F57-W75 VanDerWaalsContact CB-CZ2 3.41Å; F57-W75 HydrophobicContact CB-CZ3 3.88Å; F57-W75 AromaticContact CD1-CH2 3.98Å; F57-W75 HydrophobicContact CD1-CH2 3.98Å; F57-W75 AromaticContact CD2-CH2 3.81Å; F57-W75 HydrophobicContact CD2-CH2 3.81Å; F57-W75 AromaticContact CD2-CZ3 3.98Å; F57-W75 HydrophobicContact CD2-CZ3 3.98Å; F57-W75 AromaticContact CG-CH2 3.39Å; F57-W75 HydrophobicContact CG-CH2 3.39Å; F57-W75 HydrophobicContact CG-CZ2 4.13Å; F57-W75 HydrophobicContact CG-CZ3 4.04Å; A73-W75 HydrophobicContact CB-CD2 4.17Å; A73-W75 HydrophobicContact CB-CG 4.36Å; A73-W75 HydrophobicContact CB-CZ2 4.04Å; A73-W75 PolarHBondContact O-N 2.86Å; A73-W75 VanDerWaalsContact O-N 3.13Å; W75-Q78 WeakPolarHBondContact O-CG 3.45Å; W75-Y195 HydrophobicContact CE3-CD1 4.27Å; W75-Y195 HydrophobicContact CE3-CG 4.48Å; W75-Y195 HydrophobicContact CH2-CG 4.13Å; W75-Y195 AromaticContact CZ3-CD1 3.6Å; W75-Y195 HydrophobicContact CZ3-CD1 3.6Å; W75-Y195 HydrophobicContact CZ3-CD2 4.29Å; W75-Y195 HydrophobicContact CZ3-CE1 4.35Å; W75-Y195 AromaticContact CZ3-CG 3.57Å; W75-Y195 HydrophobicContact CZ3-CG 3.57Å; W75-N198 HydrophobicContact CB-CB 4.43Å; W75-G199 VanDerWaalsContact CG-CA 3.46Å; W75-L203 HydrophobicContact CD2-CD1 4.4Å; W75-L203 HydrophobicContact CH2-CD1 4.3Å; W75-L203 HydrophobicContact CZ2-CD1 3.77Å; W75-L203 HydrophobicContact CZ2-CD2 3.99Å; W75-L203 HydrophobicContact CZ2-CG 4.29Å
76	V	97.2	Very high	96.8	Very high	0 Å²	0	68.3 Å²	68.3	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-98.1	-16.9	170.1	72.9	0	0	0	0	112.3	F57 P71 A73 P74 Q78 E79 Y83 W84 Y195	F57-V76 HydrophobicContact CB-CG1 4.35Å; F57-V76 HydrophobicContact CD2-CB 4.34Å; F57-V76 HydrophobicContact CD2-CG1 4.38Å; F57-V76 HydrophobicContact CD2-CG2 4.16Å; F57-V76 VanDerWaalsContact O-CG1 3.26Å; F57-V76 WeakPolarHBondContact O-CG1 3.25Å; P71-V76 HydrophobicContact CB-CG1 3.88Å; A73-V76 VanDerWaalsContact O-CG1 3.3Å; A73-V76 WeakPolarHBondContact O-CG1 3.45Å; A73-V76 PolarHBondContact O-N 3.44Å; P74-V76 VanDerWaalsContact C-N 3.26Å; P74-V76 PolarHBondContact O-N 2.65Å; V76-Q78 PolarHBondContact O-N 2.78Å; V76-Q78 VanDerWaalsContact O-N 3.14Å; V76-E79 HydrophobicContact CG2-CB 4.46Å; V76-E79 HydrophobicContact CG2-CG 3.84Å; V76-E79 VanDerWaalsContact O-CB 3.31Å; V76-E79 WeakPolarHBondContact O-CB 3.3Å; V76-E79 WeakPolarHBondContact O-CG 3.47Å; V76-E79 PolarHBondContact O-N 3.47Å; V76-Y83 HydrophobicContact CG2-CE1 4.05Å; V76-W84 HydrophobicContact CG1-CH2 3.99Å; V76-W84 HydrophobicContact CG1-CZ2 4.23Å; V76-W84 HydrophobicContact CG2-CH2 3.98Å; V76-W84 HydrophobicContact CG2-CZ2 3.98Å; V76-W84 WeakPolarHBondContact O-CZ2 3.48Å; V76-Y195 HydrophobicContact CG2-CE1 4.32Å
77	E	95.6	Very high	96.9	Very high	118 Å²	118	64.7 Å²	64.7	55%	0.551	32%	0.324	S	S	*	.	H	α-helix	trans	-60.8	-25.3	178.4	-65.6	179.5	-172.9	0	0	113.2	P71 P74 E79	P71-E77 HydrophobicContact CB-CG 3.66Å; P71-E77 HydrophobicContact CG-CG 3.92Å; P74-E77 WeakPolarHBondContact O-CB 3.33Å; P74-E77 PolarHBondContact O-N 2.93Å; E77-E79 PolarHBondContact O-N 2.93Å
78	Q	94.7	Very high	97	Very high	126 Å²	126	63.5 Å²	63.5	59%	0.589	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-8.6	174.4	66.2	177.4	18.1	0	0	114.5	W75 V76 N198	W75-Q78 WeakPolarHBondContact O-CG 3.45Å; V76-Q78 PolarHBondContact O-N 2.78Å; V76-Q78 VanDerWaalsContact O-N 3.14Å; Q78-N198 PolarHBondContact NE2-ND2 2.53Å; Q78-N198 VanDerWaalsContact NE2-ND2 3.14Å; Q78-N198 PolarHBondContact NE2-OD1 2.99Å
79	E	96.6	Very high	97	Very high	13 Å²	13	61.4 Å²	61.4	6%	0.061	31%	0.312	C	S	.	.	S	Bend	trans	-69	135	174.3	-67.9	-61.8	151.2	0	0	111	V76 E77 Y83 W84 R194 N198	V76-E79 HydrophobicContact CG2-CB 4.46Å; V76-E79 HydrophobicContact CG2-CG 3.84Å; V76-E79 VanDerWaalsContact O-CB 3.31Å; V76-E79 WeakPolarHBondContact O-CB 3.3Å; V76-E79 WeakPolarHBondContact O-CG 3.47Å; V76-E79 PolarHBondContact O-N 3.47Å; E77-E79 PolarHBondContact O-N 2.93Å; E79-Y83 HydrophobicContact CB-CD1 3.57Å; E79-Y83 HydrophobicContact CB-CD2 4.35Å; E79-Y83 HydrophobicContact CB-CE1 4.13Å; E79-Y83 HydrophobicContact CB-CG 3.72Å; E79-Y83 HydrophobicContact CG-CD1 4.18Å; E79-Y83 HydrophobicContact CG-CD2 4.33Å; E79-Y83 HydrophobicContact CG-CE1 4.35Å; E79-Y83 HydrophobicContact CG-CE2 4.48Å; E79-Y83 HydrophobicContact CG-CG 4.19Å; E79-W84 VanDerWaalsContact O-CD1 3.3Å; E79-W84 PolarHBondContact O-NE1 3.2Å; E79-R194 IonicContact OE1-CZ 2.72Å; E79-R194 IonicContact OE1-NE 3.88Å; E79-R194 PolarHBondContact OE1-NE 3.19Å; E79-R194 IonicContact OE1-NH2 3.73Å; E79-R194 PolarHBondContact OE1-NH2 2.85Å; E79-R194 IonicContact OE2-CZ 3.58Å; E79-R194 IonicContact OE2-NE 2.76Å; E79-R194 IonicContact OE2-NH2 3.65Å; E79-R194 PolarHBondContact OE2-NH2 2.87Å; E79-N198 PolarHBondContact OE1-ND2 3.05Å
80	G	95.8	Very high	97	Very high	35 Å²	35	64.6 Å²	64.6	36%	0.361	33%	0.325	S	S	.	.			trans	-69.5	169.2	-172.8	0	0	0	0	0	114.7	E82 Y83 W84	G80-E82 PolarHBondContact O-N 3.24Å; G80-Y83 WeakPolarHBondContact O-CB 3.26Å; G80-Y83 PolarHBondContact O-N 2.91Å; G80-W84 PolarHBondContact O-N 2.86Å
81	P	96.8	Very high	97.1	Very high	99 Å²	99	62.2 Å²	62.2	64%	0.643	31%	0.313	S	S	*	.	H	α-helix	trans	-57.2	-36.5	-177.8	23	-33.7	0	0	0	113.1	Y83 W84 D85	P81-Y83 VanDerWaalsContact C-N 3.25Å; P81-Y83 PolarHBondContact O-N 3.42Å; P81-W84 PolarHBondContact O-N 2.82Å; P81-W84 VanDerWaalsContact O-N 3.11Å; P81-D85 WeakPolarHBondContact O-CB 2.95Å; P81-D85 PolarHBondContact O-N 3.49Å
82	E	97.4	Very high	97.1	Very high	165 Å²	165	63.7 Å²	63.7	77%	0.771	32%	0.315	S	S	*	.	H	α-helix	trans	-59	-33.5	177.1	-61	178.6	178.9	0	0	113.3	G80 R86	G80-E82 PolarHBondContact O-N 3.24Å; E82-R86 WeakPolarHBondContact O-CB 3.01Å; E82-R86 PolarHBondContact O-N 2.96Å; E82-R86 VanDerWaalsContact O-N 3.13Å
83	Y	97.5	Very high	97.1	Very high	7 Å²	7	65.7 Å²	65.7	3%	0.027	32%	0.322	C	S	.	.	H	α-helix	trans	-66.5	-53.9	172.9	169	-88.2	0	0	0	109.8	V76 E79 G80 P81 D85 R86 E87 W191 Y195	V76-Y83 HydrophobicContact CG2-CE1 4.05Å; E79-Y83 HydrophobicContact CB-CD1 3.57Å; E79-Y83 HydrophobicContact CB-CD2 4.35Å; E79-Y83 HydrophobicContact CB-CE1 4.13Å; E79-Y83 HydrophobicContact CB-CG 3.72Å; E79-Y83 HydrophobicContact CG-CD1 4.18Å; E79-Y83 HydrophobicContact CG-CD2 4.33Å; E79-Y83 HydrophobicContact CG-CE1 4.35Å; E79-Y83 HydrophobicContact CG-CE2 4.48Å; E79-Y83 HydrophobicContact CG-CG 4.19Å; G80-Y83 WeakPolarHBondContact O-CB 3.26Å; G80-Y83 PolarHBondContact O-N 2.91Å; P81-Y83 VanDerWaalsContact C-N 3.25Å; P81-Y83 PolarHBondContact O-N 3.42Å; Y83-D85 VanDerWaalsContact C-N 3.34Å; Y83-D85 PolarHBondContact O-N 3.01Å; Y83-R86 PolarHBondContact O-N 2.83Å; Y83-R86 VanDerWaalsContact O-N 3.16Å; Y83-E87 HydrophobicContact CD1-CG 4.3Å; Y83-E87 HydrophobicContact CD2-CG 4.19Å; Y83-E87 HydrophobicContact CE1-CG 3.97Å; Y83-E87 HydrophobicContact CE2-CG 3.85Å; Y83-E87 HydrophobicContact CG-CG 4.39Å; Y83-E87 WeakPolarHBondContact O-CG 3.34Å; Y83-E87 PolarHBondContact O-N 3.34Å; Y83-W191 AromaticContact CD2-CH2 3.59Å; Y83-W191 HydrophobicContact CD2-CH2 3.59Å; Y83-W191 HydrophobicContact CD2-CZ2 4.35Å; Y83-W191 AromaticContact CD2-CZ3 3.71Å; Y83-W191 HydrophobicContact CD2-CZ3 3.71Å; Y83-W191 HydrophobicContact CE2-CE3 4.13Å; Y83-W191 AromaticContact CE2-CH2 3.95Å; Y83-W191 HydrophobicContact CE2-CH2 3.95Å; Y83-W191 AromaticContact CE2-CZ3 3.65Å; Y83-W191 HydrophobicContact CE2-CZ3 3.65Å; Y83-Y195 VanDerWaalsContact CE2-OH 3.26Å; Y83-Y195 WeakPolarHBondContact CE2-OH 3.4Å; Y83-Y195 PolarHBondContact OH-OH 3.01Å
84	W	97.9	Very high	97.2	Very high	41 Å²	41	67.5 Å²	67.5	16%	0.155	33%	0.33	C	S	.	.	H	α-helix	trans	-62.9	-37.9	-176.8	-66.9	109.1	0	0	0	113.2	V58 P71 V76 E79 G80 P81 T88	V58-W84 HydrophobicContact CG1-CH2 3.92Å; V58-W84 HydrophobicContact CG1-CZ3 3.85Å; P71-W84 HydrophobicContact CB-CH2 3.64Å; P71-W84 HydrophobicContact CB-CZ2 3.87Å; P71-W84 HydrophobicContact CG-CH2 4.24Å; P71-W84 HydrophobicContact CG-CZ2 4.3Å; V76-W84 HydrophobicContact CG1-CH2 3.99Å; V76-W84 HydrophobicContact CG1-CZ2 4.23Å; V76-W84 HydrophobicContact CG2-CH2 3.98Å; V76-W84 HydrophobicContact CG2-CZ2 3.98Å; V76-W84 WeakPolarHBondContact O-CZ2 3.48Å; E79-W84 VanDerWaalsContact O-CD1 3.3Å; E79-W84 PolarHBondContact O-NE1 3.2Å; G80-W84 PolarHBondContact O-N 2.86Å; P81-W84 PolarHBondContact O-N 2.82Å; P81-W84 VanDerWaalsContact O-N 3.11Å; W84-T88 WeakPolarHBondContact O-CB 3.12Å; W84-T88 PolarHBondContact O-N 3.17Å; W84-T88 PolarHBondContact O-OG1 3.1Å
85	D	97.9	Very high	97.3	Very high	107 Å²	107	63.5 Å²	63.5	57%	0.572	31%	0.305	S	S	*	.	H	α-helix	trans	-64.9	-47.1	173.5	-76.9	-27.4	0	0	0	111.1	P81 Y83 T88 Q89	P81-D85 WeakPolarHBondContact O-CB 2.95Å; P81-D85 PolarHBondContact O-N 3.49Å; Y83-D85 VanDerWaalsContact C-N 3.34Å; Y83-D85 PolarHBondContact O-N 3.01Å; D85-T88 PolarHBondContact O-N 2.71Å; D85-Q89 WeakPolarHBondContact O-CB 3.48Å; D85-Q89 VanDerWaalsContact O-CG 3.27Å; D85-Q89 WeakPolarHBondContact O-CG 3.16Å; D85-Q89 PolarHBondContact O-N 2.91Å
86	R	97.5	Very high	97.4	Very high	100 Å²	100	67.8 Å²	67.8	38%	0.377	33%	0.326	S	S	.	.	H	α-helix	trans	-63	-46.4	179.2	-175.5	-174.2	66.2	-139.5	-4.8	112.3	E82 Y83 Q89 K90	E82-R86 WeakPolarHBondContact O-CB 3.01Å; E82-R86 PolarHBondContact O-N 2.96Å; E82-R86 VanDerWaalsContact O-N 3.13Å; Y83-R86 PolarHBondContact O-N 2.83Å; Y83-R86 VanDerWaalsContact O-N 3.16Å; R86-Q89 PolarHBondContact O-N 2.9Å; R86-K90 WeakPolarHBondContact O-CG 3.37Å; R86-K90 PolarHBondContact O-N 2.99Å
87	E	97.6	Very high	97.5	Very high	7 Å²	7	69.6 Å²	69.6	3%	0.033	34%	0.341	C	S	.	.	H	α-helix	trans	-66.6	-41.4	177.9	-57.8	-41.9	117.7	0	0	110.8	Y83 Q89 K90 Y91	Y83-E87 HydrophobicContact CD1-CG 4.3Å; Y83-E87 HydrophobicContact CD2-CG 4.19Å; Y83-E87 HydrophobicContact CE1-CG 3.97Å; Y83-E87 HydrophobicContact CE2-CG 3.85Å; Y83-E87 HydrophobicContact CG-CG 4.39Å; Y83-E87 WeakPolarHBondContact O-CG 3.34Å; Y83-E87 PolarHBondContact O-N 3.34Å; E87-Q89 VanDerWaalsContact C-N 3.29Å; E87-Q89 PolarHBondContact O-N 2.98Å; E87-K90 WeakPolarHBondContact O-CB 3.23Å; E87-K90 PolarHBondContact O-N 3.41Å; E87-K90 IonicContact OE1-NZ 3.31Å; E87-K90 PolarHBondContact OE1-NZ 2.8Å; E87-K90 WeakPolarHBondContact OE2-CD 3.45Å; E87-K90 WeakPolarHBondContact OE2-CE 3.18Å; E87-K90 IonicContact OE2-NZ 2.8Å; E87-K90 PolarHBondContact OE2-NZ 3.13Å; E87-Y91 HydrophobicContact CB-CE2 4Å; E87-Y91 WeakPolarHBondContact O-CD2 3.45Å; E87-Y91 PolarHBondContact O-N 3.22Å
88	T	98.3	Very high	97.6	Very high	10 Å²	10	64.3 Å²	64.3	6%	0.061	32%	0.317	C	S	.	.	H	α-helix	trans	-55.9	-41.3	171.7	-64.8	0	0	0	0	112.5	R68 G69 W84 D85 K92	R68-T88 HydrophobicContact CB-CG2 4.2Å; G69-T88 PolarHBondContact N-OG1 2.8Å; W84-T88 WeakPolarHBondContact O-CB 3.12Å; W84-T88 PolarHBondContact O-N 3.17Å; W84-T88 PolarHBondContact O-OG1 3.1Å; D85-T88 PolarHBondContact O-N 2.71Å; T88-K92 HydrophobicContact CG2-CD 4.01Å; T88-K92 WeakPolarHBondContact O-CB 3.33Å; T88-K92 WeakPolarHBondContact O-CG 3.43Å; T88-K92 PolarHBondContact O-N 2.85Å
89	Q	98.3	Very high	97.7	Very high	107 Å²	107	61.3 Å²	61.3	50%	0.5	30%	0.3	S	S	.	.	H	α-helix	trans	-74.4	-24.5	176.9	-67.5	-64.7	-11.1	0	0	113.4	D85 R86 E87 R93	D85-Q89 WeakPolarHBondContact O-CB 3.48Å; D85-Q89 VanDerWaalsContact O-CG 3.27Å; D85-Q89 WeakPolarHBondContact O-CG 3.16Å; D85-Q89 PolarHBondContact O-N 2.91Å; R86-Q89 PolarHBondContact O-N 2.9Å; E87-Q89 VanDerWaalsContact C-N 3.29Å; E87-Q89 PolarHBondContact O-N 2.98Å; Q89-R93 WeakPolarHBondContact O-CB 3.35Å; Q89-R93 VanDerWaalsContact O-CG 3.3Å; Q89-R93 WeakPolarHBondContact O-CG 3.19Å; Q89-R93 PolarHBondContact O-N 2.87Å; Q89-R93 PolarHBondContact O-NE 2.9Å
90	K	97.6	Very high	97.8	Very high	73 Å²	73	63.7 Å²	63.7	32%	0.317	32%	0.315	S	S	.	.	H	α-helix	trans	-68.2	-54.1	167.7	-71.7	171.1	-178.3	170.7	0	110.3	R86 E87 K92 R93 Q94	R86-K90 WeakPolarHBondContact O-CG 3.37Å; R86-K90 PolarHBondContact O-N 2.99Å; E87-K90 WeakPolarHBondContact O-CB 3.23Å; E87-K90 PolarHBondContact O-N 3.41Å; E87-K90 IonicContact OE1-NZ 3.31Å; E87-K90 PolarHBondContact OE1-NZ 2.8Å; E87-K90 WeakPolarHBondContact OE2-CD 3.45Å; E87-K90 WeakPolarHBondContact OE2-CE 3.18Å; E87-K90 IonicContact OE2-NZ 2.8Å; E87-K90 PolarHBondContact OE2-NZ 3.13Å; K90-K92 VanDerWaalsContact C-N 3.3Å; K90-K92 PolarHBondContact O-N 2.91Å; K90-R93 PolarHBondContact O-N 2.83Å; K90-Q94 PolarHBondContact O-N 2.83Å
91	Y	98.4	Very high	97.9	Very high	6 Å²	6	64.4 Å²	64.4	2%	0.024	31%	0.311	C	S	.	.	H	α-helix	trans	-56.9	-41.6	179.8	-59.2	-49.4	0	0	0	112.5	F46 S48 V58 F60 E87 R93 Q94 A95	F46-Y91 HydrophobicContact CE1-CD1 4.46Å; S48-Y91 WeakPolarHBondContact OG-CE1 3.45Å; V58-Y91 WeakPolarHBondContact CG2-OH 3.4Å; F60-Y91 HydrophobicContact CB-CD1 4.22Å; F60-Y91 HydrophobicContact CB-CD2 3.58Å; F60-Y91 HydrophobicContact CB-CE2 4.05Å; F60-Y91 HydrophobicContact CB-CG 3.69Å; F60-Y91 HydrophobicContact CD1-CG 4.43Å; F60-Y91 AromaticContact CD2-CD2 3.67Å; F60-Y91 HydrophobicContact CD2-CD2 3.67Å; F60-Y91 AromaticContact CD2-CG 3.9Å; F60-Y91 HydrophobicContact CD2-CG 3.9Å; F60-Y91 AromaticContact CG-CD2 3.83Å; F60-Y91 HydrophobicContact CG-CD2 3.83Å; F60-Y91 AromaticContact CG-CG 3.76Å; F60-Y91 HydrophobicContact CG-CG 3.76Å; E87-Y91 HydrophobicContact CB-CE2 4Å; E87-Y91 WeakPolarHBondContact O-CD2 3.45Å; E87-Y91 PolarHBondContact O-N 3.22Å; Y91-R93 PolarHBondContact O-N 2.97Å; Y91-Q94 PolarHBondContact O-N 2.87Å; Y91-A95 WeakPolarHBondContact O-CB 3.29Å; Y91-A95 PolarHBondContact O-N 2.84Å
92	K	98.3	Very high	97.9	Very high	81 Å²	81	60 Å²	60	35%	0.352	28%	0.282	S	S	.	.	H	α-helix	trans	-65	-35.8	175.8	-75.4	174.9	-179.9	169.7	0	113.4	F60 P67 T88 K90 Q96	F60-K92 HydrophobicContact CE2-CG 4.22Å; F60-K92 HydrophobicContact CZ-CG 4.02Å; P67-K92 WeakPolarHBondContact O-CE 3.48Å; P67-K92 PolarHBondContact O-NZ 3.03Å; T88-K92 HydrophobicContact CG2-CD 4.01Å; T88-K92 WeakPolarHBondContact O-CB 3.33Å; T88-K92 WeakPolarHBondContact O-CG 3.43Å; T88-K92 PolarHBondContact O-N 2.85Å; K90-K92 VanDerWaalsContact C-N 3.3Å; K90-K92 PolarHBondContact O-N 2.91Å; K92-Q96 WeakPolarHBondContact O-CG 3.32Å; K92-Q96 PolarHBondContact O-N 2.79Å
93	R	98.3	Very high	97.8	Very high	165 Å²	165	58.2 Å²	58.2	62%	0.623	27%	0.268	S	S	*	.	H	α-helix	trans	-70.4	-43	174	-77	-178.5	-67.7	167.2	1.5	111.4	Q89 K90 Y91 Q96 A97	Q89-R93 WeakPolarHBondContact O-CB 3.35Å; Q89-R93 VanDerWaalsContact O-CG 3.3Å; Q89-R93 WeakPolarHBondContact O-CG 3.19Å; Q89-R93 PolarHBondContact O-N 2.87Å; Q89-R93 PolarHBondContact O-NE 2.9Å; K90-R93 PolarHBondContact O-N 2.83Å; Y91-R93 PolarHBondContact O-N 2.97Å; R93-Q96 PolarHBondContact O-N 3.12Å; R93-A97 PolarHBondContact O-N 2.81Å
94	Q	98.3	Very high	97.8	Very high	41 Å²	41	62.6 Å²	62.6	19%	0.192	29%	0.287	C	S	.	.	H	α-helix	trans	-62.8	-45.2	178	-169.9	57.6	32.2	0	0	111.8	D33 F46 K90 Y91 Q96 A97 D98 W121	D33-Q94 WeakPolarHBondContact OD2-CG 3.4Å; F46-Q94 HydrophobicContact CE2-CB 4.18Å; F46-Q94 HydrophobicContact CE2-CG 3.67Å; F46-Q94 HydrophobicContact CZ-CB 3.9Å; F46-Q94 HydrophobicContact CZ-CG 3.72Å; K90-Q94 PolarHBondContact O-N 2.83Å; Y91-Q94 PolarHBondContact O-N 2.87Å; Q94-Q96 VanDerWaalsContact C-N 3.25Å; Q94-Q96 PolarHBondContact O-N 2.87Å; Q94-A97 CarbonylContact O-C 3.51Å; Q94-A97 WeakPolarHBondContact O-CA 3.45Å; Q94-A97 WeakPolarHBondContact O-CB 3.43Å; Q94-A97 PolarHBondContact O-N 3.27Å; Q94-D98 VanDerWaalsContact NE2-CG 3.27Å; Q94-D98 PolarHBondContact NE2-OD1 2.82Å; Q94-D98 PolarHBondContact NE2-OD2 2.03Å; Q94-D98 PolarHBondContact O-N 3.02Å; Q94-W121 VanDerWaalsContact CD-CZ3 3.41Å; Q94-W121 HydrophobicContact CG-CE3 4.29Å; Q94-W121 HydrophobicContact CG-CZ3 4.04Å
95	A	98.3	Very high	97.8	Very high	18 Å²	18	61.1 Å²	61.1	15%	0.149	28%	0.282	C	S	.	.	H	α-helix	trans	-55.1	-37.4	174	0	0	0	0	0	113.4	F46 Y91 R99	F46-A95 HydrophobicContact CB-CB 3.61Å; F46-A95 HydrophobicContact CD1-CB 3.79Å; F46-A95 HydrophobicContact CD2-CB 4.19Å; F46-A95 HydrophobicContact CG-CB 3.6Å; Y91-A95 WeakPolarHBondContact O-CB 3.29Å; Y91-A95 PolarHBondContact O-N 2.84Å; A95-R99 VanDerWaalsContact O-CB 3.28Å; A95-R99 WeakPolarHBondContact O-CB 3.41Å; A95-R99 PolarHBondContact O-N 2.8Å; A95-R99 VanDerWaalsContact O-N 3.11Å
96	Q	97.9	Very high	97.7	Very high	104 Å²	104	58.9 Å²	58.9	49%	0.486	27%	0.266	S	S	.	.	H	α-helix	trans	-75.7	-34.8	174.4	-65.1	-58.8	-38.1	0	0	112.7	K92 R93 Q94 V100	K92-Q96 WeakPolarHBondContact O-CG 3.32Å; K92-Q96 PolarHBondContact O-N 2.79Å; R93-Q96 PolarHBondContact O-N 3.12Å; Q94-Q96 VanDerWaalsContact C-N 3.25Å; Q94-Q96 PolarHBondContact O-N 2.87Å; Q96-V100 WeakPolarHBondContact O-CG2 3.4Å; Q96-V100 PolarHBondContact O-N 3.02Å
97	A	97.9	Very high	97.7	Very high	39 Å²	39	56.2 Å²	56.2	32%	0.322	27%	0.269	S	S	.	.	H	α-helix	trans	-62.5	-47.9	173.3	0	0	0	0	0	110.8	R93 Q94 R99 V100 N101	R93-A97 PolarHBondContact O-N 2.81Å; Q94-A97 CarbonylContact O-C 3.51Å; Q94-A97 WeakPolarHBondContact O-CA 3.45Å; Q94-A97 WeakPolarHBondContact O-CB 3.43Å; Q94-A97 PolarHBondContact O-N 3.27Å; A97-R99 PolarHBondContact O-N 3.13Å; A97-V100 CarbonylContact O-C 3.6Å; A97-V100 WeakPolarHBondContact O-CA 3.47Å; A97-V100 WeakPolarHBondContact O-CB 3.49Å; A97-V100 PolarHBondContact O-N 3.28Å; A97-N101 PolarHBondContact O-N 2.83Å; A97-N101 PolarHBondContact O-ND2 3.29Å
98	D	97.9	Very high	97.7	Very high	6 Å²	6	58.5 Å²	58.5	3%	0.032	28%	0.278	C	S	.	.	H	α-helix	trans	-69.7	-34.9	-178.5	-69.3	-25.5	0	0	0	113	A35 F46 Q94 V100 N101 L102 L119	A35-D98 HydrophobicContact CB-CB 3.63Å; F46-D98 WeakPolarHBondContact CE2-OD2 3.45Å; Q94-D98 VanDerWaalsContact NE2-CG 3.27Å; Q94-D98 PolarHBondContact NE2-OD1 2.82Å; Q94-D98 PolarHBondContact NE2-OD2 2.03Å; Q94-D98 PolarHBondContact O-N 3.02Å; D98-V100 PolarHBondContact O-N 3.39Å; D98-N101 PolarHBondContact O-N 3.09Å; D98-N101 VanDerWaalsContact O-N 3.15Å; D98-N101 PolarHBondContact OD1-ND2 3.01Å; D98-L102 WeakPolarHBondContact O-CB 3.35Å; D98-L102 VanDerWaalsContact O-CG 3.3Å; D98-L102 WeakPolarHBondContact O-CG 3.35Å; D98-L102 PolarHBondContact O-N 2.92Å; D98-L119 HydrophobicContact CB-CD2 4.1Å; D98-L119 WeakPolarHBondContact OD1-CD2 3.23Å
99	R	97.4	Very high	97.7	Very high	63 Å²	63	61.3 Å²	61.3	24%	0.238	29%	0.288	C	S	.	.	H	α-helix	trans	-54.9	-38.8	166.9	176.4	-171.1	-177.7	-146.7	-0.3	112.5	E43 P44 A95 A97 R103	E43-R99 VanDerWaalsContact CD-NH2 3.28Å; E43-R99 IonicContact OE1-CZ 3.86Å; E43-R99 IonicContact OE1-NE 3.54Å; E43-R99 PolarHBondContact OE1-NE 2.61Å; E43-R99 IonicContact OE1-NH2 3.66Å; E43-R99 PolarHBondContact OE1-NH2 2.89Å; E43-R99 IonicContact OE2-CZ 3.46Å; E43-R99 IonicContact OE2-NE 2.76Å; E43-R99 PolarHBondContact OE2-NE 3.44Å; E43-R99 IonicContact OE2-NH2 3.63Å; E43-R99 PolarHBondContact OE2-NH2 2.96Å; P44-R99 HydrophobicContact CG-CB 4.38Å; P44-R99 HydrophobicContact CG-CG 4.26Å; A95-R99 VanDerWaalsContact O-CB 3.28Å; A95-R99 WeakPolarHBondContact O-CB 3.41Å; A95-R99 PolarHBondContact O-N 2.8Å; A95-R99 VanDerWaalsContact O-N 3.11Å; A97-R99 PolarHBondContact O-N 3.13Å; R99-R103 WeakPolarHBondContact O-CG 3.28Å
100	V	97.4	Very high	97.6	Very high	63 Å²	63	63.4 Å²	63.4	38%	0.382	30%	0.303	S	S	.	.	H	α-helix	trans	-77.2	-38.3	175.6	171.7	0	0	0	0	111.2	Q96 A97 D98 R103 K104	Q96-V100 WeakPolarHBondContact O-CG2 3.4Å; Q96-V100 PolarHBondContact O-N 3.02Å; A97-V100 CarbonylContact O-C 3.6Å; A97-V100 WeakPolarHBondContact O-CA 3.47Å; A97-V100 WeakPolarHBondContact O-CB 3.49Å; A97-V100 PolarHBondContact O-N 3.28Å; D98-V100 PolarHBondContact O-N 3.39Å; V100-R103 PolarHBondContact O-N 2.96Å; V100-K104 HydrophobicContact CG1-CD 4.32Å; V100-K104 WeakPolarHBondContact O-CG 3.31Å; V100-K104 PolarHBondContact O-N 3.16Å; V100-K104 VanDerWaalsContact O-N 3.12Å
101	N	97.9	Very high	97.5	Very high	51 Å²	51	62.8 Å²	62.8	27%	0.273	30%	0.301	S	S	.	.	H	α-helix	trans	-66.8	-43.8	179.7	-64.4	-26.9	0	0	0	111.7	A97 D98 R103 K104 L105 L119	A97-N101 PolarHBondContact O-N 2.83Å; A97-N101 PolarHBondContact O-ND2 3.29Å; D98-N101 PolarHBondContact O-N 3.09Å; D98-N101 VanDerWaalsContact O-N 3.15Å; D98-N101 PolarHBondContact OD1-ND2 3.01Å; N101-R103 VanDerWaalsContact C-N 3.25Å; N101-R103 PolarHBondContact O-N 2.88Å; N101-K104 WeakPolarHBondContact O-CA 3.16Å; N101-K104 WeakPolarHBondContact O-CB 3.46Å; N101-K104 PolarHBondContact O-N 2.98Å; N101-L105 WeakPolarHBondContact O-CB 3.49Å; N101-L105 VanDerWaalsContact O-CG 3.29Å; N101-L105 WeakPolarHBondContact O-CG 3.35Å; N101-L105 PolarHBondContact O-N 3.46Å; N101-L119 HydrophobicContact CB-CD2 3.75Å
102	L	98	Very high	97.3	Very high	7 Å²	7	66.1 Å²	66.1	4%	0.037	33%	0.325	C	S	.	.	H	α-helix	trans	-52.8	-41.4	172.8	-76.3	166.9	0	0	0	112.3	A35 P44 D98 R106 H117 L119 Y142	A35-L102 HydrophobicContact CB-CD1 3.88Å; P44-L102 HydrophobicContact CB-CD1 3.66Å; P44-L102 HydrophobicContact CG-CD1 3.83Å; D98-L102 WeakPolarHBondContact O-CB 3.35Å; D98-L102 VanDerWaalsContact O-CG 3.3Å; D98-L102 WeakPolarHBondContact O-CG 3.35Å; D98-L102 PolarHBondContact O-N 2.92Å; L102-R106 VanDerWaalsContact O-CB 3.29Å; L102-R106 WeakPolarHBondContact O-CB 3.49Å; L102-R106 PolarHBondContact O-N 2.95Å; L102-R106 VanDerWaalsContact O-N 3.08Å; L102-H117 HydrophobicContact CD2-CB 4.3Å; L102-L119 HydrophobicContact CD2-CB 3.68Å; L102-L119 HydrophobicContact CG-CB 4.14Å; L102-Y142 HydrophobicContact CD2-CE2 4.03Å
103	R	96.1	Very high	96.9	Very high	126 Å²	126	68.5 Å²	68.5	48%	0.475	34%	0.337	S	S	.	.	H	α-helix	trans	-68.4	-38.7	175.8	-66	173.9	-173.5	162.4	2.1	112.7	E43 R99 V100 N101 G107	E43-R103 IonicContact OE2-NH2 3.85Å; R99-R103 WeakPolarHBondContact O-CG 3.28Å; V100-R103 PolarHBondContact O-N 2.96Å; N101-R103 VanDerWaalsContact C-N 3.25Å; N101-R103 PolarHBondContact O-N 2.88Å; R103-G107 PolarHBondContact O-N 3.35Å
