A0A061AJ20_CAEEL Loading...

Dual specificity tyrosine-phosphorylation-regulated kinase mbk-2

Required for oocyte-to-zygote transition in which it phosphorylates oocyte proteins, including mei-1, oma-1, oma-2, mex-5, and mex-6, modifying their activity and/or stability following meiosis. Through phosphorylation of P granule components including meg-1, promotes the disassembly of zygotic P granules in the anterior cytoplasm during zygote polarization, and thus plays a role in P granule distribution and segregation in early stage embryos following meiosis. Functions in both spindle positioning and in the posterior localization of cytoplasmic determinants, including pie-1, pos-1, and pgl-1, in early embryos. Involved in the asymmetric distribution of plk-1 at the 2-cell embryonic stage.

AlphaFold DB , UniProt , Accession A0A061AJ20, Species CAEEL (Caenorhabditis elegans), Gene mbk-2, Length 469 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	32.1	Very low	29.8	Very low	236 Å²	236	145.4 Å²	145.4	100%	1.163	83%	0.83	S	S	*	*				0	119	0	-65.2	172.4	-178.8	0	0	105.5
2	T	30.9	Very low	29.6	Very low	117 Å²	117	146.8 Å²	146.8	72%	0.718	83%	0.831	S	S	*	*			cis	-168.8	133.8	12.8	7.8	0	0	0	0	107
3	Q	28.3	Very low	29.3	Very low	169 Å²	169	142.5 Å²	142.5	79%	0.79	82%	0.817	S	S	*	*			trans	57.4	124.9	141.6	-61.5	177.4	0.6	0	0	119.8
4	S	28.4	Very low	29.1	Very low	108 Å²	108	139.6 Å²	139.6	76%	0.755	82%	0.818	S	S	*	*				72.7	141.8	52.7	-173.7	0	0	0	0	115.2
5	I	30.8	Very low	29	Very low	159 Å²	159	138.3 Å²	138.3	82%	0.815	82%	0.82	S	S	*	*			trans	118.7	125.3	167.5	-59.6	155.9	0	0	0	110.7
6	G	27.1	Very low	29	Very low	71 Å²	71	141 Å²	141	73%	0.732	82%	0.821	S	S	*	*			cis	143.3	118.4	2.6	0	0	0	0	0	111.6
7	G	25	Very low	28.7	Very low	78 Å²	78	139.8 Å²	139.8	80%	0.804	82%	0.822	S	S	*	*			trans	58.8	173.4	152.2	0	0	0	0	0	120.7
8	P	39.9	Very low	28.5	Very low	134 Å²	134	139.1 Å²	139.1	87%	0.87	82%	0.82	S	S	*	*			cis	-135.7	173.1	14.1	38.8	-19.2	0	0	0	118
9	N	29.4	Very low	28.4	Very low	145 Å²	145	141.2 Å²	141.2	78%	0.775	83%	0.826	S	S	*	*			trans	-54.1	161.6	174.1	-78.2	-32.5	0	0	0	117.8
10	K	29.7	Very low	28.2	Very low	217 Å²	217	141.7 Å²	141.7	94%	0.943	83%	0.825	S	S	*	*			trans	-150	138.3	131.4	-103.6	-179	-171.4	-177.5	0	113.3
11	H	26.6	Very low	28	Very low	165 Å²	165	141.8 Å²	141.8	76%	0.764	83%	0.828	S	S	*	*			trans	-83.8	165.1	-176.5	-97.3	-89.3	0	0	0	114.6
12	L	26.9	Very low	27.6	Very low	162 Å²	162	135.4 Å²	135.4	85%	0.848	81%	0.813	S	S	*	*				174.9	104.2	130	-90.2	146.9	0	0	0	108.7
13	S	25.4	Very low	27.2	Very low	92 Å²	92	134.6 Å²	134.6	64%	0.643	81%	0.812	S	S	*	*				86.4	108.2	82.3	73.4	0	0	0	0	115.4
14	A	27.6	Very low	27	Very low	101 Å²	101	132.7 Å²	132.7	84%	0.835	81%	0.812	S	S	*	*				85.3	144.1	113.7	0	0	0	0	0	114.3
15	S	26.3	Very low	27.1	Very low	120 Å²	120	135.8 Å²	135.8	84%	0.839	81%	0.814	S	S	*	*			cis	-165.8	161.9	34.4	48.2	0	0	0	0	113.4
16	H	29.2	Very low	26.8	Very low	182 Å²	182	135.6 Å²	135.6	84%	0.843	82%	0.815	S	S	*	*			trans	-67.7	156	174.5	-86	-83.5	0	0	0	116.1
17	S	24.8	Very low	26.7	Very low	120 Å²	120	140.1 Å²	140.1	84%	0.839	82%	0.819	S	S	*	*			trans	-153.9	123.3	137	62.5	0	0	0	0	112.1
18	T	25.4	Very low	26.6	Very low	128 Å²	128	145.1 Å²	145.1	79%	0.785	82%	0.823	S	S	*	*			trans	-82	146.6	173.8	9.4	0	0	0	0	111.7
19	L	25.5	Very low	25.9	Very low	178 Å²	178	147 Å²	147	93%	0.932	82%	0.821	S	S	*	*			trans	-146.7	121.7	153	-102.1	166.8	0	0	0	109.8
20	N	24	Very low	25.7	Very low	152 Å²	152	145.7 Å²	145.7	81%	0.813	82%	0.823	S	S	*	*			trans	-75.5	143	174	-98.6	-15.6	0	0	0	110.9
21	T	24.6	Very low	25.5	Very low	143 Å²	143	144.7 Å²	144.7	88%	0.877	82%	0.818	S	S	*	*			trans	-151.5	125.4	138.3	40.9	0	0	0	0	109.9
22	A	23.1	Very low	25.9	Very low	102 Å²	102	141.7 Å²	141.7	84%	0.843	81%	0.807	S	S	*	*			trans	-74.3	146.1	171.7	0	0	0	0	0	111.3
23	S	23.3	Very low	26	Very low	101 Å²	101	139.6 Å²	139.6	71%	0.706	80%	0.803	S	S	*	*				-172.4	142.9	121.6	85.8	0	0	0	0	112.8
24	T	24.2	Very low	26.1	Very low	128 Å²	128	144.2 Å²	144.2	79%	0.785	81%	0.811	S	S	*	*			trans	65.5	104.3	145	53.5	0	0	0	0	120.2
25	H	30.2	Very low	26.4	Very low	174 Å²	174	142 Å²	142	81%	0.806	79%	0.79	S	S	*	*			trans	-32.3	127.8	146.3	-95	-92.7	0	0	0	113.2
26	D	24.4	Very low	26.5	Very low	155 Å²	155	141.6 Å²	141.6	83%	0.829	78%	0.784	S	S	*	*			trans	-141.2	108.1	150.5	-124.2	-15.3	0	0	0	109.3	M28	D26-M28 PolarHBondContact O-N 3.18Å
27	M	24.7	Very low	26.7	Very low	165 Å²	165	138 Å²	138	81%	0.813	78%	0.779	S	S	*	*			trans	-74.6	98.5	175	-80.5	174.4	125.3	0	0	108.7	H29	M27-H29 PolarHBondContact O-N 3.16Å; M27-H29 VanDerWaalsContact O-N 3.16Å
28	M	24	Very low	27.2	Very low	183 Å²	183	138.3 Å²	138.3	90%	0.901	77%	0.772	S	S	*	*			trans	-74.7	102.3	166	-77.6	-168.7	176.9	0	0	109.9	D26 S30	D26-M28 PolarHBondContact O-N 3.18Å; M28-S30 PolarHBondContact O-N 3.09Å; M28-S30 VanDerWaalsContact O-N 3.09Å
29	H	25	Very low	27.6	Very low	175 Å²	175	140.9 Å²	140.9	81%	0.81	78%	0.775	S	S	*	*			trans	-55.4	109.4	160.3	-84.3	-74	0	0	0	109.7	M27 K31	M27-H29 PolarHBondContact O-N 3.16Å; M27-H29 VanDerWaalsContact O-N 3.16Å; H29-K31 PolarHBondContact O-N 2.99Å
30	S	24.7	Very low	27.7	Very low	117 Å²	117	137.2 Å²	137.2	82%	0.818	76%	0.764	S	S	*	*			trans	-68.7	101.6	171.4	72.4	0	0	0	0	109.2	M28 I32	M28-S30 PolarHBondContact O-N 3.09Å; M28-S30 VanDerWaalsContact O-N 3.09Å; S30-I32 PolarHBondContact O-N 3.24Å
31	K	26	Very low	28	Very low	196 Å²	196	137 Å²	137	85%	0.852	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-66.3	128.6	170.5	-75.3	178.2	177.4	173.6	0	109.3	H29	H29-K31 PolarHBondContact O-N 2.99Å
32	I	35.4	Very low	28.3	Very low	102 Å²	102	136.1 Å²	136.1	52%	0.523	76%	0.761	S	S	.	*	P	Polyproline II helix	trans	-54.5	135.4	167.2	-60.6	168.3	0	0	0	108.2	S30 K34	S30-I32 PolarHBondContact O-N 3.24Å; I32-K34 PolarHBondContact O-N 2.9Å; I32-K34 VanDerWaalsContact O-N 3.15Å
33	P	27.7	Very low	28.6	Very low	117 Å²	117	141.7 Å²	141.7	76%	0.76	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-62.2	119.4	172.1	-14.4	27.2	0	0	0	108.9	S35	P33-S35 PolarHBondContact O-N 3.32Å
34	K	27.6	Very low	28.9	Very low	190 Å²	190	141.6 Å²	141.6	83%	0.826	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-57.6	129	169.2	-71.4	-177.9	175.2	-176.3	0	108.2	I32	I32-K34 PolarHBondContact O-N 2.9Å; I32-K34 VanDerWaalsContact O-N 3.15Å
35	S	34.4	Very low	29.1	Very low	55 Å²	55	144.7 Å²	144.7	39%	0.385	77%	0.765	S	S	.	*	P	Polyproline II helix	trans	-54.3	139.4	160.6	38.6	0	0	0	0	108.3	P33 S37	P33-S35 PolarHBondContact O-N 3.32Å; S35-S37 PolarHBondContact O-N 3.45Å
36	P	29.1	Very low	29	Very low	111 Å²	111	142.5 Å²	142.5	72%	0.721	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-55.4	130.2	173.1	-18.8	30	0	0	0	108.8	N38	P36-N38 PolarHBondContact O-N 3Å
37	S	31.8	Very low	29.2	Very low	106 Å²	106	140.7 Å²	140.7	74%	0.741	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-53.6	131.1	173.6	42.3	0	0	0	0	110.4	S35 E39	S35-S37 PolarHBondContact O-N 3.45Å; S37-E39 PolarHBondContact O-N 3.37Å
38	N	36.5	Very low	29.4	Very low	127 Å²	127	138.3 Å²	138.3	68%	0.679	76%	0.763	S	S	*	*	S	Bend	trans	-61.5	80.1	168.8	-95	-18.5	0	0	0	110.7	P36	P36-N38 PolarHBondContact O-N 3Å
39	E	33.5	Very low	29.8	Very low	182 Å²	182	135.3 Å²	135.3	85%	0.85	76%	0.76	S	S	*	*			trans	-138.8	75.8	159	-80.9	-159.1	159.8	0	0	109.4	S37	S37-E39 PolarHBondContact O-N 3.37Å
40	S	27.4	Very low	29.8	Very low	100 Å²	100	130.8 Å²	130.8	70%	0.699	76%	0.761	S	S	*	*	S	Bend	trans	-154.7	127.2	152.9	56.7	0	0	0	0	110.2
41	L	30	Very low	29.9	Very low	149 Å²	149	128.8 Å²	128.8	78%	0.78	76%	0.758	S	S	*	*			trans	91.5	61	170.4	-53.9	163.7	0	0	0	116.9
42	S	30.6	Very low	30	Very low	123 Å²	123	125.5 Å²	125.5	86%	0.86	76%	0.76	S	S	*	*			trans	-83.5	109.2	136.3	51	0	0	0	0	108.2
43	R	30.7	Very low	30	Very low	220 Å²	220	130.5 Å²	130.5	83%	0.83	78%	0.781	S	S	*	*			trans	-129	122.7	162.1	-82.7	-169.6	179.8	-175	0.6	110.7
44	S	28.9	Very low	30	Very low	99 Å²	99	128.2 Å²	128.2	69%	0.692	78%	0.78	S	S	*	*			trans	-39	123.4	173.5	48.8	0	0	0	0	115.2	T46	S44-T46 PolarHBondContact O-N 3.47Å
45	H	27.6	Very low	30.3	Very low	193 Å²	193	123.1 Å²	123.1	89%	0.894	78%	0.78	S	S	*	*			trans	-78.6	104.9	152.1	-73.4	-68.3	0	0	0	108.3
46	T	28	Very low	30.1	Very low	127 Å²	127	129.2 Å²	129.2	78%	0.779	80%	0.802	S	S	*	*			trans	-103.8	105.7	164.9	49.6	0	0	0	0	108.4	S44	S44-T46 PolarHBondContact O-N 3.47Å
47	S	29.8	Very low	30.3	Very low	117 Å²	117	132 Å²	132	82%	0.818	81%	0.812	S	S	*	*			trans	-107.5	119.3	162.5	54.8	0	0	0	0	108.4	S49	S47-S49 PolarHBondContact O-N 2.98Å
48	S	29.3	Very low	30.4	Very low	115 Å²	115	132.2 Å²	132.2	80%	0.804	81%	0.813	S	S	*	*			trans	-73.2	117.1	177.6	50.5	0	0	0	0	112
49	S	30.8	Very low	30.5	Very low	121 Å²	121	133.5 Å²	133.5	85%	0.846	82%	0.82	S	S	*	*			trans	21.3	122.8	144.4	57.7	0	0	0	0	121.5	S47	S47-S49 PolarHBondContact O-N 2.98Å
50	G	26.6	Very low	31	Very low	80 Å²	80	130.2 Å²	130.2	83%	0.825	82%	0.817	S	S	*	*			trans	-156.8	112.6	146.3	0	0	0	0	0	108.1
51	G	26.5	Very low	31.9	Very low	74 Å²	74	128.4 Å²	128.4	76%	0.763	81%	0.814	S	S	*	*			trans	-77.3	155.2	-164.9	0	0	0	0	0	115.7
52	S	27.8	Very low	33.4	Very low	127 Å²	127	125.6 Å²	125.6	89%	0.888	81%	0.807	S	S	*	*			trans	-176	138.6	136.1	-79.2	0	0	0	0	109.4
53	Q	34.9	Very low	35.7	Very low	207 Å²	207	122.6 Å²	122.6	97%	0.967	78%	0.781	S	S	*	*			trans	-61.6	136.2	-176.3	-67.6	179.5	-5.7	0	0	112.2
54	G	27.9	Very low	38.5	Very low	70 Å²	70	116.5 Å²	116.5	72%	0.722	77%	0.772	S	S	*	*			trans	-179.6	101	171.3	0	0	0	0	0	110	H56	G54-H56 PolarHBondContact O-N 3.27Å; G54-H56 VanDerWaalsContact O-N 3.11Å
55	G	33.3	Very low	41.6	Very low	82 Å²	82	112.1 Å²	112.1	85%	0.845	74%	0.742	S	S	*	*			trans	-66	106.8	179.9	0	0	0	0	0	111.9
56	H	30.9	Very low	44.9	Very low	183 Å²	183	107 Å²	107	85%	0.847	72%	0.718	S	S	*	*			trans	-126.8	111.9	161.5	-89.3	-28.2	0	0	0	110.4	G54 S58	G54-H56 PolarHBondContact O-N 3.27Å; G54-H56 VanDerWaalsContact O-N 3.11Å; H56-S58 PolarHBondContact O-N 3.36Å; H56-S58 VanDerWaalsContact O-N 3.15Å
57	N	34.2	Very low	48.2	Very low	171 Å²	171	107.1 Å²	107.1	91%	0.914	70%	0.704	S	S	*	*			trans	-67	101.5	177.2	-141	6	0	0	0	108.9
58	S	34	Very low	51.5	Low	109 Å²	109	102 Å²	102	76%	0.762	67%	0.668	S	S	*	*			trans	-107.8	83.6	171.6	51.4	0	0	0	0	109.5	H56 S60	H56-S58 PolarHBondContact O-N 3.36Å; H56-S58 VanDerWaalsContact O-N 3.15Å; S58-S60 PolarHBondContact O-N 3.41Å; S58-S60 VanDerWaalsContact O-N 3.08Å
59	N	38.1	Very low	54.7	Low	154 Å²	154	100.4 Å²	100.4	82%	0.824	65%	0.648	S	S	*	*			trans	-77.7	89	176.2	-153	16.2	0	0	0	109.2	G61	N59-G61 PolarHBondContact O-N 3.33Å
60	S	44.5	Very low	57.9	Low	114 Å²	114	97.6 Å²	97.6	80%	0.797	62%	0.623	S	S	*	*			trans	-90.9	75.5	168.5	53.2	0	0	0	0	109.5	S58 S62	S58-S60 PolarHBondContact O-N 3.41Å; S58-S60 VanDerWaalsContact O-N 3.08Å; S60-S62 PolarHBondContact O-N 2.99Å; S60-S62 VanDerWaalsContact O-N 3.13Å
61	G	46	Very low	61.2	Low	61 Å²	61	93.8 Å²	93.8	63%	0.629	58%	0.584	S	S	*	*			trans	-69.5	105.2	180	0	0	0	0	0	111.7	N59 N63	N59-G61 PolarHBondContact O-N 3.33Å; G61-N63 PolarHBondContact O-N 2.95Å
62	S	60	Low	64.6	Low	91 Å²	91	91.9 Å²	91.9	64%	0.636	56%	0.558	S	S	*	*			trans	-65.1	125	166.5	62.4	0	0	0	0	109.4	S60 S64	S60-S62 PolarHBondContact O-N 2.99Å; S60-S62 VanDerWaalsContact O-N 3.13Å; S62-S64 PolarHBondContact O-N 3.15Å
63	N	80.3	Confident	67.9	Low	60 Å²	60	93.7 Å²	93.7	32%	0.321	55%	0.552	S	S	.	*			trans	-58.9	121.8	172.8	179.4	-0.4	0	0	0	108.9	G61 G65 F94 H154	G61-N63 PolarHBondContact O-N 2.95Å; N63-G65 VanDerWaalsContact C-N 3.29Å; N63-G65 PolarHBondContact O-N 3.25Å; N63-G65 PolarHBondContact OD1-N 3.36Å; N63-G65 VanDerWaalsContact OD1-N 3.15Å; N63-F94 VanDerWaalsContact O-CE1 3.27Å; N63-F94 WeakPolarHBondContact O-CE1 3.4Å; N63-H154 WeakPolarHBondContact CB-O 3.44Å; N63-H154 PolarHBondContact ND2-O 3.4Å
64	S	89.3	Confident	70.8	Confident	91 Å²	91	87.8 Å²	87.8	64%	0.636	53%	0.53	S	S	*	.			trans	-76.1	-15.9	-174.3	55.6	0	0	0	0	113.8	S62 R92	S62-S64 PolarHBondContact O-N 3.15Å; S64-R92 PolarHBondContact O-NH1 3.49Å
65	G	94.3	Very high	74.1	Confident	7 Å²	7	87 Å²	87	7%	0.072	51%	0.507	C	S	.	.			trans	65.7	154.3	-179.1	0	0	0	0	0	114	N63 R92 V93	N63-G65 VanDerWaalsContact C-N 3.29Å; N63-G65 PolarHBondContact O-N 3.25Å; N63-G65 PolarHBondContact OD1-N 3.36Å; N63-G65 VanDerWaalsContact OD1-N 3.15Å; G65-R92 PolarHBondContact O-NH1 3.33Å; G65-V93 CarbonylContact C-O 3.58Å; G65-V93 WeakPolarHBondContact CA-O 3.45Å
66	F	97.1	Very high	77	Confident	87 Å²	87	83.8 Å²	83.8	38%	0.382	47%	0.474	S	S	.	.	B	Isolated β-bridge	trans	-76.5	150.9	175.4	-67	-90	0	0	0	111	D70 A71 F75 R92 V93	F66-D70 HydrophobicContact CB-CB 4.43Å; F66-D70 HydrophobicContact CD1-CB 4.1Å; F66-A71 HydrophobicContact CB-CB 3.91Å; F66-F75 HydrophobicContact CD2-CE2 4.01Å; F66-F75 AromaticContact CE2-CE2 3.88Å; F66-F75 HydrophobicContact CE2-CE2 3.88Å; F66-F75 HydrophobicContact CE2-CZ 4.07Å; F66-F75 HydrophobicContact CG-CE2 4.5Å; F66-F75 HydrophobicContact CZ-CE2 4.26Å; F66-F75 HydrophobicContact CZ-CZ 4.31Å; F66-R92 WeakPolarHBondContact O-CA 3.35Å; F66-V93 HydrophobicContact CB-CB 4.41Å; F66-V93 PolarHBondContact N-O 3.35Å; F66-V93 PolarHBondContact O-N 3.15Å
67	R	97.6	Very high	80.1	Confident	129 Å²	129	80 Å²	80	49%	0.487	47%	0.474	S	S	.	.			trans	-68.9	154.8	159.2	-60.9	177.2	56.8	-160.2	-10.5	108.9	E69 D70 A71	R67-E69 VanDerWaalsContact C-N 3.25Å; R67-E69 IonicContact CZ-OE2 3.72Å; R67-E69 IonicContact NE-OE2 3.67Å; R67-E69 PolarHBondContact NE-OE2 2.95Å; R67-E69 IonicContact NH2-OE2 3.43Å; R67-E69 PolarHBondContact NH2-OE2 2.97Å; R67-E69 PolarHBondContact O-N 3.31Å; R67-D70 WeakPolarHBondContact CB-OD2 3.08Å; R67-D70 PolarHBondContact O-N 3.05Å; R67-A71 WeakPolarHBondContact O-CB 3.14Å; R67-A71 PolarHBondContact O-N 3.22Å
68	P	97.3	Very high	83.1	Confident	10 Å²	10	77.5 Å²	77.5	7%	0.065	46%	0.455	C	S	.	.	H	α-helix	trans	-54.9	-40.3	178.8	-29.7	38.9	0	0	0	113.4	A71 V72 Y88 Y90	P68-A71 PolarHBondContact O-N 3.15Å; P68-V72 WeakPolarHBondContact O-CG2 2.94Å; P68-V72 PolarHBondContact O-N 3.37Å; P68-Y88 HydrophobicContact CB-CD1 3.66Å; P68-Y88 HydrophobicContact CB-CE1 3.99Å; P68-Y88 HydrophobicContact CB-CG 4.38Å; P68-Y90 WeakPolarHBondContact CG-O 3.39Å
69	E	97.4	Very high	86.1	Confident	80 Å²	80	72.8 Å²	72.8	37%	0.374	42%	0.421	S	S	.	.	H	α-helix	trans	-60.4	-50	178.1	-60.8	75.9	-148	0	0	111.4	R67 A71 V72 Q73 Y88	R67-E69 VanDerWaalsContact C-N 3.25Å; R67-E69 IonicContact CZ-OE2 3.72Å; R67-E69 IonicContact NE-OE2 3.67Å; R67-E69 PolarHBondContact NE-OE2 2.95Å; R67-E69 IonicContact NH2-OE2 3.43Å; R67-E69 PolarHBondContact NH2-OE2 2.97Å; R67-E69 PolarHBondContact O-N 3.31Å; E69-A71 VanDerWaalsContact C-N 3.31Å; E69-A71 PolarHBondContact O-N 3.17Å; E69-V72 PolarHBondContact O-N 3.17Å; E69-Q73 PolarHBondContact O-N 3.38Å; E69-Y88 HydrophobicContact CG-CE1 4.21Å
70	D	97.3	Very high	88.9	Confident	62 Å²	62	66.6 Å²	66.6	33%	0.332	39%	0.389	S	S	.	.	H	α-helix	trans	-64.8	-37.3	179.7	-52.9	-34	0	0	0	111.1	F66 R67 Q73 T74	F66-D70 HydrophobicContact CB-CB 4.43Å; F66-D70 HydrophobicContact CD1-CB 4.1Å; R67-D70 WeakPolarHBondContact CB-OD2 3.08Å; R67-D70 PolarHBondContact O-N 3.05Å; D70-Q73 PolarHBondContact O-N 3.5Å; D70-T74 VanDerWaalsContact O-CB 3.27Å; D70-T74 WeakPolarHBondContact O-CB 3.41Å; D70-T74 PolarHBondContact O-N 3.07Å; D70-T74 PolarHBondContact O-OG1 2.68Å
71	A	97.3	Very high	91.3	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-66.8	-41.4	177.1	0	0	0	0	0	112	F66 R67 P68 E69 T74 F75 I87 V93	F66-A71 HydrophobicContact CB-CB 3.91Å; R67-A71 WeakPolarHBondContact O-CB 3.14Å; R67-A71 PolarHBondContact O-N 3.22Å; P68-A71 PolarHBondContact O-N 3.15Å; E69-A71 VanDerWaalsContact C-N 3.31Å; E69-A71 PolarHBondContact O-N 3.17Å; A71-T74 PolarHBondContact O-N 3.28Å; A71-F75 HydrophobicContact CB-CD2 4.38Å; A71-F75 WeakPolarHBondContact O-CA 3.21Å; A71-F75 WeakPolarHBondContact O-CB 3.42Å; A71-F75 WeakPolarHBondContact O-CD2 3.21Å; A71-F75 PolarHBondContact O-N 3.3Å; A71-I87 HydrophobicContact CB-CD1 3.88Å; A71-V93 HydrophobicContact CB-CB 3.85Å; A71-V93 HydrophobicContact CB-CG1 3.77Å; A71-V93 HydrophobicContact CB-CG2 3.99Å
72	V	97.3	Very high	93.6	Very high	35 Å²	35	64.7 Å²	64.7	21%	0.212	36%	0.358	C	S	.	.	H	α-helix	trans	-66.3	-40.3	174.4	172	0	0	0	0	110.7	P68 E69 G76 L79 I87 Y88	P68-V72 WeakPolarHBondContact O-CG2 2.94Å; P68-V72 PolarHBondContact O-N 3.37Å; E69-V72 PolarHBondContact O-N 3.17Å; V72-G76 WeakPolarHBondContact O-CA 3.39Å; V72-G76 PolarHBondContact O-N 2.91Å; V72-L79 HydrophobicContact CG2-CD1 4.26Å; V72-I87 HydrophobicContact CG2-CD1 4.19Å; V72-I87 HydrophobicContact CG2-CG2 3.57Å; V72-Y88 HydrophobicContact CG2-CE2 4.24Å
73	Q	97	Very high	95.4	Very high	164 Å²	164	60.4 Å²	60.4	77%	0.766	33%	0.328	S	S	*	.	H	α-helix	trans	-63.2	-42.7	175.9	-174	176.6	4.2	0	0	111.8	E69 D70	E69-Q73 PolarHBondContact O-N 3.38Å; D70-Q73 PolarHBondContact O-N 3.5Å
74	T	96.6	Very high	96.1	Very high	84 Å²	84	61.9 Å²	61.9	52%	0.515	33%	0.332	S	S	.	.	H	α-helix	trans	-78.8	-41.8	-175.4	-53.7	0	0	0	0	112.3	D70 A71	D70-T74 VanDerWaalsContact O-CB 3.27Å; D70-T74 WeakPolarHBondContact O-CB 3.41Å; D70-T74 PolarHBondContact O-N 3.07Å; D70-T74 PolarHBondContact O-OG1 2.68Å; A71-T74 PolarHBondContact O-N 3.28Å
75	F	96.7	Very high	96.3	Very high	54 Å²	54	62.4 Å²	62.4	24%	0.237	33%	0.328	C	S	.	.	H	α-helix	trans	-116.6	4.2	-169.5	-53.2	-68.7	0	0	0	113.9	F66 A71 A77 K78 L79 V96	F66-F75 HydrophobicContact CD2-CE2 4.01Å; F66-F75 AromaticContact CE2-CE2 3.88Å; F66-F75 HydrophobicContact CE2-CE2 3.88Å; F66-F75 HydrophobicContact CE2-CZ 4.07Å; F66-F75 HydrophobicContact CG-CE2 4.5Å; F66-F75 HydrophobicContact CZ-CE2 4.26Å; F66-F75 HydrophobicContact CZ-CZ 4.31Å; A71-F75 HydrophobicContact CB-CD2 4.38Å; A71-F75 WeakPolarHBondContact O-CA 3.21Å; A71-F75 WeakPolarHBondContact O-CB 3.42Å; A71-F75 WeakPolarHBondContact O-CD2 3.21Å; A71-F75 PolarHBondContact O-N 3.3Å; F75-A77 PolarHBondContact O-N 3.1Å; F75-K78 WeakPolarHBondContact O-CA 3.24Å; F75-K78 WeakPolarHBondContact O-CB 3.32Å; F75-K78 PolarHBondContact O-N 3.43Å; F75-L79 PolarHBondContact O-N 2.96Å; F75-V96 HydrophobicContact CB-CG1 4.49Å; F75-V96 HydrophobicContact CB-CG2 3.95Å; F75-V96 HydrophobicContact CD1-CG2 4.06Å; F75-V96 HydrophobicContact CD2-CG1 4.12Å; F75-V96 HydrophobicContact CD2-CG2 4.13Å; F75-V96 HydrophobicContact CG-CG1 4.45Å; F75-V96 HydrophobicContact CG-CG2 3.78Å
76	G	94.8	Very high	96.4	Very high	14 Å²	14	62.9 Å²	62.9	14%	0.144	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-26	-171.4	0	0	0	0	0	115.4	V72 K78 K84	V72-G76 WeakPolarHBondContact O-CA 3.39Å; V72-G76 PolarHBondContact O-N 2.91Å; G76-K78 PolarHBondContact O-N 2.96Å; G76-K84 WeakPolarHBondContact O-CE 3.1Å; G76-K84 PolarHBondContact O-NZ 2.76Å
77	A	96.2	Very high	96.5	Very high	102 Å²	102	58.8 Å²	58.8	84%	0.843	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-15.1	173.1	0	0	0	0	0	113.8	F75	F75-A77 PolarHBondContact O-N 3.1Å
78	K	96.7	Very high	96.4	Very high	120 Å²	120	58.2 Å²	58.2	52%	0.522	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-7	179.7	-56.2	-60.6	-175.4	-177	0	113.2	F75 G76	F75-K78 WeakPolarHBondContact O-CA 3.24Å; F75-K78 WeakPolarHBondContact O-CB 3.32Å; F75-K78 PolarHBondContact O-N 3.43Å; G76-K78 PolarHBondContact O-N 2.96Å
79	L	96.7	Very high	96.4	Very high	10 Å²	10	60.7 Å²	60.7	5%	0.052	32%	0.322	C	S	.	.	S	Bend	trans	-90.5	138.1	178.1	-60.5	-179.6	0	0	0	111.2	V72 F75 E83 K84 I87 V96	V72-L79 HydrophobicContact CG2-CD1 4.26Å; F75-L79 PolarHBondContact O-N 2.96Å; L79-E83 WeakPolarHBondContact CA-OE2 3.4Å; L79-E83 HydrophobicContact CB-CB 4.09Å; L79-E83 HydrophobicContact CD2-CB 4.29Å; L79-K84 HydrophobicContact CB-CG 4.02Å; L79-I87 HydrophobicContact CD1-CD1 3.9Å; L79-V96 HydrophobicContact CD2-CB 3.98Å; L79-V96 HydrophobicContact CD2-CG1 4.2Å
80	V	96	Very high	96.4	Very high	23 Å²	23	58.9 Å²	58.9	14%	0.139	31%	0.311	C	S	.	.			trans	-74.5	159.1	171	-61.8	0	0	0	0	111	F82 E83 K84 K102	V80-F82 HydrophobicContact CG2-CB 4.31Å; V80-F82 PolarHBondContact O-N 2.94Å; V80-F82 VanDerWaalsContact O-N 3.14Å; V80-E83 HydrophobicContact CG2-CB 4.09Å; V80-E83 HydrophobicContact CG2-CG 3.61Å; V80-E83 PolarHBondContact N-OE2 2.77Å; V80-E83 WeakPolarHBondContact O-CB 3.43Å; V80-E83 PolarHBondContact O-N 3.3Å; V80-K84 PolarHBondContact O-N 3.15Å; V80-K102 HydrophobicContact CG1-CB 3.77Å; V80-K102 HydrophobicContact CG1-CD 4.12Å
