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Sorting nexin-27

Involved in the retrograde transport from endosome to plasma membrane, a trafficking pathway that promotes the recycling of internalized transmembrane proteins. Following internalization, endocytosed transmembrane proteins are delivered to early endosomes and recycled to the plasma membrane instead of being degraded in lysosomes. SNX27 specifically binds and directs sorting of a subset of transmembrane proteins containing a PDZ-binding motif at the C-terminus: following interaction with target transmembrane proteins, associates with the retromer complex, preventing entry into the lysosomal pathway, and promotes retromer-tubule based plasma membrane recycling. SNX27 also binds with the WASH complex. Interacts with membranes containing phosphatidylinositol-3-phosphate (PtdIns(3P)). May participate in establishment of natural killer cell polarity. Recruits CYTIP to early endosomes.

AlphaFold DB (A0A0D9S5T1), UniProt , Accession A0A096NEC4, Species PAPAN (Papio anubis, Olive baboon), Gene SNX27, Length 528 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	36.7	Very low	34.1	Very low	244 Å²	244	142.5 Å²	142.5	100%	1.202	81%	0.81	S	S	*	*				0	101	0	-124	-180	167.5	0	0	104.7
2	A	34.2	Very low	33.4	Very low	82 Å²	82	141.3 Å²	141.3	68%	0.678	82%	0.818	S	S	*	*			trans	59.9	129.5	179.2	0	0	0	0	0	115.3
3	D	32.8	Very low	33	Very low	142 Å²	142	137.8 Å²	137.8	76%	0.759	82%	0.816	S	S	*	*			cis	65.9	129.7	35.9	-40.6	-48.6	0	0	0	109.8
4	E	35.9	Very low	33.8	Very low	189 Å²	189	136.2 Å²	136.2	88%	0.883	81%	0.811	S	S	*	*			cis	-153.6	166.3	4	-97.1	153.4	119.5	0	0	106
5	D	34.7	Very low	33.4	Very low	156 Å²	156	140.3 Å²	140.3	83%	0.834	82%	0.818	S	S	*	*			cis	-162.1	176.3	-1.2	167.2	46.7	0	0	0	107.6
6	G	31.1	Very low	33.3	Very low	66 Å²	66	146 Å²	146	68%	0.68	82%	0.821	S	S	*	*			trans	157.3	76.8	158.5	0	0	0	0	0	119.3
7	E	31	Very low	33.1	Very low	179 Å²	179	147.1 Å²	147.1	84%	0.836	83%	0.825	S	S	*	*			trans	-71.9	166.5	160.9	-58.3	-170.2	125.9	0	0	111.4
8	G	29.3	Very low	32.9	Very low	72 Å²	72	143.2 Å²	143.2	74%	0.742	82%	0.823	S	S	*	*			cis	-176.8	-163.8	9.3	0	0	0	0	0	108.1
9	I	30.1	Very low	32.6	Very low	154 Å²	154	140.2 Å²	140.2	79%	0.79	83%	0.827	S	S	*	*			cis	-159.2	158.5	-7.4	-102	152.6	0	0	0	106.4
10	H	27.7	Very low	32.3	Very low	176 Å²	176	137.6 Å²	137.6	82%	0.815	83%	0.83	S	S	*	*			trans	-116.4	-171.5	-175.1	-133.8	-36.8	0	0	0	112.7
11	P	51.6	Low	32.1	Very low	107 Å²	107	135.1 Å²	135.1	70%	0.695	83%	0.833	S	S	*	*				-102.4	174.7	-122.4	41.8	-32	0	0	0	116.8
12	S	26.4	Very low	31.6	Very low	129 Å²	129	127.6 Å²	127.6	90%	0.902	82%	0.818	S	S	*	*			trans	-154.7	154.3	165.5	-74.4	0	0	0	0	113.7
13	A	27.4	Very low	31.3	Very low	95 Å²	95	127.8 Å²	127.8	79%	0.785	83%	0.828	S	S	*	*			trans	-152.9	-176	169.5	0	0	0	0	0	107.5
14	P	44.7	Very low	30.9	Very low	116 Å²	116	125 Å²	125	75%	0.753	83%	0.832	S	S	*	*			cis	-120	-164	-23.2	40.2	-25.1	0	0	0	111
15	H	28.2	Very low	30.3	Very low	198 Å²	198	119.5 Å²	119.5	92%	0.917	83%	0.827	S	S	*	*			trans	-143.7	158.9	163.6	-113.1	-81.7	0	0	0	113.5
16	R	31.1	Very low	30	Very low	231 Å²	231	118.2 Å²	118.2	87%	0.872	83%	0.83	S	S	*	*			trans	-152.9	132.9	-166.5	-171.5	-171.9	-167.2	-165.8	6.3	112.8
17	N	29.5	Very low	29.7	Very low	165 Å²	165	118.7 Å²	118.7	88%	0.882	84%	0.835	S	S	*	*			trans	178.3	152.9	155.9	-93.1	-16.2	0	0	0	106.9
18	G	29.5	Very low	29.7	Very low	76 Å²	76	118 Å²	118	78%	0.784	84%	0.836	S	S	*	*			cis	102.5	124.8	13.7	0	0	0	0	0	110.6
19	G	27.5	Very low	29.6	Very low	87 Å²	87	123.7 Å²	123.7	90%	0.897	84%	0.843	S	S	*	*			cis	170.2	168.8	-3.9	0	0	0	0	0	109.8
20	G	27.5	Very low	29.4	Very low	87 Å²	87	122.8 Å²	122.8	90%	0.897	85%	0.849	S	S	*	*			trans	144.4	157.7	174.7	0	0	0	0	0	114.2
21	G	27.3	Very low	29.4	Very low	87 Å²	87	119.1 Å²	119.1	90%	0.897	85%	0.849	S	S	*	*			trans	-166	174.1	-179.4	0	0	0	0	0	113.8
22	G	26.5	Very low	28.3	Very low	86 Å²	86	117.6 Å²	117.6	89%	0.887	85%	0.853	S	S	*	*			trans	-179.8	147.8	178.7	0	0	0	0	0	108.4
23	G	26.8	Very low	28.4	Very low	86 Å²	86	119 Å²	119	89%	0.887	85%	0.85	S	S	*	*			trans	-143.3	171	-169.1	0	0	0	0	0	115
24	G	24.7	Very low	28.5	Very low	82 Å²	82	118.4 Å²	118.4	85%	0.845	85%	0.853	S	S	*	*			trans	150.9	148.9	173.9	0	0	0	0	0	112.7
25	G	24.2	Very low	28	Very low	74 Å²	74	116.7 Å²	116.7	76%	0.763	86%	0.857	S	S	*	*			trans	99.4	80.2	162.2	0	0	0	0	0	117.6
26	S	28	Very low	28.1	Very low	129 Å²	129	110.9 Å²	110.9	90%	0.902	85%	0.85	S	S	*	*			trans	5.5	124.8	141.6	54.9	0	0	0	0	120
27	G	24.7	Very low	28.6	Very low	76 Å²	76	104.2 Å²	104.2	78%	0.784	85%	0.854	S	S	*	*			trans	-170.7	114.8	159.9	0	0	0	0	0	112.5
28	L	30.6	Very low	29.2	Very low	166 Å²	166	99.9 Å²	99.9	87%	0.869	85%	0.848	S	S	*	*			trans	-72.5	132.9	167.5	-88.5	67.7	0	0	0	109
29	H	26.8	Very low	30.6	Very low	190 Å²	190	98.2 Å²	98.2	88%	0.88	83%	0.83	S	S	*	*			trans	-171.3	110	133.8	-96.2	-62.2	0	0	0	109.6	A31	H29-A31 PolarHBondContact O-N 3.17Å
30	C	26.5	Very low	32.9	Very low	135 Å²	135	96.1 Å²	96.1	91%	0.912	81%	0.809	S	S	*	*			trans	-85	84.9	-175.3	38.1	0	0	0	0	112.5	G32	C30-G32 PolarHBondContact O-N 3.08Å; C30-G32 VanDerWaalsContact O-N 3.08Å
31	A	28	Very low	35.9	Very low	99 Å²	99	95.1 Å²	95.1	82%	0.818	79%	0.786	S	S	*	*			trans	-78.1	80.6	168	0	0	0	0	0	111	H29 N33	H29-A31 PolarHBondContact O-N 3.17Å; A31-N33 PolarHBondContact O-N 2.95Å; A31-N33 VanDerWaalsContact O-N 3.09Å
32	G	27.8	Very low	39	Very low	75 Å²	75	93.8 Å²	93.8	77%	0.773	75%	0.754	S	S	*	*			trans	-72	95.3	177.4	0	0	0	0	0	112.4	C30 G34	C30-G32 PolarHBondContact O-N 3.08Å; C30-G32 VanDerWaalsContact O-N 3.08Å; G32-G34 PolarHBondContact O-N 3.09Å
33	N	29.4	Very low	42.2	Very low	159 Å²	159	94.3 Å²	94.3	85%	0.85	74%	0.74	S	S	*	*			trans	-75.3	84	178.6	-169.5	68.8	0	0	0	111.6	A31 G35	A31-N33 PolarHBondContact O-N 2.95Å; A31-N33 VanDerWaalsContact O-N 3.09Å; N33-G35 VanDerWaalsContact C-N 3.33Å; N33-G35 PolarHBondContact O-N 3.34Å
34	G	28.7	Very low	45.5	Very low	83 Å²	83	90.7 Å²	90.7	86%	0.856	70%	0.701	S	S	*	*			trans	-71.8	72	-174.3	0	0	0	0	0	115.1	G32	G32-G34 PolarHBondContact O-N 3.09Å
35	G	35.3	Very low	48.9	Very low	80 Å²	80	94.5 Å²	94.5	83%	0.825	69%	0.69	S	S	*	*			trans	-96.9	87.5	170.4	0	0	0	0	0	112.2	N33	N33-G35 VanDerWaalsContact C-N 3.33Å; N33-G35 PolarHBondContact O-N 3.34Å
36	G	30.5	Very low	52.2	Low	75 Å²	75	91 Å²	91	77%	0.773	65%	0.653	S	S	*	*			trans	-156	118	176.6	0	0	0	0	0	112.3	G38	G36-G38 PolarHBondContact O-N 3.36Å
37	G	41.1	Very low	55.3	Low	92 Å²	92	89.1 Å²	89.1	95%	0.948	64%	0.636	S	S	*	*			trans	-80	107	177.1	0	0	0	0	0	111.4
38	G	41.1	Very low	58.4	Low	74 Å²	74	89.5 Å²	89.5	76%	0.763	62%	0.617	S	S	*	*			trans	-96.7	108.7	172.3	0	0	0	0	0	111.4	G36	G36-G38 PolarHBondContact O-N 3.36Å
39	G	60.3	Low	61	Low	40 Å²	40	83.3 Å²	83.3	41%	0.412	59%	0.587	S	S	.	*			trans	-91.1	-9.7	177.2	0	0	0	0	0	115.4	N71	G39-N71 PolarHBondContact O-ND2 3.2Å
40	G	75.1	Confident	63.5	Low	43 Å²	43	84.3 Å²	84.3	44%	0.443	59%	0.592	S	S	.	*	S	Bend	trans	-77.7	175.3	-177.1	0	0	0	0	0	114.7
41	P	89.8	Confident	65.8	Low	66 Å²	66	81.9 Å²	81.9	43%	0.429	58%	0.576	S	S	.	*			trans	-58.8	141	175.8	-19.6	29.2	0	0	0	112.5	L102 T131 L133	P41-L102 HydrophobicContact CB-CD2 4.23Å; P41-L102 HydrophobicContact CG-CD2 4.02Å; P41-T131 HydrophobicContact CB-CG2 3.78Å; P41-L133 HydrophobicContact CB-CD2 4.28Å; P41-L133 HydrophobicContact CG-CD2 3.82Å
42	R	93.6	Very high	68.7	Low	59 Å²	59	78.1 Å²	78.1	22%	0.223	55%	0.548	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	143	170.2	76.1	-173.3	-166.3	-66.9	5.4	111.3	V44 G94 D99 V132 S134	R42-V44 HydrophobicContact CG-CG1 4.45Å; R42-G94 PolarHBondContact NH2-O 2.99Å; R42-D99 IonicContact CZ-OD1 3.84Å; R42-D99 IonicContact CZ-OD2 2.72Å; R42-D99 IonicContact NH1-OD1 2.65Å; R42-D99 PolarHBondContact NH1-OD1 3.14Å; R42-D99 IonicContact NH1-OD2 3.26Å; R42-D99 PolarHBondContact NH1-OD2 3.06Å; R42-D99 IonicContact NH2-OD1 2.82Å; R42-D99 PolarHBondContact NH2-OD1 3.26Å; R42-D99 IonicContact NH2-OD2 2.76Å; R42-D99 PolarHBondContact NH2-OD2 2.85Å; R42-V132 HydrophobicContact CG-CG2 3.93Å; R42-V132 PolarHBondContact N-O 2.69Å; R42-V132 WeakPolarHBondContact O-CG2 3.47Å; R42-V132 PolarHBondContact O-N 3.23Å; R42-S134 PolarHBondContact NH1-OG 2.92Å
43	V	94	Very high	71.6	Confident	98 Å²	98	75.5 Å²	75.5	59%	0.594	52%	0.515	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	130.8	176.2	-174.5	0	0	0	0	109.8	I129 L130	V43-I129 HydrophobicContact CG1-CG2 3.54Å; V43-L130 CarbonylContact C-O 3.48Å; V43-L130 WeakPolarHBondContact CA-O 3.33Å
44	V	95.4	Very high	74.4	Confident	9 Å²	9	68.6 Å²	68.6	6%	0.055	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	138.3	174.3	-64.3	0	0	0	0	110.3	R42 V95 L130 V132	R42-V44 HydrophobicContact CG-CG1 4.45Å; V44-V95 HydrophobicContact CB-CG2 4.48Å; V44-V95 HydrophobicContact CG2-CG2 3.97Å; V44-L130 HydrophobicContact CG2-CB 3.85Å; V44-L130 PolarHBondContact N-O 3.09Å; V44-L130 PolarHBondContact O-N 2.72Å; V44-V132 HydrophobicContact CG1-CG2 4.07Å; V44-V132 HydrophobicContact CG2-CG2 3.87Å
45	R	95.5	Very high	77.5	Confident	162 Å²	162	65.9 Å²	65.9	61%	0.611	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.8	105.7	-173.3	-175.6	-174.4	-176.3	-158.4	-4.4	109.8	A93 E127	R45-A93 WeakPolarHBondContact O-CB 3.22Å; R45-E127 HydrophobicContact CG-CG 4.29Å; R45-E127 IonicContact CZ-OE1 3.49Å; R45-E127 IonicContact CZ-OE2 3.86Å; R45-E127 IonicContact NE-OE1 3.74Å; R45-E127 PolarHBondContact NE-OE1 3.35Å; R45-E127 IonicContact NE-OE2 3.76Å; R45-E127 PolarHBondContact NE-OE2 3.01Å; R45-E127 IonicContact NH2-OE1 2.76Å; R45-E127 PolarHBondContact NH2-OE1 2.9Å; R45-E127 IonicContact NH2-OE2 3.62Å; R45-E127 PolarHBondContact NH2-OE2 3.39Å
46	I	95	Very high	79.9	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	112.8	-173.4	-40.1	177	0	0	0	109.5	Y53 F55 A89 A90 A93 V95 E127 L128 L130	I46-Y53 HydrophobicContact CB-CD1 4.09Å; I46-Y53 HydrophobicContact CG2-CD1 3.78Å; I46-F55 HydrophobicContact CD1-CD1 4.21Å; I46-F55 HydrophobicContact CD1-CE1 3.8Å; I46-F55 HydrophobicContact CD1-CZ 4.46Å; I46-A89 HydrophobicContact CG2-CB 3.97Å; I46-A90 HydrophobicContact CD1-CB 4.26Å; I46-A90 HydrophobicContact CG2-CB 4.46Å; I46-A93 HydrophobicContact CB-CB 4.34Å; I46-A93 HydrophobicContact CG1-CB 3.94Å; I46-A93 HydrophobicContact CG2-CB 4.37Å; I46-V95 HydrophobicContact CD1-CG2 3.62Å; I46-V95 HydrophobicContact CG1-CG2 4.15Å; I46-E127 CarbonylContact O-C 3.59Å; I46-E127 WeakPolarHBondContact O-CA 3.47Å; I46-L128 HydrophobicContact CB-CB 4.44Å; I46-L128 HydrophobicContact CD1-CD2 4.32Å; I46-L128 PolarHBondContact N-O 2.89Å; I46-L128 PolarHBondContact O-N 3.25Å; I46-L130 HydrophobicContact CD1-CD1 3.9Å; I46-L130 HydrophobicContact CD1-CG 4.44Å
47	V	92.4	Very high	82.6	Confident	90 Å²	90	64.5 Å²	64.5	55%	0.545	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	127.2	170.5	-177.3	0	0	0	0	108.8	A89	V47-A89 WeakPolarHBondContact O-CB 3.17Å
48	K	88.6	Confident	84.5	Confident	85 Å²	85	66.1 Å²	66.1	37%	0.37	38%	0.38	S	S	.	.			trans	-67.2	135.1	-174.7	-156.5	175.1	-167	163.8	0	110.8	Y53 G124 E125 K126	K48-Y53 HydrophobicContact CB-CD1 4.04Å; K48-Y53 HydrophobicContact CB-CE1 3.58Å; K48-Y53 HydrophobicContact CD-CE1 4.22Å; K48-Y53 HydrophobicContact CD-CE2 3.96Å; K48-Y53 HydrophobicContact CG-CD1 4.06Å; K48-Y53 HydrophobicContact CG-CD2 4.37Å; K48-Y53 HydrophobicContact CG-CE1 3.82Å; K48-Y53 HydrophobicContact CG-CE2 4.12Å; K48-Y53 HydrophobicContact CG-CG 4.34Å; K48-G124 PolarHBondContact NZ-O 3.27Å; K48-E125 WeakPolarHBondContact CD-O 3.34Å; K48-E125 WeakPolarHBondContact CE-O 3.43Å; K48-E125 PolarHBondContact NZ-O 2.93Å; K48-K126 WeakPolarHBondContact CB-O 3.44Å; K48-K126 PolarHBondContact N-O 3.36Å
49	S	86.8	Confident	86.1	Confident	35 Å²	35	64.2 Å²	64.2	25%	0.245	36%	0.361	C	S	.	.	B	Isolated β-bridge	trans	-105.1	177.3	174.9	66.1	0	0	0	0	111.4	S51 G52	S49-S51 PolarHBondContact O-N 3.48Å; S49-S51 PolarHBondContact OG-OG 3.43Å; S49-G52 PolarHBondContact N-O 2.82Å; S49-G52 WeakPolarHBondContact O-CA 3.31Å; S49-G52 PolarHBondContact O-N 2.71Å; S49-G52 PolarHBondContact OG-O 2.94Å
50	E	79.2	Confident	86.5	Confident	211 Å²	211	64.3 Å²	64.3	99%	0.986	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-30.4	177	-62	179.7	170.4	0	0	112.5	G52	E50-G52 VanDerWaalsContact C-N 3.25Å; E50-G52 PolarHBondContact O-N 2.68Å
51	S	75.2	Confident	85.8	Confident	84 Å²	84	68.1 Å²	68.1	59%	0.587	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	19.5	170.6	56.8	0	0	0	0	113.6	S49	S49-S51 PolarHBondContact O-N 3.48Å; S49-S51 PolarHBondContact OG-OG 3.43Å
52	G	87.7	Confident	84.3	Confident	21 Å²	21	68.4 Å²	68.4	22%	0.216	37%	0.368	C	S	.	.	B	Isolated β-bridge	trans	76.5	-144.9	-177.3	0	0	0	0	0	113.1	S49 E50	S49-G52 PolarHBondContact N-O 2.82Å; S49-G52 WeakPolarHBondContact O-CA 3.31Å; S49-G52 PolarHBondContact O-N 2.71Å; S49-G52 PolarHBondContact OG-O 2.94Å; E50-G52 VanDerWaalsContact C-N 3.25Å; E50-G52 PolarHBondContact O-N 2.68Å
53	Y	89.6	Confident	83	Confident	19 Å²	19	72 Å²	72	8%	0.075	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-16.4	-179.4	-64.7	-68.2	0	0	0	114	I46 K48 F55 A89 A90 G124 E127 L128	I46-Y53 HydrophobicContact CB-CD1 4.09Å; I46-Y53 HydrophobicContact CG2-CD1 3.78Å; K48-Y53 HydrophobicContact CB-CD1 4.04Å; K48-Y53 HydrophobicContact CB-CE1 3.58Å; K48-Y53 HydrophobicContact CD-CE1 4.22Å; K48-Y53 HydrophobicContact CD-CE2 3.96Å; K48-Y53 HydrophobicContact CG-CD1 4.06Å; K48-Y53 HydrophobicContact CG-CD2 4.37Å; K48-Y53 HydrophobicContact CG-CE1 3.82Å; K48-Y53 HydrophobicContact CG-CE2 4.12Å; K48-Y53 HydrophobicContact CG-CG 4.34Å; Y53-F55 HydrophobicContact CG-CE1 4.44Å; Y53-A89 WeakPolarHBondContact O-CB 3.33Å; Y53-A90 VanDerWaalsContact O-CB 3.24Å; Y53-A90 WeakPolarHBondContact O-CB 3.32Å; Y53-A90 PolarHBondContact O-N 3.36Å; Y53-G124 WeakPolarHBondContact OH-CA 3.43Å; Y53-G124 PolarHBondContact OH-O 2.77Å; Y53-E127 PolarHBondContact OH-O 3.43Å; Y53-L128 HydrophobicContact CD1-CB 4.01Å; Y53-L128 HydrophobicContact CD1-CD2 4.18Å; Y53-L128 HydrophobicContact CD2-CD2 4.03Å; Y53-L128 HydrophobicContact CE1-CB 3.42Å; Y53-L128 VanDerWaalsContact CE1-CB 3.42Å; Y53-L128 HydrophobicContact CE1-CD2 4.28Å; Y53-L128 HydrophobicContact CE2-CB 4.28Å; Y53-L128 HydrophobicContact CE2-CD2 4.14Å; Y53-L128 HydrophobicContact CG-CD2 4.06Å
54	G	88	Confident	81.3	Confident	15 Å²	15	68.8 Å²	68.8	16%	0.155	38%	0.375	C	S	.	.			trans	72.6	32.9	172.5	0	0	0	0	0	116	L85	G54-L85 WeakPolarHBondContact O-CB 3.38Å; G54-L85 PolarHBondContact O-N 3.02Å
55	F	93	Very high	79.6	Confident	25 Å²	25	71 Å²	71	11%	0.11	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	156.4	170.4	73.5	-77.3	0	0	0	111.5	I46 Y53 V57 V81 A83 V84 A90 I101 I121 L128 L130	I46-F55 HydrophobicContact CD1-CD1 4.21Å; I46-F55 HydrophobicContact CD1-CE1 3.8Å; I46-F55 HydrophobicContact CD1-CZ 4.46Å; Y53-F55 HydrophobicContact CG-CE1 4.44Å; F55-V57 HydrophobicContact CD2-CG2 3.97Å; F55-V57 HydrophobicContact CE2-CG2 3.48Å; F55-V57 VanDerWaalsContact CE2-CG2 3.48Å; F55-V57 HydrophobicContact CZ-CG2 4.42Å; F55-V81 HydrophobicContact CB-CG1 4.18Å; F55-V81 HydrophobicContact CD2-CG1 4.17Å; F55-V81 HydrophobicContact CD2-CG2 3.97Å; F55-V81 HydrophobicContact CE2-CG2 4.33Å; F55-A83 CarbonylContact C-O 3.58Å; F55-A83 VanDerWaalsContact CA-O 3.31Å; F55-A83 WeakPolarHBondContact CA-O 3.44Å; F55-A83 WeakPolarHBondContact CB-O 3.29Å; F55-V84 HydrophobicContact CB-CG2 4.39Å; F55-A90 HydrophobicContact CB-CB 3.82Å; F55-A90 HydrophobicContact CD1-CB 3.81Å; F55-A90 HydrophobicContact CG-CB 4.15Å; F55-I101 HydrophobicContact CE2-CD1 4.37Å; F55-I121 HydrophobicContact CE2-CD1 4.44Å; F55-I121 HydrophobicContact CZ-CD1 4.2Å; F55-L128 HydrophobicContact CE1-CD2 3.91Å; F55-L128 HydrophobicContact CZ-CD2 3.96Å; F55-L130 HydrophobicContact CE1-CD1 4.45Å; F55-L130 HydrophobicContact CE2-CD1 4.18Å; F55-L130 HydrophobicContact CZ-CD1 3.78Å
56	N	87.1	Confident	77.9	Confident	102 Å²	102	71 Å²	71	55%	0.545	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	141.7	177.2	-70.9	-15	0	0	0	110.7	V81 S82 A83	N56-V81 CarbonylContact O-C 3.51Å; N56-V81 WeakPolarHBondContact O-CA 3.27Å; N56-S82 PolarHBondContact O-N 3.18Å; N56-S82 PolarHBondContact O-OG 2.89Å; N56-A83 HydrophobicContact CB-CB 4.24Å; N56-A83 PolarHBondContact N-O 2.77Å
57	V	87	Confident	76.5	Confident	24 Å²	24	75.7 Å²	75.7	15%	0.145	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	142.3	176.5	-178.5	0	0	0	0	110.1	F55 Q79 H80 I101 H114 I121	F55-V57 HydrophobicContact CD2-CG2 3.97Å; F55-V57 HydrophobicContact CE2-CG2 3.48Å; F55-V57 VanDerWaalsContact CE2-CG2 3.48Å; F55-V57 HydrophobicContact CZ-CG2 4.42Å; V57-Q79 HydrophobicContact CG1-CB 3.76Å; V57-Q79 HydrophobicContact CG1-CG 4.46Å; V57-H80 WeakPolarHBondContact CA-O 3.18Å; V57-I101 HydrophobicContact CG1-CD1 4.22Å; V57-I101 HydrophobicContact CG2-CD1 3.91Å; V57-H114 PolarHBondContact O-CE1 2.82Å; V57-I121 HydrophobicContact CG2-CD1 3.97Å
58	R	79.6	Confident	75.3	Confident	126 Å²	126	78.9 Å²	78.9	48%	0.475	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	165	166.6	-79	-178.7	176.2	167.5	-3.3	109.1	Q79 H80	R58-Q79 CarbonylContact O-C 3.5Å; R58-Q79 PolarHBondContact O-OE1 3.01Å; R58-H80 PolarHBondContact N-O 3.5Å; R58-H80 PolarHBondContact O-N 2.82Å; R58-H80 PolarHBondContact O-ND1 2.87Å
59	G	75.3	Confident	74.6	Confident	35 Å²	35	78.8 Å²	78.8	36%	0.361	44%	0.443	S	S	.	.			trans	157.8	-155.2	179.7	0	0	0	0	0	111.9
60	Q	68.4	Low	73.9	Confident	41 Å²	41	77.9 Å²	77.9	19%	0.192	44%	0.435	C	S	.	.			trans	-73.5	143.1	-174	-160.5	175	-85.6	0	0	112.4	S62 G64 P77 Q79 H114	Q60-S62 PolarHBondContact NE2-O 2.87Å; Q60-S62 PolarHBondContact NE2-OG 2.85Å; Q60-G64 PolarHBondContact NE2-O 2.82Å; Q60-P77 HydrophobicContact CB-CB 4.45Å; Q60-Q79 PolarHBondContact O-NE2 3.17Å; Q60-H114 WeakPolarHBondContact O-CB 3.26Å; Q60-H114 PolarHBondContact O-N 2.82Å
61	V	60.8	Low	73.6	Confident	124 Å²	124	71.2 Å²	71.2	75%	0.752	41%	0.406	S	S	*	.	S	Bend	trans	-95.4	-30.9	-179.1	-172.2	0	0	0	0	111.9	T113	V61-T113 WeakPolarHBondContact O-CG2 3.24Å
62	S	57.6	Low	72.8	Confident	71 Å²	71	70.4 Å²	70.4	50%	0.497	41%	0.411	S	S	.	.	S	Bend	trans	-86	160.1	171.7	53.1	0	0	0	0	112.4	Q60	Q60-S62 PolarHBondContact NE2-O 2.87Å; Q60-S62 PolarHBondContact NE2-OG 2.85Å
63	E	66.8	Low	71.8	Confident	134 Å²	134	74.5 Å²	74.5	63%	0.626	43%	0.425	S	S	*	.	S	Bend	trans	-85.1	153.8	174	-164	158.5	-136.2	0	0	111	G111 T113 Q116	E63-G111 CarbonylContact C-O 3.52Å; E63-G111 WeakPolarHBondContact CA-O 3.28Å; E63-T113 HydrophobicContact CB-CG2 3.95Å; E63-Q116 PolarHBondContact OE1-NE2 3.38Å
64	G	58.8	Low	70.9	Confident	32 Å²	32	79.2 Å²	79.2	33%	0.33	45%	0.45	S	S	.	.	S	Bend	trans	70.8	-139.5	-179.3	0	0	0	0	0	113.6	Q60 P77 G111	Q60-G64 PolarHBondContact NE2-O 2.82Å; G64-P77 WeakPolarHBondContact O-CD 3.47Å; G64-P77 WeakPolarHBondContact O-CG 3.41Å; G64-G111 PolarHBondContact N-O 2.91Å
65	G	59	Low	70.3	Confident	54 Å²	54	79.6 Å²	79.6	56%	0.557	45%	0.447	S	S	*	.			trans	101.3	172.1	178.5	0	0	0	0	0	114.7
66	Q	60.7	Low	69.7	Low	164 Å²	164	79.3 Å²	79.3	77%	0.766	45%	0.45	S	S	*	.			trans	-67.2	137.9	-172.8	-167.4	177.8	26.8	0	0	112.3	P77	Q66-P77 WeakPolarHBondContact O-CG 3.43Å
67	L	66	Low	69.5	Low	97 Å²	97	74.7 Å²	74.7	51%	0.508	43%	0.425	S	S	.	.			trans	-58	141.6	174.7	-59.6	179.1	0	0	0	111.1	L74 Y75 A76	L67-L74 HydrophobicContact CB-CB 4.31Å; L67-L74 HydrophobicContact CB-CD2 4.43Å; L67-L74 HydrophobicContact CD1-CB 4.29Å; L67-L74 HydrophobicContact CD1-CD1 4.32Å; L67-Y75 CarbonylContact C-O 3.51Å; L67-Y75 WeakPolarHBondContact CA-O 3.49Å; L67-A76 HydrophobicContact CD2-CB 4.01Å
68	R	65.8	Low	69.6	Low	158 Å²	158	74.4 Å²	74.4	60%	0.596	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.3	135.5	178.6	-59.6	-172.9	-178.7	-138.5	-1.9	109.8	I70 Y75	R68-I70 PolarHBondContact O-N 2.78Å; R68-Y75 PolarHBondContact N-O 2.77Å; R68-Y75 PolarHBondContact O-N 3.45Å
69	S	73.3	Confident	70.1	Confident	83 Å²	83	68.4 Å²	68.4	58%	0.58	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.5	127.4	169.5	-173.8	0	0	0	0	109.6	E73	S69-E73 CarbonylContact C-O 3.43Å; S69-E73 WeakPolarHBondContact CA-O 3.37Å
70	I	73.4	Confident	70.8	Confident	15 Å²	15	68.3 Å²	68.3	8%	0.077	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	116.8	170.6	-53.3	169.3	0	0	0	106	R68 G72 E73 Y75 L78 R100 L133 V135	R68-I70 PolarHBondContact O-N 2.78Å; I70-G72 PolarHBondContact O-N 2.75Å; I70-E73 PolarHBondContact N-O 2.85Å; I70-E73 PolarHBondContact O-N 2.67Å; I70-E73 VanDerWaalsContact O-N 3.16Å; I70-Y75 HydrophobicContact CB-CD2 3.86Å; I70-Y75 HydrophobicContact CB-CE2 4.21Å; I70-Y75 HydrophobicContact CD1-CD2 3.95Å; I70-Y75 HydrophobicContact CD1-CG 4.22Å; I70-Y75 HydrophobicContact CG1-CD2 4.15Å; I70-L78 HydrophobicContact CD1-CD1 3.82Å; I70-L78 HydrophobicContact CD1-CG 4.27Å; I70-R100 HydrophobicContact CD1-CB 4.39Å; I70-R100 HydrophobicContact CD1-CG 4.15Å; I70-R100 HydrophobicContact CG2-CG 4.4Å; I70-L133 HydrophobicContact CB-CD1 4.25Å; I70-L133 HydrophobicContact CD1-CD1 4.05Å; I70-L133 HydrophobicContact CG2-CB 4.09Å; I70-L133 HydrophobicContact CG2-CD1 3.93Å; I70-V135 HydrophobicContact CG2-CG1 4.4Å
71	N	71.7	Confident	72	Confident	72 Å²	72	66.4 Å²	66.4	39%	0.385	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	20	-176.7	-59.5	-22.7	0	0	0	115.6	G39 S134	G39-N71 PolarHBondContact O-ND2 3.2Å; N71-S134 PolarHBondContact ND2-O 2.89Å
72	G	59.5	Low	73.1	Confident	66 Å²	66	60.9 Å²	60.9	68%	0.68	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	104.9	-6.5	178.2	0	0	0	0	0	115.3	I70	I70-G72 PolarHBondContact O-N 2.75Å
73	E	67.5	Low	74.3	Confident	108 Å²	108	59.2 Å²	59.2	51%	0.505	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	146	177.2	-70.9	168.6	167.9	0	0	110.6	S69 I70 Y75	S69-E73 CarbonylContact C-O 3.43Å; S69-E73 WeakPolarHBondContact CA-O 3.37Å; I70-E73 PolarHBondContact N-O 2.85Å; I70-E73 PolarHBondContact O-N 2.67Å; I70-E73 VanDerWaalsContact O-N 3.16Å; E73-Y75 HydrophobicContact CB-CD2 4.3Å; E73-Y75 HydrophobicContact CB-CE2 3.56Å; E73-Y75 WeakPolarHBondContact O-CD2 3.26Å; E73-Y75 PolarHBondContact OE2-OH 3.37Å
74	L	68.7	Low	75.4	Confident	118 Å²	118	54.3 Å²	54.3	62%	0.618	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.7	116.6	-179.6	-70	178.9	0	0	0	111.1	L67	L67-L74 HydrophobicContact CB-CB 4.31Å; L67-L74 HydrophobicContact CB-CD2 4.43Å; L67-L74 HydrophobicContact CD1-CB 4.29Å; L67-L74 HydrophobicContact CD1-CD1 4.32Å
75	Y	76	Confident	76.6	Confident	22 Å²	22	56.8 Å²	56.8	9%	0.086	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	151.9	175	-64.4	-89.2	0	0	0	110.4	L67 R68 I70 E73 L102 E110 L133	L67-Y75 CarbonylContact C-O 3.51Å; L67-Y75 WeakPolarHBondContact CA-O 3.49Å; R68-Y75 PolarHBondContact N-O 2.77Å; R68-Y75 PolarHBondContact O-N 3.45Å; I70-Y75 HydrophobicContact CB-CD2 3.86Å; I70-Y75 HydrophobicContact CB-CE2 4.21Å; I70-Y75 HydrophobicContact CD1-CD2 3.95Å; I70-Y75 HydrophobicContact CD1-CG 4.22Å; I70-Y75 HydrophobicContact CG1-CD2 4.15Å; E73-Y75 HydrophobicContact CB-CD2 4.3Å; E73-Y75 HydrophobicContact CB-CE2 3.56Å; E73-Y75 WeakPolarHBondContact O-CD2 3.26Å; E73-Y75 PolarHBondContact OE2-OH 3.37Å; Y75-L102 HydrophobicContact CD1-CD1 3.62Å; Y75-L102 HydrophobicContact CE1-CD1 3.75Å; Y75-L102 HydrophobicContact CE1-CD2 4.02Å; Y75-E110 WeakPolarHBondContact CA-OE2 3.48Å; Y75-L133 HydrophobicContact CD1-CD1 4.24Å; Y75-L133 HydrophobicContact CD2-CD1 3.88Å; Y75-L133 HydrophobicContact CE1-CD1 3.95Å; Y75-L133 HydrophobicContact CE2-CD1 3.58Å; Y75-L133 HydrophobicContact CE2-CD2 4.4Å; Y75-L133 HydrophobicContact CG-CD1 4.2Å
76	A	81.2	Confident	77.9	Confident	20 Å²	20	59.6 Å²	59.6	17%	0.165	33%	0.331	C	S	.	.			trans	-71.2	161.8	167.5	0	0	0	0	0	110.6	L67 L78 E110	L67-A76 HydrophobicContact CD2-CB 4.01Å; A76-L78 PolarHBondContact O-N 2.94Å; A76-E110 HydrophobicContact CB-CB 3.96Å; A76-E110 PolarHBondContact N-OE2 3.38Å
77	P	82.2	Confident	79	Confident	4 Å²	4	54 Å²	54	3%	0.026	32%	0.317	C	S	.	.			trans	-53.1	113.5	-170.5	-31.8	38.6	0	0	0	114.6	Q60 G64 Q66 G111	Q60-P77 HydrophobicContact CB-CB 4.45Å; G64-P77 WeakPolarHBondContact O-CD 3.47Å; G64-P77 WeakPolarHBondContact O-CG 3.41Å; Q66-P77 WeakPolarHBondContact O-CG 3.43Å; P77-G111 WeakPolarHBondContact O-CA 3.02Å; P77-G111 PolarHBondContact O-N 3.29Å; P77-G111 VanDerWaalsContact O-N 3.11Å
78	L	88.9	Confident	80.1	Confident	18 Å²	18	49.5 Å²	49.5	9%	0.094	30%	0.295	C	S	.	.			trans	-90.9	150	179.1	-63.1	-171.9	0	0	0	112.7	I70 A76 R100 I101 L102 E110 L133	I70-L78 HydrophobicContact CD1-CD1 3.82Å; I70-L78 HydrophobicContact CD1-CG 4.27Å; A76-L78 PolarHBondContact O-N 2.94Å; L78-R100 HydrophobicContact CB-CB 4.08Å; L78-R100 HydrophobicContact CD1-CB 3.72Å; L78-I101 WeakPolarHBondContact CD2-O 3.49Å; L78-L102 HydrophobicContact CD1-CB 4.35Å; L78-L102 HydrophobicContact CD1-CD1 4.26Å; L78-L102 HydrophobicContact CD2-CD1 4.27Å; L78-E110 HydrophobicContact CD2-CB 4.37Å; L78-E110 HydrophobicContact CD2-CG 3.58Å; L78-L133 HydrophobicContact CD1-CD1 3.89Å
79	Q	89.9	Confident	81.3	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	153.8	162.3	-54.4	-65.8	-46.4	0	0	109.8	V57 R58 Q60 R100 I101 A112 H114 V117	V57-Q79 HydrophobicContact CG1-CB 3.76Å; V57-Q79 HydrophobicContact CG1-CG 4.46Å; R58-Q79 CarbonylContact O-C 3.5Å; R58-Q79 PolarHBondContact O-OE1 3.01Å; Q60-Q79 PolarHBondContact O-NE2 3.17Å; Q79-R100 CarbonylContact O-C 3.52Å; Q79-R100 WeakPolarHBondContact O-CA 3.26Å; Q79-I101 PolarHBondContact O-N 3.12Å; Q79-A112 PolarHBondContact NE2-O 2.71Å; Q79-H114 PolarHBondContact OE1-ND1 3.29Å; Q79-H114 VanDerWaalsContact OE1-ND1 3.14Å; Q79-V117 HydrophobicContact CB-CG1 4.26Å; Q79-V117 HydrophobicContact CG-CB 3.84Å; Q79-V117 HydrophobicContact CG-CG1 4.01Å; Q79-V117 HydrophobicContact CG-CG2 3.57Å
80	H	91.3	Very high	82.3	Confident	34 Å²	34	38.2 Å²	38.2	16%	0.157	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	154.8	-178.6	68.5	-96.9	0	0	0	113.1	V57 R58 S82 D99	V57-H80 WeakPolarHBondContact CA-O 3.18Å; R58-H80 PolarHBondContact N-O 3.5Å; R58-H80 PolarHBondContact O-N 2.82Å; R58-H80 PolarHBondContact O-ND1 2.87Å; H80-S82 PolarHBondContact O-N 2.9Å; H80-D99 CarbonylContact C-O 3.55Å; H80-D99 VanDerWaalsContact CA-O 3.24Å; H80-D99 WeakPolarHBondContact CA-O 3.26Å
81	V	92.8	Very high	83.2	Confident	0 Å²	0	41 Å²	41	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	107.9	172.6	-179.1	0	0	0	0	109.3	F55 N56 V84 V95 G98 D99 I101	F55-V81 HydrophobicContact CB-CG1 4.18Å; F55-V81 HydrophobicContact CD2-CG1 4.17Å; F55-V81 HydrophobicContact CD2-CG2 3.97Å; F55-V81 HydrophobicContact CE2-CG2 4.33Å; N56-V81 CarbonylContact O-C 3.51Å; N56-V81 WeakPolarHBondContact O-CA 3.27Å; V81-V84 HydrophobicContact CG1-CG2 3.54Å; V81-V95 HydrophobicContact CB-CG1 4.42Å; V81-V95 HydrophobicContact CG1-CG1 4Å; V81-V95 HydrophobicContact CG2-CG1 3.86Å; V81-G98 PolarHBondContact O-N 2.92Å; V81-D99 HydrophobicContact CB-CB 4.32Å; V81-D99 HydrophobicContact CG2-CB 4.01Å; V81-D99 PolarHBondContact N-O 3.21Å; V81-I101 HydrophobicContact CG2-CD1 4.44Å; V81-I101 HydrophobicContact CG2-CG1 4.42Å
82	S	84.1	Confident	84.1	Confident	8 Å²	8	45.7 Å²	45.7	6%	0.056	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	-26.7	-177.8	52	0	0	0	0	113.4	N56 H80 K97	N56-S82 PolarHBondContact O-N 3.18Å; N56-S82 PolarHBondContact O-OG 2.89Å; H80-S82 PolarHBondContact O-N 2.9Å; S82-K97 WeakPolarHBondContact O-CE 3.47Å
83	A	83.2	Confident	85.7	Confident	36 Å²	36	43.8 Å²	43.8	30%	0.298	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	152.3	172	0	0	0	0	0	111	F55 N56	F55-A83 CarbonylContact C-O 3.58Å; F55-A83 VanDerWaalsContact CA-O 3.31Å; F55-A83 WeakPolarHBondContact CA-O 3.44Å; F55-A83 WeakPolarHBondContact CB-O 3.29Å; N56-A83 HydrophobicContact CB-CB 4.24Å; N56-A83 PolarHBondContact N-O 2.77Å
84	V	89.4	Confident	86.8	Confident	32 Å²	32	40.4 Å²	40.4	19%	0.194	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	136.4	172.4	-177.4	0	0	0	0	107.8	F55 V81 P86 A90 D91 V95	F55-V84 HydrophobicContact CB-CG2 4.39Å; V81-V84 HydrophobicContact CG1-CG2 3.54Å; V84-P86 WeakPolarHBondContact O-CD 3.42Å; V84-A90 HydrophobicContact CG1-CB 4.1Å; V84-D91 HydrophobicContact CG1-CB 3.77Å; V84-V95 HydrophobicContact CG2-CG1 4.02Å
85	L	83.8	Confident	88	Confident	84 Å²	84	35 Å²	35	44%	0.44	21%	0.212	S	C	.	.			trans	-75.2	117.2	176.9	179	66.3	0	0	0	109.7	G54 G87 G88 D91	G54-L85 WeakPolarHBondContact O-CB 3.38Å; G54-L85 PolarHBondContact O-N 3.02Å; L85-G87 PolarHBondContact O-N 2.83Å; L85-G88 WeakPolarHBondContact O-CA 3.44Å; L85-G88 PolarHBondContact O-N 2.96Å; L85-D91 WeakPolarHBondContact O-CB 3.43Å
86	P	86.1	Confident	88.8	Confident	112 Å²	112	40.7 Å²	40.7	73%	0.727	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	133.1	-179.9	-25	35.8	0	0	0	112.1	V84 G88	V84-P86 WeakPolarHBondContact O-CD 3.42Å; P86-G88 PolarHBondContact O-N 3.03Å
87	G	84.3	Confident	89.2	Confident	46 Å²	46	42.2 Å²	42.2	47%	0.474	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.5	1	-172.3	0	0	0	0	0	114.8	L85 D91 R92	L85-G87 PolarHBondContact O-N 2.83Å; G87-D91 WeakPolarHBondContact CA-OD2 3.3Å; G87-D91 PolarHBondContact N-OD2 3.15Å; G87-R92 PolarHBondContact O-NH1 3Å
88	G	90	Very high	89.5	Confident	4 Å²	4	42 Å²	42	4%	0.041	24%	0.235	C	C	.	.	S	Bend	trans	-74.8	-179	-177.6	0	0	0	0	0	114.5	L85 P86 D91 R92	L85-G88 WeakPolarHBondContact O-CA 3.44Å; L85-G88 PolarHBondContact O-N 2.96Å; P86-G88 PolarHBondContact O-N 3.03Å; G88-D91 PolarHBondContact O-N 3.26Å; G88-R92 VanDerWaalsContact O-CG 3.28Å; G88-R92 WeakPolarHBondContact O-CG 3.47Å; G88-R92 PolarHBondContact O-N 2.86Å; G88-R92 VanDerWaalsContact O-N 3.1Å
89	A	91.1	Very high	89.8	Confident	4 Å²	4	41.2 Å²	41.2	3%	0.033	23%	0.23	C	C	.	.	H	α-helix	trans	-63.3	-45.9	-177.8	0	0	0	0	0	113.2	I46 V47 Y53 A93	I46-A89 HydrophobicContact CG2-CB 3.97Å; V47-A89 WeakPolarHBondContact O-CB 3.17Å; Y53-A89 WeakPolarHBondContact O-CB 3.33Å; A89-A93 WeakPolarHBondContact O-CB 3.36Å; A89-A93 PolarHBondContact O-N 3.37Å
90	A	93.8	Very high	89.9	Confident	0 Å²	0	43 Å²	43	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64.8	-41.8	176.2	0	0	0	0	0	113.4	I46 Y53 F55 V84 A93 G94 V95	I46-A90 HydrophobicContact CD1-CB 4.26Å; I46-A90 HydrophobicContact CG2-CB 4.46Å; Y53-A90 VanDerWaalsContact O-CB 3.24Å; Y53-A90 WeakPolarHBondContact O-CB 3.32Å; Y53-A90 PolarHBondContact O-N 3.36Å; F55-A90 HydrophobicContact CB-CB 3.82Å; F55-A90 HydrophobicContact CD1-CB 3.81Å; F55-A90 HydrophobicContact CG-CB 4.15Å; V84-A90 HydrophobicContact CG1-CB 4.1Å; A90-A93 CarbonylContact O-C 3.49Å; A90-A93 WeakPolarHBondContact O-CA 3.41Å; A90-A93 WeakPolarHBondContact O-CB 3.36Å; A90-A93 PolarHBondContact O-N 3.38Å; A90-G94 PolarHBondContact O-N 3.1Å; A90-V95 HydrophobicContact CB-CB 3.9Å; A90-V95 HydrophobicContact CB-CG1 4.38Å; A90-V95 HydrophobicContact CB-CG2 3.82Å; A90-V95 WeakPolarHBondContact O-CB 3.44Å; A90-V95 WeakPolarHBondContact O-CG2 3.34Å; A90-V95 PolarHBondContact O-N 2.92Å
91	D	91.6	Very high	90.1	Very high	73 Å²	73	41.4 Å²	41.4	39%	0.39	23%	0.23	S	C	.	.	H	α-helix	trans	-59.1	-50.7	177.2	-171.6	41.3	0	0	0	111.2	V84 L85 G87 G88 A93 G94	V84-D91 HydrophobicContact CG1-CB 3.77Å; L85-D91 WeakPolarHBondContact O-CB 3.43Å; G87-D91 WeakPolarHBondContact CA-OD2 3.3Å; G87-D91 PolarHBondContact N-OD2 3.15Å; G88-D91 PolarHBondContact O-N 3.26Å; D91-A93 PolarHBondContact O-N 2.93Å; D91-A93 VanDerWaalsContact O-N 3.14Å; D91-G94 PolarHBondContact O-N 2.88Å
92	R	91.6	Very high	90.2	Very high	170 Å²	170	42.1 Å²	42.1	64%	0.642	23%	0.234	S	C	*	.	H	α-helix	trans	-64.4	-16.8	174.8	-63.2	-177.5	-46.1	-114.8	6.6	113.8	G87 G88	G87-R92 PolarHBondContact O-NH1 3Å; G88-R92 VanDerWaalsContact O-CG 3.28Å; G88-R92 WeakPolarHBondContact O-CG 3.47Å; G88-R92 PolarHBondContact O-N 2.86Å; G88-R92 VanDerWaalsContact O-N 3.1Å
93	A	92	Very high	90.8	Very high	27 Å²	27	44.3 Å²	44.3	22%	0.223	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	1	174.5	0	0	0	0	0	113.4	R45 I46 A89 A90 D91	R45-A93 WeakPolarHBondContact O-CB 3.22Å; I46-A93 HydrophobicContact CB-CB 4.34Å; I46-A93 HydrophobicContact CG1-CB 3.94Å; I46-A93 HydrophobicContact CG2-CB 4.37Å; A89-A93 WeakPolarHBondContact O-CB 3.36Å; A89-A93 PolarHBondContact O-N 3.37Å; A90-A93 CarbonylContact O-C 3.49Å; A90-A93 WeakPolarHBondContact O-CA 3.41Å; A90-A93 WeakPolarHBondContact O-CB 3.36Å; A90-A93 PolarHBondContact O-N 3.38Å; D91-A93 PolarHBondContact O-N 2.93Å; D91-A93 VanDerWaalsContact O-N 3.14Å
94	G	91.6	Very high	91.3	Very high	36 Å²	36	42.6 Å²	42.6	37%	0.371	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.7	19.8	178.5	0	0	0	0	0	114.8	R42 A90 D91	R42-G94 PolarHBondContact NH2-O 2.99Å; A90-G94 PolarHBondContact O-N 3.1Å; D91-G94 PolarHBondContact O-N 2.88Å
95	V	93.9	Very high	91.4	Very high	4 Å²	4	43.7 Å²	43.7	2%	0.024	23%	0.234	C	C	.	.			trans	-72.8	136.1	168.5	-176	0	0	0	0	109.1	V44 I46 V81 V84 A90	V44-V95 HydrophobicContact CB-CG2 4.48Å; V44-V95 HydrophobicContact CG2-CG2 3.97Å; I46-V95 HydrophobicContact CD1-CG2 3.62Å; I46-V95 HydrophobicContact CG1-CG2 4.15Å; V81-V95 HydrophobicContact CB-CG1 4.42Å; V81-V95 HydrophobicContact CG1-CG1 4Å; V81-V95 HydrophobicContact CG2-CG1 3.86Å; V84-V95 HydrophobicContact CG2-CG1 4.02Å; A90-V95 HydrophobicContact CB-CB 3.9Å; A90-V95 HydrophobicContact CB-CG1 4.38Å; A90-V95 HydrophobicContact CB-CG2 3.82Å; A90-V95 WeakPolarHBondContact O-CB 3.44Å; A90-V95 WeakPolarHBondContact O-CG2 3.34Å; A90-V95 PolarHBondContact O-N 2.92Å
96	R	92.1	Very high	91.7	Very high	142 Å²	142	45.9 Å²	45.9	54%	0.536	24%	0.241	S	C	.	.			trans	-118.8	151	-179.8	-64.3	-172.8	-77	-151.1	-1.8	110.7	G98 D99 S134	R96-G98 PolarHBondContact O-N 2.91Å; R96-D99 PolarHBondContact N-OD2 2.98Å; R96-D99 WeakPolarHBondContact O-CB 3.28Å; R96-D99 PolarHBondContact O-N 3.42Å; R96-S134 VanDerWaalsContact CZ-OG 3.32Å; R96-S134 PolarHBondContact NE-OG 3.47Å; R96-S134 VanDerWaalsContact NE-OG 3.1Å; R96-S134 VanDerWaalsContact NH2-CB 3.35Å; R96-S134 PolarHBondContact NH2-OG 2.88Å
97	K	88.8	Confident	91.9	Very high	52 Å²	52	43.9 Å²	43.9	23%	0.226	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	139.5	165	-171	-179.2	177.4	-164.1	0	108.3	S82 D99 A140 D144	S82-K97 WeakPolarHBondContact O-CE 3.47Å; K97-D99 VanDerWaalsContact C-N 3.33Å; K97-D99 PolarHBondContact O-N 2.97Å; K97-A140 WeakPolarHBondContact CD-O 3.48Å; K97-A140 WeakPolarHBondContact CE-O 3.45Å; K97-A140 PolarHBondContact NZ-O 2.72Å; K97-A140 WeakPolarHBondContact O-CB 3.41Å; K97-D144 IonicContact NZ-OD1 3.15Å; K97-D144 PolarHBondContact NZ-OD1 3.18Å; K97-D144 IonicContact NZ-OD2 2.74Å; K97-D144 PolarHBondContact NZ-OD2 2.82Å
98	G	89.7	Confident	92.3	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	85	-15.2	-178.2	0	0	0	0	0	116.5	V81 R96 R100 V135	V81-G98 PolarHBondContact O-N 2.92Å; R96-G98 PolarHBondContact O-N 2.91Å; G98-R100 PolarHBondContact O-N 2.81Å; G98-R100 PolarHBondContact O-NH1 3.48Å; G98-V135 WeakPolarHBondContact O-CG2 3.33Å
99	D	94.4	Very high	92.4	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	22%	0.223	C	C	.	.			trans	-51.5	127.6	175.8	-84.1	-29.2	0	0	0	111.2	R42 H80 V81 R96 K97 V132 L133 S134	R42-D99 IonicContact CZ-OD1 3.84Å; R42-D99 IonicContact CZ-OD2 2.72Å; R42-D99 IonicContact NH1-OD1 2.65Å; R42-D99 PolarHBondContact NH1-OD1 3.14Å; R42-D99 IonicContact NH1-OD2 3.26Å; R42-D99 PolarHBondContact NH1-OD2 3.06Å; R42-D99 IonicContact NH2-OD1 2.82Å; R42-D99 PolarHBondContact NH2-OD1 3.26Å; R42-D99 IonicContact NH2-OD2 2.76Å; R42-D99 PolarHBondContact NH2-OD2 2.85Å; H80-D99 CarbonylContact C-O 3.55Å; H80-D99 VanDerWaalsContact CA-O 3.24Å; H80-D99 WeakPolarHBondContact CA-O 3.26Å; V81-D99 HydrophobicContact CB-CB 4.32Å; V81-D99 HydrophobicContact CG2-CB 4.01Å; V81-D99 PolarHBondContact N-O 3.21Å; R96-D99 PolarHBondContact N-OD2 2.98Å; R96-D99 WeakPolarHBondContact O-CB 3.28Å; R96-D99 PolarHBondContact O-N 3.42Å; K97-D99 VanDerWaalsContact C-N 3.33Å; K97-D99 PolarHBondContact O-N 2.97Å; D99-V132 HydrophobicContact CB-CB 4.14Å; D99-V132 HydrophobicContact CB-CG1 4.26Å; D99-L133 CarbonylContact C-O 3.45Å; D99-L133 WeakPolarHBondContact CA-O 3.4Å; D99-S134 VanDerWaalsContact OD1-CA 3.29Å; D99-S134 WeakPolarHBondContact OD1-CA 3.37Å; D99-S134 WeakPolarHBondContact OD1-CB 3.3Å; D99-S134 PolarHBondContact OD1-OG 3.2Å
100	R	93.4	Very high	92.4	Very high	38 Å²	38	48.5 Å²	48.5	14%	0.143	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	129.6	174.7	-42.3	-64.6	-169.4	-131.9	4.4	108.4	I70 L78 Q79 G98 V132 L133 V135 E139	I70-R100 HydrophobicContact CD1-CB 4.39Å; I70-R100 HydrophobicContact CD1-CG 4.15Å; I70-R100 HydrophobicContact CG2-CG 4.4Å; L78-R100 HydrophobicContact CB-CB 4.08Å; L78-R100 HydrophobicContact CD1-CB 3.72Å; Q79-R100 CarbonylContact O-C 3.52Å; Q79-R100 WeakPolarHBondContact O-CA 3.26Å; G98-R100 PolarHBondContact O-N 2.81Å; G98-R100 PolarHBondContact O-NH1 3.48Å; R100-V132 CarbonylContact O-C 3.59Å; R100-V132 WeakPolarHBondContact O-CA 3.43Å; R100-L133 HydrophobicContact CB-CB 4.27Å; R100-L133 PolarHBondContact N-O 3.23Å; R100-L133 PolarHBondContact O-N 2.85Å; R100-V135 HydrophobicContact CG-CG1 3.97Å; R100-E139 IonicContact CZ-OE2 3.32Å; R100-E139 IonicContact NH2-OE2 2.77Å; R100-E139 PolarHBondContact NH2-OE2 2.58Å
101	I	95.2	Very high	91.8	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	111	-176.2	-55.1	171.3	0	0	0	108.3	F55 V57 L78 Q79 V81 V104 V109 I121 L130 V132	F55-I101 HydrophobicContact CE2-CD1 4.37Å; V57-I101 HydrophobicContact CG1-CD1 4.22Å; V57-I101 HydrophobicContact CG2-CD1 3.91Å; L78-I101 WeakPolarHBondContact CD2-O 3.49Å; Q79-I101 PolarHBondContact O-N 3.12Å; V81-I101 HydrophobicContact CG2-CD1 4.44Å; V81-I101 HydrophobicContact CG2-CG1 4.42Å; I101-V104 HydrophobicContact CG2-CG2 3.8Å; I101-V109 HydrophobicContact CG2-CG2 4.1Å; I101-V109 WeakPolarHBondContact O-CG2 3.26Å; I101-I121 HydrophobicContact CD1-CD1 4.37Å; I101-L130 HydrophobicContact CG2-CD2 4.26Å; I101-V132 HydrophobicContact CG1-CG1 4.25Å
102	L	93.7	Very high	91.2	Very high	16 Å²	16	45.8 Å²	45.8	8%	0.084	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	-38.8	179.4	-178.6	63.3	0	0	0	111.7	P41 Y75 L78 N108 V109 E110 T131	P41-L102 HydrophobicContact CB-CD2 4.23Å; P41-L102 HydrophobicContact CG-CD2 4.02Å; Y75-L102 HydrophobicContact CD1-CD1 3.62Å; Y75-L102 HydrophobicContact CE1-CD1 3.75Å; Y75-L102 HydrophobicContact CE1-CD2 4.02Å; L78-L102 HydrophobicContact CD1-CB 4.35Å; L78-L102 HydrophobicContact CD1-CD1 4.26Å; L78-L102 HydrophobicContact CD2-CD1 4.27Å; L102-N108 WeakPolarHBondContact O-CA 3.33Å; L102-V109 WeakPolarHBondContact O-CG2 3.33Å; L102-V109 PolarHBondContact O-N 3.38Å; L102-E110 HydrophobicContact CD1-CG 3.79Å; L102-T131 HydrophobicContact CB-CG2 4.44Å; L102-T131 HydrophobicContact CD2-CG2 4.25Å; L102-T131 PolarHBondContact N-O 3.14Å
103	E	96.3	Very high	90.7	Very high	53 Å²	53	38.8 Å²	38.8	25%	0.248	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	150.5	174.8	-50.3	179.8	123	0	0	112.2	V107 L130 T131	E103-V107 CarbonylContact C-O 3.57Å; E103-V107 WeakPolarHBondContact CA-O 3.33Å; E103-L130 WeakPolarHBondContact O-CA 3.44Å; E103-T131 HydrophobicContact CG-CG2 4.4Å; E103-T131 PolarHBondContact N-O 3.22Å; E103-T131 PolarHBondContact O-N 2.95Å; E103-T131 VanDerWaalsContact O-N 3.08Å; E103-T131 VanDerWaalsContact OE2-CB 3.26Å; E103-T131 WeakPolarHBondContact OE2-CB 3.33Å; E103-T131 PolarHBondContact OE2-OG1 3.15Å
104	V	95.3	Very high	90.1	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	117.5	167.9	-176.5	0	0	0	0	108.8	I101 H106 V107 V109 V117 L120 I121 L128 L130	I101-V104 HydrophobicContact CG2-CG2 3.8Å; V104-H106 VanDerWaalsContact C-N 3.26Å; V104-H106 PolarHBondContact O-N 2.94Å; V104-V107 PolarHBondContact N-O 3.01Å; V104-V107 WeakPolarHBondContact O-CB 3.4Å; V104-V107 PolarHBondContact O-N 2.92Å; V104-V109 HydrophobicContact CB-CG1 4.44Å; V104-V109 HydrophobicContact CG2-CG1 4.06Å; V104-V109 HydrophobicContact CG2-CG2 4.37Å; V104-V117 HydrophobicContact CG2-CG1 4.01Å; V104-L120 HydrophobicContact CB-CB 4.09Å; V104-L120 HydrophobicContact CG1-CB 3.79Å; V104-I121 HydrophobicContact CG1-CG1 3.87Å; V104-I121 HydrophobicContact CG2-CG1 4.13Å; V104-L128 HydrophobicContact CG1-CD1 3.84Å; V104-L130 HydrophobicContact CB-CD2 4.33Å; V104-L130 HydrophobicContact CG1-CD2 4.15Å; V104-L130 HydrophobicContact CG2-CD2 3.96Å
105	N	91.8	Very high	89.5	Confident	56 Å²	56	46.1 Å²	46.1	30%	0.299	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.1	43.6	-179.1	-61	-36.8	0	0	0	113.5	V107 I129	N105-V107 VanDerWaalsContact C-N 3.28Å; N105-V107 PolarHBondContact O-N 2.9Å; N105-I129 PolarHBondContact N-O 3.03Å; N105-I129 PolarHBondContact OD1-N 2.84Å; N105-I129 PolarHBondContact OD1-O 2.86Å
106	H	89.9	Confident	88.9	Confident	129 Å²	129	49.4 Å²	49.4	60%	0.597	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.2	17.8	-176.8	-42.9	-66.5	0	0	0	115.8	V104	V104-H106 VanDerWaalsContact C-N 3.26Å; V104-H106 PolarHBondContact O-N 2.94Å
107	V	90.5	Very high	88.8	Confident	70 Å²	70	42.6 Å²	42.6	42%	0.424	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	118	165.3	-177	0	0	0	0	107.9	E103 V104 N105 L120	E103-V107 CarbonylContact C-O 3.57Å; E103-V107 WeakPolarHBondContact CA-O 3.33Å; V104-V107 PolarHBondContact N-O 3.01Å; V104-V107 WeakPolarHBondContact O-CB 3.4Å; V104-V107 PolarHBondContact O-N 2.92Å; N105-V107 VanDerWaalsContact C-N 3.28Å; N105-V107 PolarHBondContact O-N 2.9Å; V107-L120 HydrophobicContact CB-CD1 4.48Å; V107-L120 HydrophobicContact CG1-CD1 4.18Å
108	N	91.9	Very high	88.7	Confident	80 Å²	80	41.5 Å²	41.5	43%	0.428	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	140	171.5	176.7	-58.7	0	0	0	109.8	L102 E110	L102-N108 WeakPolarHBondContact O-CA 3.33Å; N108-E110 PolarHBondContact ND2-OE1 2.94Å; N108-E110 VanDerWaalsContact OD1-CB 3.25Å; N108-E110 WeakPolarHBondContact OD1-CB 3.42Å; N108-E110 WeakPolarHBondContact OD1-CG 3.37Å; N108-E110 PolarHBondContact OD1-N 3.12Å
109	V	91.9	Very high	88.6	Confident	3 Å²	3	44.8 Å²	44.8	2%	0.018	22%	0.223	C	C	.	.			trans	-124.3	27.6	-176.1	-66.1	0	0	0	0	113.6	I101 L102 V104 G111 A112 V117 L120	I101-V109 HydrophobicContact CG2-CG2 4.1Å; I101-V109 WeakPolarHBondContact O-CG2 3.26Å; L102-V109 WeakPolarHBondContact O-CG2 3.33Å; L102-V109 PolarHBondContact O-N 3.38Å; V104-V109 HydrophobicContact CB-CG1 4.44Å; V104-V109 HydrophobicContact CG2-CG1 4.06Å; V104-V109 HydrophobicContact CG2-CG2 4.37Å; V109-G111 PolarHBondContact O-N 3.4Å; V109-A112 HydrophobicContact CB-CB 4.02Å; V109-A112 VanDerWaalsContact O-CB 3.28Å; V109-A112 WeakPolarHBondContact O-CB 3.08Å; V109-A112 PolarHBondContact O-N 2.93Å; V109-A112 VanDerWaalsContact O-N 3.16Å; V109-V117 HydrophobicContact CB-CG2 3.75Å; V109-V117 HydrophobicContact CG1-CG2 3.98Å; V109-V117 HydrophobicContact CG2-CG2 4.18Å; V109-L120 HydrophobicContact CG1-CD1 3.67Å
110	E	91.3	Very high	88.4	Confident	69 Å²	69	47.4 Å²	47.4	32%	0.322	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	125.3	175.9	-80.1	-175.1	-101.5	0	0	112.7	Y75 A76 L78 L102 N108 A112	Y75-E110 WeakPolarHBondContact CA-OE2 3.48Å; A76-E110 HydrophobicContact CB-CB 3.96Å; A76-E110 PolarHBondContact N-OE2 3.38Å; L78-E110 HydrophobicContact CD2-CB 4.37Å; L78-E110 HydrophobicContact CD2-CG 3.58Å; L102-E110 HydrophobicContact CD1-CG 3.79Å; N108-E110 PolarHBondContact ND2-OE1 2.94Å; N108-E110 VanDerWaalsContact OD1-CB 3.25Å; N108-E110 WeakPolarHBondContact OD1-CB 3.42Å; N108-E110 WeakPolarHBondContact OD1-CG 3.37Å; N108-E110 PolarHBondContact OD1-N 3.12Å; E110-A112 PolarHBondContact O-N 2.84Å; E110-A112 VanDerWaalsContact O-N 3.16Å