104	K	96.9	Very high	96.5	Very high	100 Å²	100	67.5 Å²	67.5	44%	0.435	34%	0.344	S	S	.	.	H	α-helix	trans	-66.9	-47.6	176.5	-69.9	169.5	-176.9	161	0	111.4	V100 N101 G107 Y108	V100-K104 HydrophobicContact CG1-CD 4.32Å; V100-K104 WeakPolarHBondContact O-CG 3.31Å; V100-K104 PolarHBondContact O-N 3.16Å; V100-K104 VanDerWaalsContact O-N 3.12Å; N101-K104 WeakPolarHBondContact O-CA 3.16Å; N101-K104 WeakPolarHBondContact O-CB 3.46Å; N101-K104 PolarHBondContact O-N 2.98Å; K104-G107 CarbonylContact O-C 3.56Å; K104-G107 WeakPolarHBondContact O-CA 3.22Å; K104-G107 PolarHBondContact O-N 2.79Å; K104-G107 VanDerWaalsContact O-N 3.09Å; K104-Y108 WeakPolarHBondContact O-CD1 3.44Å; K104-Y108 PolarHBondContact O-N 2.82Å
105	L	97.8	Very high	96.2	Very high	9 Å²	9	66.3 Å²	66.3	5%	0.047	34%	0.343	C	S	.	.	H	α-helix	trans	-60.1	-50.5	-179.9	-68.7	166.6	0	0	0	110.6	N101 G107 Y108 Y109 L119 Y142 Y147	N101-L105 WeakPolarHBondContact O-CB 3.49Å; N101-L105 VanDerWaalsContact O-CG 3.29Å; N101-L105 WeakPolarHBondContact O-CG 3.35Å; N101-L105 PolarHBondContact O-N 3.46Å; L105-G107 PolarHBondContact O-N 3.4Å; L105-G107 VanDerWaalsContact O-N 3.13Å; L105-Y108 PolarHBondContact O-N 2.63Å; L105-Y109 HydrophobicContact CD2-CE2 4.37Å; L105-Y109 VanDerWaalsContact O-CD2 3.27Å; L105-Y109 WeakPolarHBondContact O-CD2 3.2Å; L105-Y109 PolarHBondContact O-N 3.32Å; L105-L119 HydrophobicContact CD1-CD1 3.91Å; L105-L119 HydrophobicContact CD1-CD2 4.15Å; L105-L119 HydrophobicContact CD1-CG 4.47Å; L105-Y142 HydrophobicContact CB-CD1 4.26Å; L105-Y142 HydrophobicContact CB-CD2 4.24Å; L105-Y142 HydrophobicContact CB-CE1 3.88Å; L105-Y142 HydrophobicContact CB-CE2 3.89Å; L105-Y142 HydrophobicContact CB-CG 4.42Å; L105-Y142 HydrophobicContact CD1-CD2 3.66Å; L105-Y142 HydrophobicContact CD1-CE2 3.96Å; L105-Y142 HydrophobicContact CD1-CG 4.06Å; L105-Y142 HydrophobicContact CG-CD2 4.49Å; L105-Y147 HydrophobicContact CD2-CD1 4.4Å; L105-Y147 HydrophobicContact CD2-CD2 4.06Å; L105-Y147 HydrophobicContact CD2-CE1 3.82Å; L105-Y147 HydrophobicContact CD2-CE2 3.42Å; L105-Y147 VanDerWaalsContact CD2-CE2 3.42Å; L105-Y147 WeakPolarHBondContact CD2-OH 3.2Å
106	R	96.4	Very high	96.2	Very high	61 Å²	61	69.3 Å²	69.3	23%	0.23	36%	0.363	C	S	.	.	H	α-helix	trans	-51.1	-39.3	172.8	-168.5	-168.6	66.3	173.5	7.4	112.4	L102 N110 Q111 E113 Y142	L102-R106 VanDerWaalsContact O-CB 3.29Å; L102-R106 WeakPolarHBondContact O-CB 3.49Å; L102-R106 PolarHBondContact O-N 2.95Å; L102-R106 VanDerWaalsContact O-N 3.08Å; R106-N110 PolarHBondContact O-N 3.24Å; R106-Q111 HydrophobicContact CG-CB 3.73Å; R106-Q111 PolarHBondContact O-N 3.41Å; R106-E113 IonicContact CZ-OE1 3.35Å; R106-E113 IonicContact NH1-OE1 3.55Å; R106-E113 PolarHBondContact NH1-OE1 3.03Å; R106-E113 IonicContact NH2-OE1 3.61Å; R106-E113 PolarHBondContact NH2-OE1 3.35Å; R106-Y142 PolarHBondContact N-OH 2.9Å
107	G	96.5	Very high	96.2	Very high	43 Å²	43	65 Å²	65	44%	0.443	34%	0.343	S	S	.	.	H	α-helix	trans	-68.7	-44.7	173.9	0	0	0	0	0	114	R103 K104 L105 Y109 N110	R103-G107 PolarHBondContact O-N 3.35Å; K104-G107 CarbonylContact O-C 3.56Å; K104-G107 WeakPolarHBondContact O-CA 3.22Å; K104-G107 PolarHBondContact O-N 2.79Å; K104-G107 VanDerWaalsContact O-N 3.09Å; L105-G107 PolarHBondContact O-N 3.4Å; L105-G107 VanDerWaalsContact O-N 3.13Å; G107-Y109 VanDerWaalsContact C-N 3.3Å; G107-Y109 PolarHBondContact O-N 3.36Å; G107-N110 PolarHBondContact O-N 3.29Å
108	Y	97.7	Very high	96.2	Very high	56 Å²	56	65 Å²	65	22%	0.22	34%	0.339	C	S	.	.	H	α-helix	trans	-62.4	-36.7	177.7	-64.5	-10.6	0	0	0	112.4	K104 L105 A163 I166 K170	K104-Y108 WeakPolarHBondContact O-CD1 3.44Å; K104-Y108 PolarHBondContact O-N 2.82Å; L105-Y108 PolarHBondContact O-N 2.63Å; Y108-A163 HydrophobicContact CD2-CB 4.41Å; Y108-I166 HydrophobicContact CD1-CD1 4.27Å; Y108-I166 HydrophobicContact CD2-CD1 4.45Å; Y108-I166 HydrophobicContact CE1-CG2 4.12Å; Y108-I166 HydrophobicContact CE2-CB 4.11Å; Y108-I166 HydrophobicContact CE2-CG2 4.11Å; Y108-I166 HydrophobicContact CG-CD1 4.23Å; Y108-K170 PolarHBondContact OH-NZ 2.91Å
109	Y	97.6	Very high	96.3	Very high	68 Å²	68	65.1 Å²	65.1	27%	0.267	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	2.4	178.1	-68.9	-71.5	0	0	0	114.2	L105 G107 Q111 Y142 Y147 D161 A163	L105-Y109 HydrophobicContact CD2-CE2 4.37Å; L105-Y109 VanDerWaalsContact O-CD2 3.27Å; L105-Y109 WeakPolarHBondContact O-CD2 3.2Å; L105-Y109 PolarHBondContact O-N 3.32Å; G107-Y109 VanDerWaalsContact C-N 3.3Å; G107-Y109 PolarHBondContact O-N 3.36Å; Y109-Q111 PolarHBondContact O-N 3.35Å; Y109-Y142 AromaticContact CD2-CD1 3.67Å; Y109-Y142 HydrophobicContact CD2-CD1 3.67Å; Y109-Y142 AromaticContact CD2-CE1 3.48Å; Y109-Y142 HydrophobicContact CD2-CE1 3.48Å; Y109-Y142 VanDerWaalsContact CD2-CE1 3.48Å; Y109-Y142 AromaticContact CE2-CD1 3.45Å; Y109-Y142 HydrophobicContact CE2-CD1 3.45Å; Y109-Y142 VanDerWaalsContact CE2-CD1 3.45Å; Y109-Y142 AromaticContact CE2-CE1 3.79Å; Y109-Y142 HydrophobicContact CE2-CE1 3.79Å; Y109-Y142 HydrophobicContact CG-CE1 4.41Å; Y109-Y147 HydrophobicContact CE2-CD2 4.33Å; Y109-Y147 HydrophobicContact CE2-CE2 4.06Å; Y109-Y147 VanDerWaalsContact OH-CD2 3.29Å; Y109-Y147 WeakPolarHBondContact OH-CD2 3.45Å; Y109-Y147 WeakPolarHBondContact OH-CE2 3.45Å; Y109-D161 WeakPolarHBondContact CE1-OD2 3.46Å; Y109-D161 VanDerWaalsContact CZ-OD2 3.31Å; Y109-D161 VanDerWaalsContact OH-CG 3.27Å; Y109-D161 PolarHBondContact OH-OD1 2.78Å; Y109-D161 PolarHBondContact OH-OD2 3.43Å; Y109-A163 HydrophobicContact CD1-CB 4.24Å; Y109-A163 HydrophobicContact CD2-CB 4.49Å; Y109-A163 HydrophobicContact CE1-CB 3.69Å; Y109-A163 HydrophobicContact CE2-CB 3.97Å
110	N	96.5	Very high	96.3	Very high	152 Å²	152	66 Å²	66	81%	0.813	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	37.1	-177.8	-54.6	-74.8	0	0	0	113.9	R106 G107	R106-N110 PolarHBondContact O-N 3.24Å; G107-N110 PolarHBondContact O-N 3.29Å
111	Q	96.6	Very high	96.4	Very high	59 Å²	59	64.4 Å²	64.4	28%	0.276	33%	0.334	S	S	.	.			trans	-84.6	149.5	-176.8	-70.3	163.6	-41.2	0	0	112	R106 Y109 H117 Y142 D143	R106-Q111 HydrophobicContact CG-CB 3.73Å; R106-Q111 PolarHBondContact O-N 3.41Å; Y109-Q111 PolarHBondContact O-N 3.35Å; Q111-H117 PolarHBondContact NE2-CE1 3.06Å; Q111-H117 VanDerWaalsContact NE2-CE1 3.29Å; Q111-H117 PolarHBondContact OE1-CE1 3.02Å; Q111-Y142 PolarHBondContact OE1-OH 2.6Å; Q111-D143 PolarHBondContact NE2-OD2 3.46Å
112	S	93.8	Very high	96.4	Very high	77 Å²	77	63 Å²	63	54%	0.538	33%	0.325	S	S	.	.			trans	-66.5	152.6	179.7	56	0	0	0	0	113.5	D114 G115	S112-D114 VanDerWaalsContact C-N 3.31Å; S112-D114 PolarHBondContact O-N 3.46Å; S112-G115 PolarHBondContact O-N 3.15Å
113	E	89.9	Confident	96.4	Very high	130 Å²	130	63.9 Å²	63.9	61%	0.607	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-26.7	-178.7	-60.9	-141.1	103.2	0	0	114.5	P39 R106 G115	P39-E113 WeakPolarHBondContact CB-O 3.12Å; P39-E113 WeakPolarHBondContact CG-O 3.49Å; R106-E113 IonicContact CZ-OE1 3.35Å; R106-E113 IonicContact NH1-OE1 3.55Å; R106-E113 PolarHBondContact NH1-OE1 3.03Å; R106-E113 IonicContact NH2-OE1 3.61Å; R106-E113 PolarHBondContact NH2-OE1 3.35Å; E113-G115 PolarHBondContact O-N 2.83Å
114	D	89.9	Confident	96.6	Very high	144 Å²	144	57.9 Å²	57.9	77%	0.77	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-5.2	-179.4	-54.9	-53.6	0	0	0	113.3	S112	S112-D114 VanDerWaalsContact C-N 3.31Å; S112-D114 PolarHBondContact O-N 3.46Å
115	G	92.4	Very high	96.6	Very high	16 Å²	16	53.1 Å²	53.1	17%	0.165	29%	0.285	C	S	.	.			trans	-72.3	126	178	0	0	0	0	0	113.3	S37 P39 S112 E113 H117	S37-G115 PolarHBondContact OG-O 3.12Å; P39-G115 VanDerWaalsContact CG-O 3.22Å; P39-G115 WeakPolarHBondContact CG-O 3.37Å; S112-G115 PolarHBondContact O-N 3.15Å; E113-G115 PolarHBondContact O-N 2.83Å; G115-H117 PolarHBondContact O-CD2 2.87Å
116	S	96.9	Very high	96.6	Very high	82 Å²	82	53.8 Å²	53.8	57%	0.573	29%	0.289	S	S	*	.			trans	-77.2	125.2	162.1	-174.4	0	0	0	0	108.5	S37	S37-S116 PolarHBondContact O-OG 3.41Å; S37-S116 VanDerWaalsContact O-OG 3.06Å
117	H	98.2	Very high	96.7	Very high	14 Å²	14	51 Å²	51	7%	0.065	28%	0.279	C	S	.	.			trans	-128.7	150.4	-176.3	-65.9	-73.5	0	0	0	110.9	V36 S37 L102 Q111 G115 Y142 D143	V36-H117 CarbonylContact C-O 3.55Å; V36-H117 WeakPolarHBondContact CA-O 3.4Å; S37-H117 PolarHBondContact N-O 3.48Å; S37-H117 PolarHBondContact OG-N 2.85Å; S37-H117 PolarHBondContact OG-O 2.83Å; L102-H117 HydrophobicContact CD2-CB 4.3Å; Q111-H117 PolarHBondContact NE2-CE1 3.06Å; Q111-H117 VanDerWaalsContact NE2-CE1 3.29Å; Q111-H117 PolarHBondContact OE1-CE1 3.02Å; G115-H117 PolarHBondContact O-CD2 2.87Å; H117-Y142 HydrophobicContact CB-CE2 3.87Å; H117-Y142 WeakPolarHBondContact CB-OH 3.11Å; H117-Y142 VanDerWaalsContact CG-OH 3.26Å; H117-Y142 AromaticContact ND1-CZ 3.96Å; H117-Y142 PolarHBondContact ND1-OH 3.32Å; H117-D143 WeakPolarHBondContact CA-OD1 3.45Å; H117-D143 WeakPolarHBondContact CB-OD1 3.31Å; H117-D143 IonicContact CE1-OD2 3.4Å; H117-D143 IonicContact CG-OD1 2.65Å; H117-D143 IonicContact CG-OD2 3.4Å; H117-D143 IonicContact ND1-OD1 2.69Å; H117-D143 PolarHBondContact ND1-OD1 2.94Å; H117-D143 IonicContact ND1-OD2 3.33Å; H117-D143 PolarHBondContact ND1-OD2 3.26Å
118	T	98.6	Very high	96.5	Very high	38 Å²	38	49.4 Å²	49.4	23%	0.233	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	125.4	-177	-56.9	0	0	0	0	110.3	T34 A35 V36 Q120 Y142 D143	T34-T118 HydrophobicContact CG2-CG2 4.05Å; A35-T118 WeakPolarHBondContact O-CA 2.92Å; V36-T118 HydrophobicContact CG2-CG2 4.19Å; T118-Q120 HydrophobicContact CG2-CG 3.84Å; T118-Y142 WeakPolarHBondContact O-CA 3.45Å; T118-Y142 VanDerWaalsContact O-CD2 3.28Å; T118-Y142 WeakPolarHBondContact O-CD2 3.24Å; T118-D143 PolarHBondContact N-OD1 2.91Å; T118-D143 PolarHBondContact O-N 3.21Å
119	L	98.8	Very high	96	Very high	9 Å²	9	51 Å²	51	5%	0.047	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	127.1	167.5	174.4	60	0	0	0	107.8	T34 A35 D98 N101 L102 L105	T34-L119 WeakPolarHBondContact CA-O 3.31Å; A35-L119 HydrophobicContact CB-CB 4.48Å; A35-L119 PolarHBondContact N-O 3.23Å; A35-L119 PolarHBondContact O-N 3.23Å; D98-L119 HydrophobicContact CB-CD2 4.1Å; D98-L119 WeakPolarHBondContact OD1-CD2 3.23Å; N101-L119 HydrophobicContact CB-CD2 3.75Å; L102-L119 HydrophobicContact CD2-CB 3.68Å; L102-L119 HydrophobicContact CG-CB 4.14Å; L105-L119 HydrophobicContact CD1-CD1 3.91Å; L105-L119 HydrophobicContact CD1-CD2 4.15Å; L105-L119 HydrophobicContact CD1-CG 4.47Å
120	Q	98.8	Very high	95.6	Very high	82 Å²	82	52.3 Å²	52.3	38%	0.383	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	145.4	176.1	-59.7	177.1	-99.7	0	0	109.1	D33 T34 T118 S140 A141	D33-Q120 WeakPolarHBondContact O-CA 3.14Å; T34-Q120 HydrophobicContact CG2-CG 4.2Å; T118-Q120 HydrophobicContact CG2-CG 3.84Å; Q120-S140 CarbonylContact O-C 3.53Å; Q120-S140 VanDerWaalsContact O-CA 3.3Å; Q120-S140 WeakPolarHBondContact O-CA 3.28Å; Q120-A141 HydrophobicContact CB-CB 4.41Å; Q120-A141 PolarHBondContact N-O 3.41Å; Q120-A141 PolarHBondContact O-N 3.18Å
121	W	98.6	Very high	95.2	Very high	29 Å²	29	46.1 Å²	46.1	11%	0.11	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	128.3	-179.4	-177.5	40.8	0	0	0	110	F32 D33 Q94 Y123 D138 S140 W180	F32-W121 WeakPolarHBondContact CA-O 3.45Å; D33-W121 HydrophobicContact CB-CB 4.26Å; D33-W121 HydrophobicContact CB-CE3 4.3Å; D33-W121 PolarHBondContact N-O 2.9Å; D33-W121 PolarHBondContact O-N 2.94Å; Q94-W121 VanDerWaalsContact CD-CZ3 3.41Å; Q94-W121 HydrophobicContact CG-CE3 4.29Å; Q94-W121 HydrophobicContact CG-CZ3 4.04Å; W121-Y123 AromaticContact CD2-CD1 3.77Å; W121-Y123 HydrophobicContact CD2-CD1 3.77Å; W121-Y123 HydrophobicContact CD2-CE1 4.29Å; W121-Y123 AromaticContact CE2-CD1 3.69Å; W121-Y123 AromaticContact CE3-CD1 3.8Å; W121-Y123 HydrophobicContact CE3-CD1 3.8Å; W121-Y123 AromaticContact CE3-CE1 3.82Å; W121-Y123 HydrophobicContact CE3-CE1 3.82Å; W121-Y123 AromaticContact CH2-CD1 3.77Å; W121-Y123 HydrophobicContact CH2-CD1 3.77Å; W121-Y123 AromaticContact CH2-CE1 3.86Å; W121-Y123 HydrophobicContact CH2-CE1 3.86Å; W121-Y123 AromaticContact CZ2-CD1 3.71Å; W121-Y123 HydrophobicContact CZ2-CD1 3.71Å; W121-Y123 HydrophobicContact CZ2-CE1 4.29Å; W121-Y123 HydrophobicContact CZ2-CG 4.31Å; W121-Y123 AromaticContact CZ3-CD1 3.79Å; W121-Y123 HydrophobicContact CZ3-CD1 3.79Å; W121-Y123 AromaticContact CZ3-CE1 3.59Å; W121-Y123 HydrophobicContact CZ3-CE1 3.59Å; W121-D138 PolarHBondContact NE1-OD1 2.89Å; W121-S140 VanDerWaalsContact CD1-OG 3.31Å; W121-W180 AromaticContact CH2-CH2 3.43Å; W121-W180 HydrophobicContact CH2-CH2 3.43Å; W121-W180 VanDerWaalsContact CH2-CH2 3.43Å; W121-W180 AromaticContact CH2-CZ2 3.5Å; W121-W180 HydrophobicContact CH2-CZ2 3.5Å; W121-W180 VanDerWaalsContact CH2-CZ2 3.5Å; W121-W180 AromaticContact CZ2-CH2 3.34Å; W121-W180 HydrophobicContact CZ2-CH2 3.34Å; W121-W180 AromaticContact CZ2-CZ2 3.26Å; W121-W180 HydrophobicContact CZ2-CZ2 3.26Å; W121-W180 HydrophobicContact CZ2-CZ3 4.27Å
122	M	98.7	Very high	95	Very high	20 Å²	20	51.4 Å²	51.4	10%	0.099	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	125.8	176.3	-169.1	-76.2	-69	0	0	108.9	R30 Y31 F32 Y137 D138 Q139	R30-M122 HydrophobicContact CB-SD 4.48Å; Y31-M122 WeakPolarHBondContact O-CA 3.39Å; F32-M122 HydrophobicContact CD1-CB 4.07Å; F32-M122 HydrophobicContact CD1-CG 3.53Å; F32-M122 HydrophobicContact CE1-CB 4.28Å; F32-M122 HydrophobicContact CE1-CG 3.35Å; F32-M122 HydrophobicContact CG-CG 4.34Å; F32-M122 HydrophobicContact CZ-CG 4.02Å; M122-Y137 HydrophobicContact CE-CD1 3.88Å; M122-Y137 HydrophobicContact CE-CG 3.98Å; M122-D138 WeakPolarHBondContact O-CA 3.47Å; M122-Q139 HydrophobicContact CB-CG 4.06Å; M122-Q139 HydrophobicContact CE-CG 3.88Å; M122-Q139 PolarHBondContact N-O 3.21Å; M122-Q139 PolarHBondContact O-N 2.9Å
123	Y	98.8	Very high	95.2	Very high	27 Å²	27	50 Å²	50	11%	0.106	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	155	174	67.8	-95	0	0	0	110.7	Y31 W121 Y137 W180 Y183	Y31-Y123 HydrophobicContact CD2-CD2 4.14Å; Y31-Y123 AromaticContact CD2-CE2 3.4Å; Y31-Y123 HydrophobicContact CD2-CE2 3.4Å; Y31-Y123 AromaticContact CD2-CZ 3.83Å; Y31-Y123 HydrophobicContact CE2-CE2 4.17Å; Y31-Y123 HydrophobicContact CG-CE1 4.41Å; Y31-Y123 AromaticContact CG-CE2 3.71Å; Y31-Y123 HydrophobicContact CG-CE2 3.71Å; Y31-Y123 AromaticContact CG-CZ 3.62Å; Y31-Y123 PolarHBondContact N-O 3Å; Y31-Y123 PolarHBondContact O-N 3.06Å; W121-Y123 AromaticContact CD2-CD1 3.77Å; W121-Y123 HydrophobicContact CD2-CD1 3.77Å; W121-Y123 HydrophobicContact CD2-CE1 4.29Å; W121-Y123 AromaticContact CE2-CD1 3.69Å; W121-Y123 AromaticContact CE3-CD1 3.8Å; W121-Y123 HydrophobicContact CE3-CD1 3.8Å; W121-Y123 AromaticContact CE3-CE1 3.82Å; W121-Y123 HydrophobicContact CE3-CE1 3.82Å; W121-Y123 AromaticContact CH2-CD1 3.77Å; W121-Y123 HydrophobicContact CH2-CD1 3.77Å; W121-Y123 AromaticContact CH2-CE1 3.86Å; W121-Y123 HydrophobicContact CH2-CE1 3.86Å; W121-Y123 AromaticContact CZ2-CD1 3.71Å; W121-Y123 HydrophobicContact CZ2-CD1 3.71Å; W121-Y123 HydrophobicContact CZ2-CE1 4.29Å; W121-Y123 HydrophobicContact CZ2-CG 4.31Å; W121-Y123 AromaticContact CZ3-CD1 3.79Å; W121-Y123 HydrophobicContact CZ3-CD1 3.79Å; W121-Y123 AromaticContact CZ3-CE1 3.59Å; W121-Y123 HydrophobicContact CZ3-CE1 3.59Å; Y123-Y137 WeakPolarHBondContact CA-O 3.29Å; Y123-Y137 WeakPolarHBondContact CB-O 3.47Å; Y123-W180 HydrophobicContact CD2-CZ3 4.16Å; Y123-W180 HydrophobicContact CG-CH2 4.41Å; Y123-W180 HydrophobicContact CG-CZ3 4.19Å; Y123-Y183 AromaticContact CD2-CE1 3.92Å; Y123-Y183 HydrophobicContact CD2-CE1 3.92Å; Y123-Y183 HydrophobicContact CE2-CE1 4.12Å
124	G	98.6	Very high	95.5	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	162.8	-178.9	-177.2	0	0	0	0	0	114.7	M29 G136 Y137 L184	M29-G124 CarbonylContact O-C 3.54Å; M29-G124 WeakPolarHBondContact O-CA 3.4Å; G124-G136 CarbonylContact O-C 3.58Å; G124-Y137 PolarHBondContact N-O 3.42Å; G124-Y137 PolarHBondContact O-N 3.43Å; G124-L184 WeakPolarHBondContact O-CD2 3.38Å
125	C	98.5	Very high	95.8	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	147	-178	53.8	0	0	0	0	111.3	S28 M29 L133 R135 C188	S28-C125 CarbonylContact C-O 3.58Å; S28-C125 WeakPolarHBondContact CA-O 3.38Å; M29-C125 PolarHBondContact N-O 2.78Å; M29-C125 PolarHBondContact O-N 2.76Å; C125-L133 HydrophobicContact CB-CD1 3.54Å; C125-R135 WeakPolarHBondContact CA-O 3.09Å; C125-C188 HydrophobicContact CB-CB 3.89Å; C125-C188 WeakPolarHBondContact CB-SG 3.31Å; C125-C188 PolarHBondContact N-SG 2.88Å; C125-C188 WeakPolarHBondContact SG-CB 3.36Å; C125-C188 CovalentContact SG-SG 2.04Å; C125-C188 PolarHBondContact SG-SG 2.76Å
126	D	97.9	Very high	96.1	Very high	22 Å²	22	46.7 Å²	46.7	12%	0.118	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	138	172.2	-59.6	-6.7	0	0	0	108.8	H27 S28 R30 L134 R135 Y137	H27-D126 CarbonylContact O-C 3.55Å; H27-D126 WeakPolarHBondContact O-CA 3.38Å; S28-D126 WeakPolarHBondContact CB-OD1 3.48Å; R30-D126 IonicContact CZ-OD1 2.78Å; R30-D126 VanDerWaalsContact CZ-OD1 3.27Å; R30-D126 IonicContact CZ-OD2 3.62Å; R30-D126 IonicContact NE-OD1 2.67Å; R30-D126 PolarHBondContact NE-OD1 3.15Å; R30-D126 IonicContact NH2-OD1 3.21Å; R30-D126 PolarHBondContact NH2-OD1 3.2Å; R30-D126 IonicContact NH2-OD2 3.38Å; R30-D126 PolarHBondContact NH2-OD2 3.24Å; D126-L134 HydrophobicContact CB-CB 4.49Å; D126-L134 PolarHBondContact O-N 3Å; D126-R135 HydrophobicContact CB-CB 4.43Å; D126-R135 PolarHBondContact N-O 3.48Å; D126-R135 PolarHBondContact O-N 3.31Å; D126-Y137 VanDerWaalsContact OD2-CE2 3.31Å; D126-Y137 WeakPolarHBondContact OD2-CE2 3.36Å; D126-Y137 PolarHBondContact OD2-OH 3.13Å; D126-Y137 VanDerWaalsContact OD2-OH 3.06Å
127	L	96.5	Very high	96.1	Very high	4 Å²	4	44.6 Å²	44.6	2%	0.021	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	136.6	173.7	-55.7	-177.3	0	0	0	110.4	S26 H27 R132 V189 L192 R193 L196	S26-L127 VanDerWaalsContact CA-O 3.24Å; S26-L127 WeakPolarHBondContact CA-O 3.42Å; S26-L127 WeakPolarHBondContact CB-O 3.23Å; H27-L127 PolarHBondContact N-O 2.85Å; H27-L127 PolarHBondContact O-N 3.03Å; L127-R132 CarbonylContact C-O 3.6Å; L127-R132 WeakPolarHBondContact CA-O 3.39Å; L127-V189 HydrophobicContact CD2-CB 4.16Å; L127-V189 HydrophobicContact CD2-CG1 3.79Å; L127-V189 HydrophobicContact CD2-CG2 3.82Å; L127-L192 HydrophobicContact CD1-CB 4.35Å; L127-L192 HydrophobicContact CD1-CD2 3.78Å; L127-L192 HydrophobicContact CD1-CG 3.77Å; L127-L192 HydrophobicContact CD2-CD2 4.47Å; L127-L192 HydrophobicContact CG-CD2 3.61Å; L127-L192 HydrophobicContact CG-CG 4.19Å; L127-R193 HydrophobicContact CD1-CG 3.91Å; L127-L196 HydrophobicContact CD1-CD1 4.45Å
128	G	92.8	Very high	96.1	Very high	8 Å²	8	44 Å²	44	8%	0.082	22%	0.22	C	C	.	.			trans	-71.4	174.7	165.1	0	0	0	0	0	112.1	D130 G131 R132	G128-D130 PolarHBondContact O-N 2.91Å; G128-G131 WeakPolarHBondContact O-CA 3.2Å; G128-G131 PolarHBondContact O-N 2.81Å; G128-R132 PolarHBondContact N-O 2.82Å
129	P	88.2	Confident	96.1	Very high	90 Å²	90	45.9 Å²	45.9	58%	0.584	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-22.7	-179.6	-18.6	30	0	0	0	113.9	A24 G131	A24-P129 HydrophobicContact CB-CB 3.99Å; A24-P129 HydrophobicContact CB-CG 3.27Å; P129-G131 PolarHBondContact O-N 2.72Å
130	D	88.2	Confident	96.1	Very high	96 Å²	96	46.2 Å²	46.2	51%	0.513	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	4.1	172.6	74.8	-17.1	0	0	0	113	G128 R132	G128-D130 PolarHBondContact O-N 2.91Å; D130-R132 VanDerWaalsContact C-N 3.25Å; D130-R132 PolarHBondContact O-N 2.76Å; D130-R132 WeakPolarHBondContact OD1-CB 3.27Å; D130-R132 PolarHBondContact OD1-N 2.77Å; D130-R132 WeakPolarHBondContact OD2-CD 3.29Å; D130-R132 VanDerWaalsContact OD2-CG 3.3Å; D130-R132 WeakPolarHBondContact OD2-CG 3.44Å; D130-R132 IonicContact OD2-CZ 3.24Å; D130-R132 IonicContact OD2-NE 2.72Å; D130-R132 PolarHBondContact OD2-NE 3.31Å; D130-R132 IonicContact OD2-NH1 3.14Å
131	G	88.2	Confident	96.1	Very high	21 Å²	21	43.2 Å²	43.2	22%	0.216	22%	0.218	C	C	.	.	S	Bend	trans	71.3	10.3	-179	0	0	0	0	0	114.5	G128 P129 R193	G128-G131 WeakPolarHBondContact O-CA 3.2Å; G128-G131 PolarHBondContact O-N 2.81Å; P129-G131 PolarHBondContact O-N 2.72Å; G131-R193 VanDerWaalsContact O-CZ 3.28Å; G131-R193 PolarHBondContact O-NE 2.76Å; G131-R193 PolarHBondContact O-NH2 3.21Å
132	R	93.3	Very high	96.1	Very high	170 Å²	170	42.3 Å²	42.3	64%	0.642	22%	0.215	S	C	*	.	S	Bend	trans	-89.8	158	177.3	-60.8	-174.2	-173	156	-2.7	111.5	L127 G128 D130 L134	L127-R132 CarbonylContact C-O 3.6Å; L127-R132 WeakPolarHBondContact CA-O 3.39Å; G128-R132 PolarHBondContact N-O 2.82Å; D130-R132 VanDerWaalsContact C-N 3.25Å; D130-R132 PolarHBondContact O-N 2.76Å; D130-R132 WeakPolarHBondContact OD1-CB 3.27Å; D130-R132 PolarHBondContact OD1-N 2.77Å; D130-R132 WeakPolarHBondContact OD2-CD 3.29Å; D130-R132 VanDerWaalsContact OD2-CG 3.3Å; D130-R132 WeakPolarHBondContact OD2-CG 3.44Å; D130-R132 IonicContact OD2-CZ 3.24Å; D130-R132 IonicContact OD2-NE 2.72Å; D130-R132 PolarHBondContact OD2-NE 3.31Å; D130-R132 IonicContact OD2-NH1 3.14Å; R132-L134 PolarHBondContact O-N 2.68Å; R132-L134 VanDerWaalsContact O-N 3.1Å
133	L	96.6	Very high	96.1	Very high	49 Å²	49	44.4 Å²	44.4	26%	0.257	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57	116.4	173.4	-175.4	72.5	0	0	0	109.9	C125 R135 L154 E185 V189	C125-L133 HydrophobicContact CB-CD1 3.54Å; L133-R135 VanDerWaalsContact CD1-O 3.27Å; L133-R135 WeakPolarHBondContact CD1-O 3.3Å; L133-L154 HydrophobicContact CD2-CD1 4.04Å; L133-E185 HydrophobicContact CD2-CB 4.45Å; L133-E185 HydrophobicContact CD2-CG 3.76Å; L133-V189 HydrophobicContact CB-CG2 4.04Å; L133-V189 HydrophobicContact CD1-CG2 4.15Å
134	L	96.3	Very high	96	Very high	120 Å²	120	45.9 Å²	45.9	63%	0.628	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-87.4	-44.3	170.1	178.2	62.5	0	0	0	110.2	D126 R132	D126-L134 HydrophobicContact CB-CB 4.49Å; D126-L134 PolarHBondContact O-N 3Å; R132-L134 PolarHBondContact O-N 2.68Å; R132-L134 VanDerWaalsContact O-N 3.1Å