81	P	94.6	Very high	96.3	Very high	94 Å²	94	61.1 Å²	61.1	61%	0.61	33%	0.328	S	S	*	.	H	α-helix	trans	-53.5	-37	-177.8	-29.2	36.4	0	0	0	114.5	K84 N85	P81-K84 PolarHBondContact O-N 3.14Å; P81-N85 PolarHBondContact O-ND2 2.97Å
82	F	95.6	Very high	96.3	Very high	41 Å²	41	66.6 Å²	66.6	18%	0.18	35%	0.348	C	S	.	.	H	α-helix	trans	-60	-47	174.4	-174.2	-89.9	0	0	0	112.1	V80 K84 N85 E86 I107 Y115 R206	V80-F82 HydrophobicContact CG2-CB 4.31Å; V80-F82 PolarHBondContact O-N 2.94Å; V80-F82 VanDerWaalsContact O-N 3.14Å; F82-K84 VanDerWaalsContact C-N 3.31Å; F82-K84 PolarHBondContact O-N 3.39Å; F82-N85 PolarHBondContact O-N 2.83Å; F82-N85 VanDerWaalsContact O-N 3.15Å; F82-E86 HydrophobicContact CD1-CB 4.16Å; F82-E86 HydrophobicContact CE1-CB 4Å; F82-E86 HydrophobicContact CE1-CG 4.18Å; F82-E86 PolarHBondContact O-N 3.43Å; F82-I107 HydrophobicContact CD2-CD1 4.47Å; F82-I107 HydrophobicContact CD2-CG1 3.69Å; F82-I107 HydrophobicContact CE2-CG1 3.62Å; F82-Y115 AromaticContact CD1-CE2 3.84Å; F82-Y115 HydrophobicContact CD1-CE2 3.84Å; F82-Y115 AromaticContact CD1-CZ 3.9Å; F82-Y115 WeakPolarHBondContact CD1-OH 3.39Å; F82-Y115 HydrophobicContact CD2-CE2 4.17Å; F82-Y115 AromaticContact CE1-CE2 3.73Å; F82-Y115 HydrophobicContact CE1-CE2 3.73Å; F82-Y115 HydrophobicContact CE2-CE2 4.07Å; F82-Y115 HydrophobicContact CG-CE2 4.07Å; F82-Y115 WeakPolarHBondContact CG-OH 3.48Å; F82-Y115 AromaticContact CZ-CE2 3.86Å; F82-Y115 HydrophobicContact CZ-CE2 3.86Å; F82-R206 HydrophobicContact CE1-CG 4.28Å
83	E	97.1	Very high	96.4	Very high	1 Å²	1	65 Å²	65	1%	0.005	34%	0.338	C	S	.	.	H	α-helix	trans	-64.8	-33.5	-178.5	-72.9	171.9	162.2	0	0	112.6	L79 V80 N85 E86 I87 K102 H129 Y132 R206	L79-E83 WeakPolarHBondContact CA-OE2 3.4Å; L79-E83 HydrophobicContact CB-CB 4.09Å; L79-E83 HydrophobicContact CD2-CB 4.29Å; V80-E83 HydrophobicContact CG2-CB 4.09Å; V80-E83 HydrophobicContact CG2-CG 3.61Å; V80-E83 PolarHBondContact N-OE2 2.77Å; V80-E83 WeakPolarHBondContact O-CB 3.43Å; V80-E83 PolarHBondContact O-N 3.3Å; E83-N85 PolarHBondContact O-N 2.94Å; E83-N85 VanDerWaalsContact O-N 3.17Å; E83-E86 PolarHBondContact O-N 3.27Å; E83-I87 VanDerWaalsContact O-CB 3.24Å; E83-I87 WeakPolarHBondContact O-CB 3.33Å; E83-I87 WeakPolarHBondContact O-CG2 3.06Å; E83-I87 PolarHBondContact O-N 2.94Å; E83-K102 IonicContact OE1-NZ 2.67Å; E83-K102 PolarHBondContact OE1-NZ 3.44Å; E83-K102 WeakPolarHBondContact OE2-CD 3.41Å; E83-K102 WeakPolarHBondContact OE2-CE 3.31Å; E83-K102 IonicContact OE2-NZ 3.58Å; E83-K102 PolarHBondContact OE2-NZ 3.03Å; E83-H129 IonicContact OE1-CD2 3.62Å; E83-H129 IonicContact OE1-NE2 2.87Å; E83-H129 PolarHBondContact OE1-NE2 2.82Å; E83-Y132 WeakPolarHBondContact CA-OH 3.33Å; E83-Y132 WeakPolarHBondContact CB-OH 3.36Å; E83-Y132 PolarHBondContact O-OH 3.37Å; E83-Y132 VanDerWaalsContact O-OH 3.07Å; E83-R206 IonicContact OE1-NH2 3.93Å; E83-R206 PolarHBondContact OE1-NH2 3.14Å
84	K	95	Very high	96.4	Very high	91 Å²	91	58.7 Å²	58.7	40%	0.396	31%	0.309	S	S	.	.	H	α-helix	trans	-60.8	-24.6	177.2	-66.9	-177.6	-179.3	-175.8	0	112.8	G76 L79 V80 P81 F82 Y88	G76-K84 WeakPolarHBondContact O-CE 3.1Å; G76-K84 PolarHBondContact O-NZ 2.76Å; L79-K84 HydrophobicContact CB-CG 4.02Å; V80-K84 PolarHBondContact O-N 3.15Å; P81-K84 PolarHBondContact O-N 3.14Å; F82-K84 VanDerWaalsContact C-N 3.31Å; F82-K84 PolarHBondContact O-N 3.39Å; K84-Y88 WeakPolarHBondContact O-CD2 3.23Å; K84-Y88 WeakPolarHBondContact O-CE2 3.37Å
85	N	94.3	Very high	96.5	Very high	103 Å²	103	56.5 Å²	56.5	55%	0.551	29%	0.292	S	S	*	.	H	α-helix	trans	-95.4	-43.3	174	-61.6	-52.9	0	0	0	111.6	P81 F82 E83 I87	P81-N85 PolarHBondContact O-ND2 2.97Å; F82-N85 PolarHBondContact O-N 2.83Å; F82-N85 VanDerWaalsContact O-N 3.15Å; E83-N85 PolarHBondContact O-N 2.94Å; E83-N85 VanDerWaalsContact O-N 3.17Å; N85-I87 VanDerWaalsContact C-N 3.3Å; N85-I87 PolarHBondContact O-N 3.39Å
86	E	96.6	Very high	96.5	Very high	17 Å²	17	54.3 Å²	54.3	8%	0.079	28%	0.283	C	S	.	.	H	α-helix	trans	-60.9	-36.7	-177.9	-179.4	-177.4	-132	0	0	112.8	F82 E83 Y88 N89 Y90 Y132 R206	F82-E86 HydrophobicContact CD1-CB 4.16Å; F82-E86 HydrophobicContact CE1-CB 4Å; F82-E86 HydrophobicContact CE1-CG 4.18Å; F82-E86 PolarHBondContact O-N 3.43Å; E83-E86 PolarHBondContact O-N 3.27Å; E86-Y88 PolarHBondContact O-N 3.48Å; E86-Y88 VanDerWaalsContact O-N 3.15Å; E86-N89 VanDerWaalsContact O-CB 3.31Å; E86-N89 WeakPolarHBondContact O-CB 2.93Å; E86-N89 PolarHBondContact O-N 2.87Å; E86-N89 PolarHBondContact O-ND2 3.04Å; E86-Y90 HydrophobicContact CG-CE2 4.04Å; E86-Y132 HydrophobicContact CG-CE2 4.12Å; E86-Y132 PolarHBondContact OE2-OH 2.88Å; E86-R206 WeakPolarHBondContact OE1-CG 3.43Å; E86-R206 IonicContact OE1-NE 3.75Å; E86-R206 PolarHBondContact OE1-NE 2.72Å; E86-R206 IonicContact OE2-CZ 3.69Å; E86-R206 IonicContact OE2-NE 2.88Å; E86-R206 PolarHBondContact OE2-NE 2.96Å; E86-R206 IonicContact OE2-NH2 2.82Å; E86-R206 PolarHBondContact OE2-NH2 3.04Å
87	I	97.6	Very high	96.7	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-58	-30.9	-173.7	-163.1	166.1	0	0	0	113.8	A71 V72 L79 E83 N85 N89 Y90 V93 Y132	A71-I87 HydrophobicContact CB-CD1 3.88Å; V72-I87 HydrophobicContact CG2-CD1 4.19Å; V72-I87 HydrophobicContact CG2-CG2 3.57Å; L79-I87 HydrophobicContact CD1-CD1 3.9Å; E83-I87 VanDerWaalsContact O-CB 3.24Å; E83-I87 WeakPolarHBondContact O-CB 3.33Å; E83-I87 WeakPolarHBondContact O-CG2 3.06Å; E83-I87 PolarHBondContact O-N 2.94Å; N85-I87 VanDerWaalsContact C-N 3.3Å; N85-I87 PolarHBondContact O-N 3.39Å; I87-N89 PolarHBondContact O-N 2.8Å; I87-Y90 PolarHBondContact O-N 3.24Å; I87-Y90 VanDerWaalsContact O-N 3.11Å; I87-V93 HydrophobicContact CD1-CG1 4.41Å; I87-V93 HydrophobicContact CD1-CG2 3.82Å; I87-V93 HydrophobicContact CG1-CG2 3.56Å; I87-Y132 HydrophobicContact CB-CE1 4.03Å; I87-Y132 HydrophobicContact CB-CE2 4.12Å; I87-Y132 HydrophobicContact CD1-CD1 4.14Å; I87-Y132 HydrophobicContact CD1-CE1 3.82Å; I87-Y132 HydrophobicContact CG1-CD1 4.09Å; I87-Y132 HydrophobicContact CG1-CE1 3.77Å; I87-Y132 HydrophobicContact CG1-CE2 4.24Å; I87-Y132 HydrophobicContact CG1-CG 4.43Å; I87-Y132 PolarHBondContact N-OH 3.09Å
88	Y	97.4	Very high	96.7	Very high	117 Å²	117	50.4 Å²	50.4	46%	0.459	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-72.3	-10.6	178.9	-66.8	-75.6	0	0	0	113.7	P68 E69 V72 K84 E86 Y90	P68-Y88 HydrophobicContact CB-CD1 3.66Å; P68-Y88 HydrophobicContact CB-CE1 3.99Å; P68-Y88 HydrophobicContact CB-CG 4.38Å; E69-Y88 HydrophobicContact CG-CE1 4.21Å; V72-Y88 HydrophobicContact CG2-CE2 4.24Å; K84-Y88 WeakPolarHBondContact O-CD2 3.23Å; K84-Y88 WeakPolarHBondContact O-CE2 3.37Å; E86-Y88 PolarHBondContact O-N 3.48Å; E86-Y88 VanDerWaalsContact O-N 3.15Å; Y88-Y90 PolarHBondContact O-N 2.79Å
89	N	96.8	Very high	96.6	Very high	63 Å²	63	53.1 Å²	53.1	34%	0.337	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-77.9	-7.8	170.7	-61.8	-40.4	0	0	0	112.7	E86 I87	E86-N89 VanDerWaalsContact O-CB 3.31Å; E86-N89 WeakPolarHBondContact O-CB 2.93Å; E86-N89 PolarHBondContact O-N 2.87Å; E86-N89 PolarHBondContact O-ND2 3.04Å; I87-N89 PolarHBondContact O-N 2.8Å
90	Y	96.9	Very high	96.6	Very high	41 Å²	41	53.4 Å²	53.4	16%	0.161	27%	0.265	C	S	.	.			trans	-109.3	131.9	-178.4	-65.5	-89.4	0	0	0	110.1	P68 E86 I87 Y88 R92 A131 Y132 F205	P68-Y90 WeakPolarHBondContact CG-O 3.39Å; E86-Y90 HydrophobicContact CG-CE2 4.04Å; I87-Y90 PolarHBondContact O-N 3.24Å; I87-Y90 VanDerWaalsContact O-N 3.11Å; Y88-Y90 PolarHBondContact O-N 2.79Å; Y90-R92 VanDerWaalsContact C-N 3.33Å; Y90-R92 PolarHBondContact O-N 2.79Å; Y90-A131 HydrophobicContact CD1-CB 4.47Å; Y90-A131 HydrophobicContact CE1-CB 3.65Å; Y90-Y132 HydrophobicContact CD1-CD2 4.31Å; Y90-Y132 AromaticContact CD2-CD2 3.32Å; Y90-Y132 HydrophobicContact CD2-CD2 3.32Å; Y90-Y132 AromaticContact CD2-CE2 3.5Å; Y90-Y132 HydrophobicContact CD2-CE2 3.5Å; Y90-Y132 AromaticContact CE2-CD2 3.61Å; Y90-Y132 HydrophobicContact CE2-CD2 3.61Å; Y90-Y132 AromaticContact CE2-CE2 3.6Å; Y90-Y132 HydrophobicContact CE2-CE2 3.6Å; Y90-Y132 AromaticContact CG-CD2 3.72Å; Y90-Y132 HydrophobicContact CG-CD2 3.72Å; Y90-Y132 HydrophobicContact CG-CE2 4.35Å; Y90-F205 WeakPolarHBondContact OH-CD2 3Å
91	T	95.8	Very high	96.6	Very high	110 Å²	110	61.6 Å²	61.6	68%	0.675	30%	0.299	S	S	*	.	S	Bend	trans	-72.7	-28.3	-178.7	52.9	0	0	0	0	113.1
92	R	97.1	Very high	96.6	Very high	114 Å²	114	58.7 Å²	58.7	43%	0.43	28%	0.277	S	S	.	.			trans	-141.4	140.7	179.5	-68.8	-67.3	-176.5	159.6	-4.3	110.4	S64 G65 F66 Y90 F94	S64-R92 PolarHBondContact O-NH1 3.49Å; G65-R92 PolarHBondContact O-NH1 3.33Å; F66-R92 WeakPolarHBondContact O-CA 3.35Å; Y90-R92 VanDerWaalsContact C-N 3.33Å; Y90-R92 PolarHBondContact O-N 2.79Å; R92-F94 HydrophobicContact CB-CD2 4.46Å; R92-F94 HydrophobicContact CB-CE1 4.42Å; R92-F94 HydrophobicContact CB-CE2 3.61Å; R92-F94 HydrophobicContact CB-CZ 3.58Å; R92-F94 HydrophobicContact CG-CZ 4.3Å
93	V	98.1	Very high	96.5	Very high	1 Å²	1	59.6 Å²	59.6	1%	0.006	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-114	115.5	178.2	172.9	0	0	0	0	108.6	G65 F66 A71 I87 V96 Y132	G65-V93 CarbonylContact C-O 3.58Å; G65-V93 WeakPolarHBondContact CA-O 3.45Å; F66-V93 HydrophobicContact CB-CB 4.41Å; F66-V93 PolarHBondContact N-O 3.35Å; F66-V93 PolarHBondContact O-N 3.15Å; A71-V93 HydrophobicContact CB-CB 3.85Å; A71-V93 HydrophobicContact CB-CG1 3.77Å; A71-V93 HydrophobicContact CB-CG2 3.99Å; I87-V93 HydrophobicContact CD1-CG1 4.41Å; I87-V93 HydrophobicContact CD1-CG2 3.82Å; I87-V93 HydrophobicContact CG1-CG2 3.56Å; V93-V96 HydrophobicContact CG1-CG1 3.53Å; V93-Y132 HydrophobicContact CG1-CD1 4.27Å; V93-Y132 HydrophobicContact CG2-CG 4.38Å
94	F	98.2	Very high	96.1	Very high	33 Å²	33	62.9 Å²	62.9	15%	0.145	31%	0.309	C	S	.	.	S	Bend	trans	-103.3	-28.5	179.9	-54	-88.3	0	0	0	112	N63 R92 Y132 R133 H154 K155	N63-F94 VanDerWaalsContact O-CE1 3.27Å; N63-F94 WeakPolarHBondContact O-CE1 3.4Å; R92-F94 HydrophobicContact CB-CD2 4.46Å; R92-F94 HydrophobicContact CB-CE1 4.42Å; R92-F94 HydrophobicContact CB-CE2 3.61Å; R92-F94 HydrophobicContact CB-CZ 3.58Å; R92-F94 HydrophobicContact CG-CZ 4.3Å; F94-Y132 PolarHBondContact N-O 2.86Å; F94-R133 HydrophobicContact CD2-CB 4.06Å; F94-R133 HydrophobicContact CD2-CG 4.09Å; F94-H154 HydrophobicContact CB-CB 3.89Å; F94-K155 HydrophobicContact CD1-CB 3.9Å; F94-K155 HydrophobicContact CD1-CG 4.22Å; F94-K155 HydrophobicContact CD2-CB 4.27Å; F94-K155 HydrophobicContact CE1-CB 3.92Å; F94-K155 HydrophobicContact CE1-CD 4.35Å; F94-K155 HydrophobicContact CE1-CG 3.71Å; F94-K155 HydrophobicContact CE2-CB 4.28Å; F94-K155 HydrophobicContact CE2-CD 4.24Å; F94-K155 HydrophobicContact CE2-CG 4.33Å; F94-K155 HydrophobicContact CG-CB 4.09Å; F94-K155 HydrophobicContact CZ-CB 4.11Å; F94-K155 HydrophobicContact CZ-CD 3.89Å; F94-K155 HydrophobicContact CZ-CG 3.77Å
95	F	98.3	Very high	95.8	Very high	38 Å²	38	59.1 Å²	59.1	17%	0.167	30%	0.296	C	S	.	.			trans	-153.6	134.3	-177	-177.2	-108.2	0	0	0	111.5	H127 H129 Y132 E135 H154	F95-H127 WeakPolarHBondContact CZ-O 3.42Å; F95-H129 HydrophobicContact CD1-CB 3.69Å; F95-H129 HydrophobicContact CE1-CB 4.19Å; F95-Y132 PolarHBondContact N-O 3.15Å; F95-Y132 CarbonylContact O-C 3.52Å; F95-Y132 WeakPolarHBondContact O-CA 3.39Å; F95-E135 HydrophobicContact CD1-CB 3.91Å; F95-E135 HydrophobicContact CD1-CG 4.48Å; F95-E135 HydrophobicContact CE1-CB 3.53Å; F95-E135 HydrophobicContact CE1-CG 3.62Å; F95-E135 HydrophobicContact CE2-CB 4.45Å; F95-E135 HydrophobicContact CE2-CG 4.41Å; F95-E135 HydrophobicContact CZ-CB 3.83Å; F95-E135 HydrophobicContact CZ-CG 3.57Å; F95-H154 HydrophobicContact CB-CB 4.04Å; F95-H154 AromaticContact CD2-CD2 3.69Å; F95-H154 AromaticContact CD2-CE1 3.54Å; F95-H154 AromaticContact CD2-NE2 3.31Å; F95-H154 VanDerWaalsContact CD2-NE2 3.31Å; F95-H154 WeakPolarHBondContact CD2-NE2 3.48Å; F95-H154 AromaticContact CE2-CE1 3.95Å; F95-H154 AromaticContact CE2-NE2 3.66Å; F95-H154 AromaticContact CG-CD2 3.56Å; F95-H154 AromaticContact CG-NE2 3.65Å
96	V	97.9	Very high	95.6	Very high	7 Å²	7	58.8 Å²	58.8	4%	0.042	30%	0.298	C	S	.	.			trans	-116.8	-2.3	-177.8	-61.5	0	0	0	0	113.9	F75 L79 V93 S98 K102 H129 Y132	F75-V96 HydrophobicContact CB-CG1 4.49Å; F75-V96 HydrophobicContact CB-CG2 3.95Å; F75-V96 HydrophobicContact CD1-CG2 4.06Å; F75-V96 HydrophobicContact CD2-CG1 4.12Å; F75-V96 HydrophobicContact CD2-CG2 4.13Å; F75-V96 HydrophobicContact CG-CG1 4.45Å; F75-V96 HydrophobicContact CG-CG2 3.78Å; L79-V96 HydrophobicContact CD2-CB 3.98Å; L79-V96 HydrophobicContact CD2-CG1 4.2Å; V93-V96 HydrophobicContact CG1-CG1 3.53Å; V96-S98 VanDerWaalsContact CG2-OG 3.24Å; V96-S98 WeakPolarHBondContact CG2-OG 3.41Å; V96-S98 PolarHBondContact O-N 3.26Å; V96-K102 VanDerWaalsContact O-CE 3.23Å; V96-K102 WeakPolarHBondContact O-CE 3.43Å; V96-K102 PolarHBondContact O-NZ 3.2Å; V96-H129 PolarHBondContact O-CD2 3.15Å; V96-Y132 HydrophobicContact CG1-CD1 4.23Å
97	G	97.6	Very high	95.1	Very high	1 Å²	1	63.6 Å²	63.6	1%	0.01	32%	0.323	C	S	.	.			trans	62.3	41.8	179.8	0	0	0	0	0	114.5	H99 A100 K102 H127	G97-H99 PolarHBondContact O-N 3.34Å; G97-A100 WeakPolarHBondContact O-CB 3.23Å; G97-A100 PolarHBondContact O-N 2.92Å; G97-K102 WeakPolarHBondContact O-CE 3.39Å; G97-H127 WeakPolarHBondContact CA-O 3.48Å
98	S	96.6	Very high	94.6	Very high	33 Å²	33	67.6 Å²	67.6	23%	0.231	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-20.1	-172	-61.1	0	0	0	0	116.3	V96	V96-S98 VanDerWaalsContact CG2-OG 3.24Å; V96-S98 WeakPolarHBondContact CG2-OG 3.41Å; V96-S98 PolarHBondContact O-N 3.26Å
99	H	94.9	Very high	94.2	Very high	177 Å²	177	63.4 Å²	63.4	82%	0.819	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	-2.4	-178	-57.8	-66.3	0	0	0	113.2	G97	G97-H99 PolarHBondContact O-N 3.34Å
100	A	96.4	Very high	94	Very high	16 Å²	16	64.2 Å²	64.2	13%	0.132	37%	0.372	C	S	.	.	S	Bend	trans	-73.5	146.5	179.9	0	0	0	0	0	111.4	G97 K102 V125 D128	G97-A100 WeakPolarHBondContact O-CB 3.23Å; G97-A100 PolarHBondContact O-N 2.92Å; A100-K102 HydrophobicContact CB-CG 4.21Å; A100-K102 PolarHBondContact O-N 2.91Å; A100-V125 HydrophobicContact CB-CG1 4.08Å; A100-D128 HydrophobicContact CB-CB 3.65Å
101	K	95.8	Very high	93.9	Very high	195 Å²	195	66.1 Å²	66.1	85%	0.848	39%	0.385	S	S	*	.			trans	-79.1	72.1	170.5	-66.4	-176.3	-179.6	-178.8	0	109.6	V125	K101-V125 WeakPolarHBondContact O-CG1 3.41Å
102	K	95.4	Very high	93.9	Very high	34 Å²	34	62.6 Å²	62.6	15%	0.148	36%	0.362	C	S	.	.			trans	-60.1	146.5	-172.2	-67.7	173	174.1	-70.1	0	112.6	V80 E83 V96 G97 A100 D128 H129	V80-K102 HydrophobicContact CG1-CB 3.77Å; V80-K102 HydrophobicContact CG1-CD 4.12Å; E83-K102 IonicContact OE1-NZ 2.67Å; E83-K102 PolarHBondContact OE1-NZ 3.44Å; E83-K102 WeakPolarHBondContact OE2-CD 3.41Å; E83-K102 WeakPolarHBondContact OE2-CE 3.31Å; E83-K102 IonicContact OE2-NZ 3.58Å; E83-K102 PolarHBondContact OE2-NZ 3.03Å; V96-K102 VanDerWaalsContact O-CE 3.23Å; V96-K102 WeakPolarHBondContact O-CE 3.43Å; V96-K102 PolarHBondContact O-NZ 3.2Å; G97-K102 WeakPolarHBondContact O-CE 3.39Å; A100-K102 HydrophobicContact CB-CG 4.21Å; A100-K102 PolarHBondContact O-N 2.91Å; K102-D128 IonicContact NZ-OD1 2.87Å; K102-D128 PolarHBondContact NZ-OD1 3.23Å; K102-H129 PolarHBondContact NZ-CD2 3.4Å
103	Q	92	Very high	93.8	Very high	60 Å²	60	57.6 Å²	57.6	28%	0.28	35%	0.346	S	S	.	.			trans	-83.4	129.9	169.6	-168.1	160.7	12.3	0	0	110.7	G105 G114 Y115	Q103-G105 PolarHBondContact O-N 2.88Å; Q103-G105 VanDerWaalsContact O-N 3.1Å; Q103-G114 PolarHBondContact NE2-O 3.49Å; Q103-G114 PolarHBondContact OE1-O 2.95Å; Q103-Y115 HydrophobicContact CB-CD1 4.44Å; Q103-Y115 HydrophobicContact CB-CE1 4.19Å; Q103-Y115 PolarHBondContact O-OH 2.81Å
104	A	89.7	Confident	93.6	Very high	70 Å²	70	58.5 Å²	58.5	58%	0.579	36%	0.356	S	S	*	.			trans	-82.9	82	177	0	0	0	0	0	110
105	G	88	Confident	93.6	Very high	12 Å²	12	57.1 Å²	57.1	12%	0.124	35%	0.35	C	S	.	.			trans	-65.4	147.7	-179.9	0	0	0	0	0	113.2	Q103 G113 Y115	Q103-G105 PolarHBondContact O-N 2.88Å; Q103-G105 VanDerWaalsContact O-N 3.1Å; G105-G113 CarbonylContact C-O 3.51Å; G105-G113 WeakPolarHBondContact CA-O 3.37Å; G105-Y115 PolarHBondContact N-OH 3.16Å
106	V	89.8	Confident	93.5	Very high	95 Å²	95	55.6 Å²	55.6	58%	0.576	34%	0.343	S	S	*	.			trans	-117.3	119.2	178.6	-177.7	0	0	0	0	109.5	G108 G109 G113	V106-G108 PolarHBondContact O-N 2.87Å; V106-G109 PolarHBondContact O-N 2.79Å; V106-G113 PolarHBondContact N-O 2.94Å; V106-G113 WeakPolarHBondContact O-CA 3.27Å
107	I	86.4	Confident	93.4	Very high	118 Å²	118	57.8 Å²	57.8	61%	0.605	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	128.4	-179.6	-61.5	171.4	0	0	0	109.9	F82 G109	F82-I107 HydrophobicContact CD2-CD1 4.47Å; F82-I107 HydrophobicContact CD2-CG1 3.69Å; F82-I107 HydrophobicContact CE2-CG1 3.62Å; I107-G109 PolarHBondContact O-N 2.95Å
108	G	87	Confident	93.2	Very high	84 Å²	84	66.4 Å²	66.4	87%	0.866	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.6	0.4	-179.3	0	0	0	0	0	115	V106	V106-G108 PolarHBondContact O-N 2.87Å
109	G	90.1	Very high	93.1	Very high	30 Å²	30	69.3 Å²	69.3	31%	0.309	41%	0.407	S	S	.	.			trans	-66.8	163.2	174.2	0	0	0	0	0	112.8	V106 I107 G113	V106-G109 PolarHBondContact O-N 2.79Å; I107-G109 PolarHBondContact O-N 2.95Å; G109-G113 PolarHBondContact O-N 3.47Å
110	A	92.7	Very high	93.1	Very high	79 Å²	79	61.4 Å²	61.4	65%	0.653	37%	0.374	S	S	*	.	H	α-helix	trans	-56	156.9	174	0	0	0	0	0	111.8	N112 G113 G114	A110-N112 PolarHBondContact O-N 2.74Å; A110-G113 PolarHBondContact O-N 2.71Å; A110-G113 VanDerWaalsContact O-N 3.15Å; A110-G114 PolarHBondContact O-N 3.5Å
111	N	94.3	Very high	93.1	Very high	82 Å²	82	61 Å²	61	44%	0.439	37%	0.37	S	S	.	.	H	α-helix	trans	52.1	51	177.9	-59.3	81.3	0	0	0	112.9	G113 G114 Y115 D116 D117	N111-G113 VanDerWaalsContact C-N 3.33Å; N111-G113 PolarHBondContact O-N 2.87Å; N111-G114 CarbonylContact O-C 3.38Å; N111-G114 WeakPolarHBondContact O-CA 3.35Å; N111-G114 PolarHBondContact O-N 2.7Å; N111-Y115 PolarHBondContact O-N 3.05Å; N111-D116 PolarHBondContact O-N 3.44Å; N111-D117 PolarHBondContact ND2-O 3.41Å
112	N	95.8	Very high	93.2	Very high	35 Å²	35	52.2 Å²	52.2	19%	0.187	33%	0.332	C	S	.	.	H	α-helix	trans	57.1	45.2	-178.5	-172	28.7	0	0	0	112.4	A110 G114 Y115 D116 R206 N207	A110-N112 PolarHBondContact O-N 2.74Å; N112-G114 PolarHBondContact O-N 2.76Å; N112-Y115 WeakPolarHBondContact O-CD2 3.46Å; N112-Y115 PolarHBondContact O-N 2.8Å; N112-D116 HydrophobicContact CB-CB 3.96Å; N112-D116 WeakPolarHBondContact CB-OD1 3.37Å; N112-D116 VanDerWaalsContact CB-OD2 3.23Å; N112-D116 WeakPolarHBondContact CB-OD2 3.33Å; N112-D116 PolarHBondContact ND2-OD1 3.35Å; N112-R206 PolarHBondContact ND2-O 3.43Å; N112-N207 PolarHBondContact OD1-ND2 2.9Å
113	G	93.8	Very high	93.3	Very high	9 Å²	9	54.5 Å²	54.5	9%	0.093	34%	0.343	C	S	.	.	H	α-helix	trans	67	23.3	-175.4	0	0	0	0	0	114.3	G105 V106 G109 A110 N111	G105-G113 CarbonylContact C-O 3.51Å; G105-G113 WeakPolarHBondContact CA-O 3.37Å; V106-G113 PolarHBondContact N-O 2.94Å; V106-G113 WeakPolarHBondContact O-CA 3.27Å; G109-G113 PolarHBondContact O-N 3.47Å; A110-G113 PolarHBondContact O-N 2.71Å; A110-G113 VanDerWaalsContact O-N 3.15Å; N111-G113 VanDerWaalsContact C-N 3.33Å; N111-G113 PolarHBondContact O-N 2.87Å
114	G	95.6	Very high	93.5	Very high	21 Å²	21	53.6 Å²	53.6	22%	0.216	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	93	-12.1	-175.8	0	0	0	0	0	114.4	Q103 A110 N111 N112 D116 Q123	Q103-G114 PolarHBondContact NE2-O 3.49Å; Q103-G114 PolarHBondContact OE1-O 2.95Å; A110-G114 PolarHBondContact O-N 3.5Å; N111-G114 CarbonylContact O-C 3.38Å; N111-G114 WeakPolarHBondContact O-CA 3.35Å; N111-G114 PolarHBondContact O-N 2.7Å; N112-G114 PolarHBondContact O-N 2.76Å; G114-D116 PolarHBondContact O-N 2.93Å; G114-Q123 PolarHBondContact O-NE2 3.32Å