111	G	81.6	Confident	88.3	Confident	4 Å²	4	46.4 Å²	46.4	4%	0.041	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.7	3.9	-175.4	0	0	0	0	0	114.2	E63 G64 P77 V109	E63-G111 CarbonylContact C-O 3.52Å; E63-G111 WeakPolarHBondContact CA-O 3.28Å; G64-G111 PolarHBondContact N-O 2.91Å; P77-G111 WeakPolarHBondContact O-CA 3.02Å; P77-G111 PolarHBondContact O-N 3.29Å; P77-G111 VanDerWaalsContact O-N 3.11Å; V109-G111 PolarHBondContact O-N 3.4Å
112	A	79.4	Confident	87.8	Confident	12 Å²	12	54.9 Å²	54.9	10%	0.099	27%	0.266	C	S	.	.			trans	-73.7	140.7	-178.2	0	0	0	0	0	112	Q79 V109 E110 Q116 V117	Q79-A112 PolarHBondContact NE2-O 2.71Å; V109-A112 HydrophobicContact CB-CB 4.02Å; V109-A112 VanDerWaalsContact O-CB 3.28Å; V109-A112 WeakPolarHBondContact O-CB 3.08Å; V109-A112 PolarHBondContact O-N 2.93Å; V109-A112 VanDerWaalsContact O-N 3.16Å; E110-A112 PolarHBondContact O-N 2.84Å; E110-A112 VanDerWaalsContact O-N 3.16Å; A112-Q116 HydrophobicContact CB-CB 4.33Å; A112-V117 HydrophobicContact CB-CG2 3.87Å
113	T	81	Confident	87.3	Confident	23 Å²	23	57.6 Å²	57.6	14%	0.141	29%	0.292	C	S	.	.			trans	-60	152	176.2	66.5	0	0	0	0	111.4	V61 E63 K115 Q116 V117	V61-T113 WeakPolarHBondContact O-CG2 3.24Å; E63-T113 HydrophobicContact CB-CG2 3.95Å; T113-K115 PolarHBondContact O-N 3.2Å; T113-Q116 VanDerWaalsContact CB-OE1 3.26Å; T113-Q116 VanDerWaalsContact CG2-OE1 3.29Å; T113-Q116 PolarHBondContact O-N 2.95Å; T113-Q116 VanDerWaalsContact O-N 3.09Å; T113-Q116 WeakPolarHBondContact OG1-CG 3.29Å; T113-Q116 PolarHBondContact OG1-N 3.06Å; T113-Q116 VanDerWaalsContact OG1-N 3.17Å; T113-Q116 PolarHBondContact OG1-OE1 2.82Å; T113-V117 PolarHBondContact O-N 2.57Å
114	H	79.4	Confident	86.2	Confident	69 Å²	69	55.3 Å²	55.3	32%	0.319	28%	0.282	S	S	.	.	H	α-helix	trans	-49.4	-36.1	171.7	-176.2	69.5	0	0	0	112.8	V57 Q60 Q79 V118	V57-H114 PolarHBondContact O-CE1 2.82Å; Q60-H114 WeakPolarHBondContact O-CB 3.26Å; Q60-H114 PolarHBondContact O-N 2.82Å; Q79-H114 PolarHBondContact OE1-ND1 3.29Å; Q79-H114 VanDerWaalsContact OE1-ND1 3.14Å; H114-V118 WeakPolarHBondContact O-CB 3.38Å; H114-V118 VanDerWaalsContact O-CG2 3.26Å; H114-V118 WeakPolarHBondContact O-CG2 3.45Å; H114-V118 PolarHBondContact O-N 2.82Å
115	K	78.8	Confident	85.3	Confident	148 Å²	148	62.7 Å²	62.7	64%	0.643	32%	0.316	S	S	*	.	H	α-helix	trans	-65.8	-52.7	177.3	-174.6	-173.3	171.9	-165.7	0	112.1	T113 V117 V118 D119	T113-K115 PolarHBondContact O-N 3.2Å; K115-V117 VanDerWaalsContact C-N 3.28Å; K115-V117 PolarHBondContact O-N 2.85Å; K115-V118 PolarHBondContact O-N 3Å; K115-D119 VanDerWaalsContact CE-OD2 3.22Å; K115-D119 WeakPolarHBondContact CE-OD2 3.45Å; K115-D119 WeakPolarHBondContact CG-OD2 3.37Å; K115-D119 WeakPolarHBondContact O-CB 3.3Å; K115-D119 PolarHBondContact O-N 3.41Å
116	Q	81.3	Confident	85	Confident	72 Å²	72	67.7 Å²	67.7	34%	0.336	34%	0.336	S	S	.	.	H	α-helix	trans	-55.3	-45.1	-179.8	-76.4	153	-51.7	0	0	111.3	E63 A112 T113 D119 L120	E63-Q116 PolarHBondContact OE1-NE2 3.38Å; A112-Q116 HydrophobicContact CB-CB 4.33Å; T113-Q116 VanDerWaalsContact CB-OE1 3.26Å; T113-Q116 VanDerWaalsContact CG2-OE1 3.29Å; T113-Q116 PolarHBondContact O-N 2.95Å; T113-Q116 VanDerWaalsContact O-N 3.09Å; T113-Q116 WeakPolarHBondContact OG1-CG 3.29Å; T113-Q116 PolarHBondContact OG1-N 3.06Å; T113-Q116 VanDerWaalsContact OG1-N 3.17Å; T113-Q116 PolarHBondContact OG1-OE1 2.82Å; Q116-D119 PolarHBondContact O-N 3.49Å; Q116-L120 WeakPolarHBondContact O-CG 3.3Å; Q116-L120 PolarHBondContact O-N 3.24Å
117	V	88.7	Confident	85.1	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-67.7	-41.1	179.8	-177	0	0	0	0	112.2	Q79 V104 V109 A112 T113 K115 L120 I121	Q79-V117 HydrophobicContact CB-CG1 4.26Å; Q79-V117 HydrophobicContact CG-CB 3.84Å; Q79-V117 HydrophobicContact CG-CG1 4.01Å; Q79-V117 HydrophobicContact CG-CG2 3.57Å; V104-V117 HydrophobicContact CG2-CG1 4.01Å; V109-V117 HydrophobicContact CB-CG2 3.75Å; V109-V117 HydrophobicContact CG1-CG2 3.98Å; V109-V117 HydrophobicContact CG2-CG2 4.18Å; A112-V117 HydrophobicContact CB-CG2 3.87Å; T113-V117 PolarHBondContact O-N 2.57Å; K115-V117 VanDerWaalsContact C-N 3.28Å; K115-V117 PolarHBondContact O-N 2.85Å; V117-L120 PolarHBondContact O-N 2.98Å; V117-I121 HydrophobicContact CG1-CD1 3.99Å; V117-I121 WeakPolarHBondContact O-CB 3.46Å; V117-I121 VanDerWaalsContact O-CG1 3.27Å; V117-I121 WeakPolarHBondContact O-CG1 3.29Å; V117-I121 PolarHBondContact O-N 3.36Å
118	V	88	Confident	85.3	Confident	28 Å²	28	61.3 Å²	61.3	17%	0.17	30%	0.301	C	S	.	.	H	α-helix	trans	-66.6	-38	176	166.2	0	0	0	0	112	H114 K115 I121 R122	H114-V118 WeakPolarHBondContact O-CB 3.38Å; H114-V118 VanDerWaalsContact O-CG2 3.26Å; H114-V118 WeakPolarHBondContact O-CG2 3.45Å; H114-V118 PolarHBondContact O-N 2.82Å; K115-V118 PolarHBondContact O-N 3Å; V118-I121 PolarHBondContact O-N 3.06Å; V118-R122 HydrophobicContact CG1-CG 4.47Å; V118-R122 WeakPolarHBondContact O-CB 3.35Å; V118-R122 WeakPolarHBondContact O-CD 3.31Å; V118-R122 VanDerWaalsContact O-CG 3.23Å; V118-R122 WeakPolarHBondContact O-CG 3.48Å; V118-R122 PolarHBondContact O-N 3.45Å
119	D	86.6	Confident	85.4	Confident	69 Å²	69	59.2 Å²	59.2	37%	0.369	29%	0.29	S	S	.	.	H	α-helix	trans	-70.4	-38	178.2	-70.7	-20.9	0	0	0	111.3	K115 Q116 R122 A123	K115-D119 VanDerWaalsContact CE-OD2 3.22Å; K115-D119 WeakPolarHBondContact CE-OD2 3.45Å; K115-D119 WeakPolarHBondContact CG-OD2 3.37Å; K115-D119 WeakPolarHBondContact O-CB 3.3Å; K115-D119 PolarHBondContact O-N 3.41Å; Q116-D119 PolarHBondContact O-N 3.49Å; D119-R122 PolarHBondContact O-N 2.74Å; D119-R122 IonicContact OD1-NH1 3.36Å; D119-A123 PolarHBondContact O-N 3.06Å
120	L	90.5	Very high	85.6	Confident	56 Å²	56	59.1 Å²	59.1	29%	0.293	29%	0.289	S	S	.	.	H	α-helix	trans	-62.3	-42.3	169.7	-73.5	169.1	0	0	0	112.7	V104 V107 V109 Q116 V117 R122 A123	V104-L120 HydrophobicContact CB-CB 4.09Å; V104-L120 HydrophobicContact CG1-CB 3.79Å; V107-L120 HydrophobicContact CB-CD1 4.48Å; V107-L120 HydrophobicContact CG1-CD1 4.18Å; V109-L120 HydrophobicContact CG1-CD1 3.67Å; Q116-L120 WeakPolarHBondContact O-CG 3.3Å; Q116-L120 PolarHBondContact O-N 3.24Å; V117-L120 PolarHBondContact O-N 2.98Å; L120-R122 VanDerWaalsContact C-N 3.29Å; L120-R122 PolarHBondContact O-N 3.15Å; L120-A123 PolarHBondContact O-N 2.78Å
121	I	91.1	Very high	85.9	Confident	18 Å²	18	56.3 Å²	56.3	9%	0.092	28%	0.277	C	S	.	.	H	α-helix	trans	-63.3	-36.6	175.4	-75	169	0	0	0	111.1	F55 V57 I101 V104 V117 V118 G124 L128 L130	F55-I121 HydrophobicContact CE2-CD1 4.44Å; F55-I121 HydrophobicContact CZ-CD1 4.2Å; V57-I121 HydrophobicContact CG2-CD1 3.97Å; I101-I121 HydrophobicContact CD1-CD1 4.37Å; V104-I121 HydrophobicContact CG1-CG1 3.87Å; V104-I121 HydrophobicContact CG2-CG1 4.13Å; V117-I121 HydrophobicContact CG1-CD1 3.99Å; V117-I121 WeakPolarHBondContact O-CB 3.46Å; V117-I121 VanDerWaalsContact O-CG1 3.27Å; V117-I121 WeakPolarHBondContact O-CG1 3.29Å; V117-I121 PolarHBondContact O-N 3.36Å; V118-I121 PolarHBondContact O-N 3.06Å; I121-G124 PolarHBondContact O-N 3.14Å; I121-L128 HydrophobicContact CG1-CD1 4.29Å; I121-L128 HydrophobicContact CG1-CD2 4.36Å; I121-L128 HydrophobicContact CG2-CD2 3.92Å; I121-L130 HydrophobicContact CG1-CD2 4.46Å
122	R	83.9	Confident	86.5	Confident	177 Å²	177	56.1 Å²	56.1	67%	0.668	28%	0.275	S	S	*	.	H	α-helix	trans	-74.3	-27.7	178.3	-76.1	167.9	172.5	177.6	-3.3	113.8	V118 D119 L120 G124	V118-R122 HydrophobicContact CG1-CG 4.47Å; V118-R122 WeakPolarHBondContact O-CB 3.35Å; V118-R122 WeakPolarHBondContact O-CD 3.31Å; V118-R122 VanDerWaalsContact O-CG 3.23Å; V118-R122 WeakPolarHBondContact O-CG 3.48Å; V118-R122 PolarHBondContact O-N 3.45Å; D119-R122 PolarHBondContact O-N 2.74Å; D119-R122 IonicContact OD1-NH1 3.36Å; L120-R122 VanDerWaalsContact C-N 3.29Å; L120-R122 PolarHBondContact O-N 3.15Å; R122-G124 PolarHBondContact O-N 2.77Å
123	A	84.4	Confident	87.1	Confident	74 Å²	74	55.6 Å²	55.6	61%	0.612	27%	0.27	S	S	*	.	H	α-helix	trans	-64.3	-17.7	170.9	0	0	0	0	0	112.6	D119 L120 E125	D119-A123 PolarHBondContact O-N 3.06Å; L120-A123 PolarHBondContact O-N 2.78Å; A123-E125 PolarHBondContact O-N 3.46Å; A123-E125 VanDerWaalsContact O-N 3.16Å
124	G	73.2	Confident	87.5	Confident	5 Å²	5	55.3 Å²	55.3	5%	0.052	27%	0.27	C	S	.	.			trans	-64.1	106.3	164.6	0	0	0	0	0	112	K48 Y53 I121 R122	K48-G124 PolarHBondContact NZ-O 3.27Å; Y53-G124 WeakPolarHBondContact OH-CA 3.43Å; Y53-G124 PolarHBondContact OH-O 2.77Å; I121-G124 PolarHBondContact O-N 3.14Å; R122-G124 PolarHBondContact O-N 2.77Å
125	E	76.1	Confident	87.6	Confident	154 Å²	154	52.8 Å²	52.8	72%	0.72	26%	0.259	S	S	*	.	S	Bend	trans	-71.6	-59.7	178.3	-74	-161.8	163.3	0	0	112.8	K48 A123	K48-E125 WeakPolarHBondContact CD-O 3.34Å; K48-E125 WeakPolarHBondContact CE-O 3.43Å; K48-E125 PolarHBondContact NZ-O 2.93Å; A123-E125 PolarHBondContact O-N 3.46Å; A123-E125 VanDerWaalsContact O-N 3.16Å
126	K	85.6	Confident	87.5	Confident	161 Å²	161	47.9 Å²	47.9	70%	0.7	24%	0.242	S	C	*	.	S	Bend	trans	-121.1	-22.2	-172.5	-61.4	-179.5	-171.7	175.9	0	113.3	K48	K48-K126 WeakPolarHBondContact CB-O 3.44Å; K48-K126 PolarHBondContact N-O 3.36Å
127	E	91.1	Very high	86.9	Confident	65 Å²	65	49.1 Å²	49.1	30%	0.304	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	153.1	-174.4	-170.8	172.9	138.3	0	0	108.6	R45 I46 Y53	R45-E127 HydrophobicContact CG-CG 4.29Å; R45-E127 IonicContact CZ-OE1 3.49Å; R45-E127 IonicContact CZ-OE2 3.86Å; R45-E127 IonicContact NE-OE1 3.74Å; R45-E127 PolarHBondContact NE-OE1 3.35Å; R45-E127 IonicContact NE-OE2 3.76Å; R45-E127 PolarHBondContact NE-OE2 3.01Å; R45-E127 IonicContact NH2-OE1 2.76Å; R45-E127 PolarHBondContact NH2-OE1 2.9Å; R45-E127 IonicContact NH2-OE2 3.62Å; R45-E127 PolarHBondContact NH2-OE2 3.39Å; I46-E127 CarbonylContact O-C 3.59Å; I46-E127 WeakPolarHBondContact O-CA 3.47Å; Y53-E127 PolarHBondContact OH-O 3.43Å
128	L	94.8	Very high	85.8	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	123.8	177.1	177.1	66.1	0	0	0	108.2	I46 Y53 F55 V104 I121 L130	I46-L128 HydrophobicContact CB-CB 4.44Å; I46-L128 HydrophobicContact CD1-CD2 4.32Å; I46-L128 PolarHBondContact N-O 2.89Å; I46-L128 PolarHBondContact O-N 3.25Å; Y53-L128 HydrophobicContact CD1-CB 4.01Å; Y53-L128 HydrophobicContact CD1-CD2 4.18Å; Y53-L128 HydrophobicContact CD2-CD2 4.03Å; Y53-L128 HydrophobicContact CE1-CB 3.42Å; Y53-L128 VanDerWaalsContact CE1-CB 3.42Å; Y53-L128 HydrophobicContact CE1-CD2 4.28Å; Y53-L128 HydrophobicContact CE2-CB 4.28Å; Y53-L128 HydrophobicContact CE2-CD2 4.14Å; Y53-L128 HydrophobicContact CG-CD2 4.06Å; F55-L128 HydrophobicContact CE1-CD2 3.91Å; F55-L128 HydrophobicContact CZ-CD2 3.96Å; V104-L128 HydrophobicContact CG1-CD1 3.84Å; I121-L128 HydrophobicContact CG1-CD1 4.29Å; I121-L128 HydrophobicContact CG1-CD2 4.36Å; I121-L128 HydrophobicContact CG2-CD2 3.92Å; L128-L130 HydrophobicContact CD1-CD2 3.94Å; L128-L130 HydrophobicContact CD2-CD1 4.42Å; L128-L130 HydrophobicContact CD2-CD2 4.11Å; L128-L130 HydrophobicContact CD2-CG 4.29Å; L128-L130 HydrophobicContact CG-CD2 3.88Å; L128-L130 HydrophobicContact CG-CG 4.09Å
129	I	95	Very high	84.7	Confident	37 Å²	37	56.3 Å²	56.3	19%	0.19	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	124.5	173.7	-59.1	175.8	0	0	0	106.8	V43 N105	V43-I129 HydrophobicContact CG1-CG2 3.54Å; N105-I129 PolarHBondContact N-O 3.03Å; N105-I129 PolarHBondContact OD1-N 2.84Å; N105-I129 PolarHBondContact OD1-O 2.86Å
130	L	96.8	Very high	83.9	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	137.7	172.8	-54.8	177.2	0	0	0	109.5	V43 V44 I46 F55 I101 E103 V104 I121 L128 V132	V43-L130 CarbonylContact C-O 3.48Å; V43-L130 WeakPolarHBondContact CA-O 3.33Å; V44-L130 HydrophobicContact CG2-CB 3.85Å; V44-L130 PolarHBondContact N-O 3.09Å; V44-L130 PolarHBondContact O-N 2.72Å; I46-L130 HydrophobicContact CD1-CD1 3.9Å; I46-L130 HydrophobicContact CD1-CG 4.44Å; F55-L130 HydrophobicContact CE1-CD1 4.45Å; F55-L130 HydrophobicContact CE2-CD1 4.18Å; F55-L130 HydrophobicContact CZ-CD1 3.78Å; I101-L130 HydrophobicContact CG2-CD2 4.26Å; E103-L130 WeakPolarHBondContact O-CA 3.44Å; V104-L130 HydrophobicContact CB-CD2 4.33Å; V104-L130 HydrophobicContact CG1-CD2 4.15Å; V104-L130 HydrophobicContact CG2-CD2 3.96Å; I121-L130 HydrophobicContact CG1-CD2 4.46Å; L128-L130 HydrophobicContact CD1-CD2 3.94Å; L128-L130 HydrophobicContact CD2-CD1 4.42Å; L128-L130 HydrophobicContact CD2-CD2 4.11Å; L128-L130 HydrophobicContact CD2-CG 4.29Å; L128-L130 HydrophobicContact CG-CD2 3.88Å; L128-L130 HydrophobicContact CG-CG 4.09Å; L130-V132 HydrophobicContact CB-CG1 4.03Å
131	T	96.2	Very high	82.4	Confident	11 Å²	11	55.9 Å²	55.9	7%	0.067	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	121.7	163.2	-59.6	0	0	0	0	107.2	P41 L102 E103	P41-T131 HydrophobicContact CB-CG2 3.78Å; L102-T131 HydrophobicContact CB-CG2 4.44Å; L102-T131 HydrophobicContact CD2-CG2 4.25Å; L102-T131 PolarHBondContact N-O 3.14Å; E103-T131 HydrophobicContact CG-CG2 4.4Å; E103-T131 PolarHBondContact N-O 3.22Å; E103-T131 PolarHBondContact O-N 2.95Å; E103-T131 VanDerWaalsContact O-N 3.08Å; E103-T131 VanDerWaalsContact OE2-CB 3.26Å; E103-T131 WeakPolarHBondContact OE2-CB 3.33Å; E103-T131 PolarHBondContact OE2-OG1 3.15Å
132	V	95.6	Very high	80.9	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	135.8	-170	-74.2	0	0	0	0	113.1	R42 V44 D99 R100 I101 L130	R42-V132 HydrophobicContact CG-CG2 3.93Å; R42-V132 PolarHBondContact N-O 2.69Å; R42-V132 WeakPolarHBondContact O-CG2 3.47Å; R42-V132 PolarHBondContact O-N 3.23Å; V44-V132 HydrophobicContact CG1-CG2 4.07Å; V44-V132 HydrophobicContact CG2-CG2 3.87Å; D99-V132 HydrophobicContact CB-CB 4.14Å; D99-V132 HydrophobicContact CB-CG1 4.26Å; R100-V132 CarbonylContact O-C 3.59Å; R100-V132 WeakPolarHBondContact O-CA 3.43Å; I101-V132 HydrophobicContact CG1-CG1 4.25Å; L130-V132 HydrophobicContact CB-CG1 4.03Å
133	L	91.9	Very high	79.7	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	123.8	167.7	-66.4	161.5	0	0	0	108.4	P41 I70 Y75 L78 D99 R100	P41-L133 HydrophobicContact CB-CD2 4.28Å; P41-L133 HydrophobicContact CG-CD2 3.82Å; I70-L133 HydrophobicContact CB-CD1 4.25Å; I70-L133 HydrophobicContact CD1-CD1 4.05Å; I70-L133 HydrophobicContact CG2-CB 4.09Å; I70-L133 HydrophobicContact CG2-CD1 3.93Å; Y75-L133 HydrophobicContact CD1-CD1 4.24Å; Y75-L133 HydrophobicContact CD2-CD1 3.88Å; Y75-L133 HydrophobicContact CE1-CD1 3.95Å; Y75-L133 HydrophobicContact CE2-CD1 3.58Å; Y75-L133 HydrophobicContact CE2-CD2 4.4Å; Y75-L133 HydrophobicContact CG-CD1 4.2Å; L78-L133 HydrophobicContact CD1-CD1 3.89Å; D99-L133 CarbonylContact C-O 3.45Å; D99-L133 WeakPolarHBondContact CA-O 3.4Å; R100-L133 HydrophobicContact CB-CB 4.27Å; R100-L133 PolarHBondContact N-O 3.23Å; R100-L133 PolarHBondContact O-N 2.85Å
134	S	89.4	Confident	77.9	Confident	18 Å²	18	55.8 Å²	55.8	13%	0.126	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-83.9	135.3	168.4	-94.8	0	0	0	0	110.7	R42 N71 R96 D99	R42-S134 PolarHBondContact NH1-OG 2.92Å; N71-S134 PolarHBondContact ND2-O 2.89Å; R96-S134 VanDerWaalsContact CZ-OG 3.32Å; R96-S134 PolarHBondContact NE-OG 3.47Å; R96-S134 VanDerWaalsContact NE-OG 3.1Å; R96-S134 VanDerWaalsContact NH2-CB 3.35Å; R96-S134 PolarHBondContact NH2-OG 2.88Å; D99-S134 VanDerWaalsContact OD1-CA 3.29Å; D99-S134 WeakPolarHBondContact OD1-CA 3.37Å; D99-S134 WeakPolarHBondContact OD1-CB 3.3Å; D99-S134 PolarHBondContact OD1-OG 3.2Å
135	V	80.3	Confident	76.3	Confident	16 Å²	16	60.2 Å²	60.2	10%	0.097	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-93.4	160.9	168	-60.9	0	0	0	0	110.8	I70 G98 R100 E139 A140	I70-V135 HydrophobicContact CG2-CG1 4.4Å; G98-V135 WeakPolarHBondContact O-CG2 3.33Å; R100-V135 HydrophobicContact CG-CG1 3.97Å; V135-E139 HydrophobicContact CB-CB 3.73Å; V135-E139 HydrophobicContact CB-CG 4.39Å; V135-E139 WeakPolarHBondContact CG1-OE2 3.38Å; V135-E139 HydrophobicContact CG2-CB 3.58Å; V135-A140 HydrophobicContact CG2-CB 4.43Å
136	P	77.2	Confident	74.4	Confident	44 Å²	44	57.6 Å²	57.6	29%	0.286	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-56	152.4	171.5	-25.8	36.1	0	0	0	112.6	H138 E139 A140	P136-H138 VanDerWaalsContact CB-CE1 3.4Å; P136-H138 WeakPolarHBondContact CB-CE1 3.2Å; P136-H138 PolarHBondContact O-N 3.45Å; P136-H138 VanDerWaalsContact O-N 3.12Å; P136-E139 WeakPolarHBondContact CD-OE1 3.49Å; P136-E139 WeakPolarHBondContact O-CB 3.35Å; P136-E139 PolarHBondContact O-N 3.17Å; P136-A140 PolarHBondContact O-N 3.17Å
137	P	69.5	Low	72.3	Confident	98 Å²	98	57.3 Å²	57.3	64%	0.636	32%	0.322	S	S	*	.	H	α-helix	trans	-53.8	-37.1	-177.9	-29.3	36.2	0	0	0	114.5	E139 A140 D141	P137-E139 VanDerWaalsContact C-N 3.27Å; P137-E139 PolarHBondContact O-N 2.96Å; P137-A140 WeakPolarHBondContact O-CA 2.96Å; P137-A140 WeakPolarHBondContact O-CB 3.5Å; P137-A140 PolarHBondContact O-N 2.78Å; P137-D141 PolarHBondContact O-N 3.34Å
138	H	64.8	Low	69.6	Low	109 Å²	109	62 Å²	62	51%	0.505	35%	0.349	S	S	.	.	H	α-helix	trans	-65	-26.5	177.8	60.5	-104.9	0	0	0	113.7	P136 N142	P136-H138 VanDerWaalsContact CB-CE1 3.4Å; P136-H138 WeakPolarHBondContact CB-CE1 3.2Å; P136-H138 PolarHBondContact O-N 3.45Å; P136-H138 VanDerWaalsContact O-N 3.12Å; H138-N142 VanDerWaalsContact O-CG 3.22Å; H138-N142 PolarHBondContact O-ND2 2.89Å
139	E	65.8	Low	66.7	Low	70 Å²	70	67 Å²	67	33%	0.327	38%	0.384	S	S	.	.	H	α-helix	trans	-79.5	-22.9	170.1	-82.5	-168.1	-116.1	0	0	113.2	R100 V135 P136 P137	R100-E139 IonicContact CZ-OE2 3.32Å; R100-E139 IonicContact NH2-OE2 2.77Å; R100-E139 PolarHBondContact NH2-OE2 2.58Å; V135-E139 HydrophobicContact CB-CB 3.73Å; V135-E139 HydrophobicContact CB-CG 4.39Å; V135-E139 WeakPolarHBondContact CG1-OE2 3.38Å; V135-E139 HydrophobicContact CG2-CB 3.58Å; P136-E139 WeakPolarHBondContact CD-OE1 3.49Å; P136-E139 WeakPolarHBondContact O-CB 3.35Å; P136-E139 PolarHBondContact O-N 3.17Å; P137-E139 VanDerWaalsContact C-N 3.27Å; P137-E139 PolarHBondContact O-N 2.96Å
140	A	67.9	Low	64	Low	9 Å²	9	73.5 Å²	73.5	7%	0.074	42%	0.418	C	S	.	.	H	α-helix	trans	-81.4	-36.7	177.3	0	0	0	0	0	112.1	K97 V135 P136 P137	K97-A140 WeakPolarHBondContact CD-O 3.48Å; K97-A140 WeakPolarHBondContact CE-O 3.45Å; K97-A140 PolarHBondContact NZ-O 2.72Å; K97-A140 WeakPolarHBondContact O-CB 3.41Å; V135-A140 HydrophobicContact CG2-CB 4.43Å; P136-A140 PolarHBondContact O-N 3.17Å; P137-A140 WeakPolarHBondContact O-CA 2.96Å; P137-A140 WeakPolarHBondContact O-CB 3.5Å; P137-A140 PolarHBondContact O-N 2.78Å
141	D	60.4	Low	61.3	Low	107 Å²	107	77 Å²	77	57%	0.572	46%	0.455	S	S	*	.	H	α-helix	trans	-72.2	-36.8	-179	-67.4	-32	0	0	0	111.9	P137 L143	P137-D141 PolarHBondContact O-N 3.34Å; D141-L143 PolarHBondContact O-N 3.13Å
142	N	58.9	Low	58.6	Low	126 Å²	126	83.4 Å²	83.4	67%	0.674	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	17.6	176.3	-75.2	-17.4	0	0	0	115.6	H138	H138-N142 VanDerWaalsContact O-CG 3.22Å; H138-N142 PolarHBondContact O-ND2 2.89Å
143	L	59.3	Low	56.3	Low	35 Å²	35	86.1 Å²	86.1	18%	0.183	50%	0.503	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	-4.9	-178.2	-59.5	173.9	0	0	0	114.2	D141	D141-L143 PolarHBondContact O-N 3.13Å
144	D	45.5	Very low	54.6	Low	107 Å²	107	94 Å²	94	57%	0.572	54%	0.538	S	S	*	.	S	Bend	trans	-88.1	125.4	172.2	-69	-22.8	0	0	0	110.3	K97 S146	K97-D144 IonicContact NZ-OD1 3.15Å; K97-D144 PolarHBondContact NZ-OD1 3.18Å; K97-D144 IonicContact NZ-OD2 2.74Å; K97-D144 PolarHBondContact NZ-OD2 2.82Å; D144-S146 PolarHBondContact O-N 3.27Å; D144-S146 VanDerWaalsContact O-N 3.12Å
145	P	40.7	Very low	53.5	Low	97 Å²	97	95.3 Å²	95.3	63%	0.63	54%	0.54	S	S	*	.			trans	-80.1	95.5	178.2	31.9	-32.8	0	0	0	110.4
146	S	35.7	Very low	53.3	Low	99 Å²	99	98.8 Å²	98.8	69%	0.692	56%	0.558	S	S	*	*			trans	-74.3	121.2	151.1	55.4	0	0	0	0	108.4	D144	D144-S146 PolarHBondContact O-N 3.27Å; D144-S146 VanDerWaalsContact O-N 3.12Å
147	D	41.1	Very low	53.6	Low	155 Å²	155	98.7 Å²	98.7	83%	0.829	55%	0.552	S	S	*	*	S	Bend	trans	-55.3	163.1	173.1	-91.8	-44.6	0	0	0	112.5
148	D	36	Very low	53.9	Low	164 Å²	164	99.1 Å²	99.1	88%	0.877	55%	0.553	S	S	*	*	S	Bend	trans	64.6	38.1	175.4	-65.7	-28.3	0	0	0	117
149	S	32.8	Very low	54.3	Low	104 Å²	104	98.7 Å²	98.7	73%	0.727	55%	0.552	S	S	*	*			trans	-139.8	112.2	157.3	-78.1	0	0	0	0	112.8	G151	S149-G151 PolarHBondContact O-N 3.43Å
150	L	37.8	Very low	55	Low	174 Å²	174	103.1 Å²	103.1	91%	0.911	57%	0.57	S	S	*	*			trans	-59.3	132.6	175.7	-68.4	166.1	0	0	0	110	Q152	L150-Q152 PolarHBondContact O-N 2.85Å
151	G	40.7	Very low	55.3	Low	74 Å²	74	105.3 Å²	105.3	76%	0.763	58%	0.578	S	S	*	*			trans	-55.4	108.3	-161.5	0	0	0	0	0	114.8	S149 S153	S149-G151 PolarHBondContact O-N 3.43Å; G151-S153 PolarHBondContact O-N 2.85Å; G151-S153 VanDerWaalsContact O-N 3.14Å
152	Q	40.3	Very low	55.9	Low	146 Å²	146	105.2 Å²	105.2	68%	0.682	59%	0.592	S	S	*	*			trans	-79.3	91.4	166.9	-71.4	-170.8	0.3	0	0	109.7	L150 F154	L150-Q152 PolarHBondContact O-N 2.85Å; Q152-F154 PolarHBondContact O-N 2.85Å
153	S	47.4	Very low	56.6	Low	57 Å²	57	100.2 Å²	100.2	40%	0.399	57%	0.566	S	S	.	*			trans	-52.2	119.7	162.5	-66	0	0	0	0	109.8	G151 Y155	G151-S153 PolarHBondContact O-N 2.85Å; G151-S153 VanDerWaalsContact O-N 3.14Å; S153-Y155 VanDerWaalsContact CB-OH 3.23Å; S153-Y155 WeakPolarHBondContact CB-OH 3.45Å; S153-Y155 WeakPolarHBondContact O-CD2 3.35Å; S153-Y155 WeakPolarHBondContact O-CE2 3.24Å; S153-Y155 PolarHBondContact O-N 2.79Å; S153-Y155 VanDerWaalsContact O-N 3.14Å; S153-Y155 PolarHBondContact OG-OH 3.3Å
154	F	54.5	Low	57.7	Low	166 Å²	166	102.4 Å²	102.4	73%	0.728	58%	0.583	S	S	*	*			trans	-86	85.3	-179.1	-165.2	-89.2	0	0	0	110.2	Q152	Q152-F154 PolarHBondContact O-N 2.85Å
155	Y	68	Low	59.8	Low	45 Å²	45	98 Å²	98	18%	0.176	56%	0.559	C	S	.	*			trans	-80.7	144.3	177.7	-49.8	-86.3	0	0	0	112.2	S153 Y157 E210 F211 V251	S153-Y155 VanDerWaalsContact CB-OH 3.23Å; S153-Y155 WeakPolarHBondContact CB-OH 3.45Å; S153-Y155 WeakPolarHBondContact O-CD2 3.35Å; S153-Y155 WeakPolarHBondContact O-CE2 3.24Å; S153-Y155 PolarHBondContact O-N 2.79Å; S153-Y155 VanDerWaalsContact O-N 3.14Å; S153-Y155 PolarHBondContact OG-OH 3.3Å; Y155-Y157 WeakPolarHBondContact CD2-OH 3.5Å; Y155-Y157 HydrophobicContact CG-CE1 4.48Å; Y155-E210 WeakPolarHBondContact OH-CG 3.38Å; Y155-E210 PolarHBondContact OH-OE1 3.27Å; Y155-F211 HydrophobicContact CD1-CD1 4.3Å; Y155-F211 AromaticContact CD1-CE1 3.76Å; Y155-F211 HydrophobicContact CD1-CE1 3.76Å; Y155-F211 AromaticContact CD2-CD1 3.36Å; Y155-F211 HydrophobicContact CD2-CD1 3.36Å; Y155-F211 AromaticContact CD2-CE1 3.68Å; Y155-F211 HydrophobicContact CD2-CE1 3.68Å; Y155-F211 HydrophobicContact CD2-CG 4.47Å; Y155-F211 HydrophobicContact CE1-CD1 4.38Å; Y155-F211 AromaticContact CE1-CE1 3.71Å; Y155-F211 HydrophobicContact CE1-CE1 3.71Å; Y155-F211 HydrophobicContact CE1-CZ 4.48Å; Y155-F211 AromaticContact CE2-CD1 3.45Å; Y155-F211 HydrophobicContact CE2-CD1 3.45Å; Y155-F211 VanDerWaalsContact CE2-CD1 3.45Å; Y155-F211 AromaticContact CE2-CE1 3.61Å; Y155-F211 HydrophobicContact CE2-CE1 3.61Å; Y155-F211 HydrophobicContact CE2-CG 4.36Å; Y155-F211 AromaticContact CG-CD1 3.8Å; Y155-F211 HydrophobicContact CG-CD1 3.8Å; Y155-F211 AromaticContact CG-CE1 3.74Å; Y155-F211 HydrophobicContact CG-CE1 3.74Å; Y155-F211 AromaticContact CZ-CD1 3.99Å; Y155-F211 AromaticContact CZ-CE1 3.64Å; Y155-V251 HydrophobicContact CD1-CG2 3.6Å; Y155-V251 HydrophobicContact CE1-CG2 4.48Å; Y155-V251 HydrophobicContact CG-CG2 4.2Å
156	D	74.8	Confident	62.2	Low	89 Å²	89	95 Å²	95	48%	0.476	54%	0.541	S	S	.	.			trans	-82.4	120.8	168.5	-169	-14	0	0	0	110.7	T158 V251	D156-T158 VanDerWaalsContact CG-OG1 3.32Å; D156-T158 VanDerWaalsContact OD1-CB 3.27Å; D156-T158 WeakPolarHBondContact OD1-CB 3.41Å; D156-T158 WeakPolarHBondContact OD1-CG2 3.21Å; D156-T158 PolarHBondContact OD1-N 2.89Å; D156-T158 PolarHBondContact OD1-OG1 2.89Å; D156-T158 PolarHBondContact OD2-OG1 3.16Å; D156-V251 VanDerWaalsContact O-CG1 3.25Å; D156-V251 WeakPolarHBondContact O-CG1 3.35Å
157	Y	83.4	Confident	65.1	Low	41 Å²	41	90.3 Å²	90.3	16%	0.161	51%	0.508	C	S	.	.			trans	-102.4	7.1	178.5	-54.3	-59.1	0	0	0	113.6	Y155 F211 N213 F214 I249 V251 I252	Y155-Y157 WeakPolarHBondContact CD2-OH 3.5Å; Y155-Y157 HydrophobicContact CG-CE1 4.48Å; Y157-F211 HydrophobicContact CE1-CB 4.39Å; Y157-F211 AromaticContact CE1-CD1 3.8Å; Y157-F211 HydrophobicContact CE1-CD1 3.8Å; Y157-F211 HydrophobicContact CE1-CG 4.45Å; Y157-F211 WeakPolarHBondContact OH-CB 3.43Å; Y157-N213 WeakPolarHBondContact CE2-OD1 3.48Å; Y157-N213 PolarHBondContact OH-OD1 2.96Å; Y157-F214 AromaticContact CD1-CD2 3.71Å; Y157-F214 HydrophobicContact CD1-CD2 3.71Å; Y157-F214 HydrophobicContact CD1-CE2 4.33Å; Y157-F214 HydrophobicContact CD1-CG 4.36Å; Y157-F214 HydrophobicContact CD2-CB 4.48Å; Y157-F214 AromaticContact CD2-CD2 3.88Å; Y157-F214 HydrophobicContact CD2-CD2 3.88Å; Y157-F214 HydrophobicContact CE1-CB 4.01Å; Y157-F214 HydrophobicContact CE1-CD2 4.04Å; Y157-F214 HydrophobicContact CE1-CG 4.26Å; Y157-F214 HydrophobicContact CE2-CB 3.96Å; Y157-F214 HydrophobicContact CE2-CD2 4.21Å; Y157-F214 AromaticContact CG-CD2 3.61Å; Y157-F214 HydrophobicContact CG-CD2 3.61Å; Y157-F214 HydrophobicContact CG-CE2 4.21Å; Y157-I249 HydrophobicContact CD1-CG2 3.88Å; Y157-I249 HydrophobicContact CG-CG2 4.45Å; Y157-V251 HydrophobicContact CD1-CG1 3.75Å; Y157-V251 HydrophobicContact CE1-CG1 3.94Å; Y157-I252 HydrophobicContact CD1-CD1 3.98Å; Y157-I252 HydrophobicContact CD1-CG1 4.2Å; Y157-I252 HydrophobicContact CE1-CD1 3.88Å; Y157-I252 HydrophobicContact CE1-CG1 4.03Å
158	T	76.6	Confident	67.5	Low	108 Å²	108	85.7 Å²	85.7	66%	0.663	49%	0.486	S	S	*	.			trans	-82	-29.9	178.8	68.9	0	0	0	0	112.4	D156 K160	D156-T158 VanDerWaalsContact CG-OG1 3.32Å; D156-T158 VanDerWaalsContact OD1-CB 3.27Å; D156-T158 WeakPolarHBondContact OD1-CB 3.41Å; D156-T158 WeakPolarHBondContact OD1-CG2 3.21Å; D156-T158 PolarHBondContact OD1-N 2.89Å; D156-T158 PolarHBondContact OD1-OG1 2.89Å; D156-T158 PolarHBondContact OD2-OG1 3.16Å; T158-K160 PolarHBondContact O-N 3.27Å; T158-K160 VanDerWaalsContact O-N 3.17Å
159	E	73.1	Confident	70.2	Confident	100 Å²	100	86.6 Å²	86.6	47%	0.467	48%	0.477	S	S	.	.			trans	-63.1	113.2	172.6	-79.9	-159.4	-133.7	0	0	111.5	R250	E159-R250 HydrophobicContact CB-CB 3.98Å; E159-R250 PolarHBondContact O-N 2.95Å; E159-R250 IonicContact OE1-NH1 2.84Å; E159-R250 WeakPolarHBondContact OE2-CD 3.22Å; E159-R250 IonicContact OE2-CZ 3.51Å; E159-R250 IonicContact OE2-NE 3.19Å; E159-R250 IonicContact OE2-NH1 3.83Å; E159-R250 PolarHBondContact OE2-NH1 2.79Å
160	K	79.6	Confident	73	Confident	163 Å²	163	84.1 Å²	84.1	71%	0.709	45%	0.452	S	S	*	.	B	Isolated β-bridge	trans	-116.7	136.4	179.9	-73.3	177.7	-178	175.6	0	111.9	T158 S248 I249	T158-K160 PolarHBondContact O-N 3.27Å; T158-K160 VanDerWaalsContact O-N 3.17Å; K160-S248 CarbonylContact C-O 3.52Å; K160-S248 VanDerWaalsContact CA-O 3.24Å; K160-S248 WeakPolarHBondContact CA-O 3.32Å; K160-I249 HydrophobicContact CG-CD1 4.01Å
161	Q	74.1	Confident	75.5	Confident	54 Å²	54	80.1 Å²	80.1	25%	0.252	43%	0.427	S	S	.	.			trans	-122	145.8	176.8	49.9	168.8	3.7	0	0	111.2	V163 C247 S248 R250	Q161-V163 HydrophobicContact CB-CG2 4.43Å; Q161-V163 HydrophobicContact CG-CG2 3.69Å; Q161-V163 PolarHBondContact O-N 3.3Å; Q161-C247 PolarHBondContact NE2-O 2.86Å; Q161-S248 PolarHBondContact N-O 2.82Å; Q161-S248 WeakPolarHBondContact O-CA 3.45Å; Q161-R250 HydrophobicContact CG-CB 4.22Å; Q161-R250 HydrophobicContact CG-CG 4.47Å
162	A	73.4	Confident	77.9	Confident	105 Å²	105	82.4 Å²	82.4	87%	0.868	42%	0.418	S	S	*	.			trans	-81.7	101.6	173.4	0	0	0	0	0	109.4	P164	A162-P164 WeakPolarHBondContact O-CD 3.4Å
163	V	74.8	Confident	80.1	Confident	21 Å²	21	77.4 Å²	77.4	13%	0.127	40%	0.397	C	S	.	.			trans	-101.9	111.7	-177.6	-172.4	0	0	0	0	110.2	Q161 I165 M187 C247	Q161-V163 HydrophobicContact CB-CG2 4.43Å; Q161-V163 HydrophobicContact CG-CG2 3.69Å; Q161-V163 PolarHBondContact O-N 3.3Å; V163-I165 HydrophobicContact CG1-CB 4.02Å; V163-I165 HydrophobicContact CG1-CG2 4.13Å; V163-I165 PolarHBondContact O-N 3.35Å; V163-M187 HydrophobicContact CG1-CE 3.57Å; V163-M187 HydrophobicContact CG1-CG 3.94Å; V163-M187 HydrophobicContact CG1-SD 3.39Å; V163-M187 WeakPolarHBondContact CG1-SD 3.45Å; V163-C247 HydrophobicContact CB-CB 4.26Å; V163-C247 HydrophobicContact CG1-CB 4.01Å; V163-C247 HydrophobicContact CG2-CB 4.16Å; V163-C247 WeakPolarHBondContact CG2-O 3.4Å
164	P	82.3	Confident	81.9	Confident	81 Å²	81	80.7 Å²	80.7	53%	0.526	41%	0.406	S	S	.	.			trans	-78.7	57.3	179.2	33.3	-36.4	0	0	0	111.5	A162 M187 A188	A162-P164 WeakPolarHBondContact O-CD 3.4Å; P164-M187 HydrophobicContact CG-CG 4.5Å; P164-M187 CarbonylContact O-C 3.4Å; P164-M187 WeakPolarHBondContact O-CA 3.25Å; P164-A188 HydrophobicContact CG-CB 3.86Å; P164-A188 PolarHBondContact O-N 2.86Å
165	I	89.1	Confident	83	Confident	16 Å²	16	76.5 Å²	76.5	8%	0.082	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	144.8	177.9	-171	152.3	0	0	0	111	V163 V185 Y186 M187 L243 E244 L262	V163-I165 HydrophobicContact CG1-CB 4.02Å; V163-I165 HydrophobicContact CG1-CG2 4.13Å; V163-I165 PolarHBondContact O-N 3.35Å; I165-V185 HydrophobicContact CD1-CG1 3.95Å; I165-V185 HydrophobicContact CG1-CG1 4.13Å; I165-Y186 CarbonylContact C-O 3.59Å; I165-Y186 WeakPolarHBondContact CA-O 3.36Å; I165-M187 HydrophobicContact CB-CE 4.45Å; I165-M187 HydrophobicContact CB-CG 4.21Å; I165-M187 HydrophobicContact CD1-CE 3.88Å; I165-L243 HydrophobicContact CD1-CB 3.87Å; I165-L243 HydrophobicContact CD1-CD1 4.12Å; I165-L243 HydrophobicContact CD1-CG 4.47Å; I165-L243 HydrophobicContact CG1-CB 4.24Å; I165-E244 HydrophobicContact CG2-CB 4.1Å; I165-L262 HydrophobicContact CD1-CD2 4.13Å
166	S	91.8	Very high	83.6	Confident	34 Å²	34	82.1 Å²	82.1	24%	0.238	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	159.9	-179.7	54.6	0	0	0	0	111.2	Y186	S166-Y186 PolarHBondContact N-O 3.2Å; S166-Y186 PolarHBondContact O-N 3Å
167	V	95.6	Very high	84	Confident	0 Å²	0	81 Å²	81	0%	0	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	66.9	173.7	-171.3	0	0	0	0	107.3	R169 Y183 N184 V185 R236 E240 L243	V167-R169 VanDerWaalsContact C-N 3.27Å; V167-R169 PolarHBondContact O-N 3.21Å; V167-Y183 HydrophobicContact CG1-CD1 4.37Å; V167-N184 WeakPolarHBondContact CA-O 3.35Å; V167-V185 HydrophobicContact CG2-CG2 4.35Å; V167-R236 HydrophobicContact CB-CG 4.41Å; V167-R236 HydrophobicContact CG1-CG 3.99Å; V167-R236 WeakPolarHBondContact O-CD 3.44Å; V167-R236 WeakPolarHBondContact O-CG 3.28Å; V167-R236 PolarHBondContact O-NH1 2.87Å; V167-E240 HydrophobicContact CB-CB 4.04Å; V167-E240 HydrophobicContact CG2-CB 4.09Å; V167-E240 PolarHBondContact N-OE2 3.44Å; V167-L243 HydrophobicContact CG2-CD1 4.17Å
168	P	92.1	Very high	84	Confident	57 Å²	57	83.8 Å²	83.8	37%	0.37	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	-21.3	-164.9	27.7	-36.5	0	0	0	113.9	Y186	P168-Y186 VanDerWaalsContact CD-CD2 3.49Å; P168-Y186 HydrophobicContact CG-CD2 3.56Å; P168-Y186 HydrophobicContact CG-CE2 3.66Å; P168-Y186 HydrophobicContact CG-CG 4.18Å
169	R	91.3	Very high	84.5	Confident	183 Å²	183	85.9 Å²	85.9	69%	0.691	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.1	154.4	-175.8	-61.7	-175.3	-176.7	169.3	2.7	112.1	V167 N184	V167-R169 VanDerWaalsContact C-N 3.27Å; V167-R169 PolarHBondContact O-N 3.21Å; R169-N184 PolarHBondContact O-N 2.7Å
170	Y	93.1	Very high	85.2	Confident	52 Å²	52	82.4 Å²	82.4	20%	0.204	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	161.4	161.4	57.4	-95	0	0	0	110	V181 V182 Y183 E229 L232 D233 R236	Y170-V181 HydrophobicContact CD2-CG1 3.83Å; Y170-V181 HydrophobicContact CG-CG1 4.05Å; Y170-V182 CarbonylContact C-O 3.55Å; Y170-V182 WeakPolarHBondContact CA-O 3.33Å; Y170-V182 VanDerWaalsContact CB-O 3.3Å; Y170-V182 WeakPolarHBondContact CB-O 3.37Å; Y170-Y183 HydrophobicContact CD1-CE1 4.27Å; Y170-Y183 HydrophobicContact CG-CE1 4.35Å; Y170-E229 PolarHBondContact OH-O 2.7Å; Y170-E229 PolarHBondContact OH-OE2 2.74Å; Y170-L232 HydrophobicContact CD1-CB 4.42Å; Y170-L232 HydrophobicContact CD2-CB 4.46Å; Y170-L232 HydrophobicContact CD2-CD1 4.44Å; Y170-L232 HydrophobicContact CE1-CB 3.82Å; Y170-L232 HydrophobicContact CE2-CB 3.86Å; Y170-L232 HydrophobicContact CE2-CD1 3.82Å; Y170-L232 HydrophobicContact CE2-CG 4.44Å; Y170-L232 VanDerWaalsContact CZ-CB 3.49Å; Y170-D233 HydrophobicContact CE1-CB 4.27Å; Y170-R236 HydrophobicContact CD1-CB 4.19Å; Y170-R236 HydrophobicContact CD1-CG 4.39Å
171	K	90.3	Very high	85.8	Confident	90 Å²	90	75.8 Å²	75.8	39%	0.391	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	148.1	174.6	62.6	-174.7	173.2	-174.1	0	110.4	V173 V181 V182 N184 S194	K171-V173 HydrophobicContact CD-CG2 4.4Å; K171-V173 HydrophobicContact CG-CG2 4.09Å; K171-V181 WeakPolarHBondContact O-CA 3.47Å; K171-V182 HydrophobicContact CD-CG2 4.03Å; K171-V182 HydrophobicContact CG-CG2 3.44Å; K171-V182 VanDerWaalsContact CG-CG2 3.44Å; K171-V182 PolarHBondContact N-O 2.82Å; K171-V182 PolarHBondContact O-N 2.96Å; K171-N184 WeakPolarHBondContact CE-OD1 3.43Å; K171-S194 PolarHBondContact NZ-OG 2.58Å; K171-S194 VanDerWaalsContact NZ-OG 3.12Å
172	H	89.8	Confident	86.7	Confident	123 Å²	123	73.6 Å²	73.6	57%	0.569	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.3	136.8	167.3	-73.3	83.8	0	0	0	109.1	V181 E229	H172-V181 WeakPolarHBondContact NE2-CG2 3.4Å; H172-E229 IonicContact CE1-OE1 4Å
173	V	86.4	Confident	87.7	Confident	41 Å²	41	68.7 Å²	68.7	25%	0.248	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	142.1	179	178.3	0	0	0	0	108.5	K171 Q175 K179 F180 V182	K171-V173 HydrophobicContact CD-CG2 4.4Å; K171-V173 HydrophobicContact CG-CG2 4.09Å; V173-Q175 HydrophobicContact CG1-CB 4.43Å; V173-K179 WeakPolarHBondContact O-CA 3.48Å; V173-F180 HydrophobicContact CB-CE2 4.34Å; V173-F180 HydrophobicContact CG1-CE2 4.49Å; V173-F180 HydrophobicContact CG1-CZ 4.33Å; V173-F180 PolarHBondContact N-O 3.08Å; V173-F180 PolarHBondContact O-N 2.86Å; V173-V182 HydrophobicContact CG2-CG1 4.12Å; V173-V182 HydrophobicContact CG2-CG2 3.67Å
174	E	85.8	Confident	88.5	Confident	125 Å²	125	68.5 Å²	68.5	58%	0.584	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.9	116.1	171.9	-177.9	162.8	-155.1	0	0	108.1	E178 K179	E174-E178 WeakPolarHBondContact CA-O 3.29Å; E174-K179 HydrophobicContact CB-CG 4.18Å; E174-K179 HydrophobicContact CG-CG 4.15Å; E174-K179 WeakPolarHBondContact OE1-CE 3.27Å; E174-K179 IonicContact OE1-NZ 3.65Å; E174-K179 PolarHBondContact OE1-NZ 3.03Å; E174-K179 WeakPolarHBondContact OE2-CE 3.5Å; E174-K179 IonicContact OE2-NZ 3.27Å; E174-K179 PolarHBondContact OE2-NZ 3.41Å
175	Q	77.7	Confident	88.9	Confident	79 Å²	79	64.6 Å²	64.6	37%	0.369	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	130.6	-177.5	-173.8	-178.7	5.1	0	0	109	V173 G177 E178 F180	V173-Q175 HydrophobicContact CG1-CB 4.43Å; Q175-G177 PolarHBondContact O-N 3.49Å; Q175-E178 PolarHBondContact N-O 2.94Å; Q175-E178 PolarHBondContact O-N 3.1Å; Q175-F180 HydrophobicContact CB-CE1 4.03Å; Q175-F180 HydrophobicContact CB-CZ 4.17Å
176	N	80.1	Confident	88.8	Confident	163 Å²	163	66.3 Å²	66.3	87%	0.872	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	26.2	-176.8	-57.3	-7.4	0	0	0	114.1	E178	N176-E178 VanDerWaalsContact C-N 3.34Å
177	G	83.1	Confident	88.4	Confident	64 Å²	64	65 Å²	65	66%	0.66	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.4	-8.6	-175.4	0	0	0	0	0	115.5	Q175	Q175-G177 PolarHBondContact O-N 3.49Å
178	E	84.3	Confident	87.4	Confident	101 Å²	101	66.3 Å²	66.3	47%	0.472	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	134.8	169.5	-72.5	-160.5	169.2	0	0	111.2	E174 Q175 N176 F180 R196	E174-E178 WeakPolarHBondContact CA-O 3.29Å; Q175-E178 PolarHBondContact N-O 2.94Å; Q175-E178 PolarHBondContact O-N 3.1Å; N176-E178 VanDerWaalsContact C-N 3.34Å; E178-F180 HydrophobicContact CB-CD1 3.94Å; E178-F180 HydrophobicContact CB-CE1 4.26Å; E178-R196 IonicContact OE2-CZ 3Å; E178-R196 VanDerWaalsContact OE2-CZ 3.28Å; E178-R196 IonicContact OE2-NH1 2.78Å; E178-R196 PolarHBondContact OE2-NH1 2.91Å; E178-R196 IonicContact OE2-NH2 3.84Å; E178-R196 PolarHBondContact OE2-NH2 3.34Å
179	K	86.4	Confident	86.6	Confident	151 Å²	151	66.3 Å²	66.3	66%	0.657	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.2	122.2	165.2	-71.8	-177.5	178.7	-177.5	0	110.4	V173 E174	V173-K179 WeakPolarHBondContact O-CA 3.48Å; E174-K179 HydrophobicContact CB-CG 4.18Å; E174-K179 HydrophobicContact CG-CG 4.15Å; E174-K179 WeakPolarHBondContact OE1-CE 3.27Å; E174-K179 IonicContact OE1-NZ 3.65Å; E174-K179 PolarHBondContact OE1-NZ 3.03Å; E174-K179 WeakPolarHBondContact OE2-CE 3.5Å; E174-K179 IonicContact OE2-NZ 3.27Å; E174-K179 PolarHBondContact OE2-NZ 3.41Å
180	F	89.1	Confident	85.8	Confident	27 Å²	27	57.7 Å²	57.7	12%	0.118	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	163.2	177.8	56.6	-91.3	0	0	0	112.5	V173 Q175 E178 V182 R196	V173-F180 HydrophobicContact CB-CE2 4.34Å; V173-F180 HydrophobicContact CG1-CE2 4.49Å; V173-F180 HydrophobicContact CG1-CZ 4.33Å; V173-F180 PolarHBondContact N-O 3.08Å; V173-F180 PolarHBondContact O-N 2.86Å; Q175-F180 HydrophobicContact CB-CE1 4.03Å; Q175-F180 HydrophobicContact CB-CZ 4.17Å; E178-F180 HydrophobicContact CB-CD1 3.94Å; E178-F180 HydrophobicContact CB-CE1 4.26Å; F180-V182 HydrophobicContact CD2-CG1 3.76Å; F180-V182 HydrophobicContact CE2-CG1 3.53Å; F180-R196 HydrophobicContact CD2-CB 3.76Å; F180-R196 HydrophobicContact CD2-CG 4.41Å; F180-R196 HydrophobicContact CE2-CB 4.1Å
181	V	90.9	Very high	85.3	Confident	25 Å²	25	58 Å²	58	15%	0.152	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	131.1	175.7	-179.9	0	0	0	0	109.8	Y170 K171 H172 Y183 L232	Y170-V181 HydrophobicContact CD2-CG1 3.83Å; Y170-V181 HydrophobicContact CG-CG1 4.05Å; K171-V181 WeakPolarHBondContact O-CA 3.47Å; H172-V181 WeakPolarHBondContact NE2-CG2 3.4Å; V181-Y183 HydrophobicContact CG1-CE2 4.29Å; V181-L232 HydrophobicContact CB-CD2 4.33Å; V181-L232 HydrophobicContact CG1-CD2 4.25Å; V181-L232 HydrophobicContact CG2-CD1 4.14Å; V181-L232 HydrophobicContact CG2-CD2 4.04Å
182	V	92.8	Very high	84.8	Confident	7 Å²	7	54 Å²	54	4%	0.042	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	149.4	166.3	-54.1	0	0	0	0	110.6	Y170 K171 V173 F180 K195 R196	Y170-V182 CarbonylContact C-O 3.55Å; Y170-V182 WeakPolarHBondContact CA-O 3.33Å; Y170-V182 VanDerWaalsContact CB-O 3.3Å; Y170-V182 WeakPolarHBondContact CB-O 3.37Å; K171-V182 HydrophobicContact CD-CG2 4.03Å; K171-V182 HydrophobicContact CG-CG2 3.44Å; K171-V182 VanDerWaalsContact CG-CG2 3.44Å; K171-V182 PolarHBondContact N-O 2.82Å; K171-V182 PolarHBondContact O-N 2.96Å; V173-V182 HydrophobicContact CG2-CG1 4.12Å; V173-V182 HydrophobicContact CG2-CG2 3.67Å; F180-V182 HydrophobicContact CD2-CG1 3.76Å; F180-V182 HydrophobicContact CE2-CG1 3.53Å; V182-K195 CarbonylContact C-O 3.52Å; V182-K195 WeakPolarHBondContact CA-O 3.48Å; V182-R196 HydrophobicContact CG1-CB 4.12Å
183	Y	94.3	Very high	84.6	Confident	3 Å²	3	48.1 Å²	48.1	1%	0.012	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	126.8	177.1	-61.8	-88.1	0	0	0	107.8	V167 Y170 V181 S194 K195 F200 R235 R236 L239	V167-Y183 HydrophobicContact CG1-CD1 4.37Å; Y170-Y183 HydrophobicContact CD1-CE1 4.27Å; Y170-Y183 HydrophobicContact CG-CE1 4.35Å; V181-Y183 HydrophobicContact CG1-CE2 4.29Å; Y183-S194 WeakPolarHBondContact O-CA 3.31Å; Y183-K195 PolarHBondContact N-O 2.77Å; Y183-K195 PolarHBondContact O-N 2.91Å; Y183-F200 HydrophobicContact CD2-CE2 4.27Å; Y183-F200 HydrophobicContact CG-CE2 4.5Å; Y183-R235 VanDerWaalsContact OH-CD 3.26Å; Y183-R235 WeakPolarHBondContact OH-CD 3.4Å; Y183-R236 HydrophobicContact CD1-CB 4.02Å; Y183-R236 HydrophobicContact CD1-CG 4.19Å; Y183-R236 HydrophobicContact CE1-CB 3.92Å; Y183-L239 HydrophobicContact CD1-CD1 4.07Å; Y183-L239 HydrophobicContact CD2-CD1 3.74Å; Y183-L239 HydrophobicContact CE1-CD1 4.31Å; Y183-L239 HydrophobicContact CE2-CD1 4Å; Y183-L239 HydrophobicContact CG-CD1 3.8Å
184	N	91.6	Very high	84.7	Confident	16 Å²	16	47.5 Å²	47.5	9%	0.086	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	115.8	179.5	-63.1	23.6	0	0	0	108.4	V167 R169 K171 Y186 Q191 C193 S194	V167-N184 WeakPolarHBondContact CA-O 3.35Å; R169-N184 PolarHBondContact O-N 2.7Å; K171-N184 WeakPolarHBondContact CE-OD1 3.43Å; N184-Y186 HydrophobicContact CB-CD2 4.23Å; N184-Y186 HydrophobicContact CB-CE2 3.65Å; N184-Q191 HydrophobicContact CB-CG 4.41Å; N184-Q191 PolarHBondContact ND2-OE1 3.48Å; N184-C193 WeakPolarHBondContact CA-O 3.15Å; N184-S194 PolarHBondContact OD1-OG 2.77Å
185	V	91.3	Very high	85	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	132.5	177.3	-174.9	0	0	0	0	108.9	I165 V167 Q191 L192 C193 F200 L243 L262	I165-V185 HydrophobicContact CD1-CG1 3.95Å; I165-V185 HydrophobicContact CG1-CG1 4.13Å; V167-V185 HydrophobicContact CG2-CG2 4.35Å; V185-Q191 WeakPolarHBondContact O-CG 3.44Å; V185-L192 PolarHBondContact O-N 3.03Å; V185-C193 PolarHBondContact N-O 2.79Å; V185-C193 PolarHBondContact O-N 2.82Å; V185-F200 HydrophobicContact CG2-CE1 4.17Å; V185-F200 HydrophobicContact CG2-CZ 3.76Å; V185-L243 HydrophobicContact CG1-CD1 3.83Å; V185-L243 HydrophobicContact CG2-CD1 4.01Å; V185-L262 HydrophobicContact CG1-CD2 3.93Å
186	Y	86.5	Confident	85.6	Confident	52 Å²	52	41.7 Å²	41.7	20%	0.204	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	145.1	178.2	-72.3	-114.2	0	0	0	110.3	I165 S166 P168 N184 R190 Q191	I165-Y186 CarbonylContact C-O 3.59Å; I165-Y186 WeakPolarHBondContact CA-O 3.36Å; S166-Y186 PolarHBondContact N-O 3.2Å; S166-Y186 PolarHBondContact O-N 3Å; P168-Y186 VanDerWaalsContact CD-CD2 3.49Å; P168-Y186 HydrophobicContact CG-CD2 3.56Å; P168-Y186 HydrophobicContact CG-CE2 3.66Å; P168-Y186 HydrophobicContact CG-CG 4.18Å; N184-Y186 HydrophobicContact CB-CD2 4.23Å; N184-Y186 HydrophobicContact CB-CE2 3.65Å; Y186-R190 CarbonylContact C-O 3.51Å; Y186-R190 WeakPolarHBondContact CA-O 3.3Å; Y186-R190 WeakPolarHBondContact CB-O 3.45Å; Y186-Q191 HydrophobicContact CD1-CB 3.83Å; Y186-Q191 HydrophobicContact CD1-CG 4.41Å; Y186-Q191 VanDerWaalsContact CD1-N 3.35Å; Y186-Q191 HydrophobicContact CD2-CB 4.32Å; Y186-Q191 HydrophobicContact CD2-CG 4.01Å; Y186-Q191 HydrophobicContact CE1-CB 3.62Å; Y186-Q191 HydrophobicContact CE1-CG 4.19Å; Y186-Q191 HydrophobicContact CE2-CB 4.17Å; Y186-Q191 HydrophobicContact CE2-CG 3.79Å; Y186-Q191 HydrophobicContact CG-CB 4.17Å; Y186-Q191 HydrophobicContact CG-CG 4.33Å; Y186-Q191 PolarHBondContact OH-OE1 3.06Å
187	M	84.1	Confident	86.3	Confident	7 Å²	7	35.4 Å²	35.4	3%	0.034	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	135.1	167.8	-159	-172.5	-64.4	0	0	110.7	V163 P164 I165 G189 R190 L192 L262 Y346	V163-M187 HydrophobicContact CG1-CE 3.57Å; V163-M187 HydrophobicContact CG1-CG 3.94Å; V163-M187 HydrophobicContact CG1-SD 3.39Å; V163-M187 WeakPolarHBondContact CG1-SD 3.45Å; P164-M187 HydrophobicContact CG-CG 4.5Å; P164-M187 CarbonylContact O-C 3.4Å; P164-M187 WeakPolarHBondContact O-CA 3.25Å; I165-M187 HydrophobicContact CB-CE 4.45Å; I165-M187 HydrophobicContact CB-CG 4.21Å; I165-M187 HydrophobicContact CD1-CE 3.88Å; M187-G189 PolarHBondContact O-N 3.21Å; M187-G189 VanDerWaalsContact O-N 3.08Å; M187-R190 PolarHBondContact N-O 3.02Å; M187-R190 WeakPolarHBondContact O-CB 3.35Å; M187-R190 PolarHBondContact O-N 2.84Å; M187-L192 HydrophobicContact CB-CD1 3.65Å; M187-L192 HydrophobicContact CB-CG 4.17Å; M187-L192 HydrophobicContact CE-CD1 4.1Å; M187-L262 HydrophobicContact CE-CD1 3.83Å; M187-Y346 HydrophobicContact CE-CD2 4.01Å; M187-Y346 HydrophobicContact CE-CE2 3.62Å; M187-Y346 HydrophobicContact CG-CD2 4.49Å; M187-Y346 HydrophobicContact SD-CD2 3.22Å; M187-Y346 WeakPolarHBondContact SD-CD2 3.44Å; M187-Y346 HydrophobicContact SD-CE2 3.34Å; M187-Y346 WeakPolarHBondContact SD-CE2 3.38Å; M187-Y346 HydrophobicContact SD-CG 4.23Å