135	R	96.8	Very high	96	Very high	93 Å²	93	53.4 Å²	53.4	35%	0.351	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	143.9	-177.7	-171.9	163.5	172	135.1	10.3	111.7	C125 D126 L133 Y137 E152	C125-R135 WeakPolarHBondContact CA-O 3.09Å; D126-R135 HydrophobicContact CB-CB 4.43Å; D126-R135 PolarHBondContact N-O 3.48Å; D126-R135 PolarHBondContact O-N 3.31Å; L133-R135 VanDerWaalsContact CD1-O 3.27Å; L133-R135 WeakPolarHBondContact CD1-O 3.3Å; R135-Y137 HydrophobicContact CB-CE2 4.07Å; R135-Y137 VanDerWaalsContact CD-CZ 3.49Å; R135-Y137 VanDerWaalsContact CD-OH 3.24Å; R135-Y137 WeakPolarHBondContact CD-OH 3.41Å; R135-Y137 HydrophobicContact CG-CD2 4.35Å; R135-Y137 HydrophobicContact CG-CE1 4.32Å; R135-Y137 HydrophobicContact CG-CE2 3.69Å; R135-Y137 PolarHBondContact NE-OH 3.1Å; R135-E152 VanDerWaalsContact CZ-CD 3.43Å; R135-E152 IonicContact CZ-OE1 3.45Å; R135-E152 IonicContact NH1-OE1 2.75Å; R135-E152 PolarHBondContact NH1-OE1 2.9Å; R135-E152 IonicContact NH1-OE2 3.16Å; R135-E152 IonicContact NH2-OE1 3.14Å; R135-E152 PolarHBondContact NH2-OE1 3.44Å
136	G	98.1	Very high	96.1	Very high	6 Å²	6	59.3 Å²	59.3	6%	0.062	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	153.7	170.4	0	0	0	0	0	111.3	G124	G124-G136 CarbonylContact O-C 3.58Å
137	Y	98.4	Very high	96.1	Very high	39 Å²	39	58.6 Å²	58.6	15%	0.153	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	138.6	-178.4	-57.9	-98.8	0	0	0	110.9	R30 M122 Y123 G124 D126 R135	R30-Y137 VanDerWaalsContact NH2-CZ 3.31Å; R30-Y137 PolarHBondContact NH2-OH 3.04Å; M122-Y137 HydrophobicContact CE-CD1 3.88Å; M122-Y137 HydrophobicContact CE-CG 3.98Å; Y123-Y137 WeakPolarHBondContact CA-O 3.29Å; Y123-Y137 WeakPolarHBondContact CB-O 3.47Å; G124-Y137 PolarHBondContact N-O 3.42Å; G124-Y137 PolarHBondContact O-N 3.43Å; D126-Y137 VanDerWaalsContact OD2-CE2 3.31Å; D126-Y137 WeakPolarHBondContact OD2-CE2 3.36Å; D126-Y137 PolarHBondContact OD2-OH 3.13Å; D126-Y137 VanDerWaalsContact OD2-OH 3.06Å; R135-Y137 HydrophobicContact CB-CE2 4.07Å; R135-Y137 VanDerWaalsContact CD-CZ 3.49Å; R135-Y137 VanDerWaalsContact CD-OH 3.24Å; R135-Y137 WeakPolarHBondContact CD-OH 3.41Å; R135-Y137 HydrophobicContact CG-CD2 4.35Å; R135-Y137 HydrophobicContact CG-CE1 4.32Å; R135-Y137 HydrophobicContact CG-CE2 3.69Å; R135-Y137 PolarHBondContact NE-OH 3.1Å
138	D	98.4	Very high	96.2	Very high	1 Å²	1	58.6 Å²	58.6	1%	0.005	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	112.4	160.8	172	-3.1	0	0	0	106	W121 M122 A149 L150 W157 W180	W121-D138 PolarHBondContact NE1-OD1 2.89Å; M122-D138 WeakPolarHBondContact O-CA 3.47Å; D138-A149 CarbonylContact O-C 3.59Å; D138-A149 WeakPolarHBondContact O-CA 3.01Å; D138-L150 HydrophobicContact CB-CB 3.92Å; D138-L150 HydrophobicContact CB-CD2 4.18Å; D138-L150 PolarHBondContact O-N 3.44Å; D138-W157 WeakPolarHBondContact OD2-CH2 3.22Å; D138-W180 HydrophobicContact CB-CD2 4.39Å; D138-W180 HydrophobicContact CB-CE3 4.43Å; D138-W180 VanDerWaalsContact OD2-CD2 3.31Å; D138-W180 PolarHBondContact OD2-NE1 3.28Å
139	Q	98.6	Very high	96.5	Very high	77 Å²	77	59.7 Å²	59.7	36%	0.36	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	132.4	-179.9	62.5	-170.3	68.5	0	0	111.6	M122 I148 A149	M122-Q139 HydrophobicContact CB-CG 4.06Å; M122-Q139 HydrophobicContact CE-CG 3.88Å; M122-Q139 PolarHBondContact N-O 3.21Å; M122-Q139 PolarHBondContact O-N 2.9Å; Q139-I148 WeakPolarHBondContact CA-O 3.29Å; Q139-A149 HydrophobicContact CB-CB 3.82Å
140	S	98.6	Very high	97	Very high	17 Å²	17	56 Å²	56	12%	0.119	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	143.8	178.5	-60	0	0	0	0	111.2	Q120 W121 Y147 I148	Q120-S140 CarbonylContact O-C 3.53Å; Q120-S140 VanDerWaalsContact O-CA 3.3Å; Q120-S140 WeakPolarHBondContact O-CA 3.28Å; W121-S140 VanDerWaalsContact CD1-OG 3.31Å; S140-Y147 WeakPolarHBondContact O-CA 3.36Å; S140-Y147 WeakPolarHBondContact O-CB 3.44Å; S140-Y147 PolarHBondContact O-N 3.08Å; S140-I148 PolarHBondContact N-O 2.78Å; S140-I148 PolarHBondContact O-N 2.94Å
141	A	98.8	Very high	97.5	Very high	18 Å²	18	53.6 Å²	53.6	15%	0.149	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	144.5	173.8	0	0	0	0	0	110.8	Q120 K145	Q120-A141 HydrophobicContact CB-CB 4.41Å; Q120-A141 PolarHBondContact N-O 3.41Å; Q120-A141 PolarHBondContact O-N 3.18Å; A141-K145 CarbonylContact C-O 3.58Å; A141-K145 WeakPolarHBondContact CA-O 3.37Å; A141-K145 VanDerWaalsContact CB-O 3.24Å; A141-K145 WeakPolarHBondContact CB-O 3.3Å
142	Y	98.8	Very high	97.9	Very high	11 Å²	11	59.2 Å²	59.2	4%	0.043	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	130.7	178.5	-173.1	-123.3	0	0	0	110.7	L102 L105 R106 Y109 Q111 H117 T118 G144 K145	L102-Y142 HydrophobicContact CD2-CE2 4.03Å; L105-Y142 HydrophobicContact CB-CD1 4.26Å; L105-Y142 HydrophobicContact CB-CD2 4.24Å; L105-Y142 HydrophobicContact CB-CE1 3.88Å; L105-Y142 HydrophobicContact CB-CE2 3.89Å; L105-Y142 HydrophobicContact CB-CG 4.42Å; L105-Y142 HydrophobicContact CD1-CD2 3.66Å; L105-Y142 HydrophobicContact CD1-CE2 3.96Å; L105-Y142 HydrophobicContact CD1-CG 4.06Å; L105-Y142 HydrophobicContact CG-CD2 4.49Å; R106-Y142 PolarHBondContact N-OH 2.9Å; Y109-Y142 AromaticContact CD2-CD1 3.67Å; Y109-Y142 HydrophobicContact CD2-CD1 3.67Å; Y109-Y142 AromaticContact CD2-CE1 3.48Å; Y109-Y142 HydrophobicContact CD2-CE1 3.48Å; Y109-Y142 VanDerWaalsContact CD2-CE1 3.48Å; Y109-Y142 AromaticContact CE2-CD1 3.45Å; Y109-Y142 HydrophobicContact CE2-CD1 3.45Å; Y109-Y142 VanDerWaalsContact CE2-CD1 3.45Å; Y109-Y142 AromaticContact CE2-CE1 3.79Å; Y109-Y142 HydrophobicContact CE2-CE1 3.79Å; Y109-Y142 HydrophobicContact CG-CE1 4.41Å; Q111-Y142 PolarHBondContact OE1-OH 2.6Å; H117-Y142 HydrophobicContact CB-CE2 3.87Å; H117-Y142 WeakPolarHBondContact CB-OH 3.11Å; H117-Y142 VanDerWaalsContact CG-OH 3.26Å; H117-Y142 AromaticContact ND1-CZ 3.96Å; H117-Y142 PolarHBondContact ND1-OH 3.32Å; T118-Y142 WeakPolarHBondContact O-CA 3.45Å; T118-Y142 VanDerWaalsContact O-CD2 3.28Å; T118-Y142 WeakPolarHBondContact O-CD2 3.24Å; Y142-G144 PolarHBondContact O-N 3.07Å; Y142-G144 VanDerWaalsContact O-N 3.15Å; Y142-K145 PolarHBondContact N-O 2.95Å; Y142-K145 PolarHBondContact O-N 3.29Å
143	D	98.2	Very high	98.1	Very high	64 Å²	64	54.7 Å²	54.7	34%	0.342	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.3	39.7	-174.2	-65.6	-21.9	0	0	0	113.4	Q111 H117 T118	Q111-D143 PolarHBondContact NE2-OD2 3.46Å; H117-D143 WeakPolarHBondContact CA-OD1 3.45Å; H117-D143 WeakPolarHBondContact CB-OD1 3.31Å; H117-D143 IonicContact CE1-OD2 3.4Å; H117-D143 IonicContact CG-OD1 2.65Å; H117-D143 IonicContact CG-OD2 3.4Å; H117-D143 IonicContact ND1-OD1 2.69Å; H117-D143 PolarHBondContact ND1-OD1 2.94Å; H117-D143 IonicContact ND1-OD2 3.33Å; H117-D143 PolarHBondContact ND1-OD2 3.26Å; T118-D143 PolarHBondContact N-OD1 2.91Å; T118-D143 PolarHBondContact O-N 3.21Å
144	G	97.5	Very high	98.2	Very high	57 Å²	57	52.9 Å²	52.9	59%	0.588	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	78	13.8	178.2	0	0	0	0	0	115.4	Y142	Y142-G144 PolarHBondContact O-N 3.07Å; Y142-G144 VanDerWaalsContact O-N 3.15Å
145	K	98.5	Very high	98.2	Very high	158 Å²	158	55.1 Å²	55.1	69%	0.687	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.2	146.9	176.6	-61.2	179	-176.6	176.8	0	110.8	A141 Y142 Y147	A141-K145 CarbonylContact C-O 3.58Å; A141-K145 WeakPolarHBondContact CA-O 3.37Å; A141-K145 VanDerWaalsContact CB-O 3.24Å; A141-K145 WeakPolarHBondContact CB-O 3.3Å; Y142-K145 PolarHBondContact N-O 2.95Å; Y142-K145 PolarHBondContact O-N 3.29Å; K145-Y147 PolarHBondContact O-N 2.91Å
146	D	98.7	Very high	98.3	Very high	124 Å²	124	52.7 Å²	52.7	66%	0.663	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-53.6	137.5	174.5	-62.3	-29.3	0	0	0	111.1	A160	D146-A160 HydrophobicContact CB-CB 4.3Å; D146-A160 WeakPolarHBondContact O-CB 3.36Å
147	Y	98.8	Very high	98.3	Very high	8 Å²	8	52.8 Å²	52.8	3%	0.031	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	-63.5	178	-180	-106.3	0	0	0	110.1	L105 Y109 S140 K145 A160 A163 A164 T167	L105-Y147 HydrophobicContact CD2-CD1 4.4Å; L105-Y147 HydrophobicContact CD2-CD2 4.06Å; L105-Y147 HydrophobicContact CD2-CE1 3.82Å; L105-Y147 HydrophobicContact CD2-CE2 3.42Å; L105-Y147 VanDerWaalsContact CD2-CE2 3.42Å; L105-Y147 WeakPolarHBondContact CD2-OH 3.2Å; Y109-Y147 HydrophobicContact CE2-CD2 4.33Å; Y109-Y147 HydrophobicContact CE2-CE2 4.06Å; Y109-Y147 VanDerWaalsContact OH-CD2 3.29Å; Y109-Y147 WeakPolarHBondContact OH-CD2 3.45Å; Y109-Y147 WeakPolarHBondContact OH-CE2 3.45Å; S140-Y147 WeakPolarHBondContact O-CA 3.36Å; S140-Y147 WeakPolarHBondContact O-CB 3.44Å; S140-Y147 PolarHBondContact O-N 3.08Å; K145-Y147 PolarHBondContact O-N 2.91Å; Y147-A160 WeakPolarHBondContact O-CB 3.46Å; Y147-A160 PolarHBondContact O-N 2.9Å; Y147-A163 HydrophobicContact CE2-CB 4.43Å; Y147-A163 PolarHBondContact OH-O 3Å; Y147-A164 HydrophobicContact CD2-CB 3.88Å; Y147-A164 HydrophobicContact CE1-CB 4.43Å; Y147-A164 HydrophobicContact CE2-CB 3.77Å; Y147-A164 HydrophobicContact CG-CB 4.27Å; Y147-A164 WeakPolarHBondContact O-CB 3.23Å; Y147-T167 HydrophobicContact CE1-CG2 4.25Å; Y147-T167 PolarHBondContact OH-OG1 3.49Å
148	I	98.8	Very high	98.4	Very high	3 Å²	3	54.7 Å²	54.7	2%	0.015	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	142.4	178.7	-160.9	172	0	0	0	110.4	Q139 S140 W157 T158 T167 Q168 W171	Q139-I148 WeakPolarHBondContact CA-O 3.29Å; S140-I148 PolarHBondContact N-O 2.78Å; S140-I148 PolarHBondContact O-N 2.94Å; I148-W157 HydrophobicContact CD1-CB 4.2Å; I148-W157 HydrophobicContact CD1-CD2 4.44Å; I148-W157 HydrophobicContact CD1-CE3 4.29Å; I148-W157 HydrophobicContact CD1-CG 4.43Å; I148-W157 HydrophobicContact CG1-CB 4.28Å; I148-W157 HydrophobicContact CG1-CE3 4.14Å; I148-T158 WeakPolarHBondContact CA-O 3.3Å; I148-T158 WeakPolarHBondContact CG1-O 3.01Å; I148-T167 HydrophobicContact CD1-CG2 3.99Å; I148-Q168 HydrophobicContact CD1-CB 3.92Å; I148-W171 HydrophobicContact CD1-CE3 3.91Å; I148-W171 HydrophobicContact CD1-CZ3 4.19Å; I148-W171 HydrophobicContact CG2-CE3 4.38Å; I148-W171 HydrophobicContact CG2-CH2 4.01Å; I148-W171 HydrophobicContact CG2-CZ3 3.61Å
149	A	98.8	Very high	98.4	Very high	31 Å²	31	55.6 Å²	55.6	26%	0.256	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	142.2	176.9	0	0	0	0	0	111.6	D138 Q139 W157 T158	D138-A149 CarbonylContact O-C 3.59Å; D138-A149 WeakPolarHBondContact O-CA 3.01Å; Q139-A149 HydrophobicContact CB-CB 3.82Å; A149-W157 CarbonylContact O-C 3.58Å; A149-W157 WeakPolarHBondContact O-CA 3.21Å; A149-T158 PolarHBondContact N-O 2.92Å; A149-T158 PolarHBondContact O-N 3.39Å
150	L	98.8	Very high	98.4	Very high	14 Å²	14	54.9 Å²	54.9	7%	0.073	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	129.4	168.3	-175.2	64.5	0	0	0	108.5	D138 L154 W157 A177 W180 L184	D138-L150 HydrophobicContact CB-CB 3.92Å; D138-L150 HydrophobicContact CB-CD2 4.18Å; D138-L150 PolarHBondContact O-N 3.44Å; L150-L154 HydrophobicContact CD2-CD2 3.8Å; L150-L154 HydrophobicContact CG-CD2 4.27Å; L150-W157 HydrophobicContact CB-CE3 3.95Å; L150-W157 HydrophobicContact CB-CH2 4.05Å; L150-W157 HydrophobicContact CB-CZ3 3.59Å; L150-W157 HydrophobicContact CD1-CD2 4.19Å; L150-W157 HydrophobicContact CD1-CE3 4.27Å; L150-W157 HydrophobicContact CD1-CH2 4.02Å; L150-W157 HydrophobicContact CD1-CZ2 3.94Å; L150-W157 HydrophobicContact CD1-CZ3 4.18Å; L150-W157 HydrophobicContact CG-CH2 4.49Å; L150-W157 HydrophobicContact CG-CZ3 4.44Å; L150-A177 HydrophobicContact CD1-CB 3.9Å; L150-W180 HydrophobicContact CD2-CB 3.95Å; L150-L184 HydrophobicContact CD2-CD1 3.9Å
151	N	98.6	Very high	98.3	Very high	45 Å²	45	56.6 Å²	56.6	24%	0.241	31%	0.314	C	S	.	.			trans	-74.6	162.6	179.9	-66.4	-29	0	0	0	111.3	D153 L154 S156 T158	N151-D153 PolarHBondContact O-N 2.65Å; N151-L154 PolarHBondContact O-N 2.87Å; N151-S156 WeakPolarHBondContact CB-O 3.34Å; N151-S156 PolarHBondContact N-O 2.86Å; N151-S156 PolarHBondContact ND2-O 3.48Å; N151-S156 PolarHBondContact ND2-OG 3.4Å; N151-T158 PolarHBondContact ND2-OG1 2.9Å; N151-T158 WeakPolarHBondContact OD1-CB 3.49Å; N151-T158 PolarHBondContact OD1-OG1 3.38Å
152	E	97.4	Very high	98.3	Very high	138 Å²	138	61 Å²	61	65%	0.645	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-18.1	-179.3	-62.8	177.9	-161.6	0	0	113.8	R135 L154	R135-E152 VanDerWaalsContact CZ-CD 3.43Å; R135-E152 IonicContact CZ-OE1 3.45Å; R135-E152 IonicContact NH1-OE1 2.75Å; R135-E152 PolarHBondContact NH1-OE1 2.9Å; R135-E152 IonicContact NH1-OE2 3.16Å; R135-E152 IonicContact NH2-OE1 3.14Å; R135-E152 PolarHBondContact NH2-OE1 3.44Å; E152-L154 PolarHBondContact O-N 2.87Å
153	D	97.3	Very high	98.3	Very high	75 Å²	75	60.8 Å²	60.8	40%	0.401	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-9.6	173.5	71.2	0.2	0	0	0	114	N151 R155 S156	N151-D153 PolarHBondContact O-N 2.65Å; D153-R155 WeakPolarHBondContact O-CG 3.45Å; D153-R155 PolarHBondContact O-N 3.09Å; D153-R155 PolarHBondContact OD1-N 2.88Å; D153-S156 VanDerWaalsContact CG-OG 3.24Å; D153-S156 PolarHBondContact OD1-N 2.82Å; D153-S156 PolarHBondContact OD1-OG 2.89Å; D153-S156 WeakPolarHBondContact OD2-CB 3.45Å; D153-S156 PolarHBondContact OD2-OG 2.84Å
154	L	97.9	Very high	98.3	Very high	11 Å²	11	57.7 Å²	57.7	6%	0.058	32%	0.323	C	S	.	.	S	Bend	trans	52.3	32.8	-173.4	-53	-178.5	0	0	0	113.3	L133 L150 N151 E152 R181 L184 E185	L133-L154 HydrophobicContact CD2-CD1 4.04Å; L150-L154 HydrophobicContact CD2-CD2 3.8Å; L150-L154 HydrophobicContact CG-CD2 4.27Å; N151-L154 PolarHBondContact O-N 2.87Å; E152-L154 PolarHBondContact O-N 2.87Å; L154-R181 HydrophobicContact CB-CB 4.03Å; L154-R181 HydrophobicContact CB-CG 3.82Å; L154-R181 HydrophobicContact CD1-CG 4.2Å; L154-R181 WeakPolarHBondContact O-CD 3.42Å; L154-L184 HydrophobicContact CD2-CD1 3.97Å; L154-E185 HydrophobicContact CD1-CG 4.31Å
155	R	97.6	Very high	98.4	Very high	168 Å²	168	58.5 Å²	58.5	63%	0.634	31%	0.311	S	S	*	.	S	Bend	trans	-139.4	-33.1	-174.1	-68.6	167.8	-166.5	-145.1	3.8	113.6	D153 A177	D153-R155 WeakPolarHBondContact O-CG 3.45Å; D153-R155 PolarHBondContact O-N 3.09Å; D153-R155 PolarHBondContact OD1-N 2.88Å; R155-A177 WeakPolarHBondContact O-CB 3.42Å
156	S	98	Very high	98.3	Very high	41 Å²	41	53.8 Å²	53.8	29%	0.287	29%	0.293	S	S	.	.			trans	-115	159.7	-177.7	62.5	0	0	0	0	111.8	N151 D153	N151-S156 WeakPolarHBondContact CB-O 3.34Å; N151-S156 PolarHBondContact N-O 2.86Å; N151-S156 PolarHBondContact ND2-O 3.48Å; N151-S156 PolarHBondContact ND2-OG 3.4Å; D153-S156 VanDerWaalsContact CG-OG 3.24Å; D153-S156 PolarHBondContact OD1-N 2.82Å; D153-S156 PolarHBondContact OD1-OG 2.89Å; D153-S156 WeakPolarHBondContact OD2-CB 3.45Å; D153-S156 PolarHBondContact OD2-OG 2.84Å
157	W	98.7	Very high	98.3	Very high	9 Å²	9	48.8 Å²	48.8	3%	0.034	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	143.3	-178.5	-60.6	93.6	0	0	0	110.8	D138 I148 A149 L150 Q168 W171 E176 A177	D138-W157 WeakPolarHBondContact OD2-CH2 3.22Å; I148-W157 HydrophobicContact CD1-CB 4.2Å; I148-W157 HydrophobicContact CD1-CD2 4.44Å; I148-W157 HydrophobicContact CD1-CE3 4.29Å; I148-W157 HydrophobicContact CD1-CG 4.43Å; I148-W157 HydrophobicContact CG1-CB 4.28Å; I148-W157 HydrophobicContact CG1-CE3 4.14Å; A149-W157 CarbonylContact O-C 3.58Å; A149-W157 WeakPolarHBondContact O-CA 3.21Å; L150-W157 HydrophobicContact CB-CE3 3.95Å; L150-W157 HydrophobicContact CB-CH2 4.05Å; L150-W157 HydrophobicContact CB-CZ3 3.59Å; L150-W157 HydrophobicContact CD1-CD2 4.19Å; L150-W157 HydrophobicContact CD1-CE3 4.27Å; L150-W157 HydrophobicContact CD1-CH2 4.02Å; L150-W157 HydrophobicContact CD1-CZ2 3.94Å; L150-W157 HydrophobicContact CD1-CZ3 4.18Å; L150-W157 HydrophobicContact CG-CH2 4.49Å; L150-W157 HydrophobicContact CG-CZ3 4.44Å; W157-Q168 HydrophobicContact CB-CG 4.19Å; W157-Q168 PolarHBondContact O-NE2 2.78Å; W157-W171 AromaticContact CD2-CE3 3.9Å; W157-W171 HydrophobicContact CD2-CE3 3.9Å; W157-W171 HydrophobicContact CD2-CZ3 4.44Å; W157-W171 AromaticContact CE2-CE3 3.8Å; W157-W171 AromaticContact CE3-CE3 3.78Å; W157-W171 HydrophobicContact CE3-CE3 3.78Å; W157-W171 AromaticContact CE3-CZ3 3.86Å; W157-W171 HydrophobicContact CE3-CZ3 3.86Å; W157-W171 AromaticContact CH2-CE3 3.55Å; W157-W171 HydrophobicContact CH2-CE3 3.55Å; W157-W171 AromaticContact CH2-CZ3 3.54Å; W157-W171 HydrophobicContact CH2-CZ3 3.54Å; W157-W171 HydrophobicContact CZ2-CD2 4.45Å; W157-W171 AromaticContact CZ2-CE3 3.64Å; W157-W171 HydrophobicContact CZ2-CE3 3.64Å; W157-W171 HydrophobicContact CZ2-CZ3 4.13Å; W157-W171 AromaticContact CZ3-CE3 3.62Å; W157-W171 HydrophobicContact CZ3-CE3 3.62Å; W157-W171 AromaticContact CZ3-CZ3 3.37Å; W157-W171 HydrophobicContact CZ3-CZ3 3.37Å; W157-E176 HydrophobicContact CZ2-CB 4.28Å; W157-A177 HydrophobicContact CZ2-CB 4.18Å
158	T	98.7	Very high	98.3	Very high	78 Å²	78	50.2 Å²	50.2	48%	0.479	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	118	165.4	-67.2	0	0	0	0	108.9	I148 A149 N151	I148-T158 WeakPolarHBondContact CA-O 3.3Å; I148-T158 WeakPolarHBondContact CG1-O 3.01Å; A149-T158 PolarHBondContact N-O 2.92Å; A149-T158 PolarHBondContact O-N 3.39Å; N151-T158 PolarHBondContact ND2-OG1 2.9Å; N151-T158 WeakPolarHBondContact OD1-CB 3.49Å; N151-T158 PolarHBondContact OD1-OG1 3.38Å
159	A	98.7	Very high	98.3	Very high	21 Å²	21	57.2 Å²	57.2	17%	0.174	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	129.4	174.3	0	0	0	0	0	110.2	A164 Q165 Q168	A159-A164 HydrophobicContact CB-CB 3.68Å; A159-Q165 HydrophobicContact CB-CG 3.99Å; A159-Q168 HydrophobicContact CB-CB 4.35Å; A159-Q168 VanDerWaalsContact CB-OE1 3.31Å
160	A	98.5	Very high	98.3	Very high	62 Å²	62	61.3 Å²	61.3	51%	0.512	31%	0.312	S	S	.	.	S	Bend	trans	-72.4	-30.4	-176.5	0	0	0	0	0	113.5	D146 Y147	D146-A160 HydrophobicContact CB-CB 4.3Å; D146-A160 WeakPolarHBondContact O-CB 3.36Å; Y147-A160 WeakPolarHBondContact O-CB 3.46Å; Y147-A160 PolarHBondContact O-N 2.9Å
161	D	98.3	Very high	98.3	Very high	52 Å²	52	63.7 Å²	63.7	28%	0.278	32%	0.32	S	S	.	.	S	Bend	trans	-149.6	-174.4	-178.6	70	30.7	0	0	0	113.9	Y109 A163 A164 Q165	Y109-D161 WeakPolarHBondContact CE1-OD2 3.46Å; Y109-D161 VanDerWaalsContact CZ-OD2 3.31Å; Y109-D161 VanDerWaalsContact OH-CG 3.27Å; Y109-D161 PolarHBondContact OH-OD1 2.78Å; Y109-D161 PolarHBondContact OH-OD2 3.43Å; D161-A163 VanDerWaalsContact C-N 3.33Å; D161-A163 PolarHBondContact O-N 2.95Å; D161-A163 WeakPolarHBondContact OD1-CA 3.35Å; D161-A163 WeakPolarHBondContact OD1-CB 3.44Å; D161-A163 PolarHBondContact OD1-N 3.4Å; D161-A164 PolarHBondContact O-N 3.05Å; D161-A164 PolarHBondContact OD1-N 3.37Å; D161-Q165 WeakPolarHBondContact O-CG 3.34Å; D161-Q165 PolarHBondContact O-N 2.97Å
162	T	98.2	Very high	98.3	Very high	112 Å²	112	65.9 Å²	65.9	69%	0.687	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-23.8	-178.5	54.3	0	0	0	0	114.4
163	A	98.1	Very high	98.3	Very high	5 Å²	5	63.5 Å²	63.5	4%	0.041	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-43.3	172.8	0	0	0	0	0	110.2	Y108 Y109 Y147 D161 Q165 I166	Y108-A163 HydrophobicContact CD2-CB 4.41Å; Y109-A163 HydrophobicContact CD1-CB 4.24Å; Y109-A163 HydrophobicContact CD2-CB 4.49Å; Y109-A163 HydrophobicContact CE1-CB 3.69Å; Y109-A163 HydrophobicContact CE2-CB 3.97Å; Y147-A163 HydrophobicContact CE2-CB 4.43Å; Y147-A163 PolarHBondContact OH-O 3Å; D161-A163 VanDerWaalsContact C-N 3.33Å; D161-A163 PolarHBondContact O-N 2.95Å; D161-A163 WeakPolarHBondContact OD1-CA 3.35Å; D161-A163 WeakPolarHBondContact OD1-CB 3.44Å; D161-A163 PolarHBondContact OD1-N 3.4Å; A163-Q165 VanDerWaalsContact C-N 3.27Å; A163-Q165 PolarHBondContact O-N 3.26Å; A163-I166 VanDerWaalsContact O-CB 3.23Å; A163-I166 WeakPolarHBondContact O-CB 3.41Å; A163-I166 PolarHBondContact O-N 2.83Å
164	A	98.5	Very high	98.3	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-58.4	-36.7	173	0	0	0	0	0	113	Y147 A159 D161 I166 T167 Q168	Y147-A164 HydrophobicContact CD2-CB 3.88Å; Y147-A164 HydrophobicContact CE1-CB 4.43Å; Y147-A164 HydrophobicContact CE2-CB 3.77Å; Y147-A164 HydrophobicContact CG-CB 4.27Å; Y147-A164 WeakPolarHBondContact O-CB 3.23Å; A159-A164 HydrophobicContact CB-CB 3.68Å; D161-A164 PolarHBondContact O-N 3.05Å; D161-A164 PolarHBondContact OD1-N 3.37Å; A164-I166 PolarHBondContact O-N 3.01Å; A164-I166 VanDerWaalsContact O-N 3.16Å; A164-T167 WeakPolarHBondContact O-CA 3.42Å; A164-T167 WeakPolarHBondContact O-CB 3.3Å; A164-T167 PolarHBondContact O-N 3.03Å; A164-Q168 PolarHBondContact O-N 2.88Å
165	Q	98.7	Very high	98.3	Very high	73 Å²	73	69.2 Å²	69.2	34%	0.341	36%	0.359	S	S	.	.	H	α-helix	trans	-58.5	-25.3	172.4	-73.6	175.4	20.4	0	0	113.6	A159 D161 A163 R169	A159-Q165 HydrophobicContact CB-CG 3.99Å; D161-Q165 WeakPolarHBondContact O-CG 3.34Å; D161-Q165 PolarHBondContact O-N 2.97Å; A163-Q165 VanDerWaalsContact C-N 3.27Å; A163-Q165 PolarHBondContact O-N 3.26Å; Q165-R169 VanDerWaalsContact O-CG 3.29Å; Q165-R169 WeakPolarHBondContact O-CG 3.42Å; Q165-R169 PolarHBondContact O-N 3.28Å; Q165-R169 VanDerWaalsContact OE1-NH2 3.1Å
166	I	98.3	Very high	98.4	Very high	60 Å²	60	63.6 Å²	63.6	31%	0.308	34%	0.34	S	S	.	.	H	α-helix	trans	-71.3	-38.3	174	-53.8	172.2	0	0	0	110.3	Y108 A163 A164 K170	Y108-I166 HydrophobicContact CD1-CD1 4.27Å; Y108-I166 HydrophobicContact CD2-CD1 4.45Å; Y108-I166 HydrophobicContact CE1-CG2 4.12Å; Y108-I166 HydrophobicContact CE2-CB 4.11Å; Y108-I166 HydrophobicContact CE2-CG2 4.11Å; Y108-I166 HydrophobicContact CG-CD1 4.23Å; A163-I166 VanDerWaalsContact O-CB 3.23Å; A163-I166 WeakPolarHBondContact O-CB 3.41Å; A163-I166 PolarHBondContact O-N 2.83Å; A164-I166 PolarHBondContact O-N 3.01Å; A164-I166 VanDerWaalsContact O-N 3.16Å; I166-K170 WeakPolarHBondContact O-CD 3.39Å; I166-K170 VanDerWaalsContact O-CG 3.32Å; I166-K170 WeakPolarHBondContact O-CG 3.34Å