115	Y	97.2	Very high	93.9	Very high	4 Å²	4	51.7 Å²	51.7	2%	0.016	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-16.2	-177.1	-71.3	-61.9	0	0	0	114.6	F82 Q103 G105 N111 N112 Y122 Q123	F82-Y115 AromaticContact CD1-CE2 3.84Å; F82-Y115 HydrophobicContact CD1-CE2 3.84Å; F82-Y115 AromaticContact CD1-CZ 3.9Å; F82-Y115 WeakPolarHBondContact CD1-OH 3.39Å; F82-Y115 HydrophobicContact CD2-CE2 4.17Å; F82-Y115 AromaticContact CE1-CE2 3.73Å; F82-Y115 HydrophobicContact CE1-CE2 3.73Å; F82-Y115 HydrophobicContact CE2-CE2 4.07Å; F82-Y115 HydrophobicContact CG-CE2 4.07Å; F82-Y115 WeakPolarHBondContact CG-OH 3.48Å; F82-Y115 AromaticContact CZ-CE2 3.86Å; F82-Y115 HydrophobicContact CZ-CE2 3.86Å; Q103-Y115 HydrophobicContact CB-CD1 4.44Å; Q103-Y115 HydrophobicContact CB-CE1 4.19Å; Q103-Y115 PolarHBondContact O-OH 2.81Å; G105-Y115 PolarHBondContact N-OH 3.16Å; N111-Y115 PolarHBondContact O-N 3.05Å; N112-Y115 WeakPolarHBondContact O-CD2 3.46Å; N112-Y115 PolarHBondContact O-N 2.8Å; Y115-Y122 HydrophobicContact CD1-CE2 4.16Å; Y115-Y122 HydrophobicContact CG-CE2 4.21Å; Y115-Q123 WeakPolarHBondContact O-CB 3.23Å; Y115-Q123 WeakPolarHBondContact O-CG 3.5Å; Y115-Q123 PolarHBondContact O-N 3.22Å
116	D	97.4	Very high	94.3	Very high	6 Å²	6	54.9 Å²	54.9	3%	0.032	34%	0.338	C	S	.	.	B	Isolated β-bridge	trans	-108	152.5	-177.9	-63.7	7.6	0	0	0	111	N111 N112 G114 S121 Q123 N167 H208	N111-D116 PolarHBondContact O-N 3.44Å; N112-D116 HydrophobicContact CB-CB 3.96Å; N112-D116 WeakPolarHBondContact CB-OD1 3.37Å; N112-D116 VanDerWaalsContact CB-OD2 3.23Å; N112-D116 WeakPolarHBondContact CB-OD2 3.33Å; N112-D116 PolarHBondContact ND2-OD1 3.35Å; G114-D116 PolarHBondContact O-N 2.93Å; D116-S121 CarbonylContact C-O 3.53Å; D116-S121 WeakPolarHBondContact CA-O 3.24Å; D116-Q123 PolarHBondContact O-NE2 3.2Å; D116-N167 VanDerWaalsContact OD2-CB 3.32Å; D116-N167 WeakPolarHBondContact OD2-CB 3.27Å; D116-N167 PolarHBondContact OD2-ND2 3.47Å; D116-H208 IonicContact OD1-CD2 3.93Å; D116-H208 IonicContact OD1-CE1 2.64Å; D116-H208 IonicContact OD1-NE2 2.77Å; D116-H208 PolarHBondContact OD1-NE2 3.33Å; D116-H208 IonicContact OD2-CE1 3.38Å; D116-H208 IonicContact OD2-NE2 3.52Å
117	D	94.9	Very high	94.7	Very high	52 Å²	52	54.8 Å²	54.8	28%	0.278	33%	0.331	S	S	.	.			trans	-74.9	179.1	163.6	70.7	15.7	0	0	0	111.6	N111 N119 G120 S121 Q123	N111-D117 PolarHBondContact ND2-O 3.41Å; D117-N119 PolarHBondContact O-N 3.11Å; D117-N119 VanDerWaalsContact O-N 3.09Å; D117-N119 VanDerWaalsContact OD1-C 3.27Å; D117-N119 VanDerWaalsContact OD1-CA 3.3Å; D117-N119 WeakPolarHBondContact OD1-CA 3.32Å; D117-N119 WeakPolarHBondContact OD1-CB 3.04Å; D117-N119 PolarHBondContact OD1-N 3.36Å; D117-G120 PolarHBondContact O-N 3.08Å; D117-G120 PolarHBondContact OD1-N 3.17Å; D117-G120 VanDerWaalsContact OD1-N 3.1Å; D117-S121 PolarHBondContact N-O 3.22Å; D117-S121 WeakPolarHBondContact OD1-CB 3.49Å; D117-S121 PolarHBondContact OD1-N 2.88Å; D117-S121 PolarHBondContact OD1-OG 3.37Å; D117-S121 VanDerWaalsContact OD2-CB 3.32Å; D117-S121 WeakPolarHBondContact OD2-CB 3.3Å; D117-S121 PolarHBondContact OD2-OG 3.1Å; D117-Q123 HydrophobicContact CB-CG 4.42Å
118	E	94.3	Very high	95.3	Very high	182 Å²	182	49.4 Å²	49.4	85%	0.85	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-20.3	178.2	-64	177.8	-179.6	0	0	113.4
119	N	93.1	Very high	95.9	Very high	94 Å²	94	45.4 Å²	45.4	50%	0.503	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	9.1	179.5	-53.4	-70.8	0	0	0	112.6	D117 S121 R166	D117-N119 PolarHBondContact O-N 3.11Å; D117-N119 VanDerWaalsContact O-N 3.09Å; D117-N119 VanDerWaalsContact OD1-C 3.27Å; D117-N119 VanDerWaalsContact OD1-CA 3.3Å; D117-N119 WeakPolarHBondContact OD1-CA 3.32Å; D117-N119 WeakPolarHBondContact OD1-CB 3.04Å; D117-N119 PolarHBondContact OD1-N 3.36Å; N119-S121 VanDerWaalsContact C-N 3.34Å; N119-S121 PolarHBondContact O-N 2.98Å; N119-R166 VanDerWaalsContact CB-CZ 3.45Å; N119-R166 WeakPolarHBondContact O-CD 3.39Å; N119-R166 WeakPolarHBondContact O-CG 3.01Å; N119-R166 PolarHBondContact O-NE 3.27Å; N119-R166 PolarHBondContact O-NH1 3.13Å
120	G	95.3	Very high	96.3	Very high	12 Å²	12	44 Å²	44	12%	0.124	25%	0.248	C	C	.	.	S	Bend	trans	76.2	17.7	-179.9	0	0	0	0	0	114.2	D117 R166 N167 H208	D117-G120 PolarHBondContact O-N 3.08Å; D117-G120 PolarHBondContact OD1-N 3.17Å; D117-G120 VanDerWaalsContact OD1-N 3.1Å; G120-R166 VanDerWaalsContact C-CG 3.48Å; G120-R166 WeakPolarHBondContact O-CG 3.45Å; G120-N167 PolarHBondContact O-N 3.38Å; G120-H208 PolarHBondContact O-CE1 3.49Å
121	S	96.6	Very high	96.5	Very high	7 Å²	7	40.8 Å²	40.8	5%	0.049	22%	0.221	C	C	.	.			trans	-92	134.5	177	-31.4	0	0	0	0	109.6	D116 D117 N119 Q123 R166	D116-S121 CarbonylContact C-O 3.53Å; D116-S121 WeakPolarHBondContact CA-O 3.24Å; D117-S121 PolarHBondContact N-O 3.22Å; D117-S121 WeakPolarHBondContact OD1-CB 3.49Å; D117-S121 PolarHBondContact OD1-N 2.88Å; D117-S121 PolarHBondContact OD1-OG 3.37Å; D117-S121 VanDerWaalsContact OD2-CB 3.32Å; D117-S121 WeakPolarHBondContact OD2-CB 3.3Å; D117-S121 PolarHBondContact OD2-OG 3.1Å; N119-S121 VanDerWaalsContact C-N 3.34Å; N119-S121 PolarHBondContact O-N 2.98Å; S121-Q123 PolarHBondContact O-N 2.84Å; S121-R166 PolarHBondContact OG-NE 3.46Å; S121-R166 PolarHBondContact OG-NH2 3.46Å
122	Y	97.7	Very high	96.7	Very high	11 Å²	11	36.9 Å²	36.9	4%	0.043	20%	0.2	C	C	.	.	B	Isolated β-bridge	trans	-60.9	132.4	-178.8	-169.2	-101.3	0	0	0	111.7	Y115 L124 I130 L164 F205 R206 H208	Y115-Y122 HydrophobicContact CD1-CE2 4.16Å; Y115-Y122 HydrophobicContact CG-CE2 4.21Å; Y122-L124 HydrophobicContact CD1-CD2 3.89Å; Y122-L124 HydrophobicContact CD1-CG 4.32Å; Y122-L124 HydrophobicContact CE1-CD2 4.35Å; Y122-L124 PolarHBondContact O-N 3.44Å; Y122-L124 VanDerWaalsContact O-N 3.14Å; Y122-I130 HydrophobicContact CE1-CD1 3.92Å; Y122-L164 HydrophobicContact CD1-CD2 3.85Å; Y122-L164 HydrophobicContact CG-CD2 4.05Å; Y122-F205 HydrophobicContact CE1-CE1 4.48Å; Y122-F205 HydrophobicContact CE2-CE1 4.18Å; Y122-F205 AromaticContact CZ-CE1 3.81Å; Y122-F205 WeakPolarHBondContact OH-CE1 3.09Å; Y122-R206 HydrophobicContact CE2-CB 4.12Å; Y122-R206 PolarHBondContact OH-NH1 3.35Å; Y122-H208 WeakPolarHBondContact CB-NE2 3.34Å; Y122-H208 AromaticContact CD2-CD2 3.47Å; Y122-H208 VanDerWaalsContact CD2-CD2 3.47Å; Y122-H208 WeakPolarHBondContact CD2-CD2 3.41Å; Y122-H208 AromaticContact CD2-NE2 3.51Å; Y122-H208 AromaticContact CG-NE2 3.98Å; Y122-H208 PolarHBondContact N-CE1 3.06Å
123	Q	97	Very high	96.9	Very high	82 Å²	82	36.2 Å²	36.2	38%	0.383	20%	0.195	S	C	.	.			trans	-80.8	93.2	177.5	-63	-164.6	69.5	0	0	110	G114 Y115 D116 D117 S121 V125	G114-Q123 PolarHBondContact O-NE2 3.32Å; Y115-Q123 WeakPolarHBondContact O-CB 3.23Å; Y115-Q123 WeakPolarHBondContact O-CG 3.5Å; Y115-Q123 PolarHBondContact O-N 3.22Å; D116-Q123 PolarHBondContact O-NE2 3.2Å; D117-Q123 HydrophobicContact CB-CG 4.42Å; S121-Q123 PolarHBondContact O-N 2.84Å; Q123-V125 PolarHBondContact O-N 2.77Å
124	L	96.8	Very high	97.1	Very high	40 Å²	40	35.9 Å²	35.9	21%	0.209	19%	0.191	C	C	.	.			trans	-67.2	131.8	-179.1	-68.8	169.7	0	0	0	112.5	Y122 V136 V139 Q147 I149 L164	Y122-L124 HydrophobicContact CD1-CD2 3.89Å; Y122-L124 HydrophobicContact CD1-CG 4.32Å; Y122-L124 HydrophobicContact CE1-CD2 4.35Å; Y122-L124 PolarHBondContact O-N 3.44Å; Y122-L124 VanDerWaalsContact O-N 3.14Å; L124-V136 HydrophobicContact CD2-CG1 4.22Å; L124-V136 HydrophobicContact CD2-CG2 4.35Å; L124-V139 HydrophobicContact CD1-CG2 3.62Å; L124-Q147 HydrophobicContact CD1-CB 4.48Å; L124-I149 HydrophobicContact CD1-CG2 3.32Å; L124-I149 HydrophobicContact CD2-CD1 4.33Å; L124-I149 HydrophobicContact CD2-CG2 4.06Å; L124-I149 HydrophobicContact CG-CG2 4.36Å; L124-L164 HydrophobicContact CD2-CD1 4.07Å; L124-L164 HydrophobicContact CD2-CD2 4.24Å
125	V	97.8	Very high	97.3	Very high	31 Å²	31	36.4 Å²	36.4	19%	0.188	19%	0.187	C	C	.	.			trans	-111.1	122.2	169	179.4	0	0	0	0	108.5	A100 K101 Q123 D128 V136	A100-V125 HydrophobicContact CB-CG1 4.08Å; K101-V125 WeakPolarHBondContact O-CG1 3.41Å; Q123-V125 PolarHBondContact O-N 2.77Å; V125-D128 HydrophobicContact CB-CB 3.79Å; V125-D128 HydrophobicContact CG1-CB 4.02Å; V125-D128 VanDerWaalsContact O-CB 3.27Å; V125-D128 WeakPolarHBondContact O-CB 3.47Å; V125-D128 PolarHBondContact O-N 3.23Å; V125-D128 VanDerWaalsContact O-N 3.15Å; V125-V136 WeakPolarHBondContact O-CB 3.47Å
126	V	97.8	Very high	97.3	Very high	79 Å²	79	36.4 Å²	36.4	48%	0.479	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	138.2	178.7	-174.5	0	0	0	0	109.7	D128 L137	V126-D128 PolarHBondContact O-N 2.89Å; V126-L137 WeakPolarHBondContact CG1-O 3.4Å
127	H	98.3	Very high	97.4	Very high	93 Å²	93	38.2 Å²	38.2	43%	0.431	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	66	5.9	-171.7	-55.4	-64.3	0	0	0	115.9	F95 G97 E135 V136	F95-H127 WeakPolarHBondContact CZ-O 3.42Å; G97-H127 WeakPolarHBondContact CA-O 3.48Å; H127-E135 IonicContact CE1-OE1 3.39Å; H127-E135 IonicContact CG-OE1 3.04Å; H127-E135 IonicContact ND1-OE1 3.98Å; H127-E135 PolarHBondContact ND1-OE1 3.48Å; H127-V136 WeakPolarHBondContact CA-O 3.39Å; H127-V136 PolarHBondContact N-O 2.93Å
128	D	98.5	Very high	97.5	Very high	5 Å²	5	42.5 Å²	42.5	3%	0.027	21%	0.214	C	C	.	.			trans	-80.2	168.6	170.3	-156.2	6.3	0	0	0	111.4	A100 K102 V125 V126 V136	A100-D128 HydrophobicContact CB-CB 3.65Å; K102-D128 IonicContact NZ-OD1 2.87Å; K102-D128 PolarHBondContact NZ-OD1 3.23Å; V125-D128 HydrophobicContact CB-CB 3.79Å; V125-D128 HydrophobicContact CG1-CB 4.02Å; V125-D128 VanDerWaalsContact O-CB 3.27Å; V125-D128 WeakPolarHBondContact O-CB 3.47Å; V125-D128 PolarHBondContact O-N 3.23Å; V125-D128 VanDerWaalsContact O-N 3.15Å; V126-D128 PolarHBondContact O-N 2.89Å; D128-V136 WeakPolarHBondContact O-CG2 3.38Å; D128-V136 PolarHBondContact O-N 3.34Å
129	H	98.5	Very high	97.6	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	149.3	179	77.4	76.3	0	0	0	112.8	E83 F95 V96 K102 Y132 Y134	E83-H129 IonicContact OE1-CD2 3.62Å; E83-H129 IonicContact OE1-NE2 2.87Å; E83-H129 PolarHBondContact OE1-NE2 2.82Å; F95-H129 HydrophobicContact CD1-CB 3.69Å; F95-H129 HydrophobicContact CE1-CB 4.19Å; V96-H129 PolarHBondContact O-CD2 3.15Å; K102-H129 PolarHBondContact NZ-CD2 3.4Å; H129-Y132 AromaticContact CE1-CD1 3.6Å; H129-Y132 AromaticContact CE1-CD2 3.92Å; H129-Y132 AromaticContact CE1-CE1 3.43Å; H129-Y132 VanDerWaalsContact CE1-CE1 3.43Å; H129-Y132 WeakPolarHBondContact CE1-CE1 3.42Å; H129-Y132 AromaticContact CE1-CE2 3.75Å; H129-Y132 AromaticContact CE1-CG 3.86Å; H129-Y132 AromaticContact CE1-CZ 3.51Å; H129-Y132 AromaticContact ND1-CD1 3.99Å; H129-Y132 PolarHBondContact ND1-N 3.14Å; H129-Y132 AromaticContact NE2-CD1 3.6Å; H129-Y132 AromaticContact NE2-CE1 3.23Å; H129-Y132 WeakPolarHBondContact NE2-CE1 3.12Å; H129-Y132 AromaticContact NE2-CZ 3.66Å; H129-Y134 CarbonylContact C-O 3.55Å; H129-Y134 WeakPolarHBondContact CA-O 3.32Å
130	I	98.6	Very high	97.7	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.005	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	127.9	157.5	-57	-61.2	0	0	0	107.3	Y122 Y132 R133 Y134 V136 L162 L164 F203 F205	Y122-I130 HydrophobicContact CE1-CD1 3.92Å; I130-Y132 PolarHBondContact O-N 2.81Å; I130-Y132 VanDerWaalsContact O-N 3.11Å; I130-R133 PolarHBondContact O-N 2.91Å; I130-R133 VanDerWaalsContact O-N 3.11Å; I130-Y134 PolarHBondContact N-O 3.27Å; I130-Y134 PolarHBondContact O-N 2.81Å; I130-V136 HydrophobicContact CD1-CG2 4.16Å; I130-V136 HydrophobicContact CG1-CG2 3.78Å; I130-L162 HydrophobicContact CB-CD1 4.28Å; I130-L162 HydrophobicContact CG2-CD1 4.07Å; I130-L164 HydrophobicContact CD1-CD2 4.03Å; I130-F203 HydrophobicContact CG2-CE2 3.81Å; I130-F203 HydrophobicContact CG2-CZ 4Å; I130-F205 HydrophobicContact CB-CD1 4.41Å; I130-F205 HydrophobicContact CB-CE1 4.42Å; I130-F205 HydrophobicContact CD1-CD1 3.81Å; I130-F205 HydrophobicContact CD1-CE1 3.47Å; I130-F205 VanDerWaalsContact CD1-CE1 3.47Å; I130-F205 HydrophobicContact CD1-CZ 4.39Å; I130-F205 HydrophobicContact CG2-CB 4.21Å; I130-F205 HydrophobicContact CG2-CD1 3.74Å; I130-F205 HydrophobicContact CG2-CE1 4.23Å; I130-F205 HydrophobicContact CG2-CG 3.96Å
131	A	98.3	Very high	97.6	Very high	10 Å²	10	36.7 Å²	36.7	8%	0.083	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.7	36	178.3	0	0	0	0	0	114.4	Y90 R133 F203 F205	Y90-A131 HydrophobicContact CD1-CB 4.47Å; Y90-A131 HydrophobicContact CE1-CB 3.65Å; A131-R133 PolarHBondContact O-N 3.11Å; A131-F203 HydrophobicContact CB-CD2 3.9Å; A131-F203 HydrophobicContact CB-CE2 3.47Å; A131-F203 VanDerWaalsContact CB-CE2 3.47Å; A131-F203 HydrophobicContact CB-CZ 4.05Å; A131-F205 HydrophobicContact CB-CD2 4.24Å; A131-F205 VanDerWaalsContact N-CD2 3.33Å; A131-F205 VanDerWaalsContact N-CE2 3.34Å
132	Y	98.5	Very high	97.4	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.2	27.9	-177.8	-61	-83.9	0	0	0	115.1	E83 E86 I87 Y90 V93 F94 F95 V96 H129 I130	E83-Y132 WeakPolarHBondContact CA-OH 3.33Å; E83-Y132 WeakPolarHBondContact CB-OH 3.36Å; E83-Y132 PolarHBondContact O-OH 3.37Å; E83-Y132 VanDerWaalsContact O-OH 3.07Å; E86-Y132 HydrophobicContact CG-CE2 4.12Å; E86-Y132 PolarHBondContact OE2-OH 2.88Å; I87-Y132 HydrophobicContact CB-CE1 4.03Å; I87-Y132 HydrophobicContact CB-CE2 4.12Å; I87-Y132 HydrophobicContact CD1-CD1 4.14Å; I87-Y132 HydrophobicContact CD1-CE1 3.82Å; I87-Y132 HydrophobicContact CG1-CD1 4.09Å; I87-Y132 HydrophobicContact CG1-CE1 3.77Å; I87-Y132 HydrophobicContact CG1-CE2 4.24Å; I87-Y132 HydrophobicContact CG1-CG 4.43Å; I87-Y132 PolarHBondContact N-OH 3.09Å; Y90-Y132 HydrophobicContact CD1-CD2 4.31Å; Y90-Y132 AromaticContact CD2-CD2 3.32Å; Y90-Y132 HydrophobicContact CD2-CD2 3.32Å; Y90-Y132 AromaticContact CD2-CE2 3.5Å; Y90-Y132 HydrophobicContact CD2-CE2 3.5Å; Y90-Y132 AromaticContact CE2-CD2 3.61Å; Y90-Y132 HydrophobicContact CE2-CD2 3.61Å; Y90-Y132 AromaticContact CE2-CE2 3.6Å; Y90-Y132 HydrophobicContact CE2-CE2 3.6Å; Y90-Y132 AromaticContact CG-CD2 3.72Å; Y90-Y132 HydrophobicContact CG-CD2 3.72Å; Y90-Y132 HydrophobicContact CG-CE2 4.35Å; V93-Y132 HydrophobicContact CG1-CD1 4.27Å; V93-Y132 HydrophobicContact CG2-CG 4.38Å; F94-Y132 PolarHBondContact N-O 2.86Å; F95-Y132 PolarHBondContact N-O 3.15Å; F95-Y132 CarbonylContact O-C 3.52Å; F95-Y132 WeakPolarHBondContact O-CA 3.39Å; V96-Y132 HydrophobicContact CG1-CD1 4.23Å; H129-Y132 AromaticContact CE1-CD1 3.6Å; H129-Y132 AromaticContact CE1-CD2 3.92Å; H129-Y132 AromaticContact CE1-CE1 3.43Å; H129-Y132 VanDerWaalsContact CE1-CE1 3.43Å; H129-Y132 WeakPolarHBondContact CE1-CE1 3.42Å; H129-Y132 AromaticContact CE1-CE2 3.75Å; H129-Y132 AromaticContact CE1-CG 3.86Å; H129-Y132 AromaticContact CE1-CZ 3.51Å; H129-Y132 AromaticContact ND1-CD1 3.99Å; H129-Y132 PolarHBondContact ND1-N 3.14Å; H129-Y132 AromaticContact NE2-CD1 3.6Å; H129-Y132 AromaticContact NE2-CE1 3.23Å; H129-Y132 WeakPolarHBondContact NE2-CE1 3.12Å; H129-Y132 AromaticContact NE2-CZ 3.66Å; I130-Y132 PolarHBondContact O-N 2.81Å; I130-Y132 VanDerWaalsContact O-N 3.11Å
133	R	98.5	Very high	96.9	Very high	22 Å²	22	45.2 Å²	45.2	8%	0.083	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-139	-45.5	-173.7	176.2	174.9	168.5	-163.2	-9.8	113.4	F94 I130 A131 D153 H154 K155 Y156 D201	F94-R133 HydrophobicContact CD2-CB 4.06Å; F94-R133 HydrophobicContact CD2-CG 4.09Å; I130-R133 PolarHBondContact O-N 2.91Å; I130-R133 VanDerWaalsContact O-N 3.11Å; A131-R133 PolarHBondContact O-N 3.11Å; R133-D153 WeakPolarHBondContact CG-OD1 3.47Å; R133-D153 IonicContact CZ-OD1 3.46Å; R133-D153 IonicContact CZ-OD2 3.59Å; R133-D153 IonicContact NE-OD1 2.67Å; R133-D153 PolarHBondContact NE-OD1 3.16Å; R133-D153 IonicContact NE-OD2 2.83Å; R133-D153 PolarHBondContact NE-OD2 2.98Å; R133-D153 IonicContact NH2-OD1 3.44Å; R133-D153 IonicContact NH2-OD2 3.48Å; R133-D153 PolarHBondContact NH2-OD2 2.79Å; R133-H154 WeakPolarHBondContact O-CB 3.42Å; R133-H154 PolarHBondContact O-N 2.95Å; R133-K155 HydrophobicContact CG-CB 4.22Å; R133-Y156 VanDerWaalsContact NH2-CD2 3.26Å; R133-D201 IonicContact CZ-OD2 3.92Å; R133-D201 IonicContact NH1-OD2 3.05Å; R133-D201 PolarHBondContact NH1-OD2 3.37Å; R133-D201 IonicContact NH2-OD2 3.89Å
134	Y	98.8	Very high	96.4	Very high	1 Å²	1	44.7 Å²	44.7	0%	0.004	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	126.5	-173.4	-53.7	-84.6	0	0	0	110.1	H129 I130 F152 D153 V160 L162 F203 T212	H129-Y134 CarbonylContact C-O 3.55Å; H129-Y134 WeakPolarHBondContact CA-O 3.32Å; I130-Y134 PolarHBondContact N-O 3.27Å; I130-Y134 PolarHBondContact O-N 2.81Å; Y134-F152 CarbonylContact C-O 3.51Å; Y134-F152 WeakPolarHBondContact CA-O 3.47Å; Y134-D153 HydrophobicContact CD1-CB 3.86Å; Y134-D153 HydrophobicContact CE1-CB 3.84Å; Y134-V160 HydrophobicContact CD1-CG2 3.97Å; Y134-V160 HydrophobicContact CE1-CG2 4.18Å; Y134-L162 HydrophobicContact CD1-CD1 4.23Å; Y134-L162 HydrophobicContact CD2-CD1 3.86Å; Y134-L162 HydrophobicContact CE2-CD1 4.5Å; Y134-L162 HydrophobicContact CG-CD1 3.7Å; Y134-F203 HydrophobicContact CD2-CE1 4.18Å; Y134-F203 AromaticContact CD2-CZ 3.78Å; Y134-F203 HydrophobicContact CD2-CZ 3.78Å; Y134-F203 HydrophobicContact CE2-CD1 4.46Å; Y134-F203 AromaticContact CE2-CE1 3.38Å; Y134-F203 HydrophobicContact CE2-CE1 3.38Å; Y134-F203 AromaticContact CE2-CZ 3.45Å; Y134-F203 HydrophobicContact CE2-CZ 3.45Å; Y134-F203 VanDerWaalsContact CE2-CZ 3.45Å; Y134-F203 AromaticContact CZ-CE1 3.98Å; Y134-T212 HydrophobicContact CD1-CG2 4.48Å; Y134-T212 HydrophobicContact CE1-CG2 3.84Å; Y134-T212 HydrophobicContact CE2-CG2 4.33Å
135	E	98.7	Very high	95.9	Very high	32 Å²	32	44.8 Å²	44.8	15%	0.15	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	126.7	172.8	179	-179.7	170.4	0	0	110.4	F95 H127 L137 A151 F152 H154	F95-E135 HydrophobicContact CD1-CB 3.91Å; F95-E135 HydrophobicContact CD1-CG 4.48Å; F95-E135 HydrophobicContact CE1-CB 3.53Å; F95-E135 HydrophobicContact CE1-CG 3.62Å; F95-E135 HydrophobicContact CE2-CB 4.45Å; F95-E135 HydrophobicContact CE2-CG 4.41Å; F95-E135 HydrophobicContact CZ-CB 3.83Å; F95-E135 HydrophobicContact CZ-CG 3.57Å; H127-E135 IonicContact CE1-OE1 3.39Å; H127-E135 IonicContact CG-OE1 3.04Å; H127-E135 IonicContact ND1-OE1 3.98Å; H127-E135 PolarHBondContact ND1-OE1 3.48Å; E135-L137 HydrophobicContact CG-CD2 3.98Å; E135-L137 PolarHBondContact O-N 2.84Å; E135-A151 CarbonylContact O-C 3.5Å; E135-A151 WeakPolarHBondContact O-CA 3.27Å; E135-A151 VanDerWaalsContact O-CB 3.26Å; E135-A151 WeakPolarHBondContact O-CB 3.33Å; E135-F152 HydrophobicContact CB-CB 4.36Å; E135-F152 PolarHBondContact N-O 3.32Å; E135-F152 PolarHBondContact O-N 2.77Å; E135-H154 IonicContact OE2-CE1 3.35Å; E135-H154 IonicContact OE2-NE2 2.79Å; E135-H154 PolarHBondContact OE2-NE2 3.11Å
136	V	98.6	Very high	95.6	Very high	4 Å²	4	43.8 Å²	43.8	2%	0.024	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	118.8	176.6	-179.3	0	0	0	0	110	L124 V125 H127 D128 I130 I149	L124-V136 HydrophobicContact CD2-CG1 4.22Å; L124-V136 HydrophobicContact CD2-CG2 4.35Å; V125-V136 WeakPolarHBondContact O-CB 3.47Å; H127-V136 WeakPolarHBondContact CA-O 3.39Å; H127-V136 PolarHBondContact N-O 2.93Å; D128-V136 WeakPolarHBondContact O-CG2 3.38Å; D128-V136 PolarHBondContact O-N 3.34Å; I130-V136 HydrophobicContact CD1-CG2 4.16Å; I130-V136 HydrophobicContact CG1-CG2 3.78Å; V136-I149 HydrophobicContact CB-CD1 4.23Å; V136-I149 HydrophobicContact CG1-CD1 4.02Å; V136-I149 HydrophobicContact CG2-CD1 3.79Å
137	L	98.4	Very high	95.5	Very high	44 Å²	44	41.2 Å²	41.2	23%	0.23	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	-54.8	179.4	-58.9	174.9	0	0	0	112.9	V126 E135 K150 F152 Y159	V126-L137 WeakPolarHBondContact CG1-O 3.4Å; E135-L137 HydrophobicContact CG-CD2 3.98Å; E135-L137 PolarHBondContact O-N 2.84Å; L137-K150 WeakPolarHBondContact CB-O 3.31Å; L137-K150 HydrophobicContact CD1-CG 4.42Å; L137-K150 PolarHBondContact N-O 3.06Å; L137-K150 VanDerWaalsContact N-O 3.09Å; L137-F152 HydrophobicContact CD1-CB 4.11Å; L137-Y159 HydrophobicContact CD1-CD1 3.78Å; L137-Y159 HydrophobicContact CD1-CE1 3.48Å; L137-Y159 VanDerWaalsContact CD1-CE1 3.48Å
138	K	97.5	Very high	95.5	Very high	143 Å²	143	38.7 Å²	38.7	62%	0.622	22%	0.217	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-153.5	138.9	-173.1	-174.6	179.1	178.2	178.3	0	111.3	I140 I149 K150	K138-I140 PolarHBondContact O-N 3.18Å; K138-I149 CarbonylContact O-C 3.43Å; K138-I149 VanDerWaalsContact O-CA 3.26Å; K138-I149 WeakPolarHBondContact O-CA 3.19Å; K138-K150 PolarHBondContact N-O 3.27Å; K138-K150 PolarHBondContact O-N 2.94Å
139	V	97.2	Very high	95.5	Very high	51 Å²	51	38.5 Å²	38.5	31%	0.309	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	124.6	167.2	-173.2	0	0	0	0	109.9	L124 G141 K142 I149	L124-V139 HydrophobicContact CD1-CG2 3.62Å; V139-G141 WeakPolarHBondContact CG1-O 3.48Å; V139-K142 HydrophobicContact CG1-CD 4.25Å; V139-K142 HydrophobicContact CG1-CG 3.62Å; V139-I149 HydrophobicContact CG2-CG2 4.24Å