188	A	75.6	Confident	86.7	Confident	27 Å²	27	40.7 Å²	40.7	22%	0.223	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	26.3	-171.5	0	0	0	0	0	113.7	P164 R190 G352	P164-A188 HydrophobicContact CG-CB 3.86Å; P164-A188 PolarHBondContact O-N 2.86Å; A188-R190 VanDerWaalsContact C-N 3.32Å; A188-R190 PolarHBondContact O-N 2.95Å; A188-G352 WeakPolarHBondContact O-CA 3.4Å
189	G	75	Confident	87.1	Confident	56 Å²	56	37.7 Å²	37.7	58%	0.577	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.5	-0.7	-174	0	0	0	0	0	115.6	M187	M187-G189 PolarHBondContact O-N 3.21Å; M187-G189 VanDerWaalsContact O-N 3.08Å
190	R	74.1	Confident	87.5	Confident	2 Å²	2	30.5 Å²	30.5	1%	0.008	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	132.1	170.6	-43	-175.8	-158.3	-178.9	10.3	109.1	Y186 M187 A188 L192 Y342 N345 G352	Y186-R190 CarbonylContact C-O 3.51Å; Y186-R190 WeakPolarHBondContact CA-O 3.3Å; Y186-R190 WeakPolarHBondContact CB-O 3.45Å; M187-R190 PolarHBondContact N-O 3.02Å; M187-R190 WeakPolarHBondContact O-CB 3.35Å; M187-R190 PolarHBondContact O-N 2.84Å; A188-R190 VanDerWaalsContact C-N 3.32Å; A188-R190 PolarHBondContact O-N 2.95Å; R190-L192 PolarHBondContact O-N 2.9Å; R190-Y342 HydrophobicContact CB-CE1 3.82Å; R190-Y342 WeakPolarHBondContact CD-O 3.28Å; R190-Y342 HydrophobicContact CG-CE1 4.02Å; R190-Y342 HydrophobicContact CG-CE2 4.04Å; R190-Y342 PolarHBondContact NH1-O 3.23Å; R190-N345 VanDerWaalsContact CZ-O 3.31Å; R190-N345 PolarHBondContact NH1-O 2.95Å; R190-N345 PolarHBondContact NH2-O 3.2Å; R190-G352 WeakPolarHBondContact CG-O 3.47Å; R190-G352 PolarHBondContact NE-O 2.73Å
191	Q	81.3	Confident	87.8	Confident	59 Å²	59	29.8 Å²	29.8	28%	0.276	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	126.9	170.5	-163	-171.4	-82.1	0	0	108.8	N184 V185 Y186 S194	N184-Q191 HydrophobicContact CB-CG 4.41Å; N184-Q191 PolarHBondContact ND2-OE1 3.48Å; V185-Q191 WeakPolarHBondContact O-CG 3.44Å; Y186-Q191 HydrophobicContact CD1-CB 3.83Å; Y186-Q191 HydrophobicContact CD1-CG 4.41Å; Y186-Q191 VanDerWaalsContact CD1-N 3.35Å; Y186-Q191 HydrophobicContact CD2-CB 4.32Å; Y186-Q191 HydrophobicContact CD2-CG 4.01Å; Y186-Q191 HydrophobicContact CE1-CB 3.62Å; Y186-Q191 HydrophobicContact CE1-CG 4.19Å; Y186-Q191 HydrophobicContact CE2-CB 4.17Å; Y186-Q191 HydrophobicContact CE2-CG 3.79Å; Y186-Q191 HydrophobicContact CG-CB 4.17Å; Y186-Q191 HydrophobicContact CG-CG 4.33Å; Y186-Q191 PolarHBondContact OH-OE1 3.06Å; Q191-S194 PolarHBondContact NE2-OG 3.1Å
192	L	80.6	Confident	88	Confident	5 Å²	5	32.5 Å²	32.5	3%	0.026	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	-52.7	177	-58.8	-174.3	0	0	0	111	V185 M187 R190 L262 Y346	V185-L192 PolarHBondContact O-N 3.03Å; M187-L192 HydrophobicContact CB-CD1 3.65Å; M187-L192 HydrophobicContact CB-CG 4.17Å; M187-L192 HydrophobicContact CE-CD1 4.1Å; R190-L192 PolarHBondContact O-N 2.9Å; L192-L262 CarbonylContact C-O 3.57Å; L192-L262 WeakPolarHBondContact CB-O 3.42Å; L192-L262 HydrophobicContact CD1-CB 4.18Å; L192-L262 HydrophobicContact CD1-CD1 4.25Å; L192-L262 HydrophobicContact CD1-CD2 4.37Å; L192-Y346 HydrophobicContact CD1-CD1 4.3Å; L192-Y346 HydrophobicContact CD1-CG 4.43Å; L192-Y346 HydrophobicContact CD2-CD1 4.35Å; L192-Y346 HydrophobicContact CD2-CG 4.48Å
193	C	85.4	Confident	88.1	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	169.3	-179.9	65.6	0	0	0	0	113.8	N184 V185 K195 F261 L262 E264	N184-C193 WeakPolarHBondContact CA-O 3.15Å; V185-C193 PolarHBondContact N-O 2.79Å; V185-C193 PolarHBondContact O-N 2.82Å; C193-K195 HydrophobicContact CB-CG 4.08Å; C193-K195 VanDerWaalsContact SG-CG 3.54Å; C193-F261 PolarHBondContact SG-O 3.29Å; C193-F261 VanDerWaalsContact SG-O 3.34Å; C193-L262 WeakPolarHBondContact CB-O 3.4Å; C193-E264 HydrophobicContact CB-CG 4.06Å
194	S	89.3	Confident	88.2	Confident	28 Å²	28	32.9 Å²	32.9	20%	0.196	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	105.1	171.2	-71.9	0	0	0	0	108.9	K171 Y183 N184 Q191	K171-S194 PolarHBondContact NZ-OG 2.58Å; K171-S194 VanDerWaalsContact NZ-OG 3.12Å; Y183-S194 WeakPolarHBondContact O-CA 3.31Å; N184-S194 PolarHBondContact OD1-OG 2.77Å; Q191-S194 PolarHBondContact NE2-OG 3.1Å
195	K	90.6	Very high	88.4	Confident	4 Å²	4	37.5 Å²	37.5	2%	0.017	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	137.2	-167.3	-67.6	-70.8	-179.4	-172	0	112.8	V182 Y183 C193 E199 F200 F261 S265	V182-K195 CarbonylContact C-O 3.52Å; V182-K195 WeakPolarHBondContact CA-O 3.48Å; Y183-K195 PolarHBondContact N-O 2.77Å; Y183-K195 PolarHBondContact O-N 2.91Å; C193-K195 HydrophobicContact CB-CG 4.08Å; C193-K195 VanDerWaalsContact SG-CG 3.54Å; K195-E199 WeakPolarHBondContact CA-OE2 3.42Å; K195-E199 HydrophobicContact CB-CB 4.38Å; K195-E199 HydrophobicContact CD-CB 4.17Å; K195-E199 HydrophobicContact CD-CG 4.37Å; K195-E199 WeakPolarHBondContact CD-OE1 3.46Å; K195-E199 WeakPolarHBondContact CD-OE2 3.45Å; K195-E199 WeakPolarHBondContact CE-OE1 3.26Å; K195-E199 IonicContact NZ-OE1 2.99Å; K195-E199 PolarHBondContact NZ-OE1 2.77Å; K195-F200 HydrophobicContact CB-CD2 4.17Å; K195-F200 HydrophobicContact CB-CE2 3.64Å; K195-F200 HydrophobicContact CB-CZ 4.36Å; K195-F200 WeakPolarHBondContact O-CE2 3.42Å; K195-F261 HydrophobicContact CB-CE2 4.13Å; K195-F261 HydrophobicContact CB-CZ 4.21Å; K195-F261 HydrophobicContact CD-CE2 4.41Å; K195-F261 HydrophobicContact CG-CE2 3.95Å; K195-F261 HydrophobicContact CG-CZ 4.13Å; K195-S265 PolarHBondContact NZ-O 2.88Å; K195-S265 PolarHBondContact NZ-OG 3.07Å
196	R	92.1	Very high	88.5	Confident	78 Å²	78	39.7 Å²	39.7	29%	0.294	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	149	171.8	76.5	-166.4	-72.9	-174.9	-1	109.5	E178 F180 V182 R198 E199	E178-R196 IonicContact OE2-CZ 3Å; E178-R196 VanDerWaalsContact OE2-CZ 3.28Å; E178-R196 IonicContact OE2-NH1 2.78Å; E178-R196 PolarHBondContact OE2-NH1 2.91Å; E178-R196 IonicContact OE2-NH2 3.84Å; E178-R196 PolarHBondContact OE2-NH2 3.34Å; F180-R196 HydrophobicContact CD2-CB 3.76Å; F180-R196 HydrophobicContact CD2-CG 4.41Å; F180-R196 HydrophobicContact CE2-CB 4.1Å; V182-R196 HydrophobicContact CG1-CB 4.12Å; R196-R198 HydrophobicContact CG-CB 4.25Å; R196-R198 PolarHBondContact O-N 2.8Å; R196-E199 HydrophobicContact CG-CG 4.28Å; R196-E199 WeakPolarHBondContact CG-OE2 3.23Å; R196-E199 PolarHBondContact N-OE2 3.02Å; R196-E199 WeakPolarHBondContact O-CB 3.41Å; R196-E199 PolarHBondContact O-N 2.87Å
197	Y	93.5	Very high	88.9	Confident	31 Å²	31	37.2 Å²	37.2	12%	0.122	19%	0.19	C	C	.	.	H	α-helix	trans	-51.1	-29.3	-174.3	167.7	-85	0	0	0	114.7	E199 F200 A201 L219 P220 K222 R235 L239	Y197-E199 PolarHBondContact O-N 2.62Å; Y197-F200 PolarHBondContact O-N 3.49Å; Y197-A201 HydrophobicContact CE1-CB 4.06Å; Y197-A201 PolarHBondContact O-N 3.27Å; Y197-A201 VanDerWaalsContact O-N 3.13Å; Y197-L219 HydrophobicContact CE2-CD2 4.45Å; Y197-P220 VanDerWaalsContact CE2-O 3.28Å; Y197-P220 WeakPolarHBondContact CE2-O 3.44Å; Y197-P220 PolarHBondContact OH-O 3.2Å; Y197-K222 HydrophobicContact CE1-CD 4.42Å; Y197-K222 HydrophobicContact CE1-CG 3.48Å; Y197-K222 VanDerWaalsContact CE1-CG 3.48Å; Y197-R235 HydrophobicContact CD2-CG 4.21Å; Y197-L239 HydrophobicContact CD2-CD1 4.46Å; Y197-L239 HydrophobicContact CD2-CD2 4.31Å; Y197-L239 HydrophobicContact CE2-CD2 4.48Å
198	R	90.9	Very high	89.3	Confident	176 Å²	176	41.3 Å²	41.3	66%	0.664	21%	0.208	S	C	*	.	H	α-helix	trans	-56.7	-35	175.5	179.9	175.4	174	167.3	-2.9	112.5	R196 A201 I202	R196-R198 HydrophobicContact CG-CB 4.25Å; R196-R198 PolarHBondContact O-N 2.8Å; R198-A201 CarbonylContact O-C 3.54Å; R198-A201 PolarHBondContact O-N 2.78Å; R198-I202 HydrophobicContact CG-CD1 4.12Å; R198-I202 WeakPolarHBondContact O-CG1 3.47Å; R198-I202 PolarHBondContact O-N 3.4Å
199	E	93.6	Very high	90.1	Very high	37 Å²	37	48.5 Å²	48.5	17%	0.173	23%	0.229	C	C	.	.	H	α-helix	trans	-75.5	-42.2	-176.4	-61.4	169.1	92.9	0	0	111.3	K195 R196 Y197 A201 I202 L203 F261	K195-E199 WeakPolarHBondContact CA-OE2 3.42Å; K195-E199 HydrophobicContact CB-CB 4.38Å; K195-E199 HydrophobicContact CD-CB 4.17Å; K195-E199 HydrophobicContact CD-CG 4.37Å; K195-E199 WeakPolarHBondContact CD-OE1 3.46Å; K195-E199 WeakPolarHBondContact CD-OE2 3.45Å; K195-E199 WeakPolarHBondContact CE-OE1 3.26Å; K195-E199 IonicContact NZ-OE1 2.99Å; K195-E199 PolarHBondContact NZ-OE1 2.77Å; R196-E199 HydrophobicContact CG-CG 4.28Å; R196-E199 WeakPolarHBondContact CG-OE2 3.23Å; R196-E199 PolarHBondContact N-OE2 3.02Å; R196-E199 WeakPolarHBondContact O-CB 3.41Å; R196-E199 PolarHBondContact O-N 2.87Å; Y197-E199 PolarHBondContact O-N 2.62Å; E199-A201 PolarHBondContact O-N 3.01Å; E199-I202 WeakPolarHBondContact O-CA 3.27Å; E199-I202 WeakPolarHBondContact O-CB 3.42Å; E199-I202 PolarHBondContact O-N 2.92Å; E199-L203 PolarHBondContact O-N 3.33Å; E199-F261 HydrophobicContact CB-CE2 4.17Å
200	F	95.7	Very high	90.7	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-56.9	-36.4	168.6	-67.5	-103	0	0	0	111.8	Y183 V185 K195 Y197 I202 H204 L219 L239 L243 F261	Y183-F200 HydrophobicContact CD2-CE2 4.27Å; Y183-F200 HydrophobicContact CG-CE2 4.5Å; V185-F200 HydrophobicContact CG2-CE1 4.17Å; V185-F200 HydrophobicContact CG2-CZ 3.76Å; K195-F200 HydrophobicContact CB-CD2 4.17Å; K195-F200 HydrophobicContact CB-CE2 3.64Å; K195-F200 HydrophobicContact CB-CZ 4.36Å; K195-F200 WeakPolarHBondContact O-CE2 3.42Å; Y197-F200 PolarHBondContact O-N 3.49Å; F200-I202 VanDerWaalsContact C-N 3.33Å; F200-H204 WeakPolarHBondContact O-CB 3.45Å; F200-H204 PolarHBondContact O-N 2.98Å; F200-L219 HydrophobicContact CB-CD1 4.42Å; F200-L239 HydrophobicContact CB-CD2 3.97Å; F200-L239 HydrophobicContact CD1-CB 4.27Å; F200-L239 HydrophobicContact CD1-CD1 4.17Å; F200-L239 HydrophobicContact CD1-CD2 3.65Å; F200-L239 HydrophobicContact CD1-CG 4.23Å; F200-L239 HydrophobicContact CD2-CD1 4.17Å; F200-L239 HydrophobicContact CE1-CB 3.96Å; F200-L239 HydrophobicContact CE1-CD1 4.04Å; F200-L239 HydrophobicContact CE1-CD2 4.19Å; F200-L239 HydrophobicContact CE1-CG 4.28Å; F200-L239 HydrophobicContact CE2-CD1 4.07Å; F200-L239 HydrophobicContact CG-CD1 4.21Å; F200-L239 HydrophobicContact CG-CD2 3.86Å; F200-L239 HydrophobicContact CZ-CD1 4.01Å; F200-L243 HydrophobicContact CD1-CD1 4.45Å; F200-L243 HydrophobicContact CE1-CD1 3.74Å; F200-L243 HydrophobicContact CE1-CG 4.37Å; F200-F261 HydrophobicContact CD1-CE1 4.32Å; F200-F261 HydrophobicContact CD1-CE2 4.4Å; F200-F261 AromaticContact CD1-CZ 3.59Å; F200-F261 HydrophobicContact CD1-CZ 3.59Å; F200-F261 HydrophobicContact CD2-CE2 4.26Å; F200-F261 AromaticContact CD2-CZ 3.99Å; F200-F261 HydrophobicContact CD2-CZ 3.99Å; F200-F261 HydrophobicContact CE1-CE1 4.29Å; F200-F261 AromaticContact CE1-CZ 3.72Å; F200-F261 HydrophobicContact CE1-CZ 3.72Å; F200-F261 HydrophobicContact CE2-CZ 4.07Å; F200-F261 HydrophobicContact CG-CE2 4.14Å; F200-F261 AromaticContact CG-CZ 3.76Å; F200-F261 HydrophobicContact CG-CZ 3.76Å; F200-F261 AromaticContact CZ-CZ 3.95Å; F200-F261 HydrophobicContact CZ-CZ 3.95Å
201	A	94.8	Very high	91.4	Very high	13 Å²	13	50.1 Å²	50.1	11%	0.107	22%	0.222	C	C	.	.	H	α-helix	trans	-74.7	-19.5	175.3	0	0	0	0	0	113.7	Y197 R198 E199 Q205 L219	Y197-A201 HydrophobicContact CE1-CB 4.06Å; Y197-A201 PolarHBondContact O-N 3.27Å; Y197-A201 VanDerWaalsContact O-N 3.13Å; R198-A201 CarbonylContact O-C 3.54Å; R198-A201 PolarHBondContact O-N 2.78Å; E199-A201 PolarHBondContact O-N 3.01Å; A201-Q205 VanDerWaalsContact O-CG 3.23Å; A201-Q205 WeakPolarHBondContact O-CG 3.39Å; A201-L219 HydrophobicContact CB-CD2 4.12Å
202	I	94.3	Very high	91.6	Very high	82 Å²	82	50.1 Å²	50.1	42%	0.421	23%	0.232	S	C	.	.	H	α-helix	trans	-80.8	-48.9	170.6	-70.7	162.5	0	0	0	109.3	R198 E199 F200 H204 Q205 N206	R198-I202 HydrophobicContact CG-CD1 4.12Å; R198-I202 WeakPolarHBondContact O-CG1 3.47Å; R198-I202 PolarHBondContact O-N 3.4Å; E199-I202 WeakPolarHBondContact O-CA 3.27Å; E199-I202 WeakPolarHBondContact O-CB 3.42Å; E199-I202 PolarHBondContact O-N 2.92Å; F200-I202 VanDerWaalsContact C-N 3.33Å; I202-H204 VanDerWaalsContact C-N 3.3Å; I202-H204 PolarHBondContact O-N 2.91Å; I202-Q205 PolarHBondContact O-N 3.2Å; I202-N206 PolarHBondContact O-N 3.01Å
203	L	95.4	Very high	91.8	Very high	5 Å²	5	53 Å²	53	3%	0.026	25%	0.247	C	C	.	.	H	α-helix	trans	-45.8	-54.3	171.1	172.9	72.1	0	0	0	111	E199 Q205 N206 L207 Y242 L243 I257 M258 F261	E199-L203 PolarHBondContact O-N 3.33Å; L203-Q205 PolarHBondContact O-N 2.92Å; L203-Q205 VanDerWaalsContact O-N 3.14Å; L203-N206 PolarHBondContact O-N 2.86Å; L203-N206 VanDerWaalsContact O-N 3.12Å; L203-L207 HydrophobicContact CD1-CD1 3.68Å; L203-L207 HydrophobicContact CD1-CD2 4.28Å; L203-L207 HydrophobicContact CD1-CG 3.78Å; L203-L207 HydrophobicContact CD2-CD1 4.32Å; L203-L207 HydrophobicContact CG-CD1 3.73Å; L203-L207 HydrophobicContact CG-CG 4.14Å; L203-L207 WeakPolarHBondContact O-CB 3.21Å; L203-L207 WeakPolarHBondContact O-CG 3.47Å; L203-L207 PolarHBondContact O-N 2.8Å; L203-Y242 HydrophobicContact CD2-CE1 4.41Å; L203-L243 HydrophobicContact CD2-CD2 4.07Å; L203-I257 HydrophobicContact CD1-CG2 4.09Å; L203-M258 HydrophobicContact CD1-CE 4.46Å; L203-M258 HydrophobicContact CD1-SD 4.34Å; L203-M258 HydrophobicContact CD2-CE 4.42Å; L203-M258 HydrophobicContact CD2-SD 4.34Å; L203-F261 HydrophobicContact CB-CD2 3.91Å; L203-F261 HydrophobicContact CB-CE2 4.37Å; L203-F261 HydrophobicContact CB-CG 4.14Å; L203-F261 HydrophobicContact CD1-CB 3.73Å; L203-F261 HydrophobicContact CD1-CD1 4.36Å; L203-F261 HydrophobicContact CD1-CG 3.95Å; L203-F261 HydrophobicContact CD2-CB 4.48Å; L203-F261 HydrophobicContact CD2-CD1 3.6Å; L203-F261 HydrophobicContact CD2-CD2 4.16Å; L203-F261 HydrophobicContact CD2-CE1 3.84Å; L203-F261 HydrophobicContact CD2-CE2 4.36Å; L203-F261 HydrophobicContact CD2-CG 3.79Å; L203-F261 HydrophobicContact CD2-CZ 4.22Å; L203-F261 HydrophobicContact CG-CB 4.46Å; L203-F261 HydrophobicContact CG-CD1 4.44Å; L203-F261 HydrophobicContact CG-CD2 4.42Å; L203-F261 HydrophobicContact CG-CG 4.16Å
204	H	96.6	Very high	91.9	Very high	13 Å²	13	54.8 Å²	54.8	6%	0.06	26%	0.255	C	S	.	.	H	α-helix	trans	-58.4	-28.9	-179.3	-174.9	74	0	0	0	114	F200 I202 K208 L219 Y242	F200-H204 WeakPolarHBondContact O-CB 3.45Å; F200-H204 PolarHBondContact O-N 2.98Å; I202-H204 VanDerWaalsContact C-N 3.3Å; I202-H204 PolarHBondContact O-N 2.91Å; H204-K208 VanDerWaalsContact NE2-CE 3.33Å; H204-K208 WeakPolarHBondContact NE2-CE 3.49Å; H204-K208 PolarHBondContact NE2-NZ 3.38Å; H204-K208 VanDerWaalsContact O-CB 3.25Å; H204-K208 WeakPolarHBondContact O-CB 3.45Å; H204-K208 VanDerWaalsContact O-CG 3.3Å; H204-K208 WeakPolarHBondContact O-CG 3.41Å; H204-K208 PolarHBondContact O-N 3.26Å; H204-L219 HydrophobicContact CB-CD2 3.88Å; H204-Y242 AromaticContact CE1-CE2 3.89Å; H204-Y242 AromaticContact ND1-CE2 3.36Å; H204-Y242 WeakPolarHBondContact ND1-CE2 3.31Å; H204-Y242 AromaticContact ND1-CZ 3.37Å; H204-Y242 PolarHBondContact ND1-OH 3.46Å
205	Q	95.2	Very high	92	Very high	112 Å²	112	59.7 Å²	59.7	52%	0.523	28%	0.284	S	S	.	.	H	α-helix	trans	-89.9	-24.7	179	-62.8	-66.4	-16	0	0	112.9	A201 I202 L203 R209	A201-Q205 VanDerWaalsContact O-CG 3.23Å; A201-Q205 WeakPolarHBondContact O-CG 3.39Å; I202-Q205 PolarHBondContact O-N 3.2Å; L203-Q205 PolarHBondContact O-N 2.92Å; L203-Q205 VanDerWaalsContact O-N 3.14Å; Q205-R209 PolarHBondContact O-N 3.25Å
206	N	94.3	Very high	92.2	Very high	46 Å²	46	60.5 Å²	60.5	25%	0.246	29%	0.288	C	S	.	.	H	α-helix	trans	-76	-49.8	171.2	-70.7	-2.7	0	0	0	109.7	I202 L203 K208 R209 E210 I257	I202-N206 PolarHBondContact O-N 3.01Å; L203-N206 PolarHBondContact O-N 2.86Å; L203-N206 VanDerWaalsContact O-N 3.12Å; N206-K208 VanDerWaalsContact C-N 3.29Å; N206-K208 PolarHBondContact O-N 2.83Å; N206-R209 WeakPolarHBondContact O-CB 3.23Å; N206-R209 PolarHBondContact O-N 3.24Å; N206-R209 PolarHBondContact OD1-NH2 2.66Å; N206-E210 PolarHBondContact O-N 2.92Å; N206-E210 VanDerWaalsContact O-N 3.09Å; N206-I257 HydrophobicContact CB-CD1 4.49Å; N206-I257 HydrophobicContact CB-CG2 3.71Å
207	L	94.3	Very high	92.3	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-57.6	-38.7	174.6	-66.2	-179.6	0	0	0	112.6	L203 R209 F211 F216 V246 I252 I257 M258	L203-L207 HydrophobicContact CD1-CD1 3.68Å; L203-L207 HydrophobicContact CD1-CD2 4.28Å; L203-L207 HydrophobicContact CD1-CG 3.78Å; L203-L207 HydrophobicContact CD2-CD1 4.32Å; L203-L207 HydrophobicContact CG-CD1 3.73Å; L203-L207 HydrophobicContact CG-CG 4.14Å; L203-L207 WeakPolarHBondContact O-CB 3.21Å; L203-L207 WeakPolarHBondContact O-CG 3.47Å; L203-L207 PolarHBondContact O-N 2.8Å; L207-R209 VanDerWaalsContact C-N 3.27Å; L207-R209 PolarHBondContact O-N 3.37Å; L207-F211 HydrophobicContact CB-CD2 4.37Å; L207-F211 HydrophobicContact CD2-CD2 4.04Å; L207-F211 HydrophobicContact CD2-CE2 3.79Å; L207-F211 WeakPolarHBondContact O-CB 3.41Å; L207-F211 WeakPolarHBondContact O-CD2 3.27Å; L207-F211 PolarHBondContact O-N 2.98Å; L207-F216 HydrophobicContact CB-CE1 3.74Å; L207-F216 HydrophobicContact CB-CE2 4.44Å; L207-F216 HydrophobicContact CB-CZ 3.57Å; L207-F216 HydrophobicContact CD1-CE1 4.08Å; L207-F216 WeakPolarHBondContact O-CE2 3.31Å; L207-F216 WeakPolarHBondContact O-CZ 3.27Å; L207-V246 HydrophobicContact CD1-CG1 3.88Å; L207-I252 HydrophobicContact CD1-CG2 4.3Å; L207-I252 HydrophobicContact CD2-CG2 3.97Å; L207-I257 HydrophobicContact CD2-CB 3.91Å; L207-I257 HydrophobicContact CD2-CG2 3.61Å; L207-I257 HydrophobicContact CG-CG2 4.02Å; L207-M258 HydrophobicContact CD1-CE 3.86Å
208	K	93.6	Very high	92.3	Very high	94 Å²	94	68.4 Å²	68.4	41%	0.409	32%	0.321	S	S	.	.	H	α-helix	trans	-69.6	-18.2	174.2	-89	-178.7	164.5	172.3	0	115.3	H204 N206 F216	H204-K208 VanDerWaalsContact NE2-CE 3.33Å; H204-K208 WeakPolarHBondContact NE2-CE 3.49Å; H204-K208 PolarHBondContact NE2-NZ 3.38Å; H204-K208 VanDerWaalsContact O-CB 3.25Å; H204-K208 WeakPolarHBondContact O-CB 3.45Å; H204-K208 VanDerWaalsContact O-CG 3.3Å; H204-K208 WeakPolarHBondContact O-CG 3.41Å; H204-K208 PolarHBondContact O-N 3.26Å; N206-K208 VanDerWaalsContact C-N 3.29Å; N206-K208 PolarHBondContact O-N 2.83Å; K208-F216 HydrophobicContact CG-CD2 3.47Å; K208-F216 VanDerWaalsContact CG-CD2 3.47Å; K208-F216 HydrophobicContact CG-CE2 3.91Å; K208-F216 HydrophobicContact CG-CG 4.09Å
209	R	91.6	Very high	92.5	Very high	177 Å²	177	61.3 Å²	61.3	67%	0.668	30%	0.296	S	S	*	.	H	α-helix	trans	-85	-41.8	177.1	-164.4	-177	-48.6	145	24.1	110.6	Q205 N206 L207	Q205-R209 PolarHBondContact O-N 3.25Å; N206-R209 WeakPolarHBondContact O-CB 3.23Å; N206-R209 PolarHBondContact O-N 3.24Å; N206-R209 PolarHBondContact OD1-NH2 2.66Å; L207-R209 VanDerWaalsContact C-N 3.27Å; L207-R209 PolarHBondContact O-N 3.37Å
210	E	88.4	Confident	92.5	Very high	90 Å²	90	60.7 Å²	60.7	42%	0.421	30%	0.296	S	S	.	.	H	α-helix	trans	-72.2	-59.3	178	-163.6	69.3	-174.9	0	0	111.1	Y155 N206 A212 I257	Y155-E210 WeakPolarHBondContact OH-CG 3.38Å; Y155-E210 PolarHBondContact OH-OE1 3.27Å; N206-E210 PolarHBondContact O-N 2.92Å; N206-E210 VanDerWaalsContact O-N 3.09Å; E210-A212 VanDerWaalsContact C-N 3.28Å; E210-A212 PolarHBondContact O-N 3.11Å; E210-A212 VanDerWaalsContact O-N 3.13Å; E210-I257 HydrophobicContact CB-CD1 3.66Å; E210-I257 HydrophobicContact CG-CD1 3.84Å
211	F	88.6	Confident	92	Very high	3 Å²	3	63.3 Å²	63.3	1%	0.013	32%	0.323	C	S	.	.	S	Bend	trans	-92.1	51.5	-177.3	-53.5	-76.6	0	0	0	110.7	Y155 Y157 L207 N213 F214 F216 I252	Y155-F211 HydrophobicContact CD1-CD1 4.3Å; Y155-F211 AromaticContact CD1-CE1 3.76Å; Y155-F211 HydrophobicContact CD1-CE1 3.76Å; Y155-F211 AromaticContact CD2-CD1 3.36Å; Y155-F211 HydrophobicContact CD2-CD1 3.36Å; Y155-F211 AromaticContact CD2-CE1 3.68Å; Y155-F211 HydrophobicContact CD2-CE1 3.68Å; Y155-F211 HydrophobicContact CD2-CG 4.47Å; Y155-F211 HydrophobicContact CE1-CD1 4.38Å; Y155-F211 AromaticContact CE1-CE1 3.71Å; Y155-F211 HydrophobicContact CE1-CE1 3.71Å; Y155-F211 HydrophobicContact CE1-CZ 4.48Å; Y155-F211 AromaticContact CE2-CD1 3.45Å; Y155-F211 HydrophobicContact CE2-CD1 3.45Å; Y155-F211 VanDerWaalsContact CE2-CD1 3.45Å; Y155-F211 AromaticContact CE2-CE1 3.61Å; Y155-F211 HydrophobicContact CE2-CE1 3.61Å; Y155-F211 HydrophobicContact CE2-CG 4.36Å; Y155-F211 AromaticContact CG-CD1 3.8Å; Y155-F211 HydrophobicContact CG-CD1 3.8Å; Y155-F211 AromaticContact CG-CE1 3.74Å; Y155-F211 HydrophobicContact CG-CE1 3.74Å; Y155-F211 AromaticContact CZ-CD1 3.99Å; Y155-F211 AromaticContact CZ-CE1 3.64Å; Y157-F211 HydrophobicContact CE1-CB 4.39Å; Y157-F211 AromaticContact CE1-CD1 3.8Å; Y157-F211 HydrophobicContact CE1-CD1 3.8Å; Y157-F211 HydrophobicContact CE1-CG 4.45Å; Y157-F211 WeakPolarHBondContact OH-CB 3.43Å; L207-F211 HydrophobicContact CB-CD2 4.37Å; L207-F211 HydrophobicContact CD2-CD2 4.04Å; L207-F211 HydrophobicContact CD2-CE2 3.79Å; L207-F211 WeakPolarHBondContact O-CB 3.41Å; L207-F211 WeakPolarHBondContact O-CD2 3.27Å; L207-F211 PolarHBondContact O-N 2.98Å; F211-N213 PolarHBondContact O-N 3.45Å; F211-N213 VanDerWaalsContact O-N 3.1Å; F211-F214 HydrophobicContact CB-CB 4Å; F211-F214 WeakPolarHBondContact O-CB 3.47Å; F211-F214 PolarHBondContact O-N 2.84Å; F211-F216 HydrophobicContact CB-CE2 3.9Å; F211-F216 HydrophobicContact CB-CZ 3.82Å; F211-F216 HydrophobicContact CD2-CZ 4.23Å; F211-F216 HydrophobicContact CG-CZ 4.41Å; F211-I252 HydrophobicContact CD1-CG1 4.01Å; F211-I252 HydrophobicContact CD2-CG1 4.29Å; F211-I252 HydrophobicContact CD2-CG2 4.02Å; F211-I252 HydrophobicContact CE1-CG1 4.1Å; F211-I252 HydrophobicContact CE2-CB 4.44Å; F211-I252 HydrophobicContact CE2-CG1 4.39Å; F211-I252 HydrophobicContact CE2-CG2 3.92Å; F211-I252 HydrophobicContact CG-CD1 4.34Å; F211-I252 HydrophobicContact CG-CG1 4.11Å; F211-I252 HydrophobicContact CZ-CG1 4.31Å; F211-I252 HydrophobicContact CZ-CG2 4.45Å
212	A	84.7	Confident	91.4	Very high	58 Å²	58	70 Å²	70	48%	0.479	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-23.9	-170	0	0	0	0	0	114.5	E210	E210-A212 VanDerWaalsContact C-N 3.28Å; E210-A212 PolarHBondContact O-N 3.11Å; E210-A212 VanDerWaalsContact O-N 3.13Å
213	N	84.1	Confident	90.7	Very high	65 Å²	65	73.1 Å²	73.1	35%	0.348	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-2.4	174.9	60.8	-16.2	0	0	0	114	Y157 F211	Y157-N213 WeakPolarHBondContact CE2-OD1 3.48Å; Y157-N213 PolarHBondContact OH-OD1 2.96Å; F211-N213 PolarHBondContact O-N 3.45Å; F211-N213 VanDerWaalsContact O-N 3.1Å
214	F	88.1	Confident	89.5	Confident	38 Å²	38	78 Å²	78	17%	0.167	39%	0.388	C	S	.	.	S	Bend	trans	-87.9	131.3	177.6	-174.2	-107.7	0	0	0	113	Y157 F211 F216 I249 I252	Y157-F214 AromaticContact CD1-CD2 3.71Å; Y157-F214 HydrophobicContact CD1-CD2 3.71Å; Y157-F214 HydrophobicContact CD1-CE2 4.33Å; Y157-F214 HydrophobicContact CD1-CG 4.36Å; Y157-F214 HydrophobicContact CD2-CB 4.48Å; Y157-F214 AromaticContact CD2-CD2 3.88Å; Y157-F214 HydrophobicContact CD2-CD2 3.88Å; Y157-F214 HydrophobicContact CE1-CB 4.01Å; Y157-F214 HydrophobicContact CE1-CD2 4.04Å; Y157-F214 HydrophobicContact CE1-CG 4.26Å; Y157-F214 HydrophobicContact CE2-CB 3.96Å; Y157-F214 HydrophobicContact CE2-CD2 4.21Å; Y157-F214 AromaticContact CG-CD2 3.61Å; Y157-F214 HydrophobicContact CG-CD2 3.61Å; Y157-F214 HydrophobicContact CG-CE2 4.21Å; F211-F214 HydrophobicContact CB-CB 4Å; F211-F214 WeakPolarHBondContact O-CB 3.47Å; F211-F214 PolarHBondContact O-N 2.84Å; F214-F216 VanDerWaalsContact C-N 3.34Å; F214-F216 HydrophobicContact CB-CD2 4.34Å; F214-F216 HydrophobicContact CB-CE2 3.97Å; F214-F216 HydrophobicContact CB-CZ 4.42Å; F214-F216 HydrophobicContact CD1-CB 4.43Å; F214-F216 AromaticContact CD1-CD1 3.76Å; F214-F216 HydrophobicContact CD1-CD1 3.76Å; F214-F216 AromaticContact CD1-CD2 3.74Å; F214-F216 HydrophobicContact CD1-CD2 3.74Å; F214-F216 AromaticContact CD1-CE1 3.76Å; F214-F216 HydrophobicContact CD1-CE1 3.76Å; F214-F216 AromaticContact CD1-CE2 3.75Å; F214-F216 HydrophobicContact CD1-CE2 3.75Å; F214-F216 AromaticContact CD1-CG 3.74Å; F214-F216 HydrophobicContact CD1-CG 3.74Å; F214-F216 AromaticContact CD1-CZ 3.74Å; F214-F216 HydrophobicContact CD1-CZ 3.74Å; F214-F216 AromaticContact CE1-CD1 3.99Å; F214-F216 HydrophobicContact CE1-CD1 3.99Å; F214-F216 HydrophobicContact CE1-CE1 4.17Å; F214-F216 HydrophobicContact CE1-CG 4.24Å; F214-F216 HydrophobicContact CG-CE2 4.36Å; F214-F216 WeakPolarHBondContact O-CD2 3.36Å; F214-F216 PolarHBondContact O-N 3.27Å; F214-I249 HydrophobicContact CE2-CG1 3.95Å; F214-I249 HydrophobicContact CE2-CG2 4.45Å; F214-I249 HydrophobicContact CZ-CG1 3.72Å; F214-I252 HydrophobicContact CB-CD1 4.32Å; F214-I252 HydrophobicContact CD1-CD1 3.55Å; F214-I252 HydrophobicContact CD2-CD1 3.94Å; F214-I252 HydrophobicContact CE1-CD1 3.75Å; F214-I252 HydrophobicContact CE2-CD1 4.12Å; F214-I252 HydrophobicContact CG-CD1 3.65Å; F214-I252 HydrophobicContact CZ-CD1 4.04Å
215	T	92.5	Very high	88.8	Confident	132 Å²	132	84.5 Å²	84.5	81%	0.81	42%	0.416	S	S	*	.			trans	-78.8	80.5	175.7	-57.8	0	0	0	0	110.9
216	F	94.6	Very high	88.1	Confident	20 Å²	20	84.6 Å²	84.6	9%	0.088	43%	0.429	C	S	.	.			trans	-57.9	140.4	179.6	-79.4	-82	0	0	0	113.9	L207 K208 F211 F214 V246 I252	L207-F216 HydrophobicContact CB-CE1 3.74Å; L207-F216 HydrophobicContact CB-CE2 4.44Å; L207-F216 HydrophobicContact CB-CZ 3.57Å; L207-F216 HydrophobicContact CD1-CE1 4.08Å; L207-F216 WeakPolarHBondContact O-CE2 3.31Å; L207-F216 WeakPolarHBondContact O-CZ 3.27Å; K208-F216 HydrophobicContact CG-CD2 3.47Å; K208-F216 VanDerWaalsContact CG-CD2 3.47Å; K208-F216 HydrophobicContact CG-CE2 3.91Å; K208-F216 HydrophobicContact CG-CG 4.09Å; F211-F216 HydrophobicContact CB-CE2 3.9Å; F211-F216 HydrophobicContact CB-CZ 3.82Å; F211-F216 HydrophobicContact CD2-CZ 4.23Å; F211-F216 HydrophobicContact CG-CZ 4.41Å; F214-F216 VanDerWaalsContact C-N 3.34Å; F214-F216 HydrophobicContact CB-CD2 4.34Å; F214-F216 HydrophobicContact CB-CE2 3.97Å; F214-F216 HydrophobicContact CB-CZ 4.42Å; F214-F216 HydrophobicContact CD1-CB 4.43Å; F214-F216 AromaticContact CD1-CD1 3.76Å; F214-F216 HydrophobicContact CD1-CD1 3.76Å; F214-F216 AromaticContact CD1-CD2 3.74Å; F214-F216 HydrophobicContact CD1-CD2 3.74Å; F214-F216 AromaticContact CD1-CE1 3.76Å; F214-F216 HydrophobicContact CD1-CE1 3.76Å; F214-F216 AromaticContact CD1-CE2 3.75Å; F214-F216 HydrophobicContact CD1-CE2 3.75Å; F214-F216 AromaticContact CD1-CG 3.74Å; F214-F216 HydrophobicContact CD1-CG 3.74Å; F214-F216 AromaticContact CD1-CZ 3.74Å; F214-F216 HydrophobicContact CD1-CZ 3.74Å; F214-F216 AromaticContact CE1-CD1 3.99Å; F214-F216 HydrophobicContact CE1-CD1 3.99Å; F214-F216 HydrophobicContact CE1-CE1 4.17Å; F214-F216 HydrophobicContact CE1-CG 4.24Å; F214-F216 HydrophobicContact CG-CE2 4.36Å; F214-F216 WeakPolarHBondContact O-CD2 3.36Å; F214-F216 PolarHBondContact O-N 3.27Å; F216-V246 HydrophobicContact CD1-CG2 4.03Å; F216-V246 HydrophobicContact CE1-CG1 4.24Å; F216-V246 HydrophobicContact CE1-CG2 4.33Å; F216-I252 HydrophobicContact CE1-CD1 4.42Å; F216-I252 HydrophobicContact CE1-CG2 4.4Å; F216-I252 HydrophobicContact CZ-CD1 4.33Å
217	P	94.5	Very high	87.8	Confident	32 Å²	32	84.1 Å²	84.1	21%	0.208	43%	0.426	C	S	.	.			trans	-61.7	157.2	169.3	26.6	-33.5	0	0	0	111.5	L219 Y242 K245 V246	P217-L219 PolarHBondContact O-N 3.01Å; P217-Y242 HydrophobicContact CB-CD2 4.36Å; P217-Y242 HydrophobicContact CG-CD2 3.8Å; P217-Y242 HydrophobicContact CG-CE2 3.93Å; P217-Y242 WeakPolarHBondContact O-CE2 3.39Å; P217-K245 HydrophobicContact CB-CB 4.36Å; P217-K245 HydrophobicContact CB-CD 4.4Å; P217-K245 HydrophobicContact CG-CB 3.96Å; P217-V246 HydrophobicContact CG-CG2 3.67Å
218	R	92.9	Very high	87.6	Confident	244 Å²	244	86.9 Å²	86.9	92%	0.921	45%	0.446	S	S	*	.			trans	-70	111.9	179.4	-66.5	-176.7	179.4	-175.7	0.1	110.4
219	L	95.1	Very high	87.5	Confident	26 Å²	26	87.7 Å²	87.7	14%	0.136	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-63.5	141.2	165.7	-170.6	76.4	0	0	0	109.6	Y197 F200 A201 H204 P217 L239 Y242	Y197-L219 HydrophobicContact CE2-CD2 4.45Å; F200-L219 HydrophobicContact CB-CD1 4.42Å; A201-L219 HydrophobicContact CB-CD2 4.12Å; H204-L219 HydrophobicContact CB-CD2 3.88Å; P217-L219 PolarHBondContact O-N 3.01Å; L219-L239 HydrophobicContact CD1-CD2 3.77Å; L219-Y242 HydrophobicContact CB-CD2 4.18Å; L219-Y242 HydrophobicContact CB-CE2 4.26Å; L219-Y242 HydrophobicContact CD1-CD1 3.66Å; L219-Y242 HydrophobicContact CD1-CD2 3.96Å; L219-Y242 HydrophobicContact CD1-CE1 3.89Å; L219-Y242 HydrophobicContact CD1-CE2 4.22Å; L219-Y242 HydrophobicContact CD1-CG 3.71Å
220	P	92.9	Very high	87.5	Confident	24 Å²	24	87 Å²	87	16%	0.156	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-52.5	138.8	171.4	-29	37.1	0	0	0	112.4	Y197 R235 G238 L239	Y197-P220 VanDerWaalsContact CE2-O 3.28Å; Y197-P220 WeakPolarHBondContact CE2-O 3.44Å; Y197-P220 PolarHBondContact OH-O 3.2Å; P220-R235 HydrophobicContact CB-CG 4.24Å; P220-G238 WeakPolarHBondContact CD-O 3.34Å; P220-G238 WeakPolarHBondContact CG-O 3.38Å; P220-L239 HydrophobicContact CG-CD2 4.13Å; P220-L239 HydrophobicContact CG-CG 4.3Å
221	G	85.9	Confident	87.7	Confident	55 Å²	55	86.4 Å²	86.4	57%	0.567	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-70.3	157	-174.6	0	0	0	0	0	114.9	R235	G221-R235 PolarHBondContact O-NH2 2.92Å
222	K	82.1	Confident	88	Confident	155 Å²	155	86.8 Å²	86.8	67%	0.674	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-66.4	149.8	162.2	-78.1	176.7	-178.3	176.3	0	109.9	Y197	Y197-K222 HydrophobicContact CE1-CD 4.42Å; Y197-K222 HydrophobicContact CE1-CG 3.48Å; Y197-K222 VanDerWaalsContact CE1-CG 3.48Å
223	W	78.9	Confident	88.4	Confident	147 Å²	147	86.1 Å²	86.1	56%	0.557	44%	0.443	S	S	*	.			trans	-129.3	139.1	172	-164.2	-112.9	0	0	0	107.9	F225 L227	W223-F225 VanDerWaalsContact C-N 3.31Å; W223-F225 AromaticContact NE1-CD2 3.85Å; W223-F225 PolarHBondContact O-N 2.65Å; W223-L227 HydrophobicContact CB-CD2 3.74Å; W223-L227 HydrophobicContact CG-CD2 3.82Å
224	P	71.6	Confident	88.9	Confident	107 Å²	107	85.5 Å²	85.5	70%	0.695	45%	0.447	S	S	*	.	S	Bend	trans	-80.3	-10.3	-173.9	31.3	-34.9	0	0	0	114
225	F	80.8	Confident	89.2	Confident	149 Å²	149	85.4 Å²	85.4	65%	0.654	45%	0.446	S	S	*	.	S	Bend	trans	-113.9	169.5	179.7	-53.6	-64.2	0	0	0	111.4	W223	W223-F225 VanDerWaalsContact C-N 3.31Å; W223-F225 AromaticContact NE1-CD2 3.85Å; W223-F225 PolarHBondContact O-N 2.65Å
226	S	80.7	Confident	89.4	Confident	115 Å²	115	80.8 Å²	80.8	80%	0.804	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-54.8	144.6	165.5	42.8	0	0	0	0	110.6
227	L	87.8	Confident	89.5	Confident	35 Å²	35	85.5 Å²	85.5	18%	0.183	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-90.8	146	175.3	-69.6	-164.6	0	0	0	110.5	W223 Q231 L232 R235	W223-L227 HydrophobicContact CB-CD2 3.74Å; W223-L227 HydrophobicContact CG-CD2 3.82Å; L227-Q231 HydrophobicContact CB-CB 3.9Å; L227-Q231 HydrophobicContact CD1-CB 4.04Å; L227-Q231 HydrophobicContact CD2-CB 3.94Å; L227-Q231 HydrophobicContact CG-CB 4.17Å; L227-L232 HydrophobicContact CB-CD2 3.84Å; L227-L232 HydrophobicContact CB-CG 3.87Å; L227-L232 HydrophobicContact CD1-CD2 4.01Å; L227-L232 HydrophobicContact CG-CD2 4.43Å; L227-R235 HydrophobicContact CD1-CB 4.46Å; L227-R235 VanDerWaalsContact CD1-CZ 3.49Å
228	S	90.8	Very high	89.6	Confident	58 Å²	58	84.8 Å²	84.8	41%	0.406	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-73.1	160.6	162.9	70.2	0	0	0	0	111.2	Q230 Q231 L232	S228-Q230 PolarHBondContact O-N 2.8Å; S228-Q231 CarbonylContact O-C 3.53Å; S228-Q231 WeakPolarHBondContact O-CA 3.35Å; S228-Q231 WeakPolarHBondContact O-CB 3.49Å; S228-Q231 PolarHBondContact O-N 3.07Å; S228-Q231 WeakPolarHBondContact OG-CG 3.44Å; S228-Q231 PolarHBondContact OG-N 3.29Å; S228-L232 PolarHBondContact O-N 3.5Å
229	E	91.3	Very high	89.8	Confident	111 Å²	111	73.1 Å²	73.1	52%	0.519	39%	0.385	S	S	.	.	H	α-helix	trans	-52.8	-37.9	175.9	-64	-63.4	118	0	0	112.7	Y170 H172 Q231 L232 D233	Y170-E229 PolarHBondContact OH-O 2.7Å; Y170-E229 PolarHBondContact OH-OE2 2.74Å; H172-E229 IonicContact CE1-OE1 4Å; E229-Q231 PolarHBondContact O-N 3.07Å; E229-L232 PolarHBondContact O-N 3.19Å; E229-D233 PolarHBondContact O-N 3.03Å
230	Q	92.1	Very high	89.9	Confident	163 Å²	163	74.1 Å²	74.1	76%	0.762	39%	0.389	S	S	*	.	H	α-helix	trans	-64.2	-38.8	175.4	-170.3	-175.4	16.9	0	0	112.1	S228 A234	S228-Q230 PolarHBondContact O-N 2.8Å; Q230-A234 VanDerWaalsContact O-CB 3.32Å; Q230-A234 WeakPolarHBondContact O-CB 3.38Å; Q230-A234 PolarHBondContact O-N 3.06Å
231	Q	92.6	Very high	90	Very high	78 Å²	78	77.5 Å²	77.5	36%	0.364	40%	0.403	S	S	.	.	H	α-helix	trans	-74.7	-30.6	175.1	-67.8	171	-33	0	0	111.9	L227 S228 E229 R235	L227-Q231 HydrophobicContact CB-CB 3.9Å; L227-Q231 HydrophobicContact CD1-CB 4.04Å; L227-Q231 HydrophobicContact CD2-CB 3.94Å; L227-Q231 HydrophobicContact CG-CB 4.17Å; S228-Q231 CarbonylContact O-C 3.53Å; S228-Q231 WeakPolarHBondContact O-CA 3.35Å; S228-Q231 WeakPolarHBondContact O-CB 3.49Å; S228-Q231 PolarHBondContact O-N 3.07Å; S228-Q231 WeakPolarHBondContact OG-CG 3.44Å; S228-Q231 PolarHBondContact OG-N 3.29Å; E229-Q231 PolarHBondContact O-N 3.07Å; Q231-R235 WeakPolarHBondContact O-CB 3.19Å; Q231-R235 PolarHBondContact O-N 3.39Å
232	L	93.3	Very high	90.5	Very high	10 Å²	10	75 Å²	75	5%	0.052	38%	0.376	C	S	.	.	H	α-helix	trans	-66.9	-43.5	173.9	-71.5	174	0	0	0	111.6	Y170 V181 L227 S228 E229 R235 R236	Y170-L232 HydrophobicContact CD1-CB 4.42Å; Y170-L232 HydrophobicContact CD2-CB 4.46Å; Y170-L232 HydrophobicContact CD2-CD1 4.44Å; Y170-L232 HydrophobicContact CE1-CB 3.82Å; Y170-L232 HydrophobicContact CE2-CB 3.86Å; Y170-L232 HydrophobicContact CE2-CD1 3.82Å; Y170-L232 HydrophobicContact CE2-CG 4.44Å; Y170-L232 VanDerWaalsContact CZ-CB 3.49Å; V181-L232 HydrophobicContact CB-CD2 4.33Å; V181-L232 HydrophobicContact CG1-CD2 4.25Å; V181-L232 HydrophobicContact CG2-CD1 4.14Å; V181-L232 HydrophobicContact CG2-CD2 4.04Å; L227-L232 HydrophobicContact CB-CD2 3.84Å; L227-L232 HydrophobicContact CB-CG 3.87Å; L227-L232 HydrophobicContact CD1-CD2 4.01Å; L227-L232 HydrophobicContact CG-CD2 4.43Å; S228-L232 PolarHBondContact O-N 3.5Å; E229-L232 PolarHBondContact O-N 3.19Å; L232-R235 PolarHBondContact O-N 2.94Å; L232-R236 WeakPolarHBondContact O-CB 3.46Å; L232-R236 PolarHBondContact O-N 2.8Å
233	D	93.1	Very high	91.2	Very high	45 Å²	45	67.7 Å²	67.7	24%	0.241	34%	0.344	C	S	.	.	H	α-helix	trans	-69.2	-39.6	172.3	174.3	72.9	0	0	0	112.6	Y170 E229 R235 R236 R237	Y170-D233 HydrophobicContact CE1-CB 4.27Å; E229-D233 PolarHBondContact O-N 3.03Å; D233-R235 VanDerWaalsContact C-N 3.27Å; D233-R235 PolarHBondContact O-N 3.45Å; D233-R236 VanDerWaalsContact O-CB 3.32Å; D233-R236 WeakPolarHBondContact O-CB 3.24Å; D233-R236 PolarHBondContact O-N 3.07Å; D233-R236 VanDerWaalsContact O-N 3.1Å; D233-R236 IonicContact OD1-CZ 3.83Å; D233-R236 VanDerWaalsContact OD1-CZ 3.31Å; D233-R236 IonicContact OD1-NE 2.92Å; D233-R236 PolarHBondContact OD1-NE 3.36Å; D233-R236 IonicContact OD1-NH2 3.47Å; D233-R236 PolarHBondContact OD1-NH2 2.98Å; D233-R237 PolarHBondContact O-N 3.39Å; D233-R237 IonicContact OD1-NE 2.7Å; D233-R237 IonicContact OD2-CZ 3.25Å; D233-R237 IonicContact OD2-NE 3.71Å; D233-R237 PolarHBondContact OD2-NE 2.99Å; D233-R237 IonicContact OD2-NH2 2.81Å; D233-R237 PolarHBondContact OD2-NH2 3.15Å
234	A	94.8	Very high	91.8	Very high	52 Å²	52	65.6 Å²	65.6	43%	0.43	34%	0.341	S	S	.	.	H	α-helix	trans	-59.7	-40.1	173.7	0	0	0	0	0	111.6	Q230 G238	Q230-A234 VanDerWaalsContact O-CB 3.32Å; Q230-A234 WeakPolarHBondContact O-CB 3.38Å; Q230-A234 PolarHBondContact O-N 3.06Å; A234-G238 PolarHBondContact O-N 2.95Å; A234-G238 VanDerWaalsContact O-N 3.07Å
235	R	95.2	Very high	92.8	Very high	36 Å²	36	64.8 Å²	64.8	14%	0.136	33%	0.326	C	S	.	.	H	α-helix	trans	-67	-41.6	171.5	-179.2	175.4	-82.8	158.5	4	111.7	Y183 Y197 P220 G221 L227 Q231 L232 D233 R237 G238 L239	Y183-R235 VanDerWaalsContact OH-CD 3.26Å; Y183-R235 WeakPolarHBondContact OH-CD 3.4Å; Y197-R235 HydrophobicContact CD2-CG 4.21Å; P220-R235 HydrophobicContact CB-CG 4.24Å; G221-R235 PolarHBondContact O-NH2 2.92Å; L227-R235 HydrophobicContact CD1-CB 4.46Å; L227-R235 VanDerWaalsContact CD1-CZ 3.49Å; Q231-R235 WeakPolarHBondContact O-CB 3.19Å; Q231-R235 PolarHBondContact O-N 3.39Å; L232-R235 PolarHBondContact O-N 2.94Å; D233-R235 VanDerWaalsContact C-N 3.27Å; D233-R235 PolarHBondContact O-N 3.45Å; R235-R237 PolarHBondContact O-N 3.14Å; R235-G238 PolarHBondContact O-N 3.09Å; R235-L239 HydrophobicContact CG-CD1 4.1Å; R235-L239 HydrophobicContact CG-CG 4.28Å; R235-L239 VanDerWaalsContact O-CG 3.29Å; R235-L239 WeakPolarHBondContact O-CG 3.43Å; R235-L239 PolarHBondContact O-N 3.34Å
236	R	96.6	Very high	93.4	Very high	34 Å²	34	57.7 Å²	57.7	13%	0.128	30%	0.295	C	S	.	.	H	α-helix	trans	-53.8	-53.6	175.9	-175.4	-161.5	66.2	71.6	-3.6	111.2	V167 Y170 Y183 L232 D233 G238 L239 E240	V167-R236 HydrophobicContact CB-CG 4.41Å; V167-R236 HydrophobicContact CG1-CG 3.99Å; V167-R236 WeakPolarHBondContact O-CD 3.44Å; V167-R236 WeakPolarHBondContact O-CG 3.28Å; V167-R236 PolarHBondContact O-NH1 2.87Å; Y170-R236 HydrophobicContact CD1-CB 4.19Å; Y170-R236 HydrophobicContact CD1-CG 4.39Å; Y183-R236 HydrophobicContact CD1-CB 4.02Å; Y183-R236 HydrophobicContact CD1-CG 4.19Å; Y183-R236 HydrophobicContact CE1-CB 3.92Å; L232-R236 WeakPolarHBondContact O-CB 3.46Å; L232-R236 PolarHBondContact O-N 2.8Å; D233-R236 VanDerWaalsContact O-CB 3.32Å; D233-R236 WeakPolarHBondContact O-CB 3.24Å; D233-R236 PolarHBondContact O-N 3.07Å; D233-R236 VanDerWaalsContact O-N 3.1Å; D233-R236 IonicContact OD1-CZ 3.83Å; D233-R236 VanDerWaalsContact OD1-CZ 3.31Å; D233-R236 IonicContact OD1-NE 2.92Å; D233-R236 PolarHBondContact OD1-NE 3.36Å; D233-R236 IonicContact OD1-NH2 3.47Å; D233-R236 PolarHBondContact OD1-NH2 2.98Å; R236-G238 PolarHBondContact O-N 3.43Å; R236-L239 PolarHBondContact O-N 3.42Å; R236-L239 VanDerWaalsContact O-N 3.16Å; R236-E240 IonicContact CZ-OE1 2.82Å; R236-E240 IonicContact NH1-OE1 3.28Å; R236-E240 PolarHBondContact NH1-OE1 2.95Å; R236-E240 IonicContact NH1-OE2 3.31Å; R236-E240 PolarHBondContact NH1-OE2 3.27Å; R236-E240 WeakPolarHBondContact O-CB 3.25Å; R236-E240 PolarHBondContact O-N 2.9Å
237	R	96.1	Very high	93.9	Very high	119 Å²	119	52.3 Å²	52.3	45%	0.449	26%	0.257	S	S	.	.	H	α-helix	trans	-61.8	-41.4	177	-73.5	-175.3	-83.6	134.4	-5.2	112.6	D233 R235 L239 E240 E241	D233-R237 PolarHBondContact O-N 3.39Å; D233-R237 IonicContact OD1-NE 2.7Å; D233-R237 IonicContact OD2-CZ 3.25Å; D233-R237 IonicContact OD2-NE 3.71Å; D233-R237 PolarHBondContact OD2-NE 2.99Å; D233-R237 IonicContact OD2-NH2 2.81Å; D233-R237 PolarHBondContact OD2-NH2 3.15Å; R235-R237 PolarHBondContact O-N 3.14Å; R237-L239 VanDerWaalsContact C-N 3.27Å; R237-L239 PolarHBondContact O-N 3.36Å; R237-E240 WeakPolarHBondContact O-CB 3.49Å; R237-E240 PolarHBondContact O-N 3.19Å; R237-E241 WeakPolarHBondContact O-CB 3.46Å; R237-E241 PolarHBondContact O-N 3.39Å
238	G	97.1	Very high	93.9	Very high	17 Å²	17	52.2 Å²	52.2	18%	0.175	26%	0.26	C	S	.	.	H	α-helix	trans	-66.8	-24.5	175.9	0	0	0	0	0	114.5	P220 A234 R235 R236 Y242	P220-G238 WeakPolarHBondContact CD-O 3.34Å; P220-G238 WeakPolarHBondContact CG-O 3.38Å; A234-G238 PolarHBondContact O-N 2.95Å; A234-G238 VanDerWaalsContact O-N 3.07Å; R235-G238 PolarHBondContact O-N 3.09Å; R236-G238 PolarHBondContact O-N 3.43Å; G238-Y242 VanDerWaalsContact O-CB 3.25Å; G238-Y242 WeakPolarHBondContact O-CB 3.47Å; G238-Y242 PolarHBondContact O-N 2.86Å
239	L	97.4	Very high	93.7	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-80.7	-36.5	172.1	-67.1	175.2	0	0	0	111.7	Y183 Y197 F200 L219 P220 R235 R236 R237 Y242 L243	Y183-L239 HydrophobicContact CD1-CD1 4.07Å; Y183-L239 HydrophobicContact CD2-CD1 3.74Å; Y183-L239 HydrophobicContact CE1-CD1 4.31Å; Y183-L239 HydrophobicContact CE2-CD1 4Å; Y183-L239 HydrophobicContact CG-CD1 3.8Å; Y197-L239 HydrophobicContact CD2-CD1 4.46Å; Y197-L239 HydrophobicContact CD2-CD2 4.31Å; Y197-L239 HydrophobicContact CE2-CD2 4.48Å; F200-L239 HydrophobicContact CB-CD2 3.97Å; F200-L239 HydrophobicContact CD1-CB 4.27Å; F200-L239 HydrophobicContact CD1-CD1 4.17Å; F200-L239 HydrophobicContact CD1-CD2 3.65Å; F200-L239 HydrophobicContact CD1-CG 4.23Å; F200-L239 HydrophobicContact CD2-CD1 4.17Å; F200-L239 HydrophobicContact CE1-CB 3.96Å; F200-L239 HydrophobicContact CE1-CD1 4.04Å; F200-L239 HydrophobicContact CE1-CD2 4.19Å; F200-L239 HydrophobicContact CE1-CG 4.28Å; F200-L239 HydrophobicContact CE2-CD1 4.07Å; F200-L239 HydrophobicContact CG-CD1 4.21Å; F200-L239 HydrophobicContact CG-CD2 3.86Å; F200-L239 HydrophobicContact CZ-CD1 4.01Å; L219-L239 HydrophobicContact CD1-CD2 3.77Å; P220-L239 HydrophobicContact CG-CD2 4.13Å; P220-L239 HydrophobicContact CG-CG 4.3Å; R235-L239 HydrophobicContact CG-CD1 4.1Å; R235-L239 HydrophobicContact CG-CG 4.28Å; R235-L239 VanDerWaalsContact O-CG 3.29Å; R235-L239 WeakPolarHBondContact O-CG 3.43Å; R235-L239 PolarHBondContact O-N 3.34Å; R236-L239 PolarHBondContact O-N 3.42Å; R236-L239 VanDerWaalsContact O-N 3.16Å; R237-L239 VanDerWaalsContact C-N 3.27Å; R237-L239 PolarHBondContact O-N 3.36Å; L239-Y242 PolarHBondContact O-N 2.97Å; L239-L243 WeakPolarHBondContact O-CG 3.33Å; L239-L243 PolarHBondContact O-N 2.98Å
240	E	96.4	Very high	93.2	Very high	46 Å²	46	49.4 Å²	49.4	22%	0.215	24%	0.236	C	C	.	.	H	α-helix	trans	-58.1	-57.1	171.5	-173.4	160.7	57.9	0	0	111	V167 R236 R237 Y242 L243 E244	V167-E240 HydrophobicContact CB-CB 4.04Å; V167-E240 HydrophobicContact CG2-CB 4.09Å; V167-E240 PolarHBondContact N-OE2 3.44Å; R236-E240 IonicContact CZ-OE1 2.82Å; R236-E240 IonicContact NH1-OE1 3.28Å; R236-E240 PolarHBondContact NH1-OE1 2.95Å; R236-E240 IonicContact NH1-OE2 3.31Å; R236-E240 PolarHBondContact NH1-OE2 3.27Å; R236-E240 WeakPolarHBondContact O-CB 3.25Å; R236-E240 PolarHBondContact O-N 2.9Å; R237-E240 WeakPolarHBondContact O-CB 3.49Å; R237-E240 PolarHBondContact O-N 3.19Å; E240-Y242 VanDerWaalsContact C-N 3.27Å; E240-Y242 PolarHBondContact O-N 3.48Å; E240-L243 PolarHBondContact O-N 3.41Å; E240-E244 WeakPolarHBondContact O-CB 3.42Å; E240-E244 PolarHBondContact O-N 2.61Å
241	E	95.8	Very high	92.6	Very high	96 Å²	96	43.8 Å²	43.8	45%	0.449	21%	0.213	S	C	.	.	H	α-helix	trans	-58.7	-33.8	174.8	-77.7	-171.4	-122.3	0	0	113.8	R237 K245	R237-E241 WeakPolarHBondContact O-CB 3.46Å; R237-E241 PolarHBondContact O-N 3.39Å; E241-K245 WeakPolarHBondContact O-CB 3.2Å; E241-K245 WeakPolarHBondContact O-CD 3.18Å; E241-K245 VanDerWaalsContact O-CG 3.23Å; E241-K245 WeakPolarHBondContact O-CG 3.38Å; E241-K245 PolarHBondContact O-N 3.24Å; E241-K245 IonicContact OE2-NZ 3.97Å; E241-K245 PolarHBondContact OE2-NZ 2.91Å
242	Y	97	Very high	92.3	Very high	3 Å²	3	40.1 Å²	40.1	1%	0.012	20%	0.196	C	C	.	.	H	α-helix	trans	-69	-48.4	178.1	173.1	-93.2	0	0	0	110.7	L203 H204 P217 L219 G238 L239 E240 K245 V246	L203-Y242 HydrophobicContact CD2-CE1 4.41Å; H204-Y242 AromaticContact CE1-CE2 3.89Å; H204-Y242 AromaticContact ND1-CE2 3.36Å; H204-Y242 WeakPolarHBondContact ND1-CE2 3.31Å; H204-Y242 AromaticContact ND1-CZ 3.37Å; H204-Y242 PolarHBondContact ND1-OH 3.46Å; P217-Y242 HydrophobicContact CB-CD2 4.36Å; P217-Y242 HydrophobicContact CG-CD2 3.8Å; P217-Y242 HydrophobicContact CG-CE2 3.93Å; P217-Y242 WeakPolarHBondContact O-CE2 3.39Å; L219-Y242 HydrophobicContact CB-CD2 4.18Å; L219-Y242 HydrophobicContact CB-CE2 4.26Å; L219-Y242 HydrophobicContact CD1-CD1 3.66Å; L219-Y242 HydrophobicContact CD1-CD2 3.96Å; L219-Y242 HydrophobicContact CD1-CE1 3.89Å; L219-Y242 HydrophobicContact CD1-CE2 4.22Å; L219-Y242 HydrophobicContact CD1-CG 3.71Å; G238-Y242 VanDerWaalsContact O-CB 3.25Å; G238-Y242 WeakPolarHBondContact O-CB 3.47Å; G238-Y242 PolarHBondContact O-N 2.86Å; L239-Y242 PolarHBondContact O-N 2.97Å; E240-Y242 VanDerWaalsContact C-N 3.27Å; E240-Y242 PolarHBondContact O-N 3.48Å; Y242-K245 PolarHBondContact O-N 3.47Å; Y242-V246 HydrophobicContact CD2-CG2 4.35Å; Y242-V246 HydrophobicContact CE1-CG2 4.08Å; Y242-V246 HydrophobicContact CE2-CG2 3.85Å; Y242-V246 WeakPolarHBondContact O-CB 3.49Å; Y242-V246 VanDerWaalsContact O-CG2 3.31Å; Y242-V246 WeakPolarHBondContact O-CG2 3.41Å; Y242-V246 PolarHBondContact O-N 2.85Å