167	T	98.3	Very high	98.4	Very high	18 Å²	18	62 Å²	62	11%	0.11	33%	0.329	C	S	.	.	H	α-helix	trans	-68.9	-47.8	172.4	-70.5	0	0	0	0	110.8	Y147 I148 A164 R169 K170 W171	Y147-T167 HydrophobicContact CE1-CG2 4.25Å; Y147-T167 PolarHBondContact OH-OG1 3.49Å; I148-T167 HydrophobicContact CD1-CG2 3.99Å; A164-T167 WeakPolarHBondContact O-CA 3.42Å; A164-T167 WeakPolarHBondContact O-CB 3.3Å; A164-T167 PolarHBondContact O-N 3.03Å; T167-R169 PolarHBondContact O-N 3.12Å; T167-K170 WeakPolarHBondContact O-CA 3.46Å; T167-K170 WeakPolarHBondContact O-CB 3.35Å; T167-K170 PolarHBondContact O-N 2.81Å; T167-W171 HydrophobicContact CG2-CD2 3.57Å; T167-W171 HydrophobicContact CG2-CE3 3.97Å; T167-W171 HydrophobicContact CG2-CG 4.02Å; T167-W171 HydrophobicContact CG2-CH2 4.28Å; T167-W171 HydrophobicContact CG2-CZ2 3.89Å; T167-W171 HydrophobicContact CG2-CZ3 4.3Å; T167-W171 PolarHBondContact O-N 3.38Å
168	Q	98.6	Very high	98.3	Very high	39 Å²	39	66.4 Å²	66.4	18%	0.182	35%	0.35	C	S	.	.	H	α-helix	trans	-49.4	-55.4	178.2	174.5	172.4	10.8	0	0	112	I148 W157 A159 A164 K170 W171 E172	I148-Q168 HydrophobicContact CD1-CB 3.92Å; W157-Q168 HydrophobicContact CB-CG 4.19Å; W157-Q168 PolarHBondContact O-NE2 2.78Å; A159-Q168 HydrophobicContact CB-CB 4.35Å; A159-Q168 VanDerWaalsContact CB-OE1 3.31Å; A164-Q168 PolarHBondContact O-N 2.88Å; Q168-K170 PolarHBondContact O-N 3.44Å; Q168-W171 PolarHBondContact O-N 3.12Å; Q168-W171 VanDerWaalsContact O-N 3.08Å; Q168-E172 VanDerWaalsContact CG-CD 3.49Å; Q168-E172 HydrophobicContact CG-CG 4.24Å; Q168-E172 WeakPolarHBondContact CG-OE1 3.41Å; Q168-E172 PolarHBondContact NE2-OE1 3.22Å; Q168-E172 WeakPolarHBondContact O-CB 3.38Å; Q168-E172 WeakPolarHBondContact O-CG 2.97Å; Q168-E172 PolarHBondContact O-N 2.66Å
169	R	98.6	Very high	98.3	Very high	150 Å²	150	68.4 Å²	68.4	57%	0.566	35%	0.354	S	S	*	.	H	α-helix	trans	-60.1	-31.7	-179.3	-67	169.4	-162.8	152	10.9	113.1	Q165 T167 A173	Q165-R169 VanDerWaalsContact O-CG 3.29Å; Q165-R169 WeakPolarHBondContact O-CG 3.42Å; Q165-R169 PolarHBondContact O-N 3.28Å; Q165-R169 VanDerWaalsContact OE1-NH2 3.1Å; T167-R169 PolarHBondContact O-N 3.12Å; R169-A173 VanDerWaalsContact O-CB 3.28Å; R169-A173 WeakPolarHBondContact O-CB 3.5Å; R169-A173 PolarHBondContact O-N 2.88Å; R169-A173 VanDerWaalsContact O-N 3.16Å
170	K	98.2	Very high	98.3	Very high	116 Å²	116	69.8 Å²	69.8	50%	0.504	36%	0.355	S	S	.	.	H	α-helix	trans	-73	-42.3	176	-71.3	172.4	-177.6	-179.7	0	111.3	Y108 I166 T167 Q168 A173 A174	Y108-K170 PolarHBondContact OH-NZ 2.91Å; I166-K170 WeakPolarHBondContact O-CD 3.39Å; I166-K170 VanDerWaalsContact O-CG 3.32Å; I166-K170 WeakPolarHBondContact O-CG 3.34Å; T167-K170 WeakPolarHBondContact O-CA 3.46Å; T167-K170 WeakPolarHBondContact O-CB 3.35Å; T167-K170 PolarHBondContact O-N 2.81Å; Q168-K170 PolarHBondContact O-N 3.44Å; K170-A173 PolarHBondContact O-N 2.96Å; K170-A174 WeakPolarHBondContact O-CB 3.46Å; K170-A174 PolarHBondContact O-N 2.87Å
171	W	98.3	Very high	98.3	Very high	64 Å²	64	70.4 Å²	70.4	24%	0.242	34%	0.344	C	S	.	.	H	α-helix	trans	-71.3	-35.7	179.2	-73.7	-0.1	0	0	0	112.9	I148 W157 T167 Q168 A174 R175 E176	I148-W171 HydrophobicContact CD1-CE3 3.91Å; I148-W171 HydrophobicContact CD1-CZ3 4.19Å; I148-W171 HydrophobicContact CG2-CE3 4.38Å; I148-W171 HydrophobicContact CG2-CH2 4.01Å; I148-W171 HydrophobicContact CG2-CZ3 3.61Å; W157-W171 AromaticContact CD2-CE3 3.9Å; W157-W171 HydrophobicContact CD2-CE3 3.9Å; W157-W171 HydrophobicContact CD2-CZ3 4.44Å; W157-W171 AromaticContact CE2-CE3 3.8Å; W157-W171 AromaticContact CE3-CE3 3.78Å; W157-W171 HydrophobicContact CE3-CE3 3.78Å; W157-W171 AromaticContact CE3-CZ3 3.86Å; W157-W171 HydrophobicContact CE3-CZ3 3.86Å; W157-W171 AromaticContact CH2-CE3 3.55Å; W157-W171 HydrophobicContact CH2-CE3 3.55Å; W157-W171 AromaticContact CH2-CZ3 3.54Å; W157-W171 HydrophobicContact CH2-CZ3 3.54Å; W157-W171 HydrophobicContact CZ2-CD2 4.45Å; W157-W171 AromaticContact CZ2-CE3 3.64Å; W157-W171 HydrophobicContact CZ2-CE3 3.64Å; W157-W171 HydrophobicContact CZ2-CZ3 4.13Å; W157-W171 AromaticContact CZ3-CE3 3.62Å; W157-W171 HydrophobicContact CZ3-CE3 3.62Å; W157-W171 AromaticContact CZ3-CZ3 3.37Å; W157-W171 HydrophobicContact CZ3-CZ3 3.37Å; T167-W171 HydrophobicContact CG2-CD2 3.57Å; T167-W171 HydrophobicContact CG2-CE3 3.97Å; T167-W171 HydrophobicContact CG2-CG 4.02Å; T167-W171 HydrophobicContact CG2-CH2 4.28Å; T167-W171 HydrophobicContact CG2-CZ2 3.89Å; T167-W171 HydrophobicContact CG2-CZ3 4.3Å; T167-W171 PolarHBondContact O-N 3.38Å; Q168-W171 PolarHBondContact O-N 3.12Å; Q168-W171 VanDerWaalsContact O-N 3.08Å; W171-A174 CarbonylContact O-C 3.56Å; W171-A174 PolarHBondContact O-N 2.92Å; W171-R175 WeakPolarHBondContact O-CA 3.35Å; W171-R175 PolarHBondContact O-N 3.05Å; W171-E176 HydrophobicContact CB-CB 4.04Å; W171-E176 HydrophobicContact CB-CG 3.83Å; W171-E176 HydrophobicContact CG-CB 4.21Å; W171-E176 HydrophobicContact CG-CG 3.81Å; W171-E176 PolarHBondContact O-N 3.04Å
172	E	98.5	Very high	98.3	Very high	91 Å²	91	71 Å²	71	43%	0.425	36%	0.356	S	S	.	.	H	α-helix	trans	-63.5	-47.9	170.1	-71.6	168.1	168.9	0	0	111.1	Q168 A174 R175	Q168-E172 VanDerWaalsContact CG-CD 3.49Å; Q168-E172 HydrophobicContact CG-CG 4.24Å; Q168-E172 WeakPolarHBondContact CG-OE1 3.41Å; Q168-E172 PolarHBondContact NE2-OE1 3.22Å; Q168-E172 WeakPolarHBondContact O-CB 3.38Å; Q168-E172 WeakPolarHBondContact O-CG 2.97Å; Q168-E172 PolarHBondContact O-N 2.66Å; E172-A174 VanDerWaalsContact C-N 3.29Å; E172-A174 PolarHBondContact O-N 3.37Å; E172-R175 PolarHBondContact O-N 2.98Å; E172-R175 VanDerWaalsContact O-N 3.1Å
173	A	98.4	Very high	98.3	Very high	88 Å²	88	68 Å²	68	73%	0.727	33%	0.333	S	S	*	.	H	α-helix	trans	-63.8	-31.4	177.1	0	0	0	0	0	113.5	R169 K170	R169-A173 VanDerWaalsContact O-CB 3.28Å; R169-A173 WeakPolarHBondContact O-CB 3.5Å; R169-A173 PolarHBondContact O-N 2.88Å; R169-A173 VanDerWaalsContact O-N 3.16Å; K170-A173 PolarHBondContact O-N 2.96Å
174	A	98.1	Very high	98.3	Very high	51 Å²	51	67.8 Å²	67.8	42%	0.421	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-3.3	175.1	0	0	0	0	0	114.1	K170 W171 E172 E176	K170-A174 WeakPolarHBondContact O-CB 3.46Å; K170-A174 PolarHBondContact O-N 2.87Å; W171-A174 CarbonylContact O-C 3.56Å; W171-A174 PolarHBondContact O-N 2.92Å; E172-A174 VanDerWaalsContact C-N 3.29Å; E172-A174 PolarHBondContact O-N 3.37Å; A174-E176 VanDerWaalsContact C-N 3.27Å; A174-E176 HydrophobicContact CB-CG 3.99Å; A174-E176 PolarHBondContact O-N 3.49Å
175	R	97.8	Very high	98.3	Very high	155 Å²	155	72 Å²	72	59%	0.585	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	35.8	-177	-57.4	171.9	70.9	-169.9	1.1	113.6	W171 E172 A177 E178	W171-R175 WeakPolarHBondContact O-CA 3.35Å; W171-R175 PolarHBondContact O-N 3.05Å; E172-R175 PolarHBondContact O-N 2.98Å; E172-R175 VanDerWaalsContact O-N 3.1Å; R175-A177 PolarHBondContact O-N 2.82Å; R175-E178 HydrophobicContact CB-CG 4.44Å; R175-E178 IonicContact CZ-OE1 3.08Å; R175-E178 IonicContact CZ-OE2 2.78Å; R175-E178 VanDerWaalsContact NE-CD 3.3Å; R175-E178 IonicContact NE-OE1 3.14Å; R175-E178 PolarHBondContact NE-OE1 2.93Å; R175-E178 IonicContact NE-OE2 2.75Å; R175-E178 PolarHBondContact NE-OE2 3.25Å; R175-E178 IonicContact NH2-OE1 2.68Å; R175-E178 PolarHBondContact NH2-OE1 3.09Å; R175-E178 IonicContact NH2-OE2 3.15Å; R175-E178 PolarHBondContact NH2-OE2 2.88Å; R175-E178 WeakPolarHBondContact O-CB 3.29Å; R175-E178 PolarHBondContact O-N 2.88Å
176	E	98	Very high	98.2	Very high	51 Å²	51	69.7 Å²	69.7	24%	0.238	35%	0.346	C	S	.	.	H	α-helix	trans	-58.6	-33.1	-175.7	-60.5	-72.1	-168.3	0	0	112.8	W157 W171 A174 E178 Q179 W180	W157-E176 HydrophobicContact CZ2-CB 4.28Å; W171-E176 HydrophobicContact CB-CB 4.04Å; W171-E176 HydrophobicContact CB-CG 3.83Å; W171-E176 HydrophobicContact CG-CB 4.21Å; W171-E176 HydrophobicContact CG-CG 3.81Å; W171-E176 PolarHBondContact O-N 3.04Å; A174-E176 VanDerWaalsContact C-N 3.27Å; A174-E176 HydrophobicContact CB-CG 3.99Å; A174-E176 PolarHBondContact O-N 3.49Å; E176-E178 PolarHBondContact O-N 2.83Å; E176-E178 VanDerWaalsContact O-N 3.16Å; E176-Q179 WeakPolarHBondContact O-CB 3.46Å; E176-Q179 PolarHBondContact O-N 3.22Å; E176-Q179 PolarHBondContact OE2-NE2 3.13Å; E176-W180 PolarHBondContact O-N 3.27Å
177	A	98.4	Very high	98.2	Very high	7 Å²	7	69.4 Å²	69.4	6%	0.058	35%	0.347	C	S	.	.	H	α-helix	trans	-57.5	-29.9	176.6	0	0	0	0	0	112.7	L150 R155 W157 R175 R181	L150-A177 HydrophobicContact CD1-CB 3.9Å; R155-A177 WeakPolarHBondContact O-CB 3.42Å; W157-A177 HydrophobicContact CZ2-CB 4.18Å; R175-A177 PolarHBondContact O-N 2.82Å; A177-R181 WeakPolarHBondContact O-CB 3.47Å; A177-R181 PolarHBondContact O-N 2.79Å
178	E	98.1	Very high	98.2	Very high	102 Å²	102	68.5 Å²	68.5	48%	0.477	34%	0.342	S	S	.	.	H	α-helix	trans	-73.9	-34	177.9	-62.5	178.6	-165.1	0	0	112.3	R175 E176 A182	R175-E178 HydrophobicContact CB-CG 4.44Å; R175-E178 IonicContact CZ-OE1 3.08Å; R175-E178 IonicContact CZ-OE2 2.78Å; R175-E178 VanDerWaalsContact NE-CD 3.3Å; R175-E178 IonicContact NE-OE1 3.14Å; R175-E178 PolarHBondContact NE-OE1 2.93Å; R175-E178 IonicContact NE-OE2 2.75Å; R175-E178 PolarHBondContact NE-OE2 3.25Å; R175-E178 IonicContact NH2-OE1 2.68Å; R175-E178 PolarHBondContact NH2-OE1 3.09Å; R175-E178 IonicContact NH2-OE2 3.15Å; R175-E178 PolarHBondContact NH2-OE2 2.88Å; R175-E178 WeakPolarHBondContact O-CB 3.29Å; R175-E178 PolarHBondContact O-N 2.88Å; E176-E178 PolarHBondContact O-N 2.83Å; E176-E178 VanDerWaalsContact O-N 3.16Å; E178-A182 WeakPolarHBondContact O-CB 3.37Å; E178-A182 PolarHBondContact O-N 3.24Å
179	Q	97.7	Very high	98.2	Very high	120 Å²	120	67 Å²	67	56%	0.561	34%	0.335	S	S	*	.	H	α-helix	trans	-68.2	-44.9	173.4	-63.1	179.8	61.6	0	0	110.4	E176 A182 Y183	E176-Q179 WeakPolarHBondContact O-CB 3.46Å; E176-Q179 PolarHBondContact O-N 3.22Å; E176-Q179 PolarHBondContact OE2-NE2 3.13Å; Q179-A182 PolarHBondContact O-N 2.8Å; Q179-Y183 PolarHBondContact O-N 3.37Å
180	W	98.2	Very high	98.2	Very high	49 Å²	49	65.8 Å²	65.8	19%	0.186	34%	0.336	C	S	.	.	H	α-helix	trans	-62.5	-46.1	175.4	-80.8	106.8	0	0	0	112.5	W121 Y123 D138 L150 E176 A182 Y183 L184	W121-W180 AromaticContact CH2-CH2 3.43Å; W121-W180 HydrophobicContact CH2-CH2 3.43Å; W121-W180 VanDerWaalsContact CH2-CH2 3.43Å; W121-W180 AromaticContact CH2-CZ2 3.5Å; W121-W180 HydrophobicContact CH2-CZ2 3.5Å; W121-W180 VanDerWaalsContact CH2-CZ2 3.5Å; W121-W180 AromaticContact CZ2-CH2 3.34Å; W121-W180 HydrophobicContact CZ2-CH2 3.34Å; W121-W180 AromaticContact CZ2-CZ2 3.26Å; W121-W180 HydrophobicContact CZ2-CZ2 3.26Å; W121-W180 HydrophobicContact CZ2-CZ3 4.27Å; Y123-W180 HydrophobicContact CD2-CZ3 4.16Å; Y123-W180 HydrophobicContact CG-CH2 4.41Å; Y123-W180 HydrophobicContact CG-CZ3 4.19Å; D138-W180 HydrophobicContact CB-CD2 4.39Å; D138-W180 HydrophobicContact CB-CE3 4.43Å; D138-W180 VanDerWaalsContact OD2-CD2 3.31Å; D138-W180 PolarHBondContact OD2-NE1 3.28Å; L150-W180 HydrophobicContact CD2-CB 3.95Å; E176-W180 PolarHBondContact O-N 3.27Å; W180-A182 VanDerWaalsContact C-N 3.33Å; W180-A182 PolarHBondContact O-N 3.48Å; W180-Y183 AromaticContact CE3-CD1 3.92Å; W180-Y183 HydrophobicContact CE3-CD1 3.92Å; W180-Y183 AromaticContact CZ3-CD1 3.62Å; W180-Y183 HydrophobicContact CZ3-CD1 3.62Å; W180-Y183 HydrophobicContact CZ3-CE1 4.03Å; W180-Y183 HydrophobicContact CZ3-CG 4.34Å; W180-Y183 PolarHBondContact O-N 3.31Å; W180-L184 VanDerWaalsContact O-CB 3.31Å; W180-L184 WeakPolarHBondContact O-CB 3.49Å; W180-L184 WeakPolarHBondContact O-CG 3.41Å; W180-L184 PolarHBondContact O-N 3.05Å
181	R	98.4	Very high	98.2	Very high	76 Å²	76	62.3 Å²	62.3	29%	0.287	32%	0.319	S	S	.	.	H	α-helix	trans	-58.4	-43.2	174.7	-173.2	169.9	178.1	-120.6	-22.5	112.3	L154 A177 Y183 L184 E185	L154-R181 HydrophobicContact CB-CB 4.03Å; L154-R181 HydrophobicContact CB-CG 3.82Å; L154-R181 HydrophobicContact CD1-CG 4.2Å; L154-R181 WeakPolarHBondContact O-CD 3.42Å; A177-R181 WeakPolarHBondContact O-CB 3.47Å; A177-R181 PolarHBondContact O-N 2.79Å; R181-Y183 PolarHBondContact O-N 3.15Å; R181-L184 PolarHBondContact O-N 2.82Å; R181-E185 HydrophobicContact CG-CG 4.06Å; R181-E185 IonicContact CZ-OE1 3.21Å; R181-E185 IonicContact CZ-OE2 3.29Å; R181-E185 IonicContact NE-OE1 2.77Å; R181-E185 PolarHBondContact NE-OE1 2.94Å; R181-E185 IonicContact NE-OE2 2.76Å; R181-E185 PolarHBondContact NE-OE2 3.12Å; R181-E185 IonicContact NH2-OE1 2.88Å; R181-E185 PolarHBondContact NH2-OE1 3Å; R181-E185 IonicContact NH2-OE2 2.65Å; R181-E185 PolarHBondContact NH2-OE2 3.33Å; R181-E185 VanDerWaalsContact NH2-OE2 3.15Å; R181-E185 VanDerWaalsContact O-CB 3.31Å; R181-E185 WeakPolarHBondContact O-CB 3.46Å; R181-E185 WeakPolarHBondContact O-CG 3.46Å; R181-E185 PolarHBondContact O-N 3.3Å
182	A	98.4	Very high	98.2	Very high	65 Å²	65	59.2 Å²	59.2	54%	0.537	31%	0.308	S	S	.	.	H	α-helix	trans	-64.2	-38.4	176.5	0	0	0	0	0	112.9	E178 Q179 W180 G186	E178-A182 WeakPolarHBondContact O-CB 3.37Å; E178-A182 PolarHBondContact O-N 3.24Å; Q179-A182 PolarHBondContact O-N 2.8Å; W180-A182 VanDerWaalsContact C-N 3.33Å; W180-A182 PolarHBondContact O-N 3.48Å; A182-G186 PolarHBondContact O-N 2.88Å
183	Y	98.3	Very high	98.1	Very high	48 Å²	48	60.7 Å²	60.7	19%	0.188	31%	0.309	C	S	.	.	I	π-helix	trans	-66.3	-46.4	172.8	170.5	-100.3	0	0	0	112	Y123 Q179 W180 R181 G186 T187 C188	Y123-Y183 AromaticContact CD2-CE1 3.92Å; Y123-Y183 HydrophobicContact CD2-CE1 3.92Å; Y123-Y183 HydrophobicContact CE2-CE1 4.12Å; Q179-Y183 PolarHBondContact O-N 3.37Å; W180-Y183 AromaticContact CE3-CD1 3.92Å; W180-Y183 HydrophobicContact CE3-CD1 3.92Å; W180-Y183 AromaticContact CZ3-CD1 3.62Å; W180-Y183 HydrophobicContact CZ3-CD1 3.62Å; W180-Y183 HydrophobicContact CZ3-CE1 4.03Å; W180-Y183 HydrophobicContact CZ3-CG 4.34Å; W180-Y183 PolarHBondContact O-N 3.31Å; R181-Y183 PolarHBondContact O-N 3.15Å; Y183-G186 CarbonylContact O-C 3.59Å; Y183-T187 HydrophobicContact CD2-CG2 3.97Å; Y183-T187 HydrophobicContact CE2-CG2 3.85Å; Y183-T187 PolarHBondContact O-N 2.8Å; Y183-T187 VanDerWaalsContact O-N 3.11Å; Y183-C188 HydrophobicContact CD1-CB 4.37Å; Y183-C188 HydrophobicContact CE1-CB 3.91Å; Y183-C188 WeakPolarHBondContact O-CB 3.5Å; Y183-C188 PolarHBondContact O-N 3.15Å
184	L	98.6	Very high	98	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	30%	0.296	C	S	.	.	I	π-helix	trans	-71.6	-41.1	-174.8	-69.3	171.1	0	0	0	112.9	G124 L150 L154 W180 R181 V189	G124-L184 WeakPolarHBondContact O-CD2 3.38Å; L150-L184 HydrophobicContact CD2-CD1 3.9Å; L154-L184 HydrophobicContact CD2-CD1 3.97Å; W180-L184 VanDerWaalsContact O-CB 3.31Å; W180-L184 WeakPolarHBondContact O-CB 3.49Å; W180-L184 WeakPolarHBondContact O-CG 3.41Å; W180-L184 PolarHBondContact O-N 3.05Å; R181-L184 PolarHBondContact O-N 2.82Å; L184-V189 WeakPolarHBondContact O-CG2 3.47Å
185	E	97.9	Very high	98	Very high	90 Å²	90	59.8 Å²	59.8	42%	0.421	28%	0.276	S	S	.	.	I	π-helix	trans	-76.8	-26	176.7	-67.9	-178.9	165	0	0	113.1	L133 L154 R181	L133-E185 HydrophobicContact CD2-CB 4.45Å; L133-E185 HydrophobicContact CD2-CG 3.76Å; L154-E185 HydrophobicContact CD1-CG 4.31Å; R181-E185 HydrophobicContact CG-CG 4.06Å; R181-E185 IonicContact CZ-OE1 3.21Å; R181-E185 IonicContact CZ-OE2 3.29Å; R181-E185 IonicContact NE-OE1 2.77Å; R181-E185 PolarHBondContact NE-OE1 2.94Å; R181-E185 IonicContact NE-OE2 2.76Å; R181-E185 PolarHBondContact NE-OE2 3.12Å; R181-E185 IonicContact NH2-OE1 2.88Å; R181-E185 PolarHBondContact NH2-OE1 3Å; R181-E185 IonicContact NH2-OE2 2.65Å; R181-E185 PolarHBondContact NH2-OE2 3.33Å; R181-E185 VanDerWaalsContact NH2-OE2 3.15Å; R181-E185 VanDerWaalsContact O-CB 3.31Å; R181-E185 WeakPolarHBondContact O-CB 3.46Å; R181-E185 WeakPolarHBondContact O-CG 3.46Å; R181-E185 PolarHBondContact O-N 3.3Å
186	G	97.9	Very high	97.9	Very high	23 Å²	23	53 Å²	53	24%	0.237	25%	0.252	C	S	.	.	I	π-helix	trans	-109	-91.4	-177.5	0	0	0	0	0	113.1	A182 Y183 C188 V189 E190	A182-G186 PolarHBondContact O-N 2.88Å; Y183-G186 CarbonylContact O-C 3.59Å; G186-C188 VanDerWaalsContact C-N 3.31Å; G186-C188 PolarHBondContact O-N 2.87Å; G186-V189 WeakPolarHBondContact O-CB 3.15Å; G186-V189 PolarHBondContact O-N 2.93Å; G186-V189 VanDerWaalsContact O-N 3.1Å; G186-E190 WeakPolarHBondContact O-CG 3.3Å; G186-E190 PolarHBondContact O-N 3.25Å
187	T	97.8	Very high	97.8	Very high	54 Å²	54	56 Å²	56	33%	0.331	27%	0.266	S	S	.	.	I	π-helix	trans	-54.6	-40.5	-169.3	-58.5	0	0	0	0	113.7	Y183 E190 W191	Y183-T187 HydrophobicContact CD2-CG2 3.97Å; Y183-T187 HydrophobicContact CE2-CG2 3.85Å; Y183-T187 PolarHBondContact O-N 2.8Å; Y183-T187 VanDerWaalsContact O-N 3.11Å; T187-E190 PolarHBondContact O-N 2.94Å; T187-W191 PolarHBondContact O-N 3.49Å
188	C	98.4	Very high	97.7	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	28%	0.276	C	S	.	.	I	π-helix	trans	-61.9	-48.8	178.5	-169.9	0	0	0	0	111.5	M29 C125 Y183 G186 E190 W191 L192	M29-C188 HydrophobicContact CE-CB 4.18Å; M29-C188 VanDerWaalsContact CE-O 3.23Å; M29-C188 WeakPolarHBondContact CE-O 3.38Å; M29-C188 WeakPolarHBondContact CE-SG 3.35Å; C125-C188 HydrophobicContact CB-CB 3.89Å; C125-C188 WeakPolarHBondContact CB-SG 3.31Å; C125-C188 PolarHBondContact N-SG 2.88Å; C125-C188 WeakPolarHBondContact SG-CB 3.36Å; C125-C188 CovalentContact SG-SG 2.04Å; C125-C188 PolarHBondContact SG-SG 2.76Å; Y183-C188 HydrophobicContact CD1-CB 4.37Å; Y183-C188 HydrophobicContact CE1-CB 3.91Å; Y183-C188 WeakPolarHBondContact O-CB 3.5Å; Y183-C188 PolarHBondContact O-N 3.15Å; G186-C188 VanDerWaalsContact C-N 3.31Å; G186-C188 PolarHBondContact O-N 2.87Å; C188-E190 PolarHBondContact O-N 3.06Å; C188-W191 PolarHBondContact O-N 3.3Å; C188-L192 WeakPolarHBondContact O-CB 3.48Å; C188-L192 PolarHBondContact O-N 3.26Å
189	V	98.3	Very high	97.6	Very high	7 Å²	7	53.4 Å²	53.4	4%	0.042	26%	0.255	C	S	.	.	H	α-helix	trans	-60.1	-44	176.8	175.9	0	0	0	0	111.5	L127 L133 L184 G186 R193	L127-V189 HydrophobicContact CD2-CB 4.16Å; L127-V189 HydrophobicContact CD2-CG1 3.79Å; L127-V189 HydrophobicContact CD2-CG2 3.82Å; L133-V189 HydrophobicContact CB-CG2 4.04Å; L133-V189 HydrophobicContact CD1-CG2 4.15Å; L184-V189 WeakPolarHBondContact O-CG2 3.47Å; G186-V189 WeakPolarHBondContact O-CB 3.15Å; G186-V189 PolarHBondContact O-N 2.93Å; G186-V189 VanDerWaalsContact O-N 3.1Å; V189-R193 VanDerWaalsContact CG1-CZ 3.41Å; V189-R193 WeakPolarHBondContact O-CB 3.28Å; V189-R193 VanDerWaalsContact O-CG 3.29Å; V189-R193 WeakPolarHBondContact O-CG 3.4Å; V189-R193 PolarHBondContact O-N 3.11Å
190	E	98	Very high	97.4	Very high	124 Å²	124	52 Å²	52	58%	0.579	25%	0.247	S	C	*	.	H	α-helix	trans	-62.5	-46.8	179.4	-70.8	174.9	165.5	0	0	112.5	G186 T187 C188 R194	G186-E190 WeakPolarHBondContact O-CG 3.3Å; G186-E190 PolarHBondContact O-N 3.25Å; T187-E190 PolarHBondContact O-N 2.94Å; C188-E190 PolarHBondContact O-N 3.06Å; E190-R194 WeakPolarHBondContact O-CB 3.44Å; E190-R194 PolarHBondContact O-N 2.82Å; E190-R194 VanDerWaalsContact O-N 3.09Å
191	W	98	Very high	97	Very high	43 Å²	43	58.9 Å²	58.9	16%	0.163	28%	0.278	C	S	.	.	H	α-helix	trans	-68.9	-41.7	178.7	-80.7	100.7	0	0	0	112.3	M29 Y83 T187 C188 R194 Y195	M29-W191 HydrophobicContact CE-CB 4.09Å; M29-W191 HydrophobicContact SD-CB 4.38Å; Y83-W191 AromaticContact CD2-CH2 3.59Å; Y83-W191 HydrophobicContact CD2-CH2 3.59Å; Y83-W191 HydrophobicContact CD2-CZ2 4.35Å; Y83-W191 AromaticContact CD2-CZ3 3.71Å; Y83-W191 HydrophobicContact CD2-CZ3 3.71Å; Y83-W191 HydrophobicContact CE2-CE3 4.13Å; Y83-W191 AromaticContact CE2-CH2 3.95Å; Y83-W191 HydrophobicContact CE2-CH2 3.95Å; Y83-W191 AromaticContact CE2-CZ3 3.65Å; Y83-W191 HydrophobicContact CE2-CZ3 3.65Å; T187-W191 PolarHBondContact O-N 3.49Å; C188-W191 PolarHBondContact O-N 3.3Å; W191-R194 WeakPolarHBondContact O-CB 3.39Å; W191-R194 PolarHBondContact O-N 3.03Å; W191-Y195 HydrophobicContact CB-CE2 4.02Å; W191-Y195 HydrophobicContact CE3-CD1 4.46Å; W191-Y195 AromaticContact CE3-CE1 3.59Å; W191-Y195 HydrophobicContact CE3-CE1 3.59Å; W191-Y195 HydrophobicContact CE3-CE2 4.36Å; W191-Y195 AromaticContact CE3-CZ 3.52Å; W191-Y195 HydrophobicContact CZ3-CE1 4.05Å; W191-Y195 VanDerWaalsContact O-CD2 3.23Å; W191-Y195 WeakPolarHBondContact O-CD2 3.32Å; W191-Y195 PolarHBondContact O-N 2.99Å
192	L	98.2	Very high	96.7	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-60.9	-46.3	176.2	174.4	50.1	0	0	0	111.4	H27 M29 V52 L127 C188 R194 Y195 L196	H27-L192 HydrophobicContact CB-CD1 4.43Å; M29-L192 HydrophobicContact CB-CB 4.01Å; M29-L192 HydrophobicContact CB-CD1 4.04Å; M29-L192 HydrophobicContact CB-CD2 3.92Å; M29-L192 HydrophobicContact CB-CG 4.21Å; M29-L192 HydrophobicContact CE-CB 4.31Å; M29-L192 HydrophobicContact SD-CB 4.5Å; V52-L192 HydrophobicContact CG1-CD1 3.58Å; V52-L192 HydrophobicContact CG2-CD1 4.27Å; L127-L192 HydrophobicContact CD1-CB 4.35Å; L127-L192 HydrophobicContact CD1-CD2 3.78Å; L127-L192 HydrophobicContact CD1-CG 3.77Å; L127-L192 HydrophobicContact CD2-CD2 4.47Å; L127-L192 HydrophobicContact CG-CD2 3.61Å; L127-L192 HydrophobicContact CG-CG 4.19Å; C188-L192 WeakPolarHBondContact O-CB 3.48Å; C188-L192 PolarHBondContact O-N 3.26Å; L192-R194 VanDerWaalsContact C-N 3.32Å; L192-R194 PolarHBondContact O-N 3.02Å; L192-Y195 PolarHBondContact O-N 3.24Å; L192-L196 HydrophobicContact CD1-CD1 3.74Å; L192-L196 HydrophobicContact CD1-CD2 4.36Å; L192-L196 HydrophobicContact CD1-CG 3.8Å; L192-L196 HydrophobicContact CG-CD1 3.98Å; L192-L196 HydrophobicContact CG-CG 4.48Å; L192-L196 WeakPolarHBondContact O-CB 3.46Å; L192-L196 VanDerWaalsContact O-CG 3.27Å; L192-L196 WeakPolarHBondContact O-CG 3.4Å; L192-L196 PolarHBondContact O-N 3.49Å
193	R	96.8	Very high	96.4	Very high	121 Å²	121	54.5 Å²	54.5	46%	0.457	25%	0.253	S	S	.	.	H	α-helix	trans	-58	-42.3	173.8	-72.6	173.2	-177.5	164.9	0.3	112.6	L127 G131 V189 L196 E197	L127-R193 HydrophobicContact CD1-CG 3.91Å; G131-R193 VanDerWaalsContact O-CZ 3.28Å; G131-R193 PolarHBondContact O-NE 2.76Å; G131-R193 PolarHBondContact O-NH2 3.21Å; V189-R193 VanDerWaalsContact CG1-CZ 3.41Å; V189-R193 WeakPolarHBondContact O-CB 3.28Å; V189-R193 VanDerWaalsContact O-CG 3.29Å; V189-R193 WeakPolarHBondContact O-CG 3.4Å; V189-R193 PolarHBondContact O-N 3.11Å; R193-L196 PolarHBondContact O-N 3.4Å; R193-E197 PolarHBondContact O-N 3.46Å; R193-E197 VanDerWaalsContact O-N 3.12Å