140	I	95.4	Very high	95.5	Very high	86 Å²	86	41.7 Å²	41.7	44%	0.441	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	-13	179	60.4	176.6	0	0	0	113	K138 V148 K150 A161 L215	K138-I140 PolarHBondContact O-N 3.18Å; I140-V148 HydrophobicContact CD1-CG1 3.95Å; I140-V148 HydrophobicContact CG1-CB 4.18Å; I140-V148 HydrophobicContact CG1-CG1 3.83Å; I140-V148 WeakPolarHBondContact CG1-O 3.5Å; I140-V148 PolarHBondContact N-O 3.42Å; I140-K150 HydrophobicContact CD1-CB 4.48Å; I140-K150 HydrophobicContact CG2-CB 3.87Å; I140-A161 HydrophobicContact CD1-CB 4Å; I140-L215 HydrophobicContact CD1-CD1 3.98Å
141	G	93.3	Very high	95.5	Very high	28 Å²	28	41.6 Å²	41.6	29%	0.289	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	148	171.7	0	0	0	0	0	112.4	V139 V148	V139-G141 WeakPolarHBondContact CG1-O 3.48Å; G141-V148 PolarHBondContact N-O 2.61Å; G141-V148 PolarHBondContact O-N 2.78Å
142	K	91.3	Very high	95.6	Very high	150 Å²	150	42.7 Å²	42.7	65%	0.652	23%	0.232	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-139	142.9	171.2	-64	-168.8	176.2	-174.4	0	109.2	V139 Q147	V139-K142 HydrophobicContact CG1-CD 4.25Å; V139-K142 HydrophobicContact CG1-CG 3.62Å; K142-Q147 HydrophobicContact CG-CG 4.15Å
143	G	87	Confident	95.6	Very high	48 Å²	48	42.9 Å²	42.9	50%	0.495	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.5	-171.7	176.7	0	0	0	0	0	112.1	F145 G146	G143-F145 PolarHBondContact O-N 3.04Å; G143-G146 PolarHBondContact N-O 3.5Å; G143-G146 PolarHBondContact O-N 3.42Å; G143-G146 VanDerWaalsContact O-N 3.16Å; G143-G146 VanDerWaalsContact O-O 3.11Å
144	S	86.2	Confident	95.5	Very high	71 Å²	71	43.3 Å²	43.3	50%	0.497	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-33	178.2	50.5	0	0	0	0	113.2	G146 F171	S144-G146 VanDerWaalsContact C-N 3.28Å; S144-G146 PolarHBondContact O-N 2.95Å; S144-F171 WeakPolarHBondContact O-CE2 3.35Å; S144-F171 WeakPolarHBondContact O-CZ 3.42Å
145	F	86.4	Confident	95.5	Very high	42 Å²	42	46 Å²	46	18%	0.184	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-15.8	-177.7	-59.8	-91.7	0	0	0	113.8	G143 V165 R166 F171	G143-F145 PolarHBondContact O-N 3.04Å; F145-V165 WeakPolarHBondContact O-CA 3.47Å; F145-R166 PolarHBondContact O-N 3.01Å; F145-F171 AromaticContact CD1-CD1 3.83Å; F145-F171 HydrophobicContact CD1-CD1 3.83Å; F145-F171 HydrophobicContact CD1-CE1 4.02Å; F145-F171 HydrophobicContact CE1-CD1 4.49Å; F145-F171 HydrophobicContact CE1-CE1 4.47Å; F145-F171 HydrophobicContact CG-CD1 4.39Å; F145-F171 HydrophobicContact CG-CE1 4.37Å
146	G	92.8	Very high	95.4	Very high	9 Å²	9	50.2 Å²	50.2	9%	0.093	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	130.5	-140.3	-173.5	0	0	0	0	0	112.1	G143 S144 L164	G143-G146 PolarHBondContact N-O 3.5Å; G143-G146 PolarHBondContact O-N 3.42Å; G143-G146 VanDerWaalsContact O-N 3.16Å; G143-G146 VanDerWaalsContact O-O 3.11Å; S144-G146 VanDerWaalsContact C-N 3.28Å; S144-G146 PolarHBondContact O-N 2.95Å; G146-L164 WeakPolarHBondContact CA-O 3.42Å
147	Q	95.9	Very high	95.3	Very high	26 Å²	26	54.8 Å²	54.8	12%	0.121	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	146.1	-170.3	-56.9	-177.1	-18.6	0	0	111	L124 K142 K163 L164	L124-Q147 HydrophobicContact CD1-CB 4.48Å; K142-Q147 HydrophobicContact CG-CG 4.15Å; Q147-K163 CarbonylContact O-C 3.54Å; Q147-K163 WeakPolarHBondContact O-CA 3.29Å; Q147-L164 PolarHBondContact N-O 3.43Å; Q147-L164 PolarHBondContact O-N 3.09Å
148	V	97.8	Very high	95.3	Very high	40 Å²	40	56.6 Å²	56.6	24%	0.242	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	128.2	172.4	-171.6	0	0	0	0	108.3	I140 G141 A161 L162 K163	I140-V148 HydrophobicContact CD1-CG1 3.95Å; I140-V148 HydrophobicContact CG1-CB 4.18Å; I140-V148 HydrophobicContact CG1-CG1 3.83Å; I140-V148 WeakPolarHBondContact CG1-O 3.5Å; I140-V148 PolarHBondContact N-O 3.42Å; G141-V148 PolarHBondContact N-O 2.61Å; G141-V148 PolarHBondContact O-N 2.78Å; V148-A161 HydrophobicContact CG1-CB 4.18Å; V148-L162 CarbonylContact C-O 3.55Å; V148-L162 WeakPolarHBondContact CA-O 3.35Å; V148-K163 HydrophobicContact CG2-CB 4.14Å; V148-K163 HydrophobicContact CG2-CG 4.07Å
149	I	98.4	Very high	95.3	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	147.3	178.7	63.7	173	0	0	0	111	L124 V136 K138 V139 A151 A161 L162 L164	L124-I149 HydrophobicContact CD1-CG2 3.32Å; L124-I149 HydrophobicContact CD2-CD1 4.33Å; L124-I149 HydrophobicContact CD2-CG2 4.06Å; L124-I149 HydrophobicContact CG-CG2 4.36Å; V136-I149 HydrophobicContact CB-CD1 4.23Å; V136-I149 HydrophobicContact CG1-CD1 4.02Å; V136-I149 HydrophobicContact CG2-CD1 3.79Å; K138-I149 CarbonylContact O-C 3.43Å; K138-I149 VanDerWaalsContact O-CA 3.26Å; K138-I149 WeakPolarHBondContact O-CA 3.19Å; V139-I149 HydrophobicContact CG2-CG2 4.24Å; I149-A151 HydrophobicContact CD1-CB 4.15Å; I149-A151 HydrophobicContact CG1-CB 4.3Å; I149-A161 CarbonylContact O-C 3.48Å; I149-A161 WeakPolarHBondContact O-CA 3.18Å; I149-L162 HydrophobicContact CD1-CB 4.32Å; I149-L162 HydrophobicContact CD1-CD2 4.39Å; I149-L162 HydrophobicContact CG1-CB 3.8Å; I149-L162 HydrophobicContact CG1-CD2 4.37Å; I149-L162 WeakPolarHBondContact CG1-O 3.35Å; I149-L162 PolarHBondContact N-O 3.07Å; I149-L162 PolarHBondContact O-N 2.88Å; I149-L164 HydrophobicContact CD1-CD1 4.04Å; I149-L164 HydrophobicContact CG1-CD1 4.06Å; I149-L164 HydrophobicContact CG2-CD1 4.26Å
150	K	98.6	Very high	95.4	Very high	67 Å²	67	53.2 Å²	53.2	29%	0.291	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	124.2	154	-178.8	178	178.2	-177.5	0	106.9	L137 K138 I140 Y159 L215	L137-K150 WeakPolarHBondContact CB-O 3.31Å; L137-K150 HydrophobicContact CD1-CG 4.42Å; L137-K150 PolarHBondContact N-O 3.06Å; L137-K150 VanDerWaalsContact N-O 3.09Å; K138-K150 PolarHBondContact N-O 3.27Å; K138-K150 PolarHBondContact O-N 2.94Å; I140-K150 HydrophobicContact CD1-CB 4.48Å; I140-K150 HydrophobicContact CG2-CB 3.87Å; K150-Y159 HydrophobicContact CD-CD1 4.46Å; K150-Y159 HydrophobicContact CG-CD1 4.44Å; K150-L215 HydrophobicContact CD-CD2 4.01Å; K150-L215 HydrophobicContact CG-CD1 4.47Å; K150-L215 HydrophobicContact CG-CD2 4.02Å
151	A	98.8	Very high	95.6	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	157.1	175.6	0	0	0	0	0	110.9	E135 I149 Y159 V160 L162	E135-A151 CarbonylContact O-C 3.5Å; E135-A151 WeakPolarHBondContact O-CA 3.27Å; E135-A151 VanDerWaalsContact O-CB 3.26Å; E135-A151 WeakPolarHBondContact O-CB 3.33Å; I149-A151 HydrophobicContact CD1-CB 4.15Å; I149-A151 HydrophobicContact CG1-CB 4.3Å; A151-Y159 WeakPolarHBondContact O-CA 3.47Å; A151-V160 HydrophobicContact CB-CG2 4.1Å; A151-V160 PolarHBondContact N-O 3.41Å; A151-V160 PolarHBondContact O-N 2.87Å; A151-L162 HydrophobicContact CB-CB 4.34Å
152	F	98.7	Very high	95.8	Very high	33 Å²	33	48.3 Å²	48.3	15%	0.145	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	123.2	169	-171	-104	0	0	0	109.6	Y134 E135 L137 H154 Q157 Y159	Y134-F152 CarbonylContact C-O 3.51Å; Y134-F152 WeakPolarHBondContact CA-O 3.47Å; E135-F152 HydrophobicContact CB-CB 4.36Å; E135-F152 PolarHBondContact N-O 3.32Å; E135-F152 PolarHBondContact O-N 2.77Å; L137-F152 HydrophobicContact CD1-CB 4.11Å; F152-H154 AromaticContact CD1-CD2 3.79Å; F152-H154 AromaticContact CD1-CE1 3.89Å; F152-H154 AromaticContact CD1-NE2 3.67Å; F152-H154 PolarHBondContact O-N 3.03Å; F152-Q157 HydrophobicContact CZ-CB 4.24Å; F152-Y159 HydrophobicContact CB-CD1 4.31Å; F152-Y159 HydrophobicContact CB-CE1 4.32Å; F152-Y159 AromaticContact CD2-CD1 3.81Å; F152-Y159 HydrophobicContact CD2-CD1 3.81Å; F152-Y159 HydrophobicContact CD2-CD2 4.38Å; F152-Y159 AromaticContact CD2-CE1 3.72Å; F152-Y159 HydrophobicContact CD2-CE1 3.72Å; F152-Y159 HydrophobicContact CD2-CE2 4.28Å; F152-Y159 HydrophobicContact CD2-CG 4.16Å; F152-Y159 AromaticContact CD2-CZ 3.96Å; F152-Y159 HydrophobicContact CE2-CE2 4.42Å; F152-Y159 HydrophobicContact CG-CE1 4.45Å
153	D	98.6	Very high	96.2	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.016	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	105.4	177.2	-177.2	-11.6	0	0	0	109.8	R133 Y134 K155 Y156 Q157 Q158 V160	R133-D153 WeakPolarHBondContact CG-OD1 3.47Å; R133-D153 IonicContact CZ-OD1 3.46Å; R133-D153 IonicContact CZ-OD2 3.59Å; R133-D153 IonicContact NE-OD1 2.67Å; R133-D153 PolarHBondContact NE-OD1 3.16Å; R133-D153 IonicContact NE-OD2 2.83Å; R133-D153 PolarHBondContact NE-OD2 2.98Å; R133-D153 IonicContact NH2-OD1 3.44Å; R133-D153 IonicContact NH2-OD2 3.48Å; R133-D153 PolarHBondContact NH2-OD2 2.79Å; Y134-D153 HydrophobicContact CD1-CB 3.86Å; Y134-D153 HydrophobicContact CE1-CB 3.84Å; D153-K155 PolarHBondContact O-N 3Å; D153-K155 VanDerWaalsContact OD1-CB 3.32Å; D153-K155 WeakPolarHBondContact OD1-CB 3.32Å; D153-K155 PolarHBondContact OD1-N 3.03Å; D153-Y156 WeakPolarHBondContact OD2-CD2 3.16Å; D153-Q157 VanDerWaalsContact O-CA 3.28Å; D153-Q157 WeakPolarHBondContact O-CA 3.39Å; D153-Q157 PolarHBondContact O-N 2.96Å; D153-Q158 HydrophobicContact CB-CG 4.3Å; D153-Q158 PolarHBondContact N-O 3.04Å; D153-Q158 PolarHBondContact O-N 3.34Å; D153-V160 HydrophobicContact CB-CG1 4.33Å
154	H	98.3	Very high	96.7	Very high	31 Å²	31	39.8 Å²	39.8	14%	0.144	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-12.1	-177.6	-77.8	-95.2	0	0	0	114.1	N63 F94 F95 R133 E135 F152 Q157	N63-H154 WeakPolarHBondContact CB-O 3.44Å; N63-H154 PolarHBondContact ND2-O 3.4Å; F94-H154 HydrophobicContact CB-CB 3.89Å; F95-H154 HydrophobicContact CB-CB 4.04Å; F95-H154 AromaticContact CD2-CD2 3.69Å; F95-H154 AromaticContact CD2-CE1 3.54Å; F95-H154 AromaticContact CD2-NE2 3.31Å; F95-H154 VanDerWaalsContact CD2-NE2 3.31Å; F95-H154 WeakPolarHBondContact CD2-NE2 3.48Å; F95-H154 AromaticContact CE2-CE1 3.95Å; F95-H154 AromaticContact CE2-NE2 3.66Å; F95-H154 AromaticContact CG-CD2 3.56Å; F95-H154 AromaticContact CG-NE2 3.65Å; R133-H154 WeakPolarHBondContact O-CB 3.42Å; R133-H154 PolarHBondContact O-N 2.95Å; E135-H154 IonicContact OE2-CE1 3.35Å; E135-H154 IonicContact OE2-NE2 2.79Å; E135-H154 PolarHBondContact OE2-NE2 3.11Å; F152-H154 AromaticContact CD1-CD2 3.79Å; F152-H154 AromaticContact CD1-CE1 3.89Å; F152-H154 AromaticContact CD1-NE2 3.67Å; F152-H154 PolarHBondContact O-N 3.03Å; H154-Q157 PolarHBondContact O-NE2 3.43Å
155	K	97.2	Very high	97.3	Very high	57 Å²	57	36.6 Å²	36.6	25%	0.248	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-50.3	174.2	-178.8	-176.2	-178.6	-168	0	111.2	F94 R133 D153	F94-K155 HydrophobicContact CD1-CB 3.9Å; F94-K155 HydrophobicContact CD1-CG 4.22Å; F94-K155 HydrophobicContact CD2-CB 4.27Å; F94-K155 HydrophobicContact CE1-CB 3.92Å; F94-K155 HydrophobicContact CE1-CD 4.35Å; F94-K155 HydrophobicContact CE1-CG 3.71Å; F94-K155 HydrophobicContact CE2-CB 4.28Å; F94-K155 HydrophobicContact CE2-CD 4.24Å; F94-K155 HydrophobicContact CE2-CG 4.33Å; F94-K155 HydrophobicContact CG-CB 4.09Å; F94-K155 HydrophobicContact CZ-CB 4.11Å; F94-K155 HydrophobicContact CZ-CD 3.89Å; F94-K155 HydrophobicContact CZ-CG 3.77Å; R133-K155 HydrophobicContact CG-CB 4.22Å; D153-K155 PolarHBondContact O-N 3Å; D153-K155 VanDerWaalsContact OD1-CB 3.32Å; D153-K155 WeakPolarHBondContact OD1-CB 3.32Å; D153-K155 PolarHBondContact OD1-N 3.03Å
156	Y	96.8	Very high	97.8	Very high	121 Å²	121	36.8 Å²	36.8	48%	0.475	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	0.3	-175.2	-63.9	-59.3	0	0	0	114.1	R133 D153 Q158	R133-Y156 VanDerWaalsContact NH2-CD2 3.26Å; D153-Y156 WeakPolarHBondContact OD2-CD2 3.16Å; Y156-Q158 PolarHBondContact O-N 3.15Å
157	Q	97.4	Very high	98	Very high	100 Å²	100	38.8 Å²	38.8	47%	0.467	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.8	47.6	177	-61.6	-65.9	-53.7	0	0	112.9	F152 D153 H154	F152-Q157 HydrophobicContact CZ-CB 4.24Å; D153-Q157 VanDerWaalsContact O-CA 3.28Å; D153-Q157 WeakPolarHBondContact O-CA 3.39Å; D153-Q157 PolarHBondContact O-N 2.96Å; H154-Q157 PolarHBondContact O-NE2 3.43Å
158	Q	97.6	Very high	97.9	Very high	83 Å²	83	40.9 Å²	40.9	39%	0.388	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	156.4	-178	63.7	179.1	-28.7	0	0	112.5	D153 Y156 V160	D153-Q158 HydrophobicContact CB-CG 4.3Å; D153-Q158 PolarHBondContact N-O 3.04Å; D153-Q158 PolarHBondContact O-N 3.34Å; Y156-Q158 PolarHBondContact O-N 3.15Å; Q158-V160 HydrophobicContact CG-CG1 4.23Å
159	Y	98.4	Very high	97.7	Very high	122 Å²	122	47.7 Å²	47.7	48%	0.478	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	136.7	172.1	-64.8	-78.4	0	0	0	111.2	L137 K150 A151 F152	L137-Y159 HydrophobicContact CD1-CD1 3.78Å; L137-Y159 HydrophobicContact CD1-CE1 3.48Å; L137-Y159 VanDerWaalsContact CD1-CE1 3.48Å; K150-Y159 HydrophobicContact CD-CD1 4.46Å; K150-Y159 HydrophobicContact CG-CD1 4.44Å; A151-Y159 WeakPolarHBondContact O-CA 3.47Å; F152-Y159 HydrophobicContact CB-CD1 4.31Å; F152-Y159 HydrophobicContact CB-CE1 4.32Å; F152-Y159 AromaticContact CD2-CD1 3.81Å; F152-Y159 HydrophobicContact CD2-CD1 3.81Å; F152-Y159 HydrophobicContact CD2-CD2 4.38Å; F152-Y159 AromaticContact CD2-CE1 3.72Å; F152-Y159 HydrophobicContact CD2-CE1 3.72Å; F152-Y159 HydrophobicContact CD2-CE2 4.28Å; F152-Y159 HydrophobicContact CD2-CG 4.16Å; F152-Y159 AromaticContact CD2-CZ 3.96Å; F152-Y159 HydrophobicContact CE2-CE2 4.42Å; F152-Y159 HydrophobicContact CG-CE1 4.45Å
160	V	98.7	Very high	97.4	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	159.6	179.1	-60.3	0	0	0	0	110.9	Y134 A151 D153 Q158 L200	Y134-V160 HydrophobicContact CD1-CG2 3.97Å; Y134-V160 HydrophobicContact CE1-CG2 4.18Å; A151-V160 HydrophobicContact CB-CG2 4.1Å; A151-V160 PolarHBondContact N-O 3.41Å; A151-V160 PolarHBondContact O-N 2.87Å; D153-V160 HydrophobicContact CB-CG1 4.33Å; Q158-V160 HydrophobicContact CG-CG1 4.23Å; V160-L200 HydrophobicContact CG1-CD1 3.79Å
161	A	98.7	Very high	97.2	Very high	11 Å²	11	51.2 Å²	51.2	9%	0.091	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	126	161.1	0	0	0	0	0	108.5	I140 V148 I149 T212 F213 L215	I140-A161 HydrophobicContact CD1-CB 4Å; V148-A161 HydrophobicContact CG1-CB 4.18Å; I149-A161 CarbonylContact O-C 3.48Å; I149-A161 WeakPolarHBondContact O-CA 3.18Å; A161-T212 CarbonylContact O-C 3.51Å; A161-T212 WeakPolarHBondContact O-CA 3.17Å; A161-F213 HydrophobicContact CB-CB 4.34Å; A161-F213 PolarHBondContact N-O 2.93Å; A161-F213 PolarHBondContact O-N 3.18Å; A161-L215 HydrophobicContact CB-CD1 4.09Å
162	L	98.7	Very high	97.1	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	115.1	179.6	-170	163.4	0	0	0	108.9	I130 Y134 V148 I149 A151 L164 F203 C210 I211 T212	I130-L162 HydrophobicContact CB-CD1 4.28Å; I130-L162 HydrophobicContact CG2-CD1 4.07Å; Y134-L162 HydrophobicContact CD1-CD1 4.23Å; Y134-L162 HydrophobicContact CD2-CD1 3.86Å; Y134-L162 HydrophobicContact CE2-CD1 4.5Å; Y134-L162 HydrophobicContact CG-CD1 3.7Å; V148-L162 CarbonylContact C-O 3.55Å; V148-L162 WeakPolarHBondContact CA-O 3.35Å; I149-L162 HydrophobicContact CD1-CB 4.32Å; I149-L162 HydrophobicContact CD1-CD2 4.39Å; I149-L162 HydrophobicContact CG1-CB 3.8Å; I149-L162 HydrophobicContact CG1-CD2 4.37Å; I149-L162 WeakPolarHBondContact CG1-O 3.35Å; I149-L162 PolarHBondContact N-O 3.07Å; I149-L162 PolarHBondContact O-N 2.88Å; A151-L162 HydrophobicContact CB-CB 4.34Å; L162-L164 HydrophobicContact CD2-CD1 3.42Å; L162-L164 VanDerWaalsContact CD2-CD1 3.42Å; L162-L164 HydrophobicContact CD2-CD2 4.46Å; L162-L164 HydrophobicContact CD2-CG 3.58Å; L162-F203 HydrophobicContact CD1-CZ 4.26Å; L162-C210 HydrophobicContact CD2-CB 4.31Å; L162-I211 CarbonylContact C-O 3.14Å; L162-I211 WeakPolarHBondContact CA-O 3.33Å; L162-T212 HydrophobicContact CB-CG2 4.21Å; L162-T212 HydrophobicContact CD1-CG2 3.97Å; L162-T212 HydrophobicContact CG-CG2 3.84Å
163	K	98.4	Very high	96.8	Very high	15 Å²	15	59.7 Å²	59.7	7%	0.065	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	119.8	174.9	-174.8	177.4	-168.3	177.6	0	108.6	Q147 V148 E178 C210 I211 F213 D280	Q147-K163 CarbonylContact O-C 3.54Å; Q147-K163 WeakPolarHBondContact O-CA 3.29Å; V148-K163 HydrophobicContact CG2-CB 4.14Å; V148-K163 HydrophobicContact CG2-CG 4.07Å; K163-E178 VanDerWaalsContact NZ-CD 3.25Å; K163-E178 IonicContact NZ-OE1 2.7Å; K163-E178 PolarHBondContact NZ-OE1 3.2Å; K163-E178 IonicContact NZ-OE2 2.74Å; K163-E178 PolarHBondContact NZ-OE2 3.27Å; K163-C210 VanDerWaalsContact O-CA 3.29Å; K163-C210 WeakPolarHBondContact O-CA 3.44Å; K163-I211 HydrophobicContact CB-CB 4.49Å; K163-I211 PolarHBondContact N-O 3.24Å; K163-I211 PolarHBondContact O-N 3.46Å; K163-F213 HydrophobicContact CB-CE2 3.89Å; K163-F213 HydrophobicContact CD-CE2 4.25Å; K163-D280 IonicContact NZ-OD1 2.78Å; K163-D280 PolarHBondContact NZ-OD1 3.4Å; K163-D280 VanDerWaalsContact NZ-OD1 3.12Å
164	L	98.2	Very high	96.5	Very high	4 Å²	4	60.4 Å²	60.4	2%	0.021	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	113.3	168	-60	94.3	0	0	0	108.1	Y122 L124 I130 G146 Q147 I149 L162	Y122-L164 HydrophobicContact CD1-CD2 3.85Å; Y122-L164 HydrophobicContact CG-CD2 4.05Å; L124-L164 HydrophobicContact CD2-CD1 4.07Å; L124-L164 HydrophobicContact CD2-CD2 4.24Å; I130-L164 HydrophobicContact CD1-CD2 4.03Å; G146-L164 WeakPolarHBondContact CA-O 3.42Å; Q147-L164 PolarHBondContact N-O 3.43Å; Q147-L164 PolarHBondContact O-N 3.09Å; I149-L164 HydrophobicContact CD1-CD1 4.04Å; I149-L164 HydrophobicContact CG1-CD1 4.06Å; I149-L164 HydrophobicContact CG2-CD1 4.26Å; L162-L164 HydrophobicContact CD2-CD1 3.42Å; L162-L164 VanDerWaalsContact CD2-CD1 3.42Å; L162-L164 HydrophobicContact CD2-CD2 4.46Å; L162-L164 HydrophobicContact CD2-CG 3.58Å
165	V	97.9	Very high	96.4	Very high	5 Å²	5	59 Å²	59	3%	0.03	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	136.5	179	-178.6	0	0	0	0	108.5	F145 F171 A175 H208 K209	F145-V165 WeakPolarHBondContact O-CA 3.47Å; V165-F171 HydrophobicContact CG1-CB 3.67Å; V165-A175 HydrophobicContact CB-CB 4.39Å; V165-A175 HydrophobicContact CG1-CB 4.08Å; V165-A175 HydrophobicContact CG2-CB 3.69Å; V165-H208 PolarHBondContact O-ND1 3.02Å; V165-K209 HydrophobicContact CB-CB 4.04Å; V165-K209 WeakPolarHBondContact CB-O 3.48Å; V165-K209 HydrophobicContact CG2-CB 4.09Å; V165-K209 WeakPolarHBondContact CG2-O 3.4Å; V165-K209 PolarHBondContact N-O 3.38Å
166	R	97.1	Very high	96.3	Very high	45 Å²	45	59.9 Å²	59.9	17%	0.17	26%	0.26	C	S	.	.			trans	-56.7	140.8	176.7	-165.3	-175.9	-102.9	-164.5	-4.1	111.3	N119 G120 S121 F145 E168 F171 H172	N119-R166 VanDerWaalsContact CB-CZ 3.45Å; N119-R166 WeakPolarHBondContact O-CD 3.39Å; N119-R166 WeakPolarHBondContact O-CG 3.01Å; N119-R166 PolarHBondContact O-NE 3.27Å; N119-R166 PolarHBondContact O-NH1 3.13Å; G120-R166 VanDerWaalsContact C-CG 3.48Å; G120-R166 WeakPolarHBondContact O-CG 3.45Å; S121-R166 PolarHBondContact OG-NE 3.46Å; S121-R166 PolarHBondContact OG-NH2 3.46Å; F145-R166 PolarHBondContact O-N 3.01Å; R166-E168 WeakPolarHBondContact CD-OE1 3.4Å; R166-E168 HydrophobicContact CG-CG 4.21Å; R166-E168 IonicContact CZ-OE1 3.85Å; R166-E168 IonicContact NE-OE1 3.55Å; R166-E168 IonicContact NH1-OE1 3.8Å; R166-E168 PolarHBondContact NH1-OE1 3.26Å; R166-E168 VanDerWaalsContact NH1-OE1 3.08Å; R166-E168 PolarHBondContact O-N 3Å; R166-F171 HydrophobicContact CB-CD2 3.92Å; R166-F171 HydrophobicContact CB-CG 4.46Å; R166-F171 HydrophobicContact CG-CD2 4.45Å; R166-H172 PolarHBondContact O-CD2 3.48Å; R166-H172 PolarHBondContact O-NE2 3.23Å
167	N	96.8	Very high	96.2	Very high	52 Å²	52	56.5 Å²	56.5	28%	0.278	25%	0.248	S	C	.	.	S	Bend	trans	-75.6	64.7	-178.5	-174.1	12.4	0	0	0	111.6	D116 G120 N207	D116-N167 VanDerWaalsContact OD2-CB 3.32Å; D116-N167 WeakPolarHBondContact OD2-CB 3.27Å; D116-N167 PolarHBondContact OD2-ND2 3.47Å; G120-N167 PolarHBondContact O-N 3.38Å; N167-N207 PolarHBondContact OD1-O 2.95Å
168	E	95.3	Very high	96.2	Very high	70 Å²	70	51.9 Å²	51.9	33%	0.327	23%	0.227	S	C	.	.	S	Bend	trans	-134.3	140.9	172.8	-55.9	-179.4	-149.4	0	0	110.2	R166 R170 F171 H172	R166-E168 WeakPolarHBondContact CD-OE1 3.4Å; R166-E168 HydrophobicContact CG-CG 4.21Å; R166-E168 IonicContact CZ-OE1 3.85Å; R166-E168 IonicContact NE-OE1 3.55Å; R166-E168 IonicContact NH1-OE1 3.8Å; R166-E168 PolarHBondContact NH1-OE1 3.26Å; R166-E168 VanDerWaalsContact NH1-OE1 3.08Å; R166-E168 PolarHBondContact O-N 3Å; E168-R170 PolarHBondContact O-N 2.9Å; E168-F171 HydrophobicContact CB-CD2 3.89Å; E168-F171 HydrophobicContact CG-CD2 4.17Å; E168-F171 PolarHBondContact O-N 2.93Å; E168-H172 PolarHBondContact O-N 3.32Å