243	L	95.6	Very high	91.8	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-67	-40.8	179.7	-74.8	177.2	0	0	0	112.1	I165 V167 V185 F200 L203 L239 E240 K245 V246 C247 M258 F261	I165-L243 HydrophobicContact CD1-CB 3.87Å; I165-L243 HydrophobicContact CD1-CD1 4.12Å; I165-L243 HydrophobicContact CD1-CG 4.47Å; I165-L243 HydrophobicContact CG1-CB 4.24Å; V167-L243 HydrophobicContact CG2-CD1 4.17Å; V185-L243 HydrophobicContact CG1-CD1 3.83Å; V185-L243 HydrophobicContact CG2-CD1 4.01Å; F200-L243 HydrophobicContact CD1-CD1 4.45Å; F200-L243 HydrophobicContact CE1-CD1 3.74Å; F200-L243 HydrophobicContact CE1-CG 4.37Å; L203-L243 HydrophobicContact CD2-CD2 4.07Å; L239-L243 WeakPolarHBondContact O-CG 3.33Å; L239-L243 PolarHBondContact O-N 2.98Å; E240-L243 PolarHBondContact O-N 3.41Å; L243-K245 PolarHBondContact O-N 2.83Å; L243-V246 PolarHBondContact O-N 3.25Å; L243-C247 VanDerWaalsContact O-CB 3.28Å; L243-C247 WeakPolarHBondContact O-CB 3.45Å; L243-C247 PolarHBondContact O-N 2.82Å; L243-C247 PolarHBondContact O-SG 3.16Å; L243-M258 HydrophobicContact CD2-SD 4.43Å; L243-F261 HydrophobicContact CD1-CE1 4.43Å; L243-F261 HydrophobicContact CD2-CE1 4.14Å
244	E	92.6	Very high	91.2	Very high	103 Å²	103	41.9 Å²	41.9	48%	0.481	20%	0.203	S	C	.	.	H	α-helix	trans	-54.2	-52.6	173.6	-178.2	-172.2	-149.5	0	0	111.3	I165 E240 V246 S248	I165-E244 HydrophobicContact CG2-CB 4.1Å; E240-E244 WeakPolarHBondContact O-CB 3.42Å; E240-E244 PolarHBondContact O-N 2.61Å; E244-V246 PolarHBondContact O-N 3.42Å; E244-S248 VanDerWaalsContact O-CB 3.27Å; E244-S248 WeakPolarHBondContact O-CB 3.45Å; E244-S248 PolarHBondContact O-N 3.41Å; E244-S248 PolarHBondContact O-OG 2.96Å
245	K	92.6	Very high	90.6	Very high	91 Å²	91	40.2 Å²	40.2	40%	0.396	19%	0.189	S	C	.	.	H	α-helix	trans	-67.8	-32.9	-177.2	-69.1	163.9	-160.5	164.6	0	112.6	P217 E241 Y242 L243 S248	P217-K245 HydrophobicContact CB-CB 4.36Å; P217-K245 HydrophobicContact CB-CD 4.4Å; P217-K245 HydrophobicContact CG-CB 3.96Å; E241-K245 WeakPolarHBondContact O-CB 3.2Å; E241-K245 WeakPolarHBondContact O-CD 3.18Å; E241-K245 VanDerWaalsContact O-CG 3.23Å; E241-K245 WeakPolarHBondContact O-CG 3.38Å; E241-K245 PolarHBondContact O-N 3.24Å; E241-K245 IonicContact OE2-NZ 3.97Å; E241-K245 PolarHBondContact OE2-NZ 2.91Å; Y242-K245 PolarHBondContact O-N 3.47Å; L243-K245 PolarHBondContact O-N 2.83Å; K245-S248 PolarHBondContact O-OG 3.38Å
246	V	93.4	Very high	89.9	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-79.6	-49	178.4	174.8	0	0	0	0	112	L207 F216 P217 Y242 L243 E244 S248 I249 I252 M258	L207-V246 HydrophobicContact CD1-CG1 3.88Å; F216-V246 HydrophobicContact CD1-CG2 4.03Å; F216-V246 HydrophobicContact CE1-CG1 4.24Å; F216-V246 HydrophobicContact CE1-CG2 4.33Å; P217-V246 HydrophobicContact CG-CG2 3.67Å; Y242-V246 HydrophobicContact CD2-CG2 4.35Å; Y242-V246 HydrophobicContact CE1-CG2 4.08Å; Y242-V246 HydrophobicContact CE2-CG2 3.85Å; Y242-V246 WeakPolarHBondContact O-CB 3.49Å; Y242-V246 VanDerWaalsContact O-CG2 3.31Å; Y242-V246 WeakPolarHBondContact O-CG2 3.41Å; Y242-V246 PolarHBondContact O-N 2.85Å; L243-V246 PolarHBondContact O-N 3.25Å; E244-V246 PolarHBondContact O-N 3.42Å; V246-S248 VanDerWaalsContact C-N 3.26Å; V246-S248 PolarHBondContact O-N 2.83Å; V246-I249 PolarHBondContact O-N 2.95Å; V246-I252 HydrophobicContact CG1-CB 4.46Å; V246-I252 HydrophobicContact CG1-CG2 3.6Å; V246-M258 HydrophobicContact CB-CE 4.42Å; V246-M258 HydrophobicContact CG1-CE 3.52Å
247	C	90.1	Very high	89.5	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.007	22%	0.217	C	C	.	.	H	α-helix	trans	-68.5	-25.2	-178.4	-61.9	0	0	0	0	112.7	Q161 V163 L243 I249	Q161-C247 PolarHBondContact NE2-O 2.86Å; V163-C247 HydrophobicContact CB-CB 4.26Å; V163-C247 HydrophobicContact CG1-CB 4.01Å; V163-C247 HydrophobicContact CG2-CB 4.16Å; V163-C247 WeakPolarHBondContact CG2-O 3.4Å; L243-C247 VanDerWaalsContact O-CB 3.28Å; L243-C247 WeakPolarHBondContact O-CB 3.45Å; L243-C247 PolarHBondContact O-N 2.82Å; L243-C247 PolarHBondContact O-SG 3.16Å; C247-I249 PolarHBondContact O-N 2.91Å
248	S	88.7	Confident	89.1	Confident	33 Å²	33	38.9 Å²	38.9	23%	0.231	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-19.8	174.1	68.1	0	0	0	0	114.1	K160 Q161 E244 K245 V246	K160-S248 CarbonylContact C-O 3.52Å; K160-S248 VanDerWaalsContact CA-O 3.24Å; K160-S248 WeakPolarHBondContact CA-O 3.32Å; Q161-S248 PolarHBondContact N-O 2.82Å; Q161-S248 WeakPolarHBondContact O-CA 3.45Å; E244-S248 VanDerWaalsContact O-CB 3.27Å; E244-S248 WeakPolarHBondContact O-CB 3.45Å; E244-S248 PolarHBondContact O-N 3.41Å; E244-S248 PolarHBondContact O-OG 2.96Å; K245-S248 PolarHBondContact O-OG 3.38Å; V246-S248 VanDerWaalsContact C-N 3.26Å; V246-S248 PolarHBondContact O-N 2.83Å
249	I	87.1	Confident	88.4	Confident	11 Å²	11	41.1 Å²	41.1	6%	0.056	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-88	111.8	171	-52.4	-53.4	0	0	0	108	Y157 K160 F214 V246 C247 V251 I252 G253	Y157-I249 HydrophobicContact CD1-CG2 3.88Å; Y157-I249 HydrophobicContact CG-CG2 4.45Å; K160-I249 HydrophobicContact CG-CD1 4.01Å; F214-I249 HydrophobicContact CE2-CG1 3.95Å; F214-I249 HydrophobicContact CE2-CG2 4.45Å; F214-I249 HydrophobicContact CZ-CG1 3.72Å; V246-I249 PolarHBondContact O-N 2.95Å; C247-I249 PolarHBondContact O-N 2.91Å; I249-V251 HydrophobicContact CG2-CG1 4.31Å; I249-V251 PolarHBondContact O-N 3.12Å; I249-I252 HydrophobicContact CB-CB 4.49Å; I249-I252 HydrophobicContact CB-CD1 4.16Å; I249-I252 HydrophobicContact CB-CG1 4.28Å; I249-I252 HydrophobicContact CG2-CD1 3.98Å; I249-I252 HydrophobicContact CG2-CG1 3.99Å; I249-I252 PolarHBondContact O-N 2.86Å; I249-G253 PolarHBondContact O-N 3.03Å
250	R	79.3	Confident	87.7	Confident	99 Å²	99	46.9 Å²	46.9	37%	0.374	23%	0.228	S	C	.	.	H	α-helix	trans	-55.9	-52.9	-163.7	-171.1	-173.1	178.4	-164.8	-7.4	113.1	E159 Q161 I252 G253 E254	E159-R250 HydrophobicContact CB-CB 3.98Å; E159-R250 PolarHBondContact O-N 2.95Å; E159-R250 IonicContact OE1-NH1 2.84Å; E159-R250 WeakPolarHBondContact OE2-CD 3.22Å; E159-R250 IonicContact OE2-CZ 3.51Å; E159-R250 IonicContact OE2-NE 3.19Å; E159-R250 IonicContact OE2-NH1 3.83Å; E159-R250 PolarHBondContact OE2-NH1 2.79Å; Q161-R250 HydrophobicContact CG-CB 4.22Å; Q161-R250 HydrophobicContact CG-CG 4.47Å; R250-I252 PolarHBondContact O-N 3.16Å; R250-I252 VanDerWaalsContact O-N 3.1Å; R250-G253 PolarHBondContact O-N 3.46Å; R250-G253 VanDerWaalsContact O-N 3.11Å; R250-E254 VanDerWaalsContact CG-CD 3.47Å; R250-E254 HydrophobicContact CG-CG 4.13Å; R250-E254 WeakPolarHBondContact CG-OE1 3.13Å; R250-E254 IonicContact CZ-OE1 3.48Å; R250-E254 IonicContact CZ-OE2 2.7Å; R250-E254 IonicContact NE-OE1 3.85Å; R250-E254 PolarHBondContact NE-OE1 2.9Å; R250-E254 IonicContact NE-OE2 2.73Å; R250-E254 PolarHBondContact NE-OE2 2.93Å; R250-E254 IonicContact NH2-OE1 3.2Å; R250-E254 PolarHBondContact NH2-OE1 2.93Å; R250-E254 IonicContact NH2-OE2 3.45Å; R250-E254 WeakPolarHBondContact O-CB 3.38Å; R250-E254 PolarHBondContact O-N 3.26Å
251	V	80.3	Confident	87.4	Confident	46 Å²	46	45.5 Å²	45.5	28%	0.279	22%	0.221	S	C	.	.	H	α-helix	trans	-60.3	-23.5	-178.5	73.8	0	0	0	0	114	Y155 D156 Y157 I249 S255	Y155-V251 HydrophobicContact CD1-CG2 3.6Å; Y155-V251 HydrophobicContact CE1-CG2 4.48Å; Y155-V251 HydrophobicContact CG-CG2 4.2Å; D156-V251 VanDerWaalsContact O-CG1 3.25Å; D156-V251 WeakPolarHBondContact O-CG1 3.35Å; Y157-V251 HydrophobicContact CD1-CG1 3.75Å; Y157-V251 HydrophobicContact CE1-CG1 3.94Å; I249-V251 HydrophobicContact CG2-CG1 4.31Å; I249-V251 PolarHBondContact O-N 3.12Å; V251-S255 WeakPolarHBondContact O-CB 3.42Å
252	I	86.3	Confident	86.9	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-90.3	-41	176.4	-48.7	-179.4	0	0	0	110.2	Y157 L207 F211 F214 F216 V246 I249 R250 S255 M258	Y157-I252 HydrophobicContact CD1-CD1 3.98Å; Y157-I252 HydrophobicContact CD1-CG1 4.2Å; Y157-I252 HydrophobicContact CE1-CD1 3.88Å; Y157-I252 HydrophobicContact CE1-CG1 4.03Å; L207-I252 HydrophobicContact CD1-CG2 4.3Å; L207-I252 HydrophobicContact CD2-CG2 3.97Å; F211-I252 HydrophobicContact CD1-CG1 4.01Å; F211-I252 HydrophobicContact CD2-CG1 4.29Å; F211-I252 HydrophobicContact CD2-CG2 4.02Å; F211-I252 HydrophobicContact CE1-CG1 4.1Å; F211-I252 HydrophobicContact CE2-CB 4.44Å; F211-I252 HydrophobicContact CE2-CG1 4.39Å; F211-I252 HydrophobicContact CE2-CG2 3.92Å; F211-I252 HydrophobicContact CG-CD1 4.34Å; F211-I252 HydrophobicContact CG-CG1 4.11Å; F211-I252 HydrophobicContact CZ-CG1 4.31Å; F211-I252 HydrophobicContact CZ-CG2 4.45Å; F214-I252 HydrophobicContact CB-CD1 4.32Å; F214-I252 HydrophobicContact CD1-CD1 3.55Å; F214-I252 HydrophobicContact CD2-CD1 3.94Å; F214-I252 HydrophobicContact CE1-CD1 3.75Å; F214-I252 HydrophobicContact CE2-CD1 4.12Å; F214-I252 HydrophobicContact CG-CD1 3.65Å; F214-I252 HydrophobicContact CZ-CD1 4.04Å; F216-I252 HydrophobicContact CE1-CD1 4.42Å; F216-I252 HydrophobicContact CE1-CG2 4.4Å; F216-I252 HydrophobicContact CZ-CD1 4.33Å; V246-I252 HydrophobicContact CG1-CB 4.46Å; V246-I252 HydrophobicContact CG1-CG2 3.6Å; I249-I252 HydrophobicContact CB-CB 4.49Å; I249-I252 HydrophobicContact CB-CD1 4.16Å; I249-I252 HydrophobicContact CB-CG1 4.28Å; I249-I252 HydrophobicContact CG2-CD1 3.98Å; I249-I252 HydrophobicContact CG2-CG1 3.99Å; I249-I252 PolarHBondContact O-N 2.86Å; R250-I252 PolarHBondContact O-N 3.16Å; R250-I252 VanDerWaalsContact O-N 3.1Å; I252-S255 WeakPolarHBondContact O-CB 3.46Å; I252-S255 PolarHBondContact O-N 3.33Å; I252-S255 PolarHBondContact O-OG 2.88Å; I252-M258 WeakPolarHBondContact O-CB 3.27Å
253	G	82.4	Confident	86	Confident	3 Å²	3	43.4 Å²	43.4	3%	0.031	22%	0.217	C	C	.	.	H	α-helix	trans	-66.8	-31.9	177	0	0	0	0	0	114.3	I249 R250 Q259	I249-G253 PolarHBondContact O-N 3.03Å; R250-G253 PolarHBondContact O-N 3.46Å; R250-G253 VanDerWaalsContact O-N 3.11Å; G253-Q259 PolarHBondContact O-NE2 2.99Å; G253-Q259 VanDerWaalsContact O-NE2 3.11Å
254	E	80	Confident	84.8	Confident	89 Å²	89	45.8 Å²	45.8	42%	0.416	23%	0.228	S	C	.	.	S	Bend	trans	-86.3	-12.9	176	-67.8	179.5	174.5	0	0	112.9	R250 Q259	R250-E254 VanDerWaalsContact CG-CD 3.47Å; R250-E254 HydrophobicContact CG-CG 4.13Å; R250-E254 WeakPolarHBondContact CG-OE1 3.13Å; R250-E254 IonicContact CZ-OE1 3.48Å; R250-E254 IonicContact CZ-OE2 2.7Å; R250-E254 IonicContact NE-OE1 3.85Å; R250-E254 PolarHBondContact NE-OE1 2.9Å; R250-E254 IonicContact NE-OE2 2.73Å; R250-E254 PolarHBondContact NE-OE2 2.93Å; R250-E254 IonicContact NH2-OE1 3.2Å; R250-E254 PolarHBondContact NH2-OE1 2.93Å; R250-E254 IonicContact NH2-OE2 3.45Å; R250-E254 WeakPolarHBondContact O-CB 3.38Å; R250-E254 PolarHBondContact O-N 3.26Å; E254-Q259 PolarHBondContact O-NE2 3.08Å
255	S	82.5	Confident	83	Confident	18 Å²	18	43.4 Å²	43.4	13%	0.126	22%	0.223	C	C	.	.	S	Bend	trans	-62.8	147.7	-174.8	71.1	0	0	0	0	114.8	V251 I252 I257 M258 Q259	V251-S255 WeakPolarHBondContact O-CB 3.42Å; I252-S255 WeakPolarHBondContact O-CB 3.46Å; I252-S255 PolarHBondContact O-N 3.33Å; I252-S255 PolarHBondContact O-OG 2.88Å; S255-I257 PolarHBondContact O-N 2.88Å; S255-M258 WeakPolarHBondContact O-CA 3.22Å; S255-M258 WeakPolarHBondContact O-CB 3.41Å; S255-M258 PolarHBondContact O-N 3.3Å; S255-M258 PolarHBondContact OG-N 2.95Å; S255-Q259 WeakPolarHBondContact O-CG 3.48Å; S255-Q259 PolarHBondContact O-N 3.24Å
256	D	79.8	Confident	81	Confident	129 Å²	129	43.9 Å²	43.9	69%	0.69	23%	0.23	S	C	*	.	H	α-helix	trans	-53.5	-39.2	178.7	-63.9	-33.5	0	0	0	112.8	M258 Q259 E260	D256-M258 VanDerWaalsContact C-N 3.26Å; D256-M258 PolarHBondContact O-N 3.15Å; D256-Q259 PolarHBondContact O-N 2.99Å; D256-E260 WeakPolarHBondContact O-CB 3.24Å; D256-E260 PolarHBondContact O-N 3.43Å
257	I	88.3	Confident	78.8	Confident	32 Å²	32	53.3 Å²	53.3	16%	0.164	27%	0.274	C	S	.	.	H	α-helix	trans	-62.2	-34.2	177.3	-59	172.8	0	0	0	111.3	L203 N206 L207 E210 S255 F261	L203-I257 HydrophobicContact CD1-CG2 4.09Å; N206-I257 HydrophobicContact CB-CD1 4.49Å; N206-I257 HydrophobicContact CB-CG2 3.71Å; L207-I257 HydrophobicContact CD2-CB 3.91Å; L207-I257 HydrophobicContact CD2-CG2 3.61Å; L207-I257 HydrophobicContact CG-CG2 4.02Å; E210-I257 HydrophobicContact CB-CD1 3.66Å; E210-I257 HydrophobicContact CG-CD1 3.84Å; S255-I257 PolarHBondContact O-N 2.88Å; I257-F261 PolarHBondContact O-N 3.4Å
258	M	88.5	Confident	76.7	Confident	0 Å²	0	59 Å²	59	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-78.1	-41.2	173.7	-172.1	62.8	73.2	0	0	111.5	L203 L207 L243 V246 I252 S255 D256 E260 F261 L262	L203-M258 HydrophobicContact CD1-CE 4.46Å; L203-M258 HydrophobicContact CD1-SD 4.34Å; L203-M258 HydrophobicContact CD2-CE 4.42Å; L203-M258 HydrophobicContact CD2-SD 4.34Å; L207-M258 HydrophobicContact CD1-CE 3.86Å; L243-M258 HydrophobicContact CD2-SD 4.43Å; V246-M258 HydrophobicContact CB-CE 4.42Å; V246-M258 HydrophobicContact CG1-CE 3.52Å; I252-M258 WeakPolarHBondContact O-CB 3.27Å; S255-M258 WeakPolarHBondContact O-CA 3.22Å; S255-M258 WeakPolarHBondContact O-CB 3.41Å; S255-M258 PolarHBondContact O-N 3.3Å; S255-M258 PolarHBondContact OG-N 2.95Å; D256-M258 VanDerWaalsContact C-N 3.26Å; D256-M258 PolarHBondContact O-N 3.15Å; M258-E260 PolarHBondContact O-N 3.36Å; M258-F261 PolarHBondContact O-N 3.35Å; M258-F261 HydrophobicContact SD-CD1 4.46Å; M258-L262 HydrophobicContact CG-CD1 3.74Å; M258-L262 HydrophobicContact CG-CG 4.1Å; M258-L262 WeakPolarHBondContact O-CB 3.3Å; M258-L262 WeakPolarHBondContact O-CG 3.42Å; M258-L262 PolarHBondContact O-N 3.08Å; M258-L262 HydrophobicContact SD-CD1 4.07Å; M258-L262 HydrophobicContact SD-CD2 4.44Å; M258-L262 HydrophobicContact SD-CG 3.98Å
259	Q	82.6	Confident	74.8	Confident	63 Å²	63	63.5 Å²	63.5	29%	0.294	32%	0.317	S	S	.	.	H	α-helix	trans	-59.9	-45.9	176.5	-59.4	-46.1	-42.5	0	0	111.7	G253 E254 S255 D256 F261 L262 S263 Y346	G253-Q259 PolarHBondContact O-NE2 2.99Å; G253-Q259 VanDerWaalsContact O-NE2 3.11Å; E254-Q259 PolarHBondContact O-NE2 3.08Å; S255-Q259 WeakPolarHBondContact O-CG 3.48Å; S255-Q259 PolarHBondContact O-N 3.24Å; D256-Q259 PolarHBondContact O-N 2.99Å; Q259-F261 VanDerWaalsContact C-N 3.34Å; Q259-F261 PolarHBondContact O-N 2.9Å; Q259-L262 PolarHBondContact O-N 3.44Å; Q259-S263 WeakPolarHBondContact O-CB 3.39Å; Q259-S263 PolarHBondContact O-N 3.49Å; Q259-Y346 PolarHBondContact NE2-OH 3.16Å; Q259-Y346 PolarHBondContact OE1-OH 2.68Å; Q259-Y346 VanDerWaalsContact OE1-OH 3.05Å
260	E	83.4	Confident	73	Confident	122 Å²	122	68 Å²	68	57%	0.57	34%	0.342	S	S	*	.	H	α-helix	trans	-57.1	-45.8	176.6	-175	-175.8	-150.4	0	0	111.4	D256 M258 S263	D256-E260 WeakPolarHBondContact O-CB 3.24Å; D256-E260 PolarHBondContact O-N 3.43Å; M258-E260 PolarHBondContact O-N 3.36Å; E260-S263 PolarHBondContact O-N 3.33Å; E260-S263 PolarHBondContact O-OG 3.29Å
261	F	89.6	Confident	72	Confident	16 Å²	16	63.6 Å²	63.6	7%	0.07	33%	0.326	C	S	.	.	H	α-helix	trans	-72.3	-38.1	179.9	171.8	-91.8	0	0	0	114.3	C193 K195 E199 F200 L203 L243 I257 M258 Q259 S263	C193-F261 PolarHBondContact SG-O 3.29Å; C193-F261 VanDerWaalsContact SG-O 3.34Å; K195-F261 HydrophobicContact CB-CE2 4.13Å; K195-F261 HydrophobicContact CB-CZ 4.21Å; K195-F261 HydrophobicContact CD-CE2 4.41Å; K195-F261 HydrophobicContact CG-CE2 3.95Å; K195-F261 HydrophobicContact CG-CZ 4.13Å; E199-F261 HydrophobicContact CB-CE2 4.17Å; F200-F261 HydrophobicContact CD1-CE1 4.32Å; F200-F261 HydrophobicContact CD1-CE2 4.4Å; F200-F261 AromaticContact CD1-CZ 3.59Å; F200-F261 HydrophobicContact CD1-CZ 3.59Å; F200-F261 HydrophobicContact CD2-CE2 4.26Å; F200-F261 AromaticContact CD2-CZ 3.99Å; F200-F261 HydrophobicContact CD2-CZ 3.99Å; F200-F261 HydrophobicContact CE1-CE1 4.29Å; F200-F261 AromaticContact CE1-CZ 3.72Å; F200-F261 HydrophobicContact CE1-CZ 3.72Å; F200-F261 HydrophobicContact CE2-CZ 4.07Å; F200-F261 HydrophobicContact CG-CE2 4.14Å; F200-F261 AromaticContact CG-CZ 3.76Å; F200-F261 HydrophobicContact CG-CZ 3.76Å; F200-F261 AromaticContact CZ-CZ 3.95Å; F200-F261 HydrophobicContact CZ-CZ 3.95Å; L203-F261 HydrophobicContact CB-CD2 3.91Å; L203-F261 HydrophobicContact CB-CE2 4.37Å; L203-F261 HydrophobicContact CB-CG 4.14Å; L203-F261 HydrophobicContact CD1-CB 3.73Å; L203-F261 HydrophobicContact CD1-CD1 4.36Å; L203-F261 HydrophobicContact CD1-CG 3.95Å; L203-F261 HydrophobicContact CD2-CB 4.48Å; L203-F261 HydrophobicContact CD2-CD1 3.6Å; L203-F261 HydrophobicContact CD2-CD2 4.16Å; L203-F261 HydrophobicContact CD2-CE1 3.84Å; L203-F261 HydrophobicContact CD2-CE2 4.36Å; L203-F261 HydrophobicContact CD2-CG 3.79Å; L203-F261 HydrophobicContact CD2-CZ 4.22Å; L203-F261 HydrophobicContact CG-CB 4.46Å; L203-F261 HydrophobicContact CG-CD1 4.44Å; L203-F261 HydrophobicContact CG-CD2 4.42Å; L203-F261 HydrophobicContact CG-CG 4.16Å; L243-F261 HydrophobicContact CD1-CE1 4.43Å; L243-F261 HydrophobicContact CD2-CE1 4.14Å; I257-F261 PolarHBondContact O-N 3.4Å; M258-F261 PolarHBondContact O-N 3.35Å; M258-F261 HydrophobicContact SD-CD1 4.46Å; Q259-F261 VanDerWaalsContact C-N 3.34Å; Q259-F261 PolarHBondContact O-N 2.9Å; F261-S263 VanDerWaalsContact C-N 3.29Å
262	L	85.6	Confident	71.2	Confident	5 Å²	5	65.7 Å²	65.7	3%	0.026	34%	0.339	C	S	.	.	H	α-helix	trans	-73.7	-24.9	176.7	-68.9	-179.5	0	0	0	111.5	I165 V185 M187 L192 C193 M258 Q259	I165-L262 HydrophobicContact CD1-CD2 4.13Å; V185-L262 HydrophobicContact CG1-CD2 3.93Å; M187-L262 HydrophobicContact CE-CD1 3.83Å; L192-L262 CarbonylContact C-O 3.57Å; L192-L262 WeakPolarHBondContact CB-O 3.42Å; L192-L262 HydrophobicContact CD1-CB 4.18Å; L192-L262 HydrophobicContact CD1-CD1 4.25Å; L192-L262 HydrophobicContact CD1-CD2 4.37Å; C193-L262 WeakPolarHBondContact CB-O 3.4Å; M258-L262 HydrophobicContact CG-CD1 3.74Å; M258-L262 HydrophobicContact CG-CG 4.1Å; M258-L262 WeakPolarHBondContact O-CB 3.3Å; M258-L262 WeakPolarHBondContact O-CG 3.42Å; M258-L262 PolarHBondContact O-N 3.08Å; M258-L262 HydrophobicContact SD-CD1 4.07Å; M258-L262 HydrophobicContact SD-CD2 4.44Å; M258-L262 HydrophobicContact SD-CG 3.98Å; Q259-L262 PolarHBondContact O-N 3.44Å
263	S	76.4	Confident	70.6	Confident	50 Å²	50	68.3 Å²	68.3	35%	0.35	36%	0.357	S	S	.	.	S	Bend	trans	-66.6	155.4	164.5	90.3	0	0	0	0	111.5	Q259 E260 F261 S265	Q259-S263 WeakPolarHBondContact O-CB 3.39Å; Q259-S263 PolarHBondContact O-N 3.49Å; E260-S263 PolarHBondContact O-N 3.33Å; E260-S263 PolarHBondContact O-OG 3.29Å; F261-S263 VanDerWaalsContact C-N 3.29Å; S263-S265 VanDerWaalsContact C-N 3.31Å; S263-S265 PolarHBondContact O-N 3Å
264	E	71.3	Confident	70.7	Confident	50 Å²	50	71.8 Å²	71.8	23%	0.234	38%	0.375	C	S	.	.			trans	-77	83	165.3	-69.5	178.4	128.8	0	0	110.4	C193 D266 K293	C193-E264 HydrophobicContact CB-CG 4.06Å; E264-D266 PolarHBondContact O-N 3.1Å; E264-D266 VanDerWaalsContact O-N 3.1Å; E264-K293 IonicContact OE1-NZ 2.74Å; E264-K293 PolarHBondContact OE1-NZ 3.44Å; E264-K293 WeakPolarHBondContact OE2-CE 3.37Å; E264-K293 IonicContact OE2-NZ 2.77Å; E264-K293 PolarHBondContact OE2-NZ 3.3Å
265	S	54.4	Low	70.9	Confident	53 Å²	53	68.7 Å²	68.7	37%	0.371	36%	0.362	S	S	.	.			trans	-60.7	114.5	152	94.8	0	0	0	0	107.5	K195 S263	K195-S265 PolarHBondContact NZ-O 2.88Å; K195-S265 PolarHBondContact NZ-OG 3.07Å; S263-S265 VanDerWaalsContact C-N 3.31Å; S263-S265 PolarHBondContact O-N 3Å
266	D	52.1	Low	71.2	Confident	102 Å²	102	73.7 Å²	73.7	55%	0.545	38%	0.384	S	S	.	.	S	Bend		-173.2	165.3	111.2	-84.8	3.5	0	0	0	109	E264 N268	E264-D266 PolarHBondContact O-N 3.1Å; E264-D266 VanDerWaalsContact O-N 3.1Å; D266-N268 PolarHBondContact O-N 3.18Å
267	E	46.6	Very low	71.7	Confident	198 Å²	198	67.5 Å²	67.5	93%	0.925	35%	0.351	S	S	*	.	S	Bend	trans	-64.6	-0.2	-164.1	-57.7	176.6	136.4	0	0	115.6	Y269	E267-Y269 PolarHBondContact O-N 2.72Å
268	N	45.1	Very low	71.8	Confident	119 Å²	119	69.9 Å²	69.9	64%	0.636	36%	0.358	S	S	*	.			trans	-77.8	38.4	178.9	-118.3	78.2	0	0	0	112.9	D266 N270	D266-N268 PolarHBondContact O-N 3.18Å; N268-N270 WeakPolarHBondContact CA-OD1 3.36Å; N268-N270 PolarHBondContact O-N 3.45Å; N268-N270 PolarHBondContact O-OD1 2.94Å
269	Y	48.8	Very low	72	Confident	129 Å²	129	69.9 Å²	69.9	51%	0.506	36%	0.358	S	S	.	.			trans	-74.5	33.5	-177.8	-139.5	-83.5	0	0	0	113.1	E267 G271	E267-Y269 PolarHBondContact O-N 2.72Å; Y269-G271 PolarHBondContact O-N 2.8Å
270	N	50.8	Low	72.6	Confident	106 Å²	106	67.4 Å²	67.4	57%	0.567	35%	0.348	S	S	*	.			trans	-61.7	-6.7	-179.1	-49.6	24.8	0	0	0	112.8	N268 V272	N268-N270 WeakPolarHBondContact CA-OD1 3.36Å; N268-N270 PolarHBondContact O-N 3.45Å; N268-N270 PolarHBondContact O-OD1 2.94Å; N270-V272 HydrophobicContact CB-CG2 4.02Å; N270-V272 WeakPolarHBondContact O-CG2 3.4Å; N270-V272 PolarHBondContact O-N 2.8Å
271	G	57.2	Low	73.2	Confident	5 Å²	5	62.2 Å²	62.2	5%	0.052	32%	0.324	C	S	.	.	S	Bend	trans	75.1	-26.8	-179.2	0	0	0	0	0	115.5	Y269 S273 K293 N294	Y269-G271 PolarHBondContact O-N 2.8Å; G271-S273 VanDerWaalsContact C-N 3.29Å; G271-S273 PolarHBondContact O-N 2.99Å; G271-S273 VanDerWaalsContact O-N 3.16Å; G271-K293 PolarHBondContact O-N 2.74Å; G271-N294 PolarHBondContact O-OD1 3.17Å
272	V	64	Low	73.5	Confident	90 Å²	90	62.3 Å²	62.3	55%	0.545	33%	0.327	S	S	.	.			trans	-66.1	-18.8	-166.1	-152.6	0	0	0	0	115.3	N270	N270-V272 HydrophobicContact CB-CG2 4.02Å; N270-V272 WeakPolarHBondContact O-CG2 3.4Å; N270-V272 PolarHBondContact O-N 2.8Å
273	S	74.3	Confident	73.9	Confident	55 Å²	55	64.6 Å²	64.6	39%	0.385	34%	0.339	S	S	.	.	S	Bend	trans	-71	134.9	-178.7	59.7	0	0	0	0	112	G271 K293	G271-S273 VanDerWaalsContact C-N 3.29Å; G271-S273 PolarHBondContact O-N 2.99Å; G271-S273 VanDerWaalsContact O-N 3.16Å; S273-K293 PolarHBondContact O-N 3.17Å; S273-K293 VanDerWaalsContact O-N 3.11Å; S273-K293 WeakPolarHBondContact OG-CD 3.39Å; S273-K293 WeakPolarHBondContact OG-CE 3.43Å; S273-K293 PolarHBondContact OG-NZ 3.09Å
274	D	83.4	Confident	74.6	Confident	77 Å²	77	65.6 Å²	65.6	41%	0.412	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	149.1	174.8	-63.6	-22.6	0	0	0	112.7	R290 V291	D274-R290 HydrophobicContact CB-CG 4.03Å; D274-R290 IonicContact OD2-CZ 2.68Å; D274-R290 IonicContact OD2-NE 3.71Å; D274-R290 PolarHBondContact OD2-NE 2.9Å; D274-R290 IonicContact OD2-NH2 3.17Å; D274-R290 PolarHBondContact OD2-NH2 2.83Å; D274-V291 CarbonylContact C-O 3.55Å; D274-V291 VanDerWaalsContact CA-O 3.31Å; D274-V291 WeakPolarHBondContact CA-O 3.37Å
275	V	84.4	Confident	75.7	Confident	23 Å²	23	66.7 Å²	66.7	14%	0.139	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	156.9	173	-76.2	0	0	0	0	110.5	L277 R290 V291 K293 H339	V275-L277 HydrophobicContact CG2-CD2 4.43Å; V275-R290 WeakPolarHBondContact O-CA 3.31Å; V275-V291 HydrophobicContact CG2-CG2 4.25Å; V275-V291 WeakPolarHBondContact CG2-O 3.28Å; V275-V291 PolarHBondContact N-O 2.83Å; V275-V291 PolarHBondContact O-N 2.68Å; V275-K293 HydrophobicContact CB-CG 4.34Å; V275-K293 HydrophobicContact CG1-CD 4.01Å; V275-K293 HydrophobicContact CG1-CG 3.47Å; V275-K293 VanDerWaalsContact CG1-CG 3.47Å; V275-K293 HydrophobicContact CG2-CG 3.92Å; V275-H339 HydrophobicContact CG2-CB 4.46Å
276	E	88.1	Confident	77.5	Confident	123 Å²	123	66.5 Å²	66.5	58%	0.575	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.9	108.9	176.5	-69.6	-173.1	163.9	0	0	110.2	T288 V289	E276-T288 HydrophobicContact CB-CG2 3.79Å; E276-T288 HydrophobicContact CG-CG2 4.35Å; E276-V289 CarbonylContact C-O 3.57Å; E276-V289 WeakPolarHBondContact CA-O 3.09Å
277	L	90.1	Very high	79.6	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	118.8	174.1	-56.8	-174.6	0	0	0	109.1	V275 T288 V289 V291 V300 P338 H339 Y342 L355	V275-L277 HydrophobicContact CG2-CD2 4.43Å; L277-T288 WeakPolarHBondContact O-CA 3.42Å; L277-V289 HydrophobicContact CB-CG2 4.13Å; L277-V289 PolarHBondContact N-O 3.17Å; L277-V289 PolarHBondContact O-N 3.06Å; L277-V291 HydrophobicContact CD1-CG2 3.62Å; L277-V291 HydrophobicContact CG-CG2 3.75Å; L277-V300 HydrophobicContact CD1-CG1 3.92Å; L277-V300 HydrophobicContact CD1-CG2 4.06Å; L277-P338 HydrophobicContact CD1-CB 4.21Å; L277-H339 HydrophobicContact CD2-CB 4.19Å; L277-Y342 HydrophobicContact CD2-CD1 3.49Å; L277-Y342 VanDerWaalsContact CD2-CD1 3.49Å; L277-Y342 HydrophobicContact CD2-CD2 4.5Å; L277-Y342 HydrophobicContact CD2-CE1 3.92Å; L277-Y342 HydrophobicContact CD2-CG 3.79Å; L277-L355 HydrophobicContact CD1-CD1 4.25Å
278	R	90.7	Very high	81.9	Confident	81 Å²	81	55.6 Å²	55.6	31%	0.306	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	135.4	167.1	-168.1	175.3	-176.3	-147	-8.2	108.5	T286 V287 Y342 P351 T353	R278-T286 HydrophobicContact CG-CG2 4.41Å; R278-T286 PolarHBondContact NE-OG1 3.24Å; R278-T286 PolarHBondContact NH2-OG1 3.49Å; R278-V287 CarbonylContact C-O 3.51Å; R278-V287 WeakPolarHBondContact CA-O 3.34Å; R278-Y342 HydrophobicContact CB-CE2 4.2Å; R278-Y342 VanDerWaalsContact CB-OH 3.3Å; R278-Y342 WeakPolarHBondContact CB-OH 3.26Å; R278-Y342 PolarHBondContact N-OH 2.98Å; R278-Y342 VanDerWaalsContact O-CE2 3.29Å; R278-Y342 WeakPolarHBondContact O-CE2 3.45Å; R278-P351 PolarHBondContact NH1-O 3.14Å; R278-T353 WeakPolarHBondContact O-CB 3.39Å; R278-T353 PolarHBondContact O-OG1 2.91Å
279	V	94	Very high	84.3	Confident	0 Å²	0	50 Å²	50	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	133.8	-178.3	-175.4	0	0	0	0	108.7	T286 V287 I304 L320 L355 I357	V279-T286 CarbonylContact O-C 3.59Å; V279-T286 WeakPolarHBondContact O-CA 3.08Å; V279-V287 HydrophobicContact CB-CG1 4.21Å; V279-V287 PolarHBondContact N-O 2.91Å; V279-V287 PolarHBondContact O-N 2.99Å; V279-I304 HydrophobicContact CB-CD1 4.23Å; V279-I304 HydrophobicContact CG1-CD1 4.07Å; V279-I304 HydrophobicContact CG2-CD1 3.84Å; V279-I304 HydrophobicContact CG2-CG1 4.46Å; V279-L320 HydrophobicContact CG1-CD1 3.85Å; V279-L355 WeakPolarHBondContact CA-O 3.38Å; V279-L355 HydrophobicContact CB-CB 4.44Å; V279-L355 HydrophobicContact CG1-CB 4.11Å; V279-L355 HydrophobicContact CG2-CB 4Å; V279-L355 HydrophobicContact CG2-CD1 4.26Å; V279-I357 HydrophobicContact CG1-CD1 4.46Å; V279-I357 HydrophobicContact CG1-CG1 4.18Å
280	A	94.1	Very high	86.4	Confident	12 Å²	12	51.8 Å²	51.8	10%	0.099	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	145.2	176.1	0	0	0	0	0	110.6	V350 T353 L355 T356 I357	A280-V350 HydrophobicContact CB-CG1 4.33Å; A280-T353 HydrophobicContact CB-CG2 3.98Å; A280-L355 PolarHBondContact N-O 2.76Å; A280-T356 CarbonylContact O-C 3.6Å; A280-T356 WeakPolarHBondContact O-CA 3.39Å; A280-T356 PolarHBondContact O-OG1 3.26Å; A280-I357 PolarHBondContact O-N 2.82Å
281	L	96.6	Very high	88.5	Confident	13 Å²	13	47.3 Å²	47.3	7%	0.068	27%	0.267	C	S	.	.			trans	-112.4	154.4	178.3	-64.7	173.1	0	0	0	109.8	D283 G284 T285 V287 V308 I357 Y379	L281-D283 WeakPolarHBondContact CB-OD1 3.36Å; L281-D283 PolarHBondContact O-N 3.25Å; L281-G284 PolarHBondContact O-N 3.34Å; L281-T285 WeakPolarHBondContact CD1-OG1 3.46Å; L281-T285 PolarHBondContact N-O 3.43Å; L281-V287 HydrophobicContact CD1-CB 4Å; L281-V287 HydrophobicContact CD1-CG1 4.12Å; L281-V287 HydrophobicContact CD2-CG1 3.96Å; L281-V287 HydrophobicContact CG-CG1 4.14Å; L281-V308 HydrophobicContact CD1-CG1 3.97Å; L281-V308 HydrophobicContact CD2-CG1 4.08Å; L281-I357 HydrophobicContact CD2-CB 4.22Å; L281-I357 HydrophobicContact CD2-CG1 3.98Å; L281-Y379 WeakPolarHBondContact CD1-OH 3.12Å; L281-Y379 HydrophobicContact CD2-CE2 4.43Å
282	P	95.9	Very high	90	Very high	18 Å²	18	51.5 Å²	51.5	12%	0.117	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-23.1	-178.2	-29.3	37.1	0	0	0	115.1	G284 F318 I357 Y379 H382 Q383	P282-G284 PolarHBondContact O-N 3.3Å; P282-F318 HydrophobicContact CG-CE1 4.33Å; P282-I357 WeakPolarHBondContact CD-O 3.12Å; P282-I357 HydrophobicContact CG-CG2 4.46Å; P282-I357 WeakPolarHBondContact CG-O 3.25Å; P282-Y379 HydrophobicContact CB-CD1 4.2Å; P282-Y379 HydrophobicContact CB-CD2 4.4Å; P282-Y379 HydrophobicContact CB-CG 3.88Å; P282-Y379 WeakPolarHBondContact CB-O 3.38Å; P282-Y379 HydrophobicContact CG-CD1 4.35Å; P282-Y379 HydrophobicContact CG-CD2 3.73Å; P282-Y379 HydrophobicContact CG-CE2 4.36Å; P282-Y379 HydrophobicContact CG-CG 3.72Å; P282-H382 WeakPolarHBondContact O-CB 3.16Å; P282-Q383 HydrophobicContact CB-CB 4.35Å
283	D	94.6	Very high	91	Very high	52 Å²	52	48.8 Å²	48.8	28%	0.278	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	2.5	175.8	63.5	10.7	0	0	0	114.7	L281 T285 Y379 H382	L281-D283 WeakPolarHBondContact CB-OD1 3.36Å; L281-D283 PolarHBondContact O-N 3.25Å; D283-T285 PolarHBondContact O-N 2.94Å; D283-T285 VanDerWaalsContact OD1-CB 3.25Å; D283-T285 WeakPolarHBondContact OD1-CB 3.38Å; D283-T285 WeakPolarHBondContact OD1-CG2 3.48Å; D283-T285 PolarHBondContact OD1-N 3.28Å; D283-T285 PolarHBondContact OD1-OG1 3.08Å; D283-T285 PolarHBondContact OD2-OG1 3.09Å; D283-Y379 HydrophobicContact CB-CD1 4.41Å; D283-Y379 HydrophobicContact CB-CE1 4.31Å; D283-H382 WeakPolarHBondContact CB-ND1 3.45Å
284	G	90.9	Very high	91.6	Very high	71 Å²	71	49.6 Å²	49.6	73%	0.732	26%	0.264	S	S	*	.	S	Bend	trans	79.5	1	-177.2	0	0	0	0	0	114.3	L281 P282	L281-G284 PolarHBondContact O-N 3.34Å; P282-G284 PolarHBondContact O-N 3.3Å
285	T	93.6	Very high	92.1	Very high	73 Å²	73	46.4 Å²	46.4	45%	0.448	25%	0.248	S	C	.	.			trans	-82.3	179.6	170.4	75.5	0	0	0	0	111	L281 D283	L281-T285 WeakPolarHBondContact CD1-OG1 3.46Å; L281-T285 PolarHBondContact N-O 3.43Å; D283-T285 PolarHBondContact O-N 2.94Å; D283-T285 VanDerWaalsContact OD1-CB 3.25Å; D283-T285 WeakPolarHBondContact OD1-CB 3.38Å; D283-T285 WeakPolarHBondContact OD1-CG2 3.48Å; D283-T285 PolarHBondContact OD1-N 3.28Å; D283-T285 PolarHBondContact OD1-OG1 3.08Å; D283-T285 PolarHBondContact OD2-OG1 3.09Å
286	T	93.1	Very high	92.7	Very high	50 Å²	50	46.9 Å²	46.9	31%	0.307	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	130.7	175.6	62.5	0	0	0	0	111.2	R278 V279	R278-T286 HydrophobicContact CG-CG2 4.41Å; R278-T286 PolarHBondContact NE-OG1 3.24Å; R278-T286 PolarHBondContact NH2-OG1 3.49Å; V279-T286 CarbonylContact O-C 3.59Å; V279-T286 WeakPolarHBondContact O-CA 3.08Å
287	V	94.9	Very high	93.1	Very high	16 Å²	16	41.3 Å²	41.3	10%	0.097	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	144.5	169.6	62.3	0	0	0	0	110.2	R278 V279 L281 V289 I304 K307 V308	R278-V287 CarbonylContact C-O 3.51Å; R278-V287 WeakPolarHBondContact CA-O 3.34Å; V279-V287 HydrophobicContact CB-CG1 4.21Å; V279-V287 PolarHBondContact N-O 2.91Å; V279-V287 PolarHBondContact O-N 2.99Å; L281-V287 HydrophobicContact CD1-CB 4Å; L281-V287 HydrophobicContact CD1-CG1 4.12Å; L281-V287 HydrophobicContact CD2-CG1 3.96Å; L281-V287 HydrophobicContact CG-CG1 4.14Å; V287-V289 HydrophobicContact CG2-CG1 4.32Å; V287-I304 HydrophobicContact CG1-CG2 4.07Å; V287-K307 HydrophobicContact CG2-CB 4.41Å; V287-K307 HydrophobicContact CG2-CD 3.88Å; V287-K307 HydrophobicContact CG2-CG 3.95Å; V287-V308 HydrophobicContact CB-CG1 4.24Å; V287-V308 HydrophobicContact CG1-CG1 4.24Å; V287-V308 HydrophobicContact CG2-CG1 4.26Å
288	T	94.3	Very high	93.4	Very high	54 Å²	54	45.3 Å²	45.3	33%	0.331	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	120.6	169.3	-57.8	0	0	0	0	109.5	E276 L277 K307	E276-T288 HydrophobicContact CB-CG2 3.79Å; E276-T288 HydrophobicContact CG-CG2 4.35Å; L277-T288 WeakPolarHBondContact O-CA 3.42Å; T288-K307 WeakPolarHBondContact O-CE 3.4Å; T288-K307 PolarHBondContact O-NZ 3.02Å
289	V	96.1	Very high	93.7	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.012	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	144.1	175.5	-66.1	0	0	0	0	110.7	E276 L277 V287 V291 V300 A303 I304 K307	E276-V289 CarbonylContact C-O 3.57Å; E276-V289 WeakPolarHBondContact CA-O 3.09Å; L277-V289 HydrophobicContact CB-CG2 4.13Å; L277-V289 PolarHBondContact N-O 3.17Å; L277-V289 PolarHBondContact O-N 3.06Å; V287-V289 HydrophobicContact CG2-CG1 4.32Å; V289-V291 HydrophobicContact CB-CG1 4.33Å; V289-V291 HydrophobicContact CG2-CG1 4.05Å; V289-V300 HydrophobicContact CG2-CG1 4.41Å; V289-A303 HydrophobicContact CB-CB 4.42Å; V289-A303 HydrophobicContact CG1-CB 4.48Å; V289-A303 WeakPolarHBondContact CG1-O 3.15Å; V289-I304 HydrophobicContact CG1-CB 4.4Å; V289-I304 HydrophobicContact CG1-CG1 3.72Å; V289-I304 HydrophobicContact CG2-CG1 4.04Å; V289-K307 HydrophobicContact CG1-CB 4.46Å; V289-K307 HydrophobicContact CG1-CD 4.16Å
290	R	93.6	Very high	93.9	Very high	167 Å²	167	46.3 Å²	46.3	63%	0.63	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.1	117.3	174.3	179.6	172.7	167.5	162.6	-4.7	108.6	D274 V275	D274-R290 HydrophobicContact CB-CG 4.03Å; D274-R290 IonicContact OD2-CZ 2.68Å; D274-R290 IonicContact OD2-NE 3.71Å; D274-R290 PolarHBondContact OD2-NE 2.9Å; D274-R290 IonicContact OD2-NH2 3.17Å; D274-R290 PolarHBondContact OD2-NH2 2.83Å; V275-R290 WeakPolarHBondContact O-CA 3.31Å
291	V	93.9	Very high	94.1	Very high	11 Å²	11	46.8 Å²	46.8	7%	0.067	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	170.1	-171.9	-63	0	0	0	0	109.8	D274 V275 L277 V289 V300 A303	D274-V291 CarbonylContact C-O 3.55Å; D274-V291 VanDerWaalsContact CA-O 3.31Å; D274-V291 WeakPolarHBondContact CA-O 3.37Å; V275-V291 HydrophobicContact CG2-CG2 4.25Å; V275-V291 WeakPolarHBondContact CG2-O 3.28Å; V275-V291 PolarHBondContact N-O 2.83Å; V275-V291 PolarHBondContact O-N 2.68Å; L277-V291 HydrophobicContact CD1-CG2 3.62Å; L277-V291 HydrophobicContact CG-CG2 3.75Å; V289-V291 HydrophobicContact CB-CG1 4.33Å; V289-V291 HydrophobicContact CG2-CG1 4.05Å; V291-V300 HydrophobicContact CB-CG2 4.43Å; V291-V300 HydrophobicContact CG1-CG2 4.35Å; V291-V300 HydrophobicContact CG2-CG2 4.15Å; V291-A303 HydrophobicContact CG1-CB 3.9Å
292	K	89.4	Confident	94.2	Very high	94 Å²	94	51.4 Å²	51.4	41%	0.409	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	153.4	175.5	-68.2	178.5	178.8	174.9	0	110.9	N294 S295	K292-N294 WeakPolarHBondContact CB-OD1 3.4Å; K292-N294 PolarHBondContact O-N 3Å; K292-S295 PolarHBondContact N-OG 3.5Å; K292-S295 WeakPolarHBondContact O-CB 3.29Å; K292-S295 PolarHBondContact O-N 2.86Å
293	K	84.8	Confident	94.3	Very high	32 Å²	32	52.2 Å²	52.2	14%	0.139	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-26.2	176.5	-70.6	-177	-169.5	165.9	0	113.7	E264 G271 S273 V275	E264-K293 IonicContact OE1-NZ 2.74Å; E264-K293 PolarHBondContact OE1-NZ 3.44Å; E264-K293 WeakPolarHBondContact OE2-CE 3.37Å; E264-K293 IonicContact OE2-NZ 2.77Å; E264-K293 PolarHBondContact OE2-NZ 3.3Å; G271-K293 PolarHBondContact O-N 2.74Å; S273-K293 PolarHBondContact O-N 3.17Å; S273-K293 VanDerWaalsContact O-N 3.11Å; S273-K293 WeakPolarHBondContact OG-CD 3.39Å; S273-K293 WeakPolarHBondContact OG-CE 3.43Å; S273-K293 PolarHBondContact OG-NZ 3.09Å; V275-K293 HydrophobicContact CB-CG 4.34Å; V275-K293 HydrophobicContact CG1-CD 4.01Å; V275-K293 HydrophobicContact CG1-CG 3.47Å; V275-K293 VanDerWaalsContact CG1-CG 3.47Å; V275-K293 HydrophobicContact CG2-CG 3.92Å
294	N	86.8	Confident	94.4	Very high	72 Å²	72	49.7 Å²	49.7	39%	0.385	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	14.3	173.5	73.9	-23.8	0	0	0	114	G271 K292 T296 F337	G271-N294 PolarHBondContact O-OD1 3.17Å; K292-N294 WeakPolarHBondContact CB-OD1 3.4Å; K292-N294 PolarHBondContact O-N 3Å; N294-T296 PolarHBondContact O-N 2.87Å; N294-F337 HydrophobicContact CB-CE1 4.41Å; N294-F337 WeakPolarHBondContact O-CD1 3.45Å; N294-F337 WeakPolarHBondContact O-CE1 3.42Å
295	S	93.9	Very high	94.8	Very high	10 Å²	10	46.5 Å²	46.5	7%	0.07	24%	0.237	C	C	.	.			trans	-65.5	131.8	171.6	-79.8	0	0	0	0	110.3	K292 Q299	K292-S295 PolarHBondContact N-OG 3.5Å; K292-S295 WeakPolarHBondContact O-CB 3.29Å; K292-S295 PolarHBondContact O-N 2.86Å; S295-Q299 VanDerWaalsContact CA-OE1 3.31Å; S295-Q299 PolarHBondContact OG-OE1 2.65Å
296	T	96.4	Very high	95	Very high	33 Å²	33	47 Å²	47	20%	0.202	25%	0.249	C	C	.	.			trans	-75.6	166.8	178.5	63	0	0	0	0	111.4	N294 D298 Q299 V300 P334 E336 F337	N294-T296 PolarHBondContact O-N 2.87Å; T296-D298 VanDerWaalsContact C-N 3.25Å; T296-D298 PolarHBondContact O-N 3.2Å; T296-Q299 PolarHBondContact O-N 3.09Å; T296-V300 WeakPolarHBondContact O-CG2 3.47Å; T296-V300 PolarHBondContact O-N 3.05Å; T296-P334 WeakPolarHBondContact CB-O 3.42Å; T296-E336 CarbonylContact C-O 3.55Å; T296-E336 VanDerWaalsContact CA-O 3.22Å; T296-E336 WeakPolarHBondContact CA-O 3.41Å; T296-F337 HydrophobicContact CG2-CE1 4.13Å
297	T	97.9	Very high	95.2	Very high	7 Å²	7	51 Å²	51	4%	0.043	26%	0.262	C	S	.	.	H	α-helix	trans	-44.5	-49.6	173.6	-62.8	0	0	0	0	112.3	Q299 V300 Y301 L320 L332 A333 P334 E336	T297-Q299 PolarHBondContact O-N 3.21Å; T297-V300 PolarHBondContact O-N 3.35Å; T297-Y301 VanDerWaalsContact O-CB 3.32Å; T297-Y301 WeakPolarHBondContact O-CB 3.22Å; T297-Y301 PolarHBondContact O-N 3.32Å; T297-L320 HydrophobicContact CG2-CB 4.33Å; T297-L320 HydrophobicContact CG2-CD2 4.43Å; T297-L332 HydrophobicContact CG2-CB 3.65Å; T297-A333 WeakPolarHBondContact CB-O 3.33Å; T297-A333 PolarHBondContact OG1-O 2.98Å; T297-P334 PolarHBondContact N-O 3.2Å; T297-E336 PolarHBondContact N-O 3.47Å; T297-E336 PolarHBondContact OG1-O 3.03Å
298	D	96.3	Very high	95.4	Very high	83 Å²	83	51.9 Å²	51.9	44%	0.444	27%	0.267	S	S	.	.	H	α-helix	trans	-61.7	-44.2	-179.8	-60.1	-15.7	0	0	0	112.5	T296 V300 Y301 Q302 P334	T296-D298 VanDerWaalsContact C-N 3.25Å; T296-D298 PolarHBondContact O-N 3.2Å; D298-V300 VanDerWaalsContact C-N 3.33Å; D298-V300 PolarHBondContact O-N 3.31Å; D298-Y301 PolarHBondContact O-N 2.93Å; D298-Q302 WeakPolarHBondContact O-CB 3.41Å; D298-Q302 VanDerWaalsContact O-CG 3.28Å; D298-Q302 WeakPolarHBondContact O-CG 3.45Å; D298-Q302 PolarHBondContact O-N 3.17Å; D298-P334 WeakPolarHBondContact OD1-CB 3.49Å
299	Q	96.8	Very high	95.5	Very high	103 Å²	103	52 Å²	52	48%	0.481	28%	0.279	S	S	.	.	H	α-helix	trans	-65.7	-38.6	-179.8	-66.7	178.6	13.5	0	0	111.7	S295 T296 T297 A303	S295-Q299 VanDerWaalsContact CA-OE1 3.31Å; S295-Q299 PolarHBondContact OG-OE1 2.65Å; T296-Q299 PolarHBondContact O-N 3.09Å; T297-Q299 PolarHBondContact O-N 3.21Å; Q299-A303 WeakPolarHBondContact O-CB 3.26Å; Q299-A303 PolarHBondContact O-N 3.06Å; Q299-A303 VanDerWaalsContact O-N 3.14Å
300	V	98.1	Very high	95.5	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-68.8	-42.8	175	178.3	0	0	0	0	110.3	L277 V289 V291 T296 T297 D298 A303 I304 L320 P338	L277-V300 HydrophobicContact CD1-CG1 3.92Å; L277-V300 HydrophobicContact CD1-CG2 4.06Å; V289-V300 HydrophobicContact CG2-CG1 4.41Å; V291-V300 HydrophobicContact CB-CG2 4.43Å; V291-V300 HydrophobicContact CG1-CG2 4.35Å; V291-V300 HydrophobicContact CG2-CG2 4.15Å; T296-V300 WeakPolarHBondContact O-CG2 3.47Å; T296-V300 PolarHBondContact O-N 3.05Å; T297-V300 PolarHBondContact O-N 3.35Å; D298-V300 VanDerWaalsContact C-N 3.33Å; D298-V300 PolarHBondContact O-N 3.31Å; V300-A303 PolarHBondContact O-N 2.87Å; V300-I304 HydrophobicContact CG1-CD1 3.95Å; V300-I304 WeakPolarHBondContact O-CD1 3.49Å; V300-I304 VanDerWaalsContact O-CG1 3.27Å; V300-I304 WeakPolarHBondContact O-CG1 3.36Å; V300-I304 PolarHBondContact O-N 3.33Å; V300-L320 HydrophobicContact CB-CD2 4.16Å; V300-L320 HydrophobicContact CG1-CD2 3.81Å; V300-P338 HydrophobicContact CB-CG 4.07Å; V300-P338 HydrophobicContact CG1-CB 4.35Å; V300-P338 HydrophobicContact CG1-CG 4.36Å; V300-P338 HydrophobicContact CG2-CB 4.25Å; V300-P338 HydrophobicContact CG2-CG 3.91Å
301	Y	98.4	Very high	95.6	Very high	21 Å²	21	47.6 Å²	47.6	8%	0.082	27%	0.267	C	S	.	.	H	α-helix	trans	-64.8	-44	179.1	-178.1	-124.4	0	0	0	112.4	T297 D298 A303 I304 A305 M310 V315 F318 L320 I357	T297-Y301 VanDerWaalsContact O-CB 3.32Å; T297-Y301 WeakPolarHBondContact O-CB 3.22Å; T297-Y301 PolarHBondContact O-N 3.32Å; D298-Y301 PolarHBondContact O-N 2.93Å; Y301-A303 VanDerWaalsContact C-N 3.34Å; Y301-A303 PolarHBondContact O-N 3.26Å; Y301-I304 WeakPolarHBondContact O-CB 3.38Å; Y301-I304 PolarHBondContact O-N 2.77Å; Y301-I304 VanDerWaalsContact O-N 3.09Å; Y301-A305 WeakPolarHBondContact O-CB 3.37Å; Y301-A305 PolarHBondContact O-N 3.48Å; Y301-M310 HydrophobicContact CE2-SD 4.48Å; Y301-V315 HydrophobicContact CD1-CG2 4.5Å; Y301-V315 HydrophobicContact CE1-CG2 3.59Å; Y301-V315 PolarHBondContact OH-O 3.32Å; Y301-V315 VanDerWaalsContact OH-O 3.07Å; Y301-F318 WeakPolarHBondContact OH-CB 3.28Å; Y301-F318 PolarHBondContact OH-O 3.22Å; Y301-L320 HydrophobicContact CD2-CB 4.42Å; Y301-I357 HydrophobicContact CD2-CD1 3.75Å; Y301-I357 HydrophobicContact CE2-CD1 3.86Å
302	Q	97.6	Very high	95.7	Very high	111 Å²	111	52 Å²	52	52%	0.519	30%	0.299	S	S	.	.	H	α-helix	trans	-62.9	-38.6	174.3	-69.1	-63.9	-28.1	0	0	112.3	D298 I304 A305 A306	D298-Q302 WeakPolarHBondContact O-CB 3.41Å; D298-Q302 VanDerWaalsContact O-CG 3.28Å; D298-Q302 WeakPolarHBondContact O-CG 3.45Å; D298-Q302 PolarHBondContact O-N 3.17Å; Q302-I304 VanDerWaalsContact C-N 3.27Å; Q302-I304 PolarHBondContact O-N 3.14Å; Q302-A305 PolarHBondContact O-N 2.7Å; Q302-A306 WeakPolarHBondContact O-CB 3.42Å; Q302-A306 PolarHBondContact O-N 3.48Å
303	A	98.2	Very high	95.9	Very high	34 Å²	34	51.1 Å²	51.1	28%	0.281	30%	0.301	S	S	.	.	H	α-helix	trans	-65.8	-28	173.7	0	0	0	0	0	113.2	V289 V291 Q299 V300 Y301 K307	V289-A303 HydrophobicContact CB-CB 4.42Å; V289-A303 HydrophobicContact CG1-CB 4.48Å; V289-A303 WeakPolarHBondContact CG1-O 3.15Å; V291-A303 HydrophobicContact CG1-CB 3.9Å; Q299-A303 WeakPolarHBondContact O-CB 3.26Å; Q299-A303 PolarHBondContact O-N 3.06Å; Q299-A303 VanDerWaalsContact O-N 3.14Å; V300-A303 PolarHBondContact O-N 2.87Å; Y301-A303 VanDerWaalsContact C-N 3.34Å; Y301-A303 PolarHBondContact O-N 3.26Å; A303-K307 VanDerWaalsContact O-CB 3.3Å; A303-K307 WeakPolarHBondContact O-CB 3.09Å
304	I	98.4	Very high	96.4	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-75.5	-53.5	172.6	-66.5	158	0	0	0	110.2	V279 V287 V289 V300 Y301 Q302 A306 K307 V308 L320 I357	V279-I304 HydrophobicContact CB-CD1 4.23Å; V279-I304 HydrophobicContact CG1-CD1 4.07Å; V279-I304 HydrophobicContact CG2-CD1 3.84Å; V279-I304 HydrophobicContact CG2-CG1 4.46Å; V287-I304 HydrophobicContact CG1-CG2 4.07Å; V289-I304 HydrophobicContact CG1-CB 4.4Å; V289-I304 HydrophobicContact CG1-CG1 3.72Å; V289-I304 HydrophobicContact CG2-CG1 4.04Å; V300-I304 HydrophobicContact CG1-CD1 3.95Å; V300-I304 WeakPolarHBondContact O-CD1 3.49Å; V300-I304 VanDerWaalsContact O-CG1 3.27Å; V300-I304 WeakPolarHBondContact O-CG1 3.36Å; V300-I304 PolarHBondContact O-N 3.33Å; Y301-I304 WeakPolarHBondContact O-CB 3.38Å; Y301-I304 PolarHBondContact O-N 2.77Å; Y301-I304 VanDerWaalsContact O-N 3.09Å; Q302-I304 VanDerWaalsContact C-N 3.27Å; Q302-I304 PolarHBondContact O-N 3.14Å; I304-A306 VanDerWaalsContact C-N 3.34Å; I304-A306 PolarHBondContact O-N 2.9Å; I304-K307 CarbonylContact O-C 3.56Å; I304-K307 WeakPolarHBondContact O-CA 3.47Å; I304-K307 PolarHBondContact O-N 3Å; I304-V308 HydrophobicContact CG2-CG1 4.31Å; I304-V308 PolarHBondContact O-N 2.74Å; I304-L320 HydrophobicContact CD1-CD1 3.95Å; I304-I357 HydrophobicContact CD1-CD1 4.05Å; I304-I357 HydrophobicContact CG2-CD1 4.03Å; I304-I357 HydrophobicContact CG2-CG1 3.87Å
305	A	98.1	Very high	96.8	Very high	3 Å²	3	47.1 Å²	47.1	3%	0.025	28%	0.282	C	S	.	.	H	α-helix	trans	-52.3	-50.6	-179.1	0	0	0	0	0	111.6	Y301 Q302 K307 V308 G309 M310 V315	Y301-A305 WeakPolarHBondContact O-CB 3.37Å; Y301-A305 PolarHBondContact O-N 3.48Å; Q302-A305 PolarHBondContact O-N 2.7Å; A305-K307 PolarHBondContact O-N 3Å; A305-V308 PolarHBondContact O-N 3.16Å; A305-G309 PolarHBondContact O-N 3.11Å; A305-M310 HydrophobicContact CB-CB 4.03Å; A305-M310 HydrophobicContact CB-SD 4.2Å; A305-M310 PolarHBondContact O-N 2.85Å; A305-V315 HydrophobicContact CB-CG2 3.81Å