194	R	97	Very high	95.9	Very high	118 Å²	118	56.4 Å²	56.4	45%	0.445	26%	0.264	S	S	.	.	H	α-helix	trans	-62.6	-45	176.1	177.5	178.7	173.4	124.8	1.8	111.8	E79 E190 W191 L192 E197 N198	E79-R194 IonicContact OE1-CZ 2.72Å; E79-R194 IonicContact OE1-NE 3.88Å; E79-R194 PolarHBondContact OE1-NE 3.19Å; E79-R194 IonicContact OE1-NH2 3.73Å; E79-R194 PolarHBondContact OE1-NH2 2.85Å; E79-R194 IonicContact OE2-CZ 3.58Å; E79-R194 IonicContact OE2-NE 2.76Å; E79-R194 IonicContact OE2-NH2 3.65Å; E79-R194 PolarHBondContact OE2-NH2 2.87Å; E190-R194 WeakPolarHBondContact O-CB 3.44Å; E190-R194 PolarHBondContact O-N 2.82Å; E190-R194 VanDerWaalsContact O-N 3.09Å; W191-R194 WeakPolarHBondContact O-CB 3.39Å; W191-R194 PolarHBondContact O-N 3.03Å; L192-R194 VanDerWaalsContact C-N 3.32Å; L192-R194 PolarHBondContact O-N 3.02Å; R194-E197 PolarHBondContact O-N 2.9Å; R194-N198 WeakPolarHBondContact O-CB 3.38Å; R194-N198 PolarHBondContact O-N 3.01Å; R194-N198 PolarHBondContact O-OD1 2.84Å
195	Y	97.4	Very high	95.5	Very high	2 Å²	2	60.5 Å²	60.5	1%	0.008	28%	0.279	C	S	.	.	H	α-helix	trans	-66.7	-38.5	178	-62.2	-32.5	0	0	0	112.4	M29 V52 F57 W75 V76 Y83 W191 L192 E197 N198 G199 L203	M29-Y195 HydrophobicContact SD-CD2 3.76Å; M29-Y195 HydrophobicContact SD-CE2 3.53Å; M29-Y195 VanDerWaalsContact SD-CE2 3.53Å; V52-Y195 HydrophobicContact CG2-CD2 3.87Å; V52-Y195 HydrophobicContact CG2-CG 4.41Å; F57-Y195 HydrophobicContact CD2-CE2 4.38Å; F57-Y195 HydrophobicContact CE2-CD2 4.22Å; F57-Y195 HydrophobicContact CE2-CE1 4.45Å; F57-Y195 AromaticContact CE2-CE2 3.54Å; F57-Y195 HydrophobicContact CE2-CE2 3.54Å; F57-Y195 AromaticContact CE2-CZ 3.68Å; F57-Y195 HydrophobicContact CZ-CD2 4.24Å; F57-Y195 AromaticContact CZ-CE2 3.65Å; F57-Y195 HydrophobicContact CZ-CE2 3.65Å; W75-Y195 HydrophobicContact CE3-CD1 4.27Å; W75-Y195 HydrophobicContact CE3-CG 4.48Å; W75-Y195 HydrophobicContact CH2-CG 4.13Å; W75-Y195 AromaticContact CZ3-CD1 3.6Å; W75-Y195 HydrophobicContact CZ3-CD1 3.6Å; W75-Y195 HydrophobicContact CZ3-CD2 4.29Å; W75-Y195 HydrophobicContact CZ3-CE1 4.35Å; W75-Y195 AromaticContact CZ3-CG 3.57Å; W75-Y195 HydrophobicContact CZ3-CG 3.57Å; V76-Y195 HydrophobicContact CG2-CE1 4.32Å; Y83-Y195 VanDerWaalsContact CE2-OH 3.26Å; Y83-Y195 WeakPolarHBondContact CE2-OH 3.4Å; Y83-Y195 PolarHBondContact OH-OH 3.01Å; W191-Y195 HydrophobicContact CB-CE2 4.02Å; W191-Y195 HydrophobicContact CE3-CD1 4.46Å; W191-Y195 AromaticContact CE3-CE1 3.59Å; W191-Y195 HydrophobicContact CE3-CE1 3.59Å; W191-Y195 HydrophobicContact CE3-CE2 4.36Å; W191-Y195 AromaticContact CE3-CZ 3.52Å; W191-Y195 HydrophobicContact CZ3-CE1 4.05Å; W191-Y195 VanDerWaalsContact O-CD2 3.23Å; W191-Y195 WeakPolarHBondContact O-CD2 3.32Å; W191-Y195 PolarHBondContact O-N 2.99Å; L192-Y195 PolarHBondContact O-N 3.24Å; Y195-E197 VanDerWaalsContact C-N 3.35Å; Y195-E197 PolarHBondContact O-N 2.75Å; Y195-N198 PolarHBondContact O-N 2.9Å; Y195-G199 WeakPolarHBondContact O-CA 3.23Å; Y195-G199 PolarHBondContact O-N 3.34Å; Y195-L203 WeakPolarHBondContact O-CD1 3.36Å
196	L	95.9	Very high	95.3	Very high	14 Å²	14	58.1 Å²	58.1	7%	0.073	28%	0.275	C	S	.	.	H	α-helix	trans	-63	-37.7	175.2	-72.4	168.3	0	0	0	112.6	H27 V52 L127 L192 R193 K200 L203 Q204	H27-L196 HydrophobicContact CB-CD1 3.65Å; H27-L196 HydrophobicContact CB-CD2 3.93Å; H27-L196 HydrophobicContact CB-CG 4.38Å; H27-L196 VanDerWaalsContact CG-CD2 3.49Å; H27-L196 WeakPolarHBondContact ND1-CD2 3.38Å; V52-L196 HydrophobicContact CG1-CD2 4.13Å; L127-L196 HydrophobicContact CD1-CD1 4.45Å; L192-L196 HydrophobicContact CD1-CD1 3.74Å; L192-L196 HydrophobicContact CD1-CD2 4.36Å; L192-L196 HydrophobicContact CD1-CG 3.8Å; L192-L196 HydrophobicContact CG-CD1 3.98Å; L192-L196 HydrophobicContact CG-CG 4.48Å; L192-L196 WeakPolarHBondContact O-CB 3.46Å; L192-L196 VanDerWaalsContact O-CG 3.27Å; L192-L196 WeakPolarHBondContact O-CG 3.4Å; L192-L196 PolarHBondContact O-N 3.49Å; R193-L196 PolarHBondContact O-N 3.4Å; L196-K200 WeakPolarHBondContact O-CA 3.24Å; L196-K200 WeakPolarHBondContact O-CB 3.38Å; L196-K200 PolarHBondContact O-N 2.65Å; L196-L203 HydrophobicContact CD2-CB 4.09Å; L196-L203 HydrophobicContact CD2-CD1 4.27Å; L196-Q204 PolarHBondContact O-NE2 2.68Å
197	E	95.8	Very high	95.1	Very high	114 Å²	114	60 Å²	60	53%	0.533	28%	0.278	S	S	.	.	H	α-helix	trans	-75.3	-44.3	175	-169.3	59	-152.8	0	0	111.6	R193 R194 Y195 G199 K200	R193-E197 PolarHBondContact O-N 3.46Å; R193-E197 VanDerWaalsContact O-N 3.12Å; R194-E197 PolarHBondContact O-N 2.9Å; Y195-E197 VanDerWaalsContact C-N 3.35Å; Y195-E197 PolarHBondContact O-N 2.75Å; E197-G199 VanDerWaalsContact C-N 3.33Å; E197-G199 PolarHBondContact O-N 2.85Å; E197-K200 WeakPolarHBondContact O-CB 3.19Å; E197-K200 PolarHBondContact O-N 2.93Å; E197-K200 IonicContact OE1-NZ 2.81Å; E197-K200 PolarHBondContact OE1-NZ 2.84Å; E197-K200 IonicContact OE2-NZ 3.34Å; E197-K200 PolarHBondContact OE2-NZ 3.35Å
198	N	96.6	Very high	95	Very high	50 Å²	50	62.2 Å²	62.2	27%	0.267	28%	0.284	S	S	.	.	H	α-helix	trans	-57.3	-45.3	174.8	-72.5	-1.4	0	0	0	112.2	W75 Q78 E79 R194 Y195	W75-N198 HydrophobicContact CB-CB 4.43Å; Q78-N198 PolarHBondContact NE2-ND2 2.53Å; Q78-N198 VanDerWaalsContact NE2-ND2 3.14Å; Q78-N198 PolarHBondContact NE2-OD1 2.99Å; E79-N198 PolarHBondContact OE1-ND2 3.05Å; R194-N198 WeakPolarHBondContact O-CB 3.38Å; R194-N198 PolarHBondContact O-N 3.01Å; R194-N198 PolarHBondContact O-OD1 2.84Å; Y195-N198 PolarHBondContact O-N 2.9Å
199	G	95.6	Very high	94.9	Very high	3 Å²	3	62.6 Å²	62.6	3%	0.031	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96	10.3	-174.6	0	0	0	0	0	114.4	W75 Y195 E197 K201 T202 L203	W75-G199 VanDerWaalsContact CG-CA 3.46Å; Y195-G199 WeakPolarHBondContact O-CA 3.23Å; Y195-G199 PolarHBondContact O-N 3.34Å; E197-G199 VanDerWaalsContact C-N 3.33Å; E197-G199 PolarHBondContact O-N 2.85Å; G199-K201 VanDerWaalsContact C-N 3.28Å; G199-K201 PolarHBondContact O-N 3.13Å; G199-T202 CarbonylContact O-C 3.56Å; G199-T202 WeakPolarHBondContact O-CA 3.03Å; G199-T202 PolarHBondContact O-N 2.87Å; G199-L203 PolarHBondContact O-N 3.21Å
200	K	93.4	Very high	94.9	Very high	91 Å²	91	69.5 Å²	69.5	40%	0.396	32%	0.316	S	S	.	.	H	α-helix	trans	-44.3	-44.3	-170.2	-170.9	168.9	-154.9	150.2	0	115.5	L196 E197 T202 Q204	L196-K200 WeakPolarHBondContact O-CA 3.24Å; L196-K200 WeakPolarHBondContact O-CB 3.38Å; L196-K200 PolarHBondContact O-N 2.65Å; E197-K200 WeakPolarHBondContact O-CB 3.19Å; E197-K200 PolarHBondContact O-N 2.93Å; E197-K200 IonicContact OE1-NZ 2.81Å; E197-K200 PolarHBondContact OE1-NZ 2.84Å; E197-K200 IonicContact OE2-NZ 3.34Å; E197-K200 PolarHBondContact OE2-NZ 3.35Å; K200-T202 PolarHBondContact O-N 2.77Å; K200-Q204 WeakPolarHBondContact O-CB 3.39Å; K200-Q204 PolarHBondContact O-N 3.14Å; K200-Q204 VanDerWaalsContact O-N 3.13Å
201	K	91.4	Very high	94.9	Very high	194 Å²	194	65.2 Å²	65.2	84%	0.843	30%	0.298	S	S	*	.	H	α-helix	trans	-67.2	-14	178.6	-64.5	-178.5	179.2	177.6	0	114.8	G199	G199-K201 VanDerWaalsContact C-N 3.28Å; G199-K201 PolarHBondContact O-N 3.13Å
202	T	90.6	Very high	94.9	Very high	44 Å²	44	67 Å²	67	27%	0.27	31%	0.308	S	S	.	.	H	α-helix	trans	-115.4	-41.9	-176.5	-56.7	0	0	0	0	111.8	G199 K200 R205	G199-T202 CarbonylContact O-C 3.56Å; G199-T202 WeakPolarHBondContact O-CA 3.03Å; G199-T202 PolarHBondContact O-N 2.87Å; K200-T202 PolarHBondContact O-N 2.77Å; T202-R205 WeakPolarHBondContact O-CG 3.49Å
203	L	91.8	Very high	94.9	Very high	4 Å²	4	68.1 Å²	68.1	2%	0.021	32%	0.315	C	S	.	.	H	α-helix	trans	-88	-32	-175	-60.2	172.8	0	0	0	113.1	V52 T55 W75 Y195 L196 G199 R205	V52-L203 HydrophobicContact CB-CD1 4.28Å; V52-L203 HydrophobicContact CB-CD2 4.22Å; V52-L203 HydrophobicContact CG1-CD1 3.82Å; V52-L203 HydrophobicContact CG1-CD2 4.11Å; V52-L203 HydrophobicContact CG1-CG 4.48Å; T55-L203 HydrophobicContact CG2-CD2 4.05Å; W75-L203 HydrophobicContact CD2-CD1 4.4Å; W75-L203 HydrophobicContact CH2-CD1 4.3Å; W75-L203 HydrophobicContact CZ2-CD1 3.77Å; W75-L203 HydrophobicContact CZ2-CD2 3.99Å; W75-L203 HydrophobicContact CZ2-CG 4.29Å; Y195-L203 WeakPolarHBondContact O-CD1 3.36Å; L196-L203 HydrophobicContact CD2-CB 4.09Å; L196-L203 HydrophobicContact CD2-CD1 4.27Å; G199-L203 PolarHBondContact O-N 3.21Å; L203-R205 VanDerWaalsContact C-N 3.34Å
204	Q	89.3	Confident	94.9	Very high	89 Å²	89	64 Å²	64	42%	0.416	30%	0.303	S	S	.	.	S	Bend	trans	-101.4	36.4	177.3	-58	173.3	27.1	0	0	110.8	L196 K200	L196-Q204 PolarHBondContact O-NE2 2.68Å; K200-Q204 WeakPolarHBondContact O-CB 3.39Å; K200-Q204 PolarHBondContact O-N 3.14Å; K200-Q204 VanDerWaalsContact O-N 3.13Å
205	R	90.3	Very high	94.9	Very high	85 Å²	85	60.9 Å²	60.9	32%	0.321	29%	0.293	S	S	.	.			trans	-114.1	139.7	172.2	86.8	-173.6	-173.4	-141.8	1.3	108.5	T202 L203 E207 Y233	T202-R205 WeakPolarHBondContact O-CG 3.49Å; L203-R205 VanDerWaalsContact C-N 3.34Å; R205-E207 IonicContact CZ-OE1 2.71Å; R205-E207 IonicContact NE-OE1 2.75Å; R205-E207 PolarHBondContact NE-OE1 2.85Å; R205-E207 IonicContact NH2-OE1 2.84Å; R205-E207 PolarHBondContact NH2-OE1 2.92Å; R205-Y233 HydrophobicContact CG-CD1 4.39Å; R205-Y233 VanDerWaalsContact O-CD1 3.3Å; R205-Y233 WeakPolarHBondContact O-CD1 3.38Å
206	A	92.1	Very high	94.8	Very high	41 Å²	41	64.7 Å²	64.7	34%	0.339	31%	0.311	S	S	.	.			trans	-107.5	127	164.2	0	0	0	0	0	108.5	Y233 E288	A206-Y233 CarbonylContact C-O 3.58Å; A206-Y233 WeakPolarHBondContact CA-O 3.35Å; A206-E288 HydrophobicContact CB-CG 4.36Å; A206-E288 WeakPolarHBondContact CB-OE1 3.41Å
207	E	94.3	Very high	94.7	Very high	63 Å²	63	68.7 Å²	68.7	29%	0.294	34%	0.338	S	S	.	.	B	Isolated β-bridge	trans	-102.2	117.8	170.8	-71.4	-176.6	-114.6	0	0	108.8	R205 F232 Y233 H287	R205-E207 IonicContact CZ-OE1 2.71Å; R205-E207 IonicContact NE-OE1 2.75Å; R205-E207 PolarHBondContact NE-OE1 2.85Å; R205-E207 IonicContact NH2-OE1 2.84Å; R205-E207 PolarHBondContact NH2-OE1 2.92Å; E207-F232 WeakPolarHBondContact O-CA 3.46Å; E207-F232 VanDerWaalsContact O-CB 3.28Å; E207-F232 WeakPolarHBondContact O-CB 3.47Å; E207-Y233 PolarHBondContact N-O 2.87Å; E207-Y233 PolarHBondContact O-N 2.75Å; E207-Y233 VanDerWaalsContact O-N 3.15Å; E207-H287 PolarHBondContact O-CE1 2.91Å; E207-H287 VanDerWaalsContact O-CE1 3.24Å
208	H	95.3	Very high	94.5	Very high	100 Å²	100	67.7 Å²	67.7	46%	0.463	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-66.7	141.6	-178.4	-49.4	-101	0	0	0	111.6	K210 G289 L290	H208-K210 PolarHBondContact O-N 3.18Å; H208-G289 PolarHBondContact CE1-O 2.87Å; H208-G289 PolarHBondContact ND1-O 3.15Å; H208-L290 HydrophobicContact CB-CD2 4.06Å
209	P	97.6	Very high	94.3	Very high	7 Å²	7	67.8 Å²	67.8	5%	0.045	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-65.1	130.4	175.2	27.7	-35.5	0	0	0	111.8	T211 A229 F232 I237 V285 H287 L290	P209-T211 HydrophobicContact CB-CG2 3.9Å; P209-T211 HydrophobicContact CG-CG2 4.11Å; P209-T211 PolarHBondContact O-N 3.32Å; P209-A229 HydrophobicContact CB-CB 3.83Å; P209-F232 HydrophobicContact CB-CB 3.91Å; P209-F232 HydrophobicContact CB-CD1 3.88Å; P209-F232 HydrophobicContact CB-CG 4.16Å; P209-I237 HydrophobicContact CB-CD1 4.03Å; P209-I237 HydrophobicContact CG-CD1 4.11Å; P209-V285 HydrophobicContact CG-CG1 3.96Å; P209-H287 HydrophobicContact CG-CB 4.14Å; P209-L290 HydrophobicContact CG-CD1 3.74Å; P209-L290 HydrophobicContact CG-CD2 4.32Å; P209-L290 HydrophobicContact CG-CG 4.11Å
210	K	97.9	Very high	94	Very high	152 Å²	152	74.9 Å²	74.9	66%	0.661	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78	105	165.2	-63.8	167.3	-170.1	160	0	107.6	H208 L230	H208-K210 PolarHBondContact O-N 3.18Å; K210-L230 WeakPolarHBondContact CB-O 3.23Å; K210-L230 PolarHBondContact N-O 2.71Å; K210-L230 PolarHBondContact O-N 2.88Å; K210-L230 VanDerWaalsContact O-N 3.09Å
211	T	97.9	Very high	93.9	Very high	34 Å²	34	77.4 Å²	77.4	21%	0.209	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	144.7	-171.7	57.3	0	0	0	0	113.4	P209 W228 A229 V285 L294 L296	P209-T211 HydrophobicContact CB-CG2 3.9Å; P209-T211 HydrophobicContact CG-CG2 4.11Å; P209-T211 PolarHBondContact O-N 3.32Å; T211-W228 WeakPolarHBondContact CA-O 3.26Å; T211-A229 HydrophobicContact CG2-CB 4.3Å; T211-V285 HydrophobicContact CG2-CB 4.4Å; T211-V285 HydrophobicContact CG2-CG1 4.11Å; T211-V285 HydrophobicContact CG2-CG2 4.04Å; T211-L294 HydrophobicContact CG2-CD1 4.37Å; T211-L296 VanDerWaalsContact CB-CD1 3.47Å; T211-L296 HydrophobicContact CG2-CD1 4.16Å
212	H	97.3	Very high	94.1	Very high	82 Å²	82	72.7 Å²	72.7	38%	0.38	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	159.4	171.5	63	-72.7	0	0	0	110.9	W228	H212-W228 VanDerWaalsContact CE1-CB 3.48Å; H212-W228 WeakPolarHBondContact CE1-CB 3.3Å; H212-W228 AromaticContact CE1-CD1 3.9Å; H212-W228 AromaticContact CE1-CG 3.72Å; H212-W228 PolarHBondContact N-O 3.46Å; H212-W228 AromaticContact NE2-CD1 3.55Å; H212-W228 AromaticContact NE2-CG 3.83Å; H212-W228 PolarHBondContact O-N 2.87Å
213	V	98.2	Very high	94.4	Very high	23 Å²	23	70.6 Å²	70.6	14%	0.139	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	126.1	175.3	-179.4	0	0	0	0	109.7	L225 C227 W241 L296 W298	V213-L225 HydrophobicContact CG1-CB 4.36Å; V213-L225 HydrophobicContact CG1-CD2 4.4Å; V213-C227 HydrophobicContact CG2-CB 4.36Å; V213-W241 HydrophobicContact CG1-CH2 3.85Å; V213-W241 HydrophobicContact CG1-CZ2 4.29Å; V213-W241 HydrophobicContact CG2-CH2 4.26Å; V213-L296 HydrophobicContact CG2-CB 3.97Å; V213-W298 HydrophobicContact CB-CB 4.44Å; V213-W298 HydrophobicContact CG1-CB 3.81Å
214	T	97.1	Very high	94.7	Very high	34 Å²	34	71.4 Å²	71.4	21%	0.209	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	145.7	173.5	49.2	0	0	0	0	110.4	H216 L225 R226 W228	T214-H216 PolarHBondContact OG1-NE2 3.23Å; T214-L225 CarbonylContact O-C 3.55Å; T214-L225 WeakPolarHBondContact O-CA 3.39Å; T214-R226 PolarHBondContact N-O 3.13Å; T214-R226 PolarHBondContact O-N 3.43Å; T214-R226 WeakPolarHBondContact OG1-CB 3.39Å; T214-R226 PolarHBondContact OG1-O 2.77Å; T214-W228 PolarHBondContact OG1-NE1 3.04Å
215	H	96.3	Very high	95.1	Very high	53 Å²	53	67.2 Å²	67.2	25%	0.245	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	127.4	-179.7	166.5	-91.5	0	0	0	109.6	A223 L225 W298	H215-A223 VanDerWaalsContact NE2-CB 3.26Å; H215-A223 WeakPolarHBondContact NE2-CB 3.43Å; H215-L225 HydrophobicContact CB-CD2 3.94Å; H215-W298 HydrophobicContact CB-CD2 4.07Å; H215-W298 HydrophobicContact CB-CG 4.11Å; H215-W298 HydrophobicContact CB-CZ2 4.05Å; H215-W298 VanDerWaalsContact CB-NE1 3.32Å; H215-W298 AromaticContact CG-CE2 3.77Å; H215-W298 AromaticContact CG-CZ2 3.79Å; H215-W298 AromaticContact ND1-CZ2 3.9Å
216	H	95.3	Very high	95.5	Very high	81 Å²	81	65.4 Å²	65.4	38%	0.375	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	105.7	-178.1	-57.2	-71.2	0	0	0	109.5	T214 V218 A223 T224 R226	T214-H216 PolarHBondContact OG1-NE2 3.23Å; H216-V218 PolarHBondContact O-N 2.94Å; H216-A223 CarbonylContact O-C 3.51Å; H216-A223 WeakPolarHBondContact O-CA 3.43Å; H216-T224 PolarHBondContact N-O 2.66Å; H216-T224 PolarHBondContact O-N 2.96Å; H216-R226 PolarHBondContact CD2-NH1 3.42Å; H216-R226 VanDerWaalsContact CD2-NH1 3.31Å; H216-R226 PolarHBondContact NE2-NH1 2.85Å; H216-R226 VanDerWaalsContact NE2-NH1 3.2Å
217	P	94.1	Very high	95.8	Very high	99 Å²	99	63.5 Å²	63.5	64%	0.643	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.6	133.6	172.6	-21.9	32.1	0	0	0	110.9
218	V	91.3	Very high	96	Very high	92 Å²	92	62.9 Å²	62.9	56%	0.558	32%	0.32	S	S	*	.			trans	-107.8	-39.5	175.8	-178.1	0	0	0	0	110.1	H216 E222 T224	H216-V218 PolarHBondContact O-N 2.94Å; V218-E222 PolarHBondContact N-O 2.97Å; V218-T224 WeakPolarHBondContact CG2-OG1 3.44Å
219	S	92.4	Very high	96.1	Very high	52 Å²	52	58.1 Å²	58.1	36%	0.364	30%	0.298	S	S	.	.	S	Bend	trans	-148.6	-178.6	174.5	71.2	0	0	0	0	110.7	H221 E222	S219-H221 PolarHBondContact O-N 3.16Å; S219-H221 VanDerWaalsContact O-N 3.14Å; S219-H221 PolarHBondContact OG-N 3.31Å; S219-H221 VanDerWaalsContact OG-N 3.15Å; S219-E222 PolarHBondContact N-O 3.17Å; S219-E222 PolarHBondContact OG-N 3.33Å; S219-E222 VanDerWaalsContact OG-N 3.14Å
220	D	89.7	Confident	96.2	Very high	152 Å²	152	60.5 Å²	60.5	81%	0.813	31%	0.31	S	S	*	.	S	Bend	trans	-67.8	-2.6	171.3	-63.1	-27.5	0	0	0	113.5
221	H	92.9	Very high	96.1	Very high	144 Å²	144	54 Å²	54	67%	0.667	29%	0.286	S	S	*	.	S	Bend	trans	-124.1	-16.7	-175.9	-55.8	-29.4	0	0	0	113.4	S219 P274 S275	S219-H221 PolarHBondContact O-N 3.16Å; S219-H221 VanDerWaalsContact O-N 3.14Å; S219-H221 PolarHBondContact OG-N 3.31Å; S219-H221 VanDerWaalsContact OG-N 3.15Å; H221-P274 WeakPolarHBondContact O-CA 3.42Å; H221-S275 PolarHBondContact O-N 2.76Å; H221-S275 PolarHBondContact O-OG 3.42Å
222	E	95.4	Very high	96.1	Very high	95 Å²	95	52.3 Å²	52.3	44%	0.444	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	142.2	-171.4	-66.4	179.7	165.5	0	0	112.1	V218 S219 V272 V273 S275	V218-E222 PolarHBondContact N-O 2.97Å; S219-E222 PolarHBondContact N-O 3.17Å; S219-E222 PolarHBondContact OG-N 3.33Å; S219-E222 VanDerWaalsContact OG-N 3.14Å; E222-V272 HydrophobicContact CB-CG1 4.08Å; E222-V272 HydrophobicContact CG-CG1 4.3Å; E222-V273 WeakPolarHBondContact CA-O 3.3Å; E222-S275 PolarHBondContact N-OG 2.87Å
223	A	96.1	Very high	96	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	154.6	170.6	0	0	0	0	0	110.8	H215 H216 V272 V273	H215-A223 VanDerWaalsContact NE2-CB 3.26Å; H215-A223 WeakPolarHBondContact NE2-CB 3.43Å; H216-A223 CarbonylContact O-C 3.51Å; H216-A223 WeakPolarHBondContact O-CA 3.43Å; A223-V272 WeakPolarHBondContact O-CA 3.07Å; A223-V273 PolarHBondContact N-O 2.77Å; A223-V273 PolarHBondContact O-N 2.71Å
224	T	97.6	Very high	95.9	Very high	22 Å²	22	48.4 Å²	48.4	14%	0.135	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	121.6	168.3	-52.7	0	0	0	0	109.5	H216 V218 A270 V271	H216-T224 PolarHBondContact N-O 2.66Å; H216-T224 PolarHBondContact O-N 2.96Å; V218-T224 WeakPolarHBondContact CG2-OG1 3.44Å; T224-A270 HydrophobicContact CG2-CB 3.87Å; T224-V271 WeakPolarHBondContact CA-O 3.38Å
225	L	98.1	Very high	95.8	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	126.7	162.8	-63.1	-176.3	0	0	0	108.8	V213 T214 H215 W241 A270 V271 V273 E278 W298	V213-L225 HydrophobicContact CG1-CB 4.36Å; V213-L225 HydrophobicContact CG1-CD2 4.4Å; T214-L225 CarbonylContact O-C 3.55Å; T214-L225 WeakPolarHBondContact O-CA 3.39Å; H215-L225 HydrophobicContact CB-CD2 3.94Å; L225-W241 HydrophobicContact CB-CH2 3.66Å; L225-W241 HydrophobicContact CB-CZ2 3.77Å; L225-W241 HydrophobicContact CB-CZ3 4.48Å; L225-W241 HydrophobicContact CD1-CH2 3.96Å; L225-W241 HydrophobicContact CD1-CZ3 4.15Å; L225-W241 HydrophobicContact CG-CH2 4.46Å; L225-A270 CarbonylContact O-C 3.56Å; L225-A270 WeakPolarHBondContact O-CA 3.16Å; L225-V271 HydrophobicContact CB-CG2 4.22Å; L225-V271 PolarHBondContact N-O 3.04Å; L225-V271 PolarHBondContact O-N 2.94Å; L225-V273 HydrophobicContact CD1-CG1 4.04Å; L225-V273 HydrophobicContact CD1-CG2 4.11Å; L225-V273 HydrophobicContact CG-CG1 4.15Å; L225-V273 HydrophobicContact CG-CG2 3.87Å; L225-E278 HydrophobicContact CD1-CB 4.12Å; L225-E278 HydrophobicContact CD2-CB 4.45Å; L225-E278 HydrophobicContact CD2-CG 4.37Å; L225-W298 HydrophobicContact CD1-CB 4.44Å; L225-W298 HydrophobicContact CD2-CB 3.84Å; L225-W298 HydrophobicContact CD2-CD2 4.39Å; L225-W298 HydrophobicContact CD2-CG 4Å
226	R	98.3	Very high	95.8	Very high	48 Å²	48	51.8 Å²	51.8	18%	0.181	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	114.9	175.1	178.8	-178	-65.1	108.2	1.2	110.3	T214 H216 W228 W268 A269 A270	T214-R226 PolarHBondContact N-O 3.13Å; T214-R226 PolarHBondContact O-N 3.43Å; T214-R226 WeakPolarHBondContact OG1-CB 3.39Å; T214-R226 PolarHBondContact OG1-O 2.77Å; H216-R226 PolarHBondContact CD2-NH1 3.42Å; H216-R226 VanDerWaalsContact CD2-NH1 3.31Å; H216-R226 PolarHBondContact NE2-NH1 2.85Å; H216-R226 VanDerWaalsContact NE2-NH1 3.2Å; R226-W228 VanDerWaalsContact CD-CE2 3.45Å; R226-W228 VanDerWaalsContact CD-CZ2 3.42Å; R226-W228 HydrophobicContact CG-CZ2 4.43Å; R226-W268 HydrophobicContact CG-CB 3.99Å; R226-W268 HydrophobicContact CG-CD2 4.02Å; R226-W268 HydrophobicContact CG-CE3 3.78Å; R226-W268 HydrophobicContact CG-CG 4.16Å; R226-A269 WeakPolarHBondContact CA-O 3.42Å; R226-A270 HydrophobicContact CB-CB 3.92Å; R226-A270 HydrophobicContact CG-CB 4.11Å
227	C	98.4	Very high	95.8	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	124.3	174.4	-174.4	0	0	0	0	109.6	V213 W241 W268 A269 C283	V213-C227 HydrophobicContact CG2-CB 4.36Å; C227-W241 HydrophobicContact CB-CH2 4.46Å; C227-W241 HydrophobicContact CB-CZ2 3.61Å; C227-W268 CarbonylContact O-C 3.38Å; C227-W268 WeakPolarHBondContact O-CA 2.98Å; C227-W268 WeakPolarHBondContact O-CB 3.37Å; C227-A269 PolarHBondContact N-O 3.28Å; C227-A269 PolarHBondContact O-N 2.96Å; C227-C283 HydrophobicContact CB-CB 3.49Å; C227-C283 VanDerWaalsContact CB-CB 3.49Å; C227-C283 WeakPolarHBondContact CB-SG 3.42Å; C227-C283 WeakPolarHBondContact SG-CB 3.29Å; C227-C283 CovalentContact SG-SG 2.03Å; C227-C283 PolarHBondContact SG-SG 3.39Å
228	W	98.4	Very high	96	Very high	51 Å²	51	46.4 Å²	46.4	19%	0.193	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	143.2	179.7	-68	88.8	0	0	0	110.9	T211 H212 T214 R226 L230 W268	T211-W228 WeakPolarHBondContact CA-O 3.26Å; H212-W228 VanDerWaalsContact CE1-CB 3.48Å; H212-W228 WeakPolarHBondContact CE1-CB 3.3Å; H212-W228 AromaticContact CE1-CD1 3.9Å; H212-W228 AromaticContact CE1-CG 3.72Å; H212-W228 PolarHBondContact N-O 3.46Å; H212-W228 AromaticContact NE2-CD1 3.55Å; H212-W228 AromaticContact NE2-CG 3.83Å; H212-W228 PolarHBondContact O-N 2.87Å; T214-W228 PolarHBondContact OG1-NE1 3.04Å; R226-W228 VanDerWaalsContact CD-CE2 3.45Å; R226-W228 VanDerWaalsContact CD-CZ2 3.42Å; R226-W228 HydrophobicContact CG-CZ2 4.43Å; W228-L230 HydrophobicContact CB-CG 4.5Å; W228-L230 HydrophobicContact CE3-CD2 3.95Å; W228-W268 HydrophobicContact CD2-CB 3.99Å; W228-W268 HydrophobicContact CD2-CG 4.44Å; W228-W268 HydrophobicContact CE3-CB 3.88Å; W228-W268 AromaticContact CE3-CD1 3.78Å; W228-W268 HydrophobicContact CE3-CG 4.12Å; W228-W268 HydrophobicContact CG-CB 4.38Å; W228-W268 AromaticContact CH2-CD1 3.71Å; W228-W268 HydrophobicContact CH2-CG 4.35Å; W228-W268 HydrophobicContact CZ3-CB 4.36Å; W228-W268 AromaticContact CZ3-CD1 3.37Å; W228-W268 HydrophobicContact CZ3-CG 4.09Å