169	K	94	Very high	96.1	Very high	182 Å²	182	48.6 Å²	48.6	79%	0.791	21%	0.212	S	C	*	.	H	α-helix	trans	-54.5	-33.7	-177.4	-66	-175.5	-179.1	179.8	0	113.7	R173	K169-R173 WeakPolarHBondContact O-CG 3.26Å; K169-R173 PolarHBondContact O-N 2.81Å
170	R	91.9	Very high	96.1	Very high	124 Å²	124	48 Å²	48	47%	0.468	21%	0.209	S	C	.	.	H	α-helix	trans	-66.1	-49.5	177.9	-179.5	-175.6	175	-172.5	-1	111.2	E168 H172 R173 Q174	E168-R170 PolarHBondContact O-N 2.9Å; R170-H172 VanDerWaalsContact C-N 3.34Å; R170-R173 PolarHBondContact O-N 3.23Å; R170-Q174 PolarHBondContact O-N 2.79Å
171	F	94.2	Very high	96	Very high	17 Å²	17	48 Å²	48	8%	0.075	21%	0.209	C	C	.	.	H	α-helix	trans	-70.6	-32.2	-179.2	-65.1	-59.7	0	0	0	111.8	S144 F145 V165 R166 E168 R173 Q174 A175	S144-F171 WeakPolarHBondContact O-CE2 3.35Å; S144-F171 WeakPolarHBondContact O-CZ 3.42Å; F145-F171 AromaticContact CD1-CD1 3.83Å; F145-F171 HydrophobicContact CD1-CD1 3.83Å; F145-F171 HydrophobicContact CD1-CE1 4.02Å; F145-F171 HydrophobicContact CE1-CD1 4.49Å; F145-F171 HydrophobicContact CE1-CE1 4.47Å; F145-F171 HydrophobicContact CG-CD1 4.39Å; F145-F171 HydrophobicContact CG-CE1 4.37Å; V165-F171 HydrophobicContact CG1-CB 3.67Å; R166-F171 HydrophobicContact CB-CD2 3.92Å; R166-F171 HydrophobicContact CB-CG 4.46Å; R166-F171 HydrophobicContact CG-CD2 4.45Å; E168-F171 HydrophobicContact CB-CD2 3.89Å; E168-F171 HydrophobicContact CG-CD2 4.17Å; E168-F171 PolarHBondContact O-N 2.93Å; F171-R173 PolarHBondContact O-N 2.82Å; F171-Q174 PolarHBondContact O-N 2.74Å; F171-A175 WeakPolarHBondContact O-CB 3.09Å; F171-A175 PolarHBondContact O-N 2.85Å
172	H	95.8	Very high	95.9	Very high	40 Å²	40	47.8 Å²	47.8	19%	0.185	21%	0.206	C	C	.	.	H	α-helix	trans	-59.9	-45.2	172.4	-76	-167.1	0	0	0	112.6	R166 E168 R170 Q174 A175 D176 N207 K209	R166-H172 PolarHBondContact O-CD2 3.48Å; R166-H172 PolarHBondContact O-NE2 3.23Å; E168-H172 PolarHBondContact O-N 3.32Å; R170-H172 VanDerWaalsContact C-N 3.34Å; H172-Q174 VanDerWaalsContact C-N 3.34Å; H172-Q174 PolarHBondContact O-N 2.83Å; H172-A175 PolarHBondContact O-N 2.95Å; H172-D176 PolarHBondContact O-N 3.32Å; H172-N207 PolarHBondContact CE1-O 2.82Å; H172-N207 PolarHBondContact NE2-O 3.15Å; H172-K209 HydrophobicContact CB-CD 4.13Å; H172-K209 WeakPolarHBondContact O-CE 3.3Å
173	R	93.1	Very high	95.7	Very high	171 Å²	171	50.1 Å²	50.1	65%	0.645	22%	0.219	S	C	*	.	H	α-helix	trans	-63	-39.1	176	-73.7	-172.8	-70.8	165.4	-3.5	112.7	K169 R170 F171 D176 E177	K169-R173 WeakPolarHBondContact O-CG 3.26Å; K169-R173 PolarHBondContact O-N 2.81Å; R170-R173 PolarHBondContact O-N 3.23Å; F171-R173 PolarHBondContact O-N 2.82Å; R173-D176 PolarHBondContact O-N 2.96Å; R173-E177 PolarHBondContact O-N 3.1Å; R173-E177 VanDerWaalsContact O-N 3.13Å
174	Q	92.1	Very high	95.6	Very high	19 Å²	19	52.2 Å²	52.2	9%	0.089	23%	0.228	C	C	.	.	H	α-helix	trans	-66.2	-38.7	175.8	-75.8	178.4	-15.8	0	0	112.1	R170 F171 H172 E177 E178 Y292	R170-Q174 PolarHBondContact O-N 2.79Å; F171-Q174 PolarHBondContact O-N 2.74Å; H172-Q174 VanDerWaalsContact C-N 3.34Å; H172-Q174 PolarHBondContact O-N 2.83Å; Q174-E177 PolarHBondContact O-N 2.96Å; Q174-E178 WeakPolarHBondContact O-CB 3.38Å; Q174-E178 PolarHBondContact O-N 2.79Å; Q174-Y292 PolarHBondContact NE2-OH 3.39Å
175	A	96.1	Very high	95.5	Very high	2 Å²	2	52 Å²	52	2%	0.017	23%	0.227	C	C	.	.	H	α-helix	trans	-66.5	-38.8	176.1	0	0	0	0	0	112.4	V165 F171 H172 E177 E178 I179 K209 I211	V165-A175 HydrophobicContact CB-CB 4.39Å; V165-A175 HydrophobicContact CG1-CB 4.08Å; V165-A175 HydrophobicContact CG2-CB 3.69Å; F171-A175 WeakPolarHBondContact O-CB 3.09Å; F171-A175 PolarHBondContact O-N 2.85Å; H172-A175 PolarHBondContact O-N 2.95Å; A175-E177 VanDerWaalsContact C-N 3.32Å; A175-E177 PolarHBondContact O-N 3.22Å; A175-E178 PolarHBondContact O-N 2.82Å; A175-I179 WeakPolarHBondContact O-CD1 3.24Å; A175-I179 VanDerWaalsContact O-CG1 3.24Å; A175-I179 WeakPolarHBondContact O-CG1 3.45Å; A175-I179 PolarHBondContact O-N 2.7Å; A175-K209 HydrophobicContact CB-CB 4.27Å; A175-K209 HydrophobicContact CB-CD 3.78Å; A175-I211 HydrophobicContact CB-CD1 4.48Å
176	D	95.8	Very high	95.2	Very high	74 Å²	74	56.5 Å²	56.5	40%	0.396	24%	0.244	S	C	.	.	H	α-helix	trans	-62.4	-41.2	174.1	-72	-35	0	0	0	111.8	H172 R173 R180 K209	H172-D176 PolarHBondContact O-N 3.32Å; R173-D176 PolarHBondContact O-N 2.96Å; D176-R180 WeakPolarHBondContact O-CB 3.43Å; D176-R180 PolarHBondContact O-N 2.85Å; D176-K209 VanDerWaalsContact CG-CE 3.47Å; D176-K209 VanDerWaalsContact CG-NZ 3.26Å; D176-K209 WeakPolarHBondContact OD1-CE 3.32Å; D176-K209 IonicContact OD1-NZ 3.35Å; D176-K209 PolarHBondContact OD1-NZ 3.41Å; D176-K209 WeakPolarHBondContact OD2-CE 3.49Å; D176-K209 IonicContact OD2-NZ 3.24Å; D176-K209 PolarHBondContact OD2-NZ 3.1Å
177	E	94.3	Very high	95	Very high	50 Å²	50	62.9 Å²	62.9	23%	0.234	27%	0.268	C	S	.	.	H	α-helix	trans	-68.3	-39.4	175.4	-170.4	60	-164.8	0	0	112.1	R173 Q174 A175 R180 I181	R173-E177 PolarHBondContact O-N 3.1Å; R173-E177 VanDerWaalsContact O-N 3.13Å; Q174-E177 PolarHBondContact O-N 2.96Å; A175-E177 VanDerWaalsContact C-N 3.32Å; A175-E177 PolarHBondContact O-N 3.22Å; E177-R180 PolarHBondContact O-N 3.03Å; E177-R180 IonicContact OE1-CZ 3.08Å; E177-R180 IonicContact OE1-NE 3.18Å; E177-R180 PolarHBondContact OE1-NE 3.44Å; E177-R180 IonicContact OE1-NH2 2.84Å; E177-R180 PolarHBondContact OE1-NH2 3.29Å; E177-R180 IonicContact OE2-CZ 3.9Å; E177-R180 IonicContact OE2-NE 3.79Å; E177-R180 PolarHBondContact OE2-NE 2.8Å; E177-R180 IonicContact OE2-NH2 3.92Å; E177-R180 PolarHBondContact OE2-NH2 2.81Å; E177-I181 HydrophobicContact CG-CD1 3.94Å; E177-I181 HydrophobicContact CG-CG1 4.5Å; E177-I181 WeakPolarHBondContact O-CB 3.45Å; E177-I181 VanDerWaalsContact O-CG1 3.3Å; E177-I181 WeakPolarHBondContact O-CG1 3.24Å; E177-I181 PolarHBondContact O-N 2.83Å
178	E	96.3	Very high	94.8	Very high	4 Å²	4	64 Å²	64	2%	0.019	27%	0.271	C	S	.	.	H	α-helix	trans	-59.4	-47.5	174.5	-175.9	170.9	-165.7	0	0	111.5	K163 Q174 A175 R180 I181 L182 F281	K163-E178 VanDerWaalsContact NZ-CD 3.25Å; K163-E178 IonicContact NZ-OE1 2.7Å; K163-E178 PolarHBondContact NZ-OE1 3.2Å; K163-E178 IonicContact NZ-OE2 2.74Å; K163-E178 PolarHBondContact NZ-OE2 3.27Å; Q174-E178 WeakPolarHBondContact O-CB 3.38Å; Q174-E178 PolarHBondContact O-N 2.79Å; A175-E178 PolarHBondContact O-N 2.82Å; E178-R180 PolarHBondContact O-N 3.48Å; E178-I181 PolarHBondContact O-N 3.39Å; E178-L182 HydrophobicContact CG-CD1 3.84Å; E178-L182 HydrophobicContact CG-CG 4.48Å; E178-L182 WeakPolarHBondContact O-CB 3.18Å; E178-L182 VanDerWaalsContact O-CG 3.27Å; E178-L182 WeakPolarHBondContact O-CG 3.43Å; E178-L182 PolarHBondContact O-N 2.95Å; E178-F281 HydrophobicContact CG-CB 4.05Å; E178-F281 PolarHBondContact OE1-N 2.75Å
179	I	97.4	Very high	94.7	Very high	14 Å²	14	60.7 Å²	60.7	7%	0.072	26%	0.256	C	S	.	.	H	α-helix	trans	-58.3	-48.9	175.6	-69.6	162.6	0	0	0	109.9	A175 I181 L182 D183 M199 Y202 I211	A175-I179 WeakPolarHBondContact O-CD1 3.24Å; A175-I179 VanDerWaalsContact O-CG1 3.24Å; A175-I179 WeakPolarHBondContact O-CG1 3.45Å; A175-I179 PolarHBondContact O-N 2.7Å; I179-I181 PolarHBondContact O-N 3.43Å; I179-L182 PolarHBondContact O-N 2.91Å; I179-D183 WeakPolarHBondContact O-CB 3.4Å; I179-D183 PolarHBondContact O-N 2.84Å; I179-M199 HydrophobicContact CB-SD 4.45Å; I179-M199 HydrophobicContact CG1-SD 4.07Å; I179-M199 HydrophobicContact CG2-CE 4.1Å; I179-M199 HydrophobicContact CG2-SD 4.3Å; I179-Y202 HydrophobicContact CD1-CD2 3.88Å; I179-Y202 HydrophobicContact CD1-CG 3.93Å; I179-Y202 HydrophobicContact CG1-CG 4.31Å; I179-Y202 HydrophobicContact CG2-CD1 3.87Å; I179-Y202 HydrophobicContact CG2-CD2 4.3Å; I179-Y202 HydrophobicContact CG2-CE1 3.9Å; I179-Y202 HydrophobicContact CG2-CE2 4.34Å; I179-Y202 HydrophobicContact CG2-CG 4.08Å; I179-I211 HydrophobicContact CD1-CD1 4.06Å; I179-I211 HydrophobicContact CD1-CG1 4.12Å; I179-I211 HydrophobicContact CG1-CD1 3.72Å; I179-I211 HydrophobicContact CG1-CG1 4.08Å
180	R	96.5	Very high	94.3	Very high	110 Å²	110	56.5 Å²	56.5	42%	0.415	25%	0.25	S	C	.	.	H	α-helix	trans	-58.5	-45.7	179.8	-173.3	177.4	82.6	122.3	-4.5	112.3	D176 E177 E178 H184 F286	D176-R180 WeakPolarHBondContact O-CB 3.43Å; D176-R180 PolarHBondContact O-N 2.85Å; E177-R180 PolarHBondContact O-N 3.03Å; E177-R180 IonicContact OE1-CZ 3.08Å; E177-R180 IonicContact OE1-NE 3.18Å; E177-R180 PolarHBondContact OE1-NE 3.44Å; E177-R180 IonicContact OE1-NH2 2.84Å; E177-R180 PolarHBondContact OE1-NH2 3.29Å; E177-R180 IonicContact OE2-CZ 3.9Å; E177-R180 IonicContact OE2-NE 3.79Å; E177-R180 PolarHBondContact OE2-NE 2.8Å; E177-R180 IonicContact OE2-NH2 3.92Å; E177-R180 PolarHBondContact OE2-NH2 2.81Å; E178-R180 PolarHBondContact O-N 3.48Å; R180-H184 WeakPolarHBondContact O-CB 3.48Å; R180-H184 PolarHBondContact O-N 3.5Å; R180-H184 VanDerWaalsContact O-N 3.1Å; R180-F286 VanDerWaalsContact NH2-CD2 3.27Å
181	I	96.8	Very high	94.2	Very high	0 Å²	0	56 Å²	56	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-66	-46.5	179.6	-72.4	171.2	0	0	0	110.6	E177 E178 I179 H184 L185 L256 F281 F286	E177-I181 HydrophobicContact CG-CD1 3.94Å; E177-I181 HydrophobicContact CG-CG1 4.5Å; E177-I181 WeakPolarHBondContact O-CB 3.45Å; E177-I181 VanDerWaalsContact O-CG1 3.3Å; E177-I181 WeakPolarHBondContact O-CG1 3.24Å; E177-I181 PolarHBondContact O-N 2.83Å; E178-I181 PolarHBondContact O-N 3.39Å; I179-I181 PolarHBondContact O-N 3.43Å; I181-H184 WeakPolarHBondContact O-CB 3.32Å; I181-H184 PolarHBondContact O-N 3.35Å; I181-L185 HydrophobicContact CG2-CD1 3.68Å; I181-L185 HydrophobicContact CG2-CG 4.41Å; I181-L185 VanDerWaalsContact O-CG 3.32Å; I181-L185 WeakPolarHBondContact O-CG 3.44Å; I181-L185 PolarHBondContact O-N 3.38Å; I181-L256 HydrophobicContact CD1-CD2 4.03Å; I181-L256 HydrophobicContact CG1-CD2 4.02Å; I181-L256 HydrophobicContact CG2-CD1 4.07Å; I181-L256 HydrophobicContact CG2-CD2 4.24Å; I181-F281 HydrophobicContact CG2-CD1 3.92Å; I181-F286 HydrophobicContact CG1-CE2 3.99Å; I181-F286 HydrophobicContact CG1-CZ 4.46Å
182	L	97.1	Very high	93.9	Very high	5 Å²	5	55.6 Å²	55.6	3%	0.026	26%	0.257	C	S	.	.	H	α-helix	trans	-66.7	-39.8	-178.6	-71.9	171.6	0	0	0	112.3	E178 I179 H184 L185 R186 I196 I197 M199 F213 F281	E178-L182 HydrophobicContact CG-CD1 3.84Å; E178-L182 HydrophobicContact CG-CG 4.48Å; E178-L182 WeakPolarHBondContact O-CB 3.18Å; E178-L182 VanDerWaalsContact O-CG 3.27Å; E178-L182 WeakPolarHBondContact O-CG 3.43Å; E178-L182 PolarHBondContact O-N 2.95Å; I179-L182 PolarHBondContact O-N 2.91Å; L182-H184 VanDerWaalsContact C-N 3.31Å; L182-H184 PolarHBondContact O-N 3.03Å; L182-L185 PolarHBondContact O-N 2.91Å; L182-R186 VanDerWaalsContact O-CB 3.26Å; L182-R186 WeakPolarHBondContact O-CB 3.36Å; L182-R186 PolarHBondContact O-N 3.29Å; L182-I196 HydrophobicContact CD2-CG2 4.22Å; L182-I197 HydrophobicContact CD2-CG2 4.06Å; L182-M199 HydrophobicContact CD1-CB 4.38Å; L182-F213 HydrophobicContact CD1-CE1 3.68Å; L182-F213 HydrophobicContact CD1-CZ 4.25Å; L182-F281 HydrophobicContact CD2-CB 4.35Å; L182-F281 HydrophobicContact CD2-CD2 3.74Å; L182-F281 HydrophobicContact CD2-CE2 4.21Å; L182-F281 HydrophobicContact CD2-CG 4.02Å; L182-F281 HydrophobicContact CG-CB 4.38Å
183	D	95.5	Very high	93.8	Very high	50 Å²	50	57 Å²	57	27%	0.267	27%	0.269	S	S	.	.	H	α-helix	trans	-62	-39.6	173.1	-90.7	-10.1	0	0	0	111.9	I179 M199	I179-D183 WeakPolarHBondContact O-CB 3.4Å; I179-D183 PolarHBondContact O-N 2.84Å; D183-M199 WeakPolarHBondContact OD1-CE 3.44Å
184	H	95.3	Very high	93.9	Very high	58 Å²	58	50.9 Å²	50.9	27%	0.269	25%	0.247	S	C	.	.	H	α-helix	trans	-63.7	-44.3	175.8	-179.5	67.5	0	0	0	112.4	R180 I181 L182 Q188 N254	R180-H184 WeakPolarHBondContact O-CB 3.48Å; R180-H184 PolarHBondContact O-N 3.5Å; R180-H184 VanDerWaalsContact O-N 3.1Å; I181-H184 WeakPolarHBondContact O-CB 3.32Å; I181-H184 PolarHBondContact O-N 3.35Å; L182-H184 VanDerWaalsContact C-N 3.31Å; L182-H184 PolarHBondContact O-N 3.03Å; H184-Q188 PolarHBondContact NE2-NE2 3.49Å; H184-N254 PolarHBondContact NE2-OD1 2.74Å
185	L	95.6	Very high	94.2	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-71.7	-35.9	179.4	-69	168.3	0	0	0	112.4	I181 L182 R187 Q188 D189 I196 L250 L251 L256 F281	I181-L185 HydrophobicContact CG2-CD1 3.68Å; I181-L185 HydrophobicContact CG2-CG 4.41Å; I181-L185 VanDerWaalsContact O-CG 3.32Å; I181-L185 WeakPolarHBondContact O-CG 3.44Å; I181-L185 PolarHBondContact O-N 3.38Å; L182-L185 PolarHBondContact O-N 2.91Å; L185-R187 PolarHBondContact O-N 2.89Å; L185-Q188 PolarHBondContact O-N 2.74Å; L185-D189 PolarHBondContact O-N 3.02Å; L185-I196 HydrophobicContact CB-CD1 4.37Å; L185-I196 HydrophobicContact CD1-CD1 4.06Å; L185-I196 HydrophobicContact CD1-CG2 4.49Å; L185-I196 HydrophobicContact CD2-CD1 4.2Å; L185-I196 HydrophobicContact CG-CD1 4.45Å; L185-L250 HydrophobicContact CD2-CD2 4.13Å; L185-L250 HydrophobicContact CD2-CG 4.2Å; L185-L251 HydrophobicContact CD1-CD2 3.78Å; L185-L251 HydrophobicContact CD2-CD2 3.91Å; L185-L256 HydrophobicContact CD1-CD1 4.18Å; L185-L256 HydrophobicContact CD2-CD1 3.86Å; L185-L256 HydrophobicContact CG-CD1 4.08Å; L185-F281 HydrophobicContact CD1-CD1 4.22Å; L185-F281 HydrophobicContact CD1-CE1 3.83Å; L185-F281 HydrophobicContact CD1-CZ 4.38Å
186	R	93.3	Very high	94.2	Very high	98 Å²	98	50.4 Å²	50.4	37%	0.37	25%	0.245	S	C	.	.	H	α-helix	trans	-58.8	-33.7	-178.3	-177.3	56	171.4	145	-3.7	112.9	L182 Q188 D189 S190 H198	L182-R186 VanDerWaalsContact O-CB 3.26Å; L182-R186 WeakPolarHBondContact O-CB 3.36Å; L182-R186 PolarHBondContact O-N 3.29Å; R186-Q188 PolarHBondContact O-N 3.23Å; R186-D189 PolarHBondContact NH1-O 2.91Å; R186-D189 CarbonylContact O-C 3.58Å; R186-D189 PolarHBondContact O-N 2.86Å; R186-S190 PolarHBondContact NH1-O 3.33Å; R186-S190 PolarHBondContact O-N 2.92Å; R186-H198 PolarHBondContact NH1-CE1 2.87Å; R186-H198 PolarHBondContact NH1-ND1 3.22Å; R186-H198 VanDerWaalsContact NH1-ND1 3.14Å; R186-H198 PolarHBondContact NH1-NE2 3Å
187	R	91.8	Very high	94.3	Very high	180 Å²	180	47.4 Å²	47.4	68%	0.679	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-23.9	176.7	-62.2	-179.4	-162.3	110.5	7.6	113.2	L185	L185-R187 PolarHBondContact O-N 2.89Å
188	Q	93.1	Very high	94.4	Very high	75 Å²	75	46 Å²	46	35%	0.35	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-16	-179.6	-62.9	174	64.3	0	0	112.6	H184 L185 R186 L250 N254	H184-Q188 PolarHBondContact NE2-NE2 3.49Å; L185-Q188 PolarHBondContact O-N 2.74Å; R186-Q188 PolarHBondContact O-N 3.23Å; Q188-L250 HydrophobicContact CB-CD1 4.1Å; Q188-L250 HydrophobicContact CB-CD2 4.37Å; Q188-N254 PolarHBondContact NE2-ND2 2.82Å; Q188-N254 PolarHBondContact NE2-OD1 3.01Å; Q188-N254 PolarHBondContact OE1-ND2 3.23Å; Q188-N254 PolarHBondContact OE1-OD1 2.83Å
189	D	92.4	Very high	94.4	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.005	23%	0.227	C	C	.	.			trans	-116.8	49.3	177.5	-168.9	44.5	0	0	0	111.3	L185 R186 D191 G192 T193 H194 H198 L250	L185-D189 PolarHBondContact O-N 3.02Å; R186-D189 PolarHBondContact NH1-O 2.91Å; R186-D189 CarbonylContact O-C 3.58Å; R186-D189 PolarHBondContact O-N 2.86Å; D189-D191 VanDerWaalsContact C-N 3.31Å; D189-D191 PolarHBondContact O-N 3.22Å; D189-G192 PolarHBondContact O-N 3.44Å; D189-G192 VanDerWaalsContact OD1-C 3.23Å; D189-G192 VanDerWaalsContact OD1-CA 3.27Å; D189-G192 WeakPolarHBondContact OD1-CA 3.26Å; D189-G192 PolarHBondContact OD1-N 2.67Å; D189-T193 PolarHBondContact OD1-N 3.35Å; D189-H194 HydrophobicContact CB-CB 4.26Å; D189-H194 WeakPolarHBondContact OD1-CB 3.28Å; D189-H194 IonicContact OD1-CG 2.89Å; D189-H194 PolarHBondContact OD1-N 2.98Å; D189-H194 IonicContact OD1-ND1 3.26Å; D189-H194 PolarHBondContact OD1-ND1 3.35Å; D189-H194 VanDerWaalsContact OD1-ND1 3.11Å; D189-H198 PolarHBondContact O-NE2 3.42Å; D189-H198 IonicContact OD2-CD2 3.85Å; D189-H198 IonicContact OD2-CE1 2.74Å; D189-H198 IonicContact OD2-NE2 3.73Å; D189-H198 PolarHBondContact OD2-NE2 3.33Å; D189-L250 HydrophobicContact CB-CD2 4.38Å
190	S	87.1	Confident	94.4	Very high	94 Å²	94	50.2 Å²	50.2	66%	0.657	24%	0.244	S	C	*	.	S	Bend	trans	-66.2	-33.7	-179.7	55.2	0	0	0	0	112.4	R186	R186-S190 PolarHBondContact NH1-O 3.33Å; R186-S190 PolarHBondContact O-N 2.92Å
191	D	88.8	Confident	94.4	Very high	112 Å²	112	46.7 Å²	46.7	60%	0.599	23%	0.234	S	C	*	.	S	Bend	trans	-89.4	-6	179.3	66	3.7	0	0	0	113.9	D189 T193	D189-D191 VanDerWaalsContact C-N 3.31Å; D189-D191 PolarHBondContact O-N 3.22Å; D191-T193 VanDerWaalsContact C-N 3.29Å; D191-T193 HydrophobicContact CB-CG2 4.26Å; D191-T193 PolarHBondContact O-N 3.12Å; D191-T193 WeakPolarHBondContact OD1-CB 3.36Å; D191-T193 WeakPolarHBondContact OD1-CG2 3.36Å; D191-T193 PolarHBondContact OD1-N 3.36Å; D191-T193 PolarHBondContact OD1-OG1 2.71Å; D191-T193 VanDerWaalsContact OD2-CG2 3.26Å; D191-T193 WeakPolarHBondContact OD2-CG2 3.4Å; D191-T193 PolarHBondContact OD2-OG1 2.7Å
192	G	88.9	Confident	94.4	Very high	9 Å²	9	52.1 Å²	52.1	9%	0.093	26%	0.255	C	S	.	.	S	Bend	trans	72.5	16.7	178.2	0	0	0	0	0	115	D189	D189-G192 PolarHBondContact O-N 3.44Å; D189-G192 VanDerWaalsContact OD1-C 3.23Å; D189-G192 VanDerWaalsContact OD1-CA 3.27Å; D189-G192 WeakPolarHBondContact OD1-CA 3.26Å; D189-G192 PolarHBondContact OD1-N 2.67Å
193	T	92.7	Very high	94.5	Very high	71 Å²	71	53.7 Å²	53.7	44%	0.436	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-22.7	-177.9	56.5	0	0	0	0	113.5	D189 D191 N195 L246	D189-T193 PolarHBondContact OD1-N 3.35Å; D191-T193 VanDerWaalsContact C-N 3.29Å; D191-T193 HydrophobicContact CB-CG2 4.26Å; D191-T193 PolarHBondContact O-N 3.12Å; D191-T193 WeakPolarHBondContact OD1-CB 3.36Å; D191-T193 WeakPolarHBondContact OD1-CG2 3.36Å; D191-T193 PolarHBondContact OD1-N 3.36Å; D191-T193 PolarHBondContact OD1-OG1 2.71Å; D191-T193 VanDerWaalsContact OD2-CG2 3.26Å; D191-T193 WeakPolarHBondContact OD2-CG2 3.4Å; D191-T193 PolarHBondContact OD2-OG1 2.7Å; T193-N195 VanDerWaalsContact C-N 3.26Å; T193-N195 PolarHBondContact O-N 2.8Å; T193-N195 PolarHBondContact O-ND2 3.03Å; T193-L246 WeakPolarHBondContact O-CD1 3.32Å
194	H	95.4	Very high	94.6	Very high	41 Å²	41	55.2 Å²	55.2	19%	0.19	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-0	179.5	-58.9	85.9	0	0	0	113.4	D189 I196 C247 L250	D189-H194 HydrophobicContact CB-CB 4.26Å; D189-H194 WeakPolarHBondContact OD1-CB 3.28Å; D189-H194 IonicContact OD1-CG 2.89Å; D189-H194 PolarHBondContact OD1-N 2.98Å; D189-H194 IonicContact OD1-ND1 3.26Å; D189-H194 PolarHBondContact OD1-ND1 3.35Å; D189-H194 VanDerWaalsContact OD1-ND1 3.11Å; H194-I196 PolarHBondContact O-N 3.47Å; H194-C247 WeakPolarHBondContact O-CA 3.3Å; H194-C247 VanDerWaalsContact O-CB 3.27Å; H194-C247 WeakPolarHBondContact O-CB 3.49Å; H194-C247 PolarHBondContact O-N 3.05Å; H194-C247 VanDerWaalsContact O-N 3.14Å; H194-L250 HydrophobicContact CB-CB 4.33Å; H194-L250 HydrophobicContact CB-CD2 3.73Å
195	N	97.4	Very high	94.7	Very high	9 Å²	9	52.5 Å²	52.5	5%	0.048	26%	0.257	C	S	.	.			trans	59	42.4	173.6	-55.3	-54	0	0	0	113.6	T193 S243 K269 I276 K277 V278	T193-N195 VanDerWaalsContact C-N 3.26Å; T193-N195 PolarHBondContact O-N 2.8Å; T193-N195 PolarHBondContact O-ND2 3.03Å; N195-S243 PolarHBondContact ND2-O 3.38Å; N195-K269 WeakPolarHBondContact OD1-CE 3.44Å; N195-K269 PolarHBondContact OD1-NZ 3Å; N195-I276 HydrophobicContact CB-CD1 4.06Å; N195-I276 WeakPolarHBondContact CB-O 3.42Å; N195-I276 PolarHBondContact OD1-O 3.03Å; N195-K277 CarbonylContact O-C 3.26Å; N195-K277 WeakPolarHBondContact O-CA 3.4Å; N195-V278 PolarHBondContact O-N 2.82Å
196	I	97.5	Very high	94.8	Very high	2 Å²	2	53.2 Å²	53.2	1%	0.01	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-104	141.4	173.3	-59.8	-178.7	0	0	0	108.8	L182 L185 H194 H198 C247 L250 L251 K277 F281	L182-I196 HydrophobicContact CD2-CG2 4.22Å; L185-I196 HydrophobicContact CB-CD1 4.37Å; L185-I196 HydrophobicContact CD1-CD1 4.06Å; L185-I196 HydrophobicContact CD1-CG2 4.49Å; L185-I196 HydrophobicContact CD2-CD1 4.2Å; L185-I196 HydrophobicContact CG-CD1 4.45Å; H194-I196 PolarHBondContact O-N 3.47Å; I196-H198 PolarHBondContact O-CD2 2.79Å; I196-H198 PolarHBondContact O-N 3.02Å; I196-H198 PolarHBondContact O-NE2 2.59Å; I196-C247 HydrophobicContact CG1-CB 4.25Å; I196-L250 HydrophobicContact CD1-CD2 3.8Å; I196-L251 HydrophobicContact CD1-CD2 4.24Å; I196-K277 VanDerWaalsContact O-CD 3.31Å; I196-K277 WeakPolarHBondContact O-CD 3.23Å; I196-K277 WeakPolarHBondContact O-CE 3.21Å; I196-K277 PolarHBondContact O-NZ 3.19Å; I196-F281 HydrophobicContact CG2-CE2 3.86Å; I196-F281 HydrophobicContact CG2-CZ 3.85Å