306	A	97.9	Very high	96.9	Very high	85 Å²	85	51 Å²	51	70%	0.702	30%	0.302	S	S	*	.	H	α-helix	trans	-64.6	-24.1	176.9	0	0	0	0	0	114	Q302 I304	Q302-A306 WeakPolarHBondContact O-CB 3.42Å; Q302-A306 PolarHBondContact O-N 3.48Å; I304-A306 VanDerWaalsContact C-N 3.34Å; I304-A306 PolarHBondContact O-N 2.9Å
307	K	98.3	Very high	96.9	Very high	133 Å²	133	50.9 Å²	50.9	58%	0.578	30%	0.298	S	S	*	.	H	α-helix	trans	-90.9	-26.4	-180	-171.6	163.8	-174.7	173.8	0	113.8	V287 T288 V289 A303 I304 A305	V287-K307 HydrophobicContact CG2-CB 4.41Å; V287-K307 HydrophobicContact CG2-CD 3.88Å; V287-K307 HydrophobicContact CG2-CG 3.95Å; T288-K307 WeakPolarHBondContact O-CE 3.4Å; T288-K307 PolarHBondContact O-NZ 3.02Å; V289-K307 HydrophobicContact CG1-CB 4.46Å; V289-K307 HydrophobicContact CG1-CD 4.16Å; A303-K307 VanDerWaalsContact O-CB 3.3Å; A303-K307 WeakPolarHBondContact O-CB 3.09Å; I304-K307 CarbonylContact O-C 3.56Å; I304-K307 WeakPolarHBondContact O-CA 3.47Å; I304-K307 PolarHBondContact O-N 3Å; A305-K307 PolarHBondContact O-N 3Å
308	V	97.8	Very high	97	Very high	35 Å²	35	50.8 Å²	50.8	21%	0.212	30%	0.297	C	S	.	.	H	α-helix	trans	-91.9	-12.7	173.3	-55	0	0	0	0	113.1	L281 V287 I304 A305 M310 L375	L281-V308 HydrophobicContact CD1-CG1 3.97Å; L281-V308 HydrophobicContact CD2-CG1 4.08Å; V287-V308 HydrophobicContact CB-CG1 4.24Å; V287-V308 HydrophobicContact CG1-CG1 4.24Å; V287-V308 HydrophobicContact CG2-CG1 4.26Å; I304-V308 HydrophobicContact CG2-CG1 4.31Å; I304-V308 PolarHBondContact O-N 2.74Å; A305-V308 PolarHBondContact O-N 3.16Å; V308-M310 HydrophobicContact CG2-CE 4.45Å; V308-M310 HydrophobicContact CG2-CG 3.88Å; V308-M310 HydrophobicContact CG2-SD 4.39Å; V308-L375 HydrophobicContact CG2-CD2 4.47Å
309	G	97	Very high	97.1	Very high	55 Å²	55	47.4 Å²	47.4	57%	0.567	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.2	29.5	179.1	0	0	0	0	0	114.3	A305 D311	A305-G309 PolarHBondContact O-N 3.11Å; G309-D311 PolarHBondContact O-N 3.42Å
310	M	97.1	Very high	97.1	Very high	18 Å²	18	42.6 Å²	42.6	9%	0.089	26%	0.258	C	S	.	.			trans	-66.1	129.2	167.6	-76.3	177.2	176.8	0	0	110	Y301 A305 V308 T314 F318 I357 L375 Y379	Y301-M310 HydrophobicContact CE2-SD 4.48Å; A305-M310 HydrophobicContact CB-CB 4.03Å; A305-M310 HydrophobicContact CB-SD 4.2Å; A305-M310 PolarHBondContact O-N 2.85Å; V308-M310 HydrophobicContact CG2-CE 4.45Å; V308-M310 HydrophobicContact CG2-CG 3.88Å; V308-M310 HydrophobicContact CG2-SD 4.39Å; M310-T314 HydrophobicContact CB-CG2 4.48Å; M310-T314 HydrophobicContact CG-CG2 4.03Å; M310-F318 HydrophobicContact CE-CB 3.97Å; M310-F318 HydrophobicContact CE-CD1 4.24Å; M310-F318 HydrophobicContact CE-CD2 3.67Å; M310-F318 HydrophobicContact CE-CE2 4.21Å; M310-F318 HydrophobicContact CE-CG 3.69Å; M310-F318 HydrophobicContact SD-CD2 4.47Å; M310-I357 HydrophobicContact CE-CG2 4.13Å; M310-L375 HydrophobicContact CB-CD2 4.48Å; M310-L375 HydrophobicContact CG-CD2 3.79Å; M310-Y379 HydrophobicContact CE-CD2 4.02Å; M310-Y379 HydrophobicContact CE-CE2 3.82Å
311	D	95.7	Very high	97.1	Very high	59 Å²	59	42.8 Å²	42.8	32%	0.316	26%	0.259	S	S	.	.			trans	-76.8	173.4	169.8	62	67.4	0	0	0	112.5	G309 T313 T314 V315 N373	G309-D311 PolarHBondContact O-N 3.42Å; D311-T313 PolarHBondContact O-N 3.3Å; D311-T313 VanDerWaalsContact O-N 3.16Å; D311-T313 WeakPolarHBondContact OD1-CA 3.44Å; D311-T313 VanDerWaalsContact OD1-CB 3.28Å; D311-T313 WeakPolarHBondContact OD1-CB 3.4Å; D311-T313 PolarHBondContact OD1-N 2.9Å; D311-T314 VanDerWaalsContact CG-OG1 3.29Å; D311-T314 PolarHBondContact O-N 2.85Å; D311-T314 PolarHBondContact OD1-N 3.45Å; D311-T314 PolarHBondContact OD1-OG1 2.95Å; D311-T314 VanDerWaalsContact OD1-OG1 3.11Å; D311-T314 PolarHBondContact OD2-OG1 2.88Å; D311-V315 WeakPolarHBondContact O-CB 3.4Å; D311-V315 WeakPolarHBondContact O-CG1 3.47Å; D311-V315 PolarHBondContact O-N 3.29Å; D311-V315 VanDerWaalsContact O-N 3.13Å; D311-N373 PolarHBondContact OD2-ND2 2.9Å
312	S	95.2	Very high	96.8	Very high	104 Å²	104	42 Å²	42	73%	0.727	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-11.7	-178.4	52.7	0	0	0	0	115.3	N316	S312-N316 PolarHBondContact O-ND2 3.06Å
313	T	94.1	Very high	96.3	Very high	75 Å²	75	37.2 Å²	37.2	46%	0.46	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-52.8	176.5	-55.6	0	0	0	0	109.3	D311 V315 N316 Y317 L370	D311-T313 PolarHBondContact O-N 3.3Å; D311-T313 VanDerWaalsContact O-N 3.16Å; D311-T313 WeakPolarHBondContact OD1-CA 3.44Å; D311-T313 VanDerWaalsContact OD1-CB 3.28Å; D311-T313 WeakPolarHBondContact OD1-CB 3.4Å; D311-T313 PolarHBondContact OD1-N 2.9Å; T313-V315 VanDerWaalsContact C-N 3.27Å; T313-V315 PolarHBondContact O-N 2.96Å; T313-N316 PolarHBondContact O-N 2.78Å; T313-N316 VanDerWaalsContact O-N 3.16Å; T313-N316 PolarHBondContact O-ND2 2.94Å; T313-Y317 HydrophobicContact CG2-CE2 4.1Å; T313-Y317 VanDerWaalsContact O-CD2 3.23Å; T313-Y317 WeakPolarHBondContact O-CD2 3.34Å; T313-Y317 WeakPolarHBondContact O-CE2 3.34Å; T313-L370 HydrophobicContact CG2-CD2 4.36Å
314	T	94.4	Very high	95.5	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-56.8	-37.2	-179.3	-58.8	0	0	0	0	112.5	M310 D311 N316 Y317 F318 N373 A376	M310-T314 HydrophobicContact CB-CG2 4.48Å; M310-T314 HydrophobicContact CG-CG2 4.03Å; D311-T314 VanDerWaalsContact CG-OG1 3.29Å; D311-T314 PolarHBondContact O-N 2.85Å; D311-T314 PolarHBondContact OD1-N 3.45Å; D311-T314 PolarHBondContact OD1-OG1 2.95Å; D311-T314 VanDerWaalsContact OD1-OG1 3.11Å; D311-T314 PolarHBondContact OD2-OG1 2.88Å; T314-N316 PolarHBondContact O-N 2.83Å; T314-Y317 PolarHBondContact O-N 3.11Å; T314-Y317 VanDerWaalsContact O-N 3.11Å; T314-F318 HydrophobicContact CG2-CD2 4.07Å; T314-F318 HydrophobicContact CG2-CE2 3.82Å; T314-F318 WeakPolarHBondContact O-CD2 3.47Å; T314-N373 PolarHBondContact OG1-ND2 2.92Å; T314-A376 HydrophobicContact CG2-CB 4.18Å
315	V	96.2	Very high	94.3	Very high	20 Å²	20	42.8 Å²	42.8	12%	0.121	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-61.9	-12.7	-179.9	73.9	0	0	0	0	114.7	Y301 A305 D311 T313	Y301-V315 HydrophobicContact CD1-CG2 4.5Å; Y301-V315 HydrophobicContact CE1-CG2 3.59Å; Y301-V315 PolarHBondContact OH-O 3.32Å; Y301-V315 VanDerWaalsContact OH-O 3.07Å; A305-V315 HydrophobicContact CB-CG2 3.81Å; D311-V315 WeakPolarHBondContact O-CB 3.4Å; D311-V315 WeakPolarHBondContact O-CG1 3.47Å; D311-V315 PolarHBondContact O-N 3.29Å; D311-V315 VanDerWaalsContact O-N 3.13Å; T313-V315 VanDerWaalsContact C-N 3.27Å; T313-V315 PolarHBondContact O-N 2.96Å
316	N	95.5	Very high	93.1	Very high	91 Å²	91	48 Å²	48	49%	0.487	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-91.9	-3.8	178.3	-48.6	-71.5	0	0	0	113.7	S312 T313 T314 R516	S312-N316 PolarHBondContact O-ND2 3.06Å; T313-N316 PolarHBondContact O-N 2.78Å; T313-N316 VanDerWaalsContact O-N 3.16Å; T313-N316 PolarHBondContact O-ND2 2.94Å; T314-N316 PolarHBondContact O-N 2.83Å; N316-R516 PolarHBondContact O-NH2 3.26Å
317	Y	96.9	Very high	92.2	Very high	31 Å²	31	47 Å²	47	12%	0.122	27%	0.271	C	S	.	.	S	Bend	trans	-117	6.6	-173.9	-58.8	-67.5	0	0	0	113.4	T313 T314 W360 L361 E366 L370 W523	T313-Y317 HydrophobicContact CG2-CE2 4.1Å; T313-Y317 VanDerWaalsContact O-CD2 3.23Å; T313-Y317 WeakPolarHBondContact O-CD2 3.34Å; T313-Y317 WeakPolarHBondContact O-CE2 3.34Å; T314-Y317 PolarHBondContact O-N 3.11Å; T314-Y317 VanDerWaalsContact O-N 3.11Å; Y317-W360 PolarHBondContact O-N 2.9Å; Y317-L361 HydrophobicContact CD1-CB 4.37Å; Y317-L361 HydrophobicContact CD1-CD1 3.81Å; Y317-L361 HydrophobicContact CD1-CD2 3.76Å; Y317-L361 HydrophobicContact CD1-CG 4.2Å; Y317-L361 HydrophobicContact CE1-CD1 4.04Å; Y317-L361 HydrophobicContact CE1-CD2 4.31Å; Y317-L361 HydrophobicContact CG-CD2 4.36Å; Y317-E366 HydrophobicContact CE1-CB 4.29Å; Y317-E366 PolarHBondContact OH-OE2 3.11Å; Y317-L370 HydrophobicContact CD2-CD1 3.57Å; Y317-L370 HydrophobicContact CD2-CD2 4.13Å; Y317-L370 HydrophobicContact CD2-CG 4.37Å; Y317-L370 HydrophobicContact CE2-CD1 4.05Å; Y317-L370 HydrophobicContact CE2-CD2 4.16Å; Y317-L370 HydrophobicContact CE2-CG 4.46Å; Y317-L370 HydrophobicContact CG-CD1 3.8Å; Y317-W523 HydrophobicContact CE1-CH2 4.38Å; Y317-W523 HydrophobicContact CE1-CZ3 4.14Å
318	F	98.1	Very high	91.8	Very high	6 Å²	6	41.6 Å²	41.6	3%	0.026	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	162.1	172.3	-67.5	-90.4	0	0	0	109.5	P282 Y301 M310 T314 I357 R358 K359 A376 Y379 F380	P282-F318 HydrophobicContact CG-CE1 4.33Å; Y301-F318 WeakPolarHBondContact OH-CB 3.28Å; Y301-F318 PolarHBondContact OH-O 3.22Å; M310-F318 HydrophobicContact CE-CB 3.97Å; M310-F318 HydrophobicContact CE-CD1 4.24Å; M310-F318 HydrophobicContact CE-CD2 3.67Å; M310-F318 HydrophobicContact CE-CE2 4.21Å; M310-F318 HydrophobicContact CE-CG 3.69Å; M310-F318 HydrophobicContact SD-CD2 4.47Å; T314-F318 HydrophobicContact CG2-CD2 4.07Å; T314-F318 HydrophobicContact CG2-CE2 3.82Å; T314-F318 WeakPolarHBondContact O-CD2 3.47Å; F318-I357 HydrophobicContact CB-CG2 4.04Å; F318-I357 HydrophobicContact CD1-CG2 3.88Å; F318-I357 HydrophobicContact CG-CG2 4.26Å; F318-R358 WeakPolarHBondContact CA-O 3.24Å; F318-R358 WeakPolarHBondContact CD1-O 3.42Å; F318-K359 HydrophobicContact CE1-CB 4.41Å; F318-A376 HydrophobicContact CE2-CB 4.49Å; F318-Y379 HydrophobicContact CD1-CD2 4.43Å; F318-Y379 AromaticContact CE1-CD2 3.85Å; F318-Y379 HydrophobicContact CE1-CD2 3.85Å; F318-Y379 HydrophobicContact CE1-CG 4.29Å; F318-Y379 AromaticContact CZ-CD2 3.96Å; F318-Y379 HydrophobicContact CZ-CD2 3.96Å; F318-Y379 HydrophobicContact CZ-CG 4.3Å; F318-F380 HydrophobicContact CE1-CD1 4.02Å; F318-F380 AromaticContact CE1-CE1 3.83Å; F318-F380 HydrophobicContact CE1-CE1 3.83Å; F318-F380 HydrophobicContact CE2-CD1 4.43Å; F318-F380 AromaticContact CE2-CE1 3.65Å; F318-F380 HydrophobicContact CE2-CE1 3.65Å; F318-F380 HydrophobicContact CE2-CZ 4.16Å; F318-F380 AromaticContact CZ-CD1 3.57Å; F318-F380 HydrophobicContact CZ-CD1 3.57Å; F318-F380 AromaticContact CZ-CE1 3.19Å; F318-F380 HydrophobicContact CZ-CE1 3.19Å; F318-F380 HydrophobicContact CZ-CZ 4.08Å
319	A	98.4	Very high	91.5	Very high	11 Å²	11	41.3 Å²	41.3	9%	0.091	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	173.4	170	0	0	0	0	0	110.9	F321 K331 I357 R358 W360	A319-F321 HydrophobicContact CB-CD2 4.33Å; A319-F321 HydrophobicContact CB-CE2 3.69Å; A319-F321 HydrophobicContact CB-CZ 4.3Å; A319-F321 VanDerWaalsContact O-CD2 3.25Å; A319-F321 WeakPolarHBondContact O-CD2 3.5Å; A319-F321 WeakPolarHBondContact O-CE2 3.48Å; A319-K331 HydrophobicContact CB-CD 4.15Å; A319-K331 HydrophobicContact CB-CG 3.97Å; A319-I357 WeakPolarHBondContact O-CA 3.49Å; A319-R358 PolarHBondContact N-O 2.95Å; A319-R358 VanDerWaalsContact N-O 3.09Å; A319-R358 PolarHBondContact O-N 2.73Å; A319-W360 HydrophobicContact CB-CB 3.95Å; A319-W360 HydrophobicContact CB-CG 4.19Å
320	L	98.3	Very high	91.4	Very high	3 Å²	3	40.5 Å²	40.5	2%	0.016	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	129.3	170.8	-174.8	62.7	0	0	0	109.9	V279 T297 V300 Y301 I304 L332 P338 L355 I357	V279-L320 HydrophobicContact CG1-CD1 3.85Å; T297-L320 HydrophobicContact CG2-CB 4.33Å; T297-L320 HydrophobicContact CG2-CD2 4.43Å; V300-L320 HydrophobicContact CB-CD2 4.16Å; V300-L320 HydrophobicContact CG1-CD2 3.81Å; Y301-L320 HydrophobicContact CD2-CB 4.42Å; I304-L320 HydrophobicContact CD1-CD1 3.95Å; L320-L332 HydrophobicContact CD2-CD1 4.05Å; L320-L332 HydrophobicContact CG-CD1 4.02Å; L320-L332 PolarHBondContact O-N 3.49Å; L320-P338 HydrophobicContact CD2-CB 4.14Å; L320-P338 HydrophobicContact CD2-CG 3.75Å; L320-L355 HydrophobicContact CD1-CB 4.32Å; L320-I357 HydrophobicContact CB-CD1 4.31Å; L320-I357 HydrophobicContact CD1-CD1 3.84Å
321	F	97.1	Very high	91.4	Very high	4 Å²	4	41 Å²	41	2%	0.018	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	156.2	-176.5	-66.3	-109.9	0	0	0	111.1	A319 V329 R330 K331 L355 T356 R358 W360	A319-F321 HydrophobicContact CB-CD2 4.33Å; A319-F321 HydrophobicContact CB-CE2 3.69Å; A319-F321 HydrophobicContact CB-CZ 4.3Å; A319-F321 VanDerWaalsContact O-CD2 3.25Å; A319-F321 WeakPolarHBondContact O-CD2 3.5Å; A319-F321 WeakPolarHBondContact O-CE2 3.48Å; F321-V329 HydrophobicContact CD1-CB 4.4Å; F321-R330 CarbonylContact C-O 3.52Å; F321-R330 WeakPolarHBondContact CA-O 3.27Å; F321-R330 VanDerWaalsContact CB-O 3.25Å; F321-R330 WeakPolarHBondContact CB-O 3.03Å; F321-R330 VanDerWaalsContact CD1-C 3.41Å; F321-R330 WeakPolarHBondContact CD1-O 3.47Å; F321-K331 HydrophobicContact CD1-CB 4.1Å; F321-K331 VanDerWaalsContact CD1-N 3.35Å; F321-K331 HydrophobicContact CE1-CB 3.88Å; F321-K331 HydrophobicContact CZ-CB 4.31Å; F321-L355 WeakPolarHBondContact O-CA 3.25Å; F321-T356 HydrophobicContact CB-CG2 3.84Å; F321-T356 PolarHBondContact N-O 3.34Å; F321-T356 PolarHBondContact O-N 2.76Å; F321-R358 HydrophobicContact CD2-CB 3.76Å; F321-R358 HydrophobicContact CE2-CB 3.69Å; F321-R358 WeakPolarHBondContact CE2-O 3.49Å; F321-R358 HydrophobicContact CG-CB 4.31Å; F321-R358 HydrophobicContact CZ-CB 4.17Å; F321-W360 HydrophobicContact CE1-CE3 4.43Å; F321-W360 HydrophobicContact CZ-CB 4.46Å; F321-W360 AromaticContact CZ-CE3 3.98Å; F321-W360 HydrophobicContact CZ-CE3 3.98Å
322	E	92.5	Very high	91.4	Very high	5 Å²	5	38.2 Å²	38.2	2%	0.023	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	138.2	167	169.7	171.1	-121.1	0	0	111.1	I324 V329 R330 L332 L341 N345 C354	E322-I324 HydrophobicContact CG-CG1 3.91Å; E322-V329 WeakPolarHBondContact O-CA 3.35Å; E322-R330 HydrophobicContact CB-CG 4.24Å; E322-R330 PolarHBondContact N-O 3.44Å; E322-R330 PolarHBondContact O-N 2.93Å; E322-R330 IonicContact OE2-CZ 2.77Å; E322-R330 VanDerWaalsContact OE2-CZ 3.25Å; E322-R330 IonicContact OE2-NE 2.61Å; E322-R330 PolarHBondContact OE2-NE 3Å; E322-R330 IonicContact OE2-NH2 3.17Å; E322-R330 PolarHBondContact OE2-NH2 2.77Å; E322-L332 HydrophobicContact CB-CD2 3.76Å; E322-L341 WeakPolarHBondContact OE1-CB 3.38Å; E322-N345 PolarHBondContact OE1-ND2 3.23Å; E322-C354 CarbonylContact C-O 3.4Å; E322-C354 WeakPolarHBondContact CA-O 3.4Å
323	V	87.8	Confident	91.3	Very high	10 Å²	10	34.5 Å²	34.5	6%	0.061	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	105.7	176.5	-172.5	0	0	0	0	110.2	F328 V329 S348 V350 C354 T356	V323-F328 WeakPolarHBondContact CA-O 3.33Å; V323-V329 HydrophobicContact CG2-CG1 4.05Å; V323-S348 PolarHBondContact O-OG 2.85Å; V323-V350 HydrophobicContact CG1-CG2 4.07Å; V323-V350 HydrophobicContact CG2-CG2 4.35Å; V323-C354 PolarHBondContact N-O 2.83Å; V323-T356 HydrophobicContact CG2-CG2 3.72Å
324	I	81.6	Confident	91.1	Very high	25 Å²	25	33.9 Å²	33.9	13%	0.128	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	137.3	-177.7	-57.2	-178.8	0	0	0	109.6	E322 H326 S327 F328 R330 Y506	E322-I324 HydrophobicContact CG-CG1 3.91Å; I324-H326 PolarHBondContact O-N 2.95Å; I324-S327 PolarHBondContact O-N 3.26Å; I324-F328 HydrophobicContact CB-CD1 4.48Å; I324-F328 PolarHBondContact N-O 3.44Å; I324-F328 PolarHBondContact O-N 3.18Å; I324-F328 VanDerWaalsContact O-N 3.1Å; I324-R330 HydrophobicContact CD1-CG 3.89Å; I324-Y506 HydrophobicContact CD1-CE1 3.73Å
325	N	72.2	Confident	90.8	Very high	125 Å²	125	39.5 Å²	39.5	67%	0.668	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.2	38.4	178.4	-60.8	-6.3	0	0	0	112.9	S327	N325-S327 PolarHBondContact O-N 3.36Å; N325-S327 PolarHBondContact O-OG 3.29Å
326	H	72.9	Confident	90.6	Very high	112 Å²	112	40.6 Å²	40.6	52%	0.519	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.9	-1.5	174.4	-41.7	-20.7	0	0	0	116.2	I324 A349	I324-H326 PolarHBondContact O-N 2.95Å; H326-A349 HydrophobicContact CB-CB 3.98Å; H326-A349 PolarHBondContact CE1-N 2.97Å; H326-A349 VanDerWaalsContact CG-CB 3.44Å; H326-A349 PolarHBondContact ND1-N 2.97Å
327	S	80.1	Confident	90.5	Very high	66 Å²	66	39.9 Å²	39.9	46%	0.462	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-138.9	-47.4	-163.2	51.3	0	0	0	0	112.6	I324 N325 Y392	I324-S327 PolarHBondContact O-N 3.26Å; N325-S327 PolarHBondContact O-N 3.36Å; N325-S327 PolarHBondContact O-OG 3.29Å; S327-Y392 PolarHBondContact O-OH 3.3Å
328	F	88.8	Confident	90.3	Very high	18 Å²	18	38.4 Å²	38.4	8%	0.079	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	148.3	177.2	-176.7	-122.3	0	0	0	111.6	V323 I324 R330 I428 F429 P430 Y506 Y509	V323-F328 WeakPolarHBondContact CA-O 3.33Å; I324-F328 HydrophobicContact CB-CD1 4.48Å; I324-F328 PolarHBondContact N-O 3.44Å; I324-F328 PolarHBondContact O-N 3.18Å; I324-F328 VanDerWaalsContact O-N 3.1Å; F328-R330 HydrophobicContact CE1-CB 4.25Å; F328-I428 WeakPolarHBondContact CE2-O 3.35Å; F328-F429 HydrophobicContact CE2-CD1 4.36Å; F328-F429 HydrophobicContact CE2-CG 4.36Å; F328-F429 AromaticContact CZ-CD1 3.87Å; F328-F429 HydrophobicContact CZ-CD1 3.87Å; F328-F429 HydrophobicContact CZ-CE1 4.2Å; F328-F429 HydrophobicContact CZ-CG 4.33Å; F328-P430 HydrophobicContact CB-CG 4.18Å; F328-P430 HydrophobicContact CD1-CG 4.02Å; F328-P430 HydrophobicContact CD2-CG 4.14Å; F328-P430 HydrophobicContact CE1-CG 4.47Å; F328-P430 HydrophobicContact CG-CG 3.84Å; F328-Y506 HydrophobicContact CD1-CD1 4.47Å; F328-Y506 HydrophobicContact CD1-CD2 4.42Å; F328-Y506 HydrophobicContact CD1-CE1 4.15Å; F328-Y506 HydrophobicContact CD1-CE2 4.12Å; F328-Y506 AromaticContact CD1-CZ 3.96Å; F328-Y506 AromaticContact CE1-CD1 3.71Å; F328-Y506 HydrophobicContact CE1-CD1 3.71Å; F328-Y506 AromaticContact CE1-CD2 3.78Å; F328-Y506 HydrophobicContact CE1-CD2 3.78Å; F328-Y506 AromaticContact CE1-CE1 3.85Å; F328-Y506 HydrophobicContact CE1-CE1 3.85Å; F328-Y506 AromaticContact CE1-CE2 3.92Å; F328-Y506 HydrophobicContact CE1-CE2 3.92Å; F328-Y506 AromaticContact CE1-CG 3.67Å; F328-Y506 HydrophobicContact CE1-CG 3.67Å; F328-Y506 AromaticContact CE1-CZ 3.95Å; F328-Y506 HydrophobicContact CZ-CD2 4.35Å; F328-Y506 HydrophobicContact CZ-CG 4.25Å; F328-Y509 HydrophobicContact CE2-CE1 4.41Å; F328-Y509 AromaticContact CZ-CD1 3.98Å; F328-Y509 HydrophobicContact CZ-CD1 3.98Å; F328-Y509 AromaticContact CZ-CE1 3.87Å; F328-Y509 HydrophobicContact CZ-CE1 3.87Å
329	V	91.8	Very high	89.8	Confident	29 Å²	29	38.6 Å²	38.6	18%	0.176	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	126	176.6	-70.8	0	0	0	0	110.6	F321 E322 V323 T356 Y509	F321-V329 HydrophobicContact CD1-CB 4.4Å; E322-V329 WeakPolarHBondContact O-CA 3.35Å; V323-V329 HydrophobicContact CG2-CG1 4.05Å; V329-T356 HydrophobicContact CG1-CG2 4.47Å; V329-Y509 WeakPolarHBondContact O-CE1 3.29Å; V329-Y509 PolarHBondContact O-OH 3.07Å
330	R	93.9	Very high	89.1	Confident	38 Å²	38	42 Å²	42	14%	0.143	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	143.3	171	70.8	173.3	-172.2	99.1	-2.3	110.5	F321 E322 I324 F328 E336 Y509	F321-R330 CarbonylContact C-O 3.52Å; F321-R330 WeakPolarHBondContact CA-O 3.27Å; F321-R330 VanDerWaalsContact CB-O 3.25Å; F321-R330 WeakPolarHBondContact CB-O 3.03Å; F321-R330 VanDerWaalsContact CD1-C 3.41Å; F321-R330 WeakPolarHBondContact CD1-O 3.47Å; E322-R330 HydrophobicContact CB-CG 4.24Å; E322-R330 PolarHBondContact N-O 3.44Å; E322-R330 PolarHBondContact O-N 2.93Å; E322-R330 IonicContact OE2-CZ 2.77Å; E322-R330 VanDerWaalsContact OE2-CZ 3.25Å; E322-R330 IonicContact OE2-NE 2.61Å; E322-R330 PolarHBondContact OE2-NE 3Å; E322-R330 IonicContact OE2-NH2 3.17Å; E322-R330 PolarHBondContact OE2-NH2 2.77Å; I324-R330 HydrophobicContact CD1-CG 3.89Å; F328-R330 HydrophobicContact CE1-CB 4.25Å; R330-E336 IonicContact CZ-OE1 2.65Å; R330-E336 IonicContact CZ-OE2 3.26Å; R330-E336 VanDerWaalsContact NH1-CD 3.32Å; R330-E336 IonicContact NH1-OE1 3.58Å; R330-E336 PolarHBondContact NH1-OE1 2.98Å; R330-E336 IonicContact NH1-OE2 2.72Å; R330-E336 PolarHBondContact NH1-OE2 3.24Å; R330-E336 VanDerWaalsContact NH1-OE2 3.13Å; R330-E336 IonicContact NH2-OE1 2.8Å; R330-E336 IonicContact NH2-OE2 2.7Å; R330-E336 PolarHBondContact NH2-OE2 2.7Å; R330-Y509 HydrophobicContact CB-CD1 3.78Å; R330-Y509 HydrophobicContact CB-CE1 4.05Å; R330-Y509 HydrophobicContact CB-CG 4.14Å
331	K	97.4	Very high	88.4	Confident	28 Å²	28	42.9 Å²	42.9	12%	0.122	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	147.1	166.4	-171.3	-172.8	137.3	-59.8	0	108.5	A319 F321 W360 Y509 E512	A319-K331 HydrophobicContact CB-CD 4.15Å; A319-K331 HydrophobicContact CB-CG 3.97Å; F321-K331 HydrophobicContact CD1-CB 4.1Å; F321-K331 VanDerWaalsContact CD1-N 3.35Å; F321-K331 HydrophobicContact CE1-CB 3.88Å; F321-K331 HydrophobicContact CZ-CB 4.31Å; K331-W360 HydrophobicContact CD-CD2 3.9Å; K331-W360 HydrophobicContact CD-CE3 4.24Å; K331-W360 HydrophobicContact CD-CG 4.45Å; K331-W360 HydrophobicContact CD-CH2 4.08Å; K331-W360 HydrophobicContact CD-CZ2 3.73Å; K331-W360 HydrophobicContact CD-CZ3 4.32Å; K331-Y509 HydrophobicContact CB-CD2 3.8Å; K331-Y509 HydrophobicContact CB-CE2 3.43Å; K331-Y509 VanDerWaalsContact CB-CE2 3.43Å; K331-Y509 VanDerWaalsContact N-CE2 3.28Å; K331-E512 WeakPolarHBondContact CD-OE2 3.32Å; K331-E512 WeakPolarHBondContact CE-OE2 3.36Å; K331-E512 IonicContact NZ-OE1 3.87Å; K331-E512 PolarHBondContact NZ-OE1 2.91Å; K331-E512 IonicContact NZ-OE2 2.78Å; K331-E512 PolarHBondContact NZ-OE2 3.37Å
332	L	96.6	Very high	87.6	Confident	2 Å²	2	43.1 Å²	43.1	1%	0.01	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-84.7	142.1	169.6	-61.2	-170.7	0	0	0	110.9	T297 L320 E322 E336 P338 L341 L355	T297-L332 HydrophobicContact CG2-CB 3.65Å; L320-L332 HydrophobicContact CD2-CD1 4.05Å; L320-L332 HydrophobicContact CG-CD1 4.02Å; L320-L332 PolarHBondContact O-N 3.49Å; E322-L332 HydrophobicContact CB-CD2 3.76Å; L332-E336 WeakPolarHBondContact CA-OE1 3.34Å; L332-P338 HydrophobicContact CD1-CB 4.19Å; L332-P338 HydrophobicContact CD1-CG 3.9Å; L332-L341 HydrophobicContact CD1-CD1 3.85Å; L332-L341 HydrophobicContact CD2-CD1 3.45Å; L332-L341 VanDerWaalsContact CD2-CD1 3.45Å; L332-L341 HydrophobicContact CG-CD1 4.32Å; L332-L355 HydrophobicContact CD1-CD2 4Å
333	A	92.9	Very high	86.7	Confident	25 Å²	25	44.3 Å²	44.3	21%	0.207	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-73.5	148.4	171.8	0	0	0	0	0	110.3	T297 N335 E336	T297-A333 WeakPolarHBondContact CB-O 3.33Å; T297-A333 PolarHBondContact OG1-O 2.98Å; A333-N335 WeakPolarHBondContact CB-OD1 3.25Å; A333-N335 PolarHBondContact O-N 2.87Å; A333-E336 HydrophobicContact CB-CG 4.21Å; A333-E336 PolarHBondContact N-OE1 2.76Å; A333-E336 PolarHBondContact O-N 3.07Å
334	P	90.4	Very high	86	Confident	62 Å²	62	49.8 Å²	49.8	40%	0.403	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-30.9	-176	-31.2	38.1	0	0	0	115.2	T296 T297 D298	T296-P334 WeakPolarHBondContact CB-O 3.42Å; T297-P334 PolarHBondContact N-O 3.2Å; D298-P334 WeakPolarHBondContact OD1-CB 3.49Å
335	N	87.3	Confident	85.3	Confident	119 Å²	119	51.3 Å²	51.3	64%	0.636	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-3.3	-177.1	63.1	-18.5	0	0	0	114.8	A333	A333-N335 WeakPolarHBondContact CB-OD1 3.25Å; A333-N335 PolarHBondContact O-N 2.87Å
336	E	93.1	Very high	84.9	Confident	43 Å²	43	46.3 Å²	46.3	20%	0.201	24%	0.236	C	C	.	.			trans	-69	164.1	172.5	-75.7	-175	-94.6	0	0	112.1	T296 T297 R330 L332 A333 P338	T296-E336 CarbonylContact C-O 3.55Å; T296-E336 VanDerWaalsContact CA-O 3.22Å; T296-E336 WeakPolarHBondContact CA-O 3.41Å; T297-E336 PolarHBondContact N-O 3.47Å; T297-E336 PolarHBondContact OG1-O 3.03Å; R330-E336 IonicContact CZ-OE1 2.65Å; R330-E336 IonicContact CZ-OE2 3.26Å; R330-E336 VanDerWaalsContact NH1-CD 3.32Å; R330-E336 IonicContact NH1-OE1 3.58Å; R330-E336 PolarHBondContact NH1-OE1 2.98Å; R330-E336 IonicContact NH1-OE2 2.72Å; R330-E336 PolarHBondContact NH1-OE2 3.24Å; R330-E336 VanDerWaalsContact NH1-OE2 3.13Å; R330-E336 IonicContact NH2-OE1 2.8Å; R330-E336 IonicContact NH2-OE2 2.7Å; R330-E336 PolarHBondContact NH2-OE2 2.7Å; L332-E336 WeakPolarHBondContact CA-OE1 3.34Å; A333-E336 HydrophobicContact CB-CG 4.21Å; A333-E336 PolarHBondContact N-OE1 2.76Å; A333-E336 PolarHBondContact O-N 3.07Å; E336-P338 WeakPolarHBondContact O-CD 3.46Å
337	F	92.4	Very high	84	Confident	76 Å²	76	44.9 Å²	44.9	33%	0.333	24%	0.236	S	C	.	.			trans	-116.4	93.3	-179.9	-60.7	-76.8	0	0	0	110	N294 T296 H339 K340	N294-F337 HydrophobicContact CB-CE1 4.41Å; N294-F337 WeakPolarHBondContact O-CD1 3.45Å; N294-F337 WeakPolarHBondContact O-CE1 3.42Å; T296-F337 HydrophobicContact CG2-CE1 4.13Å; F337-H339 PolarHBondContact O-N 2.75Å; F337-K340 HydrophobicContact CB-CD 4.17Å; F337-K340 HydrophobicContact CB-CG 4.05Å; F337-K340 HydrophobicContact CD2-CD 4.44Å; F337-K340 PolarHBondContact O-N 3.43Å
338	P	93.1	Very high	82.8	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-57	-25.4	-172.7	-28.2	35.3	0	0	0	114.8	L277 V300 L320 L332 E336 K340 Y342 L355	L277-P338 HydrophobicContact CD1-CB 4.21Å; V300-P338 HydrophobicContact CB-CG 4.07Å; V300-P338 HydrophobicContact CG1-CB 4.35Å; V300-P338 HydrophobicContact CG1-CG 4.36Å; V300-P338 HydrophobicContact CG2-CB 4.25Å; V300-P338 HydrophobicContact CG2-CG 3.91Å; L320-P338 HydrophobicContact CD2-CB 4.14Å; L320-P338 HydrophobicContact CD2-CG 3.75Å; L332-P338 HydrophobicContact CD1-CB 4.19Å; L332-P338 HydrophobicContact CD1-CG 3.9Å; E336-P338 WeakPolarHBondContact O-CD 3.46Å; P338-K340 PolarHBondContact O-N 3.09Å; P338-Y342 WeakPolarHBondContact O-CB 3.23Å; P338-Y342 PolarHBondContact O-N 3.42Å; P338-L355 HydrophobicContact CB-CD1 3.85Å; P338-L355 HydrophobicContact CB-CD2 4.16Å
339	H	87.8	Confident	80.8	Confident	9 Å²	9	44.2 Å²	44.2	4%	0.042	24%	0.237	C	C	.	.	H	α-helix	trans	-60.5	-41	172.7	175.6	-109.1	0	0	0	113.1	V275 L277 F337 Y342 I343	V275-H339 HydrophobicContact CG2-CB 4.46Å; L277-H339 HydrophobicContact CD2-CB 4.19Å; F337-H339 PolarHBondContact O-N 2.75Å; H339-Y342 PolarHBondContact O-N 2.94Å; H339-I343 WeakPolarHBondContact O-CG1 3.5Å; H339-I343 PolarHBondContact O-N 3.17Å; H339-I343 VanDerWaalsContact O-N 3.09Å
340	K	83.3	Confident	79.1	Confident	83 Å²	83	45 Å²	45	36%	0.361	24%	0.242	S	C	.	.	H	α-helix	trans	-61.7	-49.5	179.4	-65.7	-172	178.7	-175.8	0	110.7	F337 P338 Y342 I343 Q344	F337-K340 HydrophobicContact CB-CD 4.17Å; F337-K340 HydrophobicContact CB-CG 4.05Å; F337-K340 HydrophobicContact CD2-CD 4.44Å; F337-K340 PolarHBondContact O-N 3.43Å; P338-K340 PolarHBondContact O-N 3.09Å; K340-Y342 VanDerWaalsContact C-N 3.33Å; K340-Y342 PolarHBondContact O-N 3.05Å; K340-I343 VanDerWaalsContact O-CG1 3.3Å; K340-I343 WeakPolarHBondContact O-CG1 3.42Å; K340-I343 PolarHBondContact O-N 3.09Å; K340-Q344 WeakPolarHBondContact O-CB 3.41Å; K340-Q344 VanDerWaalsContact O-CG 3.29Å; K340-Q344 WeakPolarHBondContact O-CG 3.44Å; K340-Q344 PolarHBondContact O-N 3.43Å; K340-Q344 PolarHBondContact O-OE1 2.95Å
341	L	83.2	Confident	77.6	Confident	21 Å²	21	48.5 Å²	48.5	11%	0.11	27%	0.269	C	S	.	.	H	α-helix	trans	-58.4	-43.9	176	-58.6	179.2	0	0	0	111.8	E322 L332 I343 Q344 N345	E322-L341 WeakPolarHBondContact OE1-CB 3.38Å; L332-L341 HydrophobicContact CD1-CD1 3.85Å; L332-L341 HydrophobicContact CD2-CD1 3.45Å; L332-L341 VanDerWaalsContact CD2-CD1 3.45Å; L332-L341 HydrophobicContact CG-CD1 4.32Å; L341-I343 VanDerWaalsContact C-N 3.33Å; L341-I343 PolarHBondContact O-N 3.36Å; L341-Q344 PolarHBondContact O-N 2.85Å; L341-N345 PolarHBondContact O-N 2.93Å
342	Y	80.4	Confident	76.3	Confident	9 Å²	9	47.2 Å²	47.2	4%	0.035	26%	0.264	C	S	.	.	H	α-helix	trans	-64	-31.1	-179.8	-177.5	-102.6	0	0	0	114.3	R190 L277 R278 P338 H339 K340 L355	R190-Y342 HydrophobicContact CB-CE1 3.82Å; R190-Y342 WeakPolarHBondContact CD-O 3.28Å; R190-Y342 HydrophobicContact CG-CE1 4.02Å; R190-Y342 HydrophobicContact CG-CE2 4.04Å; R190-Y342 PolarHBondContact NH1-O 3.23Å; L277-Y342 HydrophobicContact CD2-CD1 3.49Å; L277-Y342 VanDerWaalsContact CD2-CD1 3.49Å; L277-Y342 HydrophobicContact CD2-CD2 4.5Å; L277-Y342 HydrophobicContact CD2-CE1 3.92Å; L277-Y342 HydrophobicContact CD2-CG 3.79Å; R278-Y342 HydrophobicContact CB-CE2 4.2Å; R278-Y342 VanDerWaalsContact CB-OH 3.3Å; R278-Y342 WeakPolarHBondContact CB-OH 3.26Å; R278-Y342 PolarHBondContact N-OH 2.98Å; R278-Y342 VanDerWaalsContact O-CE2 3.29Å; R278-Y342 WeakPolarHBondContact O-CE2 3.45Å; P338-Y342 WeakPolarHBondContact O-CB 3.23Å; P338-Y342 PolarHBondContact O-N 3.42Å; H339-Y342 PolarHBondContact O-N 2.94Å; K340-Y342 VanDerWaalsContact C-N 3.33Å; K340-Y342 PolarHBondContact O-N 3.05Å; Y342-L355 HydrophobicContact CD2-CD1 4.09Å; Y342-L355 HydrophobicContact CD2-CG 4.33Å; Y342-L355 HydrophobicContact CG-CD1 4.44Å
343	I	74.8	Confident	75.7	Confident	31 Å²	31	47.2 Å²	47.2	16%	0.159	26%	0.264	C	S	.	.	H	α-helix	trans	-93.3	-12.6	174.8	69.6	172	0	0	0	114.1	H339 K340 L341 Y346	H339-I343 WeakPolarHBondContact O-CG1 3.5Å; H339-I343 PolarHBondContact O-N 3.17Å; H339-I343 VanDerWaalsContact O-N 3.09Å; K340-I343 VanDerWaalsContact O-CG1 3.3Å; K340-I343 WeakPolarHBondContact O-CG1 3.42Å; K340-I343 PolarHBondContact O-N 3.09Å; L341-I343 VanDerWaalsContact C-N 3.33Å; L341-I343 PolarHBondContact O-N 3.36Å; I343-Y346 WeakPolarHBondContact O-CD1 3.34Å
344	Q	71.4	Confident	75.4	Confident	124 Å²	124	46 Å²	46	58%	0.579	25%	0.254	S	S	*	.	H	α-helix	trans	-88.7	-51.2	173.3	-73.5	171.9	-51.9	0	0	110.8	K340 L341 Y346	K340-Q344 WeakPolarHBondContact O-CB 3.41Å; K340-Q344 VanDerWaalsContact O-CG 3.29Å; K340-Q344 WeakPolarHBondContact O-CG 3.44Å; K340-Q344 PolarHBondContact O-N 3.43Å; K340-Q344 PolarHBondContact O-OE1 2.95Å; L341-Q344 PolarHBondContact O-N 2.85Å; Q344-Y346 WeakPolarHBondContact O-CD1 3.18Å; Q344-Y346 PolarHBondContact O-N 3.39Å
345	N	68.1	Low	75.5	Confident	57 Å²	57	43 Å²	43	31%	0.305	24%	0.235	S	C	.	.			trans	-87.9	48.8	-176.3	-71.7	-39.8	0	0	0	112.5	R190 E322 L341 T347 S348 C354	R190-N345 VanDerWaalsContact CZ-O 3.31Å; R190-N345 PolarHBondContact NH1-O 2.95Å; R190-N345 PolarHBondContact NH2-O 3.2Å; E322-N345 PolarHBondContact OE1-ND2 3.23Å; L341-N345 PolarHBondContact O-N 2.93Å; N345-T347 VanDerWaalsContact C-N 3.33Å; N345-S348 PolarHBondContact O-N 2.91Å; N345-C354 HydrophobicContact CB-CB 3.9Å
346	Y	63.3	Low	75.9	Confident	20 Å²	20	38.1 Å²	38.1	8%	0.078	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-23.3	179	64.4	-106.6	0	0	0	113.7	M187 L192 Q259 I343 Q344 S348	M187-Y346 HydrophobicContact CE-CD2 4.01Å; M187-Y346 HydrophobicContact CE-CE2 3.62Å; M187-Y346 HydrophobicContact CG-CD2 4.49Å; M187-Y346 HydrophobicContact SD-CD2 3.22Å; M187-Y346 WeakPolarHBondContact SD-CD2 3.44Å; M187-Y346 HydrophobicContact SD-CE2 3.34Å; M187-Y346 WeakPolarHBondContact SD-CE2 3.38Å; M187-Y346 HydrophobicContact SD-CG 4.23Å; L192-Y346 HydrophobicContact CD1-CD1 4.3Å; L192-Y346 HydrophobicContact CD1-CG 4.43Å; L192-Y346 HydrophobicContact CD2-CD1 4.35Å; L192-Y346 HydrophobicContact CD2-CG 4.48Å; Q259-Y346 PolarHBondContact NE2-OH 3.16Å; Q259-Y346 PolarHBondContact OE1-OH 2.68Å; Q259-Y346 VanDerWaalsContact OE1-OH 3.05Å; I343-Y346 WeakPolarHBondContact O-CD1 3.34Å; Q344-Y346 WeakPolarHBondContact O-CD1 3.18Å; Q344-Y346 PolarHBondContact O-N 3.39Å; Y346-S348 VanDerWaalsContact C-N 3.34Å
347	T	54.3	Low	76.2	Confident	83 Å²	83	36.1 Å²	36.1	51%	0.509	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-8.8	174.4	50.9	0	0	0	0	114.1	N345 A349	N345-T347 VanDerWaalsContact C-N 3.33Å; T347-A349 PolarHBondContact O-N 3.39Å
348	S	54.1	Low	76.4	Confident	10 Å²	10	34.1 Å²	34.1	7%	0.07	19%	0.19	C	C	.	.			trans	-66.1	128.1	-178.9	-162.2	0	0	0	0	111.4	V323 N345 Y346 V350	V323-S348 PolarHBondContact O-OG 2.85Å; N345-S348 PolarHBondContact O-N 2.91Å; Y346-S348 VanDerWaalsContact C-N 3.34Å; S348-V350 PolarHBondContact O-N 2.77Å
349	A	47.6	Very low	76.6	Confident	60 Å²	60	35 Å²	35	50%	0.496	19%	0.194	S	C	.	.	S	Bend	trans	-72.7	5.6	-163.3	0	0	0	0	0	116.7	H326 T347 P351	H326-A349 HydrophobicContact CB-CB 3.98Å; H326-A349 PolarHBondContact CE1-N 2.97Å; H326-A349 VanDerWaalsContact CG-CB 3.44Å; H326-A349 PolarHBondContact ND1-N 2.97Å; T347-A349 PolarHBondContact O-N 3.39Å; A349-P351 VanDerWaalsContact O-CD 3.28Å; A349-P351 WeakPolarHBondContact O-CD 3.33Å
350	V	55.4	Low	77	Confident	46 Å²	46	35.8 Å²	35.8	28%	0.279	20%	0.197	S	C	.	.	S	Bend	trans	-73.8	116	165	169.1	0	0	0	0	107.7	A280 V323 S348 G352 T353	A280-V350 HydrophobicContact CB-CG1 4.33Å; V323-V350 HydrophobicContact CG1-CG2 4.07Å; V323-V350 HydrophobicContact CG2-CG2 4.35Å; S348-V350 PolarHBondContact O-N 2.77Å; V350-G352 PolarHBondContact O-N 2.78Å; V350-T353 VanDerWaalsContact CB-O 3.26Å; V350-T353 WeakPolarHBondContact CB-O 3.49Å; V350-T353 HydrophobicContact CG1-CG2 3.97Å; V350-T353 WeakPolarHBondContact CG1-O 3.47Å; V350-T353 PolarHBondContact O-N 2.82Å; V350-T353 VanDerWaalsContact O-O 3.05Å
351	P	63.5	Low	77.7	Confident	110 Å²	110	32.2 Å²	32.2	71%	0.714	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	94.6	-163.7	-28.9	38.1	0	0	0	115.4	R278 A349	R278-P351 PolarHBondContact NH1-O 3.14Å; A349-P351 VanDerWaalsContact O-CD 3.28Å; A349-P351 WeakPolarHBondContact O-CD 3.33Å
352	G	68.7	Low	78.3	Confident	2 Å²	2	31.4 Å²	31.4	2%	0.021	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.9	14.3	175.6	0	0	0	0	0	116.3	A188 R190 V350	A188-G352 WeakPolarHBondContact O-CA 3.4Å; R190-G352 WeakPolarHBondContact CG-O 3.47Å; R190-G352 PolarHBondContact NE-O 2.73Å; V350-G352 PolarHBondContact O-N 2.78Å
353	T	84.5	Confident	79	Confident	1 Å²	1	31 Å²	31	1%	0.006	18%	0.176	C	C	.	.			trans	-159.3	149.2	165.1	-173.8	0	0	0	0	112.4	R278 A280 V350 L355	R278-T353 WeakPolarHBondContact O-CB 3.39Å; R278-T353 PolarHBondContact O-OG1 2.91Å; A280-T353 HydrophobicContact CB-CG2 3.98Å; V350-T353 VanDerWaalsContact CB-O 3.26Å; V350-T353 WeakPolarHBondContact CB-O 3.49Å; V350-T353 HydrophobicContact CG1-CG2 3.97Å; V350-T353 WeakPolarHBondContact CG1-O 3.47Å; V350-T353 PolarHBondContact O-N 2.82Å; V350-T353 VanDerWaalsContact O-O 3.05Å; T353-L355 WeakPolarHBondContact CG2-O 3.45Å; T353-L355 PolarHBondContact OG1-N 3.13Å; T353-L355 PolarHBondContact OG1-O 2.72Å
354	C	86.8	Confident	80	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.178	C	C	.	.	S	Bend	trans	-100	-3.7	164	61.1	0	0	0	0	112.6	E322 V323 N345	E322-C354 CarbonylContact C-O 3.4Å; E322-C354 WeakPolarHBondContact CA-O 3.4Å; V323-C354 PolarHBondContact N-O 2.83Å; N345-C354 HydrophobicContact CB-CB 3.9Å
355	L	93.4	Very high	81	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	135.8	-178.6	-62.5	176.8	0	0	0	110	L277 V279 A280 L320 F321 L332 P338 Y342 T353	L277-L355 HydrophobicContact CD1-CD1 4.25Å; V279-L355 WeakPolarHBondContact CA-O 3.38Å; V279-L355 HydrophobicContact CB-CB 4.44Å; V279-L355 HydrophobicContact CG1-CB 4.11Å; V279-L355 HydrophobicContact CG2-CB 4Å; V279-L355 HydrophobicContact CG2-CD1 4.26Å; A280-L355 PolarHBondContact N-O 2.76Å; L320-L355 HydrophobicContact CD1-CB 4.32Å; F321-L355 WeakPolarHBondContact O-CA 3.25Å; L332-L355 HydrophobicContact CD1-CD2 4Å; P338-L355 HydrophobicContact CB-CD1 3.85Å; P338-L355 HydrophobicContact CB-CD2 4.16Å; Y342-L355 HydrophobicContact CD2-CD1 4.09Å; Y342-L355 HydrophobicContact CD2-CG 4.33Å; Y342-L355 HydrophobicContact CG-CD1 4.44Å; T353-L355 WeakPolarHBondContact CG2-O 3.45Å; T353-L355 PolarHBondContact OG1-N 3.13Å; T353-L355 PolarHBondContact OG1-O 2.72Å
356	T	95.4	Very high	82.2	Confident	16 Å²	16	27.5 Å²	27.5	10%	0.098	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	148.6	178.6	-168.7	0	0	0	0	112.1	A280 F321 V323 V329 R358	A280-T356 CarbonylContact O-C 3.6Å; A280-T356 WeakPolarHBondContact O-CA 3.39Å; A280-T356 PolarHBondContact O-OG1 3.26Å; F321-T356 HydrophobicContact CB-CG2 3.84Å; F321-T356 PolarHBondContact N-O 3.34Å; F321-T356 PolarHBondContact O-N 2.76Å; V323-T356 HydrophobicContact CG2-CG2 3.72Å; V329-T356 HydrophobicContact CG1-CG2 4.47Å; T356-R358 HydrophobicContact CG2-CG 4.16Å
357	I	97.9	Very high	83.6	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	132.9	164.8	-61.5	-54.8	0	0	0	108.5	V279 A280 L281 P282 Y301 I304 M310 F318 A319 L320	V279-I357 HydrophobicContact CG1-CD1 4.46Å; V279-I357 HydrophobicContact CG1-CG1 4.18Å; A280-I357 PolarHBondContact O-N 2.82Å; L281-I357 HydrophobicContact CD2-CB 4.22Å; L281-I357 HydrophobicContact CD2-CG1 3.98Å; P282-I357 WeakPolarHBondContact CD-O 3.12Å; P282-I357 HydrophobicContact CG-CG2 4.46Å; P282-I357 WeakPolarHBondContact CG-O 3.25Å; Y301-I357 HydrophobicContact CD2-CD1 3.75Å; Y301-I357 HydrophobicContact CE2-CD1 3.86Å; I304-I357 HydrophobicContact CD1-CD1 4.05Å; I304-I357 HydrophobicContact CG2-CD1 4.03Å; I304-I357 HydrophobicContact CG2-CG1 3.87Å; M310-I357 HydrophobicContact CE-CG2 4.13Å; F318-I357 HydrophobicContact CB-CG2 4.04Å; F318-I357 HydrophobicContact CD1-CG2 3.88Å; F318-I357 HydrophobicContact CG-CG2 4.26Å; A319-I357 WeakPolarHBondContact O-CA 3.49Å; L320-I357 HydrophobicContact CB-CD1 4.31Å; L320-I357 HydrophobicContact CD1-CD1 3.84Å
358	R	97.3	Very high	85.6	Confident	35 Å²	35	26.2 Å²	26.2	13%	0.132	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	161.4	171.3	-74.1	-177.6	66.5	100.2	-6.7	110.7	F318 A319 F321 T356 Q383 D386 D387	F318-R358 WeakPolarHBondContact CA-O 3.24Å; F318-R358 WeakPolarHBondContact CD1-O 3.42Å; A319-R358 PolarHBondContact N-O 2.95Å; A319-R358 VanDerWaalsContact N-O 3.09Å; A319-R358 PolarHBondContact O-N 2.73Å; F321-R358 HydrophobicContact CD2-CB 3.76Å; F321-R358 HydrophobicContact CE2-CB 3.69Å; F321-R358 WeakPolarHBondContact CE2-O 3.49Å; F321-R358 HydrophobicContact CG-CB 4.31Å; F321-R358 HydrophobicContact CZ-CB 4.17Å; T356-R358 HydrophobicContact CG2-CG 4.16Å; R358-Q383 VanDerWaalsContact NH2-NE2 3.16Å; R358-D386 IonicContact NH1-OD2 3.19Å; R358-D387 IonicContact CZ-OD1 2.67Å; R358-D387 IonicContact CZ-OD2 2.77Å; R358-D387 IonicContact NH1-OD1 2.69Å; R358-D387 PolarHBondContact NH1-OD1 3.1Å; R358-D387 VanDerWaalsContact NH2-CG 3.26Å; R358-D387 IonicContact NH2-OD1 3.17Å; R358-D387 PolarHBondContact NH2-OD1 2.88Å; R358-D387 IonicContact NH2-OD2 2.94Å; R358-D387 PolarHBondContact NH2-OD2 2.99Å
359	K	97.1	Very high	87.5	Confident	19 Å²	19	31.4 Å²	31.4	8%	0.083	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	134.6	174.1	-178.3	172.1	71.5	-172.7	0	109.7	F318 L361 E367 F380 Y424 N425	F318-K359 HydrophobicContact CE1-CB 4.41Å; K359-L361 HydrophobicContact CD-CB 4.18Å; K359-L361 HydrophobicContact CG-CB 3.82Å; K359-E367 HydrophobicContact CD-CG 4.46Å; K359-E367 IonicContact NZ-OE2 3.42Å; K359-E367 PolarHBondContact NZ-OE2 3.06Å; K359-F380 HydrophobicContact CB-CD1 4.19Å; K359-F380 HydrophobicContact CB-CE1 4.12Å; K359-F380 HydrophobicContact CD-CD1 3.54Å; K359-F380 HydrophobicContact CD-CE1 3.49Å; K359-F380 VanDerWaalsContact CD-CE1 3.49Å; K359-F380 HydrophobicContact CD-CG 4.21Å; K359-F380 HydrophobicContact CD-CZ 4.14Å; K359-F380 HydrophobicContact CG-CD1 4.03Å; K359-F380 HydrophobicContact CG-CE1 3.66Å; K359-F380 HydrophobicContact CG-CZ 4.48Å; K359-Y424 PolarHBondContact NZ-OH 3Å; K359-N425 WeakPolarHBondContact CE-OD1 3.31Å; K359-N425 PolarHBondContact NZ-OD1 2.84Å
360	W	97.6	Very high	89.8	Confident	25 Å²	25	29.1 Å²	29.1	10%	0.095	16%	0.155	C	C	.	.			trans	-122.8	68.4	173.9	-174.7	-119	0	0	0	108.4	Y317 A319 F321 K331 F362 I427 Y509 R516	Y317-W360 PolarHBondContact O-N 2.9Å; A319-W360 HydrophobicContact CB-CB 3.95Å; A319-W360 HydrophobicContact CB-CG 4.19Å; F321-W360 HydrophobicContact CE1-CE3 4.43Å; F321-W360 HydrophobicContact CZ-CB 4.46Å; F321-W360 AromaticContact CZ-CE3 3.98Å; F321-W360 HydrophobicContact CZ-CE3 3.98Å; K331-W360 HydrophobicContact CD-CD2 3.9Å; K331-W360 HydrophobicContact CD-CE3 4.24Å; K331-W360 HydrophobicContact CD-CG 4.45Å; K331-W360 HydrophobicContact CD-CH2 4.08Å; K331-W360 HydrophobicContact CD-CZ2 3.73Å; K331-W360 HydrophobicContact CD-CZ3 4.32Å; W360-F362 HydrophobicContact CH2-CE2 4.36Å; W360-F362 HydrophobicContact CZ3-CE2 4.19Å; W360-F362 HydrophobicContact CZ3-CZ 4.32Å; W360-I427 HydrophobicContact CE3-CD1 4.47Å; W360-I427 HydrophobicContact CZ3-CD1 3.9Å; W360-Y509 HydrophobicContact CH2-CE2 4.14Å; W360-Y509 AromaticContact CZ3-CE2 3.96Å; W360-Y509 HydrophobicContact CZ3-CE2 3.96Å; W360-R516 HydrophobicContact CD2-CG 4.44Å; W360-R516 HydrophobicContact CH2-CB 4.22Å; W360-R516 HydrophobicContact CZ2-CB 3.56Å; W360-R516 HydrophobicContact CZ2-CG 3.86Å; W360-R516 PolarHBondContact O-NH2 2.87Å
361	L	96.3	Very high	91.7	Very high	8 Å²	8	28.7 Å²	28.7	4%	0.042	15%	0.151	C	C	.	.			trans	-156.8	129	-175.1	-178.3	59.6	0	0	0	108.2	Y317 K359 T363 E366 E367 E520 W523	Y317-L361 HydrophobicContact CD1-CB 4.37Å; Y317-L361 HydrophobicContact CD1-CD1 3.81Å; Y317-L361 HydrophobicContact CD1-CD2 3.76Å; Y317-L361 HydrophobicContact CD1-CG 4.2Å; Y317-L361 HydrophobicContact CE1-CD1 4.04Å; Y317-L361 HydrophobicContact CE1-CD2 4.31Å; Y317-L361 HydrophobicContact CG-CD2 4.36Å; K359-L361 HydrophobicContact CD-CB 4.18Å; K359-L361 HydrophobicContact CG-CB 3.82Å; L361-T363 WeakPolarHBondContact CD1-OG1 3.42Å; L361-E366 HydrophobicContact CD1-CB 3.89Å; L361-E366 HydrophobicContact CD1-CG 4.33Å; L361-E366 HydrophobicContact CD2-CB 3.95Å; L361-E366 HydrophobicContact CG-CB 4.44Å; L361-E367 HydrophobicContact CD2-CB 3.86Å; L361-E367 HydrophobicContact CD2-CG 4.26Å; L361-E520 WeakPolarHBondContact CA-OE1 3.45Å; L361-W523 HydrophobicContact CD1-CZ3 4.24Å
362	F	96.8	Very high	93.2	Very high	4 Å²	4	31.3 Å²	31.3	2%	0.018	16%	0.159	C	C	.	.			trans	-102.9	-38.6	179.1	-63.5	-101.1	0	0	0	112.4	W360 N425 I427 I446 I448 C513 R516 V517 E520	W360-F362 HydrophobicContact CH2-CE2 4.36Å; W360-F362 HydrophobicContact CZ3-CE2 4.19Å; W360-F362 HydrophobicContact CZ3-CZ 4.32Å; F362-N425 WeakPolarHBondContact CD1-O 3.44Å; F362-N425 VanDerWaalsContact O-CB 3.31Å; F362-N425 WeakPolarHBondContact O-CB 3.22Å; F362-N425 PolarHBondContact O-ND2 3.42Å; F362-I427 HydrophobicContact CE1-CD1 3.78Å; F362-I427 HydrophobicContact CE1-CG1 3.83Å; F362-I427 HydrophobicContact CE2-CD1 4.43Å; F362-I427 HydrophobicContact CZ-CD1 3.51Å; F362-I427 HydrophobicContact CZ-CG1 4.11Å; F362-I446 HydrophobicContact CE1-CG2 3.92Å; F362-I446 HydrophobicContact CZ-CG2 4.36Å; F362-I448 HydrophobicContact CB-CB 3.92Å; F362-I448 HydrophobicContact CB-CD1 4.42Å; F362-C513 HydrophobicContact CZ-CB 4.15Å; F362-R516 HydrophobicContact CD2-CG 3.88Å; F362-R516 HydrophobicContact CE2-CB 4.02Å; F362-R516 HydrophobicContact CE2-CG 3.74Å; F362-V517 HydrophobicContact CB-CG2 4.23Å; F362-V517 HydrophobicContact CD1-CG2 3.75Å; F362-V517 HydrophobicContact CD2-CG2 3.75Å; F362-V517 HydrophobicContact CE1-CG2 3.89Å; F362-V517 HydrophobicContact CE2-CG2 3.9Å; F362-V517 HydrophobicContact CG-CG2 3.66Å; F362-V517 HydrophobicContact CZ-CG2 3.95Å; F362-E520 VanDerWaalsContact CA-OE2 3.28Å; F362-E520 WeakPolarHBondContact CA-OE2 3.47Å; F362-E520 VanDerWaalsContact CB-OE2 3.31Å; F362-E520 WeakPolarHBondContact CB-OE2 3.42Å; F362-E520 PolarHBondContact N-OE1 3.48Å; F362-E520 PolarHBondContact N-OE2 3.37Å
363	T	95.3	Very high	94.6	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.006	17%	0.167	C	C	.	.			trans	-60.1	146.8	174	49.7	0	0	0	0	112.2	L361 E366 I448 E520 R524	L361-T363 WeakPolarHBondContact CD1-OG1 3.42Å; T363-E366 WeakPolarHBondContact OG1-CB 3.43Å; T363-E366 VanDerWaalsContact OG1-CG 3.26Å; T363-E366 WeakPolarHBondContact OG1-CG 3.39Å; T363-I448 HydrophobicContact CG2-CD1 3.58Å; T363-I448 HydrophobicContact CG2-CG1 3.7Å; T363-E520 HydrophobicContact CG2-CB 3.9Å; T363-E520 PolarHBondContact N-OE2 3.43Å; T363-E520 PolarHBondContact OG1-OE2 2.91Å; T363-R524 HydrophobicContact CG2-CG 4.49Å