229	A	98.5	Very high	96.3	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	126.2	160.7	0	0	0	0	0	108	P209 T211 F232 I237 L239 Q266 K267	P209-A229 HydrophobicContact CB-CB 3.83Å; T211-A229 HydrophobicContact CG2-CB 4.3Å; A229-F232 HydrophobicContact CB-CD1 4.04Å; A229-F232 HydrophobicContact CB-CE1 3.76Å; A229-F232 WeakPolarHBondContact O-CE1 3.46Å; A229-I237 HydrophobicContact CB-CD1 3.72Å; A229-L239 HydrophobicContact CB-CD1 4.01Å; A229-L239 HydrophobicContact CB-CD2 4.2Å; A229-Q266 VanDerWaalsContact O-CA 3.32Å; A229-Q266 WeakPolarHBondContact O-CA 3.23Å; A229-K267 PolarHBondContact N-O 3.21Å; A229-K267 PolarHBondContact O-N 2.86Å; A229-K267 VanDerWaalsContact O-O 3.05Å
230	L	98.3	Very high	96.5	Very high	56 Å²	56	41.7 Å²	41.7	29%	0.293	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	143.8	-174.8	-59.7	176.9	0	0	0	111.2	K210 W228 Q266	K210-L230 WeakPolarHBondContact CB-O 3.23Å; K210-L230 PolarHBondContact N-O 2.71Å; K210-L230 PolarHBondContact O-N 2.88Å; K210-L230 VanDerWaalsContact O-N 3.09Å; W228-L230 HydrophobicContact CB-CG 4.5Å; W228-L230 HydrophobicContact CE3-CD2 3.95Å; L230-Q266 HydrophobicContact CD2-CB 3.6Å
231	G	97.4	Very high	96.9	Very high	15 Å²	15	34.5 Å²	34.5	16%	0.155	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	70.7	36.5	168.9	0	0	0	0	0	113.8	T264 F265	G231-T264 WeakPolarHBondContact CA-OG1 3.21Å; G231-F265 PolarHBondContact N-O 3.01Å
232	F	97.3	Very high	97.2	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	156.8	178	58.7	-89.5	0	0	0	112.6	E207 P209 A229 P234 I237 T257 T264 F265 K267 H287	E207-F232 WeakPolarHBondContact O-CA 3.46Å; E207-F232 VanDerWaalsContact O-CB 3.28Å; E207-F232 WeakPolarHBondContact O-CB 3.47Å; P209-F232 HydrophobicContact CB-CB 3.91Å; P209-F232 HydrophobicContact CB-CD1 3.88Å; P209-F232 HydrophobicContact CB-CG 4.16Å; A229-F232 HydrophobicContact CB-CD1 4.04Å; A229-F232 HydrophobicContact CB-CE1 3.76Å; A229-F232 WeakPolarHBondContact O-CE1 3.46Å; F232-P234 WeakPolarHBondContact CD2-O 3.45Å; F232-I237 HydrophobicContact CD1-CD1 3.88Å; F232-I237 HydrophobicContact CD2-CB 4.32Å; F232-I237 HydrophobicContact CD2-CD1 3.94Å; F232-I237 HydrophobicContact CE1-CD1 3.78Å; F232-I237 HydrophobicContact CE1-CG2 4.47Å; F232-I237 HydrophobicContact CE2-CB 3.79Å; F232-I237 HydrophobicContact CE2-CD1 3.87Å; F232-I237 HydrophobicContact CE2-CG1 4.42Å; F232-I237 HydrophobicContact CE2-CG2 3.56Å; F232-I237 HydrophobicContact CG-CD1 3.97Å; F232-I237 HydrophobicContact CZ-CB 4.19Å; F232-I237 HydrophobicContact CZ-CD1 3.81Å; F232-I237 HydrophobicContact CZ-CG2 3.55Å; F232-T257 HydrophobicContact CE2-CG2 4.03Å; F232-T257 HydrophobicContact CZ-CG2 3.88Å; F232-T264 CarbonylContact O-C 3.55Å; F232-T264 WeakPolarHBondContact O-CA 3.49Å; F232-T264 WeakPolarHBondContact O-CB 3.38Å; F232-F265 WeakPolarHBondContact CD1-O 3.49Å; F232-F265 HydrophobicContact CD2-CB 3.91Å; F232-F265 HydrophobicContact CE1-CB 4.34Å; F232-F265 WeakPolarHBondContact CE1-O 3.49Å; F232-F265 HydrophobicContact CE2-CB 3.47Å; F232-F265 VanDerWaalsContact CE2-CB 3.47Å; F232-F265 HydrophobicContact CG-CB 4.48Å; F232-F265 HydrophobicContact CZ-CB 3.7Å; F232-F265 PolarHBondContact N-O 3.27Å; F232-F265 PolarHBondContact O-N 3.47Å; F232-K267 HydrophobicContact CE1-CB 4.41Å; F232-K267 HydrophobicContact CZ-CB 4.11Å; F232-H287 AromaticContact CD2-CD2 3.89Å; F232-H287 AromaticContact CD2-NE2 3.8Å
233	Y	95.8	Very high	97.3	Very high	6 Å²	6	28.4 Å²	28.4	2%	0.024	14%	0.143	C	C	.	.	B	Isolated β-bridge	trans	-152.4	137.6	173	176.8	-81.9	0	0	0	107.9	D54 T55 R205 A206 E207 G263 F265 H287	D54-Y233 HydrophobicContact CB-CE2 4Å; T55-Y233 WeakPolarHBondContact OG1-CE2 3.45Å; T55-Y233 PolarHBondContact OG1-OH 2.79Å; R205-Y233 HydrophobicContact CG-CD1 4.39Å; R205-Y233 VanDerWaalsContact O-CD1 3.3Å; R205-Y233 WeakPolarHBondContact O-CD1 3.38Å; A206-Y233 CarbonylContact C-O 3.58Å; A206-Y233 WeakPolarHBondContact CA-O 3.35Å; E207-Y233 PolarHBondContact N-O 2.87Å; E207-Y233 PolarHBondContact O-N 2.75Å; E207-Y233 VanDerWaalsContact O-N 3.15Å; Y233-G263 WeakPolarHBondContact CD2-O 3.04Å; Y233-F265 HydrophobicContact CD2-CD2 4.45Å; Y233-F265 HydrophobicContact CD2-CE2 4.04Å; Y233-F265 HydrophobicContact CE2-CE2 4.5Å; Y233-H287 PolarHBondContact O-CE1 2.67Å
234	P	94.9	Very high	97.2	Very high	17 Å²	17	33.2 Å²	33.2	11%	0.11	17%	0.169	C	C	.	.	S	Bend	cis	-69.1	179	-0.9	29.8	-37.3	0	0	0	113.1	D54 F232 E236 H287 E288	D54-P234 VanDerWaalsContact OD2-CB 3.22Å; D54-P234 WeakPolarHBondContact OD2-CB 3.44Å; F232-P234 WeakPolarHBondContact CD2-O 3.45Å; P234-E236 VanDerWaalsContact C-N 3.34Å; P234-H287 PolarHBondContact O-NE2 3.38Å; P234-E288 VanDerWaalsContact CD-CD 3.45Å; P234-E288 WeakPolarHBondContact CD-OE1 3.18Å; P234-E288 HydrophobicContact CG-CG 3.66Å
235	A	96.3	Very high	97	Very high	14 Å²	14	34.4 Å²	34.4	12%	0.116	19%	0.186	C	C	.	.	S	Bend	trans	-72.6	-23	-175.7	0	0	0	0	0	114.1	D54 I237 T257 F265	D54-A235 HydrophobicContact CB-CB 4.36Å; D54-A235 VanDerWaalsContact CG-CB 3.48Å; D54-A235 WeakPolarHBondContact OD1-CB 3.24Å; D54-A235 WeakPolarHBondContact OD2-CB 3.42Å; D54-A235 PolarHBondContact OD2-N 3.42Å; A235-I237 PolarHBondContact O-N 3.29Å; A235-T257 HydrophobicContact CB-CG2 4.28Å; A235-T257 WeakPolarHBondContact O-CG2 3.03Å; A235-F265 HydrophobicContact CB-CD1 3.74Å; A235-F265 HydrophobicContact CB-CD2 3.72Å; A235-F265 HydrophobicContact CB-CE1 3.77Å; A235-F265 HydrophobicContact CB-CE2 3.76Å; A235-F265 HydrophobicContact CB-CG 3.72Å; A235-F265 HydrophobicContact CB-CZ 3.81Å
236	E	95.4	Very high	96.8	Very high	144 Å²	144	41.5 Å²	41.5	67%	0.673	22%	0.219	S	C	*	.			trans	-66.2	117.1	179.9	-172.6	51.7	-130.7	0	0	110.5	P234 H287	P234-E236 VanDerWaalsContact C-N 3.34Å; E236-H287 PolarHBondContact O-CD2 2.83Å; E236-H287 VanDerWaalsContact O-CD2 3.23Å
237	I	96.2	Very high	96.7	Very high	9 Å²	9	43.7 Å²	43.7	5%	0.046	23%	0.234	C	C	.	.			trans	-154.8	135.1	-175.8	-163.3	171.7	0	0	0	110.4	P209 A229 F232 A235 L239 K267 V285 Q286 H287	P209-I237 HydrophobicContact CB-CD1 4.03Å; P209-I237 HydrophobicContact CG-CD1 4.11Å; A229-I237 HydrophobicContact CB-CD1 3.72Å; F232-I237 HydrophobicContact CD1-CD1 3.88Å; F232-I237 HydrophobicContact CD2-CB 4.32Å; F232-I237 HydrophobicContact CD2-CD1 3.94Å; F232-I237 HydrophobicContact CE1-CD1 3.78Å; F232-I237 HydrophobicContact CE1-CG2 4.47Å; F232-I237 HydrophobicContact CE2-CB 3.79Å; F232-I237 HydrophobicContact CE2-CD1 3.87Å; F232-I237 HydrophobicContact CE2-CG1 4.42Å; F232-I237 HydrophobicContact CE2-CG2 3.56Å; F232-I237 HydrophobicContact CG-CD1 3.97Å; F232-I237 HydrophobicContact CZ-CB 4.19Å; F232-I237 HydrophobicContact CZ-CD1 3.81Å; F232-I237 HydrophobicContact CZ-CG2 3.55Å; A235-I237 PolarHBondContact O-N 3.29Å; I237-L239 HydrophobicContact CD1-CD1 3.7Å; I237-L239 HydrophobicContact CG1-CD1 3.67Å; I237-L239 HydrophobicContact CG2-CD1 4.17Å; I237-K267 HydrophobicContact CG2-CB 4.25Å; I237-K267 HydrophobicContact CG2-CD 3.56Å; I237-V285 HydrophobicContact CD1-CG1 4.03Å; I237-V285 HydrophobicContact CG1-CG1 4.34Å; I237-Q286 VanDerWaalsContact CG1-O 3.31Å; I237-Q286 WeakPolarHBondContact CG1-O 3.21Å; I237-H287 HydrophobicContact CD1-CB 4.25Å; I237-H287 HydrophobicContact CG1-CB 4.04Å
238	T	97.1	Very high	96.5	Very high	58 Å²	58	45 Å²	45	36%	0.356	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	121.9	173.8	-65.7	0	0	0	0	110.1	T240 V285 Q286	T238-T240 HydrophobicContact CG2-CG2 3.98Å; T238-V285 WeakPolarHBondContact O-CA 3.13Å; T238-Q286 PolarHBondContact N-O 3.21Å; T238-Q286 PolarHBondContact O-N 2.72Å
239	L	97.8	Very high	96	Very high	7 Å²	7	47.5 Å²	47.5	4%	0.037	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	121.2	170.5	-88.9	62.5	0	0	0	108	A229 I237 L254 K267 A269 H284 V285	A229-L239 HydrophobicContact CB-CD1 4.01Å; A229-L239 HydrophobicContact CB-CD2 4.2Å; I237-L239 HydrophobicContact CD1-CD1 3.7Å; I237-L239 HydrophobicContact CG1-CD1 3.67Å; I237-L239 HydrophobicContact CG2-CD1 4.17Å; L239-L254 HydrophobicContact CB-CD1 4.15Å; L239-K267 HydrophobicContact CD1-CD 4.32Å; L239-K267 HydrophobicContact CD2-CB 4.33Å; L239-K267 HydrophobicContact CD2-CG 4.41Å; L239-A269 HydrophobicContact CB-CB 4.06Å; L239-A269 HydrophobicContact CD2-CB 4.32Å; L239-H284 WeakPolarHBondContact CA-O 3.27Å; L239-V285 HydrophobicContact CD1-CG1 4Å; L239-V285 HydrophobicContact CD1-CG2 4.46Å; L239-V285 HydrophobicContact CG-CG2 4.29Å
240	T	97.5	Very high	95.5	Very high	37 Å²	37	56.6 Å²	56.6	23%	0.227	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	151.6	174	59.5	0	0	0	0	111.4	T238 C283 H284	T238-T240 HydrophobicContact CG2-CG2 3.98Å; T240-C283 CarbonylContact O-C 3.58Å; T240-C283 WeakPolarHBondContact O-CA 3.39Å; T240-H284 PolarHBondContact N-O 3.03Å; T240-H284 PolarHBondContact O-N 2.8Å
241	W	98.2	Very high	95	Very high	2 Å²	2	59.6 Å²	59.6	1%	0.008	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	136.9	168.4	-82.9	104.1	0	0	0	110	V213 L225 C227 Q248 A269 V271 T282 C283	V213-W241 HydrophobicContact CG1-CH2 3.85Å; V213-W241 HydrophobicContact CG1-CZ2 4.29Å; V213-W241 HydrophobicContact CG2-CH2 4.26Å; L225-W241 HydrophobicContact CB-CH2 3.66Å; L225-W241 HydrophobicContact CB-CZ2 3.77Å; L225-W241 HydrophobicContact CB-CZ3 4.48Å; L225-W241 HydrophobicContact CD1-CH2 3.96Å; L225-W241 HydrophobicContact CD1-CZ3 4.15Å; L225-W241 HydrophobicContact CG-CH2 4.46Å; C227-W241 HydrophobicContact CB-CH2 4.46Å; C227-W241 HydrophobicContact CB-CZ2 3.61Å; W241-Q248 HydrophobicContact CB-CB 4.32Å; W241-Q248 PolarHBondContact O-N 3.19Å; W241-A269 PolarHBondContact NE1-O 2.92Å; W241-V271 HydrophobicContact CB-CG1 3.72Å; W241-V271 HydrophobicContact CB-CG2 4.42Å; W241-V271 HydrophobicContact CD2-CG1 4.39Å; W241-V271 HydrophobicContact CD2-CG2 3.63Å; W241-V271 HydrophobicContact CE3-CG2 4.03Å; W241-V271 HydrophobicContact CG-CB 4.4Å; W241-V271 HydrophobicContact CG-CG1 3.67Å; W241-V271 HydrophobicContact CG-CG2 3.82Å; W241-V271 HydrophobicContact CZ2-CG2 4.27Å; W241-T282 WeakPolarHBondContact CA-O 3.45Å; W241-C283 HydrophobicContact CD2-CB 4.1Å; W241-C283 HydrophobicContact CE3-CB 4.05Å; W241-C283 HydrophobicContact CH2-CB 4.01Å; W241-C283 HydrophobicContact CZ2-CB 4.06Å; W241-C283 HydrophobicContact CZ3-CB 4Å
242	Q	97.9	Very high	94.9	Very high	40 Å²	40	60 Å²	60	19%	0.187	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	148.5	171	-72.3	-175.4	-4.4	0	0	110.5	E246 D247 Y281 T282	Q242-E246 CarbonylContact C-O 3.54Å; Q242-E246 VanDerWaalsContact CA-O 3.25Å; Q242-E246 WeakPolarHBondContact CA-O 3.44Å; Q242-D247 WeakPolarHBondContact CG-OD1 3.4Å; Q242-D247 PolarHBondContact NE2-OD1 2.98Å; Q242-Y281 CarbonylContact O-C 3.55Å; Q242-Y281 VanDerWaalsContact O-CA 3.26Å; Q242-Y281 WeakPolarHBondContact O-CA 3.41Å; Q242-T282 PolarHBondContact N-O 3.2Å; Q242-T282 PolarHBondContact O-N 2.82Å
243	R	97.4	Very high	94.9	Very high	70 Å²	70	65.4 Å²	65.4	26%	0.264	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	117	168.8	-175.1	-170.7	-173.3	-178.9	2	108	G245 E246 Q248 E277 R280 Y281	R243-G245 PolarHBondContact O-N 2.81Å; R243-E246 PolarHBondContact N-O 2.94Å; R243-E246 PolarHBondContact O-N 2.85Å; R243-Q248 HydrophobicContact CB-CG 3.96Å; R243-E277 IonicContact CZ-OE2 3.27Å; R243-E277 IonicContact NE-OE2 2.76Å; R243-E277 IonicContact NH2-OE1 3.66Å; R243-E277 IonicContact NH2-OE2 2.88Å; R243-E277 PolarHBondContact NH2-OE2 3.04Å; R243-R280 WeakPolarHBondContact CA-O 3.39Å; R243-R280 HydrophobicContact CG-CB 4.33Å; R243-Y281 HydrophobicContact CB-CD1 4.04Å; R243-Y281 HydrophobicContact CB-CE1 3.85Å; R243-Y281 WeakPolarHBondContact CD-OH 3.31Å; R243-Y281 HydrophobicContact CG-CD1 4.35Å; R243-Y281 HydrophobicContact CG-CD2 4.48Å; R243-Y281 HydrophobicContact CG-CE1 3.97Å; R243-Y281 HydrophobicContact CG-CE2 4.09Å; R243-Y281 PolarHBondContact NE-OH 3.14Å
244	D	95.4	Very high	94.9	Very high	102 Å²	102	69.4 Å²	69.4	55%	0.545	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	22.7	-174.9	-52.5	-54.9	0	0	0	115	R280	D244-R280 PolarHBondContact N-O 3.42Å; D244-R280 IonicContact OD1-NE 3.54Å; D244-R280 PolarHBondContact OD1-NE 3.42Å; D244-R280 IonicContact OD2-CZ 3.39Å; D244-R280 IonicContact OD2-NE 3.61Å; D244-R280 PolarHBondContact OD2-NE 3.11Å; D244-R280 IonicContact OD2-NH2 2.67Å; D244-R280 PolarHBondContact OD2-NH2 2.95Å
245	G	91.6	Very high	95	Very high	47 Å²	47	70.2 Å²	70.2	49%	0.485	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	99	-1.9	-176.8	0	0	0	0	0	115.7	R243	R243-G245 PolarHBondContact O-N 2.81Å
246	E	95.5	Very high	95	Very high	148 Å²	148	77.8 Å²	77.8	69%	0.692	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.7	126.3	175.8	-62.3	-172.3	164.6	0	0	111.5	Q242 R243 Q248	Q242-E246 CarbonylContact C-O 3.54Å; Q242-E246 VanDerWaalsContact CA-O 3.25Å; Q242-E246 WeakPolarHBondContact CA-O 3.44Å; R243-E246 PolarHBondContact N-O 2.94Å; R243-E246 PolarHBondContact O-N 2.85Å; E246-Q248 PolarHBondContact O-NE2 3.02Å
247	D	95.3	Very high	95.1	Very high	94 Å²	94	73.2 Å²	73.2	50%	0.503	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	132.9	-179.3	-67.9	-37.2	0	0	0	112.6	Q242	Q242-D247 WeakPolarHBondContact CG-OD1 3.4Å; Q242-D247 PolarHBondContact NE2-OD1 2.98Å
248	Q	94.9	Very high	95.2	Very high	28 Å²	28	77.6 Å²	77.6	13%	0.131	40%	0.402	C	S	.	.			trans	-102.6	34.8	-175.8	-55.6	-62.3	-81.5	0	0	112.3	W241 R243 E246 Q250 D251 T252 V271 Y281	W241-Q248 HydrophobicContact CB-CB 4.32Å; W241-Q248 PolarHBondContact O-N 3.19Å; R243-Q248 HydrophobicContact CB-CG 3.96Å; E246-Q248 PolarHBondContact O-NE2 3.02Å; Q248-Q250 VanDerWaalsContact C-N 3.29Å; Q248-Q250 PolarHBondContact O-N 2.74Å; Q248-Q250 VanDerWaalsContact O-N 3.17Å; Q248-D251 PolarHBondContact O-N 2.9Å; Q248-D251 VanDerWaalsContact O-N 3.13Å; Q248-T252 WeakPolarHBondContact O-CB 3.43Å; Q248-T252 PolarHBondContact O-N 2.04Å; Q248-T252 VanDerWaalsContact O-N 3.1Å; Q248-T252 PolarHBondContact O-OG1 3.35Å; Q248-V271 HydrophobicContact CB-CG1 4.4Å; Q248-Y281 HydrophobicContact CG-CE1 4.36Å
249	T	88.3	Confident	95.2	Very high	104 Å²	104	79.2 Å²	79.2	64%	0.638	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-32.1	-167.1	-47.9	0	0	0	0	114.5
250	Q	88.1	Confident	95.1	Very high	191 Å²	191	81.3 Å²	81.3	89%	0.893	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-30.7	179.8	-64.8	-172.5	6.2	0	0	113	Q248	Q248-Q250 VanDerWaalsContact C-N 3.29Å; Q248-Q250 PolarHBondContact O-N 2.74Å; Q248-Q250 VanDerWaalsContact O-N 3.17Å
251	D	87.2	Confident	94.9	Very high	119 Å²	119	83.3 Å²	83.3	64%	0.636	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	3.1	-178.6	-53.7	-67.6	0	0	0	112.5	Q248	Q248-D251 PolarHBondContact O-N 2.9Å; Q248-D251 VanDerWaalsContact O-N 3.13Å
252	T	94.7	Very high	94.6	Very high	24 Å²	24	88.6 Å²	88.6	15%	0.147	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	118.3	179.6	-61.5	0	0	0	0	111.4	Q248 L254 A269 A270 V271	Q248-T252 WeakPolarHBondContact O-CB 3.43Å; Q248-T252 PolarHBondContact O-N 2.04Å; Q248-T252 VanDerWaalsContact O-N 3.1Å; Q248-T252 PolarHBondContact O-OG1 3.35Å; T252-L254 HydrophobicContact CG2-CB 4.36Å; T252-L254 PolarHBondContact O-N 2.84Å; T252-A269 HydrophobicContact CG2-CB 3.92Å; T252-A270 CarbonylContact C-O 3.6Å; T252-A270 WeakPolarHBondContact CA-O 3.47Å; T252-V271 HydrophobicContact CG2-CG1 4.41Å; T252-V271 VanDerWaalsContact OG1-CG1 3.3Å; T252-V271 WeakPolarHBondContact OG1-CG1 3.26Å
253	E	96.8	Very high	94.3	Very high	112 Å²	112	88.8 Å²	88.8	52%	0.523	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	102.4	162.6	-173.7	-172.7	-164.1	0	0	109	W268 A269 A270	E253-W268 HydrophobicContact CB-CZ3 4.28Å; E253-W268 HydrophobicContact CG-CH2 3.98Å; E253-W268 HydrophobicContact CG-CZ3 3.86Å; E253-W268 VanDerWaalsContact OE2-CH2 3.3Å; E253-W268 WeakPolarHBondContact OE2-CH2 3.4Å; E253-W268 WeakPolarHBondContact OE2-CZ3 3.46Å; E253-A269 CarbonylContact O-C 3.51Å; E253-A269 WeakPolarHBondContact O-CA 3.44Å; E253-A270 HydrophobicContact CB-CB 4.41Å; E253-A270 PolarHBondContact N-O 3.39Å; E253-A270 PolarHBondContact O-N 3.29Å
254	L	96.8	Very high	94.3	Very high	90 Å²	90	85.8 Å²	85.8	47%	0.471	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	120	177.6	-174.5	69.3	0	0	0	110.2	L239 T252 K267 A269	L239-L254 HydrophobicContact CB-CD1 4.15Å; T252-L254 HydrophobicContact CG2-CB 4.36Å; T252-L254 PolarHBondContact O-N 2.84Å; L254-K267 HydrophobicContact CD1-CD 4.49Å; L254-A269 HydrophobicContact CD1-CB 3.67Å
255	V	96.6	Very high	94.4	Very high	35 Å²	35	82.2 Å²	82.2	21%	0.212	47%	0.47	C	S	.	.	P	Polyproline II helix	trans	-84.7	153.2	175	-63.6	0	0	0	0	112.5	K267 W268	V255-K267 HydrophobicContact CG2-CG 4.48Å; V255-K267 WeakPolarHBondContact O-CE 3.43Å; V255-K267 WeakPolarHBondContact O-CG 3.02Å; V255-K267 PolarHBondContact O-NZ 2.9Å; V255-W268 HydrophobicContact CG1-CD2 4.05Å; V255-W268 VanDerWaalsContact CG1-CE2 3.49Å; V255-W268 HydrophobicContact CG1-CE3 4.35Å; V255-W268 HydrophobicContact CG1-CH2 3.73Å; V255-W268 HydrophobicContact CG1-CZ2 3.35Å; V255-W268 HydrophobicContact CG1-CZ3 4.19Å; V255-W268 HydrophobicContact CG2-CD2 3.84Å; V255-W268 HydrophobicContact CG2-CG 3.79Å; V255-W268 WeakPolarHBondContact CG2-O 3.35Å; V255-W268 PolarHBondContact N-O 3.18Å
256	E	96.5	Very high	94.7	Very high	173 Å²	173	82 Å²	82	81%	0.808	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-55.7	147.8	166.6	-67.7	-176.5	169.9	0	0	111.2	R258	E256-R258 PolarHBondContact O-N 3.19Å
257	T	97.8	Very high	94.9	Very high	47 Å²	47	76 Å²	76	29%	0.288	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-70.3	128.6	175	-55.4	0	0	0	0	108.5	F232 A235 F265 K267	F232-T257 HydrophobicContact CE2-CG2 4.03Å; F232-T257 HydrophobicContact CZ-CG2 3.88Å; A235-T257 HydrophobicContact CB-CG2 4.28Å; A235-T257 WeakPolarHBondContact O-CG2 3.03Å; T257-F265 HydrophobicContact CG2-CB 3.84Å; T257-F265 HydrophobicContact CG2-CD1 4Å; T257-F265 HydrophobicContact CG2-CG 4.21Å; T257-K267 WeakPolarHBondContact OG1-CD 3.27Å; T257-K267 PolarHBondContact OG1-NZ 3.02Å
258	R	97.2	Very high	95	Very high	101 Å²	101	72.7 Å²	72.7	38%	0.381	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	145.2	-174.4	70.1	-166.2	-177.2	-172	2.6	111.2	E256 Q266	E256-R258 PolarHBondContact O-N 3.19Å; R258-Q266 HydrophobicContact CG-CG 3.67Å; R258-Q266 PolarHBondContact N-O 3.27Å; R258-Q266 VanDerWaalsContact O-CG 3.29Å; R258-Q266 WeakPolarHBondContact O-CG 3.45Å; R258-Q266 PolarHBondContact O-N 3.2Å
259	P	97.1	Very high	95.2	Very high	92 Å²	92	71.3 Å²	71.3	60%	0.597	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.7	149	177.6	27.8	-34.7	0	0	0	111.4	F265 Q266	P259-F265 HydrophobicContact CB-CD1 4.44Å; P259-F265 HydrophobicContact CB-CE1 4.18Å; P259-Q266 PolarHBondContact O-NE2 3.36Å
260	A	96.5	Very high	95.6	Very high	52 Å²	52	66.5 Å²	66.5	43%	0.43	37%	0.373	S	S	.	.			trans	-89.2	-20.6	170.5	0	0	0	0	0	112.6	T264 Q266	A260-T264 WeakPolarHBondContact CB-O 3.36Å; A260-T264 PolarHBondContact N-O 3.36Å; A260-Q266 HydrophobicContact CB-CG 4.49Å
261	G	93.1	Very high	96.1	Very high	78 Å²	78	57.6 Å²	57.6	80%	0.804	33%	0.331	S	S	*	.	S	Bend	trans	98.2	-6.7	178.1	0	0	0	0	0	115.1
262	D	92.6	Very high	96.6	Very high	114 Å²	114	55.8 Å²	55.8	61%	0.61	32%	0.324	S	S	*	.	S	Bend	trans	-101.1	6.5	175.1	58.9	4.1	0	0	0	113.4	T264	D262-T264 WeakPolarHBondContact OD1-CB 3.41Å; D262-T264 PolarHBondContact OD1-N 3.41Å; D262-T264 PolarHBondContact OD1-OG1 2.88Å
263	G	91.3	Very high	96.7	Very high	44 Å²	44	54.7 Å²	54.7	45%	0.454	32%	0.317	S	S	.	.	S	Bend	trans	96.6	-6.7	-172.1	0	0	0	0	0	114	Y233	Y233-G263 WeakPolarHBondContact CD2-O 3.04Å
264	T	96.4	Very high	96.7	Very high	7 Å²	7	51.6 Å²	51.6	4%	0.043	31%	0.307	C	S	.	.			trans	-101.2	172.4	175.4	74	0	0	0	0	112.6	G231 F232 A260 D262	G231-T264 WeakPolarHBondContact CA-OG1 3.21Å; F232-T264 CarbonylContact O-C 3.55Å; F232-T264 WeakPolarHBondContact O-CA 3.49Å; F232-T264 WeakPolarHBondContact O-CB 3.38Å; A260-T264 WeakPolarHBondContact CB-O 3.36Å; A260-T264 PolarHBondContact N-O 3.36Å; D262-T264 WeakPolarHBondContact OD1-CB 3.41Å; D262-T264 PolarHBondContact OD1-N 3.41Å; D262-T264 PolarHBondContact OD1-OG1 2.88Å
265	F	98.1	Very high	96.5	Very high	27 Å²	27	50 Å²	50	12%	0.118	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	164.2	-177	-65.6	-85	0	0	0	112.5	D54 G231 F232 Y233 A235 T257 P259	D54-F265 HydrophobicContact CB-CE2 3.71Å; D54-F265 HydrophobicContact CB-CZ 3.72Å; G231-F265 PolarHBondContact N-O 3.01Å; F232-F265 WeakPolarHBondContact CD1-O 3.49Å; F232-F265 HydrophobicContact CD2-CB 3.91Å; F232-F265 HydrophobicContact CE1-CB 4.34Å; F232-F265 WeakPolarHBondContact CE1-O 3.49Å; F232-F265 HydrophobicContact CE2-CB 3.47Å; F232-F265 VanDerWaalsContact CE2-CB 3.47Å; F232-F265 HydrophobicContact CG-CB 4.48Å; F232-F265 HydrophobicContact CZ-CB 3.7Å; F232-F265 PolarHBondContact N-O 3.27Å; F232-F265 PolarHBondContact O-N 3.47Å; Y233-F265 HydrophobicContact CD2-CD2 4.45Å; Y233-F265 HydrophobicContact CD2-CE2 4.04Å; Y233-F265 HydrophobicContact CE2-CE2 4.5Å; A235-F265 HydrophobicContact CB-CD1 3.74Å; A235-F265 HydrophobicContact CB-CD2 3.72Å; A235-F265 HydrophobicContact CB-CE1 3.77Å; A235-F265 HydrophobicContact CB-CE2 3.76Å; A235-F265 HydrophobicContact CB-CG 3.72Å; A235-F265 HydrophobicContact CB-CZ 3.81Å; T257-F265 HydrophobicContact CG2-CB 3.84Å; T257-F265 HydrophobicContact CG2-CD1 4Å; T257-F265 HydrophobicContact CG2-CG 4.21Å; P259-F265 HydrophobicContact CB-CD1 4.44Å; P259-F265 HydrophobicContact CB-CE1 4.18Å