197	I	97.6	Very high	94.9	Very high	12 Å²	12	53.3 Å²	53.3	6%	0.062	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-57.1	135.2	173.5	-170.5	70.5	0	0	0	111.3	L182 F213 E214 L216 V278 I279 F281	L182-I197 HydrophobicContact CD2-CG2 4.06Å; I197-F213 HydrophobicContact CD1-CB 4.19Å; I197-F213 HydrophobicContact CG1-CB 4.01Å; I197-F213 HydrophobicContact CG1-CD1 3.59Å; I197-F213 HydrophobicContact CG1-CE1 4.37Å; I197-F213 HydrophobicContact CG1-CG 4.09Å; I197-F213 HydrophobicContact CG2-CD1 4.33Å; I197-F213 HydrophobicContact CG2-CE1 4.34Å; I197-E214 HydrophobicContact CD1-CG 3.58Å; I197-L216 HydrophobicContact CD1-CD1 3.48Å; I197-L216 VanDerWaalsContact CD1-CD1 3.48Å; I197-L216 HydrophobicContact CD1-CG 3.85Å; I197-V278 PolarHBondContact N-O 3.08Å; I197-I279 HydrophobicContact CB-CB 4.49Å; I197-I279 HydrophobicContact CB-CG2 4.06Å; I197-I279 HydrophobicContact CD1-CG2 4.22Å; I197-I279 HydrophobicContact CG1-CG2 4.33Å; I197-I279 HydrophobicContact CG2-CB 4.46Å; I197-F281 HydrophobicContact CG2-CD2 4.39Å; I197-F281 HydrophobicContact CG2-CE2 4.37Å
198	H	96.3	Very high	95.3	Very high	20 Å²	20	44.8 Å²	44.8	9%	0.093	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-95.9	117.6	176.4	-62.7	165.7	0	0	0	110.2	R186 D189 I196 F213 E214 K277	R186-H198 PolarHBondContact NH1-CE1 2.87Å; R186-H198 PolarHBondContact NH1-ND1 3.22Å; R186-H198 VanDerWaalsContact NH1-ND1 3.14Å; R186-H198 PolarHBondContact NH1-NE2 3Å; D189-H198 PolarHBondContact O-NE2 3.42Å; D189-H198 IonicContact OD2-CD2 3.85Å; D189-H198 IonicContact OD2-CE1 2.74Å; D189-H198 IonicContact OD2-NE2 3.73Å; D189-H198 PolarHBondContact OD2-NE2 3.33Å; I196-H198 PolarHBondContact O-CD2 2.79Å; I196-H198 PolarHBondContact O-N 3.02Å; I196-H198 PolarHBondContact O-NE2 2.59Å; H198-F213 WeakPolarHBondContact O-CA 3.32Å; H198-E214 WeakPolarHBondContact CB-OE1 3.3Å; H198-E214 IonicContact CG-OE1 3.41Å; H198-E214 PolarHBondContact N-OE1 3.05Å; H198-E214 IonicContact ND1-OE1 3.18Å; H198-E214 PolarHBondContact O-N 3.3Å; H198-K277 PolarHBondContact CD2-NZ 3.24Å; H198-K277 PolarHBondContact CE1-NZ 3.22Å; H198-K277 PolarHBondContact ND1-NZ 2.96Å; H198-K277 PolarHBondContact NE2-NZ 3.43Å
199	M	96.9	Very high	95.5	Very high	23 Å²	23	42.7 Å²	42.7	11%	0.113	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	136.2	164.9	-177.4	178.1	70.7	0	0	109.2	I179 L182 D183 Y202 I211 T212 F213	I179-M199 HydrophobicContact CB-SD 4.45Å; I179-M199 HydrophobicContact CG1-SD 4.07Å; I179-M199 HydrophobicContact CG2-CE 4.1Å; I179-M199 HydrophobicContact CG2-SD 4.3Å; L182-M199 HydrophobicContact CD1-CB 4.38Å; D183-M199 WeakPolarHBondContact OD1-CE 3.44Å; M199-Y202 HydrophobicContact CE-CD1 3.88Å; M199-Y202 HydrophobicContact CE-CE1 4.38Å; M199-Y202 HydrophobicContact SD-CD1 4.13Å; M199-I211 HydrophobicContact CG-CG2 3.58Å; M199-I211 HydrophobicContact SD-CG2 3.58Å; M199-I211 VanDerWaalsContact SD-CG2 3.58Å; M199-T212 CarbonylContact C-O 3.6Å; M199-T212 WeakPolarHBondContact CA-O 3.33Å; M199-F213 HydrophobicContact CB-CD1 4.23Å; M199-F213 HydrophobicContact CB-CE1 4.18Å
200	L	96.2	Very high	95.8	Very high	83 Å²	83	42.7 Å²	42.7	44%	0.435	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	-39.2	-178.6	-56.7	179.5	0	0	0	112.2	V160 T212	V160-L200 HydrophobicContact CG1-CD1 3.79Å; L200-T212 PolarHBondContact N-O 3.11Å
201	D	96.4	Very high	96.3	Very high	37 Å²	37	38.2 Å²	38.2	20%	0.198	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	154.8	-174.6	-152.4	-20.1	0	0	0	109.4	R133 T212	R133-D201 IonicContact CZ-OD2 3.92Å; R133-D201 IonicContact NH1-OD2 3.05Å; R133-D201 PolarHBondContact NH1-OD2 3.37Å; R133-D201 IonicContact NH2-OD2 3.89Å; D201-T212 WeakPolarHBondContact CA-OG1 3.48Å; D201-T212 WeakPolarHBondContact CB-OG1 3.4Å; D201-T212 PolarHBondContact N-OG1 3.42Å; D201-T212 PolarHBondContact O-N 3.39Å; D201-T212 PolarHBondContact O-OG1 3.13Å; D201-T212 VanDerWaalsContact O-OG1 3.1Å
202	Y	97.7	Very high	96.8	Very high	113 Å²	113	32.9 Å²	32.9	44%	0.443	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	142.4	172.3	68.7	-89.3	0	0	0	110.8	I179 M199 C210	I179-Y202 HydrophobicContact CD1-CD2 3.88Å; I179-Y202 HydrophobicContact CD1-CG 3.93Å; I179-Y202 HydrophobicContact CG1-CG 4.31Å; I179-Y202 HydrophobicContact CG2-CD1 3.87Å; I179-Y202 HydrophobicContact CG2-CD2 4.3Å; I179-Y202 HydrophobicContact CG2-CE1 3.9Å; I179-Y202 HydrophobicContact CG2-CE2 4.34Å; I179-Y202 HydrophobicContact CG2-CG 4.08Å; M199-Y202 HydrophobicContact CE-CD1 3.88Å; M199-Y202 HydrophobicContact CE-CE1 4.38Å; M199-Y202 HydrophobicContact SD-CD1 4.13Å; Y202-C210 CarbonylContact C-O 3.55Å; Y202-C210 VanDerWaalsContact CA-O 3.24Å; Y202-C210 WeakPolarHBondContact CA-O 3.27Å
203	F	97.9	Very high	97.2	Very high	39 Å²	39	33.3 Å²	33.3	17%	0.171	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161	172.4	-176.6	54.9	-89	0	0	0	111	I130 A131 Y134 L162 F205 C210 T212	I130-F203 HydrophobicContact CG2-CE2 3.81Å; I130-F203 HydrophobicContact CG2-CZ 4Å; A131-F203 HydrophobicContact CB-CD2 3.9Å; A131-F203 HydrophobicContact CB-CE2 3.47Å; A131-F203 VanDerWaalsContact CB-CE2 3.47Å; A131-F203 HydrophobicContact CB-CZ 4.05Å; Y134-F203 HydrophobicContact CD2-CE1 4.18Å; Y134-F203 AromaticContact CD2-CZ 3.78Å; Y134-F203 HydrophobicContact CD2-CZ 3.78Å; Y134-F203 HydrophobicContact CE2-CD1 4.46Å; Y134-F203 AromaticContact CE2-CE1 3.38Å; Y134-F203 HydrophobicContact CE2-CE1 3.38Å; Y134-F203 AromaticContact CE2-CZ 3.45Å; Y134-F203 HydrophobicContact CE2-CZ 3.45Å; Y134-F203 VanDerWaalsContact CE2-CZ 3.45Å; Y134-F203 AromaticContact CZ-CE1 3.98Å; L162-F203 HydrophobicContact CD1-CZ 4.26Å; F203-F205 HydrophobicContact CD2-CB 4.2Å; F203-F205 HydrophobicContact CE2-CB 4.01Å; F203-C210 HydrophobicContact CD1-CB 4.44Å; F203-C210 HydrophobicContact CD2-CB 3.8Å; F203-C210 HydrophobicContact CE1-CB 4.11Å; F203-C210 HydrophobicContact CE2-CB 3.41Å; F203-C210 VanDerWaalsContact CE2-CB 3.41Å; F203-C210 HydrophobicContact CG-CB 4.29Å; F203-C210 HydrophobicContact CZ-CB 3.59Å; F203-C210 PolarHBondContact N-O 2.86Å; F203-C210 PolarHBondContact O-N 3.12Å; F203-T212 HydrophobicContact CE1-CG2 4.15Å
204	N	97.8	Very high	97.5	Very high	81 Å²	81	32.3 Å²	32.3	43%	0.433	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	137.2	170.4	-60.4	-47	0	0	0	109.8	H208 K209	N204-H208 CarbonylContact C-O 3.57Å; N204-H208 WeakPolarHBondContact CA-O 3.38Å; N204-K209 WeakPolarHBondContact OD1-CG 3.47Å
205	F	98.1	Very high	97.6	Very high	1 Å²	1	33 Å²	33	0%	0.004	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	122.5	173.5	175.5	-108.5	0	0	0	109.3	Y90 Y122 I130 A131 F203 N207 H208	Y90-F205 WeakPolarHBondContact OH-CD2 3Å; Y122-F205 HydrophobicContact CE1-CE1 4.48Å; Y122-F205 HydrophobicContact CE2-CE1 4.18Å; Y122-F205 AromaticContact CZ-CE1 3.81Å; Y122-F205 WeakPolarHBondContact OH-CE1 3.09Å; I130-F205 HydrophobicContact CB-CD1 4.41Å; I130-F205 HydrophobicContact CB-CE1 4.42Å; I130-F205 HydrophobicContact CD1-CD1 3.81Å; I130-F205 HydrophobicContact CD1-CE1 3.47Å; I130-F205 VanDerWaalsContact CD1-CE1 3.47Å; I130-F205 HydrophobicContact CD1-CZ 4.39Å; I130-F205 HydrophobicContact CG2-CB 4.21Å; I130-F205 HydrophobicContact CG2-CD1 3.74Å; I130-F205 HydrophobicContact CG2-CE1 4.23Å; I130-F205 HydrophobicContact CG2-CG 3.96Å; A131-F205 HydrophobicContact CB-CD2 4.24Å; A131-F205 VanDerWaalsContact N-CD2 3.33Å; A131-F205 VanDerWaalsContact N-CE2 3.34Å; F203-F205 HydrophobicContact CD2-CB 4.2Å; F203-F205 HydrophobicContact CE2-CB 4.01Å; F205-N207 VanDerWaalsContact C-N 3.3Å; F205-N207 PolarHBondContact O-N 3.09Å; F205-H208 PolarHBondContact N-O 3.32Å; F205-H208 WeakPolarHBondContact O-CB 3.44Å; F205-H208 PolarHBondContact O-N 2.91Å
206	R	97.1	Very high	97.6	Very high	16 Å²	16	33.8 Å²	33.8	6%	0.06	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.1	51.6	179.6	-62.6	-179.3	-179.3	167	-0.4	113	F82 E83 E86 N112 Y122 H208	F82-R206 HydrophobicContact CE1-CG 4.28Å; E83-R206 IonicContact OE1-NH2 3.93Å; E83-R206 PolarHBondContact OE1-NH2 3.14Å; E86-R206 WeakPolarHBondContact OE1-CG 3.43Å; E86-R206 IonicContact OE1-NE 3.75Å; E86-R206 PolarHBondContact OE1-NE 2.72Å; E86-R206 IonicContact OE2-CZ 3.69Å; E86-R206 IonicContact OE2-NE 2.88Å; E86-R206 PolarHBondContact OE2-NE 2.96Å; E86-R206 IonicContact OE2-NH2 2.82Å; E86-R206 PolarHBondContact OE2-NH2 3.04Å; N112-R206 PolarHBondContact ND2-O 3.43Å; Y122-R206 HydrophobicContact CE2-CB 4.12Å; Y122-R206 PolarHBondContact OH-NH1 3.35Å; R206-H208 PolarHBondContact O-CD2 2.95Å; R206-H208 PolarHBondContact O-N 3.35Å
207	N	96.8	Very high	97.6	Very high	100 Å²	100	35.3 Å²	35.3	54%	0.535	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.4	6.1	-177.9	-60.5	-45.2	0	0	0	117.1	N112 N167 H172 F205	N112-N207 PolarHBondContact OD1-ND2 2.9Å; N167-N207 PolarHBondContact OD1-O 2.95Å; H172-N207 PolarHBondContact CE1-O 2.82Å; H172-N207 PolarHBondContact NE2-O 3.15Å; F205-N207 VanDerWaalsContact C-N 3.3Å; F205-N207 PolarHBondContact O-N 3.09Å
208	H	98.3	Very high	97.6	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	138.3	169.8	-64.2	-85.7	0	0	0	111.3	D116 G120 Y122 V165 N204 F205 R206	D116-H208 IonicContact OD1-CD2 3.93Å; D116-H208 IonicContact OD1-CE1 2.64Å; D116-H208 IonicContact OD1-NE2 2.77Å; D116-H208 PolarHBondContact OD1-NE2 3.33Å; D116-H208 IonicContact OD2-CE1 3.38Å; D116-H208 IonicContact OD2-NE2 3.52Å; G120-H208 PolarHBondContact O-CE1 3.49Å; Y122-H208 WeakPolarHBondContact CB-NE2 3.34Å; Y122-H208 AromaticContact CD2-CD2 3.47Å; Y122-H208 VanDerWaalsContact CD2-CD2 3.47Å; Y122-H208 WeakPolarHBondContact CD2-CD2 3.41Å; Y122-H208 AromaticContact CD2-NE2 3.51Å; Y122-H208 AromaticContact CG-NE2 3.98Å; Y122-H208 PolarHBondContact N-CE1 3.06Å; V165-H208 PolarHBondContact O-ND1 3.02Å; N204-H208 CarbonylContact C-O 3.57Å; N204-H208 WeakPolarHBondContact CA-O 3.38Å; F205-H208 PolarHBondContact N-O 3.32Å; F205-H208 WeakPolarHBondContact O-CB 3.44Å; F205-H208 PolarHBondContact O-N 2.91Å; R206-H208 PolarHBondContact O-CD2 2.95Å; R206-H208 PolarHBondContact O-N 3.35Å
209	K	98	Very high	97.7	Very high	31 Å²	31	37 Å²	37	14%	0.135	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	127.3	161.5	-72.5	-179.2	-177	-76	0	109	V165 H172 A175 D176 N204	V165-K209 HydrophobicContact CB-CB 4.04Å; V165-K209 WeakPolarHBondContact CB-O 3.48Å; V165-K209 HydrophobicContact CG2-CB 4.09Å; V165-K209 WeakPolarHBondContact CG2-O 3.4Å; V165-K209 PolarHBondContact N-O 3.38Å; H172-K209 HydrophobicContact CB-CD 4.13Å; H172-K209 WeakPolarHBondContact O-CE 3.3Å; A175-K209 HydrophobicContact CB-CB 4.27Å; A175-K209 HydrophobicContact CB-CD 3.78Å; D176-K209 VanDerWaalsContact CG-CE 3.47Å; D176-K209 VanDerWaalsContact CG-NZ 3.26Å; D176-K209 WeakPolarHBondContact OD1-CE 3.32Å; D176-K209 IonicContact OD1-NZ 3.35Å; D176-K209 PolarHBondContact OD1-NZ 3.41Å; D176-K209 WeakPolarHBondContact OD2-CE 3.49Å; D176-K209 IonicContact OD2-NZ 3.24Å; D176-K209 PolarHBondContact OD2-NZ 3.1Å; N204-K209 WeakPolarHBondContact OD1-CG 3.47Å
210	C	98.6	Very high	97.7	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.007	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	132.8	179	-64.4	0	0	0	0	109.6	L162 K163 Y202 F203	L162-C210 HydrophobicContact CD2-CB 4.31Å; K163-C210 VanDerWaalsContact O-CA 3.29Å; K163-C210 WeakPolarHBondContact O-CA 3.44Å; Y202-C210 CarbonylContact C-O 3.55Å; Y202-C210 VanDerWaalsContact CA-O 3.24Å; Y202-C210 WeakPolarHBondContact CA-O 3.27Å; F203-C210 HydrophobicContact CD1-CB 4.44Å; F203-C210 HydrophobicContact CD2-CB 3.8Å; F203-C210 HydrophobicContact CE1-CB 4.11Å; F203-C210 HydrophobicContact CE2-CB 3.41Å; F203-C210 VanDerWaalsContact CE2-CB 3.41Å; F203-C210 HydrophobicContact CG-CB 4.29Å; F203-C210 HydrophobicContact CZ-CB 3.59Å; F203-C210 PolarHBondContact N-O 2.86Å; F203-C210 PolarHBondContact O-N 3.12Å
211	I	98.5	Very high	97.8	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	128.6	176.8	-49.8	172.4	0	0	0	107.9	L162 K163 A175 I179 M199 F213	L162-I211 CarbonylContact C-O 3.14Å; L162-I211 WeakPolarHBondContact CA-O 3.33Å; K163-I211 HydrophobicContact CB-CB 4.49Å; K163-I211 PolarHBondContact N-O 3.24Å; K163-I211 PolarHBondContact O-N 3.46Å; A175-I211 HydrophobicContact CB-CD1 4.48Å; I179-I211 HydrophobicContact CD1-CD1 4.06Å; I179-I211 HydrophobicContact CD1-CG1 4.12Å; I179-I211 HydrophobicContact CG1-CD1 3.72Å; I179-I211 HydrophobicContact CG1-CG1 4.08Å; M199-I211 HydrophobicContact CG-CG2 3.58Å; M199-I211 HydrophobicContact SD-CG2 3.58Å; M199-I211 VanDerWaalsContact SD-CG2 3.58Å; I211-F213 HydrophobicContact CB-CE2 3.8Å; I211-F213 HydrophobicContact CB-CZ 3.98Å; I211-F213 HydrophobicContact CG2-CD2 4.31Å; I211-F213 HydrophobicContact CG2-CE1 3.94Å; I211-F213 HydrophobicContact CG2-CE2 3.56Å; I211-F213 HydrophobicContact CG2-CZ 3.36Å
212	T	98.5	Very high	97.9	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.006	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	142.9	176.4	61.1	0	0	0	0	110.8	Y134 A161 L162 M199 L200 D201 F203	Y134-T212 HydrophobicContact CD1-CG2 4.48Å; Y134-T212 HydrophobicContact CE1-CG2 3.84Å; Y134-T212 HydrophobicContact CE2-CG2 4.33Å; A161-T212 CarbonylContact O-C 3.51Å; A161-T212 WeakPolarHBondContact O-CA 3.17Å; L162-T212 HydrophobicContact CB-CG2 4.21Å; L162-T212 HydrophobicContact CD1-CG2 3.97Å; L162-T212 HydrophobicContact CG-CG2 3.84Å; M199-T212 CarbonylContact C-O 3.6Å; M199-T212 WeakPolarHBondContact CA-O 3.33Å; L200-T212 PolarHBondContact N-O 3.11Å; D201-T212 WeakPolarHBondContact CA-OG1 3.48Å; D201-T212 WeakPolarHBondContact CB-OG1 3.4Å; D201-T212 PolarHBondContact N-OG1 3.42Å; D201-T212 PolarHBondContact O-N 3.39Å; D201-T212 PolarHBondContact O-OG1 3.13Å; D201-T212 VanDerWaalsContact O-OG1 3.1Å; F203-T212 HydrophobicContact CE1-CG2 4.15Å
213	F	98.4	Very high	97.9	Very high	17 Å²	17	33.4 Å²	33.4	8%	0.075	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	158.9	-178	-57.3	-87.1	0	0	0	110.1	A161 K163 L182 I197 H198 M199 I211 L215	A161-F213 HydrophobicContact CB-CB 4.34Å; A161-F213 PolarHBondContact N-O 2.93Å; A161-F213 PolarHBondContact O-N 3.18Å; K163-F213 HydrophobicContact CB-CE2 3.89Å; K163-F213 HydrophobicContact CD-CE2 4.25Å; L182-F213 HydrophobicContact CD1-CE1 3.68Å; L182-F213 HydrophobicContact CD1-CZ 4.25Å; I197-F213 HydrophobicContact CD1-CB 4.19Å; I197-F213 HydrophobicContact CG1-CB 4.01Å; I197-F213 HydrophobicContact CG1-CD1 3.59Å; I197-F213 HydrophobicContact CG1-CE1 4.37Å; I197-F213 HydrophobicContact CG1-CG 4.09Å; I197-F213 HydrophobicContact CG2-CD1 4.33Å; I197-F213 HydrophobicContact CG2-CE1 4.34Å; H198-F213 WeakPolarHBondContact O-CA 3.32Å; M199-F213 HydrophobicContact CB-CD1 4.23Å; M199-F213 HydrophobicContact CB-CE1 4.18Å; I211-F213 HydrophobicContact CB-CE2 3.8Å; I211-F213 HydrophobicContact CB-CZ 3.98Å; I211-F213 HydrophobicContact CG2-CD2 4.31Å; I211-F213 HydrophobicContact CG2-CE1 3.94Å; I211-F213 HydrophobicContact CG2-CE2 3.56Å; I211-F213 HydrophobicContact CG2-CZ 3.36Å; F213-L215 PolarHBondContact O-N 3.29Å
214	E	97.2	Very high	98	Very high	50 Å²	50	31.6 Å²	31.6	23%	0.234	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.6	139.2	163.3	69.5	-171.4	124.5	0	0	110.4	I197 H198 L216 K277	I197-E214 HydrophobicContact CD1-CG 3.58Å; H198-E214 WeakPolarHBondContact CB-OE1 3.3Å; H198-E214 IonicContact CG-OE1 3.41Å; H198-E214 PolarHBondContact N-OE1 3.05Å; H198-E214 IonicContact ND1-OE1 3.18Å; H198-E214 PolarHBondContact O-N 3.3Å; E214-L216 HydrophobicContact CG-CD2 3.87Å; E214-L216 HydrophobicContact CG-CG 4.23Å; E214-L216 PolarHBondContact O-N 2.83Å; E214-K277 VanDerWaalsContact OE1-CD 3.32Å; E214-K277 WeakPolarHBondContact OE1-CD 3.42Å; E214-K277 WeakPolarHBondContact OE1-CE 3.39Å; E214-K277 IonicContact OE1-NZ 3.52Å; E214-K277 PolarHBondContact OE1-NZ 2.95Å; E214-K277 IonicContact OE2-NZ 2.7Å; E214-K277 PolarHBondContact OE2-NZ 3.11Å
215	L	98.1	Very high	98	Very high	57 Å²	57	32.9 Å²	32.9	30%	0.298	16%	0.16	S	C	.	.			trans	-81.6	114.5	177.7	-175.5	66.8	0	0	0	110.1	I140 K150 A161 F213	I140-L215 HydrophobicContact CD1-CD1 3.98Å; K150-L215 HydrophobicContact CD-CD2 4.01Å; K150-L215 HydrophobicContact CG-CD1 4.47Å; K150-L215 HydrophobicContact CG-CD2 4.02Å; A161-L215 HydrophobicContact CB-CD1 4.09Å; F213-L215 PolarHBondContact O-N 3.29Å
216	L	97.9	Very high	98	Very high	25 Å²	25	39.5 Å²	39.5	13%	0.131	19%	0.185	C	C	.	.			trans	-95.7	179.2	174.4	-57.1	-178.3	0	0	0	111.9	I197 E214 L267 K277 I279	I197-L216 HydrophobicContact CD1-CD1 3.48Å; I197-L216 VanDerWaalsContact CD1-CD1 3.48Å; I197-L216 HydrophobicContact CD1-CG 3.85Å; E214-L216 HydrophobicContact CG-CD2 3.87Å; E214-L216 HydrophobicContact CG-CG 4.23Å; E214-L216 PolarHBondContact O-N 2.83Å; L216-L267 HydrophobicContact CB-CB 4Å; L216-L267 HydrophobicContact CB-CD2 3.91Å; L216-L267 HydrophobicContact CD1-CB 3.76Å; L216-L267 HydrophobicContact CD1-CD2 4.3Å; L216-K277 HydrophobicContact CD1-CB 3.82Å; L216-K277 HydrophobicContact CD1-CD 4.37Å; L216-K277 HydrophobicContact CD1-CG 4.45Å; L216-K277 HydrophobicContact CD2-CD 4.26Å; L216-I279 HydrophobicContact CD1-CG2 4.11Å
217	S	97.3	Very high	98	Very high	33 Å²	33	41.7 Å²	41.7	23%	0.231	20%	0.198	C	C	.	.			trans	-89.7	-159.3	174.9	-160.6	0	0	0	0	111.7	L267 L268	S217-L267 WeakPolarHBondContact O-CD2 3.49Å; S217-L268 WeakPolarHBondContact CA-O 3.45Å; S217-L268 VanDerWaalsContact CB-O 3.25Å; S217-L268 WeakPolarHBondContact CB-O 3.23Å; S217-L268 PolarHBondContact N-O 3.33Å
218	I	97.1	Very high	98.1	Very high	31 Å²	31	44.6 Å²	44.6	16%	0.159	21%	0.206	C	C	.	.			trans	-63.5	154.7	-178.2	64.1	174.7	0	0	0	112.6	E222 L223 L268	I218-E222 HydrophobicContact CB-CB 4.12Å; I218-E222 HydrophobicContact CD1-CB 4.44Å; I218-L223 HydrophobicContact CD1-CB 4.06Å; I218-L223 HydrophobicContact CD1-CD1 4.09Å; I218-L268 HydrophobicContact CD1-CD1 4.46Å; I218-L268 HydrophobicContact CG1-CD1 3.98Å; I218-L268 PolarHBondContact O-N 3.41Å
219	N	98.1	Very high	98.1	Very high	36 Å²	36	47.6 Å²	47.6	19%	0.193	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-75.4	166.3	169.6	67.2	42.6	0	0	0	112.4	Y221 E222 L223 E264 V266 L267	N219-Y221 VanDerWaalsContact C-N 3.3Å; N219-Y221 PolarHBondContact O-N 3.29Å; N219-Y221 WeakPolarHBondContact OD1-CB 3.18Å; N219-Y221 PolarHBondContact OD1-N 2.94Å; N219-E222 PolarHBondContact O-N 3.16Å; N219-E222 WeakPolarHBondContact OD1-CB 3.26Å; N219-E222 WeakPolarHBondContact OD1-CG 3.48Å; N219-E222 PolarHBondContact OD1-N 3.39Å; N219-L223 PolarHBondContact O-N 2.74Å; N219-E264 VanDerWaalsContact CB-O 3.26Å; N219-E264 WeakPolarHBondContact CB-O 3.49Å; N219-V266 CarbonylContact C-O 3.56Å; N219-V266 VanDerWaalsContact CA-O 3.26Å; N219-V266 WeakPolarHBondContact CA-O 3.42Å; N219-L267 HydrophobicContact CB-CD1 3.62Å; N219-L267 HydrophobicContact CB-CG 4.04Å
220	L	98.6	Very high	98.1	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-68	-27.6	-177.7	-67.2	-172.5	0	0	0	113	L223 I224 F240 P263 V266 L268 I276 L327	L220-L223 HydrophobicContact CD2-CD2 3.95Å; L220-L223 WeakPolarHBondContact O-CB 3.47Å; L220-L223 PolarHBondContact O-N 2.92Å; L220-I224 VanDerWaalsContact O-CG1 3.31Å; L220-I224 WeakPolarHBondContact O-CG1 3.33Å; L220-I224 PolarHBondContact O-N 3.22Å; L220-F240 HydrophobicContact CD1-CG 4.47Å; L220-F240 HydrophobicContact CD2-CD1 4.35Å; L220-F240 HydrophobicContact CD2-CE1 3.93Å; L220-F240 HydrophobicContact CD2-CE2 4.17Å; L220-F240 HydrophobicContact CD2-CZ 3.83Å; L220-P263 HydrophobicContact CB-CB 4.13Å; L220-P263 PolarHBondContact N-O 2.76Å; L220-V266 HydrophobicContact CD1-CB 3.8Å; L220-V266 HydrophobicContact CD1-CG1 3.54Å; L220-V266 HydrophobicContact CG-CB 3.96Å; L220-V266 HydrophobicContact CG-CG1 3.89Å; L220-V266 WeakPolarHBondContact CG-O 3.36Å; L220-V266 PolarHBondContact N-O 3.49Å; L220-L268 HydrophobicContact CD2-CD2 4.11Å; L220-L268 HydrophobicContact CD2-CG 4.49Å; L220-I276 HydrophobicContact CD2-CG2 4.23Å; L220-L327 HydrophobicContact CB-CD2 4.13Å; L220-L327 HydrophobicContact CD1-CD1 4.07Å; L220-L327 HydrophobicContact CD1-CD2 4.03Å