364	T	94.9	Very high	95.2	Very high	34 Å²	34	39.4 Å²	39.4	21%	0.209	20%	0.202	C	C	.	.	S	Bend	trans	-94.8	-19.9	175.7	58.5	0	0	0	0	112.2	E367 I368 R419 Y424	T364-E367 WeakPolarHBondContact O-CB 3.26Å; T364-E367 PolarHBondContact O-N 2.93Å; T364-I368 WeakPolarHBondContact O-CD1 3.37Å; T364-I368 VanDerWaalsContact O-CG1 3.27Å; T364-I368 WeakPolarHBondContact O-CG1 3.35Å; T364-I368 PolarHBondContact O-N 2.94Å; T364-I368 VanDerWaalsContact O-N 3.07Å; T364-R419 HydrophobicContact CG2-CB 4.16Å; T364-R419 HydrophobicContact CG2-CG 4.06Å; T364-Y424 HydrophobicContact CG2-CD1 4.11Å; T364-Y424 HydrophobicContact CG2-CE1 4.25Å
365	E	92.6	Very high	95.7	Very high	75 Å²	75	41.3 Å²	41.3	35%	0.35	21%	0.212	S	C	.	.	H	α-helix	trans	-73.6	-49.4	-177.2	-62.8	92.9	130.4	0	0	111.3	E367 I368 L369 R524	E365-E367 VanDerWaalsContact C-N 3.25Å; E365-E367 PolarHBondContact O-N 2.8Å; E365-I368 WeakPolarHBondContact O-CA 3.39Å; E365-I368 VanDerWaalsContact O-CB 3.31Å; E365-I368 WeakPolarHBondContact O-CB 3.36Å; E365-I368 PolarHBondContact O-N 2.82Å; E365-L369 PolarHBondContact O-N 2.92Å; E365-R524 IonicContact OE1-CZ 3.48Å; E365-R524 IonicContact OE1-NE 3.22Å; E365-R524 PolarHBondContact OE1-NE 3Å; E365-R524 IonicContact OE1-NH2 3.43Å; E365-R524 PolarHBondContact OE1-NH2 2.91Å
366	E	92.6	Very high	95.9	Very high	29 Å²	29	41.3 Å²	41.3	14%	0.136	21%	0.212	C	C	.	.	H	α-helix	trans	-58.6	-38.6	169.2	-67.2	-69	154.2	0	0	111.9	Y317 L361 T363 I368 L369 L370 W523	Y317-E366 HydrophobicContact CE1-CB 4.29Å; Y317-E366 PolarHBondContact OH-OE2 3.11Å; L361-E366 HydrophobicContact CD1-CB 3.89Å; L361-E366 HydrophobicContact CD1-CG 4.33Å; L361-E366 HydrophobicContact CD2-CB 3.95Å; L361-E366 HydrophobicContact CG-CB 4.44Å; T363-E366 WeakPolarHBondContact OG1-CB 3.43Å; T363-E366 VanDerWaalsContact OG1-CG 3.26Å; T363-E366 WeakPolarHBondContact OG1-CG 3.39Å; E366-I368 PolarHBondContact O-N 3.16Å; E366-L369 WeakPolarHBondContact O-CB 3.49Å; E366-L369 PolarHBondContact O-N 3.36Å; E366-L369 VanDerWaalsContact O-N 3.09Å; E366-L370 PolarHBondContact O-N 3.07Å; E366-W523 HydrophobicContact CG-CE3 3.78Å; E366-W523 HydrophobicContact CG-CZ3 3.91Å
367	E	94.7	Very high	96	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-66.7	-23.7	177.6	-157.1	-159.7	110.8	0	0	112.2	K359 L361 T364 E365 F380 R419 Y424 N425	K359-E367 HydrophobicContact CD-CG 4.46Å; K359-E367 IonicContact NZ-OE2 3.42Å; K359-E367 PolarHBondContact NZ-OE2 3.06Å; L361-E367 HydrophobicContact CD2-CB 3.86Å; L361-E367 HydrophobicContact CD2-CG 4.26Å; T364-E367 WeakPolarHBondContact O-CB 3.26Å; T364-E367 PolarHBondContact O-N 2.93Å; E365-E367 VanDerWaalsContact C-N 3.25Å; E365-E367 PolarHBondContact O-N 2.8Å; E367-F380 HydrophobicContact CB-CE2 4.49Å; E367-F380 HydrophobicContact CG-CD2 3.5Å; E367-F380 VanDerWaalsContact CG-CD2 3.5Å; E367-F380 HydrophobicContact CG-CE2 3.42Å; E367-F380 VanDerWaalsContact CG-CE2 3.42Å; E367-F380 HydrophobicContact CG-CG 4.25Å; E367-F380 HydrophobicContact CG-CZ 4.12Å; E367-R419 PolarHBondContact O-NH2 2.72Å; E367-R419 VanDerWaalsContact O-NH2 3.07Å; E367-R419 IonicContact OE1-CZ 3.78Å; E367-R419 IonicContact OE1-NE 2.91Å; E367-R419 PolarHBondContact OE1-NE 2.88Å; E367-R419 IonicContact OE1-NH2 2.78Å; E367-R419 PolarHBondContact OE1-NH2 2.83Å; E367-Y424 PolarHBondContact OE1-OH 3.06Å; E367-Y424 WeakPolarHBondContact OE2-CE1 3.3Å; E367-Y424 PolarHBondContact OE2-OH 3.23Å; E367-N425 PolarHBondContact OE2-ND2 3.32Å
368	I	95.5	Very high	96	Very high	76 Å²	76	42.8 Å²	42.8	39%	0.39	22%	0.221	S	C	.	.	H	α-helix	trans	-78.6	-32.5	172.7	-78.2	162.2	0	0	0	111.4	T364 E365 E366 L370 N371 R419	T364-I368 WeakPolarHBondContact O-CD1 3.37Å; T364-I368 VanDerWaalsContact O-CG1 3.27Å; T364-I368 WeakPolarHBondContact O-CG1 3.35Å; T364-I368 PolarHBondContact O-N 2.94Å; T364-I368 VanDerWaalsContact O-N 3.07Å; E365-I368 WeakPolarHBondContact O-CA 3.39Å; E365-I368 VanDerWaalsContact O-CB 3.31Å; E365-I368 WeakPolarHBondContact O-CB 3.36Å; E365-I368 PolarHBondContact O-N 2.82Å; E366-I368 PolarHBondContact O-N 3.16Å; I368-L370 PolarHBondContact O-N 3.3Å; I368-N371 WeakPolarHBondContact CA-ND2 3.28Å; I368-N371 VanDerWaalsContact O-CB 3.29Å; I368-N371 WeakPolarHBondContact O-CB 3.46Å; I368-N371 PolarHBondContact O-N 3.02Å; I368-N371 VanDerWaalsContact O-N 3.09Å; I368-N371 PolarHBondContact O-ND2 2.89Å; I368-R419 VanDerWaalsContact CG1-NH1 3.34Å
369	L	94.4	Very high	96.1	Very high	119 Å²	119	41.4 Å²	41.4	62%	0.623	22%	0.216	S	C	*	.	H	α-helix	trans	-63	-23.7	173.7	-56.4	-175.8	0	0	0	112.5	E365 E366	E365-L369 PolarHBondContact O-N 2.92Å; E366-L369 WeakPolarHBondContact O-CB 3.49Å; E366-L369 PolarHBondContact O-N 3.36Å; E366-L369 VanDerWaalsContact O-N 3.09Å
370	L	95.3	Very high	96.1	Very high	11 Å²	11	40.5 Å²	40.5	6%	0.058	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	4.1	176.7	-62.5	168.6	0	0	0	114	T313 Y317 E366 I368 D372 N373 A376 F380	T313-L370 HydrophobicContact CG2-CD2 4.36Å; Y317-L370 HydrophobicContact CD2-CD1 3.57Å; Y317-L370 HydrophobicContact CD2-CD2 4.13Å; Y317-L370 HydrophobicContact CD2-CG 4.37Å; Y317-L370 HydrophobicContact CE2-CD1 4.05Å; Y317-L370 HydrophobicContact CE2-CD2 4.16Å; Y317-L370 HydrophobicContact CE2-CG 4.46Å; Y317-L370 HydrophobicContact CG-CD1 3.8Å; E366-L370 PolarHBondContact O-N 3.07Å; I368-L370 PolarHBondContact O-N 3.3Å; L370-D372 PolarHBondContact O-N 2.78Å; L370-D372 VanDerWaalsContact O-N 3.17Å; L370-N373 WeakPolarHBondContact O-CB 3.25Å; L370-N373 PolarHBondContact O-N 3.17Å; L370-A376 HydrophobicContact CB-CB 4.08Å; L370-F380 HydrophobicContact CB-CE2 4.01Å; L370-F380 HydrophobicContact CD1-CE2 3.69Å; L370-F380 HydrophobicContact CD1-CZ 3.57Å
371	N	95.9	Very high	96.2	Very high	37 Å²	37	39.6 Å²	39.6	20%	0.198	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-21.6	-179.2	-74	-34.4	0	0	0	113.7	I368 N373 V377 V412 R419	I368-N371 WeakPolarHBondContact CA-ND2 3.28Å; I368-N371 VanDerWaalsContact O-CB 3.29Å; I368-N371 WeakPolarHBondContact O-CB 3.46Å; I368-N371 PolarHBondContact O-N 3.02Å; I368-N371 VanDerWaalsContact O-N 3.09Å; I368-N371 PolarHBondContact O-ND2 2.89Å; N371-N373 VanDerWaalsContact C-N 3.33Å; N371-V377 WeakPolarHBondContact O-CG2 3.49Å; N371-V412 HydrophobicContact CB-CG1 4.37Å; N371-R419 PolarHBondContact OD1-NH1 3.48Å; N371-R419 VanDerWaalsContact OD1-NH1 3.07Å; N371-R419 PolarHBondContact OD1-NH2 2.92Å
372	D	95.4	Very high	96.2	Very high	165 Å²	165	41.7 Å²	41.7	88%	0.882	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.3	2.4	176.1	-67.6	-28.2	0	0	0	113.1	L370	L370-D372 PolarHBondContact O-N 2.78Å; L370-D372 VanDerWaalsContact O-N 3.17Å
373	N	97.3	Very high	96.3	Very high	33 Å²	33	42.3 Å²	42.3	18%	0.176	22%	0.221	C	C	.	.			trans	-105.3	104.2	177	-171.3	-68.9	0	0	0	110.9	D311 T314 L370 N371 L375 A376 V377	D311-N373 PolarHBondContact OD2-ND2 2.9Å; T314-N373 PolarHBondContact OG1-ND2 2.92Å; L370-N373 WeakPolarHBondContact O-CB 3.25Å; L370-N373 PolarHBondContact O-N 3.17Å; N371-N373 VanDerWaalsContact C-N 3.33Å; N373-L375 PolarHBondContact O-N 3.35Å; N373-L375 VanDerWaalsContact O-N 3.16Å; N373-L375 PolarHBondContact OD1-N 3.39Å; N373-A376 HydrophobicContact CB-CB 3.97Å; N373-A376 PolarHBondContact O-N 3.25Å; N373-A376 PolarHBondContact OD1-N 3.13Å; N373-V377 WeakPolarHBondContact O-CG2 3.23Å; N373-V377 PolarHBondContact O-N 3.11Å
374	D	96.9	Very high	96.3	Very high	140 Å²	140	42.4 Å²	42.4	75%	0.749	22%	0.222	S	C	*	.	H	α-helix	trans	-53.4	-37.5	-177.2	-77.8	-35	0	0	0	113.7	T378	D374-T378 WeakPolarHBondContact O-CB 3.4Å; D374-T378 PolarHBondContact O-N 2.84Å; D374-T378 PolarHBondContact O-OG1 3.16Å
375	L	97.1	Very high	96.4	Very high	40 Å²	40	41.1 Å²	41.1	21%	0.209	21%	0.214	C	C	.	.	H	α-helix	trans	-71.3	-48	-179	-176.6	65.6	0	0	0	111.1	V308 M310 N373 T378 Y379	V308-L375 HydrophobicContact CG2-CD2 4.47Å; M310-L375 HydrophobicContact CB-CD2 4.48Å; M310-L375 HydrophobicContact CG-CD2 3.79Å; N373-L375 PolarHBondContact O-N 3.35Å; N373-L375 VanDerWaalsContact O-N 3.16Å; N373-L375 PolarHBondContact OD1-N 3.39Å; L375-T378 PolarHBondContact O-N 2.8Å; L375-Y379 HydrophobicContact CD1-CD1 4.26Å; L375-Y379 HydrophobicContact CD1-CE1 3.76Å; L375-Y379 HydrophobicContact CD1-CE2 4.1Å; L375-Y379 HydrophobicContact CG-CE2 4.43Å; L375-Y379 WeakPolarHBondContact O-CB 3.39Å; L375-Y379 PolarHBondContact O-N 2.87Å
376	A	97.6	Very high	96.5	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-60.5	-49.3	176.6	0	0	0	0	0	111	T314 F318 L370 N373 T378 Y379 F380	T314-A376 HydrophobicContact CG2-CB 4.18Å; F318-A376 HydrophobicContact CE2-CB 4.49Å; L370-A376 HydrophobicContact CB-CB 4.08Å; N373-A376 HydrophobicContact CB-CB 3.97Å; N373-A376 PolarHBondContact O-N 3.25Å; N373-A376 PolarHBondContact OD1-N 3.13Å; A376-T378 PolarHBondContact O-N 3.44Å; A376-Y379 PolarHBondContact O-N 2.96Å; A376-F380 HydrophobicContact CB-CE2 4.05Å; A376-F380 HydrophobicContact CB-CZ 4.21Å; A376-F380 WeakPolarHBondContact O-CB 3.11Å; A376-F380 WeakPolarHBondContact O-CD1 3.38Å; A376-F380 WeakPolarHBondContact O-CD2 3.4Å; A376-F380 WeakPolarHBondContact O-CG 3.45Å; A376-F380 PolarHBondContact O-N 2.88Å
377	V	98	Very high	96.6	Very high	9 Å²	9	39.4 Å²	39.4	6%	0.055	21%	0.209	C	C	.	.	H	α-helix	trans	-58.4	-46	176.8	170.8	0	0	0	0	111.7	N371 N373 Y379 F380 F381 M411 V412 L415	N371-V377 WeakPolarHBondContact O-CG2 3.49Å; N373-V377 WeakPolarHBondContact O-CG2 3.23Å; N373-V377 PolarHBondContact O-N 3.11Å; V377-Y379 VanDerWaalsContact C-N 3.33Å; V377-Y379 PolarHBondContact O-N 3.19Å; V377-F380 PolarHBondContact O-N 3.44Å; V377-F381 WeakPolarHBondContact O-CB 3.48Å; V377-F381 PolarHBondContact O-N 2.63Å; V377-M411 HydrophobicContact CG1-CB 3.66Å; V377-M411 HydrophobicContact CG1-SD 4.31Å; V377-V412 HydrophobicContact CG1-CG2 3.78Å; V377-V412 HydrophobicContact CG2-CG2 4.15Å; V377-L415 HydrophobicContact CG1-CD1 4.43Å
378	T	98	Very high	96.7	Very high	38 Å²	38	41.2 Å²	41.2	23%	0.233	22%	0.219	C	C	.	.	H	α-helix	trans	-60.5	-43.4	178.3	-64.2	0	0	0	0	111.4	D374 L375 A376 H382	D374-T378 WeakPolarHBondContact O-CB 3.4Å; D374-T378 PolarHBondContact O-N 2.84Å; D374-T378 PolarHBondContact O-OG1 3.16Å; L375-T378 PolarHBondContact O-N 2.8Å; A376-T378 PolarHBondContact O-N 3.44Å; T378-H382 PolarHBondContact O-N 2.78Å; T378-H382 PolarHBondContact O-ND1 2.85Å; T378-H382 VanDerWaalsContact O-ND1 3.17Å
379	Y	98.3	Very high	96.6	Very high	6 Å²	6	44.7 Å²	44.7	2%	0.024	23%	0.232	C	C	.	.	H	α-helix	trans	-72.7	-42.6	-178.9	-79.8	10.6	0	0	0	112.5	L281 P282 D283 M310 F318 L375 A376 V377 Q383	L281-Y379 WeakPolarHBondContact CD1-OH 3.12Å; L281-Y379 HydrophobicContact CD2-CE2 4.43Å; P282-Y379 HydrophobicContact CB-CD1 4.2Å; P282-Y379 HydrophobicContact CB-CD2 4.4Å; P282-Y379 HydrophobicContact CB-CG 3.88Å; P282-Y379 WeakPolarHBondContact CB-O 3.38Å; P282-Y379 HydrophobicContact CG-CD1 4.35Å; P282-Y379 HydrophobicContact CG-CD2 3.73Å; P282-Y379 HydrophobicContact CG-CE2 4.36Å; P282-Y379 HydrophobicContact CG-CG 3.72Å; D283-Y379 HydrophobicContact CB-CD1 4.41Å; D283-Y379 HydrophobicContact CB-CE1 4.31Å; M310-Y379 HydrophobicContact CE-CD2 4.02Å; M310-Y379 HydrophobicContact CE-CE2 3.82Å; F318-Y379 HydrophobicContact CD1-CD2 4.43Å; F318-Y379 AromaticContact CE1-CD2 3.85Å; F318-Y379 HydrophobicContact CE1-CD2 3.85Å; F318-Y379 HydrophobicContact CE1-CG 4.29Å; F318-Y379 AromaticContact CZ-CD2 3.96Å; F318-Y379 HydrophobicContact CZ-CD2 3.96Å; F318-Y379 HydrophobicContact CZ-CG 4.3Å; L375-Y379 HydrophobicContact CD1-CD1 4.26Å; L375-Y379 HydrophobicContact CD1-CE1 3.76Å; L375-Y379 HydrophobicContact CD1-CE2 4.1Å; L375-Y379 HydrophobicContact CG-CE2 4.43Å; L375-Y379 WeakPolarHBondContact O-CB 3.39Å; L375-Y379 PolarHBondContact O-N 2.87Å; A376-Y379 PolarHBondContact O-N 2.96Å; V377-Y379 VanDerWaalsContact C-N 3.33Å; V377-Y379 PolarHBondContact O-N 3.19Å; Y379-Q383 WeakPolarHBondContact O-CB 3.43Å; Y379-Q383 PolarHBondContact O-N 3.42Å
380	F	98.4	Very high	96.5	Very high	1 Å²	1	43.7 Å²	43.7	0%	0.004	22%	0.222	C	C	.	.	H	α-helix	trans	-62	-43.4	174.7	-62.1	-17.9	0	0	0	111.4	F318 K359 E367 L370 A376 V377 A384 L415	F318-F380 HydrophobicContact CE1-CD1 4.02Å; F318-F380 AromaticContact CE1-CE1 3.83Å; F318-F380 HydrophobicContact CE1-CE1 3.83Å; F318-F380 HydrophobicContact CE2-CD1 4.43Å; F318-F380 AromaticContact CE2-CE1 3.65Å; F318-F380 HydrophobicContact CE2-CE1 3.65Å; F318-F380 HydrophobicContact CE2-CZ 4.16Å; F318-F380 AromaticContact CZ-CD1 3.57Å; F318-F380 HydrophobicContact CZ-CD1 3.57Å; F318-F380 AromaticContact CZ-CE1 3.19Å; F318-F380 HydrophobicContact CZ-CE1 3.19Å; F318-F380 HydrophobicContact CZ-CZ 4.08Å; K359-F380 HydrophobicContact CB-CD1 4.19Å; K359-F380 HydrophobicContact CB-CE1 4.12Å; K359-F380 HydrophobicContact CD-CD1 3.54Å; K359-F380 HydrophobicContact CD-CE1 3.49Å; K359-F380 VanDerWaalsContact CD-CE1 3.49Å; K359-F380 HydrophobicContact CD-CG 4.21Å; K359-F380 HydrophobicContact CD-CZ 4.14Å; K359-F380 HydrophobicContact CG-CD1 4.03Å; K359-F380 HydrophobicContact CG-CE1 3.66Å; K359-F380 HydrophobicContact CG-CZ 4.48Å; E367-F380 HydrophobicContact CB-CE2 4.49Å; E367-F380 HydrophobicContact CG-CD2 3.5Å; E367-F380 VanDerWaalsContact CG-CD2 3.5Å; E367-F380 HydrophobicContact CG-CE2 3.42Å; E367-F380 VanDerWaalsContact CG-CE2 3.42Å; E367-F380 HydrophobicContact CG-CG 4.25Å; E367-F380 HydrophobicContact CG-CZ 4.12Å; L370-F380 HydrophobicContact CB-CE2 4.01Å; L370-F380 HydrophobicContact CD1-CE2 3.69Å; L370-F380 HydrophobicContact CD1-CZ 3.57Å; A376-F380 HydrophobicContact CB-CE2 4.05Å; A376-F380 HydrophobicContact CB-CZ 4.21Å; A376-F380 WeakPolarHBondContact O-CB 3.11Å; A376-F380 WeakPolarHBondContact O-CD1 3.38Å; A376-F380 WeakPolarHBondContact O-CD2 3.4Å; A376-F380 WeakPolarHBondContact O-CG 3.45Å; A376-F380 PolarHBondContact O-N 2.88Å; V377-F380 PolarHBondContact O-N 3.44Å; F380-A384 VanDerWaalsContact O-CB 3.26Å; F380-A384 WeakPolarHBondContact O-CB 3.46Å; F380-A384 PolarHBondContact O-N 3.14Å; F380-L415 HydrophobicContact CB-CD1 3.95Å; F380-L415 HydrophobicContact CB-CD2 4.06Å
381	F	98.4	Very high	96.4	Very high	6 Å²	6	45.5 Å²	45.5	3%	0.026	24%	0.244	C	C	.	.	H	α-helix	trans	-62	-52.1	178.1	168.4	-105.3	0	0	0	111.9	V377 Q383 A384 V385 Y406 M411 Y414 L415	V377-F381 WeakPolarHBondContact O-CB 3.48Å; V377-F381 PolarHBondContact O-N 2.63Å; F381-Q383 PolarHBondContact O-N 3.12Å; F381-A384 PolarHBondContact O-N 2.61Å; F381-V385 HydrophobicContact CD2-CG2 4.27Å; F381-V385 HydrophobicContact CE1-CG2 4.4Å; F381-V385 HydrophobicContact CE2-CG2 3.98Å; F381-V385 HydrophobicContact CZ-CG2 4.06Å; F381-V385 VanDerWaalsContact O-CG2 3.27Å; F381-V385 WeakPolarHBondContact O-CG2 3.44Å; F381-V385 PolarHBondContact O-N 3.37Å; F381-Y406 HydrophobicContact CE1-CD2 4.32Å; F381-Y406 HydrophobicContact CE1-CE2 4.46Å; F381-Y406 HydrophobicContact CE2-CD2 4.3Å; F381-Y406 AromaticContact CZ-CD2 3.56Å; F381-Y406 HydrophobicContact CZ-CD2 3.56Å; F381-Y406 HydrophobicContact CZ-CE2 4.13Å; F381-Y406 HydrophobicContact CZ-CG 4.41Å; F381-M411 HydrophobicContact CB-CB 3.92Å; F381-M411 HydrophobicContact CB-CG 4.04Å; F381-M411 HydrophobicContact CB-SD 4.12Å; F381-M411 HydrophobicContact CD1-CB 4.33Å; F381-M411 HydrophobicContact CD1-CE 3.72Å; F381-M411 HydrophobicContact CD1-CG 3.58Å; F381-M411 HydrophobicContact CD1-SD 3.73Å; F381-M411 HydrophobicContact CD2-CB 3.94Å; F381-M411 HydrophobicContact CD2-CG 3.94Å; F381-M411 HydrophobicContact CE1-CE 3.91Å; F381-M411 HydrophobicContact CE1-CG 3.92Å; F381-M411 HydrophobicContact CE1-SD 4.37Å; F381-M411 HydrophobicContact CE2-CG 4.25Å; F381-M411 HydrophobicContact CG-CB 3.81Å; F381-M411 HydrophobicContact CG-CG 3.58Å; F381-M411 HydrophobicContact CG-SD 4.03Å; F381-M411 HydrophobicContact CZ-CG 4.23Å; F381-Y414 AromaticContact CD2-CD1 3.57Å; F381-Y414 HydrophobicContact CD2-CD1 3.57Å; F381-Y414 HydrophobicContact CD2-CE1 4.22Å; F381-Y414 AromaticContact CD2-CG 3.88Å; F381-Y414 HydrophobicContact CD2-CG 3.88Å; F381-Y414 AromaticContact CE2-CD1 3.65Å; F381-Y414 HydrophobicContact CE2-CD1 3.65Å; F381-Y414 HydrophobicContact CE2-CD2 4.04Å; F381-Y414 HydrophobicContact CE2-CE1 4.17Å; F381-Y414 AromaticContact CE2-CG 3.59Å; F381-Y414 HydrophobicContact CE2-CG 3.59Å; F381-L415 HydrophobicContact CB-CD1 4.34Å; F381-L415 HydrophobicContact CB-CG 4.46Å
382	H	97.9	Very high	96.2	Very high	51 Å²	51	47.7 Å²	47.7	24%	0.236	25%	0.25	C	C	.	.	H	α-helix	trans	-68.7	-34.6	-178.3	-67.8	137.7	0	0	0	112.8	P282 D283 T378 V385 D386	P282-H382 WeakPolarHBondContact O-CB 3.16Å; D283-H382 WeakPolarHBondContact CB-ND1 3.45Å; T378-H382 PolarHBondContact O-N 2.78Å; T378-H382 PolarHBondContact O-ND1 2.85Å; T378-H382 VanDerWaalsContact O-ND1 3.17Å; H382-V385 PolarHBondContact O-N 3.3Å; H382-D386 PolarHBondContact O-N 3.05Å
383	Q	97.1	Very high	96.3	Very high	17 Å²	17	40.1 Å²	40.1	8%	0.079	21%	0.209	C	C	.	.	H	α-helix	trans	-63.7	-46.1	171.5	-158.4	-160.7	-76.5	0	0	111.4	P282 R358 Y379 F381 V385 D386 D387	P282-Q383 HydrophobicContact CB-CB 4.35Å; R358-Q383 VanDerWaalsContact NH2-NE2 3.16Å; Y379-Q383 WeakPolarHBondContact O-CB 3.43Å; Y379-Q383 PolarHBondContact O-N 3.42Å; F381-Q383 PolarHBondContact O-N 3.12Å; Q383-V385 VanDerWaalsContact C-N 3.28Å; Q383-V385 PolarHBondContact O-N 3.23Å; Q383-D386 WeakPolarHBondContact O-CB 3.42Å; Q383-D386 PolarHBondContact O-N 3.38Å; Q383-D386 VanDerWaalsContact O-N 3.08Å; Q383-D387 PolarHBondContact NE2-OD2 3.34Å; Q383-D387 WeakPolarHBondContact O-CB 3.33Å; Q383-D387 PolarHBondContact O-N 3.06Å
384	A	97.2	Very high	96.2	Very high	3 Å²	3	43.5 Å²	43.5	3%	0.025	22%	0.222	C	C	.	.	H	α-helix	trans	-64.2	-32.4	178.5	0	0	0	0	0	112.6	F380 F381 V388 I393 L415 L418 Y424	F380-A384 VanDerWaalsContact O-CB 3.26Å; F380-A384 WeakPolarHBondContact O-CB 3.46Å; F380-A384 PolarHBondContact O-N 3.14Å; F381-A384 PolarHBondContact O-N 2.61Å; A384-V388 WeakPolarHBondContact O-CB 3.28Å; A384-V388 VanDerWaalsContact O-CG2 3.29Å; A384-V388 WeakPolarHBondContact O-CG2 3.34Å; A384-V388 PolarHBondContact O-N 2.83Å; A384-I393 HydrophobicContact CB-CD1 4.46Å; A384-L415 HydrophobicContact CB-CD2 4.1Å; A384-L418 HydrophobicContact CB-CD1 3.79Å; A384-Y424 HydrophobicContact CB-CE2 4.04Å
385	V	96.9	Very high	96.1	Very high	8 Å²	8	37.2 Å²	37.2	5%	0.048	19%	0.19	C	C	.	.	H	α-helix	trans	-65.7	-38.9	171.4	167.2	0	0	0	0	111.9	F381 H382 Q383 K389 Y406 Y414	F381-V385 HydrophobicContact CD2-CG2 4.27Å; F381-V385 HydrophobicContact CE1-CG2 4.4Å; F381-V385 HydrophobicContact CE2-CG2 3.98Å; F381-V385 HydrophobicContact CZ-CG2 4.06Å; F381-V385 VanDerWaalsContact O-CG2 3.27Å; F381-V385 WeakPolarHBondContact O-CG2 3.44Å; F381-V385 PolarHBondContact O-N 3.37Å; H382-V385 PolarHBondContact O-N 3.3Å; Q383-V385 VanDerWaalsContact C-N 3.28Å; Q383-V385 PolarHBondContact O-N 3.23Å; V385-K389 HydrophobicContact CG1-CD 4.22Å; V385-K389 WeakPolarHBondContact O-CD 3.22Å; V385-K389 WeakPolarHBondContact O-CG 3.39Å; V385-K389 PolarHBondContact O-N 3.11Å; V385-K389 VanDerWaalsContact O-N 3.15Å; V385-Y406 HydrophobicContact CG1-CD2 4.37Å; V385-Y406 HydrophobicContact CG1-CE2 3.95Å; V385-Y406 HydrophobicContact CG2-CD2 3.88Å; V385-Y406 HydrophobicContact CG2-CE2 4.11Å; V385-Y414 HydrophobicContact CG2-CD1 4.41Å; V385-Y414 HydrophobicContact CG2-CE1 3.55Å; V385-Y414 HydrophobicContact CG2-CE2 4.42Å
386	D	94.2	Very high	95.9	Very high	53 Å²	53	41.6 Å²	41.6	28%	0.283	21%	0.209	S	C	.	.	H	α-helix	trans	-69.4	-44.7	175	179.2	53.4	0	0	0	111.7	R358 H382 Q383 V388 K389 K390	R358-D386 IonicContact NH1-OD2 3.19Å; H382-D386 PolarHBondContact O-N 3.05Å; Q383-D386 WeakPolarHBondContact O-CB 3.42Å; Q383-D386 PolarHBondContact O-N 3.38Å; Q383-D386 VanDerWaalsContact O-N 3.08Å; D386-V388 PolarHBondContact O-N 3.06Å; D386-K389 WeakPolarHBondContact O-CB 3.32Å; D386-K389 PolarHBondContact O-N 2.73Å; D386-K389 VanDerWaalsContact O-N 3.11Å; D386-K390 VanDerWaalsContact CG-NZ 3.29Å; D386-K390 WeakPolarHBondContact O-CG 3.46Å; D386-K390 PolarHBondContact O-N 2.91Å; D386-K390 WeakPolarHBondContact OD1-CE 3.42Å; D386-K390 IonicContact OD1-NZ 3.84Å; D386-K390 PolarHBondContact OD1-NZ 3.01Å; D386-K390 VanDerWaalsContact OD1-NZ 3.17Å; D386-K390 WeakPolarHBondContact OD2-CE 3.46Å; D386-K390 IonicContact OD2-NZ 2.71Å; D386-K390 PolarHBondContact OD2-NZ 3.05Å
387	D	95.3	Very high	95.7	Very high	15 Å²	15	50.4 Å²	50.4	8%	0.08	25%	0.251	C	S	.	.	H	α-helix	trans	-66.7	-34.1	179.8	-63.8	-24.6	0	0	0	111.7	R358 Q383 G391 Y392 I393	R358-D387 IonicContact CZ-OD1 2.67Å; R358-D387 IonicContact CZ-OD2 2.77Å; R358-D387 IonicContact NH1-OD1 2.69Å; R358-D387 PolarHBondContact NH1-OD1 3.1Å; R358-D387 VanDerWaalsContact NH2-CG 3.26Å; R358-D387 IonicContact NH2-OD1 3.17Å; R358-D387 PolarHBondContact NH2-OD1 2.88Å; R358-D387 IonicContact NH2-OD2 2.94Å; R358-D387 PolarHBondContact NH2-OD2 2.99Å; Q383-D387 PolarHBondContact NE2-OD2 3.34Å; Q383-D387 WeakPolarHBondContact O-CB 3.33Å; Q383-D387 PolarHBondContact O-N 3.06Å; D387-G391 PolarHBondContact O-N 3Å; D387-Y392 HydrophobicContact CB-CD2 4.3Å; D387-Y392 WeakPolarHBondContact O-CB 3.48Å; D387-Y392 PolarHBondContact O-N 3.23Å; D387-I393 HydrophobicContact CB-CD1 3.63Å; D387-I393 HydrophobicContact CB-CG1 4.14Å; D387-I393 PolarHBondContact O-N 2.94Å
388	V	96.1	Very high	95.5	Very high	37 Å²	37	52.1 Å²	52.1	22%	0.224	26%	0.257	C	S	.	.	H	α-helix	trans	-65.6	-45.6	167.2	166.6	0	0	0	0	111.8	A384 D386 K390 G391 I393 A395 L418	A384-V388 WeakPolarHBondContact O-CB 3.28Å; A384-V388 VanDerWaalsContact O-CG2 3.29Å; A384-V388 WeakPolarHBondContact O-CG2 3.34Å; A384-V388 PolarHBondContact O-N 2.83Å; D386-V388 PolarHBondContact O-N 3.06Å; V388-K390 PolarHBondContact O-N 3.11Å; V388-G391 PolarHBondContact O-N 2.87Å; V388-I393 HydrophobicContact CG2-CB 3.84Å; V388-I393 HydrophobicContact CG2-CD1 4.09Å; V388-I393 HydrophobicContact CG2-CG2 4.16Å; V388-A395 HydrophobicContact CG1-CB 4.23Å; V388-A395 HydrophobicContact CG2-CB 4.16Å; V388-L418 HydrophobicContact CG2-CD1 3.68Å; V388-L418 HydrophobicContact CG2-CD2 3.83Å; V388-L418 HydrophobicContact CG2-CG 4.44Å
389	K	93.5	Very high	95.3	Very high	150 Å²	150	53.6 Å²	53.6	65%	0.652	27%	0.269	S	S	*	.	H	α-helix	trans	-62.4	-27.9	179.3	-75.9	165.7	-175.6	170.8	0	113.1	V385 D386 G391	V385-K389 HydrophobicContact CG1-CD 4.22Å; V385-K389 WeakPolarHBondContact O-CD 3.22Å; V385-K389 WeakPolarHBondContact O-CG 3.39Å; V385-K389 PolarHBondContact O-N 3.11Å; V385-K389 VanDerWaalsContact O-N 3.15Å; D386-K389 WeakPolarHBondContact O-CB 3.32Å; D386-K389 PolarHBondContact O-N 2.73Å; D386-K389 VanDerWaalsContact O-N 3.11Å; K389-G391 VanDerWaalsContact C-N 3.34Å
390	K	91.1	Very high	95.2	Very high	97 Å²	97	61 Å²	61	42%	0.422	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-4.8	175.8	-71.4	169.5	178.2	168.2	0	113.8	D386 V388 Y392	D386-K390 VanDerWaalsContact CG-NZ 3.29Å; D386-K390 WeakPolarHBondContact O-CG 3.46Å; D386-K390 PolarHBondContact O-N 2.91Å; D386-K390 WeakPolarHBondContact OD1-CE 3.42Å; D386-K390 IonicContact OD1-NZ 3.84Å; D386-K390 PolarHBondContact OD1-NZ 3.01Å; D386-K390 VanDerWaalsContact OD1-NZ 3.17Å; D386-K390 WeakPolarHBondContact OD2-CE 3.46Å; D386-K390 IonicContact OD2-NZ 2.71Å; D386-K390 PolarHBondContact OD2-NZ 3.05Å; V388-K390 PolarHBondContact O-N 3.11Å; K390-Y392 VanDerWaalsContact C-N 3.26Å; K390-Y392 HydrophobicContact CB-CD1 4.12Å; K390-Y392 HydrophobicContact CB-CD2 3.91Å; K390-Y392 HydrophobicContact CB-CE1 4.05Å; K390-Y392 HydrophobicContact CB-CE2 3.84Å; K390-Y392 HydrophobicContact CB-CG 4.06Å; K390-Y392 HydrophobicContact CD-CD2 4.25Å; K390-Y392 HydrophobicContact CD-CE2 3.62Å; K390-Y392 HydrophobicContact CG-CE2 4.34Å; K390-Y392 PolarHBondContact O-N 3.37Å
391	G	93.2	Very high	95.2	Very high	50 Å²	50	65.6 Å²	65.6	52%	0.515	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.7	15.7	-176.5	0	0	0	0	0	114.2	D387 V388 K389	D387-G391 PolarHBondContact O-N 3Å; V388-G391 PolarHBondContact O-N 2.87Å; K389-G391 VanDerWaalsContact C-N 3.34Å
392	Y	93.1	Very high	95.1	Very high	82 Å²	82	65.6 Å²	65.6	32%	0.322	32%	0.32	S	S	.	.	S	Bend	trans	-73.9	-30.9	175.4	-58.1	-24.2	0	0	0	111.6	S327 D387 K390 G423	S327-Y392 PolarHBondContact O-OH 3.3Å; D387-Y392 HydrophobicContact CB-CD2 4.3Å; D387-Y392 WeakPolarHBondContact O-CB 3.48Å; D387-Y392 PolarHBondContact O-N 3.23Å; K390-Y392 VanDerWaalsContact C-N 3.26Å; K390-Y392 HydrophobicContact CB-CD1 4.12Å; K390-Y392 HydrophobicContact CB-CD2 3.91Å; K390-Y392 HydrophobicContact CB-CE1 4.05Å; K390-Y392 HydrophobicContact CB-CE2 3.84Å; K390-Y392 HydrophobicContact CB-CG 4.06Å; K390-Y392 HydrophobicContact CD-CD2 4.25Å; K390-Y392 HydrophobicContact CD-CE2 3.62Å; K390-Y392 HydrophobicContact CG-CE2 4.34Å; K390-Y392 PolarHBondContact O-N 3.37Å; Y392-G423 WeakPolarHBondContact O-CA 3.27Å
393	I	96.4	Very high	95.1	Very high	6 Å²	6	68.4 Å²	68.4	3%	0.031	33%	0.333	C	S	.	.	S	Bend	trans	-109.5	117.1	175	-56	161.6	0	0	0	108.8	A384 D387 V388 A395 L418 C421 E422 Y424	A384-I393 HydrophobicContact CB-CD1 4.46Å; D387-I393 HydrophobicContact CB-CD1 3.63Å; D387-I393 HydrophobicContact CB-CG1 4.14Å; D387-I393 PolarHBondContact O-N 2.94Å; V388-I393 HydrophobicContact CG2-CB 3.84Å; V388-I393 HydrophobicContact CG2-CD1 4.09Å; V388-I393 HydrophobicContact CG2-CG2 4.16Å; I393-A395 PolarHBondContact O-N 2.81Å; I393-L418 HydrophobicContact CG2-CD2 4.12Å; I393-C421 HydrophobicContact CG2-CB 3.58Å; I393-E422 WeakPolarHBondContact CA-O 3.32Å; I393-Y424 HydrophobicContact CD1-CD2 3.83Å; I393-Y424 HydrophobicContact CD1-CE2 4.27Å; I393-Y424 HydrophobicContact CG1-CD2 4.44Å
394	K	95	Very high	95.1	Very high	104 Å²	104	72.2 Å²	72.2	45%	0.452	35%	0.349	S	S	.	.			trans	-74.1	112.7	178.5	-58.5	-178.2	-162.5	166	0	109.4	C421 E422	K394-C421 VanDerWaalsContact O-CB 3.3Å; K394-C421 WeakPolarHBondContact O-CB 3.49Å; K394-C421 PolarHBondContact O-SG 3.41Å; K394-E422 HydrophobicContact CB-CB 4.4Å; K394-E422 HydrophobicContact CD-CB 4.25Å; K394-E422 WeakPolarHBondContact CD-OE2 3.34Å; K394-E422 WeakPolarHBondContact CE-OE2 3.39Å; K394-E422 PolarHBondContact N-O 3.27Å; K394-E422 IonicContact NZ-OE1 2.91Å; K394-E422 PolarHBondContact NZ-OE1 3.49Å; K394-E422 IonicContact NZ-OE2 2.71Å; K394-E422 PolarHBondContact NZ-OE2 3.45Å
395	A	94.9	Very high	95.1	Very high	8 Å²	8	73.1 Å²	73.1	7%	0.066	35%	0.354	C	S	.	.			trans	-140	9.1	-165.4	0	0	0	0	0	113.6	V388 I393 E397 K398 S399 L402 L418	V388-A395 HydrophobicContact CG1-CB 4.23Å; V388-A395 HydrophobicContact CG2-CB 4.16Å; I393-A395 PolarHBondContact O-N 2.81Å; A395-E397 PolarHBondContact O-N 2.92Å; A395-K398 CarbonylContact O-C 3.51Å; A395-K398 PolarHBondContact O-N 3.31Å; A395-S399 PolarHBondContact O-N 2.86Å; A395-L402 HydrophobicContact CB-CD1 3.75Å; A395-L418 HydrophobicContact CB-CD2 4.04Å
396	E	93	Very high	95.1	Very high	132 Å²	132	77.9 Å²	77.9	62%	0.617	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-56.3	-47	-172.2	-65.6	76.8	-173.6	0	0	111.8	K398 S399	E396-K398 PolarHBondContact O-N 3.2Å; E396-S399 WeakPolarHBondContact O-CB 3.07Å; E396-S399 PolarHBondContact O-N 3.23Å; E396-S399 PolarHBondContact O-OG 3.34Å
397	E	93.4	Very high	95.3	Very high	186 Å²	186	81.1 Å²	81.1	87%	0.869	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-63.1	-26.7	178.9	-58.7	-171.9	155.3	0	0	113.4	A395	A395-E397 PolarHBondContact O-N 2.92Å
398	K	94.1	Very high	95.4	Very high	44 Å²	44	85 Å²	85	19%	0.191	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-102.6	-2.2	-178.1	-54.8	-178.7	-163.9	165.2	0	112.5	A395 E396 Y400 Q401 L402 M417 T420 C421	A395-K398 CarbonylContact O-C 3.51Å; A395-K398 PolarHBondContact O-N 3.31Å; E396-K398 PolarHBondContact O-N 3.2Å; K398-Y400 PolarHBondContact O-N 2.84Å; K398-Q401 WeakPolarHBondContact O-CA 3.29Å; K398-Q401 WeakPolarHBondContact O-CB 3.3Å; K398-Q401 PolarHBondContact O-N 3.25Å; K398-L402 HydrophobicContact CB-CD1 3.84Å; K398-L402 HydrophobicContact CB-CG 4.13Å; K398-L402 WeakPolarHBondContact O-CG 3.45Å; K398-L402 PolarHBondContact O-N 2.84Å; K398-M417 HydrophobicContact CB-CG 4.34Å; K398-M417 HydrophobicContact CB-SD 4.23Å; K398-M417 HydrophobicContact CD-CG 3.77Å; K398-M417 PolarHBondContact NZ-O 2.97Å; K398-M417 VanDerWaalsContact NZ-O 3.15Å; K398-T420 VanDerWaalsContact NZ-C 3.33Å; K398-T420 PolarHBondContact NZ-O 3.41Å; K398-T420 PolarHBondContact NZ-OG1 2.85Å; K398-C421 PolarHBondContact NZ-SG 2.98Å
399	S	94.7	Very high	95.4	Very high	69 Å²	69	92.7 Å²	92.7	48%	0.483	43%	0.428	S	S	.	.	H	α-helix	trans	-46.7	-53.1	-171.4	53.9	0	0	0	0	114.7	A395 E396 Q401 L402 Q403	A395-S399 PolarHBondContact O-N 2.86Å; E396-S399 WeakPolarHBondContact O-CB 3.07Å; E396-S399 PolarHBondContact O-N 3.23Å; E396-S399 PolarHBondContact O-OG 3.34Å; S399-Q401 VanDerWaalsContact C-N 3.3Å; S399-Q401 PolarHBondContact O-N 2.81Å; S399-L402 PolarHBondContact O-N 3.09Å; S399-Q403 WeakPolarHBondContact O-CB 3.19Å; S399-Q403 PolarHBondContact O-N 3.43Å
400	Y	96.3	Very high	95.6	Very high	163 Å²	163	89.9 Å²	89.9	64%	0.639	42%	0.416	S	S	*	.	H	α-helix	trans	-60.1	-37.9	177.7	173	-103.4	0	0	0	113.2	K398 K404	K398-Y400 PolarHBondContact O-N 2.84Å; Y400-K404 WeakPolarHBondContact O-CB 3.22Å; Y400-K404 PolarHBondContact O-N 3.01Å; Y400-K404 VanDerWaalsContact O-N 3.1Å
401	Q	97.2	Very high	95.9	Very high	96 Å²	96	87 Å²	87	45%	0.449	40%	0.404	S	S	.	.	H	α-helix	trans	-73.1	-43.3	-178.1	-55.1	164.7	8.7	0	0	110	K398 S399 K404 L405 M417	K398-Q401 WeakPolarHBondContact O-CA 3.29Å; K398-Q401 WeakPolarHBondContact O-CB 3.3Å; K398-Q401 PolarHBondContact O-N 3.25Å; S399-Q401 VanDerWaalsContact C-N 3.3Å; S399-Q401 PolarHBondContact O-N 2.81Å; Q401-K404 PolarHBondContact O-N 3.05Å; Q401-L405 WeakPolarHBondContact O-CG 3.4Å; Q401-L405 PolarHBondContact O-N 3.42Å; Q401-M417 HydrophobicContact CB-CE 3.84Å; Q401-M417 HydrophobicContact CB-SD 3.61Å
402	L	96.9	Very high	96.1	Very high	6 Å²	6	87 Å²	87	3%	0.031	39%	0.393	C	S	.	.	H	α-helix	trans	-61.7	-46.1	173.7	-70.2	167.7	0	0	0	111.8	A395 K398 S399 K404 L405 Y406 Y414 M417 L418	A395-L402 HydrophobicContact CB-CD1 3.75Å; K398-L402 HydrophobicContact CB-CD1 3.84Å; K398-L402 HydrophobicContact CB-CG 4.13Å; K398-L402 WeakPolarHBondContact O-CG 3.45Å; K398-L402 PolarHBondContact O-N 2.84Å; S399-L402 PolarHBondContact O-N 3.09Å; L402-K404 PolarHBondContact O-N 2.84Å; L402-L405 PolarHBondContact O-N 3.48Å; L402-Y406 WeakPolarHBondContact O-CB 3.46Å; L402-Y406 PolarHBondContact O-N 2.6Å; L402-Y414 HydrophobicContact CB-CD2 4.17Å; L402-Y414 HydrophobicContact CB-CE2 3.67Å; L402-Y414 HydrophobicContact CD2-CD1 4.5Å; L402-Y414 HydrophobicContact CD2-CD2 3.75Å; L402-Y414 HydrophobicContact CD2-CE1 4.49Å; L402-Y414 HydrophobicContact CD2-CE2 3.73Å; L402-Y414 HydrophobicContact CD2-CG 4.13Å; L402-Y414 HydrophobicContact CG-CE2 4.29Å; L402-Y414 WeakPolarHBondContact O-CD2 3.44Å; L402-Y414 WeakPolarHBondContact O-CE2 3.45Å; L402-M417 HydrophobicContact CD2-CB 3.9Å; L402-M417 HydrophobicContact CD2-CG 3.77Å; L402-M417 HydrophobicContact CD2-SD 3.7Å; L402-M417 HydrophobicContact CG-CG 4.25Å; L402-M417 HydrophobicContact CG-SD 3.78Å; L402-L418 HydrophobicContact CD1-CD2 3.6Å; L402-L418 HydrophobicContact CD2-CD2 3.77Å; L402-L418 HydrophobicContact CD2-CG 3.8Å; L402-L418 HydrophobicContact CG-CD2 4.36Å
403	Q	96.7	Very high	96.4	Very high	111 Å²	111	88.4 Å²	88.4	52%	0.519	40%	0.404	S	S	.	.	H	α-helix	trans	-57	-48.9	175	177.7	178	-11.6	0	0	111.1	S399 L405 Y406 E407	S399-Q403 WeakPolarHBondContact O-CB 3.19Å; S399-Q403 PolarHBondContact O-N 3.43Å; Q403-L405 VanDerWaalsContact C-N 3.29Å; Q403-L405 PolarHBondContact O-N 2.8Å; Q403-Y406 WeakPolarHBondContact O-CB 3.49Å; Q403-Y406 PolarHBondContact O-N 2.91Å; Q403-E407 HydrophobicContact CG-CG 4.4Å; Q403-E407 VanDerWaalsContact CG-OE1 3.3Å; Q403-E407 WeakPolarHBondContact CG-OE1 3.46Å; Q403-E407 PolarHBondContact NE2-OE1 2.91Å; Q403-E407 WeakPolarHBondContact O-CG 3.34Å; Q403-E407 PolarHBondContact O-N 3.35Å
404	K	97.9	Very high	96.5	Very high	96 Å²	96	88.7 Å²	88.7	42%	0.417	41%	0.405	S	S	.	.	H	α-helix	trans	-60.9	-36.2	177.9	-176.4	176.8	-178.9	176.1	0	112.8	Y400 Q401 L402 Q408	Y400-K404 WeakPolarHBondContact O-CB 3.22Å; Y400-K404 PolarHBondContact O-N 3.01Å; Y400-K404 VanDerWaalsContact O-N 3.1Å; Q401-K404 PolarHBondContact O-N 3.05Å; L402-K404 PolarHBondContact O-N 2.84Å; K404-Q408 WeakPolarHBondContact O-CB 3.22Å; K404-Q408 WeakPolarHBondContact O-CG 3.45Å; K404-Q408 PolarHBondContact O-N 3.45Å; K404-Q408 VanDerWaalsContact O-N 3.13Å
405	L	98	Very high	96.6	Very high	22 Å²	22	83.7 Å²	83.7	12%	0.115	38%	0.384	C	S	.	.	H	α-helix	trans	-72.1	-37.4	175.7	-71.2	172.1	0	0	0	112.3	Q401 L402 Q403 Q408 R409 K410 M413 Y414 M417	Q401-L405 WeakPolarHBondContact O-CG 3.4Å; Q401-L405 PolarHBondContact O-N 3.42Å; L402-L405 PolarHBondContact O-N 3.48Å; Q403-L405 VanDerWaalsContact C-N 3.29Å; Q403-L405 PolarHBondContact O-N 2.8Å; L405-Q408 CarbonylContact O-C 3.54Å; L405-Q408 PolarHBondContact O-N 2.9Å; L405-R409 PolarHBondContact O-N 3.41Å; L405-R409 VanDerWaalsContact O-N 3.09Å; L405-K410 HydrophobicContact CD2-CB 3.88Å; L405-K410 HydrophobicContact CD2-CD 3.87Å; L405-K410 PolarHBondContact O-N 2.95Å; L405-M413 HydrophobicContact CD1-CB 4.19Å; L405-M413 HydrophobicContact CD2-CB 3.83Å; L405-M413 HydrophobicContact CD2-SD 4.26Å; L405-Y414 HydrophobicContact CB-CD2 4.13Å; L405-M417 HydrophobicContact CD1-CE 3.79Å; L405-M417 HydrophobicContact CD1-SD 3.97Å
406	Y	96.8	Very high	96.7	Very high	108 Å²	108	87 Å²	87	42%	0.424	40%	0.4	S	S	.	.	H	α-helix	trans	-63.5	-49.3	174	176.8	-87.8	0	0	0	111.6	F381 V385 L402 Q403 Q408 R409	F381-Y406 HydrophobicContact CE1-CD2 4.32Å; F381-Y406 HydrophobicContact CE1-CE2 4.46Å; F381-Y406 HydrophobicContact CE2-CD2 4.3Å; F381-Y406 AromaticContact CZ-CD2 3.56Å; F381-Y406 HydrophobicContact CZ-CD2 3.56Å; F381-Y406 HydrophobicContact CZ-CE2 4.13Å; F381-Y406 HydrophobicContact CZ-CG 4.41Å; V385-Y406 HydrophobicContact CG1-CD2 4.37Å; V385-Y406 HydrophobicContact CG1-CE2 3.95Å; V385-Y406 HydrophobicContact CG2-CD2 3.88Å; V385-Y406 HydrophobicContact CG2-CE2 4.11Å; L402-Y406 WeakPolarHBondContact O-CB 3.46Å; L402-Y406 PolarHBondContact O-N 2.6Å; Q403-Y406 WeakPolarHBondContact O-CB 3.49Å; Q403-Y406 PolarHBondContact O-N 2.91Å; Y406-Q408 VanDerWaalsContact C-N 3.27Å; Y406-Q408 PolarHBondContact O-N 2.94Å; Y406-R409 WeakPolarHBondContact O-CA 3.36Å; Y406-R409 PolarHBondContact O-N 3.01Å
407	E	97.1	Very high	96.9	Very high	122 Å²	122	82.8 Å²	82.8	57%	0.57	38%	0.381	S	S	*	.	H	α-helix	trans	-59.2	-37.6	175.5	-71.8	170.1	-176.9	0	0	112.2	Q403 R409	Q403-E407 HydrophobicContact CG-CG 4.4Å; Q403-E407 VanDerWaalsContact CG-OE1 3.3Å; Q403-E407 WeakPolarHBondContact CG-OE1 3.46Å; Q403-E407 PolarHBondContact NE2-OE1 2.91Å; Q403-E407 WeakPolarHBondContact O-CG 3.34Å; Q403-E407 PolarHBondContact O-N 3.35Å; E407-R409 VanDerWaalsContact C-N 3.26Å; E407-R409 PolarHBondContact O-N 2.98Å
408	Q	97.4	Very high	97.1	Very high	95 Å²	95	73.9 Å²	73.9	44%	0.444	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	2.4	175.1	-67.5	-178.1	10.3	0	0	114	K404 L405 Y406 K410	K404-Q408 WeakPolarHBondContact O-CB 3.22Å; K404-Q408 WeakPolarHBondContact O-CG 3.45Å; K404-Q408 PolarHBondContact O-N 3.45Å; K404-Q408 VanDerWaalsContact O-N 3.13Å; L405-Q408 CarbonylContact O-C 3.54Å; L405-Q408 PolarHBondContact O-N 2.9Å; Y406-Q408 VanDerWaalsContact C-N 3.27Å; Y406-Q408 PolarHBondContact O-N 2.94Å; Q408-K410 HydrophobicContact CB-CD 3.95Å; Q408-K410 HydrophobicContact CB-CG 4.03Å; Q408-K410 PolarHBondContact O-N 3.27Å
409	R	96	Very high	97.2	Very high	200 Å²	200	73.1 Å²	73.1	76%	0.755	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	28	-177.2	-60.5	179.2	174.3	-93.6	-1.4	114.5	L405 Y406 E407 M411	L405-R409 PolarHBondContact O-N 3.41Å; L405-R409 VanDerWaalsContact O-N 3.09Å; Y406-R409 WeakPolarHBondContact O-CA 3.36Å; Y406-R409 PolarHBondContact O-N 3.01Å; E407-R409 VanDerWaalsContact C-N 3.26Å; E407-R409 PolarHBondContact O-N 2.98Å; R409-M411 VanDerWaalsContact C-N 3.29Å; R409-M411 PolarHBondContact O-N 3.47Å
410	K	97.8	Very high	97.2	Very high	91 Å²	91	74.7 Å²	74.7	40%	0.396	34%	0.342	S	S	.	.			trans	-84.9	66.3	-176.1	-72.9	176	172.3	172.5	0	111.8	L405 Q408 V412 M413 Y414	L405-K410 HydrophobicContact CD2-CB 3.88Å; L405-K410 HydrophobicContact CD2-CD 3.87Å; L405-K410 PolarHBondContact O-N 2.95Å; Q408-K410 HydrophobicContact CB-CD 3.95Å; Q408-K410 HydrophobicContact CB-CG 4.03Å; Q408-K410 PolarHBondContact O-N 3.27Å; K410-V412 PolarHBondContact O-N 3.47Å; K410-M413 HydrophobicContact CB-CB 4.19Å; K410-M413 HydrophobicContact CD-SD 4Å; K410-M413 PolarHBondContact O-N 3.06Å; K410-M413 VanDerWaalsContact O-N 3.14Å; K410-Y414 PolarHBondContact O-N 3.1Å
411	M	98.1	Very high	97.1	Very high	37 Å²	37	67.9 Å²	67.9	18%	0.182	32%	0.318	C	S	.	.	H	α-helix	trans	-52	-52.3	-170.6	-61.3	-170.8	177.3	0	0	113.8	V377 F381 R409 M413 Y414 L415	V377-M411 HydrophobicContact CG1-CB 3.66Å; V377-M411 HydrophobicContact CG1-SD 4.31Å; F381-M411 HydrophobicContact CB-CB 3.92Å; F381-M411 HydrophobicContact CB-CG 4.04Å; F381-M411 HydrophobicContact CB-SD 4.12Å; F381-M411 HydrophobicContact CD1-CB 4.33Å; F381-M411 HydrophobicContact CD1-CE 3.72Å; F381-M411 HydrophobicContact CD1-CG 3.58Å; F381-M411 HydrophobicContact CD1-SD 3.73Å; F381-M411 HydrophobicContact CD2-CB 3.94Å; F381-M411 HydrophobicContact CD2-CG 3.94Å; F381-M411 HydrophobicContact CE1-CE 3.91Å; F381-M411 HydrophobicContact CE1-CG 3.92Å; F381-M411 HydrophobicContact CE1-SD 4.37Å; F381-M411 HydrophobicContact CE2-CG 4.25Å; F381-M411 HydrophobicContact CG-CB 3.81Å; F381-M411 HydrophobicContact CG-CG 3.58Å; F381-M411 HydrophobicContact CG-SD 4.03Å; F381-M411 HydrophobicContact CZ-CG 4.23Å; R409-M411 VanDerWaalsContact C-N 3.29Å; R409-M411 PolarHBondContact O-N 3.47Å; M411-M413 VanDerWaalsContact C-N 3.35Å; M411-M413 PolarHBondContact O-N 2.89Å; M411-Y414 WeakPolarHBondContact O-CB 3.35Å; M411-Y414 PolarHBondContact O-N 3.13Å; M411-L415 WeakPolarHBondContact O-CG 3.39Å; M411-L415 PolarHBondContact O-N 2.87Å
412	V	98	Very high	97	Very high	48 Å²	48	67.8 Å²	67.8	29%	0.291	32%	0.317	S	S	.	.	H	α-helix	trans	-63	-38	-179.8	-178.9	0	0	0	0	112.3	N371 V377 K410 L415 N416	N371-V412 HydrophobicContact CB-CG1 4.37Å; V377-V412 HydrophobicContact CG1-CG2 3.78Å; V377-V412 HydrophobicContact CG2-CG2 4.15Å; K410-V412 PolarHBondContact O-N 3.47Å; V412-L415 PolarHBondContact O-N 3.18Å; V412-N416 WeakPolarHBondContact O-CB 3.37Å; V412-N416 VanDerWaalsContact O-CG 3.22Å; V412-N416 PolarHBondContact O-N 2.82Å; V412-N416 PolarHBondContact O-ND2 3.19Å
413	M	98	Very high	96.9	Very high	112 Å²	112	67.9 Å²	67.9	55%	0.552	32%	0.32	S	S	*	.	H	α-helix	trans	-69.7	-35.4	175.9	-71.5	-175.6	162.5	0	0	112.4	L405 K410 M411 M417	L405-M413 HydrophobicContact CD1-CB 4.19Å; L405-M413 HydrophobicContact CD2-CB 3.83Å; L405-M413 HydrophobicContact CD2-SD 4.26Å; K410-M413 HydrophobicContact CB-CB 4.19Å; K410-M413 HydrophobicContact CD-SD 4Å; K410-M413 PolarHBondContact O-N 3.06Å; K410-M413 VanDerWaalsContact O-N 3.14Å; M411-M413 VanDerWaalsContact C-N 3.35Å; M411-M413 PolarHBondContact O-N 2.89Å; M413-M417 PolarHBondContact O-N 3.34Å; M413-M417 VanDerWaalsContact O-N 3.15Å
414	Y	98.3	Very high	96.9	Very high	12 Å²	12	63.6 Å²	63.6	5%	0.047	30%	0.299	C	S	.	.	H	α-helix	trans	-64.9	-44.6	174.1	-175.1	-84.3	0	0	0	110.8	F381 V385 L402 L405 K410 M411 M417 L418	F381-Y414 AromaticContact CD2-CD1 3.57Å; F381-Y414 HydrophobicContact CD2-CD1 3.57Å; F381-Y414 HydrophobicContact CD2-CE1 4.22Å; F381-Y414 AromaticContact CD2-CG 3.88Å; F381-Y414 HydrophobicContact CD2-CG 3.88Å; F381-Y414 AromaticContact CE2-CD1 3.65Å; F381-Y414 HydrophobicContact CE2-CD1 3.65Å; F381-Y414 HydrophobicContact CE2-CD2 4.04Å; F381-Y414 HydrophobicContact CE2-CE1 4.17Å; F381-Y414 AromaticContact CE2-CG 3.59Å; F381-Y414 HydrophobicContact CE2-CG 3.59Å; V385-Y414 HydrophobicContact CG2-CD1 4.41Å; V385-Y414 HydrophobicContact CG2-CE1 3.55Å; V385-Y414 HydrophobicContact CG2-CE2 4.42Å; L402-Y414 HydrophobicContact CB-CD2 4.17Å; L402-Y414 HydrophobicContact CB-CE2 3.67Å; L402-Y414 HydrophobicContact CD2-CD1 4.5Å; L402-Y414 HydrophobicContact CD2-CD2 3.75Å; L402-Y414 HydrophobicContact CD2-CE1 4.49Å; L402-Y414 HydrophobicContact CD2-CE2 3.73Å; L402-Y414 HydrophobicContact CD2-CG 4.13Å; L402-Y414 HydrophobicContact CG-CE2 4.29Å; L402-Y414 WeakPolarHBondContact O-CD2 3.44Å; L402-Y414 WeakPolarHBondContact O-CE2 3.45Å; L405-Y414 HydrophobicContact CB-CD2 4.13Å; K410-Y414 PolarHBondContact O-N 3.1Å; M411-Y414 WeakPolarHBondContact O-CB 3.35Å; M411-Y414 PolarHBondContact O-N 3.13Å; Y414-M417 WeakPolarHBondContact O-CB 3.4Å; Y414-M417 PolarHBondContact O-N 3.41Å; Y414-L418 HydrophobicContact CD1-CD1 3.87Å; Y414-L418 HydrophobicContact CD1-CG 4.39Å; Y414-L418 HydrophobicContact CE1-CD1 3.29Å; Y414-L418 HydrophobicContact CE1-CG 4.13Å; Y414-L418 PolarHBondContact O-N 3.5Å; Y414-L418 VanDerWaalsContact O-N 3.09Å
415	L	98.1	Very high	96.8	Very high	0 Å²	0	60 Å²	60	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-61.3	-48.4	174.3	-72.8	168.7	0	0	0	111.9	V377 F380 F381 A384 M411 V412 M417 L418 R419 Y424	V377-L415 HydrophobicContact CG1-CD1 4.43Å; F380-L415 HydrophobicContact CB-CD1 3.95Å; F380-L415 HydrophobicContact CB-CD2 4.06Å; F381-L415 HydrophobicContact CB-CD1 4.34Å; F381-L415 HydrophobicContact CB-CG 4.46Å; A384-L415 HydrophobicContact CB-CD2 4.1Å; M411-L415 WeakPolarHBondContact O-CG 3.39Å; M411-L415 PolarHBondContact O-N 2.87Å; V412-L415 PolarHBondContact O-N 3.18Å; L415-M417 PolarHBondContact O-N 2.92Å; L415-M417 VanDerWaalsContact O-N 3.14Å; L415-L418 PolarHBondContact O-N 2.94Å; L415-R419 WeakPolarHBondContact O-CB 3.35Å; L415-R419 VanDerWaalsContact O-CG 3.23Å; L415-R419 WeakPolarHBondContact O-CG 3.41Å; L415-R419 PolarHBondContact O-N 2.9Å; L415-Y424 WeakPolarHBondContact CD2-OH 3.47Å
416	N	97.5	Very high	96.7	Very high	76 Å²	76	60.4 Å²	60.4	41%	0.406	29%	0.286	S	S	.	.	H	α-helix	trans	-56.7	-30.4	175.4	-72.4	-13.3	0	0	0	113.4	V412 R419	V412-N416 WeakPolarHBondContact O-CB 3.37Å; V412-N416 VanDerWaalsContact O-CG 3.22Å; V412-N416 PolarHBondContact O-N 2.82Å; V412-N416 PolarHBondContact O-ND2 3.19Å; N416-R419 PolarHBondContact OD1-NH1 2.88Å
417	M	97.1	Very high	96.7	Very high	44 Å²	44	56.8 Å²	56.8	22%	0.217	27%	0.274	C	S	.	.	H	α-helix	trans	-77	-34.7	176.4	-170.5	168.7	-75.9	0	0	112.9	K398 Q401 L402 L405 M413 Y414 L415 T420	K398-M417 HydrophobicContact CB-CG 4.34Å; K398-M417 HydrophobicContact CB-SD 4.23Å; K398-M417 HydrophobicContact CD-CG 3.77Å; K398-M417 PolarHBondContact NZ-O 2.97Å; K398-M417 VanDerWaalsContact NZ-O 3.15Å; Q401-M417 HydrophobicContact CB-CE 3.84Å; Q401-M417 HydrophobicContact CB-SD 3.61Å; L402-M417 HydrophobicContact CD2-CB 3.9Å; L402-M417 HydrophobicContact CD2-CG 3.77Å; L402-M417 HydrophobicContact CD2-SD 3.7Å; L402-M417 HydrophobicContact CG-CG 4.25Å; L402-M417 HydrophobicContact CG-SD 3.78Å; L405-M417 HydrophobicContact CD1-CE 3.79Å; L405-M417 HydrophobicContact CD1-SD 3.97Å; M413-M417 PolarHBondContact O-N 3.34Å; M413-M417 VanDerWaalsContact O-N 3.15Å; Y414-M417 WeakPolarHBondContact O-CB 3.4Å; Y414-M417 PolarHBondContact O-N 3.41Å; L415-M417 PolarHBondContact O-N 2.92Å; L415-M417 VanDerWaalsContact O-N 3.14Å; M417-T420 PolarHBondContact O-OG1 2.87Å