266	Q	98.3	Very high	96.2	Very high	42 Å²	42	51.6 Å²	51.6	20%	0.196	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	144	176.7	39.1	162.5	-24.1	0	0	110.1	A229 L230 R258 P259 A260	A229-Q266 VanDerWaalsContact O-CA 3.32Å; A229-Q266 WeakPolarHBondContact O-CA 3.23Å; L230-Q266 HydrophobicContact CD2-CB 3.6Å; R258-Q266 HydrophobicContact CG-CG 3.67Å; R258-Q266 PolarHBondContact N-O 3.27Å; R258-Q266 VanDerWaalsContact O-CG 3.29Å; R258-Q266 WeakPolarHBondContact O-CG 3.45Å; R258-Q266 PolarHBondContact O-N 3.2Å; P259-Q266 PolarHBondContact O-NE2 3.36Å; A260-Q266 HydrophobicContact CB-CG 4.49Å
267	K	98.5	Very high	96.2	Very high	22 Å²	22	45.9 Å²	45.9	10%	0.096	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	157	177.2	-160.9	-175.9	-169.5	65.8	0	109	A229 F232 I237 L239 L254 V255 T257	A229-K267 PolarHBondContact N-O 3.21Å; A229-K267 PolarHBondContact O-N 2.86Å; A229-K267 VanDerWaalsContact O-O 3.05Å; F232-K267 HydrophobicContact CE1-CB 4.41Å; F232-K267 HydrophobicContact CZ-CB 4.11Å; I237-K267 HydrophobicContact CG2-CB 4.25Å; I237-K267 HydrophobicContact CG2-CD 3.56Å; L239-K267 HydrophobicContact CD1-CD 4.32Å; L239-K267 HydrophobicContact CD2-CB 4.33Å; L239-K267 HydrophobicContact CD2-CG 4.41Å; L254-K267 HydrophobicContact CD1-CD 4.49Å; V255-K267 HydrophobicContact CG2-CG 4.48Å; V255-K267 WeakPolarHBondContact O-CE 3.43Å; V255-K267 WeakPolarHBondContact O-CG 3.02Å; V255-K267 PolarHBondContact O-NZ 2.9Å; T257-K267 WeakPolarHBondContact OG1-CD 3.27Å; T257-K267 PolarHBondContact OG1-NZ 3.02Å
268	W	98.3	Very high	96.1	Very high	24 Å²	24	44.6 Å²	44.6	9%	0.091	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	157.3	167.8	58.2	-97.2	0	0	0	111.6	R226 C227 W228 E253 V255 A270	R226-W268 HydrophobicContact CG-CB 3.99Å; R226-W268 HydrophobicContact CG-CD2 4.02Å; R226-W268 HydrophobicContact CG-CE3 3.78Å; R226-W268 HydrophobicContact CG-CG 4.16Å; C227-W268 CarbonylContact O-C 3.38Å; C227-W268 WeakPolarHBondContact O-CA 2.98Å; C227-W268 WeakPolarHBondContact O-CB 3.37Å; W228-W268 HydrophobicContact CD2-CB 3.99Å; W228-W268 HydrophobicContact CD2-CG 4.44Å; W228-W268 HydrophobicContact CE3-CB 3.88Å; W228-W268 AromaticContact CE3-CD1 3.78Å; W228-W268 HydrophobicContact CE3-CG 4.12Å; W228-W268 HydrophobicContact CG-CB 4.38Å; W228-W268 AromaticContact CH2-CD1 3.71Å; W228-W268 HydrophobicContact CH2-CG 4.35Å; W228-W268 HydrophobicContact CZ3-CB 4.36Å; W228-W268 AromaticContact CZ3-CD1 3.37Å; W228-W268 HydrophobicContact CZ3-CG 4.09Å; E253-W268 HydrophobicContact CB-CZ3 4.28Å; E253-W268 HydrophobicContact CG-CH2 3.98Å; E253-W268 HydrophobicContact CG-CZ3 3.86Å; E253-W268 VanDerWaalsContact OE2-CH2 3.3Å; E253-W268 WeakPolarHBondContact OE2-CH2 3.4Å; E253-W268 WeakPolarHBondContact OE2-CZ3 3.46Å; V255-W268 HydrophobicContact CG1-CD2 4.05Å; V255-W268 VanDerWaalsContact CG1-CE2 3.49Å; V255-W268 HydrophobicContact CG1-CE3 4.35Å; V255-W268 HydrophobicContact CG1-CH2 3.73Å; V255-W268 HydrophobicContact CG1-CZ2 3.35Å; V255-W268 HydrophobicContact CG1-CZ3 4.19Å; V255-W268 HydrophobicContact CG2-CD2 3.84Å; V255-W268 HydrophobicContact CG2-CG 3.79Å; V255-W268 WeakPolarHBondContact CG2-O 3.35Å; V255-W268 PolarHBondContact N-O 3.18Å; W268-A270 HydrophobicContact CE3-CB 3.92Å; W268-A270 HydrophobicContact CZ3-CB 3.63Å
269	A	98.4	Very high	96	Very high	0 Å²	0	44 Å²	44	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	132.1	173.9	0	0	0	0	0	108.3	R226 C227 L239 W241 T252 E253 L254	R226-A269 WeakPolarHBondContact CA-O 3.42Å; C227-A269 PolarHBondContact N-O 3.28Å; C227-A269 PolarHBondContact O-N 2.96Å; L239-A269 HydrophobicContact CB-CB 4.06Å; L239-A269 HydrophobicContact CD2-CB 4.32Å; W241-A269 PolarHBondContact NE1-O 2.92Å; T252-A269 HydrophobicContact CG2-CB 3.92Å; E253-A269 CarbonylContact O-C 3.51Å; E253-A269 WeakPolarHBondContact O-CA 3.44Å; L254-A269 HydrophobicContact CD1-CB 3.67Å
270	A	98.1	Very high	96	Very high	3 Å²	3	44.3 Å²	44.3	3%	0.025	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	145.1	179.3	0	0	0	0	0	112.5	T224 L225 R226 T252 E253 W268	T224-A270 HydrophobicContact CG2-CB 3.87Å; L225-A270 CarbonylContact O-C 3.56Å; L225-A270 WeakPolarHBondContact O-CA 3.16Å; R226-A270 HydrophobicContact CB-CB 3.92Å; R226-A270 HydrophobicContact CG-CB 4.11Å; T252-A270 CarbonylContact C-O 3.6Å; T252-A270 WeakPolarHBondContact CA-O 3.47Å; E253-A270 HydrophobicContact CB-CB 4.41Å; E253-A270 PolarHBondContact N-O 3.39Å; E253-A270 PolarHBondContact O-N 3.29Å; W268-A270 HydrophobicContact CE3-CB 3.92Å; W268-A270 HydrophobicContact CZ3-CB 3.63Å
271	V	97.8	Very high	96	Very high	4 Å²	4	42.3 Å²	42.3	2%	0.024	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	145	173.9	-74.2	0	0	0	0	109.6	T224 L225 W241 Q248 T252 V273 Y281	T224-V271 WeakPolarHBondContact CA-O 3.38Å; L225-V271 HydrophobicContact CB-CG2 4.22Å; L225-V271 PolarHBondContact N-O 3.04Å; L225-V271 PolarHBondContact O-N 2.94Å; W241-V271 HydrophobicContact CB-CG1 3.72Å; W241-V271 HydrophobicContact CB-CG2 4.42Å; W241-V271 HydrophobicContact CD2-CG1 4.39Å; W241-V271 HydrophobicContact CD2-CG2 3.63Å; W241-V271 HydrophobicContact CE3-CG2 4.03Å; W241-V271 HydrophobicContact CG-CB 4.4Å; W241-V271 HydrophobicContact CG-CG1 3.67Å; W241-V271 HydrophobicContact CG-CG2 3.82Å; W241-V271 HydrophobicContact CZ2-CG2 4.27Å; Q248-V271 HydrophobicContact CB-CG1 4.4Å; T252-V271 HydrophobicContact CG2-CG1 4.41Å; T252-V271 VanDerWaalsContact OG1-CG1 3.3Å; T252-V271 WeakPolarHBondContact OG1-CG1 3.26Å; V271-V273 HydrophobicContact CB-CG1 4.4Å; V271-V273 HydrophobicContact CG2-CG1 3.79Å; V271-Y281 HydrophobicContact CG2-CD1 4.15Å
272	V	97.4	Very high	96.3	Very high	80 Å²	80	39.1 Å²	39.1	49%	0.485	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	130.3	167	-177.6	0	0	0	0	107.9	E222 A223	E222-V272 HydrophobicContact CB-CG1 4.08Å; E222-V272 HydrophobicContact CG-CG1 4.3Å; A223-V272 WeakPolarHBondContact O-CA 3.07Å
273	V	96.7	Very high	96.5	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.006	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	144.5	-176.2	-51.4	0	0	0	0	110.5	E222 A223 L225 V271 E278 Y281	E222-V273 WeakPolarHBondContact CA-O 3.3Å; A223-V273 PolarHBondContact N-O 2.77Å; A223-V273 PolarHBondContact O-N 2.71Å; L225-V273 HydrophobicContact CD1-CG1 4.04Å; L225-V273 HydrophobicContact CD1-CG2 4.11Å; L225-V273 HydrophobicContact CG-CG1 4.15Å; L225-V273 HydrophobicContact CG-CG2 3.87Å; V271-V273 HydrophobicContact CB-CG1 4.4Å; V271-V273 HydrophobicContact CG2-CG1 3.79Å; V273-E278 HydrophobicContact CG2-CG 3.91Å; V273-Y281 HydrophobicContact CB-CD2 3.97Å; V273-Y281 HydrophobicContact CB-CE2 3.66Å; V273-Y281 HydrophobicContact CG1-CD1 3.76Å; V273-Y281 HydrophobicContact CG1-CD2 3.6Å; V273-Y281 HydrophobicContact CG1-CE1 3.7Å; V273-Y281 HydrophobicContact CG1-CE2 3.57Å; V273-Y281 HydrophobicContact CG1-CG 3.7Å
274	P	96.4	Very high	96.8	Very high	48 Å²	48	33.9 Å²	33.9	31%	0.312	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	140.8	171	-20.2	32.3	0	0	0	111.4	H221 G276 E277	H221-P274 WeakPolarHBondContact O-CA 3.42Å; P274-G276 PolarHBondContact O-N 3.46Å; P274-E277 HydrophobicContact CB-CB 4.26Å; P274-E277 HydrophobicContact CB-CG 4.11Å; P274-E277 HydrophobicContact CG-CG 4.48Å; P274-E277 WeakPolarHBondContact O-CB 3.23Å; P274-E277 PolarHBondContact O-N 3.46Å
275	S	92.8	Very high	96.9	Very high	57 Å²	57	33.6 Å²	33.6	40%	0.399	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	129	177.2	-62.1	0	0	0	0	111.7	H221 E222 E277 E278	H221-S275 PolarHBondContact O-N 2.76Å; H221-S275 PolarHBondContact O-OG 3.42Å; E222-S275 PolarHBondContact N-OG 2.87Å; S275-E277 VanDerWaalsContact C-N 3.35Å; S275-E278 WeakPolarHBondContact CA-OE1 3.41Å
276	G	91.8	Very high	96.8	Very high	68 Å²	68	36.1 Å²	36.1	70%	0.701	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.4	-6.1	-174.3	0	0	0	0	0	114.9	P274 E278	P274-G276 PolarHBondContact O-N 3.46Å; G276-E278 WeakPolarHBondContact CA-OE2 3.18Å; G276-E278 VanDerWaalsContact N-CD 3.28Å; G276-E278 PolarHBondContact N-OE1 2.86Å; G276-E278 PolarHBondContact N-OE2 3.12Å; G276-E278 VanDerWaalsContact N-OE2 3.08Å
277	E	95.6	Very high	96.7	Very high	53 Å²	53	34.4 Å²	34.4	25%	0.248	19%	0.19	C	C	.	.			trans	-98.1	1.1	174.4	-69.2	-156.2	-154.1	0	0	113.9	R243 P274 S275 Q279 R280 Y281	R243-E277 IonicContact CZ-OE2 3.27Å; R243-E277 IonicContact NE-OE2 2.76Å; R243-E277 IonicContact NH2-OE1 3.66Å; R243-E277 IonicContact NH2-OE2 2.88Å; R243-E277 PolarHBondContact NH2-OE2 3.04Å; P274-E277 HydrophobicContact CB-CB 4.26Å; P274-E277 HydrophobicContact CB-CG 4.11Å; P274-E277 HydrophobicContact CG-CG 4.48Å; P274-E277 WeakPolarHBondContact O-CB 3.23Å; P274-E277 PolarHBondContact O-N 3.46Å; S275-E277 VanDerWaalsContact C-N 3.35Å; E277-Q279 PolarHBondContact O-N 3.4Å; E277-R280 VanDerWaalsContact CD-NH1 3.32Å; E277-R280 WeakPolarHBondContact O-CB 3.15Å; E277-R280 PolarHBondContact O-N 3.35Å; E277-R280 IonicContact OE1-NH1 2.93Å; E277-R280 WeakPolarHBondContact OE2-CD 3.44Å; E277-R280 IonicContact OE2-CZ 3.72Å; E277-R280 IonicContact OE2-NE 3.98Å; E277-R280 IonicContact OE2-NH1 2.66Å; E277-R280 PolarHBondContact OE2-NH1 3.05Å; E277-Y281 HydrophobicContact CB-CE2 4.35Å; E277-Y281 WeakPolarHBondContact O-CD2 3.46Å
278	E	95.2	Very high	96.4	Very high	20 Å²	20	36.9 Å²	36.9	9%	0.093	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-56.7	-31	-169.6	-54.6	81.3	-176.5	0	0	113	L225 V273 S275 G276 R280 Y281 W298	L225-E278 HydrophobicContact CD1-CB 4.12Å; L225-E278 HydrophobicContact CD2-CB 4.45Å; L225-E278 HydrophobicContact CD2-CG 4.37Å; V273-E278 HydrophobicContact CG2-CG 3.91Å; S275-E278 WeakPolarHBondContact CA-OE1 3.41Å; G276-E278 WeakPolarHBondContact CA-OE2 3.18Å; G276-E278 VanDerWaalsContact N-CD 3.28Å; G276-E278 PolarHBondContact N-OE1 2.86Å; G276-E278 PolarHBondContact N-OE2 3.12Å; G276-E278 VanDerWaalsContact N-OE2 3.08Å; E278-R280 VanDerWaalsContact C-N 3.29Å; E278-R280 PolarHBondContact O-N 2.7Å; E278-Y281 PolarHBondContact O-N 3.14Å; E278-W298 HydrophobicContact CB-CD2 4.49Å; E278-W298 HydrophobicContact CB-CE3 3.46Å; E278-W298 VanDerWaalsContact CB-CE3 3.46Å; E278-W298 HydrophobicContact CB-CZ3 3.86Å; E278-W298 HydrophobicContact CG-CE3 3.76Å; E278-W298 HydrophobicContact CG-CZ3 3.76Å
279	Q	95.4	Very high	96	Very high	88 Å²	88	36.2 Å²	36.2	41%	0.411	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-74.5	-13.7	179.8	-62.6	-57.9	-45.3	0	0	114.4	E277 Y281 W298	E277-Q279 PolarHBondContact O-N 3.4Å; Q279-Y281 VanDerWaalsContact C-N 3.27Å; Q279-W298 PolarHBondContact NE2-O 2.84Å
280	R	96.8	Very high	95.8	Very high	99 Å²	99	36.7 Å²	36.7	37%	0.374	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-76.1	-18.9	171.2	-62.7	174.4	69.4	175.8	5.4	112	R243 D244 E277 E278	R243-R280 WeakPolarHBondContact CA-O 3.39Å; R243-R280 HydrophobicContact CG-CB 4.33Å; D244-R280 PolarHBondContact N-O 3.42Å; D244-R280 IonicContact OD1-NE 3.54Å; D244-R280 PolarHBondContact OD1-NE 3.42Å; D244-R280 IonicContact OD2-CZ 3.39Å; D244-R280 IonicContact OD2-NE 3.61Å; D244-R280 PolarHBondContact OD2-NE 3.11Å; D244-R280 IonicContact OD2-NH2 2.67Å; D244-R280 PolarHBondContact OD2-NH2 2.95Å; E277-R280 VanDerWaalsContact CD-NH1 3.32Å; E277-R280 WeakPolarHBondContact O-CB 3.15Å; E277-R280 PolarHBondContact O-N 3.35Å; E277-R280 IonicContact OE1-NH1 2.93Å; E277-R280 WeakPolarHBondContact OE2-CD 3.44Å; E277-R280 IonicContact OE2-CZ 3.72Å; E277-R280 IonicContact OE2-NE 3.98Å; E277-R280 IonicContact OE2-NH1 2.66Å; E277-R280 PolarHBondContact OE2-NH1 3.05Å; E278-R280 VanDerWaalsContact C-N 3.29Å; E278-R280 PolarHBondContact O-N 2.7Å
281	Y	97.6	Very high	95.4	Very high	9 Å²	9	42 Å²	42	4%	0.035	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	131	-176.6	-67.7	-97.9	0	0	0	111.4	Q242 R243 Q248 V271 V273 E277 E278 Q279	Q242-Y281 CarbonylContact O-C 3.55Å; Q242-Y281 VanDerWaalsContact O-CA 3.26Å; Q242-Y281 WeakPolarHBondContact O-CA 3.41Å; R243-Y281 HydrophobicContact CB-CD1 4.04Å; R243-Y281 HydrophobicContact CB-CE1 3.85Å; R243-Y281 WeakPolarHBondContact CD-OH 3.31Å; R243-Y281 HydrophobicContact CG-CD1 4.35Å; R243-Y281 HydrophobicContact CG-CD2 4.48Å; R243-Y281 HydrophobicContact CG-CE1 3.97Å; R243-Y281 HydrophobicContact CG-CE2 4.09Å; R243-Y281 PolarHBondContact NE-OH 3.14Å; Q248-Y281 HydrophobicContact CG-CE1 4.36Å; V271-Y281 HydrophobicContact CG2-CD1 4.15Å; V273-Y281 HydrophobicContact CB-CD2 3.97Å; V273-Y281 HydrophobicContact CB-CE2 3.66Å; V273-Y281 HydrophobicContact CG1-CD1 3.76Å; V273-Y281 HydrophobicContact CG1-CD2 3.6Å; V273-Y281 HydrophobicContact CG1-CE1 3.7Å; V273-Y281 HydrophobicContact CG1-CE2 3.57Å; V273-Y281 HydrophobicContact CG1-CG 3.7Å; E277-Y281 HydrophobicContact CB-CE2 4.35Å; E277-Y281 WeakPolarHBondContact O-CD2 3.46Å; E278-Y281 PolarHBondContact O-N 3.14Å; Q279-Y281 VanDerWaalsContact C-N 3.27Å
282	T	98	Very high	95.2	Very high	11 Å²	11	49.1 Å²	49.1	7%	0.067	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	130.7	175.5	45.2	0	0	0	0	110.6	W241 Q242 T295 L296 R297	W241-T282 WeakPolarHBondContact CA-O 3.45Å; Q242-T282 PolarHBondContact N-O 3.2Å; Q242-T282 PolarHBondContact O-N 2.82Å; T282-T295 HydrophobicContact CG2-CG2 3.89Å; T282-L296 CarbonylContact C-O 3.57Å; T282-L296 WeakPolarHBondContact CA-O 3.07Å; T282-R297 HydrophobicContact CG2-CG 3.69Å; T282-R297 VanDerWaalsContact CG2-NE 3.34Å
283	C	98.2	Very high	95	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	130.2	168.1	174.3	0	0	0	0	109.2	C227 T240 W241 T295 L296	C227-C283 HydrophobicContact CB-CB 3.49Å; C227-C283 VanDerWaalsContact CB-CB 3.49Å; C227-C283 WeakPolarHBondContact CB-SG 3.42Å; C227-C283 WeakPolarHBondContact SG-CB 3.29Å; C227-C283 CovalentContact SG-SG 2.03Å; C227-C283 PolarHBondContact SG-SG 3.39Å; T240-C283 CarbonylContact O-C 3.58Å; T240-C283 WeakPolarHBondContact O-CA 3.39Å; W241-C283 HydrophobicContact CD2-CB 4.1Å; W241-C283 HydrophobicContact CE3-CB 4.05Å; W241-C283 HydrophobicContact CH2-CB 4.01Å; W241-C283 HydrophobicContact CZ2-CB 4.06Å; W241-C283 HydrophobicContact CZ3-CB 4Å; C283-T295 CarbonylContact O-C 3.55Å; C283-T295 WeakPolarHBondContact O-CA 3.32Å; C283-L296 HydrophobicContact CB-CB 4.3Å; C283-L296 PolarHBondContact N-O 3.4Å; C283-L296 PolarHBondContact O-N 2.95Å
284	H	97.8	Very high	95	Very high	49 Å²	49	51.2 Å²	51.2	23%	0.227	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	134.6	173.9	-61.8	-96.2	0	0	0	109.8	L239 T240 L294 T295	L239-H284 WeakPolarHBondContact CA-O 3.27Å; T240-H284 PolarHBondContact N-O 3.03Å; T240-H284 PolarHBondContact O-N 2.8Å; H284-L294 CarbonylContact C-O 3.55Å; H284-L294 WeakPolarHBondContact CA-O 3.46Å; H284-T295 PolarHBondContact CE1-OG1 2.9Å; H284-T295 PolarHBondContact ND1-OG1 3.38Å; H284-T295 VanDerWaalsContact ND1-OG1 3.13Å; H284-T295 WeakPolarHBondContact NE2-CG2 3.49Å; H284-T295 PolarHBondContact NE2-OG1 3.3Å; H284-T295 VanDerWaalsContact NE2-OG1 3.12Å
285	V	97.9	Very high	95.1	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	121.1	-178.8	-174.6	0	0	0	0	109.4	P209 T211 I237 T238 L239 L290 P293 L294 L296	P209-V285 HydrophobicContact CG-CG1 3.96Å; T211-V285 HydrophobicContact CG2-CB 4.4Å; T211-V285 HydrophobicContact CG2-CG1 4.11Å; T211-V285 HydrophobicContact CG2-CG2 4.04Å; I237-V285 HydrophobicContact CD1-CG1 4.03Å; I237-V285 HydrophobicContact CG1-CG1 4.34Å; T238-V285 WeakPolarHBondContact O-CA 3.13Å; L239-V285 HydrophobicContact CD1-CG1 4Å; L239-V285 HydrophobicContact CD1-CG2 4.46Å; L239-V285 HydrophobicContact CG-CG2 4.29Å; V285-L290 HydrophobicContact CB-CD1 4.48Å; V285-L290 HydrophobicContact CG1-CD1 4.05Å; V285-P293 WeakPolarHBondContact O-CA 3.31Å; V285-L294 HydrophobicContact CB-CB 4.37Å; V285-L294 PolarHBondContact N-O 3.26Å; V285-L294 PolarHBondContact O-N 3.18Å; V285-L296 HydrophobicContact CG2-CD1 3.94Å
286	Q	96.8	Very high	95.3	Very high	81 Å²	81	51.4 Å²	51.4	38%	0.379	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	130.3	174.6	-52.7	-179.9	15.4	0	0	109.3	I237 T238 P293	I237-Q286 VanDerWaalsContact CG1-O 3.31Å; I237-Q286 WeakPolarHBondContact CG1-O 3.21Å; T238-Q286 PolarHBondContact N-O 3.21Å; T238-Q286 PolarHBondContact O-N 2.72Å; Q286-P293 HydrophobicContact CG-CB 4.02Å; Q286-P293 HydrophobicContact CG-CG 4.11Å
287	H	95.3	Very high	95.5	Very high	6 Å²	6	54.9 Å²	54.9	3%	0.028	27%	0.273	C	S	.	.			trans	-157.4	142.9	-176.8	-177	-99.5	0	0	0	108.3	W23 E207 P209 F232 Y233 P234 E236 I237 G289 L290	W23-H287 VanDerWaalsContact CH2-O 3.23Å; W23-H287 WeakPolarHBondContact CH2-O 3.47Å; W23-H287 VanDerWaalsContact CZ2-O 3.31Å; W23-H287 WeakPolarHBondContact CZ2-O 3.34Å; E207-H287 PolarHBondContact O-CE1 2.91Å; E207-H287 VanDerWaalsContact O-CE1 3.24Å; P209-H287 HydrophobicContact CG-CB 4.14Å; F232-H287 AromaticContact CD2-CD2 3.89Å; F232-H287 AromaticContact CD2-NE2 3.8Å; Y233-H287 PolarHBondContact O-CE1 2.67Å; P234-H287 PolarHBondContact O-NE2 3.38Å; E236-H287 PolarHBondContact O-CD2 2.83Å; E236-H287 VanDerWaalsContact O-CD2 3.23Å; I237-H287 HydrophobicContact CD1-CB 4.25Å; I237-H287 HydrophobicContact CG1-CB 4.04Å; H287-G289 PolarHBondContact ND1-N 3.08Å; H287-G289 PolarHBondContact O-N 3.01Å; H287-L290 HydrophobicContact CB-CD1 3.98Å; H287-L290 HydrophobicContact CB-CG 4.16Å; H287-L290 PolarHBondContact O-N 3.34Å
288	E	91.3	Very high	95.5	Very high	73 Å²	73	54.5 Å²	54.5	34%	0.341	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-14.4	-176.5	64.2	145.5	-138	0	0	114.8	W23 A206 P234	W23-E288 VanDerWaalsContact CH2-C 3.43Å; W23-E288 VanDerWaalsContact CH2-CA 3.47Å; W23-E288 WeakPolarHBondContact CH2-O 3.35Å; W23-E288 WeakPolarHBondContact CZ3-O 3.41Å; A206-E288 HydrophobicContact CB-CG 4.36Å; A206-E288 WeakPolarHBondContact CB-OE1 3.41Å; P234-E288 VanDerWaalsContact CD-CD 3.45Å; P234-E288 WeakPolarHBondContact CD-OE1 3.18Å; P234-E288 HydrophobicContact CG-CG 3.66Å
289	G	91	Very high	95.2	Very high	11 Å²	11	61.3 Å²	61.3	11%	0.113	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-41.1	167.8	0	0	0	0	0	112.3	H208 H287 P291	H208-G289 PolarHBondContact CE1-O 2.87Å; H208-G289 PolarHBondContact ND1-O 3.15Å; H287-G289 PolarHBondContact ND1-N 3.08Å; H287-G289 PolarHBondContact O-N 3.01Å; G289-P291 WeakPolarHBondContact O-CD 3.45Å
290	L	93.3	Very high	94.6	Very high	10 Å²	10	60.9 Å²	60.9	5%	0.052	31%	0.306	C	S	.	.			trans	-76.3	108.6	-166.2	-66.6	172.4	0	0	0	112.8	W23 H208 P209 V285 H287 E292 L294	W23-L290 WeakPolarHBondContact CH2-O 3.42Å; W23-L290 WeakPolarHBondContact CZ2-O 3.19Å; H208-L290 HydrophobicContact CB-CD2 4.06Å; P209-L290 HydrophobicContact CG-CD1 3.74Å; P209-L290 HydrophobicContact CG-CD2 4.32Å; P209-L290 HydrophobicContact CG-CG 4.11Å; V285-L290 HydrophobicContact CB-CD1 4.48Å; V285-L290 HydrophobicContact CG1-CD1 4.05Å; H287-L290 HydrophobicContact CB-CD1 3.98Å; H287-L290 HydrophobicContact CB-CG 4.16Å; H287-L290 PolarHBondContact O-N 3.34Å; L290-E292 PolarHBondContact O-N 2.82Å; L290-L294 HydrophobicContact CD1-CB 4.49Å; L290-L294 HydrophobicContact CD1-CD1 3.96Å; L290-L294 HydrophobicContact CD1-CG 3.9Å; L290-L294 HydrophobicContact CD2-CD1 3.6Å; L290-L294 HydrophobicContact CD2-CG 3.88Å; L290-L294 HydrophobicContact CG-CD1 4.44Å; L290-L294 HydrophobicContact CG-CG 4.46Å
291	P	91.1	Very high	93.1	Very high	115 Å²	115	61.2 Å²	61.2	75%	0.747	32%	0.324	S	S	*	.	S	Bend	trans	-58.3	-24.8	-173.6	25.7	-36.2	0	0	0	113.8	G289	G289-P291 WeakPolarHBondContact O-CD 3.45Å
292	E	91.9	Very high	90.8	Very high	153 Å²	153	66.2 Å²	66.2	72%	0.715	36%	0.36	S	S	*	.	S	Bend	trans	-137.2	149.7	165	-64.1	-177.7	175.5	0	0	109	L290 L294	L290-E292 PolarHBondContact O-N 2.82Å; E292-L294 PolarHBondContact O-N 3.03Å
293	P	94.8	Very high	88.4	Confident	64 Å²	64	73.5 Å²	73.5	42%	0.416	39%	0.393	S	S	.	.			trans	-53.3	134.3	173.3	-29.2	37.3	0	0	0	113.3	V285 Q286	V285-P293 WeakPolarHBondContact O-CA 3.31Å; Q286-P293 HydrophobicContact CG-CB 4.02Å; Q286-P293 HydrophobicContact CG-CG 4.11Å
294	L	96.5	Very high	85.9	Confident	60 Å²	60	78.3 Å²	78.3	31%	0.314	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	135.2	175.4	-65	178.1	0	0	0	110.6	T211 H284 V285 L290 E292	T211-L294 HydrophobicContact CG2-CD1 4.37Å; H284-L294 CarbonylContact C-O 3.55Å; H284-L294 WeakPolarHBondContact CA-O 3.46Å; V285-L294 HydrophobicContact CB-CB 4.37Å; V285-L294 PolarHBondContact N-O 3.26Å; V285-L294 PolarHBondContact O-N 3.18Å; L290-L294 HydrophobicContact CD1-CB 4.49Å; L290-L294 HydrophobicContact CD1-CD1 3.96Å; L290-L294 HydrophobicContact CD1-CG 3.9Å; L290-L294 HydrophobicContact CD2-CD1 3.6Å; L290-L294 HydrophobicContact CD2-CG 3.88Å; L290-L294 HydrophobicContact CG-CD1 4.44Å; L290-L294 HydrophobicContact CG-CG 4.46Å; E292-L294 PolarHBondContact O-N 3.03Å
295	T	97.6	Very high	83.6	Confident	74 Å²	74	82.5 Å²	82.5	45%	0.454	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	123.1	168.9	-55.4	0	0	0	0	109.1	T282 C283 H284	T282-T295 HydrophobicContact CG2-CG2 3.89Å; C283-T295 CarbonylContact O-C 3.55Å; C283-T295 WeakPolarHBondContact O-CA 3.32Å; H284-T295 PolarHBondContact CE1-OG1 2.9Å; H284-T295 PolarHBondContact ND1-OG1 3.38Å; H284-T295 VanDerWaalsContact ND1-OG1 3.13Å; H284-T295 WeakPolarHBondContact NE2-CG2 3.49Å; H284-T295 PolarHBondContact NE2-OG1 3.3Å; H284-T295 VanDerWaalsContact NE2-OG1 3.12Å
296	L	97	Very high	81.5	Confident	35 Å²	35	87.4 Å²	87.4	18%	0.183	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	142.6	-172.4	-60	158.7	0	0	0	110.1	T211 V213 T282 C283 V285	T211-L296 VanDerWaalsContact CB-CD1 3.47Å; T211-L296 HydrophobicContact CG2-CD1 4.16Å; V213-L296 HydrophobicContact CG2-CB 3.97Å; T282-L296 CarbonylContact C-O 3.57Å; T282-L296 WeakPolarHBondContact CA-O 3.07Å; C283-L296 HydrophobicContact CB-CB 4.3Å; C283-L296 PolarHBondContact N-O 3.4Å; C283-L296 PolarHBondContact O-N 2.95Å; V285-L296 HydrophobicContact CG2-CD1 3.94Å
297	R	96.1	Very high	79.6	Confident	141 Å²	141	87.6 Å²	87.6	53%	0.532	49%	0.487	S	S	.	.			trans	-116.8	164.2	166.7	-71.1	-173.9	174.8	163.6	-0.9	109.6	T282 E299	T282-R297 HydrophobicContact CG2-CG 3.69Å; T282-R297 VanDerWaalsContact CG2-NE 3.34Å; R297-E299 PolarHBondContact O-N 3.39Å