221	Y	98.3	Very high	98.1	Very high	79 Å²	79	53.1 Å²	53.1	31%	0.31	25%	0.247	S	C	.	.	H	α-helix	trans	-63.5	-48.4	173.1	-179.1	-105.4	0	0	0	111.7	N219 L223 I224 K225 P263 E264	N219-Y221 VanDerWaalsContact C-N 3.3Å; N219-Y221 PolarHBondContact O-N 3.29Å; N219-Y221 WeakPolarHBondContact OD1-CB 3.18Å; N219-Y221 PolarHBondContact OD1-N 2.94Å; Y221-L223 PolarHBondContact O-N 3.45Å; Y221-I224 WeakPolarHBondContact O-CB 3.17Å; Y221-I224 PolarHBondContact O-N 2.97Å; Y221-I224 VanDerWaalsContact O-N 3.14Å; Y221-K225 PolarHBondContact O-N 3.43Å; Y221-P263 PolarHBondContact N-O 3Å; Y221-E264 HydrophobicContact CG-CG 4.37Å
222	E	98.1	Very high	98	Very high	67 Å²	67	54 Å²	54	31%	0.313	25%	0.251	S	S	.	.	H	α-helix	trans	-63.3	-31.6	175.1	-72.8	-59.7	142.3	0	0	111.4	I218 N219 K225 R226	I218-E222 HydrophobicContact CB-CB 4.12Å; I218-E222 HydrophobicContact CD1-CB 4.44Å; N219-E222 PolarHBondContact O-N 3.16Å; N219-E222 WeakPolarHBondContact OD1-CB 3.26Å; N219-E222 WeakPolarHBondContact OD1-CG 3.48Å; N219-E222 PolarHBondContact OD1-N 3.39Å; E222-K225 PolarHBondContact O-N 2.89Å; E222-R226 WeakPolarHBondContact O-CB 3.3Å; E222-R226 VanDerWaalsContact O-CG 3.29Å; E222-R226 WeakPolarHBondContact O-CG 3.32Å; E222-R226 PolarHBondContact O-N 3.43Å
223	L	98.3	Very high	98	Very high	35 Å²	35	57.2 Å²	57.2	18%	0.183	27%	0.274	C	S	.	.	H	α-helix	trans	-65.6	-44.9	172	-172.7	66.2	0	0	0	111.9	I218 N219 L220 Y221 K225 R226 N227 F232 F240 L268	I218-L223 HydrophobicContact CD1-CB 4.06Å; I218-L223 HydrophobicContact CD1-CD1 4.09Å; N219-L223 PolarHBondContact O-N 2.74Å; L220-L223 HydrophobicContact CD2-CD2 3.95Å; L220-L223 WeakPolarHBondContact O-CB 3.47Å; L220-L223 PolarHBondContact O-N 2.92Å; Y221-L223 PolarHBondContact O-N 3.45Å; L223-K225 VanDerWaalsContact C-N 3.3Å; L223-K225 PolarHBondContact O-N 3.45Å; L223-R226 PolarHBondContact O-N 3.45Å; L223-N227 WeakPolarHBondContact O-CB 3.32Å; L223-N227 PolarHBondContact O-N 2.91Å; L223-F232 HydrophobicContact CB-CZ 4.33Å; L223-F232 HydrophobicContact CD2-CE1 4.45Å; L223-F232 HydrophobicContact CD2-CE2 4.36Å; L223-F232 HydrophobicContact CD2-CZ 3.92Å; L223-F232 HydrophobicContact CG-CE1 4.21Å; L223-F232 HydrophobicContact CG-CE2 4.48Å; L223-F232 HydrophobicContact CG-CZ 3.67Å; L223-F240 HydrophobicContact CD2-CE2 4.2Å; L223-F240 HydrophobicContact CD2-CZ 3.83Å; L223-L268 HydrophobicContact CD1-CD1 4.14Å; L223-L268 HydrophobicContact CD2-CD1 4.14Å; L223-L268 HydrophobicContact CD2-CD2 4.35Å
224	I	98.6	Very high	97.9	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-57.5	-46.1	174.5	-68.3	160.1	0	0	0	110.1	L220 Y221 N227 K228 F229 F232 E326 L327	L220-I224 VanDerWaalsContact O-CG1 3.31Å; L220-I224 WeakPolarHBondContact O-CG1 3.33Å; L220-I224 PolarHBondContact O-N 3.22Å; Y221-I224 WeakPolarHBondContact O-CB 3.17Å; Y221-I224 PolarHBondContact O-N 2.97Å; Y221-I224 VanDerWaalsContact O-N 3.14Å; I224-N227 CarbonylContact O-C 3.6Å; I224-N227 WeakPolarHBondContact O-CA 3.23Å; I224-N227 PolarHBondContact O-N 2.66Å; I224-K228 PolarHBondContact O-N 3.4Å; I224-F229 HydrophobicContact CG2-CD1 3.63Å; I224-F229 HydrophobicContact CG2-CE1 4.18Å; I224-F229 HydrophobicContact CG2-CG 4.39Å; I224-F229 PolarHBondContact O-N 2.89Å; I224-F232 HydrophobicContact CG1-CE2 3.63Å; I224-F232 HydrophobicContact CG1-CZ 4.06Å; I224-E326 HydrophobicContact CD1-CG 3.91Å; I224-L327 HydrophobicContact CD1-CD2 3.99Å; I224-L327 HydrophobicContact CG1-CD2 4.15Å
225	K	98.3	Very high	97.9	Very high	108 Å²	108	60.3 Å²	60.3	47%	0.47	29%	0.291	S	S	.	.	H	α-helix	trans	-63.6	-43.4	179	-175	-179.9	177.5	-174	0	112.4	Y221 E222 L223 N227 K228 F229	Y221-K225 PolarHBondContact O-N 3.43Å; E222-K225 PolarHBondContact O-N 2.89Å; L223-K225 VanDerWaalsContact C-N 3.3Å; L223-K225 PolarHBondContact O-N 3.45Å; K225-N227 PolarHBondContact O-N 3.31Å; K225-K228 WeakPolarHBondContact O-CA 3.17Å; K225-K228 PolarHBondContact O-N 3.18Å; K225-F229 HydrophobicContact CB-CE1 4.46Å; K225-F229 HydrophobicContact CB-CE2 4.47Å; K225-F229 HydrophobicContact CB-CZ 4.01Å; K225-F229 HydrophobicContact CG-CE2 4.15Å; K225-F229 HydrophobicContact CG-CZ 3.92Å
226	R	97.6	Very high	97.9	Very high	140 Å²	140	59.8 Å²	59.8	53%	0.528	29%	0.288	S	S	.	.	H	α-helix	trans	-61.3	-33.5	173.9	-77.5	-178.6	-174.8	-162.9	-0.3	112.1	E222 L223 K228	E222-R226 WeakPolarHBondContact O-CB 3.3Å; E222-R226 VanDerWaalsContact O-CG 3.29Å; E222-R226 WeakPolarHBondContact O-CG 3.32Å; E222-R226 PolarHBondContact O-N 3.43Å; L223-R226 PolarHBondContact O-N 3.45Å; R226-K228 PolarHBondContact O-N 3.04Å
227	N	97.5	Very high	97.9	Very high	62 Å²	62	58.6 Å²	58.6	33%	0.332	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	16.8	171.8	-164.2	45.3	0	0	0	113.4	L223 I224 K225 F229 Q230 G231 F232	L223-N227 WeakPolarHBondContact O-CB 3.32Å; L223-N227 PolarHBondContact O-N 2.91Å; I224-N227 CarbonylContact O-C 3.6Å; I224-N227 WeakPolarHBondContact O-CA 3.23Å; I224-N227 PolarHBondContact O-N 2.66Å; K225-N227 PolarHBondContact O-N 3.31Å; N227-F229 PolarHBondContact O-N 3.38Å; N227-Q230 WeakPolarHBondContact O-CB 3.26Å; N227-Q230 WeakPolarHBondContact O-CG 3.43Å; N227-Q230 PolarHBondContact O-N 3.05Å; N227-Q230 VanDerWaalsContact O-N 3.08Å; N227-G231 PolarHBondContact ND2-O 3Å; N227-F232 HydrophobicContact CB-CE1 3.7Å; N227-F232 HydrophobicContact CB-CZ 4.23Å; N227-F232 WeakPolarHBondContact ND2-CE1 3.13Å
228	K	98.3	Very high	97.9	Very high	162 Å²	162	58.7 Å²	58.7	70%	0.704	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	35.9	175.9	-55.9	179	-179.4	178.2	0	113.3	I224 K225 R226 Q230	I224-K228 PolarHBondContact O-N 3.4Å; K225-K228 WeakPolarHBondContact O-CA 3.17Å; K225-K228 PolarHBondContact O-N 3.18Å; R226-K228 PolarHBondContact O-N 3.04Å; K228-Q230 HydrophobicContact CB-CG 4.45Å; K228-Q230 PolarHBondContact O-N 3.38Å; K228-Q230 VanDerWaalsContact O-N 3.11Å; K228-Q230 PolarHBondContact O-NE2 3.5Å
229	F	98.2	Very high	97.9	Very high	64 Å²	64	61.1 Å²	61.1	28%	0.281	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.8	26.1	179.5	-50.4	-87.6	0	0	0	114.3	I224 K225 N227 G231 G330 Y331	I224-F229 HydrophobicContact CG2-CD1 3.63Å; I224-F229 HydrophobicContact CG2-CE1 4.18Å; I224-F229 HydrophobicContact CG2-CG 4.39Å; I224-F229 PolarHBondContact O-N 2.89Å; K225-F229 HydrophobicContact CB-CE1 4.46Å; K225-F229 HydrophobicContact CB-CE2 4.47Å; K225-F229 HydrophobicContact CB-CZ 4.01Å; K225-F229 HydrophobicContact CG-CE2 4.15Å; K225-F229 HydrophobicContact CG-CZ 3.92Å; N227-F229 PolarHBondContact O-N 3.38Å; F229-G231 PolarHBondContact O-N 2.77Å; F229-G330 WeakPolarHBondContact CD1-O 3.33Å; F229-Y331 HydrophobicContact CB-CE2 3.89Å; F229-Y331 VanDerWaalsContact O-CE2 3.32Å; F229-Y331 WeakPolarHBondContact O-CE2 3.43Å
230	Q	98.2	Very high	97.9	Very high	137 Å²	137	59.5 Å²	59.5	64%	0.64	28%	0.278	S	S	*	.			trans	-77.6	-7.3	178.2	-64.2	-58.8	-53.1	0	0	113.4	N227 K228	N227-Q230 WeakPolarHBondContact O-CB 3.26Å; N227-Q230 WeakPolarHBondContact O-CG 3.43Å; N227-Q230 PolarHBondContact O-N 3.05Å; N227-Q230 VanDerWaalsContact O-N 3.08Å; K228-Q230 HydrophobicContact CB-CG 4.45Å; K228-Q230 PolarHBondContact O-N 3.38Å; K228-Q230 VanDerWaalsContact O-N 3.11Å; K228-Q230 PolarHBondContact O-NE2 3.5Å
231	G	98.1	Very high	97.9	Very high	10 Å²	10	59.5 Å²	59.5	10%	0.103	28%	0.278	C	S	.	.			trans	76.6	166.8	-173	0	0	0	0	0	113.1	N227 F229 L328	N227-G231 PolarHBondContact ND2-O 3Å; F229-G231 PolarHBondContact O-N 2.77Å; G231-L328 WeakPolarHBondContact CA-O 3.47Å
232	F	98.4	Very high	98	Very high	19 Å²	19	61.7 Å²	61.7	8%	0.083	29%	0.286	C	S	.	.			trans	-109.1	157.9	-179.8	-60	-56.5	0	0	0	111.8	L223 I224 N227 L236 V237 L327 L328	L223-F232 HydrophobicContact CB-CZ 4.33Å; L223-F232 HydrophobicContact CD2-CE1 4.45Å; L223-F232 HydrophobicContact CD2-CE2 4.36Å; L223-F232 HydrophobicContact CD2-CZ 3.92Å; L223-F232 HydrophobicContact CG-CE1 4.21Å; L223-F232 HydrophobicContact CG-CE2 4.48Å; L223-F232 HydrophobicContact CG-CZ 3.67Å; I224-F232 HydrophobicContact CG1-CE2 3.63Å; I224-F232 HydrophobicContact CG1-CZ 4.06Å; N227-F232 HydrophobicContact CB-CE1 3.7Å; N227-F232 HydrophobicContact CB-CZ 4.23Å; N227-F232 WeakPolarHBondContact ND2-CE1 3.13Å; F232-L236 HydrophobicContact CB-CB 4.41Å; F232-L236 HydrophobicContact CB-CD2 4.12Å; F232-L236 HydrophobicContact CB-CG 4.47Å; F232-L236 HydrophobicContact CD1-CD2 3.94Å; F232-L236 HydrophobicContact CG-CD2 4.04Å; F232-V237 HydrophobicContact CB-CG2 4.04Å; F232-L327 WeakPolarHBondContact CB-O 3.46Å; F232-L327 HydrophobicContact CD2-CB 4.08Å; F232-L327 HydrophobicContact CD2-CD2 3.92Å; F232-L327 WeakPolarHBondContact CD2-O 3.44Å; F232-L327 HydrophobicContact CE2-CD2 3.72Å; F232-L327 PolarHBondContact N-O 3.02Å; F232-L328 PolarHBondContact N-O 2.89Å; F232-L328 WeakPolarHBondContact O-CD1 3.33Å
233	S	98	Very high	98	Very high	69 Å²	69	59.5 Å²	59.5	48%	0.483	28%	0.278	S	S	.	.			trans	-61.7	145.5	172.3	69.8	0	0	0	0	111.1	M235 L236 V237	S233-M235 PolarHBondContact O-N 3.44Å; S233-L236 PolarHBondContact O-N 2.9Å; S233-L236 PolarHBondContact OG-N 3.14Å; S233-V237 WeakPolarHBondContact O-CG2 3.03Å; S233-V237 PolarHBondContact O-N 3.21Å
234	L	96.5	Very high	98	Very high	38 Å²	38	57.8 Å²	57.8	20%	0.199	27%	0.269	C	S	.	.	H	α-helix	trans	-53.5	-31.3	176.3	-81	171.2	0	0	0	112.8	R238 L328 D417 F420	L234-R238 VanDerWaalsContact O-CB 3.26Å; L234-R238 WeakPolarHBondContact O-CB 3.38Å; L234-R238 PolarHBondContact O-N 2.95Å; L234-L328 HydrophobicContact CD2-CD1 3.72Å; L234-L328 HydrophobicContact CD2-CD2 3.98Å; L234-L328 HydrophobicContact CD2-CG 4.47Å; L234-L328 HydrophobicContact CG-CD1 3.87Å; L234-D417 HydrophobicContact CD1-CB 4.1Å; L234-F420 HydrophobicContact CD2-CB 4.1Å; L234-F420 HydrophobicContact CD2-CD1 3.98Å; L234-F420 HydrophobicContact CD2-CD2 4.26Å; L234-F420 HydrophobicContact CD2-CE1 4.48Å; L234-F420 HydrophobicContact CD2-CG 3.84Å
235	M	96.1	Very high	98	Very high	94 Å²	94	57.8 Å²	57.8	46%	0.463	27%	0.269	S	S	.	.	H	α-helix	trans	-64.9	-42	175.5	-175.7	178	64	0	0	112.4	S233 K239 L451	S233-M235 PolarHBondContact O-N 3.44Å; M235-K239 PolarHBondContact O-N 2.64Å; M235-L451 HydrophobicContact CG-CD2 3.98Å; M235-L451 HydrophobicContact SD-CD2 4.06Å
236	L	97.5	Very high	98	Very high	46 Å²	46	54.5 Å²	54.5	24%	0.241	26%	0.257	C	S	.	.	H	α-helix	trans	-71.4	-42	177	-178.3	57.2	0	0	0	111.2	F232 S233 R238 K239 F240	F232-L236 HydrophobicContact CB-CB 4.41Å; F232-L236 HydrophobicContact CB-CD2 4.12Å; F232-L236 HydrophobicContact CB-CG 4.47Å; F232-L236 HydrophobicContact CD1-CD2 3.94Å; F232-L236 HydrophobicContact CG-CD2 4.04Å; S233-L236 PolarHBondContact O-N 2.9Å; S233-L236 PolarHBondContact OG-N 3.14Å; L236-R238 VanDerWaalsContact C-N 3.26Å; L236-R238 PolarHBondContact O-N 3.43Å; L236-K239 WeakPolarHBondContact O-CB 2.98Å; L236-K239 PolarHBondContact O-N 3.21Å; L236-K239 VanDerWaalsContact O-N 3.09Å; L236-F240 HydrophobicContact CD1-CD2 4.29Å; L236-F240 HydrophobicContact CD1-CE1 4.34Å; L236-F240 HydrophobicContact CD1-CE2 3.75Å; L236-F240 HydrophobicContact CD1-CZ 3.77Å; L236-F240 HydrophobicContact CD2-CE2 3.98Å; L236-F240 HydrophobicContact CD2-CZ 4.38Å; L236-F240 HydrophobicContact CG-CD2 4.06Å; L236-F240 HydrophobicContact CG-CE2 3.54Å; L236-F240 HydrophobicContact CG-CZ 4.06Å; L236-F240 WeakPolarHBondContact O-CD2 3.48Å; L236-F240 PolarHBondContact O-N 2.8Å
237	V	98.6	Very high	98	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-57	-41.5	173.7	179.9	0	0	0	0	110.8	F232 S233 K239 F240 A241 L324 L327 L328 F420 W446	F232-V237 HydrophobicContact CB-CG2 4.04Å; S233-V237 WeakPolarHBondContact O-CG2 3.03Å; S233-V237 PolarHBondContact O-N 3.21Å; V237-K239 PolarHBondContact O-N 3.34Å; V237-F240 PolarHBondContact O-N 2.96Å; V237-A241 WeakPolarHBondContact O-CB 3.27Å; V237-A241 PolarHBondContact O-N 2.95Å; V237-L324 HydrophobicContact CG1-CB 4.21Å; V237-L324 HydrophobicContact CG1-CD2 3.95Å; V237-L327 HydrophobicContact CG1-CB 4.48Å; V237-L327 HydrophobicContact CG2-CB 4.08Å; V237-L328 HydrophobicContact CG2-CB 4.18Å; V237-L328 HydrophobicContact CG2-CD1 4.41Å; V237-F420 HydrophobicContact CG1-CE2 4.07Å; V237-F420 HydrophobicContact CG1-CZ 4.29Å; V237-W446 HydrophobicContact CG1-CH2 4.18Å; V237-W446 HydrophobicContact CG1-CZ2 4.28Å
238	R	97.8	Very high	98.1	Very high	35 Å²	35	45.2 Å²	45.2	13%	0.132	22%	0.217	C	C	.	.	H	α-helix	trans	-61.1	-41.3	175.1	-171.8	-178.2	-63.4	101.2	8.5	112.9	L234 L236 A241 Y242 W446 L447	L234-R238 VanDerWaalsContact O-CB 3.26Å; L234-R238 WeakPolarHBondContact O-CB 3.38Å; L234-R238 PolarHBondContact O-N 2.95Å; L236-R238 VanDerWaalsContact C-N 3.26Å; L236-R238 PolarHBondContact O-N 3.43Å; R238-A241 PolarHBondContact O-N 2.82Å; R238-Y242 PolarHBondContact O-N 2.82Å; R238-W446 HydrophobicContact CB-CH2 4.34Å; R238-W446 HydrophobicContact CB-CZ2 3.93Å; R238-W446 WeakPolarHBondContact CD-O 3.35Å; R238-W446 HydrophobicContact CG-CZ2 4.42Å; R238-W446 PolarHBondContact NE-O 2.81Å; R238-L447 HydrophobicContact CG-CD2 3.66Å
239	K	97.4	Very high	98.1	Very high	82 Å²	82	38.4 Å²	38.4	36%	0.357	19%	0.189	S	C	.	.	H	α-helix	trans	-62.9	-46.3	176	-72.4	-178	178.5	-175.6	0	111.2	M235 L236 V237 Y242 S243	M235-K239 PolarHBondContact O-N 2.64Å; L236-K239 WeakPolarHBondContact O-CB 2.98Å; L236-K239 PolarHBondContact O-N 3.21Å; L236-K239 VanDerWaalsContact O-N 3.09Å; V237-K239 PolarHBondContact O-N 3.34Å; K239-Y242 PolarHBondContact O-N 3.07Å; K239-S243 PolarHBondContact O-N 3.48Å; K239-S243 PolarHBondContact O-OG 3.48Å
240	F	98.6	Very high	98.1	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.009	18%	0.177	C	C	.	.	H	α-helix	trans	-63.5	-42	176.3	-66.7	-43	0	0	0	112.3	L220 L223 L236 V237 Y242 S243 M244 L268 S274 I276 L327	L220-F240 HydrophobicContact CD1-CG 4.47Å; L220-F240 HydrophobicContact CD2-CD1 4.35Å; L220-F240 HydrophobicContact CD2-CE1 3.93Å; L220-F240 HydrophobicContact CD2-CE2 4.17Å; L220-F240 HydrophobicContact CD2-CZ 3.83Å; L223-F240 HydrophobicContact CD2-CE2 4.2Å; L223-F240 HydrophobicContact CD2-CZ 3.83Å; L236-F240 HydrophobicContact CD1-CD2 4.29Å; L236-F240 HydrophobicContact CD1-CE1 4.34Å; L236-F240 HydrophobicContact CD1-CE2 3.75Å; L236-F240 HydrophobicContact CD1-CZ 3.77Å; L236-F240 HydrophobicContact CD2-CE2 3.98Å; L236-F240 HydrophobicContact CD2-CZ 4.38Å; L236-F240 HydrophobicContact CG-CD2 4.06Å; L236-F240 HydrophobicContact CG-CE2 3.54Å; L236-F240 HydrophobicContact CG-CZ 4.06Å; L236-F240 WeakPolarHBondContact O-CD2 3.48Å; L236-F240 PolarHBondContact O-N 2.8Å; V237-F240 PolarHBondContact O-N 2.96Å; F240-Y242 PolarHBondContact O-N 2.55Å; F240-S243 PolarHBondContact O-N 3.44Å; F240-M244 HydrophobicContact CB-CE 4.17Å; F240-M244 WeakPolarHBondContact O-CB 3.31Å; F240-M244 WeakPolarHBondContact O-CE 3.49Å; F240-M244 WeakPolarHBondContact O-CG 3.24Å; F240-M244 PolarHBondContact O-N 3.08Å; F240-L268 HydrophobicContact CE1-CD2 3.85Å; F240-L268 HydrophobicContact CZ-CD2 4.11Å; F240-S274 WeakPolarHBondContact CE1-O 3.45Å; F240-I276 HydrophobicContact CD1-CG2 3.7Å; F240-I276 HydrophobicContact CE1-CG2 3.69Å; F240-L327 HydrophobicContact CB-CD1 4.13Å; F240-L327 HydrophobicContact CD2-CD1 4.06Å; F240-L327 HydrophobicContact CG-CD1 4.46Å
241	A	98.7	Very high	98.1	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-56.6	-50.2	174.9	0	0	0	0	0	111.6	V237 R238 S243 M244 L245 L324 W446 L447	V237-A241 WeakPolarHBondContact O-CB 3.27Å; V237-A241 PolarHBondContact O-N 2.95Å; R238-A241 PolarHBondContact O-N 2.82Å; A241-S243 PolarHBondContact O-N 3.04Å; A241-M244 PolarHBondContact O-N 2.81Å; A241-L245 WeakPolarHBondContact O-CB 3.37Å; A241-L245 WeakPolarHBondContact O-CD1 3.42Å; A241-L245 WeakPolarHBondContact O-CG 3.49Å; A241-L245 PolarHBondContact O-N 2.95Å; A241-L324 HydrophobicContact CB-CD1 3.77Å; A241-L324 HydrophobicContact CB-CD2 3.61Å; A241-L324 HydrophobicContact CB-CG 4.35Å; A241-W446 HydrophobicContact CB-CH2 3.65Å; A241-W446 HydrophobicContact CB-CZ3 3.6Å; A241-L447 HydrophobicContact CB-CD2 4.05Å
242	Y	98.4	Very high	98.1	Very high	125 Å²	125	31.4 Å²	31.4	49%	0.49	16%	0.155	S	C	.	.	H	α-helix	trans	-58.5	-48.8	178.3	-177.6	-97.7	0	0	0	111.7	R238 K239 F240 M244 L245 L246 L442	R238-Y242 PolarHBondContact O-N 2.82Å; K239-Y242 PolarHBondContact O-N 3.07Å; F240-Y242 PolarHBondContact O-N 2.55Å; Y242-M244 PolarHBondContact O-N 2.84Å; Y242-L245 PolarHBondContact O-N 3.33Å; Y242-L246 HydrophobicContact CD1-CD1 4.19Å; Y242-L246 HydrophobicContact CD1-CG 4.5Å; Y242-L246 HydrophobicContact CE1-CD1 3.69Å; Y242-L246 HydrophobicContact CE1-CD2 4.38Å; Y242-L246 HydrophobicContact CE1-CG 4.16Å; Y242-L246 WeakPolarHBondContact O-CG 3.11Å; Y242-L246 PolarHBondContact O-N 3.21Å; Y242-L246 VanDerWaalsContact O-N 3.12Å; Y242-L442 HydrophobicContact CD2-CD2 3.73Å; Y242-L442 HydrophobicContact CE2-CD2 3.73Å
243	S	98.1	Very high	98	Very high	20 Å²	20	37.1 Å²	37.1	14%	0.14	18%	0.179	C	C	.	.	H	α-helix	trans	-63.9	-39.4	179.9	-65	0	0	0	0	113.6	N195 K239 F240 A241 L246 I276	N195-S243 PolarHBondContact ND2-O 3.38Å; K239-S243 PolarHBondContact O-N 3.48Å; K239-S243 PolarHBondContact O-OG 3.48Å; F240-S243 PolarHBondContact O-N 3.44Å; A241-S243 PolarHBondContact O-N 3.04Å; S243-L246 PolarHBondContact O-N 3.41Å; S243-I276 VanDerWaalsContact CB-CG1 3.48Å
244	M	98.8	Very high	98	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-66.9	-37.9	174.9	-73.3	-175.3	-75.2	0	0	111.5	F240 A241 Y242 L246 C247 L248 V266 I276 L320 I323 L324 L327	F240-M244 HydrophobicContact CB-CE 4.17Å; F240-M244 WeakPolarHBondContact O-CB 3.31Å; F240-M244 WeakPolarHBondContact O-CE 3.49Å; F240-M244 WeakPolarHBondContact O-CG 3.24Å; F240-M244 PolarHBondContact O-N 3.08Å; A241-M244 PolarHBondContact O-N 2.81Å; Y242-M244 PolarHBondContact O-N 2.84Å; M244-L246 VanDerWaalsContact C-N 3.32Å; M244-L246 PolarHBondContact O-N 3.36Å; M244-C247 WeakPolarHBondContact O-CB 3.43Å; M244-C247 PolarHBondContact O-N 3.14Å; M244-C247 VanDerWaalsContact O-N 3.15Å; M244-L248 WeakPolarHBondContact O-CG 3.43Å; M244-L248 PolarHBondContact O-N 2.87Å; M244-V266 HydrophobicContact CG-CG1 4.28Å; M244-V266 HydrophobicContact CG-CG2 4.42Å; M244-V266 HydrophobicContact SD-CG1 4.37Å; M244-V266 HydrophobicContact SD-CG2 3.92Å; M244-I276 HydrophobicContact CG-CD1 4.13Å; M244-L320 HydrophobicContact CB-CD1 3.92Å; M244-L320 HydrophobicContact CE-CD1 3.56Å; M244-L320 HydrophobicContact SD-CD1 3.89Å; M244-I323 HydrophobicContact CE-CG2 4.06Å; M244-I323 HydrophobicContact SD-CG2 4.21Å; M244-L324 HydrophobicContact CE-CD2 3.62Å; M244-L327 HydrophobicContact CE-CD1 4.31Å
245	L	98.8	Very high	98.1	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-66	-31.6	178	-76.9	166.7	0	0	0	113.3	A241 Y242 C247 L248 D249 M317 L320 F423 P438 A441 L442 L447	A241-L245 WeakPolarHBondContact O-CB 3.37Å; A241-L245 WeakPolarHBondContact O-CD1 3.42Å; A241-L245 WeakPolarHBondContact O-CG 3.49Å; A241-L245 PolarHBondContact O-N 2.95Å; Y242-L245 PolarHBondContact O-N 3.33Å; L245-C247 VanDerWaalsContact C-N 3.27Å; L245-C247 PolarHBondContact O-N 3.28Å; L245-L248 PolarHBondContact O-N 3.33Å; L245-D249 VanDerWaalsContact O-CB 3.23Å; L245-D249 WeakPolarHBondContact O-CB 3.44Å; L245-D249 PolarHBondContact O-N 3.44Å; L245-M317 HydrophobicContact CD2-CE 4.04Å; L245-M317 HydrophobicContact CD2-SD 3.97Å; L245-L320 HydrophobicContact CD2-CD2 3.6Å; L245-L320 HydrophobicContact CG-CD2 3.93Å; L245-F423 HydrophobicContact CD1-CZ 4.15Å; L245-P438 HydrophobicContact CD2-CB 3.99Å; L245-A441 HydrophobicContact CD1-CB 3.82Å; L245-A441 HydrophobicContact CD2-CB 3.58Å; L245-A441 HydrophobicContact CG-CB 4.38Å; L245-L442 HydrophobicContact CB-CD2 3.73Å; L245-L442 HydrophobicContact CB-CG 3.97Å; L245-L442 HydrophobicContact CD1-CD2 4.25Å; L245-L442 HydrophobicContact CD1-CG 4.42Å; L245-L447 HydrophobicContact CD1-CD1 3.26Å
246	L	98.3	Very high	98.2	Very high	39 Å²	39	35.2 Å²	35.2	20%	0.204	16%	0.156	C	C	.	.	H	α-helix	trans	-61.3	-38.2	172.3	-65.4	178.9	0	0	0	111.8	T193 Y242 S243 M244 L250 L442	T193-L246 WeakPolarHBondContact O-CD1 3.32Å; Y242-L246 HydrophobicContact CD1-CD1 4.19Å; Y242-L246 HydrophobicContact CD1-CG 4.5Å; Y242-L246 HydrophobicContact CE1-CD1 3.69Å; Y242-L246 HydrophobicContact CE1-CD2 4.38Å; Y242-L246 HydrophobicContact CE1-CG 4.16Å; Y242-L246 WeakPolarHBondContact O-CG 3.11Å; Y242-L246 PolarHBondContact O-N 3.21Å; Y242-L246 VanDerWaalsContact O-N 3.12Å; S243-L246 PolarHBondContact O-N 3.41Å; M244-L246 VanDerWaalsContact C-N 3.32Å; M244-L246 PolarHBondContact O-N 3.36Å; L246-L250 PolarHBondContact O-N 2.89Å; L246-L442 HydrophobicContact CD2-CD2 4.43Å