418	L	97	Very high	96.7	Very high	0 Å²	0	54 Å²	54	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-83.3	-28.6	177.9	-70.5	-174.4	0	0	0	114.4	A384 V388 I393 A395 L402 Y414 L415 T420 C421 Y424	A384-L418 HydrophobicContact CB-CD1 3.79Å; V388-L418 HydrophobicContact CG2-CD1 3.68Å; V388-L418 HydrophobicContact CG2-CD2 3.83Å; V388-L418 HydrophobicContact CG2-CG 4.44Å; I393-L418 HydrophobicContact CG2-CD2 4.12Å; A395-L418 HydrophobicContact CB-CD2 4.04Å; L402-L418 HydrophobicContact CD1-CD2 3.6Å; L402-L418 HydrophobicContact CD2-CD2 3.77Å; L402-L418 HydrophobicContact CD2-CG 3.8Å; L402-L418 HydrophobicContact CG-CD2 4.36Å; Y414-L418 HydrophobicContact CD1-CD1 3.87Å; Y414-L418 HydrophobicContact CD1-CG 4.39Å; Y414-L418 HydrophobicContact CE1-CD1 3.29Å; Y414-L418 HydrophobicContact CE1-CG 4.13Å; Y414-L418 PolarHBondContact O-N 3.5Å; Y414-L418 VanDerWaalsContact O-N 3.09Å; L415-L418 PolarHBondContact O-N 2.94Å; L418-T420 PolarHBondContact O-N 3.4Å; L418-C421 WeakPolarHBondContact O-CB 3.49Å; L418-C421 PolarHBondContact O-N 3.3Å; L418-Y424 HydrophobicContact CB-CD2 3.67Å; L418-Y424 HydrophobicContact CB-CE2 3.71Å; L418-Y424 VanDerWaalsContact O-CB 3.3Å; L418-Y424 WeakPolarHBondContact O-CB 3.4Å; L418-Y424 WeakPolarHBondContact O-CD2 3.39Å; L418-Y424 VanDerWaalsContact O-CG 3.3Å
419	R	96.1	Very high	96.6	Very high	28 Å²	28	49.7 Å²	49.7	11%	0.106	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-9	172	-72	163.9	-175.3	166.9	-11.1	113.4	T364 E367 I368 N371 L415 N416 Y424	T364-R419 HydrophobicContact CG2-CB 4.16Å; T364-R419 HydrophobicContact CG2-CG 4.06Å; E367-R419 PolarHBondContact O-NH2 2.72Å; E367-R419 VanDerWaalsContact O-NH2 3.07Å; E367-R419 IonicContact OE1-CZ 3.78Å; E367-R419 IonicContact OE1-NE 2.91Å; E367-R419 PolarHBondContact OE1-NE 2.88Å; E367-R419 IonicContact OE1-NH2 2.78Å; E367-R419 PolarHBondContact OE1-NH2 2.83Å; I368-R419 VanDerWaalsContact CG1-NH1 3.34Å; N371-R419 PolarHBondContact OD1-NH1 3.48Å; N371-R419 VanDerWaalsContact OD1-NH1 3.07Å; N371-R419 PolarHBondContact OD1-NH2 2.92Å; L415-R419 WeakPolarHBondContact O-CB 3.35Å; L415-R419 VanDerWaalsContact O-CG 3.23Å; L415-R419 WeakPolarHBondContact O-CG 3.41Å; L415-R419 PolarHBondContact O-N 2.9Å; N416-R419 PolarHBondContact OD1-NH1 2.88Å; R419-Y424 HydrophobicContact CB-CD1 4.46Å; R419-Y424 HydrophobicContact CB-CE1 4.41Å; R419-Y424 HydrophobicContact CG-CD1 4.16Å; R419-Y424 HydrophobicContact CG-CE1 3.64Å
420	T	94.2	Very high	96.5	Very high	102 Å²	102	42.2 Å²	42.2	63%	0.626	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-117	23.6	175.7	59.9	0	0	0	0	113.3	K398 M417 L418	K398-T420 VanDerWaalsContact NZ-C 3.33Å; K398-T420 PolarHBondContact NZ-O 3.41Å; K398-T420 PolarHBondContact NZ-OG1 2.85Å; M417-T420 PolarHBondContact O-OG1 2.87Å; L418-T420 PolarHBondContact O-N 3.4Å
421	C	96	Very high	96.4	Very high	19 Å²	19	41.4 Å²	41.4	13%	0.128	22%	0.217	C	C	.	.	S	Bend	trans	-110.1	149.9	176.2	-71.3	0	0	0	0	111.5	I393 K394 K398 L418 Y424	I393-C421 HydrophobicContact CG2-CB 3.58Å; K394-C421 VanDerWaalsContact O-CB 3.3Å; K394-C421 WeakPolarHBondContact O-CB 3.49Å; K394-C421 PolarHBondContact O-SG 3.41Å; K398-C421 PolarHBondContact NZ-SG 2.98Å; L418-C421 WeakPolarHBondContact O-CB 3.49Å; L418-C421 PolarHBondContact O-N 3.3Å; C421-Y424 WeakPolarHBondContact O-CB 3.29Å; C421-Y424 PolarHBondContact O-N 3.09Å
422	E	94.4	Very high	96.2	Very high	94 Å²	94	40 Å²	40	44%	0.439	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	140.5	171.3	-158.4	-163.5	150	0	0	110.1	I393 K394 Y424 K452	I393-E422 WeakPolarHBondContact CA-O 3.32Å; K394-E422 HydrophobicContact CB-CB 4.4Å; K394-E422 HydrophobicContact CD-CB 4.25Å; K394-E422 WeakPolarHBondContact CD-OE2 3.34Å; K394-E422 WeakPolarHBondContact CE-OE2 3.39Å; K394-E422 PolarHBondContact N-O 3.27Å; K394-E422 IonicContact NZ-OE1 2.91Å; K394-E422 PolarHBondContact NZ-OE1 3.49Å; K394-E422 IonicContact NZ-OE2 2.71Å; K394-E422 PolarHBondContact NZ-OE2 3.45Å; E422-Y424 VanDerWaalsContact C-N 3.29Å; E422-K452 IonicContact OE1-NZ 3.13Å; E422-K452 PolarHBondContact OE1-NZ 2.91Å
423	G	94.9	Very high	96	Very high	9 Å²	9	39.7 Å²	39.7	9%	0.093	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.6	-6.2	-176.1	0	0	0	0	0	114.7	Y392 N425 E426	Y392-G423 WeakPolarHBondContact O-CA 3.27Å; G423-N425 PolarHBondContact O-N 2.99Å; G423-E426 WeakPolarHBondContact O-CB 3.49Å; G423-E426 PolarHBondContact O-N 3.29Å
424	Y	96.8	Very high	95.9	Very high	20 Å²	20	34.7 Å²	34.7	8%	0.078	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	129.1	171.2	-160.6	-94.3	0	0	0	110.6	K359 T364 E367 A384 I393 L415 L418 R419 C421 E422 E426	K359-Y424 PolarHBondContact NZ-OH 3Å; T364-Y424 HydrophobicContact CG2-CD1 4.11Å; T364-Y424 HydrophobicContact CG2-CE1 4.25Å; E367-Y424 PolarHBondContact OE1-OH 3.06Å; E367-Y424 WeakPolarHBondContact OE2-CE1 3.3Å; E367-Y424 PolarHBondContact OE2-OH 3.23Å; A384-Y424 HydrophobicContact CB-CE2 4.04Å; I393-Y424 HydrophobicContact CD1-CD2 3.83Å; I393-Y424 HydrophobicContact CD1-CE2 4.27Å; I393-Y424 HydrophobicContact CG1-CD2 4.44Å; L415-Y424 WeakPolarHBondContact CD2-OH 3.47Å; L418-Y424 HydrophobicContact CB-CD2 3.67Å; L418-Y424 HydrophobicContact CB-CE2 3.71Å; L418-Y424 VanDerWaalsContact O-CB 3.3Å; L418-Y424 WeakPolarHBondContact O-CB 3.4Å; L418-Y424 WeakPolarHBondContact O-CD2 3.39Å; L418-Y424 VanDerWaalsContact O-CG 3.3Å; R419-Y424 HydrophobicContact CB-CD1 4.46Å; R419-Y424 HydrophobicContact CB-CE1 4.41Å; R419-Y424 HydrophobicContact CG-CD1 4.16Å; R419-Y424 HydrophobicContact CG-CE1 3.64Å; C421-Y424 WeakPolarHBondContact O-CB 3.29Å; C421-Y424 PolarHBondContact O-N 3.09Å; E422-Y424 VanDerWaalsContact C-N 3.29Å; Y424-E426 PolarHBondContact O-N 3.02Å
425	N	95.8	Very high	95.7	Very high	20 Å²	20	37.9 Å²	37.9	11%	0.107	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	33.2	-173.4	-64	-2.3	0	0	0	113.8	K359 F362 E367 G423	K359-N425 WeakPolarHBondContact CE-OD1 3.31Å; K359-N425 PolarHBondContact NZ-OD1 2.84Å; F362-N425 WeakPolarHBondContact CD1-O 3.44Å; F362-N425 VanDerWaalsContact O-CB 3.31Å; F362-N425 WeakPolarHBondContact O-CB 3.22Å; F362-N425 PolarHBondContact O-ND2 3.42Å; E367-N425 PolarHBondContact OE2-ND2 3.32Å; G423-N425 PolarHBondContact O-N 2.99Å
426	E	95.9	Very high	95.3	Very high	31 Å²	31	41.1 Å²	41.1	15%	0.145	23%	0.23	C	C	.	.			trans	-104	127.3	174.6	-168.7	166.2	-119.1	0	0	110.6	G423 Y424 I428 A445 I446 H450 K452	G423-E426 WeakPolarHBondContact O-CB 3.49Å; G423-E426 PolarHBondContact O-N 3.29Å; Y424-E426 PolarHBondContact O-N 3.02Å; E426-I428 HydrophobicContact CG-CG1 4.44Å; E426-A445 HydrophobicContact CG-CB 3.75Å; E426-I446 CarbonylContact C-O 3.48Å; E426-I446 VanDerWaalsContact CA-O 3.3Å; E426-I446 WeakPolarHBondContact CA-O 3.41Å; E426-H450 IonicContact OE1-CE1 2.68Å; E426-H450 PolarHBondContact OE1-CE1 3.3Å; E426-H450 IonicContact OE1-ND1 3.5Å; E426-K452 WeakPolarHBondContact OE1-CD 3.38Å; E426-K452 WeakPolarHBondContact OE1-CE 3.42Å; E426-K452 IonicContact OE1-NZ 3.47Å; E426-K452 PolarHBondContact OE1-NZ 3.12Å; E426-K452 IonicContact OE2-NZ 2.76Å; E426-K452 PolarHBondContact OE2-NZ 3.31Å
427	I	97	Very high	94.8	Very high	33 Å²	33	39.9 Å²	39.9	17%	0.169	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	114	175.8	-58.4	-172.4	0	0	0	108.9	W360 F362 F429 A445 I446 Y509	W360-I427 HydrophobicContact CE3-CD1 4.47Å; W360-I427 HydrophobicContact CZ3-CD1 3.9Å; F362-I427 HydrophobicContact CE1-CD1 3.78Å; F362-I427 HydrophobicContact CE1-CG1 3.83Å; F362-I427 HydrophobicContact CE2-CD1 4.43Å; F362-I427 HydrophobicContact CZ-CD1 3.51Å; F362-I427 HydrophobicContact CZ-CG1 4.11Å; I427-F429 HydrophobicContact CB-CE2 4.44Å; I427-F429 HydrophobicContact CG2-CD2 4.26Å; I427-F429 HydrophobicContact CG2-CE2 3.7Å; I427-F429 HydrophobicContact CG2-CZ 4.35Å; I427-A445 WeakPolarHBondContact O-CA 3.34Å; I427-I446 PolarHBondContact N-O 3.39Å; I427-I446 PolarHBondContact O-N 2.91Å; I427-Y509 HydrophobicContact CG2-CE1 4.28Å
428	I	95.9	Very high	94.1	Very high	63 Å²	63	49.9 Å²	49.9	32%	0.323	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	128.5	-177.7	-52.9	176	0	0	0	109.5	F328 E426 I443 A445	F328-I428 WeakPolarHBondContact CE2-O 3.35Å; E426-I428 HydrophobicContact CG-CG1 4.44Å; I428-I443 HydrophobicContact CG2-CG2 3.52Å; I428-A445 HydrophobicContact CG1-CB 4.18Å
429	F	96.3	Very high	93.6	Very high	4 Å²	4	57.9 Å²	57.9	2%	0.018	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-99.8	155.1	179.1	-70.3	-114	0	0	0	111.4	F328 I427 T444 I446 Y509 M510	F328-F429 HydrophobicContact CE2-CD1 4.36Å; F328-F429 HydrophobicContact CE2-CG 4.36Å; F328-F429 AromaticContact CZ-CD1 3.87Å; F328-F429 HydrophobicContact CZ-CD1 3.87Å; F328-F429 HydrophobicContact CZ-CE1 4.2Å; F328-F429 HydrophobicContact CZ-CG 4.33Å; I427-F429 HydrophobicContact CB-CE2 4.44Å; I427-F429 HydrophobicContact CG2-CD2 4.26Å; I427-F429 HydrophobicContact CG2-CE2 3.7Å; I427-F429 HydrophobicContact CG2-CZ 4.35Å; F429-T444 WeakPolarHBondContact CB-OG1 3.42Å; F429-T444 PolarHBondContact N-O 3.46Å; F429-I446 HydrophobicContact CE2-CD1 3.75Å; F429-I446 HydrophobicContact CE2-CG1 4.4Å; F429-I446 HydrophobicContact CZ-CD1 4.23Å; F429-Y509 AromaticContact CE1-CD1 3.52Å; F429-Y509 HydrophobicContact CE1-CD1 3.52Å; F429-Y509 HydrophobicContact CE1-CE1 4.03Å; F429-Y509 HydrophobicContact CE1-CG 4.3Å; F429-Y509 AromaticContact CZ-CD1 3.67Å; F429-Y509 HydrophobicContact CZ-CD1 3.67Å; F429-Y509 AromaticContact CZ-CE1 3.83Å; F429-Y509 HydrophobicContact CZ-CE1 3.83Å; F429-Y509 HydrophobicContact CZ-CG 4.36Å; F429-M510 HydrophobicContact CB-CE 4.26Å; F429-M510 HydrophobicContact CD1-CE 3.64Å; F429-M510 HydrophobicContact CD2-CE 4.2Å; F429-M510 HydrophobicContact CE1-CB 3.93Å; F429-M510 HydrophobicContact CE1-CE 3.98Å; F429-M510 HydrophobicContact CE1-CG 4.47Å; F429-M510 HydrophobicContact CG-CE 3.77Å; F429-M510 HydrophobicContact CZ-CB 4.07Å; F429-M510 HydrophobicContact CZ-CE 4.43Å; F429-M510 HydrophobicContact CZ-CG 4.35Å
430	P	93.7	Very high	93.3	Very high	44 Å²	44	57.2 Å²	57.2	29%	0.286	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-57.8	151.2	173.3	-25.9	37.4	0	0	0	113	F328 C432 Y506	F328-P430 HydrophobicContact CB-CG 4.18Å; F328-P430 HydrophobicContact CD1-CG 4.02Å; F328-P430 HydrophobicContact CD2-CG 4.14Å; F328-P430 HydrophobicContact CE1-CG 4.47Å; F328-P430 HydrophobicContact CG-CG 3.84Å; P430-C432 PolarHBondContact O-N 3.14Å; P430-C432 PolarHBondContact O-SG 3.04Å; P430-C432 VanDerWaalsContact O-SG 3.33Å; P430-Y506 HydrophobicContact CB-CE2 4.44Å; P430-Y506 HydrophobicContact CG-CD2 4.33Å; P430-Y506 HydrophobicContact CG-CE2 3.8Å
431	H	95.4	Very high	93.5	Very high	74 Å²	74	54.3 Å²	54.3	34%	0.343	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-57.4	129.9	178.3	64.7	114.8	0	0	0	111.8	H441 V442 I443 E458 G460	H431-H441 HydrophobicContact CB-CB 4.06Å; H431-H441 AromaticContact CG-ND1 4Å; H431-H441 AromaticContact ND1-ND1 3.27Å; H431-H441 PolarHBondContact ND1-ND1 3.04Å; H431-H441 PolarHBondContact O-ND1 2.88Å; H431-V442 WeakPolarHBondContact CA-O 3.23Å; H431-I443 HydrophobicContact CB-CD1 4.27Å; H431-I443 HydrophobicContact CB-CG1 3.7Å; H431-E458 PolarHBondContact CE1-O 3.49Å; H431-E458 PolarHBondContact ND1-O 2.69Å; H431-G460 PolarHBondContact ND1-N 2.94Å
432	C	94.3	Very high	93.6	Very high	8 Å²	8	53.7 Å²	53.7	5%	0.054	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-143.9	158.3	-173.9	41.2	0	0	0	0	112.2	P430 H441 V442 I502 F503	P430-C432 PolarHBondContact O-N 3.14Å; P430-C432 PolarHBondContact O-SG 3.04Å; P430-C432 VanDerWaalsContact O-SG 3.33Å; C432-H441 CarbonylContact O-C 3.49Å; C432-H441 VanDerWaalsContact O-CA 3.29Å; C432-H441 WeakPolarHBondContact O-CA 3.28Å; C432-H441 VanDerWaalsContact O-CB 3.24Å; C432-H441 WeakPolarHBondContact O-CB 3.43Å; C432-V442 PolarHBondContact N-O 2.85Å; C432-V442 PolarHBondContact O-N 3.5Å; C432-I502 VanDerWaalsContact SG-CG2 3.52Å; C432-F503 WeakPolarHBondContact CB-O 3.39Å
433	A	94.6	Very high	93.7	Very high	40 Å²	40	50.9 Å²	50.9	33%	0.331	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	148.5	177.4	0	0	0	0	0	111.1	F503	A433-F503 HydrophobicContact CB-CB 4.36Å; A433-F503 HydrophobicContact CB-CD2 4.32Å; A433-F503 PolarHBondContact O-N 3.35Å
434	C	94.7	Very high	93.8	Very high	8 Å²	8	50.4 Å²	50.4	5%	0.054	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	132.9	-178.4	171.3	0	0	0	0	110.6	S436 R437 V442 K501 I502	C434-S436 PolarHBondContact O-N 2.95Å; C434-S436 VanDerWaalsContact O-N 3.12Å; C434-R437 PolarHBondContact O-N 2.8Å; C434-V442 HydrophobicContact CB-CB 4.45Å; C434-V442 HydrophobicContact CB-CG1 4.07Å; C434-V442 HydrophobicContact CB-CG2 3.51Å; C434-K501 VanDerWaalsContact CA-O 3.27Å; C434-K501 WeakPolarHBondContact CA-O 3.5Å; C434-I502 HydrophobicContact CB-CG1 4.49Å
435	D	93.6	Very high	93.9	Very high	78 Å²	78	49.9 Å²	49.9	42%	0.417	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-20.2	-174.4	68.9	-6	0	0	0	114.3	R437 V500 K501 F503	D435-R437 PolarHBondContact O-N 3.27Å; D435-V500 WeakPolarHBondContact OD1-CA 3.41Å; D435-K501 HydrophobicContact CB-CB 4.38Å; D435-K501 PolarHBondContact N-O 3.45Å; D435-K501 PolarHBondContact OD1-N 3.46Å; D435-K501 PolarHBondContact OD2-N 2.74Å; D435-F503 HydrophobicContact CB-CE2 4.2Å
436	S	89.5	Confident	94	Very high	69 Å²	69	48.9 Å²	48.9	48%	0.483	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-5.9	174.6	-66.8	0	0	0	0	113.3	C434 V500	C434-S436 PolarHBondContact O-N 2.95Å; C434-S436 VanDerWaalsContact O-N 3.12Å; S436-V500 WeakPolarHBondContact OG-CG2 3.21Å
437	R	88.1	Confident	94.1	Very high	50 Å²	50	47.6 Å²	47.6	19%	0.189	24%	0.237	C	C	.	.			trans	-115.3	150.1	169.2	-56.3	-159.4	77.2	-157.4	-0.9	110.8	C434 D435 H441 V442 C456 E463	C434-R437 PolarHBondContact O-N 2.8Å; D435-R437 PolarHBondContact O-N 3.27Å; R437-H441 VanDerWaalsContact CD-O 3.26Å; R437-H441 WeakPolarHBondContact CD-O 3.27Å; R437-H441 PolarHBondContact NH1-O 2.83Å; R437-V442 HydrophobicContact CG-CG1 4.08Å; R437-C456 PolarHBondContact NH1-O 3.08Å; R437-E463 IonicContact CZ-OE1 2.78Å; R437-E463 IonicContact CZ-OE2 3.37Å; R437-E463 IonicContact NH1-OE1 3.81Å; R437-E463 PolarHBondContact NH1-OE1 3.11Å; R437-E463 IonicContact NH2-OE1 2.73Å; R437-E463 PolarHBondContact NH2-OE1 3.33Å; R437-E463 IonicContact NH2-OE2 3.72Å; R437-E463 PolarHBondContact NH2-OE2 3.2Å
438	R	82.1	Confident	94	Very high	254 Å²	254	47.2 Å²	47.2	96%	0.958	24%	0.235	S	C	*	.	S	Bend	trans	-100.2	-10.8	175.4	-68.2	-174.7	177.5	-175	-1.5	114
439	K	86.3	Confident	93.9	Very high	168 Å²	168	48 Å²	48	73%	0.73	24%	0.243	S	C	*	.	S	Bend	trans	-161.2	150.8	-178.5	-69.3	-161	170.8	-156.3	0	107.4
440	G	90.8	Very high	93.9	Very high	13 Å²	13	49.3 Å²	49.3	13%	0.134	25%	0.249	C	C	.	.	S	Bend	trans	73.9	162.5	-178.1	0	0	0	0	0	113.2	C456 E458	G440-C456 CarbonylContact C-O 3.57Å; G440-C456 WeakPolarHBondContact CA-O 3.38Å; G440-E458 PolarHBondContact N-OE1 3.03Å
441	H	97.4	Very high	94.1	Very high	42 Å²	42	47.2 Å²	47.2	19%	0.194	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	-178.4	179.5	-76.7	-167.3	0	0	0	111.5	H431 C432 R437 C456	H431-H441 HydrophobicContact CB-CB 4.06Å; H431-H441 AromaticContact CG-ND1 4Å; H431-H441 AromaticContact ND1-ND1 3.27Å; H431-H441 PolarHBondContact ND1-ND1 3.04Å; H431-H441 PolarHBondContact O-ND1 2.88Å; C432-H441 CarbonylContact O-C 3.49Å; C432-H441 VanDerWaalsContact O-CA 3.29Å; C432-H441 WeakPolarHBondContact O-CA 3.28Å; C432-H441 VanDerWaalsContact O-CB 3.24Å; C432-H441 WeakPolarHBondContact O-CB 3.43Å; R437-H441 VanDerWaalsContact CD-O 3.26Å; R437-H441 WeakPolarHBondContact CD-O 3.27Å; R437-H441 PolarHBondContact NH1-O 2.83Å; H441-C456 PolarHBondContact N-O 3.14Å; H441-C456 PolarHBondContact O-N 3.03Å; H441-C456 VanDerWaalsContact O-O 3.12Å
442	V	97.7	Very high	94.2	Very high	5 Å²	5	44.9 Å²	44.9	3%	0.03	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	143	161.8	-65.5	0	0	0	0	109.8	H431 C432 C434 R437 T444 L453 H454	H431-V442 WeakPolarHBondContact CA-O 3.23Å; C432-V442 PolarHBondContact N-O 2.85Å; C432-V442 PolarHBondContact O-N 3.5Å; C434-V442 HydrophobicContact CB-CB 4.45Å; C434-V442 HydrophobicContact CB-CG1 4.07Å; C434-V442 HydrophobicContact CB-CG2 3.51Å; R437-V442 HydrophobicContact CG-CG1 4.08Å; V442-T444 HydrophobicContact CG2-CG2 3.86Å; V442-L453 HydrophobicContact CB-CB 4.45Å; V442-L453 HydrophobicContact CG1-CB 4.3Å; V442-L453 HydrophobicContact CG2-CD2 4.2Å; V442-H454 CarbonylContact C-O 3.58Å; V442-H454 VanDerWaalsContact CA-O 3.26Å; V442-H454 WeakPolarHBondContact CA-O 3.3Å
443	I	97.4	Very high	94.3	Very high	35 Å²	35	44.9 Å²	44.9	18%	0.179	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	128.7	158.2	-76	174.2	0	0	0	106.8	I428 H431 H454 L462	I428-I443 HydrophobicContact CG2-CG2 3.52Å; H431-I443 HydrophobicContact CB-CD1 4.27Å; H431-I443 HydrophobicContact CB-CG1 3.7Å; I443-H454 PolarHBondContact N-O 3.29Å; I443-H454 PolarHBondContact O-N 2.9Å; I443-L462 HydrophobicContact CD1-CD2 3.88Å
444	T	97.8	Very high	94.5	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	136.1	-175.7	74.9	0	0	0	0	110.6	F429 V442 F451 K452 L453 I502 M510	F429-T444 WeakPolarHBondContact CB-OG1 3.42Å; F429-T444 PolarHBondContact N-O 3.46Å; V442-T444 HydrophobicContact CG2-CG2 3.86Å; T444-F451 HydrophobicContact CG2-CZ 4.38Å; T444-K452 VanDerWaalsContact CA-O 3.3Å; T444-K452 WeakPolarHBondContact CA-O 3.41Å; T444-L453 HydrophobicContact CG2-CD2 3.46Å; T444-L453 VanDerWaalsContact CG2-CD2 3.46Å; T444-I502 HydrophobicContact CG2-CD1 4.18Å; T444-I502 HydrophobicContact CG2-CG2 4.11Å; T444-M510 HydrophobicContact CG2-CE 4.27Å; T444-M510 WeakPolarHBondContact OG1-CE 3.36Å
445	A	97.6	Very high	94.6	Very high	8 Å²	8	45.2 Å²	45.2	7%	0.066	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	131.4	-178.3	0	0	0	0	0	111.6	E426 I427 I428 F451 K452	E426-A445 HydrophobicContact CG-CB 3.75Å; I427-A445 WeakPolarHBondContact O-CA 3.34Å; I428-A445 HydrophobicContact CG1-CB 4.18Å; A445-F451 WeakPolarHBondContact O-CD2 3.08Å; A445-K452 HydrophobicContact CB-CB 4.19Å; A445-K452 HydrophobicContact CB-CD 4.4Å; A445-K452 PolarHBondContact N-O 2.84Å; A445-K452 PolarHBondContact O-N 3.26Å
446	I	98.3	Very high	94.8	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	126.2	-175.8	-60.2	171.5	0	0	0	109.3	F362 E426 I427 F429 F451 W471 M510 C513 F514 V517	F362-I446 HydrophobicContact CE1-CG2 3.92Å; F362-I446 HydrophobicContact CZ-CG2 4.36Å; E426-I446 CarbonylContact C-O 3.48Å; E426-I446 VanDerWaalsContact CA-O 3.3Å; E426-I446 WeakPolarHBondContact CA-O 3.41Å; I427-I446 PolarHBondContact N-O 3.39Å; I427-I446 PolarHBondContact O-N 2.91Å; F429-I446 HydrophobicContact CE2-CD1 3.75Å; F429-I446 HydrophobicContact CE2-CG1 4.4Å; F429-I446 HydrophobicContact CZ-CD1 4.23Å; I446-F451 HydrophobicContact CD1-CE2 4.41Å; I446-F451 HydrophobicContact CG1-CD2 3.59Å; I446-F451 HydrophobicContact CG1-CE2 3.75Å; I446-W471 HydrophobicContact CG2-CH2 4.15Å; I446-W471 HydrophobicContact CG2-CZ2 3.98Å; I446-M510 HydrophobicContact CD1-CG 4.03Å; I446-C513 HydrophobicContact CD1-CB 3.44Å; I446-C513 VanDerWaalsContact CD1-CB 3.44Å; I446-C513 HydrophobicContact CG2-CB 4.24Å; I446-F514 HydrophobicContact CD1-CD2 3.84Å; I446-F514 HydrophobicContact CD1-CE2 3.83Å; I446-F514 HydrophobicContact CG1-CD2 4.48Å; I446-F514 HydrophobicContact CG1-CE2 4.13Å; I446-V517 HydrophobicContact CG2-CG2 3.95Å
447	S	97.2	Very high	95.1	Very high	4 Å²	4	40.2 Å²	40.2	3%	0.028	19%	0.188	C	C	.	.			trans	-134.7	175.3	171.3	75.8	0	0	0	0	111.4	T449 H450 W471	S447-T449 PolarHBondContact O-N 3.02Å; S447-T449 PolarHBondContact OG-N 2.65Å; S447-T449 VanDerWaalsContact OG-N 3.14Å; S447-T449 PolarHBondContact OG-OG1 2.75Å; S447-H450 PolarHBondContact N-O 3.44Å; S447-H450 PolarHBondContact OG-CE1 3.49Å; S447-H450 PolarHBondContact OG-N 3.09Å; S447-H450 PolarHBondContact OG-ND1 2.95Å; S447-H450 PolarHBondContact OG-O 3.39Å; S447-W471 WeakPolarHBondContact O-CZ2 3.36Å; S447-W471 PolarHBondContact O-NE1 2.89Å
448	I	95.7	Very high	95.3	Very high	25 Å²	25	43 Å²	43	13%	0.128	20%	0.203	C	C	.	.	S	Bend	trans	-62.3	-19.3	172	-166.8	58.2	0	0	0	113.9	F362 T363 W471 V517 E520 L521	F362-I448 HydrophobicContact CB-CB 3.92Å; F362-I448 HydrophobicContact CB-CD1 4.42Å; T363-I448 HydrophobicContact CG2-CD1 3.58Å; T363-I448 HydrophobicContact CG2-CG1 3.7Å; I448-W471 VanDerWaalsContact O-CD1 3.32Å; I448-W471 PolarHBondContact O-NE1 3.25Å; I448-V517 HydrophobicContact CD1-CG1 4.25Å; I448-E520 HydrophobicContact CD1-CB 4.19Å; I448-L521 HydrophobicContact CD1-CD2 3.68Å; I448-L521 HydrophobicContact CD1-CG 3.81Å; I448-L521 HydrophobicContact CG1-CD2 4.27Å
449	T	93.7	Very high	95.7	Very high	79 Å²	79	37.6 Å²	37.6	49%	0.485	19%	0.188	S	C	.	.	S	Bend	trans	-92.5	-44.3	-178.8	48.9	0	0	0	0	113	S447	S447-T449 PolarHBondContact O-N 3.02Å; S447-T449 PolarHBondContact OG-N 2.65Å; S447-T449 VanDerWaalsContact OG-N 3.14Å; S447-T449 PolarHBondContact OG-OG1 2.75Å
450	H	95.8	Very high	95.9	Very high	32 Å²	32	30.4 Å²	30.4	15%	0.148	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	163.1	-169.1	52.4	32.7	0	0	0	113	E426 S447 K452 F469	E426-H450 IonicContact OE1-CE1 2.68Å; E426-H450 PolarHBondContact OE1-CE1 3.3Å; E426-H450 IonicContact OE1-ND1 3.5Å; S447-H450 PolarHBondContact N-O 3.44Å; S447-H450 PolarHBondContact OG-CE1 3.49Å; S447-H450 PolarHBondContact OG-N 3.09Å; S447-H450 PolarHBondContact OG-ND1 2.95Å; S447-H450 PolarHBondContact OG-O 3.39Å; H450-K452 WeakPolarHBondContact CE1-CE 3.39Å; H450-K452 PolarHBondContact CE1-NZ 2.92Å; H450-K452 VanDerWaalsContact NE2-CE 3.27Å; H450-K452 WeakPolarHBondContact NE2-CE 3.37Å; H450-F469 VanDerWaalsContact CA-O 3.31Å; H450-F469 WeakPolarHBondContact CA-O 3.41Å; H450-F469 WeakPolarHBondContact CB-O 3.33Å
451	F	98	Very high	96.1	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	132.9	158	-179	-128.9	0	0	0	110.4	T444 A445 I446 L453 A468 F469 W471 M474 F488 I502 M510 F514	T444-F451 HydrophobicContact CG2-CZ 4.38Å; A445-F451 WeakPolarHBondContact O-CD2 3.08Å; I446-F451 HydrophobicContact CD1-CE2 4.41Å; I446-F451 HydrophobicContact CG1-CD2 3.59Å; I446-F451 HydrophobicContact CG1-CE2 3.75Å; F451-L453 HydrophobicContact CE1-CD2 3.81Å; F451-L453 HydrophobicContact CE1-CG 4.27Å; F451-L453 HydrophobicContact CZ-CD2 3.72Å; F451-A468 CarbonylContact O-C 3.54Å; F451-A468 WeakPolarHBondContact O-CA 3.34Å; F451-F469 HydrophobicContact CB-CB 4.47Å; F451-F469 AromaticContact CD1-CD2 3.9Å; F451-F469 HydrophobicContact CD1-CD2 3.9Å; F451-F469 HydrophobicContact CD1-CE2 4.43Å; F451-F469 PolarHBondContact N-O 2.89Å; F451-F469 PolarHBondContact O-N 2.83Å; F451-W471 HydrophobicContact CB-CH2 3.94Å; F451-W471 HydrophobicContact CB-CZ2 4.22Å; F451-W471 HydrophobicContact CB-CZ3 4.39Å; F451-M474 HydrophobicContact CB-CE 4.26Å; F451-M474 HydrophobicContact CD1-CE 4.28Å; F451-F488 HydrophobicContact CD1-CE1 4.35Å; F451-F488 HydrophobicContact CD1-CE2 4.45Å; F451-F488 HydrophobicContact CD1-CZ 4.15Å; F451-F488 HydrophobicContact CE1-CD1 4.13Å; F451-F488 AromaticContact CE1-CE1 3.6Å; F451-F488 HydrophobicContact CE1-CE1 3.6Å; F451-F488 HydrophobicContact CE1-CE2 4.45Å; F451-F488 AromaticContact CE1-CZ 3.77Å; F451-F488 HydrophobicContact CE1-CZ 3.77Å; F451-I502 HydrophobicContact CE1-CD1 4.05Å; F451-I502 HydrophobicContact CZ-CD1 3.72Å; F451-M510 HydrophobicContact CZ-SD 4.41Å; F451-F514 HydrophobicContact CB-CZ 4.28Å; F451-F514 HydrophobicContact CD1-CE2 4.42Å; F451-F514 AromaticContact CD1-CZ 3.78Å; F451-F514 HydrophobicContact CD1-CZ 3.78Å; F451-F514 AromaticContact CD2-CE2 3.91Å; F451-F514 HydrophobicContact CD2-CE2 3.91Å; F451-F514 HydrophobicContact CD2-CZ 4.06Å; F451-F514 HydrophobicContact CE1-CZ 4.03Å; F451-F514 HydrophobicContact CE2-CE2 4.01Å; F451-F514 HydrophobicContact CE2-CZ 4.29Å; F451-F514 HydrophobicContact CG-CE2 4.11Å; F451-F514 AromaticContact CG-CZ 3.78Å; F451-F514 HydrophobicContact CG-CZ 3.78Å; F451-F514 HydrophobicContact CZ-CE2 4.31Å; F451-F514 HydrophobicContact CZ-CZ 4.27Å
452	K	97.6	Very high	95.9	Very high	25 Å²	25	39.6 Å²	39.6	11%	0.109	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	141.6	178	-66.8	172.5	-178	152	0	111.8	E422 E426 T444 A445 H450 I467 A468	E422-K452 IonicContact OE1-NZ 3.13Å; E422-K452 PolarHBondContact OE1-NZ 2.91Å; E426-K452 WeakPolarHBondContact OE1-CD 3.38Å; E426-K452 WeakPolarHBondContact OE1-CE 3.42Å; E426-K452 IonicContact OE1-NZ 3.47Å; E426-K452 PolarHBondContact OE1-NZ 3.12Å; E426-K452 IonicContact OE2-NZ 2.76Å; E426-K452 PolarHBondContact OE2-NZ 3.31Å; T444-K452 VanDerWaalsContact CA-O 3.3Å; T444-K452 WeakPolarHBondContact CA-O 3.41Å; A445-K452 HydrophobicContact CB-CB 4.19Å; A445-K452 HydrophobicContact CB-CD 4.4Å; A445-K452 PolarHBondContact N-O 2.84Å; A445-K452 PolarHBondContact O-N 3.26Å; H450-K452 WeakPolarHBondContact CE1-CE 3.39Å; H450-K452 PolarHBondContact CE1-NZ 2.92Å; H450-K452 VanDerWaalsContact NE2-CE 3.27Å; H450-K452 WeakPolarHBondContact NE2-CE 3.37Å; K452-I467 CarbonylContact C-O 3.57Å; K452-I467 WeakPolarHBondContact CA-O 3.25Å; K452-A468 HydrophobicContact CG-CB 4.37Å
453	L	97.7	Very high	95.9	Very high	7 Å²	7	42.4 Å²	42.4	4%	0.037	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	110.4	159.3	-58.2	179.8	0	0	0	108.9	V442 T444 F451 V466 I467 F469 F488 V500 I502	V442-L453 HydrophobicContact CB-CB 4.45Å; V442-L453 HydrophobicContact CG1-CB 4.3Å; V442-L453 HydrophobicContact CG2-CD2 4.2Å; T444-L453 HydrophobicContact CG2-CD2 3.46Å; T444-L453 VanDerWaalsContact CG2-CD2 3.46Å; F451-L453 HydrophobicContact CE1-CD2 3.81Å; F451-L453 HydrophobicContact CE1-CG 4.27Å; F451-L453 HydrophobicContact CZ-CD2 3.72Å; L453-V466 WeakPolarHBondContact O-CA 3.3Å; L453-I467 PolarHBondContact N-O 2.99Å; L453-I467 PolarHBondContact O-N 3.39Å; L453-F469 HydrophobicContact CD1-CE2 3.87Å; L453-F469 HydrophobicContact CD1-CZ 4.33Å; L453-F469 HydrophobicContact CG-CE2 3.98Å; L453-F488 HydrophobicContact CD1-CZ 4.25Å; L453-V500 HydrophobicContact CD1-CG1 4.39Å; L453-I502 HydrophobicContact CD2-CD1 3.96Å; L453-I502 HydrophobicContact CD2-CG1 4.42Å
454	H	97.4	Very high	95.7	Very high	53 Å²	53	49.1 Å²	49.1	25%	0.245	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	116	173.3	-162.1	148.6	0	0	0	108.4	V442 I443 E463 V466	V442-H454 CarbonylContact C-O 3.58Å; V442-H454 VanDerWaalsContact CA-O 3.26Å; V442-H454 WeakPolarHBondContact CA-O 3.3Å; I443-H454 PolarHBondContact N-O 3.29Å; I443-H454 PolarHBondContact O-N 2.9Å; H454-E463 PolarHBondContact CD2-O 3.46Å; H454-E463 PolarHBondContact NE2-O 2.8Å; H454-V466 HydrophobicContact CB-CG2 4.4Å
455	A	97.6	Very high	95.6	Very high	3 Å²	3	54.2 Å²	54.2	3%	0.025	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	140.7	175.3	0	0	0	0	0	111.8	E463 Q465	A455-E463 HydrophobicContact CB-CB 4.02Å; A455-E463 WeakPolarHBondContact O-CB 3.35Å; A455-E463 PolarHBondContact O-N 2.86Å; A455-Q465 HydrophobicContact CB-CB 3.87Å; A455-Q465 HydrophobicContact CB-CG 4.48Å; A455-Q465 VanDerWaalsContact CB-O 3.28Å; A455-Q465 WeakPolarHBondContact CB-O 3.45Å; A455-Q465 PolarHBondContact N-O 3.27Å
456	C	96.8	Very high	95.6	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	165.3	176.2	56	0	0	0	0	111.9	R437 G440 H441 Q461 L462 E463	R437-C456 PolarHBondContact NH1-O 3.08Å; G440-C456 CarbonylContact C-O 3.57Å; G440-C456 WeakPolarHBondContact CA-O 3.38Å; H441-C456 PolarHBondContact N-O 3.14Å; H441-C456 PolarHBondContact O-N 3.03Å; H441-C456 VanDerWaalsContact O-O 3.12Å; C456-Q461 CarbonylContact C-O 3.56Å; C456-Q461 WeakPolarHBondContact CA-O 3.34Å; C456-Q461 WeakPolarHBondContact CB-O 3.36Å; C456-L462 HydrophobicContact CB-CD2 4.48Å; C456-E463 VanDerWaalsContact C-OE1 3.31Å
457	T	95.9	Very high	95.4	Very high	41 Å²	41	60.2 Å²	60.2	25%	0.252	31%	0.31	S	S	.	.			trans	-66	172	171.6	71.7	0	0	0	0	111.2	E459 G460 Q461	T457-E459 WeakPolarHBondContact CB-OE2 3.2Å; T457-E459 PolarHBondContact O-N 2.95Å; T457-E459 PolarHBondContact OG1-OE2 3.19Å; T457-G460 WeakPolarHBondContact O-CA 3.46Å; T457-G460 PolarHBondContact O-N 3.34Å; T457-G460 PolarHBondContact OG1-N 2.9Å; T457-Q461 HydrophobicContact CG2-CB 4.01Å; T457-Q461 PolarHBondContact N-O 3.47Å; T457-Q461 WeakPolarHBondContact OG1-CB 3.47Å; T457-Q461 PolarHBondContact OG1-N 2.93Å
458	E	92.3	Very high	95.4	Very high	110 Å²	110	61.7 Å²	61.7	51%	0.514	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-20.3	-177.3	-58.9	178.5	-172.4	0	0	110.7	H431 G440	H431-E458 PolarHBondContact CE1-O 3.49Å; H431-E458 PolarHBondContact ND1-O 2.69Å; G440-E458 PolarHBondContact N-OE1 3.03Å
459	E	90.2	Very high	95.4	Very high	139 Å²	139	60.7 Å²	60.7	65%	0.65	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	5.4	168.6	-36.3	76.1	-173.3	0	0	113.7	T457	T457-E459 WeakPolarHBondContact CB-OE2 3.2Å; T457-E459 PolarHBondContact O-N 2.95Å; T457-E459 PolarHBondContact OG1-OE2 3.19Å
460	G	91	Very high	95.5	Very high	17 Å²	17	61.5 Å²	61.5	18%	0.175	32%	0.316	C	S	.	.			trans	85.3	10.5	173.2	0	0	0	0	0	116.6	H431 T457 L462	H431-G460 PolarHBondContact ND1-N 2.94Å; T457-G460 WeakPolarHBondContact O-CA 3.46Å; T457-G460 PolarHBondContact O-N 3.34Å; T457-G460 PolarHBondContact OG1-N 2.9Å; G460-L462 PolarHBondContact O-N 3.48Å
461	Q	95.1	Very high	95.5	Very high	138 Å²	138	60.9 Å²	60.9	65%	0.645	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-72.2	126.4	176.3	-57.8	-171.1	7.4	0	0	110.9	C456 T457	C456-Q461 CarbonylContact C-O 3.56Å; C456-Q461 WeakPolarHBondContact CA-O 3.34Å; C456-Q461 WeakPolarHBondContact CB-O 3.36Å; T457-Q461 HydrophobicContact CG2-CB 4.01Å; T457-Q461 PolarHBondContact N-O 3.47Å; T457-Q461 WeakPolarHBondContact OG1-CB 3.47Å; T457-Q461 PolarHBondContact OG1-N 2.93Å
462	L	94.4	Very high	95.2	Very high	110 Å²	110	67.1 Å²	67.1	58%	0.576	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.9	134.6	-173.8	-63	178.1	0	0	0	113.2	I443 C456 G460	I443-L462 HydrophobicContact CD1-CD2 3.88Å; C456-L462 HydrophobicContact CB-CD2 4.48Å; G460-L462 PolarHBondContact O-N 3.48Å
463	E	95.8	Very high	95.1	Very high	65 Å²	65	67.1 Å²	67.1	30%	0.304	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	171.3	169.7	-64.7	175.2	-128.6	0	0	111.2	R437 H454 A455 C456 Q465	R437-E463 IonicContact CZ-OE1 2.78Å; R437-E463 IonicContact CZ-OE2 3.37Å; R437-E463 IonicContact NH1-OE1 3.81Å; R437-E463 PolarHBondContact NH1-OE1 3.11Å; R437-E463 IonicContact NH2-OE1 2.73Å; R437-E463 PolarHBondContact NH2-OE1 3.33Å; R437-E463 IonicContact NH2-OE2 3.72Å; R437-E463 PolarHBondContact NH2-OE2 3.2Å; H454-E463 PolarHBondContact CD2-O 3.46Å; H454-E463 PolarHBondContact NE2-O 2.8Å; A455-E463 HydrophobicContact CB-CB 4.02Å; A455-E463 WeakPolarHBondContact O-CB 3.35Å; A455-E463 PolarHBondContact O-N 2.86Å; C456-E463 VanDerWaalsContact C-OE1 3.31Å; E463-Q465 VanDerWaalsContact C-N 3.27Å; E463-Q465 PolarHBondContact O-N 3.27Å
464	N	94.6	Very high	95	Very high	175 Å²	175	67.4 Å²	67.4	94%	0.936	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.5	-8.7	179.1	-68.5	-29.2	0	0	0	114.4
465	Q	96.1	Very high	94.9	Very high	108 Å²	108	69.4 Å²	69.4	51%	0.505	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	114.6	-176.2	-177.1	177.9	16.5	0	0	111.1	A455 E463	A455-Q465 HydrophobicContact CB-CB 3.87Å; A455-Q465 HydrophobicContact CB-CG 4.48Å; A455-Q465 VanDerWaalsContact CB-O 3.28Å; A455-Q465 WeakPolarHBondContact CB-O 3.45Å; A455-Q465 PolarHBondContact N-O 3.27Å; E463-Q465 VanDerWaalsContact C-N 3.27Å; E463-Q465 PolarHBondContact O-N 3.27Å
466	V	95.9	Very high	94.8	Very high	71 Å²	71	77 Å²	77	43%	0.43	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	136.1	170	-171.5	0	0	0	0	109.2	L453 H454	L453-V466 WeakPolarHBondContact O-CA 3.3Å; H454-V466 HydrophobicContact CB-CG2 4.4Å
467	I	95.4	Very high	94.8	Very high	62 Å²	62	79.5 Å²	79.5	32%	0.318	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	112.4	170.6	-54.6	177.2	0	0	0	107.3	K452 L453 F469	K452-I467 CarbonylContact C-O 3.57Å; K452-I467 WeakPolarHBondContact CA-O 3.25Å; L453-I467 PolarHBondContact N-O 2.99Å; L453-I467 PolarHBondContact O-N 3.39Å; I467-F469 HydrophobicContact CB-CE2 4.43Å; I467-F469 HydrophobicContact CG2-CD2 4.44Å; I467-F469 HydrophobicContact CG2-CE1 4.04Å; I467-F469 HydrophobicContact CG2-CE2 3.77Å; I467-F469 HydrophobicContact CG2-CZ 3.55Å
468	A	96.3	Very high	94.9	Very high	36 Å²	36	82 Å²	82	30%	0.298	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	148.9	166.8	0	0	0	0	0	110.3	F451 K452 R492	F451-A468 CarbonylContact O-C 3.54Å; F451-A468 WeakPolarHBondContact O-CA 3.34Å; K452-A468 HydrophobicContact CG-CB 4.37Å; A468-R492 PolarHBondContact O-NH2 3.25Å
469	F	96.5	Very high	95.1	Very high	4 Å²	4	78.7 Å²	78.7	2%	0.018	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	129.6	171.9	-55.8	-87	0	0	0	108.1	H450 F451 L453 I467 E473 M474 F488 Y490	H450-F469 VanDerWaalsContact CA-O 3.31Å; H450-F469 WeakPolarHBondContact CA-O 3.41Å; H450-F469 WeakPolarHBondContact CB-O 3.33Å; F451-F469 HydrophobicContact CB-CB 4.47Å; F451-F469 AromaticContact CD1-CD2 3.9Å; F451-F469 HydrophobicContact CD1-CD2 3.9Å; F451-F469 HydrophobicContact CD1-CE2 4.43Å; F451-F469 PolarHBondContact N-O 2.89Å; F451-F469 PolarHBondContact O-N 2.83Å; L453-F469 HydrophobicContact CD1-CE2 3.87Å; L453-F469 HydrophobicContact CD1-CZ 4.33Å; L453-F469 HydrophobicContact CG-CE2 3.98Å; I467-F469 HydrophobicContact CB-CE2 4.43Å; I467-F469 HydrophobicContact CG2-CD2 4.44Å; I467-F469 HydrophobicContact CG2-CE1 4.04Å; I467-F469 HydrophobicContact CG2-CE2 3.77Å; I467-F469 HydrophobicContact CG2-CZ 3.55Å; F469-E473 WeakPolarHBondContact CA-OE2 3.36Å; F469-M474 HydrophobicContact CB-CE 4.2Å; F469-F488 HydrophobicContact CD1-CE2 4.42Å; F469-F488 HydrophobicContact CD2-CE2 4.31Å; F469-F488 HydrophobicContact CD2-CZ 4.38Å; F469-F488 HydrophobicContact CE1-CE2 4.18Å; F469-F488 HydrophobicContact CE2-CE2 4.07Å; F469-F488 AromaticContact CE2-CZ 3.84Å; F469-F488 HydrophobicContact CE2-CZ 3.84Å; F469-F488 HydrophobicContact CG-CE2 4.47Å; F469-F488 AromaticContact CZ-CE2 3.99Å; F469-F488 HydrophobicContact CZ-CE2 3.99Å; F469-F488 AromaticContact CZ-CZ 3.95Å; F469-F488 HydrophobicContact CZ-CZ 3.95Å; F469-Y490 HydrophobicContact CD1-CD1 4.21Å; F469-Y490 AromaticContact CD1-CD2 3.83Å; F469-Y490 HydrophobicContact CD1-CD2 3.83Å; F469-Y490 HydrophobicContact CD1-CE2 4.28Å; F469-Y490 AromaticContact CD1-CG 3.8Å; F469-Y490 HydrophobicContact CD1-CG 3.8Å; F469-Y490 AromaticContact CE1-CD1 3.66Å; F469-Y490 HydrophobicContact CE1-CD1 3.66Å; F469-Y490 AromaticContact CE1-CD2 3.7Å; F469-Y490 HydrophobicContact CE1-CD2 3.7Å; F469-Y490 AromaticContact CE1-CE1 3.68Å; F469-Y490 HydrophobicContact CE1-CE1 3.68Å; F469-Y490 AromaticContact CE1-CE2 3.73Å; F469-Y490 HydrophobicContact CE1-CE2 3.73Å; F469-Y490 AromaticContact CE1-CG 3.67Å; F469-Y490 HydrophobicContact CE1-CG 3.67Å; F469-Y490 AromaticContact CE1-CZ 3.72Å; F469-Y490 HydrophobicContact CZ-CD1 4.4Å; F469-Y490 HydrophobicContact CZ-CE1 4.25Å
470	E	95.2	Very high	95.1	Very high	95 Å²	95	73.8 Å²	73.8	44%	0.444	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	153	173.3	-58.5	-62.3	131.1	0	0	109.6	D472 E473	E470-D472 VanDerWaalsContact CB-OD1 3.26Å; E470-D472 WeakPolarHBondContact CB-OD1 3.33Å; E470-D472 PolarHBondContact O-N 2.99Å; E470-E473 HydrophobicContact CB-CG 4.32Å; E470-E473 PolarHBondContact N-OE2 2.81Å; E470-E473 WeakPolarHBondContact O-CB 3.48Å; E470-E473 PolarHBondContact O-N 2.97Å; E470-E473 VanDerWaalsContact O-N 3.12Å
471	W	95.3	Very high	94.9	Very high	19 Å²	19	79.5 Å²	79.5	7%	0.072	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-11.5	-172.7	-68.1	117.5	0	0	0	115	I446 S447 I448 F451 M474 F514 V517 F518 L521	I446-W471 HydrophobicContact CG2-CH2 4.15Å; I446-W471 HydrophobicContact CG2-CZ2 3.98Å; S447-W471 WeakPolarHBondContact O-CZ2 3.36Å; S447-W471 PolarHBondContact O-NE1 2.89Å; I448-W471 VanDerWaalsContact O-CD1 3.32Å; I448-W471 PolarHBondContact O-NE1 3.25Å; F451-W471 HydrophobicContact CB-CH2 3.94Å; F451-W471 HydrophobicContact CB-CZ2 4.22Å; F451-W471 HydrophobicContact CB-CZ3 4.39Å; W471-M474 HydrophobicContact CE3-CB 4.42Å; W471-M474 HydrophobicContact CE3-CE 4.39Å; W471-M474 HydrophobicContact CZ3-CE 4.13Å; W471-F514 HydrophobicContact CH2-CD1 4.26Å; W471-F514 HydrophobicContact CH2-CD2 4.14Å; W471-F514 HydrophobicContact CH2-CE1 4.17Å; W471-F514 HydrophobicContact CH2-CE2 4.01Å; W471-F514 HydrophobicContact CH2-CG 4.25Å; W471-F514 HydrophobicContact CH2-CZ 4.03Å; W471-F514 AromaticContact CZ3-CD1 3.78Å; W471-F514 HydrophobicContact CZ3-CD1 3.78Å; W471-F514 HydrophobicContact CZ3-CD2 4.47Å; W471-F514 AromaticContact CZ3-CE1 3.69Å; W471-F514 HydrophobicContact CZ3-CE1 3.69Å; W471-F514 HydrophobicContact CZ3-CE2 4.37Å; W471-F514 HydrophobicContact CZ3-CG 4.18Å; W471-F514 AromaticContact CZ3-CZ 3.99Å; W471-F514 HydrophobicContact CZ3-CZ 3.99Å; W471-V517 HydrophobicContact CD2-CG1 4.02Å; W471-V517 HydrophobicContact CG-CG1 4.41Å; W471-V517 HydrophobicContact CH2-CG1 4.38Å; W471-V517 HydrophobicContact CZ2-CB 4.31Å; W471-V517 HydrophobicContact CZ2-CG1 3.75Å; W471-V517 HydrophobicContact CZ2-CG2 4.42Å; W471-F518 HydrophobicContact CB-CZ 4.49Å; W471-F518 HydrophobicContact CD2-CE2 4.38Å; W471-F518 HydrophobicContact CE3-CD2 4.27Å; W471-F518 AromaticContact CE3-CE2 3.43Å; W471-F518 HydrophobicContact CE3-CE2 3.43Å; W471-F518 VanDerWaalsContact CE3-CE2 3.43Å; W471-F518 AromaticContact CE3-CZ 3.96Å; W471-F518 HydrophobicContact CE3-CZ 3.96Å; W471-F518 HydrophobicContact CZ3-CD2 4.43Å; W471-F518 AromaticContact CZ3-CE2 3.8Å; W471-F518 HydrophobicContact CZ3-CE2 3.8Å; W471-L521 HydrophobicContact CB-CD1 3.7Å; W471-L521 HydrophobicContact CD2-CD1 4.44Å; W471-L521 HydrophobicContact CG-CD1 3.72Å
472	D	93	Very high	94.4	Very high	131 Å²	131	82.2 Å²	82.2	70%	0.701	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-21.6	171.6	67.4	-34.3	0	0	0	113.3	E470 M474	E470-D472 VanDerWaalsContact CB-OD1 3.26Å; E470-D472 WeakPolarHBondContact CB-OD1 3.33Å; E470-D472 PolarHBondContact O-N 2.99Å; D472-M474 VanDerWaalsContact C-N 3.29Å
473	E	94.9	Very high	93.8	Very high	26 Å²	26	78.4 Å²	78.4	12%	0.121	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-26.5	171.8	-58.2	-169.9	118.7	0	0	112.1	F469 E470 Q475 Y490 A491 R492	F469-E473 WeakPolarHBondContact CA-OE2 3.36Å; E470-E473 HydrophobicContact CB-CG 4.32Å; E470-E473 PolarHBondContact N-OE2 2.81Å; E470-E473 WeakPolarHBondContact O-CB 3.48Å; E470-E473 PolarHBondContact O-N 2.97Å; E470-E473 VanDerWaalsContact O-N 3.12Å; E473-Q475 PolarHBondContact O-N 3.34Å; E473-Q475 PolarHBondContact O-NE2 2.75Å; E473-Y490 CarbonylContact O-C 3.55Å; E473-Y490 WeakPolarHBondContact O-CA 3.36Å; E473-A491 WeakPolarHBondContact CA-O 3.49Å; E473-A491 VanDerWaalsContact CB-O 3.32Å; E473-A491 WeakPolarHBondContact CB-O 3.04Å; E473-A491 PolarHBondContact O-N 2.74Å; E473-R492 VanDerWaalsContact OE1-CB 3.31Å; E473-R492 WeakPolarHBondContact OE1-CB 3.12Å; E473-R492 WeakPolarHBondContact OE1-CD 3.23Å; E473-R492 WeakPolarHBondContact OE1-CG 3.18Å; E473-R492 IonicContact OE1-CZ 2.72Å; E473-R492 IonicContact OE1-NE 3.36Å; E473-R492 PolarHBondContact OE1-NE 2.82Å; E473-R492 IonicContact OE1-NH2 3.25Å; E473-R492 PolarHBondContact OE1-NH2 3.42Å; E473-R492 IonicContact OE2-CZ 3.45Å; E473-R492 IonicContact OE2-NE 3.4Å; E473-R492 PolarHBondContact OE2-NE 3.1Å; E473-R492 IonicContact OE2-NH2 3.27Å; E473-R492 PolarHBondContact OE2-NH2 2.6Å
474	M	95.8	Very high	93.5	Very high	12 Å²	12	79.9 Å²	79.9	6%	0.059	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	118.3	-175.5	-158.2	67.2	67.3	0	0	111.2	F451 F469 W471 D472 W477 F488 F514 F518	F451-M474 HydrophobicContact CB-CE 4.26Å; F451-M474 HydrophobicContact CD1-CE 4.28Å; F469-M474 HydrophobicContact CB-CE 4.2Å; W471-M474 HydrophobicContact CE3-CB 4.42Å; W471-M474 HydrophobicContact CE3-CE 4.39Å; W471-M474 HydrophobicContact CZ3-CE 4.13Å; D472-M474 VanDerWaalsContact C-N 3.29Å; M474-W477 HydrophobicContact CG-CE3 3.73Å; M474-W477 HydrophobicContact CG-CZ3 3.88Å; M474-F488 HydrophobicContact CE-CD2 3.99Å; M474-F488 HydrophobicContact CE-CE2 4.36Å; M474-F488 HydrophobicContact SD-CB 3.95Å; M474-F488 HydrophobicContact SD-CD2 3.5Å; M474-F488 WeakPolarHBondContact SD-CD2 3.49Å; M474-F488 HydrophobicContact SD-CE2 4.37Å; M474-F488 HydrophobicContact SD-CG 4.08Å; M474-F514 HydrophobicContact CE-CE1 3.71Å; M474-F514 HydrophobicContact CE-CZ 4.07Å; M474-F514 HydrophobicContact CG-CE1 4.18Å; M474-F514 HydrophobicContact SD-CE1 3.86Å; M474-F518 HydrophobicContact CB-CE2 4.41Å; M474-F518 HydrophobicContact CB-CZ 4.07Å; M474-F518 HydrophobicContact CG-CE2 4.28Å; M474-F518 HydrophobicContact CG-CZ 4.37Å
475	Q	94.6	Very high	93.5	Very high	95 Å²	95	71.6 Å²	71.6	44%	0.444	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	-43.9	-175.4	-55.7	-56.3	-68.4	0	0	112.4	E473 E489 A491	E473-Q475 PolarHBondContact O-N 3.34Å; E473-Q475 PolarHBondContact O-NE2 2.75Å; Q475-E489 HydrophobicContact CB-CB 4.45Å; Q475-E489 HydrophobicContact CB-CG 4.34Å; Q475-E489 WeakPolarHBondContact CB-O 3.42Å; Q475-E489 PolarHBondContact N-O 3.26Å; Q475-A491 HydrophobicContact CG-CB 3.93Å
476	R	95.9	Very high	93.6	Very high	163 Å²	163	66.4 Å²	66.4	62%	0.615	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-153.7	157.6	-175.7	-57.2	-176	-179.6	-177	-0.3	110.7	F488 E489 W499	R476-F488 CarbonylContact O-C 3.57Å; R476-F488 WeakPolarHBondContact O-CA 3.35Å; R476-E489 HydrophobicContact CB-CB 4.1Å; R476-E489 WeakPolarHBondContact CD-OE2 3.4Å; R476-E489 PolarHBondContact N-O 2.74Å; R476-E489 IonicContact NE-OE2 2.82Å; R476-E489 PolarHBondContact O-N 2.85Å; R476-W499 HydrophobicContact CB-CH2 4.02Å; R476-W499 HydrophobicContact CB-CZ2 4.28Å
477	W	97.8	Very high	93.7	Very high	52 Å²	52	63.5 Å²	63.5	20%	0.197	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	156.2	166.4	49.7	90.5	0	0	0	109.1	M474 F486 C487 F488 H511 F514 E515 F518	M474-W477 HydrophobicContact CG-CE3 3.73Å; M474-W477 HydrophobicContact CG-CZ3 3.88Å; W477-F486 HydrophobicContact CB-CE2 3.94Å; W477-F486 HydrophobicContact CB-CZ 3.6Å; W477-F486 HydrophobicContact CG-CE2 4.5Å; W477-F486 HydrophobicContact CG-CZ 4.25Å; W477-C487 CarbonylContact C-O 3.46Å; W477-C487 WeakPolarHBondContact CA-O 3.43Å; W477-F488 HydrophobicContact CB-CB 4.23Å; W477-H511 AromaticContact CD1-CD2 3.78Å; W477-H511 AromaticContact CD1-NE2 3.66Å; W477-F514 HydrophobicContact CB-CD1 4.12Å; W477-F514 HydrophobicContact CD2-CB 4.44Å; W477-F514 AromaticContact CD2-CD1 3.84Å; W477-F514 HydrophobicContact CD2-CD1 3.84Å; W477-F514 HydrophobicContact CE3-CD1 4.06Å; W477-F514 HydrophobicContact CG-CB 4.34Å; W477-F514 AromaticContact CG-CD1 3.85Å; W477-F514 HydrophobicContact CG-CD1 3.85Å; W477-F514 HydrophobicContact CG-CG 4.47Å; W477-E515 WeakPolarHBondContact CZ2-OE1 3.31Å; W477-E515 PolarHBondContact NE1-OE1 3.21Å; W477-F518 HydrophobicContact CE3-CE2 4.12Å; W477-F518 HydrophobicContact CH2-CB 4.36Å; W477-F518 AromaticContact CH2-CD1 3.81Å; W477-F518 HydrophobicContact CH2-CD1 3.81Å; W477-F518 AromaticContact CH2-CD2 3.26Å; W477-F518 HydrophobicContact CH2-CD2 3.26Å; W477-F518 AromaticContact CH2-CE1 3.85Å; W477-F518 HydrophobicContact CH2-CE1 3.85Å; W477-F518 AromaticContact CH2-CE2 3.29Å; W477-F518 HydrophobicContact CH2-CE2 3.29Å; W477-F518 AromaticContact CH2-CG 3.53Å; W477-F518 HydrophobicContact CH2-CG 3.53Å; W477-F518 AromaticContact CH2-CZ 3.61Å; W477-F518 HydrophobicContact CH2-CZ 3.61Å; W477-F518 HydrophobicContact CZ2-CB 4.29Å; W477-F518 AromaticContact CZ2-CD2 3.62Å; W477-F518 HydrophobicContact CZ2-CD2 3.62Å; W477-F518 HydrophobicContact CZ2-CE2 4.06Å; W477-F518 AromaticContact CZ2-CG 3.9Å; W477-F518 HydrophobicContact CZ2-CG 3.9Å; W477-F518 AromaticContact CZ3-CD2 3.79Å; W477-F518 HydrophobicContact CZ3-CD2 3.79Å; W477-F518 HydrophobicContact CZ3-CE1 4.21Å; W477-F518 AromaticContact CZ3-CE2 3.32Å; W477-F518 HydrophobicContact CZ3-CE2 3.32Å; W477-F518 HydrophobicContact CZ3-CG 4.4Å; W477-F518 AromaticContact CZ3-CZ 3.57Å; W477-F518 HydrophobicContact CZ3-CZ 3.57Å
478	D	97.3	Very high	93.8	Very high	95 Å²	95	60.6 Å²	60.6	51%	0.508	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	172.1	179.7	-150.2	-15.1	0	0	0	110	C487	D478-C487 PolarHBondContact N-O 2.94Å; D478-C487 PolarHBondContact O-N 3.04Å