298	W	95.9	Very high	78	Confident	45 Å²	45	93.2 Å²	93.2	17%	0.17	52%	0.516	C	S	.	.	P	Polyproline II helix	trans	-71.1	122.5	165.5	170.7	56	0	0	0	110.1	V213 H215 L225 E278 Q279 P300	V213-W298 HydrophobicContact CB-CB 4.44Å; V213-W298 HydrophobicContact CG1-CB 3.81Å; H215-W298 HydrophobicContact CB-CD2 4.07Å; H215-W298 HydrophobicContact CB-CG 4.11Å; H215-W298 HydrophobicContact CB-CZ2 4.05Å; H215-W298 VanDerWaalsContact CB-NE1 3.32Å; H215-W298 AromaticContact CG-CE2 3.77Å; H215-W298 AromaticContact CG-CZ2 3.79Å; H215-W298 AromaticContact ND1-CZ2 3.9Å; L225-W298 HydrophobicContact CD1-CB 4.44Å; L225-W298 HydrophobicContact CD2-CB 3.84Å; L225-W298 HydrophobicContact CD2-CD2 4.39Å; L225-W298 HydrophobicContact CD2-CG 4Å; E278-W298 HydrophobicContact CB-CD2 4.49Å; E278-W298 HydrophobicContact CB-CE3 3.46Å; E278-W298 VanDerWaalsContact CB-CE3 3.46Å; E278-W298 HydrophobicContact CB-CZ3 3.86Å; E278-W298 HydrophobicContact CG-CE3 3.76Å; E278-W298 HydrophobicContact CG-CZ3 3.76Å; Q279-W298 PolarHBondContact NE2-O 2.84Å; W298-P300 HydrophobicContact CE3-CG 4.34Å; W298-P300 HydrophobicContact CH2-CB 4.25Å; W298-P300 HydrophobicContact CH2-CG 3.86Å; W298-P300 HydrophobicContact CZ2-CB 4.01Å; W298-P300 HydrophobicContact CZ2-CG 3.96Å; W298-P300 HydrophobicContact CZ3-CG 4.04Å
299	E	89.6	Confident	76.5	Confident	164 Å²	164	95.6 Å²	95.6	77%	0.766	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-99.5	120.4	168.3	-66.8	-172.6	166.2	0	0	109.3	R297 S301	R297-E299 PolarHBondContact O-N 3.39Å; E299-S301 PolarHBondContact O-N 3.19Å
300	P	82.1	Confident	75.3	Confident	79 Å²	79	97.1 Å²	97.1	51%	0.513	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-58.6	129.6	170.4	-21.4	32.2	0	0	0	109.6	W298 S302	W298-P300 HydrophobicContact CE3-CG 4.34Å; W298-P300 HydrophobicContact CH2-CB 4.25Å; W298-P300 HydrophobicContact CH2-CG 3.86Å; W298-P300 HydrophobicContact CZ2-CB 4.01Å; W298-P300 HydrophobicContact CZ2-CG 3.96Å; W298-P300 HydrophobicContact CZ3-CG 4.04Å; P300-S302 PolarHBondContact O-N 3.1Å
301	S	66.1	Low	74.3	Confident	106 Å²	106	101.1 Å²	101.1	74%	0.741	57%	0.571	S	S	*	*			trans	-61.7	108.3	-173.1	64.3	0	0	0	0	111.1	E299 Q303	E299-S301 PolarHBondContact O-N 3.19Å; S301-Q303 PolarHBondContact O-N 2.82Å
302	S	49.3	Very low	73.5	Confident	114 Å²	114	100 Å²	100	80%	0.797	56%	0.562	S	S	*	*			trans	-76.4	58.4	172.1	51.8	0	0	0	0	110.6	P300 P304	P300-S302 PolarHBondContact O-N 3.1Å; S302-P304 WeakPolarHBondContact O-CD 3.3Å
303	Q	46.5	Very low	72.6	Confident	163 Å²	163	95.1 Å²	95.1	76%	0.762	55%	0.548	S	S	*	.			trans	-67.5	108.8	155	-77.6	-166.1	-11.6	0	0	106.5	S301 T305	S301-Q303 PolarHBondContact O-N 2.82Å; Q303-T305 PolarHBondContact O-N 3.35Å
304	P	45.3	Very low	71.9	Confident	102 Å²	102	93.7 Å²	93.7	66%	0.662	55%	0.545	S	S	*	.			trans	-60.2	119.3	166.1	27.5	-32.8	0	0	0	105.9	S302 I306	S302-P304 WeakPolarHBondContact O-CD 3.3Å; P304-I306 HydrophobicContact CG-CG1 4.43Å; P304-I306 PolarHBondContact O-N 3.11Å
305	T	50	Low	71.3	Confident	136 Å²	136	96 Å²	96	83%	0.834	56%	0.557	S	S	*	*			trans	-67	81.4	163.2	-44.1	0	0	0	0	106.3	Q303 P307	Q303-T305 PolarHBondContact O-N 3.35Å; T305-P307 VanDerWaalsContact O-CD 3.32Å; T305-P307 WeakPolarHBondContact O-CD 3.42Å
306	I	54.9	Low	70.5	Confident	103 Å²	103	95 Å²	95	53%	0.528	56%	0.557	S	S	.	*			trans	-50.5	119.9	169.5	-63.2	176	0	0	0	104.3	P304 I308 I311	P304-I306 HydrophobicContact CG-CG1 4.43Å; P304-I306 PolarHBondContact O-N 3.11Å; I306-I308 PolarHBondContact O-N 3.01Å; I306-I311 HydrophobicContact CG2-CD1 3.83Å
307	P	56.5	Low	69.9	Low	86 Å²	86	97.6 Å²	97.6	56%	0.558	57%	0.574	S	S	*	*			trans	-74.5	80.6	-175	29.1	-33.9	0	0	0	108	T305 V309 G310 I311	T305-P307 VanDerWaalsContact O-CD 3.32Å; T305-P307 WeakPolarHBondContact O-CD 3.42Å; P307-V309 PolarHBondContact O-N 2.82Å; P307-G310 WeakPolarHBondContact O-CA 3.41Å; P307-G310 PolarHBondContact O-N 3.35Å; P307-I311 PolarHBondContact O-N 3.1Å; P307-I311 VanDerWaalsContact O-N 3.1Å
308	I	60.7	Low	69.3	Low	124 Å²	124	96.2 Å²	96.2	64%	0.636	58%	0.576	S	S	*	*	H	α-helix	trans	-53.9	-37	177.2	-67.2	165.4	0	0	0	108.9	I306 G310 I311 V312	I306-I308 PolarHBondContact O-N 3.01Å; I308-G310 VanDerWaalsContact C-N 3.35Å; I308-G310 PolarHBondContact O-N 2.73Å; I308-I311 PolarHBondContact O-N 3.01Å; I308-V312 HydrophobicContact CG2-CG2 4.24Å; I308-V312 WeakPolarHBondContact O-CB 3.47Å; I308-V312 VanDerWaalsContact O-CG2 3.26Å; I308-V312 WeakPolarHBondContact O-CG2 3.33Å; I308-V312 PolarHBondContact O-N 3.03Å
309	V	60.4	Low	68.8	Low	122 Å²	122	96.8 Å²	96.8	74%	0.739	59%	0.59	S	S	*	*	H	α-helix	trans	-56.3	-43.5	171.1	-178.6	0	0	0	0	112.5	P307 A313	P307-V309 PolarHBondContact O-N 2.82Å; V309-A313 VanDerWaalsContact O-CB 3.23Å; V309-A313 WeakPolarHBondContact O-CB 3.3Å; V309-A313 PolarHBondContact O-N 3.03Å
310	G	65.3	Low	68.6	Low	43 Å²	43	93.1 Å²	93.1	44%	0.443	58%	0.579	S	S	.	*	H	α-helix	trans	-68.6	-38.8	178.5	0	0	0	0	0	113	P307 I308 G314	P307-G310 WeakPolarHBondContact O-CA 3.41Å; P307-G310 PolarHBondContact O-N 3.35Å; I308-G310 VanDerWaalsContact C-N 3.35Å; I308-G310 PolarHBondContact O-N 2.73Å; G310-G314 PolarHBondContact O-N 2.97Å
311	I	72.8	Confident	68.7	Low	94 Å²	94	94.3 Å²	94.3	48%	0.482	58%	0.581	S	S	.	*	H	α-helix	trans	-67.3	-45.9	175.5	-61.2	174.7	0	0	0	110.4	I306 P307 I308 G314 L315	I306-I311 HydrophobicContact CG2-CD1 3.83Å; P307-I311 PolarHBondContact O-N 3.1Å; P307-I311 VanDerWaalsContact O-N 3.1Å; I308-I311 PolarHBondContact O-N 3.01Å; I311-G314 PolarHBondContact O-N 3.46Å; I311-L315 HydrophobicContact CG2-CD1 4.02Å; I311-L315 WeakPolarHBondContact O-CB 3.21Å; I311-L315 WeakPolarHBondContact O-CG 3.29Å; I311-L315 PolarHBondContact O-N 3.41Å
312	V	73.9	Confident	69.5	Low	91 Å²	91	92.5 Å²	92.5	55%	0.552	57%	0.572	S	S	*	*	H	α-helix	trans	-63.3	-43	177.5	171	0	0	0	0	111.3	I308 L315 A316	I308-V312 HydrophobicContact CG2-CG2 4.24Å; I308-V312 WeakPolarHBondContact O-CB 3.47Å; I308-V312 VanDerWaalsContact O-CG2 3.26Å; I308-V312 WeakPolarHBondContact O-CG2 3.33Å; I308-V312 PolarHBondContact O-N 3.03Å; V312-L315 PolarHBondContact O-N 3.42Å; V312-A316 WeakPolarHBondContact O-CB 3.47Å; V312-A316 PolarHBondContact O-N 3.19Å
313	A	73.4	Confident	71.1	Confident	52 Å²	52	91.5 Å²	91.5	43%	0.43	56%	0.561	S	S	.	*	H	α-helix	trans	-62.8	-44.2	175.1	0	0	0	0	0	112.1	V309 A316 V317	V309-A313 VanDerWaalsContact O-CB 3.23Å; V309-A313 WeakPolarHBondContact O-CB 3.3Å; V309-A313 PolarHBondContact O-N 3.03Å; A313-A316 PolarHBondContact O-N 3.42Å; A313-V317 WeakPolarHBondContact O-CG2 3.33Å; A313-V317 PolarHBondContact O-N 2.97Å
314	G	79.5	Confident	72.7	Confident	34 Å²	34	88.5 Å²	88.5	35%	0.351	55%	0.55	S	S	.	.	H	α-helix	trans	-61.2	-43.9	176.5	0	0	0	0	0	113	G310 I311 V317 L318	G310-G314 PolarHBondContact O-N 2.97Å; I311-G314 PolarHBondContact O-N 3.46Å; G314-V317 PolarHBondContact O-N 2.88Å; G314-L318 WeakPolarHBondContact O-CG 3.47Å; G314-L318 PolarHBondContact O-N 2.82Å
315	L	84.1	Confident	74.5	Confident	108 Å²	108	85.7 Å²	85.7	57%	0.565	54%	0.539	S	S	*	.	H	α-helix	trans	-65.7	-39.5	176.1	-71.4	172	0	0	0	112.4	I311 V312 L318 A319	I311-L315 HydrophobicContact CG2-CD1 4.02Å; I311-L315 WeakPolarHBondContact O-CB 3.21Å; I311-L315 WeakPolarHBondContact O-CG 3.29Å; I311-L315 PolarHBondContact O-N 3.41Å; V312-L315 PolarHBondContact O-N 3.42Å; L315-L318 PolarHBondContact O-N 3.29Å; L315-A319 WeakPolarHBondContact O-CB 3.49Å; L315-A319 PolarHBondContact O-N 3.2Å
316	A	81.7	Confident	75.8	Confident	54 Å²	54	81.8 Å²	81.8	45%	0.446	52%	0.52	S	S	.	.	H	α-helix	trans	-62.9	-43.5	175.4	0	0	0	0	0	111.9	V312 A313 A319 V320	V312-A316 WeakPolarHBondContact O-CB 3.47Å; V312-A316 PolarHBondContact O-N 3.19Å; A313-A316 PolarHBondContact O-N 3.42Å; A316-A319 PolarHBondContact O-N 3.02Å; A316-V320 WeakPolarHBondContact O-CG2 3.5Å; A316-V320 PolarHBondContact O-N 3Å
317	V	84	Confident	77	Confident	89 Å²	89	80.7 Å²	80.7	54%	0.539	52%	0.518	S	S	.	.	H	α-helix	trans	-63.2	-44.3	175.6	171.8	0	0	0	0	111.2	A313 G314 A319 V320 L321	A313-V317 WeakPolarHBondContact O-CG2 3.33Å; A313-V317 PolarHBondContact O-N 2.97Å; G314-V317 PolarHBondContact O-N 2.88Å; V317-A319 PolarHBondContact O-N 3.09Å; V317-V320 PolarHBondContact O-N 2.86Å; V317-L321 HydrophobicContact CG1-CD1 3.96Å; V317-L321 HydrophobicContact CG1-CG 4.41Å; V317-L321 WeakPolarHBondContact O-CG 3.5Å; V317-L321 PolarHBondContact O-N 3.26Å
318	L	84.3	Confident	77.9	Confident	112 Å²	112	82.1 Å²	82.1	59%	0.586	52%	0.519	S	S	*	.	H	α-helix	trans	-61	-41.4	176	-78.4	167	0	0	0	112.5	G314 L315 L321 A322	G314-L318 WeakPolarHBondContact O-CG 3.47Å; G314-L318 PolarHBondContact O-N 2.82Å; L315-L318 PolarHBondContact O-N 3.29Å; L318-L321 PolarHBondContact O-N 2.67Å; L318-A322 WeakPolarHBondContact O-CB 3.47Å; L318-A322 PolarHBondContact O-N 2.93Å
319	A	84.4	Confident	78.5	Confident	56 Å²	56	78.7 Å²	78.7	46%	0.463	51%	0.509	S	S	.	.	H	α-helix	trans	-63.2	-43.8	176.1	0	0	0	0	0	112	L315 A316 V317 A322 V323	L315-A319 WeakPolarHBondContact O-CB 3.49Å; L315-A319 PolarHBondContact O-N 3.2Å; A316-A319 PolarHBondContact O-N 3.02Å; V317-A319 PolarHBondContact O-N 3.09Å; A319-A322 PolarHBondContact O-N 3.13Å; A319-V323 WeakPolarHBondContact O-CG2 3.27Å; A319-V323 PolarHBondContact O-N 3.16Å
320	V	84.6	Confident	79.1	Confident	87 Å²	87	76.8 Å²	76.8	53%	0.527	50%	0.498	S	S	.	.	H	α-helix	trans	-62.5	-43.9	176	170.9	0	0	0	0	111.3	A316 V317 V323 L324	A316-V320 WeakPolarHBondContact O-CG2 3.5Å; A316-V320 PolarHBondContact O-N 3Å; V317-V320 PolarHBondContact O-N 2.86Å; V320-V323 PolarHBondContact O-N 3.37Å; V320-L324 HydrophobicContact CG1-CD1 3.95Å; V320-L324 HydrophobicContact CG1-CG 4.5Å; V320-L324 WeakPolarHBondContact O-CG 3.2Å; V320-L324 PolarHBondContact O-N 3.02Å
321	L	84.9	Confident	79.5	Confident	105 Å²	105	78.3 Å²	78.3	55%	0.55	50%	0.498	S	S	.	.	H	α-helix	trans	-64.2	-39.2	176.8	-70.6	172.8	0	0	0	112.3	V317 L318 L324 G325	V317-L321 HydrophobicContact CG1-CD1 3.96Å; V317-L321 HydrophobicContact CG1-CG 4.41Å; V317-L321 WeakPolarHBondContact O-CG 3.5Å; V317-L321 PolarHBondContact O-N 3.26Å; L318-L321 PolarHBondContact O-N 2.67Å; L321-L324 PolarHBondContact O-N 2.76Å; L321-G325 PolarHBondContact O-N 3.16Å
322	A	82.8	Confident	79.5	Confident	67 Å²	67	80.2 Å²	80.2	55%	0.554	51%	0.506	S	S	*	.	H	α-helix	trans	-64.2	-42.4	175.4	0	0	0	0	0	112.1	L318 A319 G325 A326	L318-A322 WeakPolarHBondContact O-CB 3.47Å; L318-A322 PolarHBondContact O-N 2.93Å; A319-A322 PolarHBondContact O-N 3.13Å; A322-G325 PolarHBondContact O-N 3.46Å; A322-A326 WeakPolarHBondContact O-CB 3.49Å; A322-A326 PolarHBondContact O-N 2.92Å
323	V	82.6	Confident	78.9	Confident	94 Å²	94	80 Å²	80	57%	0.57	51%	0.508	S	S	*	.	H	α-helix	trans	-64	-45.4	175.2	171.7	0	0	0	0	111.1	A319 V320 G325 A326 V327	A319-V323 WeakPolarHBondContact O-CG2 3.27Å; A319-V323 PolarHBondContact O-N 3.16Å; V320-V323 PolarHBondContact O-N 3.37Å; V323-G325 PolarHBondContact O-N 3.1Å; V323-A326 PolarHBondContact O-N 3.35Å; V323-V327 HydrophobicContact CG1-CG2 4.49Å; V323-V327 WeakPolarHBondContact O-CG2 3.32Å; V323-V327 PolarHBondContact O-N 2.84Å
324	L	81.8	Confident	78.3	Confident	100 Å²	100	86.6 Å²	86.6	52%	0.524	52%	0.522	S	S	.	.	H	α-helix	trans	-61.2	-42.9	175.8	-72.8	169	0	0	0	111.9	V320 L321 V327 M328	V320-L324 HydrophobicContact CG1-CD1 3.95Å; V320-L324 HydrophobicContact CG1-CG 4.5Å; V320-L324 WeakPolarHBondContact O-CG 3.2Å; V320-L324 PolarHBondContact O-N 3.02Å; L321-L324 PolarHBondContact O-N 2.76Å; L324-V327 PolarHBondContact O-N 3.22Å; L324-M328 WeakPolarHBondContact O-CB 3.33Å; L324-M328 VanDerWaalsContact O-CG 3.3Å; L324-M328 WeakPolarHBondContact O-CG 3.49Å; L324-M328 PolarHBondContact O-N 3.19Å
325	G	81.3	Confident	77.3	Confident	42 Å²	42	94.9 Å²	94.9	43%	0.433	54%	0.543	S	S	.	.	H	α-helix	trans	-60.3	-44.7	174.6	0	0	0	0	0	112.7	L321 A322 V323 M328 A329	L321-G325 PolarHBondContact O-N 3.16Å; A322-G325 PolarHBondContact O-N 3.46Å; V323-G325 PolarHBondContact O-N 3.1Å; G325-M328 PolarHBondContact O-N 3.18Å; G325-A329 WeakPolarHBondContact O-CB 3.34Å; G325-A329 PolarHBondContact O-N 3.36Å
326	A	78.9	Confident	75.7	Confident	54 Å²	54	98.4 Å²	98.4	45%	0.446	55%	0.553	S	S	.	*	H	α-helix	trans	-63.9	-42.9	176.3	0	0	0	0	0	112.3	A322 V323 A329 V330	A322-A326 WeakPolarHBondContact O-CB 3.49Å; A322-A326 PolarHBondContact O-N 2.92Å; V323-A326 PolarHBondContact O-N 3.35Å; A326-A329 PolarHBondContact O-N 3.45Å; A326-V330 WeakPolarHBondContact O-CG2 3.28Å; A326-V330 PolarHBondContact O-N 3Å
327	V	79.3	Confident	74.3	Confident	80 Å²	80	100.3 Å²	100.3	49%	0.485	56%	0.564	S	S	.	*	H	α-helix	trans	-61.9	-45.6	175.4	170.4	0	0	0	0	110.9	V323 L324 A329 V330 V331	V323-V327 HydrophobicContact CG1-CG2 4.49Å; V323-V327 WeakPolarHBondContact O-CG2 3.32Å; V323-V327 PolarHBondContact O-N 2.84Å; L324-V327 PolarHBondContact O-N 3.22Å; V327-A329 PolarHBondContact O-N 2.97Å; V327-V330 PolarHBondContact O-N 2.94Å; V327-V331 HydrophobicContact CG1-CG2 4.4Å; V327-V331 WeakPolarHBondContact O-CB 3.49Å; V327-V331 VanDerWaalsContact O-CG2 3.31Å; V327-V331 WeakPolarHBondContact O-CG2 3.44Å; V327-V331 PolarHBondContact O-N 3.45Å
328	M	74.9	Confident	72.6	Confident	117 Å²	117	100.9 Å²	100.9	58%	0.576	57%	0.572	S	S	*	*	H	α-helix	trans	-62.5	-41.4	177	-72	-65	-69.8	0	0	112.1	L324 G325 V331 M332	L324-M328 WeakPolarHBondContact O-CB 3.33Å; L324-M328 VanDerWaalsContact O-CG 3.3Å; L324-M328 WeakPolarHBondContact O-CG 3.49Å; L324-M328 PolarHBondContact O-N 3.19Å; G325-M328 PolarHBondContact O-N 3.18Å; M328-V331 PolarHBondContact O-N 2.75Å; M328-M332 WeakPolarHBondContact O-CB 3.17Å; M328-M332 WeakPolarHBondContact O-CG 3.47Å; M328-M332 PolarHBondContact O-N 2.78Å
329	A	73.8	Confident	70.7	Confident	52 Å²	52	98.7 Å²	98.7	43%	0.43	58%	0.576	S	S	.	*	H	α-helix	trans	-62.2	-44.6	174.6	0	0	0	0	0	112.1	G325 A326 V327 M332 C333	G325-A329 WeakPolarHBondContact O-CB 3.34Å; G325-A329 PolarHBondContact O-N 3.36Å; A326-A329 PolarHBondContact O-N 3.45Å; V327-A329 PolarHBondContact O-N 2.97Å; A329-M332 PolarHBondContact O-N 3.06Å; A329-C333 WeakPolarHBondContact O-CB 3.37Å; A329-C333 PolarHBondContact O-N 3.32Å; A329-C333 PolarHBondContact O-SG 3.01Å; A329-C333 VanDerWaalsContact O-SG 3.41Å
330	V	73.6	Confident	68.4	Low	82 Å²	82	100.2 Å²	100.2	50%	0.497	60%	0.597	S	S	.	*	H	α-helix	trans	-63.8	-40.9	176	169.6	0	0	0	0	111.7	A326 V327 C333 R334	A326-V330 WeakPolarHBondContact O-CG2 3.28Å; A326-V330 PolarHBondContact O-N 3Å; V327-V330 PolarHBondContact O-N 2.94Å; V330-C333 PolarHBondContact O-N 3.16Å; V330-R334 WeakPolarHBondContact O-CB 3.31Å; V330-R334 PolarHBondContact O-N 2.84Å
331	V	73.6	Confident	66	Low	75 Å²	75	106.4 Å²	106.4	46%	0.455	62%	0.617	S	S	.	*	H	α-helix	trans	-65.8	-41.7	176.2	170	0	0	0	0	111.3	V327 M328 R334 R335	V327-V331 HydrophobicContact CG1-CG2 4.4Å; V327-V331 WeakPolarHBondContact O-CB 3.49Å; V327-V331 VanDerWaalsContact O-CG2 3.31Å; V327-V331 WeakPolarHBondContact O-CG2 3.44Å; V327-V331 PolarHBondContact O-N 3.45Å; M328-V331 PolarHBondContact O-N 2.75Å; V331-R334 PolarHBondContact O-N 3Å; V331-R335 WeakPolarHBondContact O-CB 3.47Å; V331-R335 PolarHBondContact O-N 3.18Å
332	M	72.2	Confident	63.5	Low	133 Å²	133	105.4 Å²	105.4	66%	0.655	63%	0.631	S	S	*	*	H	α-helix	trans	-65.6	-42.9	175	-75	-173.4	70.1	0	0	112.3	M328 A329 R334 R335 K336	M328-M332 WeakPolarHBondContact O-CB 3.17Å; M328-M332 WeakPolarHBondContact O-CG 3.47Å; M328-M332 PolarHBondContact O-N 2.78Å; A329-M332 PolarHBondContact O-N 3.06Å; M332-R334 VanDerWaalsContact C-N 3.35Å; M332-R334 PolarHBondContact O-N 2.85Å; M332-R335 PolarHBondContact O-N 2.8Å; M332-K336 WeakPolarHBondContact O-CB 3.44Å; M332-K336 PolarHBondContact O-N 3.03Å
333	C	62.1	Low	61.1	Low	88 Å²	88	106.1 Å²	106.1	60%	0.595	65%	0.645	S	S	*	*	H	α-helix	trans	-60.2	-43.5	173.2	-76.2	0	0	0	0	111.6	A329 V330 R335 K336 S337	A329-C333 WeakPolarHBondContact O-CB 3.37Å; A329-C333 PolarHBondContact O-N 3.32Å; A329-C333 PolarHBondContact O-SG 3.01Å; A329-C333 VanDerWaalsContact O-SG 3.41Å; V330-C333 PolarHBondContact O-N 3.16Å; C333-R335 PolarHBondContact O-N 3.24Å; C333-K336 PolarHBondContact O-N 2.78Å; C333-K336 VanDerWaalsContact O-N 3.14Å; C333-S337 PolarHBondContact O-N 3.15Å; C333-S337 PolarHBondContact O-OG 2.75Å
334	R	60.8	Low	58.7	Low	189 Å²	189	107.3 Å²	107.3	71%	0.713	66%	0.658	S	S	*	*	H	α-helix	trans	-64.6	-37.5	175.6	-82.1	-175.6	156	172.8	-5.1	113.5	V330 V331 M332 K336 S337	V330-R334 WeakPolarHBondContact O-CB 3.31Å; V330-R334 PolarHBondContact O-N 2.84Å; V331-R334 PolarHBondContact O-N 3Å; M332-R334 VanDerWaalsContact C-N 3.35Å; M332-R334 PolarHBondContact O-N 2.85Å; R334-K336 VanDerWaalsContact C-N 3.31Å; R334-S337 WeakPolarHBondContact CA-OG 3.42Å; R334-S337 PolarHBondContact O-N 3.34Å; R334-S337 PolarHBondContact O-OG 3.49Å
335	R	57.5	Low	56.3	Low	208 Å²	208	107.8 Å²	107.8	79%	0.785	67%	0.669	S	S	*	*	H	α-helix	trans	-66.8	-30.1	171.7	-111	-179.1	171.4	175.7	-2.6	113	V331 M332 C333 S338	V331-R335 WeakPolarHBondContact O-CB 3.47Å; V331-R335 PolarHBondContact O-N 3.18Å; M332-R335 PolarHBondContact O-N 2.8Å; C333-R335 PolarHBondContact O-N 3.24Å; R335-S338 PolarHBondContact O-OG 2.72Å
336	K	50.7	Low	54	Low	182 Å²	182	111.4 Å²	111.4	79%	0.791	69%	0.687	S	S	*	*	H	α-helix	trans	-83.6	-23.2	178.5	-161.4	170.6	-177.7	179.5	0	113	M332 C333 R334	M332-K336 WeakPolarHBondContact O-CB 3.44Å; M332-K336 PolarHBondContact O-N 3.03Å; C333-K336 PolarHBondContact O-N 2.78Å; C333-K336 VanDerWaalsContact O-N 3.14Å; R334-K336 VanDerWaalsContact C-N 3.31Å
337	S	51.7	Low	51.9	Low	95 Å²	95	117.9 Å²	117.9	66%	0.664	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-3	176.3	57.4	0	0	0	0	115.1	C333 R334	C333-S337 PolarHBondContact O-N 3.15Å; C333-S337 PolarHBondContact O-OG 2.75Å; R334-S337 WeakPolarHBondContact CA-OG 3.42Å; R334-S337 PolarHBondContact O-N 3.34Å; R334-S337 PolarHBondContact O-OG 3.49Å
338	S	48.8	Very low	49.7	Very low	101 Å²	101	118.9 Å²	118.9	71%	0.706	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	24.4	179.6	68.3	0	0	0	0	114.2	R335	R335-S338 PolarHBondContact O-OG 2.72Å
339	G	43.8	Very low	47.6	Very low	65 Å²	65	118.3 Å²	118.3	67%	0.67	74%	0.739	S	S	*	*	S	Bend	trans	-168.5	115.2	175.6	0	0	0	0	0	113.7
340	G	36.1	Very low	45.7	Very low	88 Å²	88	121.5 Å²	121.5	91%	0.907	76%	0.758	S	S	*	*			trans	123.9	116.6	169.8	0	0	0	0	0	114.1
341	K	35.2	Very low	43.9	Very low	218 Å²	218	123.1 Å²	123.1	95%	0.948	77%	0.773	S	S	*	*			trans	-124.7	130	179.6	179.7	176.5	-177.7	175.8	0	109.2
342	G	33	Very low	42.2	Very low	83 Å²	83	127.6 Å²	127.6	86%	0.856	79%	0.794	S	S	*	*			trans	133.9	139.1	165.3	0	0	0	0	0	115.5
343	G	30.4	Very low	40.6	Very low	82 Å²	82	127.1 Å²	127.1	85%	0.845	80%	0.804	S	S	*	*			trans	137.9	116.8	164.4	0	0	0	0	0	116
344	S	33.7	Very low	39.4	Very low	120 Å²	120	127.5 Å²	127.5	84%	0.839	81%	0.813	S	S	*	*			trans	-154.2	162.2	174.8	-146.8	0	0	0	0	108.2
345	C	30.1	Very low	38.3	Very low	110 Å²	110	128.3 Å²	128.3	74%	0.743	83%	0.825	S	S	*	*			cis	-153.5	145.3	9.9	-174.9	0	0	0	0	110
346	S	33.6	Very low	37	Very low	118 Å²	118	122.1 Å²	122.1	83%	0.825	83%	0.826	S	S	*	*			trans	-157.2	88.7	161	37.7	0	0	0	0	114.9
347	Q	34.8	Very low	36.4	Very low	189 Å²	189	118.5 Å²	118.5	88%	0.883	82%	0.824	S	S	*	*				38.2	121.1	122.7	-154.1	160.4	3	0	0	119.9
348	A	32.2	Very low	35.7	Very low	101 Å²	101	121.3 Å²	121.3	84%	0.835	83%	0.831	S	S	*	*			trans	-74.7	151	171.9	0	0	0	0	0	113.2
349	A	32	Very low	35	Very low	106 Å²	106	125.4 Å²	125.4	88%	0.876	84%	0.839	S	S	*	*			trans	-136.8	139.2	158.7	0	0	0	0	0	109.2
350	S	34.2	Very low	34.6	Very low	118 Å²	118	126.8 Å²	126.8	83%	0.825	84%	0.839	S	S	*	*			trans	-95.2	148	-170.8	53.7	0	0	0	0	113.5
351	S	34.4	Very low	34.5	Very low	116 Å²	116	130.7 Å²	130.7	81%	0.811	84%	0.838	S	S	*	*			trans	-156.2	113.8	142.7	43.5	0	0	0	0	111.8
352	N	38.7	Very low	34.7	Very low	170 Å²	170	128.3 Å²	128.3	91%	0.909	83%	0.834	S	S	*	*			trans	-88.7	142.6	156.5	-83.5	-21.1	0	0	0	108
353	S	39.3	Very low	34.8	Very low	123 Å²	123	128.7 Å²	128.7	86%	0.86	83%	0.829	S	S	*	*			trans	-148.6	113.4	158.9	37.6	0	0	0	0	110.3
354	A	37.1	Very low	34.9	Very low	95 Å²	95	130.7 Å²	130.7	79%	0.785	83%	0.829	S	S	*	*			trans	-130.4	119.6	169.4	0	0	0	0	0	107.8
355	Q	36.6	Very low	35.1	Very low	207 Å²	207	137.7 Å²	137.7	97%	0.967	84%	0.844	S	S	*	*			trans	-177.3	146.5	158.9	-110.8	168.3	-14.8	0	0	110.2
356	G	31.4	Very low	35.4	Very low	78 Å²	78	139.1 Å²	139.1	80%	0.804	85%	0.849	S	S	*	*			trans	155.4	87.4	178.1	0	0	0	0	0	111.3
357	S	36.7	Very low	35.5	Very low	106 Å²	106	140.2 Å²	140.2	74%	0.741	85%	0.85	S	S	*	*			trans	-93.3	162	-174.9	-41.9	0	0	0	0	113.1
358	D	36.8	Very low	35.5	Very low	154 Å²	154	137.5 Å²	137.5	82%	0.824	85%	0.848	S	S	*	*			trans	35.1	119.2	148.3	-59.8	-32.6	0	0	0	121.4
359	E	34	Very low	35.7	Very low	187 Å²	187	139.6 Å²	139.6	87%	0.874	85%	0.849	S	S	*	*				-178.1	154.2	125.4	-96.6	-158.6	120.2	0	0	107.2
360	S	35.7	Very low	35.9	Very low	94 Å²	94	141.8 Å²	141.8	66%	0.657	85%	0.847	S	S	*	*			cis	-175.4	169.7	-21.4	55.5	0	0	0	0	105
361	L	35.4	Very low	36.1	Very low	170 Å²	170	143.3 Å²	143.3	89%	0.89	85%	0.849	S	S	*	*			trans	-70.9	139.9	-173.5	-73.2	143.1	0	0	0	113.2
362	I	39.1	Very low	36.2	Very low	168 Å²	168	145.3 Å²	145.3	86%	0.862	85%	0.852	S	S	*	*			trans	-126.7	118.7	154.9	-61.3	-177.2	0	0	0	109.7
363	A	34.3	Very low	36	Very low	90 Å²	90	143.4 Å²	143.4	74%	0.744	85%	0.847	S	S	*	*			trans	-123	129.7	165.4	0	0	0	0	0	108.8
364	C	32.1	Very low	35.7	Very low	125 Å²	125	145.1 Å²	145.1	85%	0.845	85%	0.846	S	S	*	*			trans	-179.3	140.1	163	-98.4	0	0	0	0	106.8
365	K	39.5	Very low	35.6	Very low	267 Å²	267	149.6 Å²	149.6	100%	1.161	85%	0.852	S	S	*	*			cis	-156.2	0	1.4	-167.7	175.7	-174.2	176.5	0	109.5

Retrieved 365 of 365 residues in 121.9 ms (Link to these results)

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