479	T	95.5	Very high	93.9	Very high	39 Å²	39	60.4 Å²	60.4	24%	0.239	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	143.6	174.8	54.9	0	0	0	0	112.5	F486 F507 N508 H511	T479-F486 HydrophobicContact CG2-CD2 4.44Å; T479-F507 HydrophobicContact CG2-CD2 3.72Å; T479-F507 HydrophobicContact CG2-CE2 4.33Å; T479-N508 WeakPolarHBondContact CG2-OD1 3.25Å; T479-H511 HydrophobicContact CG2-CB 3.76Å
480	D	91.8	Very high	93.9	Very high	37 Å²	37	62.2 Å²	62.2	20%	0.198	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	92.5	177.4	179.2	-2	0	0	0	107.7	G483 M484 A485 K501	D480-G483 CarbonylContact O-C 3.52Å; D480-G483 PolarHBondContact O-N 3.05Å; D480-G483 PolarHBondContact OD1-N 2.83Å; D480-M484 WeakPolarHBondContact O-CA 3.46Å; D480-M484 PolarHBondContact O-N 2.95Å; D480-A485 HydrophobicContact CB-CB 4.25Å; D480-A485 PolarHBondContact N-O 2.78Å; D480-A485 PolarHBondContact O-N 2.91Å; D480-K501 IonicContact OD2-NZ 2.77Å; D480-K501 PolarHBondContact OD2-NZ 3.27Å
481	E	86.3	Confident	93.9	Very high	136 Å²	136	58.7 Å²	58.7	64%	0.636	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-35.9	-176	-62.5	-162.5	141.6	0	0	112.3	M484 F507	E481-M484 PolarHBondContact O-N 2.94Å; E481-F507 HydrophobicContact CG-CE2 4.06Å; E481-F507 HydrophobicContact CG-CZ 4.22Å
482	E	85	Confident	93.8	Very high	196 Å²	196	62.6 Å²	62.6	92%	0.916	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-40.1	176.4	-65.6	-171.9	173.8	0	0	111.3	M484	E482-M484 VanDerWaalsContact C-N 3.33Å
483	G	81.1	Confident	93.5	Very high	29 Å²	29	59.8 Å²	59.8	30%	0.299	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-4.5	175.6	0	0	0	0	0	115.1	D480 A485	D480-G483 CarbonylContact O-C 3.52Å; D480-G483 PolarHBondContact O-N 3.05Å; D480-G483 PolarHBondContact OD1-N 2.83Å; G483-A485 PolarHBondContact O-N 2.92Å
484	M	90.1	Very high	93.1	Very high	97 Å²	97	68.5 Å²	68.5	48%	0.478	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.4	44.8	-172	-64.8	-72.2	-69.3	0	0	112.5	D480 E481 E482 T504 P505 F507	D480-M484 WeakPolarHBondContact O-CA 3.46Å; D480-M484 PolarHBondContact O-N 2.95Å; E481-M484 PolarHBondContact O-N 2.94Å; E482-M484 VanDerWaalsContact C-N 3.33Å; M484-T504 CarbonylContact O-C 3.58Å; M484-T504 PolarHBondContact O-N 3.43Å; M484-T504 VanDerWaalsContact O-O 3.11Å; M484-P505 HydrophobicContact CE-CB 4.39Å; M484-F507 HydrophobicContact CB-CE1 4.49Å; M484-F507 HydrophobicContact CE-CE1 3.93Å; M484-F507 HydrophobicContact SD-CE1 3.7Å; M484-F507 HydrophobicContact SD-CZ 4.38Å
485	A	94.2	Very high	92.7	Very high	0 Å²	0	74.7 Å²	74.7	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	146	-168	0	0	0	0	0	114.4	D480 G483 I502 F503 F507	D480-A485 HydrophobicContact CB-CB 4.25Å; D480-A485 PolarHBondContact N-O 2.78Å; D480-A485 PolarHBondContact O-N 2.91Å; G483-A485 PolarHBondContact O-N 2.92Å; A485-I502 CarbonylContact C-O 3.56Å; A485-I502 WeakPolarHBondContact CA-O 3.42Å; A485-I502 WeakPolarHBondContact CB-O 3.47Å; A485-F503 HydrophobicContact CB-CD1 3.76Å; A485-F503 HydrophobicContact CB-CE1 4.13Å; A485-F503 HydrophobicContact CB-CG 4.36Å; A485-F507 VanDerWaalsContact C-CB 3.46Å
486	F	98.2	Very high	92.6	Very high	0 Å²	0	79.1 Å²	79.1	0%	0	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	131.2	164.9	179.1	-104.7	0	0	0	109.1	W477 T479 F488 I502 F507 M510 H511 F514	W477-F486 HydrophobicContact CB-CE2 3.94Å; W477-F486 HydrophobicContact CB-CZ 3.6Å; W477-F486 HydrophobicContact CG-CE2 4.5Å; W477-F486 HydrophobicContact CG-CZ 4.25Å; T479-F486 HydrophobicContact CG2-CD2 4.44Å; F486-F488 HydrophobicContact CD1-CD1 4.39Å; F486-F488 HydrophobicContact CE1-CB 4.1Å; F486-F488 HydrophobicContact CE1-CD1 4.16Å; F486-I502 HydrophobicContact CD1-CD1 4.22Å; F486-I502 PolarHBondContact N-O 2.82Å; F486-I502 PolarHBondContact O-N 2.82Å; F486-F507 HydrophobicContact CB-CB 4.03Å; F486-M510 HydrophobicContact CB-CB 4.2Å; F486-M510 HydrophobicContact CB-CG 4.24Å; F486-M510 HydrophobicContact CB-SD 3.75Å; F486-M510 HydrophobicContact CD1-CB 4.42Å; F486-M510 HydrophobicContact CD1-CG 3.69Å; F486-M510 HydrophobicContact CD1-SD 3.38Å; F486-M510 WeakPolarHBondContact CD1-SD 3.46Å; F486-M510 HydrophobicContact CD2-CB 4.19Å; F486-M510 HydrophobicContact CD2-CG 4.25Å; F486-M510 HydrophobicContact CE1-CG 4.07Å; F486-M510 HydrophobicContact CE1-SD 4.16Å; F486-M510 HydrophobicContact CG-CB 4.01Å; F486-M510 HydrophobicContact CG-CG 3.79Å; F486-M510 HydrophobicContact CG-SD 3.7Å; F486-M510 HydrophobicContact CZ-CG 4.49Å; F486-H511 HydrophobicContact CD2-CB 4.06Å; F486-H511 HydrophobicContact CE2-CB 3.89Å; F486-F514 HydrophobicContact CE1-CD1 4.28Å; F486-F514 HydrophobicContact CE1-CD2 4.08Å; F486-F514 AromaticContact CE1-CE1 3.87Å; F486-F514 HydrophobicContact CE1-CE1 3.87Å; F486-F514 AromaticContact CE1-CE2 3.68Å; F486-F514 HydrophobicContact CE1-CE2 3.68Å; F486-F514 HydrophobicContact CE1-CG 4.38Å; F486-F514 AromaticContact CE1-CZ 3.56Å; F486-F514 HydrophobicContact CE1-CZ 3.56Å; F486-F514 HydrophobicContact CZ-CB 4.39Å; F486-F514 AromaticContact CZ-CD1 3.67Å; F486-F514 HydrophobicContact CZ-CD1 3.67Å; F486-F514 AromaticContact CZ-CD2 3.73Å; F486-F514 HydrophobicContact CZ-CD2 3.73Å; F486-F514 AromaticContact CZ-CE1 3.73Å; F486-F514 HydrophobicContact CZ-CE1 3.73Å; F486-F514 AromaticContact CZ-CE2 3.82Å; F486-F514 HydrophobicContact CZ-CE2 3.82Å; F486-F514 AromaticContact CZ-CG 3.68Å; F486-F514 HydrophobicContact CZ-CG 3.68Å; F486-F514 AromaticContact CZ-CZ 3.82Å; F486-F514 HydrophobicContact CZ-CZ 3.82Å
487	C	97.9	Very high	92.6	Very high	10 Å²	10	74.6 Å²	74.6	7%	0.068	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	134	-175.3	-59.9	0	0	0	0	109.8	W477 D478 W499 V500 K501	W477-C487 CarbonylContact C-O 3.46Å; W477-C487 WeakPolarHBondContact CA-O 3.43Å; D478-C487 PolarHBondContact N-O 2.94Å; D478-C487 PolarHBondContact O-N 3.04Å; C487-W499 HydrophobicContact CB-CE3 4.05Å; C487-W499 HydrophobicContact CB-CZ3 3.89Å; C487-V500 WeakPolarHBondContact CA-O 3.09Å; C487-K501 VanDerWaalsContact SG-CE 3.57Å
488	F	98	Very high	92.5	Very high	0 Å²	0	79.6 Å²	79.6	0%	0	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	149.2	173.4	71.8	-84.1	0	0	0	112.9	F451 L453 F469 M474 R476 W477 F486 Y490 W499 V500 I502 F514	F451-F488 HydrophobicContact CD1-CE1 4.35Å; F451-F488 HydrophobicContact CD1-CE2 4.45Å; F451-F488 HydrophobicContact CD1-CZ 4.15Å; F451-F488 HydrophobicContact CE1-CD1 4.13Å; F451-F488 AromaticContact CE1-CE1 3.6Å; F451-F488 HydrophobicContact CE1-CE1 3.6Å; F451-F488 HydrophobicContact CE1-CE2 4.45Å; F451-F488 AromaticContact CE1-CZ 3.77Å; F451-F488 HydrophobicContact CE1-CZ 3.77Å; L453-F488 HydrophobicContact CD1-CZ 4.25Å; F469-F488 HydrophobicContact CD1-CE2 4.42Å; F469-F488 HydrophobicContact CD2-CE2 4.31Å; F469-F488 HydrophobicContact CD2-CZ 4.38Å; F469-F488 HydrophobicContact CE1-CE2 4.18Å; F469-F488 HydrophobicContact CE2-CE2 4.07Å; F469-F488 AromaticContact CE2-CZ 3.84Å; F469-F488 HydrophobicContact CE2-CZ 3.84Å; F469-F488 HydrophobicContact CG-CE2 4.47Å; F469-F488 AromaticContact CZ-CE2 3.99Å; F469-F488 HydrophobicContact CZ-CE2 3.99Å; F469-F488 AromaticContact CZ-CZ 3.95Å; F469-F488 HydrophobicContact CZ-CZ 3.95Å; M474-F488 HydrophobicContact CE-CD2 3.99Å; M474-F488 HydrophobicContact CE-CE2 4.36Å; M474-F488 HydrophobicContact SD-CB 3.95Å; M474-F488 HydrophobicContact SD-CD2 3.5Å; M474-F488 WeakPolarHBondContact SD-CD2 3.49Å; M474-F488 HydrophobicContact SD-CE2 4.37Å; M474-F488 HydrophobicContact SD-CG 4.08Å; R476-F488 CarbonylContact O-C 3.57Å; R476-F488 WeakPolarHBondContact O-CA 3.35Å; W477-F488 HydrophobicContact CB-CB 4.23Å; F486-F488 HydrophobicContact CD1-CD1 4.39Å; F486-F488 HydrophobicContact CE1-CB 4.1Å; F486-F488 HydrophobicContact CE1-CD1 4.16Å; F488-Y490 HydrophobicContact CD2-CD1 4.31Å; F488-Y490 AromaticContact CE2-CD1 3.82Å; F488-Y490 HydrophobicContact CE2-CD1 3.82Å; F488-Y490 HydrophobicContact CE2-CG 4.47Å; F488-W499 CarbonylContact O-C 3.6Å; F488-W499 VanDerWaalsContact O-CA 3.28Å; F488-W499 WeakPolarHBondContact O-CA 3.42Å; F488-V500 HydrophobicContact CD1-CB 3.99Å; F488-V500 HydrophobicContact CD1-CG1 4.32Å; F488-V500 HydrophobicContact CE1-CB 3.45Å; F488-V500 VanDerWaalsContact CE1-CB 3.45Å; F488-V500 HydrophobicContact CE1-CG1 3.45Å; F488-V500 VanDerWaalsContact CE1-CG1 3.45Å; F488-V500 HydrophobicContact CE1-CG2 4.22Å; F488-V500 HydrophobicContact CE2-CB 4.17Å; F488-V500 HydrophobicContact CE2-CG2 4.13Å; F488-V500 HydrophobicContact CZ-CB 3.57Å; F488-V500 HydrophobicContact CZ-CG1 3.73Å; F488-V500 HydrophobicContact CZ-CG2 3.8Å; F488-V500 PolarHBondContact N-O 2.96Å; F488-V500 PolarHBondContact O-N 3.4Å; F488-I502 HydrophobicContact CD1-CD1 4.19Å; F488-I502 HydrophobicContact CE1-CD1 3.78Å; F488-F514 HydrophobicContact CB-CE1 4.45Å
489	E	97.7	Very high	92.4	Very high	32 Å²	32	80.6 Å²	80.6	15%	0.15	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	124	176.3	-172	171.4	-129.1	0	0	109.9	Q475 R476 P497 R498 W499	Q475-E489 HydrophobicContact CB-CB 4.45Å; Q475-E489 HydrophobicContact CB-CG 4.34Å; Q475-E489 WeakPolarHBondContact CB-O 3.42Å; Q475-E489 PolarHBondContact N-O 3.26Å; R476-E489 HydrophobicContact CB-CB 4.1Å; R476-E489 WeakPolarHBondContact CD-OE2 3.4Å; R476-E489 PolarHBondContact N-O 2.74Å; R476-E489 IonicContact NE-OE2 2.82Å; R476-E489 PolarHBondContact O-N 2.85Å; E489-P497 HydrophobicContact CG-CB 3.72Å; E489-R498 WeakPolarHBondContact CA-O 3.46Å; E489-W499 HydrophobicContact CB-CD2 3.87Å; E489-W499 HydrophobicContact CB-CE3 4.22Å; E489-W499 HydrophobicContact CB-CG 4.37Å; E489-W499 HydrophobicContact CB-CH2 4.1Å; E489-W499 HydrophobicContact CB-CZ2 3.72Å; E489-W499 HydrophobicContact CB-CZ3 4.33Å; E489-W499 HydrophobicContact CG-CD2 4.44Å; E489-W499 HydrophobicContact CG-CZ2 4.36Å; E489-W499 PolarHBondContact OE1-NE1 3.13Å
490	Y	96.6	Very high	92.5	Very high	43 Å²	43	78.8 Å²	78.8	17%	0.169	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	153.5	176.8	75.8	-82.8	0	0	0	112	F469 E473 F488 P497 R498 V500	F469-Y490 HydrophobicContact CD1-CD1 4.21Å; F469-Y490 AromaticContact CD1-CD2 3.83Å; F469-Y490 HydrophobicContact CD1-CD2 3.83Å; F469-Y490 HydrophobicContact CD1-CE2 4.28Å; F469-Y490 AromaticContact CD1-CG 3.8Å; F469-Y490 HydrophobicContact CD1-CG 3.8Å; F469-Y490 AromaticContact CE1-CD1 3.66Å; F469-Y490 HydrophobicContact CE1-CD1 3.66Å; F469-Y490 AromaticContact CE1-CD2 3.7Å; F469-Y490 HydrophobicContact CE1-CD2 3.7Å; F469-Y490 AromaticContact CE1-CE1 3.68Å; F469-Y490 HydrophobicContact CE1-CE1 3.68Å; F469-Y490 AromaticContact CE1-CE2 3.73Å; F469-Y490 HydrophobicContact CE1-CE2 3.73Å; F469-Y490 AromaticContact CE1-CG 3.67Å; F469-Y490 HydrophobicContact CE1-CG 3.67Å; F469-Y490 AromaticContact CE1-CZ 3.72Å; F469-Y490 HydrophobicContact CZ-CD1 4.4Å; F469-Y490 HydrophobicContact CZ-CE1 4.25Å; E473-Y490 CarbonylContact O-C 3.55Å; E473-Y490 WeakPolarHBondContact O-CA 3.36Å; F488-Y490 HydrophobicContact CD2-CD1 4.31Å; F488-Y490 AromaticContact CE2-CD1 3.82Å; F488-Y490 HydrophobicContact CE2-CD1 3.82Å; F488-Y490 HydrophobicContact CE2-CG 4.47Å; Y490-P497 CarbonylContact O-C 3.56Å; Y490-P497 VanDerWaalsContact O-CA 3.26Å; Y490-P497 WeakPolarHBondContact O-CA 3.45Å; Y490-R498 HydrophobicContact CD1-CB 4.29Å; Y490-R498 WeakPolarHBondContact CD1-O 3.45Å; Y490-R498 HydrophobicContact CE1-CB 3.72Å; Y490-R498 PolarHBondContact N-O 3.16Å; Y490-R498 PolarHBondContact O-N 3.27Å; Y490-V500 HydrophobicContact CD1-CG2 4.16Å; Y490-V500 HydrophobicContact CE1-CG2 3.71Å
491	A	95.8	Very high	92.7	Very high	21 Å²	21	80.4 Å²	80.4	17%	0.174	39%	0.391	C	S	.	.			trans	-129.4	129.7	174.3	0	0	0	0	0	110.3	E473 Q475 P497	E473-A491 WeakPolarHBondContact CA-O 3.49Å; E473-A491 VanDerWaalsContact CB-O 3.32Å; E473-A491 WeakPolarHBondContact CB-O 3.04Å; E473-A491 PolarHBondContact O-N 2.74Å; Q475-A491 HydrophobicContact CG-CB 3.93Å; A491-P497 HydrophobicContact CB-CB 4.45Å; A491-P497 HydrophobicContact CB-CG 4.21Å
492	R	91.8	Very high	93.3	Very high	100 Å²	100	74 Å²	74	38%	0.377	36%	0.361	S	S	.	.			trans	-124.8	100.9	-177.4	179	167.5	-68.1	178.3	2.9	110.7	A468 E473	A468-R492 PolarHBondContact O-NH2 3.25Å; E473-R492 VanDerWaalsContact OE1-CB 3.31Å; E473-R492 WeakPolarHBondContact OE1-CB 3.12Å; E473-R492 WeakPolarHBondContact OE1-CD 3.23Å; E473-R492 WeakPolarHBondContact OE1-CG 3.18Å; E473-R492 IonicContact OE1-CZ 2.72Å; E473-R492 IonicContact OE1-NE 3.36Å; E473-R492 PolarHBondContact OE1-NE 2.82Å; E473-R492 IonicContact OE1-NH2 3.25Å; E473-R492 PolarHBondContact OE1-NH2 3.42Å; E473-R492 IonicContact OE2-CZ 3.45Å; E473-R492 IonicContact OE2-NE 3.4Å; E473-R492 PolarHBondContact OE2-NE 3.1Å; E473-R492 IonicContact OE2-NH2 3.27Å; E473-R492 PolarHBondContact OE2-NH2 2.6Å
493	G	87.7	Confident	93.7	Very high	72 Å²	72	68.7 Å²	68.7	74%	0.742	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.4	-149.8	-171.2	0	0	0	0	0	112.2	K495	G493-K495 PolarHBondContact O-N 3.17Å
494	E	85.3	Confident	94.2	Very high	209 Å²	209	67.5 Å²	67.5	98%	0.977	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	9.8	-178.5	-56.7	-176.8	161.7	0	0	115
495	K	89.1	Confident	94.1	Very high	143 Å²	143	67 Å²	67	62%	0.622	33%	0.326	S	S	*	.	S	Bend	trans	-77.5	141	178.7	-67	174.1	-176.7	168.4	0	109.9	G493	G493-K495 PolarHBondContact O-N 3.17Å
496	K	91.3	Very high	94.1	Very high	187 Å²	187	68.9 Å²	68.9	81%	0.813	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-52.1	139.8	169.5	-68.9	-168.5	176.3	-171.2	0	110.3
497	P	95.6	Very high	93.9	Very high	68 Å²	68	69.5 Å²	69.5	44%	0.442	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-53.5	153.7	174.3	-24.9	32.8	0	0	0	112.6	E489 Y490 A491	E489-P497 HydrophobicContact CG-CB 3.72Å; Y490-P497 CarbonylContact O-C 3.56Å; Y490-P497 VanDerWaalsContact O-CA 3.26Å; Y490-P497 WeakPolarHBondContact O-CA 3.45Å; A491-P497 HydrophobicContact CB-CB 4.45Å; A491-P497 HydrophobicContact CB-CG 4.21Å
498	R	95.6	Very high	93.7	Very high	157 Å²	157	72.6 Å²	72.6	59%	0.592	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.5	130.1	-179.3	-69.5	-176.4	172.5	-147.2	-4.2	110.7	E489 Y490	E489-R498 WeakPolarHBondContact CA-O 3.46Å; Y490-R498 HydrophobicContact CD1-CB 4.29Å; Y490-R498 WeakPolarHBondContact CD1-O 3.45Å; Y490-R498 HydrophobicContact CE1-CB 3.72Å; Y490-R498 PolarHBondContact N-O 3.16Å; Y490-R498 PolarHBondContact O-N 3.27Å
499	W	96.5	Very high	93.6	Very high	116 Å²	116	73.2 Å²	73.2	44%	0.439	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	149.4	165.7	-73.9	84.1	0	0	0	111.3	R476 C487 F488 E489	R476-W499 HydrophobicContact CB-CH2 4.02Å; R476-W499 HydrophobicContact CB-CZ2 4.28Å; C487-W499 HydrophobicContact CB-CE3 4.05Å; C487-W499 HydrophobicContact CB-CZ3 3.89Å; F488-W499 CarbonylContact O-C 3.6Å; F488-W499 VanDerWaalsContact O-CA 3.28Å; F488-W499 WeakPolarHBondContact O-CA 3.42Å; E489-W499 HydrophobicContact CB-CD2 3.87Å; E489-W499 HydrophobicContact CB-CE3 4.22Å; E489-W499 HydrophobicContact CB-CG 4.37Å; E489-W499 HydrophobicContact CB-CH2 4.1Å; E489-W499 HydrophobicContact CB-CZ2 3.72Å; E489-W499 HydrophobicContact CB-CZ3 4.33Å; E489-W499 HydrophobicContact CG-CD2 4.44Å; E489-W499 HydrophobicContact CG-CZ2 4.36Å; E489-W499 PolarHBondContact OE1-NE1 3.13Å
500	V	96.9	Very high	93.7	Very high	2 Å²	2	71.7 Å²	71.7	1%	0.012	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	137.9	171.9	177.3	0	0	0	0	107.8	D435 S436 L453 C487 F488 Y490	D435-V500 WeakPolarHBondContact OD1-CA 3.41Å; S436-V500 WeakPolarHBondContact OG-CG2 3.21Å; L453-V500 HydrophobicContact CD1-CG1 4.39Å; C487-V500 WeakPolarHBondContact CA-O 3.09Å; F488-V500 HydrophobicContact CD1-CB 3.99Å; F488-V500 HydrophobicContact CD1-CG1 4.32Å; F488-V500 HydrophobicContact CE1-CB 3.45Å; F488-V500 VanDerWaalsContact CE1-CB 3.45Å; F488-V500 HydrophobicContact CE1-CG1 3.45Å; F488-V500 VanDerWaalsContact CE1-CG1 3.45Å; F488-V500 HydrophobicContact CE1-CG2 4.22Å; F488-V500 HydrophobicContact CE2-CB 4.17Å; F488-V500 HydrophobicContact CE2-CG2 4.13Å; F488-V500 HydrophobicContact CZ-CB 3.57Å; F488-V500 HydrophobicContact CZ-CG1 3.73Å; F488-V500 HydrophobicContact CZ-CG2 3.8Å; F488-V500 PolarHBondContact N-O 2.96Å; F488-V500 PolarHBondContact O-N 3.4Å; Y490-V500 HydrophobicContact CD1-CG2 4.16Å; Y490-V500 HydrophobicContact CE1-CG2 3.71Å
501	K	97.1	Very high	93.7	Very high	71 Å²	71	71.9 Å²	71.9	31%	0.309	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	131.6	173.4	-64.1	-155.4	173	-169.9	0	111.4	C434 D435 D480 C487 F503	C434-K501 VanDerWaalsContact CA-O 3.27Å; C434-K501 WeakPolarHBondContact CA-O 3.5Å; D435-K501 HydrophobicContact CB-CB 4.38Å; D435-K501 PolarHBondContact N-O 3.45Å; D435-K501 PolarHBondContact OD1-N 3.46Å; D435-K501 PolarHBondContact OD2-N 2.74Å; D480-K501 IonicContact OD2-NZ 2.77Å; D480-K501 PolarHBondContact OD2-NZ 3.27Å; C487-K501 VanDerWaalsContact SG-CE 3.57Å; K501-F503 HydrophobicContact CB-CE1 4.34Å; K501-F503 HydrophobicContact CB-CE2 3.97Å; K501-F503 HydrophobicContact CB-CZ 3.76Å; K501-F503 HydrophobicContact CD-CE1 4.36Å; K501-F503 HydrophobicContact CD-CZ 4.21Å
502	I	97.1	Very high	93.8	Very high	0 Å²	0	73.3 Å²	73.3	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	112.3	174.7	-61.7	152	0	0	0	107.7	C432 C434 T444 F451 L453 A485 F486 F488 T504 M510	C432-I502 VanDerWaalsContact SG-CG2 3.52Å; C434-I502 HydrophobicContact CB-CG1 4.49Å; T444-I502 HydrophobicContact CG2-CD1 4.18Å; T444-I502 HydrophobicContact CG2-CG2 4.11Å; F451-I502 HydrophobicContact CE1-CD1 4.05Å; F451-I502 HydrophobicContact CZ-CD1 3.72Å; L453-I502 HydrophobicContact CD2-CD1 3.96Å; L453-I502 HydrophobicContact CD2-CG1 4.42Å; A485-I502 CarbonylContact C-O 3.56Å; A485-I502 WeakPolarHBondContact CA-O 3.42Å; A485-I502 WeakPolarHBondContact CB-O 3.47Å; F486-I502 HydrophobicContact CD1-CD1 4.22Å; F486-I502 PolarHBondContact N-O 2.82Å; F486-I502 PolarHBondContact O-N 2.82Å; F488-I502 HydrophobicContact CD1-CD1 4.19Å; F488-I502 HydrophobicContact CE1-CD1 3.78Å; I502-T504 HydrophobicContact CG2-CG2 3.92Å; I502-T504 PolarHBondContact O-N 3.12Å; I502-M510 HydrophobicContact CD1-SD 3.9Å; I502-M510 HydrophobicContact CG2-CE 4.3Å; I502-M510 HydrophobicContact CG2-SD 4.43Å
503	F	94.9	Very high	94.1	Very high	86 Å²	86	68.5 Å²	68.5	38%	0.377	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	99.9	-174	-56.7	-86.3	0	0	0	109.4	C432 A433 D435 A485 K501	C432-F503 WeakPolarHBondContact CB-O 3.39Å; A433-F503 HydrophobicContact CB-CB 4.36Å; A433-F503 HydrophobicContact CB-CD2 4.32Å; A433-F503 PolarHBondContact O-N 3.35Å; D435-F503 HydrophobicContact CB-CE2 4.2Å; A485-F503 HydrophobicContact CB-CD1 3.76Å; A485-F503 HydrophobicContact CB-CE1 4.13Å; A485-F503 HydrophobicContact CB-CG 4.36Å; K501-F503 HydrophobicContact CB-CE1 4.34Å; K501-F503 HydrophobicContact CB-CE2 3.97Å; K501-F503 HydrophobicContact CB-CZ 3.76Å; K501-F503 HydrophobicContact CD-CE1 4.36Å; K501-F503 HydrophobicContact CD-CZ 4.21Å
504	T	90.9	Very high	94.6	Very high	4 Å²	4	65.1 Å²	65.1	3%	0.025	30%	0.299	C	S	.	.			trans	-152.3	134	-168.9	-177.2	0	0	0	0	111.2	M484 I502 Y506 F507 M510	M484-T504 CarbonylContact O-C 3.58Å; M484-T504 PolarHBondContact O-N 3.43Å; M484-T504 VanDerWaalsContact O-O 3.11Å; I502-T504 HydrophobicContact CG2-CG2 3.92Å; I502-T504 PolarHBondContact O-N 3.12Å; T504-Y506 PolarHBondContact O-N 2.87Å; T504-F507 HydrophobicContact CG2-CB 4.35Å; T504-F507 WeakPolarHBondContact O-CB 3.41Å; T504-F507 WeakPolarHBondContact O-CD1 3.28Å; T504-F507 PolarHBondContact O-N 3.42Å; T504-F507 VanDerWaalsContact O-N 3.11Å; T504-M510 HydrophobicContact CG2-CE 4.05Å
505	P	87.4	Confident	95.1	Very high	87 Å²	87	59.3 Å²	59.3	57%	0.565	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-6.3	179.3	28.8	-36.3	0	0	0	113.7	M484	M484-P505 HydrophobicContact CE-CB 4.39Å
506	Y	93.8	Very high	95.5	Very high	39 Å²	39	54.3 Å²	54.3	15%	0.153	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	16.2	178.3	-47.9	-61.6	0	0	0	113.2	I324 F328 P430 T504 N508 Y509 M510	I324-Y506 HydrophobicContact CD1-CE1 3.73Å; F328-Y506 HydrophobicContact CD1-CD1 4.47Å; F328-Y506 HydrophobicContact CD1-CD2 4.42Å; F328-Y506 HydrophobicContact CD1-CE1 4.15Å; F328-Y506 HydrophobicContact CD1-CE2 4.12Å; F328-Y506 AromaticContact CD1-CZ 3.96Å; F328-Y506 AromaticContact CE1-CD1 3.71Å; F328-Y506 HydrophobicContact CE1-CD1 3.71Å; F328-Y506 AromaticContact CE1-CD2 3.78Å; F328-Y506 HydrophobicContact CE1-CD2 3.78Å; F328-Y506 AromaticContact CE1-CE1 3.85Å; F328-Y506 HydrophobicContact CE1-CE1 3.85Å; F328-Y506 AromaticContact CE1-CE2 3.92Å; F328-Y506 HydrophobicContact CE1-CE2 3.92Å; F328-Y506 AromaticContact CE1-CG 3.67Å; F328-Y506 HydrophobicContact CE1-CG 3.67Å; F328-Y506 AromaticContact CE1-CZ 3.95Å; F328-Y506 HydrophobicContact CZ-CD2 4.35Å; F328-Y506 HydrophobicContact CZ-CG 4.25Å; P430-Y506 HydrophobicContact CB-CE2 4.44Å; P430-Y506 HydrophobicContact CG-CD2 4.33Å; P430-Y506 HydrophobicContact CG-CE2 3.8Å; T504-Y506 PolarHBondContact O-N 2.87Å; Y506-N508 VanDerWaalsContact C-N 3.33Å; Y506-N508 PolarHBondContact O-N 3.4Å; Y506-Y509 WeakPolarHBondContact O-CA 3.49Å; Y506-Y509 WeakPolarHBondContact O-CB 3.13Å; Y506-Y509 PolarHBondContact O-N 2.69Å; Y506-M510 PolarHBondContact O-N 3.48Å
507	F	95.3	Very high	95.8	Very high	12 Å²	12	45.4 Å²	45.4	5%	0.053	21%	0.211	C	C	.	.	H	α-helix	trans	-53.9	-42.4	-174.2	66.5	-89.8	0	0	0	113.9	T479 E481 M484 A485 F486 T504 Y509 M510 H511	T479-F507 HydrophobicContact CG2-CD2 3.72Å; T479-F507 HydrophobicContact CG2-CE2 4.33Å; E481-F507 HydrophobicContact CG-CE2 4.06Å; E481-F507 HydrophobicContact CG-CZ 4.22Å; M484-F507 HydrophobicContact CB-CE1 4.49Å; M484-F507 HydrophobicContact CE-CE1 3.93Å; M484-F507 HydrophobicContact SD-CE1 3.7Å; M484-F507 HydrophobicContact SD-CZ 4.38Å; A485-F507 VanDerWaalsContact C-CB 3.46Å; F486-F507 HydrophobicContact CB-CB 4.03Å; T504-F507 HydrophobicContact CG2-CB 4.35Å; T504-F507 WeakPolarHBondContact O-CB 3.41Å; T504-F507 WeakPolarHBondContact O-CD1 3.28Å; T504-F507 PolarHBondContact O-N 3.42Å; T504-F507 VanDerWaalsContact O-N 3.11Å; F507-Y509 VanDerWaalsContact C-N 3.35Å; F507-Y509 PolarHBondContact O-N 2.84Å; F507-M510 WeakPolarHBondContact O-CB 3.49Å; F507-M510 PolarHBondContact O-N 3.25Å; F507-H511 PolarHBondContact O-N 3.06Å
508	N	93.7	Very high	95.7	Very high	76 Å²	76	43.9 Å²	43.9	41%	0.406	20%	0.197	S	C	.	.	H	α-helix	trans	-64.8	-35	175.4	-79.4	-26.1	0	0	0	112.9	T479 Y506 H511 E512	T479-N508 WeakPolarHBondContact CG2-OD1 3.25Å; Y506-N508 VanDerWaalsContact C-N 3.33Å; Y506-N508 PolarHBondContact O-N 3.4Å; N508-H511 PolarHBondContact O-N 3.49Å; N508-E512 PolarHBondContact O-N 3.1Å
509	Y	96.5	Very high	95.7	Very high	13 Å²	13	38.7 Å²	38.7	5%	0.051	19%	0.185	C	C	.	.	H	α-helix	trans	-74.2	-32.3	174.7	175.5	-129	0	0	0	111.8	F328 V329 R330 K331 W360 I427 F429 Y506 F507 H511 E512 C513	F328-Y509 HydrophobicContact CE2-CE1 4.41Å; F328-Y509 AromaticContact CZ-CD1 3.98Å; F328-Y509 HydrophobicContact CZ-CD1 3.98Å; F328-Y509 AromaticContact CZ-CE1 3.87Å; F328-Y509 HydrophobicContact CZ-CE1 3.87Å; V329-Y509 WeakPolarHBondContact O-CE1 3.29Å; V329-Y509 PolarHBondContact O-OH 3.07Å; R330-Y509 HydrophobicContact CB-CD1 3.78Å; R330-Y509 HydrophobicContact CB-CE1 4.05Å; R330-Y509 HydrophobicContact CB-CG 4.14Å; K331-Y509 HydrophobicContact CB-CD2 3.8Å; K331-Y509 HydrophobicContact CB-CE2 3.43Å; K331-Y509 VanDerWaalsContact CB-CE2 3.43Å; K331-Y509 VanDerWaalsContact N-CE2 3.28Å; W360-Y509 HydrophobicContact CH2-CE2 4.14Å; W360-Y509 AromaticContact CZ3-CE2 3.96Å; W360-Y509 HydrophobicContact CZ3-CE2 3.96Å; I427-Y509 HydrophobicContact CG2-CE1 4.28Å; F429-Y509 AromaticContact CE1-CD1 3.52Å; F429-Y509 HydrophobicContact CE1-CD1 3.52Å; F429-Y509 HydrophobicContact CE1-CE1 4.03Å; F429-Y509 HydrophobicContact CE1-CG 4.3Å; F429-Y509 AromaticContact CZ-CD1 3.67Å; F429-Y509 HydrophobicContact CZ-CD1 3.67Å; F429-Y509 AromaticContact CZ-CE1 3.83Å; F429-Y509 HydrophobicContact CZ-CE1 3.83Å; F429-Y509 HydrophobicContact CZ-CG 4.36Å; Y506-Y509 WeakPolarHBondContact O-CA 3.49Å; Y506-Y509 WeakPolarHBondContact O-CB 3.13Å; Y506-Y509 PolarHBondContact O-N 2.69Å; F507-Y509 VanDerWaalsContact C-N 3.35Å; F507-Y509 PolarHBondContact O-N 2.84Å; Y509-H511 VanDerWaalsContact C-N 3.33Å; Y509-E512 PolarHBondContact O-N 3.45Å; Y509-C513 PolarHBondContact O-N 2.78Å; Y509-C513 PolarHBondContact O-SG 2.73Å
510	M	97.9	Very high	95.7	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-61.8	-42.8	170.5	-164.7	169.2	-68.6	0	0	111.2	F429 T444 I446 F451 F486 I502 T504 Y506 F507 C513 F514	F429-M510 HydrophobicContact CB-CE 4.26Å; F429-M510 HydrophobicContact CD1-CE 3.64Å; F429-M510 HydrophobicContact CD2-CE 4.2Å; F429-M510 HydrophobicContact CE1-CB 3.93Å; F429-M510 HydrophobicContact CE1-CE 3.98Å; F429-M510 HydrophobicContact CE1-CG 4.47Å; F429-M510 HydrophobicContact CG-CE 3.77Å; F429-M510 HydrophobicContact CZ-CB 4.07Å; F429-M510 HydrophobicContact CZ-CE 4.43Å; F429-M510 HydrophobicContact CZ-CG 4.35Å; T444-M510 HydrophobicContact CG2-CE 4.27Å; T444-M510 WeakPolarHBondContact OG1-CE 3.36Å; I446-M510 HydrophobicContact CD1-CG 4.03Å; F451-M510 HydrophobicContact CZ-SD 4.41Å; F486-M510 HydrophobicContact CB-CB 4.2Å; F486-M510 HydrophobicContact CB-CG 4.24Å; F486-M510 HydrophobicContact CB-SD 3.75Å; F486-M510 HydrophobicContact CD1-CB 4.42Å; F486-M510 HydrophobicContact CD1-CG 3.69Å; F486-M510 HydrophobicContact CD1-SD 3.38Å; F486-M510 WeakPolarHBondContact CD1-SD 3.46Å; F486-M510 HydrophobicContact CD2-CB 4.19Å; F486-M510 HydrophobicContact CD2-CG 4.25Å; F486-M510 HydrophobicContact CE1-CG 4.07Å; F486-M510 HydrophobicContact CE1-SD 4.16Å; F486-M510 HydrophobicContact CG-CB 4.01Å; F486-M510 HydrophobicContact CG-CG 3.79Å; F486-M510 HydrophobicContact CG-SD 3.7Å; F486-M510 HydrophobicContact CZ-CG 4.49Å; I502-M510 HydrophobicContact CD1-SD 3.9Å; I502-M510 HydrophobicContact CG2-CE 4.3Å; I502-M510 HydrophobicContact CG2-SD 4.43Å; T504-M510 HydrophobicContact CG2-CE 4.05Å; Y506-M510 PolarHBondContact O-N 3.48Å; F507-M510 WeakPolarHBondContact O-CB 3.49Å; F507-M510 PolarHBondContact O-N 3.25Å; M510-C513 WeakPolarHBondContact O-CB 3.5Å; M510-C513 PolarHBondContact O-N 3.16Å; M510-F514 HydrophobicContact CG-CE2 4.47Å; M510-F514 WeakPolarHBondContact O-CD2 3.37Å; M510-F514 PolarHBondContact O-N 2.92Å; M510-F514 VanDerWaalsContact O-N 3.08Å
511	H	97.8	Very high	95.5	Very high	47 Å²	47	34.4 Å²	34.4	22%	0.218	17%	0.17	C	C	.	.	H	α-helix	trans	-62.3	-46.3	172.3	-173.8	-68.2	0	0	0	112.7	W477 T479 F486 F507 N508 Y509 C513 F514 E515	W477-H511 AromaticContact CD1-CD2 3.78Å; W477-H511 AromaticContact CD1-NE2 3.66Å; T479-H511 HydrophobicContact CG2-CB 3.76Å; F486-H511 HydrophobicContact CD2-CB 4.06Å; F486-H511 HydrophobicContact CE2-CB 3.89Å; F507-H511 PolarHBondContact O-N 3.06Å; N508-H511 PolarHBondContact O-N 3.49Å; Y509-H511 VanDerWaalsContact C-N 3.33Å; H511-C513 PolarHBondContact O-N 2.92Å; H511-F514 PolarHBondContact O-N 2.85Å; H511-E515 VanDerWaalsContact CE1-CG 3.47Å; H511-E515 WeakPolarHBondContact CE1-CG 3.43Å; H511-E515 PolarHBondContact O-N 2.84Å
512	E	97.3	Very high	95.1	Very high	50 Å²	50	36.2 Å²	36.2	23%	0.234	18%	0.178	C	C	.	.	H	α-helix	trans	-57.9	-35.4	173.9	-75	-165.7	151.5	0	0	112.8	K331 N508 Y509 R516	K331-E512 WeakPolarHBondContact CD-OE2 3.32Å; K331-E512 WeakPolarHBondContact CE-OE2 3.36Å; K331-E512 IonicContact NZ-OE1 3.87Å; K331-E512 PolarHBondContact NZ-OE1 2.91Å; K331-E512 IonicContact NZ-OE2 2.78Å; K331-E512 PolarHBondContact NZ-OE2 3.37Å; N508-E512 PolarHBondContact O-N 3.1Å; Y509-E512 PolarHBondContact O-N 3.45Å; E512-R516 WeakPolarHBondContact O-CB 2.95Å; E512-R516 PolarHBondContact O-N 3.34Å
513	C	98.3	Very high	94.7	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-68.3	-41.9	176.1	-66.4	0	0	0	0	111.9	F362 I446 Y509 M510 H511 R516 V517	F362-C513 HydrophobicContact CZ-CB 4.15Å; I446-C513 HydrophobicContact CD1-CB 3.44Å; I446-C513 VanDerWaalsContact CD1-CB 3.44Å; I446-C513 HydrophobicContact CG2-CB 4.24Å; Y509-C513 PolarHBondContact O-N 2.78Å; Y509-C513 PolarHBondContact O-SG 2.73Å; M510-C513 WeakPolarHBondContact O-CB 3.5Å; M510-C513 PolarHBondContact O-N 3.16Å; H511-C513 PolarHBondContact O-N 2.92Å; C513-R516 PolarHBondContact O-N 3Å; C513-V517 WeakPolarHBondContact O-CG2 3.34Å; C513-V517 PolarHBondContact O-N 2.9Å
514	F	97.9	Very high	93.5	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-61.6	-50.2	173.9	-89.6	-126	0	0	0	111.2	I446 F451 W471 M474 W477 F486 F488 M510 H511 R516 V517 F518	I446-F514 HydrophobicContact CD1-CD2 3.84Å; I446-F514 HydrophobicContact CD1-CE2 3.83Å; I446-F514 HydrophobicContact CG1-CD2 4.48Å; I446-F514 HydrophobicContact CG1-CE2 4.13Å; F451-F514 HydrophobicContact CB-CZ 4.28Å; F451-F514 HydrophobicContact CD1-CE2 4.42Å; F451-F514 AromaticContact CD1-CZ 3.78Å; F451-F514 HydrophobicContact CD1-CZ 3.78Å; F451-F514 AromaticContact CD2-CE2 3.91Å; F451-F514 HydrophobicContact CD2-CE2 3.91Å; F451-F514 HydrophobicContact CD2-CZ 4.06Å; F451-F514 HydrophobicContact CE1-CZ 4.03Å; F451-F514 HydrophobicContact CE2-CE2 4.01Å; F451-F514 HydrophobicContact CE2-CZ 4.29Å; F451-F514 HydrophobicContact CG-CE2 4.11Å; F451-F514 AromaticContact CG-CZ 3.78Å; F451-F514 HydrophobicContact CG-CZ 3.78Å; F451-F514 HydrophobicContact CZ-CE2 4.31Å; F451-F514 HydrophobicContact CZ-CZ 4.27Å; W471-F514 HydrophobicContact CH2-CD1 4.26Å; W471-F514 HydrophobicContact CH2-CD2 4.14Å; W471-F514 HydrophobicContact CH2-CE1 4.17Å; W471-F514 HydrophobicContact CH2-CE2 4.01Å; W471-F514 HydrophobicContact CH2-CG 4.25Å; W471-F514 HydrophobicContact CH2-CZ 4.03Å; W471-F514 AromaticContact CZ3-CD1 3.78Å; W471-F514 HydrophobicContact CZ3-CD1 3.78Å; W471-F514 HydrophobicContact CZ3-CD2 4.47Å; W471-F514 AromaticContact CZ3-CE1 3.69Å; W471-F514 HydrophobicContact CZ3-CE1 3.69Å; W471-F514 HydrophobicContact CZ3-CE2 4.37Å; W471-F514 HydrophobicContact CZ3-CG 4.18Å; W471-F514 AromaticContact CZ3-CZ 3.99Å; W471-F514 HydrophobicContact CZ3-CZ 3.99Å; M474-F514 HydrophobicContact CE-CE1 3.71Å; M474-F514 HydrophobicContact CE-CZ 4.07Å; M474-F514 HydrophobicContact CG-CE1 4.18Å; M474-F514 HydrophobicContact SD-CE1 3.86Å; W477-F514 HydrophobicContact CB-CD1 4.12Å; W477-F514 HydrophobicContact CD2-CB 4.44Å; W477-F514 AromaticContact CD2-CD1 3.84Å; W477-F514 HydrophobicContact CD2-CD1 3.84Å; W477-F514 HydrophobicContact CE3-CD1 4.06Å; W477-F514 HydrophobicContact CG-CB 4.34Å; W477-F514 AromaticContact CG-CD1 3.85Å; W477-F514 HydrophobicContact CG-CD1 3.85Å; W477-F514 HydrophobicContact CG-CG 4.47Å; F486-F514 HydrophobicContact CE1-CD1 4.28Å; F486-F514 HydrophobicContact CE1-CD2 4.08Å; F486-F514 AromaticContact CE1-CE1 3.87Å; F486-F514 HydrophobicContact CE1-CE1 3.87Å; F486-F514 AromaticContact CE1-CE2 3.68Å; F486-F514 HydrophobicContact CE1-CE2 3.68Å; F486-F514 HydrophobicContact CE1-CG 4.38Å; F486-F514 AromaticContact CE1-CZ 3.56Å; F486-F514 HydrophobicContact CE1-CZ 3.56Å; F486-F514 HydrophobicContact CZ-CB 4.39Å; F486-F514 AromaticContact CZ-CD1 3.67Å; F486-F514 HydrophobicContact CZ-CD1 3.67Å; F486-F514 AromaticContact CZ-CD2 3.73Å; F486-F514 HydrophobicContact CZ-CD2 3.73Å; F486-F514 AromaticContact CZ-CE1 3.73Å; F486-F514 HydrophobicContact CZ-CE1 3.73Å; F486-F514 AromaticContact CZ-CE2 3.82Å; F486-F514 HydrophobicContact CZ-CE2 3.82Å; F486-F514 AromaticContact CZ-CG 3.68Å; F486-F514 HydrophobicContact CZ-CG 3.68Å; F486-F514 AromaticContact CZ-CZ 3.82Å; F486-F514 HydrophobicContact CZ-CZ 3.82Å; F488-F514 HydrophobicContact CB-CE1 4.45Å; M510-F514 HydrophobicContact CG-CE2 4.47Å; M510-F514 WeakPolarHBondContact O-CD2 3.37Å; M510-F514 PolarHBondContact O-N 2.92Å; M510-F514 VanDerWaalsContact O-N 3.08Å; H511-F514 PolarHBondContact O-N 2.85Å; F514-R516 VanDerWaalsContact C-N 3.3Å; F514-R516 PolarHBondContact O-N 2.82Å; F514-V517 PolarHBondContact O-N 2.92Å; F514-F518 WeakPolarHBondContact O-CD2 3.3Å; F514-F518 PolarHBondContact O-N 3.24Å
515	E	96.6	Very high	92.3	Very high	88 Å²	88	48.3 Å²	48.3	41%	0.411	23%	0.225	S	C	.	.	H	α-helix	trans	-57.6	-41	177.3	-76.8	-59.5	121.9	0	0	112.4	W477 H511 F518 C519	W477-E515 WeakPolarHBondContact CZ2-OE1 3.31Å; W477-E515 PolarHBondContact NE1-OE1 3.21Å; H511-E515 VanDerWaalsContact CE1-CG 3.47Å; H511-E515 WeakPolarHBondContact CE1-CG 3.43Å; H511-E515 PolarHBondContact O-N 2.84Å; E515-F518 PolarHBondContact O-N 2.7Å; E515-C519 WeakPolarHBondContact O-CB 3.21Å; E515-C519 PolarHBondContact O-N 2.92Å
516	R	96.6	Very high	90.8	Very high	38 Å²	38	51.8 Å²	51.8	14%	0.143	23%	0.234	C	C	.	.	H	α-helix	trans	-66.6	-46.5	176.8	-178.3	56.4	170.6	-159.5	-13.6	111.9	N316 W360 F362 E512 C513 F514 F518 C519 E520	N316-R516 PolarHBondContact O-NH2 3.26Å; W360-R516 HydrophobicContact CD2-CG 4.44Å; W360-R516 HydrophobicContact CH2-CB 4.22Å; W360-R516 HydrophobicContact CZ2-CB 3.56Å; W360-R516 HydrophobicContact CZ2-CG 3.86Å; W360-R516 PolarHBondContact O-NH2 2.87Å; F362-R516 HydrophobicContact CD2-CG 3.88Å; F362-R516 HydrophobicContact CE2-CB 4.02Å; F362-R516 HydrophobicContact CE2-CG 3.74Å; E512-R516 WeakPolarHBondContact O-CB 2.95Å; E512-R516 PolarHBondContact O-N 3.34Å; C513-R516 PolarHBondContact O-N 3Å; F514-R516 VanDerWaalsContact C-N 3.3Å; F514-R516 PolarHBondContact O-N 2.82Å; R516-F518 VanDerWaalsContact C-N 3.33Å; R516-F518 PolarHBondContact O-N 2.76Å; R516-C519 VanDerWaalsContact O-CB 3.3Å; R516-C519 WeakPolarHBondContact O-CB 3.48Å; R516-C519 PolarHBondContact O-N 2.95Å; R516-C519 VanDerWaalsContact O-N 3.08Å; R516-E520 WeakPolarHBondContact CD-OE1 3.32Å; R516-E520 HydrophobicContact CG-CG 4.49Å; R516-E520 WeakPolarHBondContact CG-OE1 3.34Å; R516-E520 IonicContact CZ-OE1 2.6Å; R516-E520 IonicContact NE-OE1 2.74Å; R516-E520 PolarHBondContact NE-OE1 3.41Å; R516-E520 IonicContact NH2-OE1 2.74Å; R516-E520 WeakPolarHBondContact O-CG 3.26Å; R516-E520 PolarHBondContact O-N 3.25Å
517	V	97.3	Very high	88.7	Confident	0 Å²	0	57 Å²	57	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-60.9	-42.8	176.4	171.5	0	0	0	0	111.1	F362 I446 I448 W471 C513 F514 C519 E520 L521	F362-V517 HydrophobicContact CB-CG2 4.23Å; F362-V517 HydrophobicContact CD1-CG2 3.75Å; F362-V517 HydrophobicContact CD2-CG2 3.75Å; F362-V517 HydrophobicContact CE1-CG2 3.89Å; F362-V517 HydrophobicContact CE2-CG2 3.9Å; F362-V517 HydrophobicContact CG-CG2 3.66Å; F362-V517 HydrophobicContact CZ-CG2 3.95Å; I446-V517 HydrophobicContact CG2-CG2 3.95Å; I448-V517 HydrophobicContact CD1-CG1 4.25Å; W471-V517 HydrophobicContact CD2-CG1 4.02Å; W471-V517 HydrophobicContact CG-CG1 4.41Å; W471-V517 HydrophobicContact CH2-CG1 4.38Å; W471-V517 HydrophobicContact CZ2-CB 4.31Å; W471-V517 HydrophobicContact CZ2-CG1 3.75Å; W471-V517 HydrophobicContact CZ2-CG2 4.42Å; C513-V517 WeakPolarHBondContact O-CG2 3.34Å; C513-V517 PolarHBondContact O-N 2.9Å; F514-V517 PolarHBondContact O-N 2.92Å; V517-C519 VanDerWaalsContact C-N 3.27Å; V517-C519 PolarHBondContact O-N 2.95Å; V517-E520 PolarHBondContact O-N 2.84Å; V517-L521 HydrophobicContact CG1-CD1 3.73Å; V517-L521 HydrophobicContact CG1-CG 4.16Å; V517-L521 WeakPolarHBondContact O-CB 3.43Å; V517-L521 VanDerWaalsContact O-CG 3.25Å; V517-L521 WeakPolarHBondContact O-CG 3.41Å; V517-L521 PolarHBondContact O-N 3.17Å
518	F	95.3	Very high	86.1	Confident	36 Å²	36	69 Å²	69	16%	0.158	31%	0.306	C	S	.	.	H	α-helix	trans	-69.8	-19	174.9	-89.1	-81.4	0	0	0	114.7	W471 M474 W477 F514 E515 R516 K522	W471-F518 HydrophobicContact CB-CZ 4.49Å; W471-F518 HydrophobicContact CD2-CE2 4.38Å; W471-F518 HydrophobicContact CE3-CD2 4.27Å; W471-F518 AromaticContact CE3-CE2 3.43Å; W471-F518 HydrophobicContact CE3-CE2 3.43Å; W471-F518 VanDerWaalsContact CE3-CE2 3.43Å; W471-F518 AromaticContact CE3-CZ 3.96Å; W471-F518 HydrophobicContact CE3-CZ 3.96Å; W471-F518 HydrophobicContact CZ3-CD2 4.43Å; W471-F518 AromaticContact CZ3-CE2 3.8Å; W471-F518 HydrophobicContact CZ3-CE2 3.8Å; M474-F518 HydrophobicContact CB-CE2 4.41Å; M474-F518 HydrophobicContact CB-CZ 4.07Å; M474-F518 HydrophobicContact CG-CE2 4.28Å; M474-F518 HydrophobicContact CG-CZ 4.37Å; W477-F518 HydrophobicContact CE3-CE2 4.12Å; W477-F518 HydrophobicContact CH2-CB 4.36Å; W477-F518 AromaticContact CH2-CD1 3.81Å; W477-F518 HydrophobicContact CH2-CD1 3.81Å; W477-F518 AromaticContact CH2-CD2 3.26Å; W477-F518 HydrophobicContact CH2-CD2 3.26Å; W477-F518 AromaticContact CH2-CE1 3.85Å; W477-F518 HydrophobicContact CH2-CE1 3.85Å; W477-F518 AromaticContact CH2-CE2 3.29Å; W477-F518 HydrophobicContact CH2-CE2 3.29Å; W477-F518 AromaticContact CH2-CG 3.53Å; W477-F518 HydrophobicContact CH2-CG 3.53Å; W477-F518 AromaticContact CH2-CZ 3.61Å; W477-F518 HydrophobicContact CH2-CZ 3.61Å; W477-F518 HydrophobicContact CZ2-CB 4.29Å; W477-F518 AromaticContact CZ2-CD2 3.62Å; W477-F518 HydrophobicContact CZ2-CD2 3.62Å; W477-F518 HydrophobicContact CZ2-CE2 4.06Å; W477-F518 AromaticContact CZ2-CG 3.9Å; W477-F518 HydrophobicContact CZ2-CG 3.9Å; W477-F518 AromaticContact CZ3-CD2 3.79Å; W477-F518 HydrophobicContact CZ3-CD2 3.79Å; W477-F518 HydrophobicContact CZ3-CE1 4.21Å; W477-F518 AromaticContact CZ3-CE2 3.32Å; W477-F518 HydrophobicContact CZ3-CE2 3.32Å; W477-F518 HydrophobicContact CZ3-CG 4.4Å; W477-F518 AromaticContact CZ3-CZ 3.57Å; W477-F518 HydrophobicContact CZ3-CZ 3.57Å; F514-F518 WeakPolarHBondContact O-CD2 3.3Å; F514-F518 PolarHBondContact O-N 3.24Å; E515-F518 PolarHBondContact O-N 2.7Å; R516-F518 VanDerWaalsContact C-N 3.33Å; R516-F518 PolarHBondContact O-N 2.76Å; F518-K522 WeakPolarHBondContact O-CD 3.44Å; F518-K522 VanDerWaalsContact O-CE 3.24Å; F518-K522 WeakPolarHBondContact O-CE 3.32Å; F518-K522 VanDerWaalsContact O-CG 3.27Å; F518-K522 WeakPolarHBondContact O-CG 3.47Å
519	C	94.9	Very high	85.7	Confident	48 Å²	48	68.7 Å²	68.7	32%	0.324	30%	0.301	S	S	.	.	H	α-helix	trans	-74.2	-52	168.5	-169	0	0	0	0	110.3	E515 R516 V517 L521 K522 W523	E515-C519 WeakPolarHBondContact O-CB 3.21Å; E515-C519 PolarHBondContact O-N 2.92Å; R516-C519 VanDerWaalsContact O-CB 3.3Å; R516-C519 WeakPolarHBondContact O-CB 3.48Å; R516-C519 PolarHBondContact O-N 2.95Å; R516-C519 VanDerWaalsContact O-N 3.08Å; V517-C519 VanDerWaalsContact C-N 3.27Å; V517-C519 PolarHBondContact O-N 2.95Å; C519-L521 VanDerWaalsContact C-N 3.34Å; C519-L521 PolarHBondContact O-N 3.21Å; C519-K522 WeakPolarHBondContact O-CB 3.48Å; C519-K522 PolarHBondContact O-N 3Å; C519-W523 PolarHBondContact O-N 2.98Å
520	E	95.5	Very high	85.1	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-65.8	-34	-178.7	-63.2	179.9	-161.3	0	0	112.7	L361 F362 T363 I448 R516 V517 K522 W523	L361-E520 WeakPolarHBondContact CA-OE1 3.45Å; F362-E520 VanDerWaalsContact CA-OE2 3.28Å; F362-E520 WeakPolarHBondContact CA-OE2 3.47Å; F362-E520 VanDerWaalsContact CB-OE2 3.31Å; F362-E520 WeakPolarHBondContact CB-OE2 3.42Å; F362-E520 PolarHBondContact N-OE1 3.48Å; F362-E520 PolarHBondContact N-OE2 3.37Å; T363-E520 HydrophobicContact CG2-CB 3.9Å; T363-E520 PolarHBondContact N-OE2 3.43Å; T363-E520 PolarHBondContact OG1-OE2 2.91Å; I448-E520 HydrophobicContact CD1-CB 4.19Å; R516-E520 WeakPolarHBondContact CD-OE1 3.32Å; R516-E520 HydrophobicContact CG-CG 4.49Å; R516-E520 WeakPolarHBondContact CG-OE1 3.34Å; R516-E520 IonicContact CZ-OE1 2.6Å; R516-E520 IonicContact NE-OE1 2.74Å; R516-E520 PolarHBondContact NE-OE1 3.41Å; R516-E520 IonicContact NH2-OE1 2.74Å; R516-E520 WeakPolarHBondContact O-CG 3.26Å; R516-E520 PolarHBondContact O-N 3.25Å; V517-E520 PolarHBondContact O-N 2.84Å; E520-K522 PolarHBondContact O-N 2.77Å; E520-W523 HydrophobicContact CB-CE3 4.24Å; E520-W523 HydrophobicContact CB-CZ3 4.41Å; E520-W523 HydrophobicContact CG-CE3 4.04Å; E520-W523 HydrophobicContact CG-CH2 3.93Å; E520-W523 HydrophobicContact CG-CZ2 4.42Å; E520-W523 HydrophobicContact CG-CZ3 3.71Å; E520-W523 PolarHBondContact O-N 2.84Å
521	L	92.9	Very high	84.4	Confident	27 Å²	27	75.6 Å²	75.6	14%	0.141	33%	0.332	C	S	.	.	H	α-helix	trans	-68.5	-13.7	172.2	-72.1	174.1	0	0	0	114	I448 W471 V517 C519	I448-L521 HydrophobicContact CD1-CD2 3.68Å; I448-L521 HydrophobicContact CD1-CG 3.81Å; I448-L521 HydrophobicContact CG1-CD2 4.27Å; W471-L521 HydrophobicContact CB-CD1 3.7Å; W471-L521 HydrophobicContact CD2-CD1 4.44Å; W471-L521 HydrophobicContact CG-CD1 3.72Å; V517-L521 HydrophobicContact CG1-CD1 3.73Å; V517-L521 HydrophobicContact CG1-CG 4.16Å; V517-L521 WeakPolarHBondContact O-CB 3.43Å; V517-L521 VanDerWaalsContact O-CG 3.25Å; V517-L521 WeakPolarHBondContact O-CG 3.41Å; V517-L521 PolarHBondContact O-N 3.17Å; C519-L521 VanDerWaalsContact C-N 3.34Å; C519-L521 PolarHBondContact O-N 3.21Å
522	K	90	Very high	83.6	Confident	110 Å²	110	77.2 Å²	77.2	48%	0.478	34%	0.339	S	S	.	.	H	α-helix	trans	-86.7	-37.3	171.8	-70.3	162.9	-170.4	162.1	0	111.6	F518 C519 E520 R524 K525 E526	F518-K522 WeakPolarHBondContact O-CD 3.44Å; F518-K522 VanDerWaalsContact O-CE 3.24Å; F518-K522 WeakPolarHBondContact O-CE 3.32Å; F518-K522 VanDerWaalsContact O-CG 3.27Å; F518-K522 WeakPolarHBondContact O-CG 3.47Å; C519-K522 WeakPolarHBondContact O-CB 3.48Å; C519-K522 PolarHBondContact O-N 3Å; E520-K522 PolarHBondContact O-N 2.77Å; K522-R524 VanDerWaalsContact C-N 3.26Å; K522-R524 PolarHBondContact O-N 2.81Å; K522-K525 WeakPolarHBondContact O-CA 2.93Å; K522-K525 WeakPolarHBondContact O-CB 2.85Å; K522-K525 PolarHBondContact O-N 3.04Å; K522-E526 PolarHBondContact O-N 3.49Å
523	W	88	Confident	82.8	Confident	68 Å²	68	78.9 Å²	78.9	26%	0.258	35%	0.345	S	S	.	.	H	α-helix	trans	-52.7	-47.5	174.8	-53.8	-17.4	0	0	0	110.6	Y317 L361 E366 C519 E520 K525 E526	Y317-W523 HydrophobicContact CE1-CH2 4.38Å; Y317-W523 HydrophobicContact CE1-CZ3 4.14Å; L361-W523 HydrophobicContact CD1-CZ3 4.24Å; E366-W523 HydrophobicContact CG-CE3 3.78Å; E366-W523 HydrophobicContact CG-CZ3 3.91Å; C519-W523 PolarHBondContact O-N 2.98Å; E520-W523 HydrophobicContact CB-CE3 4.24Å; E520-W523 HydrophobicContact CB-CZ3 4.41Å; E520-W523 HydrophobicContact CG-CE3 4.04Å; E520-W523 HydrophobicContact CG-CH2 3.93Å; E520-W523 HydrophobicContact CG-CZ2 4.42Å; E520-W523 HydrophobicContact CG-CZ3 3.71Å; E520-W523 PolarHBondContact O-N 2.84Å; W523-K525 PolarHBondContact O-N 2.92Å; W523-E526 PolarHBondContact O-N 3.27Å; W523-E526 VanDerWaalsContact O-N 3.07Å
524	R	69.6	Low	81.7	Confident	116 Å²	116	84.2 Å²	84.2	44%	0.438	37%	0.368	S	S	.	.	H	α-helix	trans	-60.9	-11	174.8	-58.3	-177.9	80.3	-149.1	11.2	115.9	T363 E365 K522	T363-R524 HydrophobicContact CG2-CG 4.49Å; E365-R524 IonicContact OE1-CZ 3.48Å; E365-R524 IonicContact OE1-NE 3.22Å; E365-R524 PolarHBondContact OE1-NE 3Å; E365-R524 IonicContact OE1-NH2 3.43Å; E365-R524 PolarHBondContact OE1-NH2 2.91Å; K522-R524 VanDerWaalsContact C-N 3.26Å; K522-R524 PolarHBondContact O-N 2.81Å
525	K	65.6	Low	80.6	Confident	160 Å²	160	90.2 Å²	90.2	70%	0.696	39%	0.394	S	S	*	.	H	α-helix	trans	-106.2	-7.5	179	-68.9	179.1	-179.1	178.6	0	113.1	K522 W523	K522-K525 WeakPolarHBondContact O-CA 2.93Å; K522-K525 WeakPolarHBondContact O-CB 2.85Å; K522-K525 PolarHBondContact O-N 3.04Å; W523-K525 PolarHBondContact O-N 2.92Å
526	E	56.9	Low	79.3	Confident	160 Å²	160	90.4 Å²	90.4	75%	0.748	39%	0.393	S	S	*	.	H	α-helix	trans	-98.7	-4.4	177.9	-67.9	173.6	-171.8	0	0	111.8	K522 W523	K522-E526 PolarHBondContact O-N 3.49Å; W523-E526 PolarHBondContact O-N 3.27Å; W523-E526 VanDerWaalsContact O-N 3.07Å
527	E	49.3	Very low	77.9	Confident	149 Å²	149	94.8 Å²	94.8	70%	0.696	41%	0.414	S	S	*	.			trans	-93.9	3.5	174	-61.1	-167.1	120.1	0	0	114.8
528	Y	39.3	Very low	76.1	Confident	263 Å²	263	103.4 Å²	103.4	100%	1.031	45%	0.452	S	S	*	.			trans	-130.2	0	-176	-76.4	-77.4	0	0	0	113.3

Retrieved 528 of 528 residues in 478 ms (Link to these results)

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