247	C	98.6	Very high	98.2	Very high	0 Å²	0	33 Å²	33	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-65.8	-54.5	172.3	174.3	0	0	0	0	110.4	H194 I196 M244 L245 D249 L250 L251 V278	H194-C247 WeakPolarHBondContact O-CA 3.3Å; H194-C247 VanDerWaalsContact O-CB 3.27Å; H194-C247 WeakPolarHBondContact O-CB 3.49Å; H194-C247 PolarHBondContact O-N 3.05Å; H194-C247 VanDerWaalsContact O-N 3.14Å; I196-C247 HydrophobicContact CG1-CB 4.25Å; M244-C247 WeakPolarHBondContact O-CB 3.43Å; M244-C247 PolarHBondContact O-N 3.14Å; M244-C247 VanDerWaalsContact O-N 3.15Å; L245-C247 VanDerWaalsContact C-N 3.27Å; L245-C247 PolarHBondContact O-N 3.28Å; C247-D249 VanDerWaalsContact C-N 3.28Å; C247-D249 PolarHBondContact O-N 2.83Å; C247-L250 PolarHBondContact O-N 3.36Å; C247-L250 VanDerWaalsContact O-N 3.09Å; C247-L251 WeakPolarHBondContact O-CG 3.26Å; C247-L251 PolarHBondContact O-N 3.46Å; C247-V278 HydrophobicContact CB-CB 4.45Å; C247-V278 HydrophobicContact CB-CG2 3.84Å
248	L	98.8	Very high	98.2	Very high	7 Å²	7	33 Å²	33	4%	0.037	14%	0.144	C	C	.	.	H	α-helix	trans	-62.4	-33.2	-175.3	-63.8	-178.4	0	0	0	113.1	M244 L245 L251 Q252 L261 D316 M317 L320 P438	M244-L248 WeakPolarHBondContact O-CG 3.43Å; M244-L248 PolarHBondContact O-N 2.87Å; L245-L248 PolarHBondContact O-N 3.33Å; L248-L251 HydrophobicContact CD2-CD1 4.23Å; L248-L251 PolarHBondContact O-N 3.46Å; L248-Q252 WeakPolarHBondContact O-CB 3.16Å; L248-Q252 PolarHBondContact O-N 3.05Å; L248-L261 HydrophobicContact CD1-CD2 4.18Å; L248-L261 HydrophobicContact CD2-CD2 4.26Å; L248-D316 HydrophobicContact CD2-CB 3.89Å; L248-M317 HydrophobicContact CD1-SD 3.94Å; L248-L320 HydrophobicContact CD1-CB 4.24Å; L248-L320 HydrophobicContact CD1-CD2 4.12Å; L248-P438 HydrophobicContact CB-CB 4.05Å; L248-P438 HydrophobicContact CB-CG 3.71Å
249	D	98.5	Very high	98.2	Very high	19 Å²	19	31.4 Å²	31.4	10%	0.102	14%	0.138	C	C	.	.	H	α-helix	trans	-65.3	-40.2	174.7	-172.6	69.5	0	0	0	111.9	L245 C247 Q252 K253 P438 L442	L245-D249 VanDerWaalsContact O-CB 3.23Å; L245-D249 WeakPolarHBondContact O-CB 3.44Å; L245-D249 PolarHBondContact O-N 3.44Å; C247-D249 VanDerWaalsContact C-N 3.28Å; C247-D249 PolarHBondContact O-N 2.83Å; D249-Q252 PolarHBondContact O-N 3.18Å; D249-K253 WeakPolarHBondContact O-CG 3.46Å; D249-K253 PolarHBondContact O-N 2.94Å; D249-K253 WeakPolarHBondContact OD2-CE 3.44Å; D249-K253 IonicContact OD2-NZ 3.12Å; D249-K253 PolarHBondContact OD2-NZ 2.92Å; D249-P438 HydrophobicContact CB-CB 3.99Å; D249-L442 HydrophobicContact CB-CD1 4.13Å
250	L	98.1	Very high	98.2	Very high	6 Å²	6	28 Å²	28	3%	0.031	12%	0.124	C	C	.	.	H	α-helix	trans	-66.4	-41.4	173.6	-173.4	63.2	0	0	0	111.8	L185 Q188 D189 H194 I196 L246 C247 Q252 K253 N254	L185-L250 HydrophobicContact CD2-CD2 4.13Å; L185-L250 HydrophobicContact CD2-CG 4.2Å; Q188-L250 HydrophobicContact CB-CD1 4.1Å; Q188-L250 HydrophobicContact CB-CD2 4.37Å; D189-L250 HydrophobicContact CB-CD2 4.38Å; H194-L250 HydrophobicContact CB-CB 4.33Å; H194-L250 HydrophobicContact CB-CD2 3.73Å; I196-L250 HydrophobicContact CD1-CD2 3.8Å; L246-L250 PolarHBondContact O-N 2.89Å; C247-L250 PolarHBondContact O-N 3.36Å; C247-L250 VanDerWaalsContact O-N 3.09Å; L250-Q252 VanDerWaalsContact C-N 3.32Å; L250-Q252 PolarHBondContact O-N 3.34Å; L250-K253 PolarHBondContact O-N 2.67Å; L250-N254 PolarHBondContact O-N 3.36Å; L250-N254 PolarHBondContact O-ND2 3.47Å
251	L	98.4	Very high	98.2	Very high	3 Å²	3	27.9 Å²	27.9	2%	0.016	12%	0.123	C	C	.	.	H	α-helix	trans	-61.2	-43.7	175.7	-59.7	-170.8	0	0	0	111	L185 I196 C247 L248 K253 N254 R255 L256 H258 F281	L185-L251 HydrophobicContact CD1-CD2 3.78Å; L185-L251 HydrophobicContact CD2-CD2 3.91Å; I196-L251 HydrophobicContact CD1-CD2 4.24Å; C247-L251 WeakPolarHBondContact O-CG 3.26Å; C247-L251 PolarHBondContact O-N 3.46Å; L248-L251 HydrophobicContact CD2-CD1 4.23Å; L248-L251 PolarHBondContact O-N 3.46Å; L251-K253 PolarHBondContact O-N 3.25Å; L251-N254 CarbonylContact O-C 3.56Å; L251-N254 PolarHBondContact O-N 3.14Å; L251-N254 VanDerWaalsContact O-N 3.08Å; L251-R255 PolarHBondContact O-N 2.94Å; L251-L256 HydrophobicContact CB-CB 4.17Å; L251-L256 HydrophobicContact CD2-CB 4.24Å; L251-L256 HydrophobicContact CD2-CD1 4.39Å; L251-L256 PolarHBondContact O-N 2.98Å; L251-H258 HydrophobicContact CD1-CB 4.04Å; L251-F281 HydrophobicContact CD1-CE1 4.09Å; L251-F281 HydrophobicContact CD2-CE1 3.8Å; L251-F281 HydrophobicContact CD2-CZ 4.42Å
252	Q	97.8	Very high	98.2	Very high	56 Å²	56	29.4 Å²	29.4	26%	0.262	13%	0.13	S	C	.	.	H	α-helix	trans	-61.1	-44.3	178	-174.1	174.1	-81	0	0	112.1	L248 D249 L250 N254 R255 M313 P438	L248-Q252 WeakPolarHBondContact O-CB 3.16Å; L248-Q252 PolarHBondContact O-N 3.05Å; D249-Q252 PolarHBondContact O-N 3.18Å; L250-Q252 VanDerWaalsContact C-N 3.32Å; L250-Q252 PolarHBondContact O-N 3.34Å; Q252-N254 PolarHBondContact O-N 2.75Å; Q252-R255 PolarHBondContact O-N 3.31Å; Q252-M313 HydrophobicContact CB-SD 4.24Å; Q252-M313 HydrophobicContact CG-CE 4.32Å; Q252-M313 HydrophobicContact CG-SD 3.88Å; Q252-P438 HydrophobicContact CB-CG 4.45Å
253	K	97.4	Very high	98.2	Very high	138 Å²	138	23.5 Å²	23.5	60%	0.6	11%	0.107	S	C	*	.	H	α-helix	trans	-59.6	-29.5	175.8	-74.2	164.7	175.2	161	0	112.9	D249 L250 L251	D249-K253 WeakPolarHBondContact O-CG 3.46Å; D249-K253 PolarHBondContact O-N 2.94Å; D249-K253 WeakPolarHBondContact OD2-CE 3.44Å; D249-K253 IonicContact OD2-NZ 3.12Å; D249-K253 PolarHBondContact OD2-NZ 2.92Å; L250-K253 PolarHBondContact O-N 2.67Å; L251-K253 PolarHBondContact O-N 3.25Å
254	N	97.6	Very high	98.2	Very high	23 Å²	23	25.7 Å²	25.7	12%	0.123	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	4.9	178.6	-74.7	-81.1	0	0	0	113.8	H184 Q188 L250 L251 Q252 L256	H184-N254 PolarHBondContact NE2-OD1 2.74Å; Q188-N254 PolarHBondContact NE2-ND2 2.82Å; Q188-N254 PolarHBondContact NE2-OD1 3.01Å; Q188-N254 PolarHBondContact OE1-ND2 3.23Å; Q188-N254 PolarHBondContact OE1-OD1 2.83Å; L250-N254 PolarHBondContact O-N 3.36Å; L250-N254 PolarHBondContact O-ND2 3.47Å; L251-N254 CarbonylContact O-C 3.56Å; L251-N254 PolarHBondContact O-N 3.14Å; L251-N254 VanDerWaalsContact O-N 3.08Å; Q252-N254 PolarHBondContact O-N 2.75Å; N254-L256 HydrophobicContact CB-CD1 3.83Å; N254-L256 HydrophobicContact CB-CG 4.16Å; N254-L256 PolarHBondContact O-N 3.26Å
255	R	97.7	Very high	98.2	Very high	137 Å²	137	26.2 Å²	26.2	52%	0.517	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	37.6	-175	-55.5	-175.9	64.4	-177.6	-2.3	112.8	L251 Q252 F286 D287	L251-R255 PolarHBondContact O-N 2.94Å; Q252-R255 PolarHBondContact O-N 3.31Å; R255-F286 WeakPolarHBondContact O-CA 3.31Å; R255-D287 HydrophobicContact CB-CB 4.22Å; R255-D287 IonicContact CZ-OD2 2.98Å; R255-D287 IonicContact NE-OD2 3.4Å; R255-D287 IonicContact NH2-OD2 2.99Å; R255-D287 PolarHBondContact NH2-OD2 3.19Å; R255-D287 WeakPolarHBondContact O-CB 3.44Å; R255-D287 PolarHBondContact O-N 2.94Å
256	L	97.9	Very high	98.2	Very high	2 Å²	2	26.2 Å²	26.2	1%	0.01	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	141.3	179.3	-79.2	167.5	0	0	0	110.7	I181 L185 L251 N254 F286	I181-L256 HydrophobicContact CD1-CD2 4.03Å; I181-L256 HydrophobicContact CG1-CD2 4.02Å; I181-L256 HydrophobicContact CG2-CD1 4.07Å; I181-L256 HydrophobicContact CG2-CD2 4.24Å; L185-L256 HydrophobicContact CD1-CD1 4.18Å; L185-L256 HydrophobicContact CD2-CD1 3.86Å; L185-L256 HydrophobicContact CG-CD1 4.08Å; L251-L256 HydrophobicContact CB-CB 4.17Å; L251-L256 HydrophobicContact CD2-CB 4.24Å; L251-L256 HydrophobicContact CD2-CD1 4.39Å; L251-L256 PolarHBondContact O-N 2.98Å; N254-L256 HydrophobicContact CB-CD1 3.83Å; N254-L256 HydrophobicContact CB-CG 4.16Å; N254-L256 PolarHBondContact O-N 3.26Å; L256-F286 HydrophobicContact CD1-CE1 4.25Å; L256-F286 HydrophobicContact CD2-CD1 3.55Å; L256-F286 HydrophobicContact CD2-CD2 3.94Å; L256-F286 HydrophobicContact CD2-CE1 3.55Å; L256-F286 HydrophobicContact CD2-CE2 3.91Å; L256-F286 HydrophobicContact CD2-CG 3.77Å; L256-F286 HydrophobicContact CD2-CZ 3.74Å; L256-F286 HydrophobicContact CG-CD1 3.93Å; L256-F286 HydrophobicContact CG-CE1 3.79Å; L256-F286 HydrophobicContact CG-CZ 4.34Å
257	I	98.4	Very high	98.2	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	128.2	174.9	-44.1	172	0	0	0	107.1	C259 S284 C285 D287 R290 Y311 M313 I315	I257-C259 VanDerWaalsContact CG2-SG 3.56Å; I257-S284 WeakPolarHBondContact O-CA 3.38Å; I257-S284 WeakPolarHBondContact O-CB 3.49Å; I257-C285 PolarHBondContact N-O 3.47Å; I257-C285 PolarHBondContact O-N 3.41Å; I257-D287 HydrophobicContact CD1-CB 4.38Å; I257-R290 HydrophobicContact CD1-CG 4.4Å; I257-Y311 HydrophobicContact CD1-CD2 4.25Å; I257-Y311 HydrophobicContact CD1-CE2 4.09Å; I257-M313 HydrophobicContact CG1-CG 3.91Å; I257-I315 HydrophobicContact CG2-CD1 3.57Å; I257-I315 HydrophobicContact CG2-CG1 3.68Å
258	H	98.4	Very high	98.2	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	12%	0.117	C	C	.	.			trans	-72.7	-36.6	178.3	-173.8	-81.5	0	0	0	112	L251 D260 L261 I279 D280 F281 S284 D316	L251-H258 HydrophobicContact CD1-CB 4.04Å; H258-D260 PolarHBondContact CE1-O 2.97Å; H258-D260 VanDerWaalsContact ND1-C 3.27Å; H258-D260 PolarHBondContact ND1-N 3.35Å; H258-D260 PolarHBondContact O-N 3.19Å; H258-L261 PolarHBondContact ND1-N 3.27Å; H258-L261 VanDerWaalsContact ND1-N 3.18Å; H258-I279 PolarHBondContact NE2-O 2.89Å; H258-D280 PolarHBondContact CE1-O 3.42Å; H258-D280 PolarHBondContact NE2-O 2.99Å; H258-F281 AromaticContact CD2-CE1 3.89Å; H258-F281 AromaticContact CD2-CZ 3.92Å; H258-S284 WeakPolarHBondContact CA-OG 3.43Å; H258-S284 PolarHBondContact O-OG 2.91Å; H258-D316 WeakPolarHBondContact CB-OD2 3.26Å; H258-D316 PolarHBondContact N-OD2 3.48Å
259	C	97.9	Very high	98.1	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	13%	0.13	C	C	.	.	S	Bend	trans	65.3	-9.4	175.6	-60.2	0	0	0	0	116.8	I257 S283 I295 Q296 D316	I257-C259 VanDerWaalsContact CG2-SG 3.56Å; C259-S283 VanDerWaalsContact CB-O 3.26Å; C259-S283 WeakPolarHBondContact CB-O 3.45Å; C259-I295 HydrophobicContact CB-CD1 4.26Å; C259-Q296 WeakPolarHBondContact O-CA 3.35Å; C259-Q296 WeakPolarHBondContact O-CG 3.48Å; C259-Q296 PolarHBondContact O-N 3.29Å; C259-D316 PolarHBondContact N-OD1 2.76Å
260	D	97.4	Very high	98	Very high	10 Å²	10	34.5 Å²	34.5	5%	0.053	15%	0.154	C	C	.	.			trans	-144.9	44.7	174.5	-162.1	34.5	0	0	0	113.8	H258 K262 N265 S297	H258-D260 PolarHBondContact CE1-O 2.97Å; H258-D260 VanDerWaalsContact ND1-C 3.27Å; H258-D260 PolarHBondContact ND1-N 3.35Å; H258-D260 PolarHBondContact O-N 3.19Å; D260-K262 PolarHBondContact O-N 2.79Å; D260-K262 IonicContact OD1-NZ 2.67Å; D260-K262 IonicContact OD2-NZ 2.97Å; D260-K262 PolarHBondContact OD2-NZ 2.83Å; D260-N265 PolarHBondContact O-ND2 3.03Å; D260-N265 PolarHBondContact OD2-ND2 3.29Å; D260-S297 WeakPolarHBondContact OD1-CB 3.46Å; D260-S297 PolarHBondContact OD1-N 3.11Å; D260-S297 PolarHBondContact OD1-OG 2.78Å
261	L	98.7	Very high	97.7	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	19%	0.186	C	C	.	.			trans	-72.4	123.3	176.9	-166.9	74.7	0	0	0	110.1	L248 H258 V266 V278 S319 L320 I323	L248-L261 HydrophobicContact CD1-CD2 4.18Å; L248-L261 HydrophobicContact CD2-CD2 4.26Å; H258-L261 PolarHBondContact ND1-N 3.27Å; H258-L261 VanDerWaalsContact ND1-N 3.18Å; L261-V266 HydrophobicContact CD1-CG2 4.31Å; L261-V278 HydrophobicContact CD1-CG1 3.81Å; L261-V278 HydrophobicContact CD1-CG2 4.36Å; L261-S319 WeakPolarHBondContact O-CB 3.1Å; L261-L320 HydrophobicContact CD2-CB 4.38Å; L261-I323 HydrophobicContact CB-CD1 4.48Å; L261-I323 HydrophobicContact CD2-CD1 3.98Å; L261-I323 HydrophobicContact CG-CD1 3.71Å
262	K	98.7	Very high	97.3	Very high	32 Å²	32	44.8 Å²	44.8	14%	0.139	22%	0.223	C	C	.	.	S	Bend	trans	-160.4	165.3	-177.8	64.5	-167	-174.8	-153	0	110.7	D260 E264 N265 S297 Y300	D260-K262 PolarHBondContact O-N 2.79Å; D260-K262 IonicContact OD1-NZ 2.67Å; D260-K262 IonicContact OD2-NZ 2.97Å; D260-K262 PolarHBondContact OD2-NZ 2.83Å; K262-E264 HydrophobicContact CG-CB 4.24Å; K262-E264 WeakPolarHBondContact CG-OE2 3.46Å; K262-E264 PolarHBondContact O-N 3.18Å; K262-N265 WeakPolarHBondContact CE-ND2 3.25Å; K262-N265 HydrophobicContact CG-CB 4.05Å; K262-N265 PolarHBondContact O-N 3.2Å; K262-S297 VanDerWaalsContact CD-OG 3.24Å; K262-S297 WeakPolarHBondContact CD-OG 3.35Å; K262-S297 PolarHBondContact NZ-OG 3.37Å; K262-Y300 HydrophobicContact CB-CD2 3.52Å; K262-Y300 HydrophobicContact CB-CE2 3.55Å; K262-Y300 HydrophobicContact CB-CG 4.14Å
263	P	98.7	Very high	97.2	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-58.4	-30.9	-177.8	-24.5	35.8	0	0	0	113.9	L220 Y221 N265 V266 Y300 I323	L220-P263 HydrophobicContact CB-CB 4.13Å; L220-P263 PolarHBondContact N-O 2.76Å; Y221-P263 PolarHBondContact N-O 3Å; P263-N265 VanDerWaalsContact C-N 3.27Å; P263-N265 PolarHBondContact O-N 3.35Å; P263-V266 PolarHBondContact O-N 2.94Å; P263-Y300 WeakPolarHBondContact CD-OH 3.44Å; P263-Y300 HydrophobicContact CG-CE1 4.07Å; P263-Y300 WeakPolarHBondContact CG-OH 3.44Å; P263-I323 HydrophobicContact CG-CG1 4.24Å; P263-I323 HydrophobicContact CG-CG2 4.43Å
264	E	97.8	Very high	97	Very high	67 Å²	67	46 Å²	46	31%	0.313	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-67.7	-26.2	175.7	-59.6	94	140	0	0	113.3	N219 Y221 K262 L267	N219-E264 VanDerWaalsContact CB-O 3.26Å; N219-E264 WeakPolarHBondContact CB-O 3.49Å; Y221-E264 HydrophobicContact CG-CG 4.37Å; K262-E264 HydrophobicContact CG-CB 4.24Å; K262-E264 WeakPolarHBondContact CG-OE2 3.46Å; K262-E264 PolarHBondContact O-N 3.18Å; E264-L267 WeakPolarHBondContact O-CD1 3.4Å
265	N	98.4	Very high	97	Very high	11 Å²	11	46.1 Å²	46.1	6%	0.059	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-98.2	16.1	-178.9	-71.8	-6.8	0	0	0	113	D260 K262 P263 I279	D260-N265 PolarHBondContact O-ND2 3.03Å; D260-N265 PolarHBondContact OD2-ND2 3.29Å; K262-N265 WeakPolarHBondContact CE-ND2 3.25Å; K262-N265 HydrophobicContact CG-CB 4.05Å; K262-N265 PolarHBondContact O-N 3.2Å; P263-N265 VanDerWaalsContact C-N 3.27Å; P263-N265 PolarHBondContact O-N 3.35Å; N265-I279 HydrophobicContact CB-CG1 4.15Å; N265-I279 WeakPolarHBondContact O-CG1 2.99Å; N265-I279 PolarHBondContact O-N 3.06Å
266	V	98.7	Very high	97.1	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	113.4	171.3	-175.4	0	0	0	0	108.2	N219 L220 M244 L261 P263 I276	N219-V266 CarbonylContact C-O 3.56Å; N219-V266 VanDerWaalsContact CA-O 3.26Å; N219-V266 WeakPolarHBondContact CA-O 3.42Å; L220-V266 HydrophobicContact CD1-CB 3.8Å; L220-V266 HydrophobicContact CD1-CG1 3.54Å; L220-V266 HydrophobicContact CG-CB 3.96Å; L220-V266 HydrophobicContact CG-CG1 3.89Å; L220-V266 WeakPolarHBondContact CG-O 3.36Å; L220-V266 PolarHBondContact N-O 3.49Å; M244-V266 HydrophobicContact CG-CG1 4.28Å; M244-V266 HydrophobicContact CG-CG2 4.42Å; M244-V266 HydrophobicContact SD-CG1 4.37Å; M244-V266 HydrophobicContact SD-CG2 3.92Å; L261-V266 HydrophobicContact CD1-CG2 4.31Å; P263-V266 PolarHBondContact O-N 2.94Å; V266-I276 HydrophobicContact CG1-CB 3.81Å; V266-I276 HydrophobicContact CG1-CD1 4.01Å; V266-I276 HydrophobicContact CG1-CG1 3.97Å; V266-I276 HydrophobicContact CG1-CG2 4.08Å
267	L	98.6	Very high	97.1	Very high	29 Å²	29	39.8 Å²	39.8	15%	0.152	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	142.3	-174.9	-84.8	63.8	0	0	0	111.3	L216 S217 N219 E264 I276 K277 I279	L216-L267 HydrophobicContact CB-CB 4Å; L216-L267 HydrophobicContact CB-CD2 3.91Å; L216-L267 HydrophobicContact CD1-CB 3.76Å; L216-L267 HydrophobicContact CD1-CD2 4.3Å; S217-L267 WeakPolarHBondContact O-CD2 3.49Å; N219-L267 HydrophobicContact CB-CD1 3.62Å; N219-L267 HydrophobicContact CB-CG 4.04Å; E264-L267 WeakPolarHBondContact O-CD1 3.4Å; L267-I276 CarbonylContact O-C 3.39Å; L267-I276 WeakPolarHBondContact O-CA 3.29Å; L267-I276 WeakPolarHBondContact O-CB 3.41Å; L267-K277 PolarHBondContact N-O 3.18Å; L267-K277 PolarHBondContact O-N 3.01Å; L267-I279 HydrophobicContact CB-CG2 4.36Å; L267-I279 HydrophobicContact CD1-CD1 3.35Å; L267-I279 HydrophobicContact CD1-CG1 3.69Å; L267-I279 HydrophobicContact CD1-CG2 3.98Å; L267-I279 HydrophobicContact CD2-CD1 4.19Å; L267-I279 HydrophobicContact CD2-CG2 4.32Å; L267-I279 HydrophobicContact CG-CD1 4.42Å; L267-I279 HydrophobicContact CG-CG2 4.45Å
268	L	98.5	Very high	97.1	Very high	7 Å²	7	39.8 Å²	39.8	4%	0.037	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	134.1	167.1	-66	179.5	0	0	0	109.4	S217 I218 L220 L223 F240 Q270 G275 I276	S217-L268 WeakPolarHBondContact CA-O 3.45Å; S217-L268 VanDerWaalsContact CB-O 3.25Å; S217-L268 WeakPolarHBondContact CB-O 3.23Å; S217-L268 PolarHBondContact N-O 3.33Å; I218-L268 HydrophobicContact CD1-CD1 4.46Å; I218-L268 HydrophobicContact CG1-CD1 3.98Å; I218-L268 PolarHBondContact O-N 3.41Å; L220-L268 HydrophobicContact CD2-CD2 4.11Å; L220-L268 HydrophobicContact CD2-CG 4.49Å; L223-L268 HydrophobicContact CD1-CD1 4.14Å; L223-L268 HydrophobicContact CD2-CD1 4.14Å; L223-L268 HydrophobicContact CD2-CD2 4.35Å; F240-L268 HydrophobicContact CE1-CD2 3.85Å; F240-L268 HydrophobicContact CZ-CD2 4.11Å; L268-Q270 VanDerWaalsContact C-N 3.29Å; L268-Q270 PolarHBondContact O-N 3.45Å; L268-G275 CarbonylContact C-O 3.54Å; L268-G275 WeakPolarHBondContact CA-O 3.45Å; L268-I276 HydrophobicContact CD2-CG2 3.83Å
269	K	96.8	Very high	97.1	Very high	73 Å²	73	41.5 Å²	41.5	32%	0.317	22%	0.219	S	C	.	.	S	Bend	trans	-59.6	-43.6	173	-66.6	-175.7	-170.4	-176.7	0	110.8	N195 G275 I276 K277	N195-K269 WeakPolarHBondContact OD1-CE 3.44Å; N195-K269 PolarHBondContact OD1-NZ 3Å; K269-G275 PolarHBondContact N-O 3.02Å; K269-I276 WeakPolarHBondContact CE-O 3.22Å; K269-K277 HydrophobicContact CD-CG 4.36Å; K269-K277 HydrophobicContact CG-CG 4.04Å
270	Q	95.5	Very high	97	Very high	129 Å²	129	43 Å²	43	60%	0.603	23%	0.227	S	C	*	.	S	Bend	trans	-146	151.2	-176.6	-66.2	178.3	-23.9	0	0	110.5	L268 R273	L268-Q270 VanDerWaalsContact C-N 3.29Å; L268-Q270 PolarHBondContact O-N 3.45Å; Q270-R273 HydrophobicContact CB-CB 4.46Å; Q270-R273 HydrophobicContact CB-CG 4.34Å; Q270-R273 PolarHBondContact O-N 2.94Å
271	Q	92.1	Very high	96.9	Very high	148 Å²	148	42.6 Å²	42.6	69%	0.692	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	137	176.5	-174.4	171.4	-3.5	0	0	111	R273	Q271-R273 PolarHBondContact O-N 3.2Å
272	G	91	Very high	96.6	Very high	77 Å²	77	42.8 Å²	42.8	79%	0.794	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.5	0.3	178.5	0	0	0	0	0	115.1
273	R	94.8	Very high	96.4	Very high	179 Å²	179	42.8 Å²	42.8	68%	0.675	23%	0.231	S	C	*	.			trans	-111.8	158.9	173.5	-58.4	-65	-172.6	166.3	0.4	109.9	Q270 Q271	Q270-R273 HydrophobicContact CB-CB 4.46Å; Q270-R273 HydrophobicContact CB-CG 4.34Å; Q270-R273 PolarHBondContact O-N 2.94Å; Q271-R273 PolarHBondContact O-N 3.2Å
274	S	94.4	Very high	96.2	Very high	41 Å²	41	43.2 Å²	43.2	29%	0.287	23%	0.234	S	C	.	.			trans	-98.2	-1.1	-178.5	48.3	0	0	0	0	114.2	F240 I276	F240-S274 WeakPolarHBondContact CE1-O 3.45Å; S274-I276 PolarHBondContact O-N 3.46Å
275	G	97.4	Very high	96.1	Very high	25 Å²	25	40.7 Å²	40.7	26%	0.258	22%	0.224	S	C	.	.			trans	-65.3	132.7	174.2	0	0	0	0	0	110.3	L268 K269	L268-G275 CarbonylContact C-O 3.54Å; L268-G275 WeakPolarHBondContact CA-O 3.45Å; K269-G275 PolarHBondContact N-O 3.02Å
276	I	98.5	Very high	95.9	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	164.8	179.8	58	77.4	0	0	0	112.1	N195 L220 F240 S243 M244 V266 L267 L268 K269 S274	N195-I276 HydrophobicContact CB-CD1 4.06Å; N195-I276 WeakPolarHBondContact CB-O 3.42Å; N195-I276 PolarHBondContact OD1-O 3.03Å; L220-I276 HydrophobicContact CD2-CG2 4.23Å; F240-I276 HydrophobicContact CD1-CG2 3.7Å; F240-I276 HydrophobicContact CE1-CG2 3.69Å; S243-I276 VanDerWaalsContact CB-CG1 3.48Å; M244-I276 HydrophobicContact CG-CD1 4.13Å; V266-I276 HydrophobicContact CG1-CB 3.81Å; V266-I276 HydrophobicContact CG1-CD1 4.01Å; V266-I276 HydrophobicContact CG1-CG1 3.97Å; V266-I276 HydrophobicContact CG1-CG2 4.08Å; L267-I276 CarbonylContact O-C 3.39Å; L267-I276 WeakPolarHBondContact O-CA 3.29Å; L267-I276 WeakPolarHBondContact O-CB 3.41Å; L268-I276 HydrophobicContact CD2-CG2 3.83Å; K269-I276 WeakPolarHBondContact CE-O 3.22Å; S274-I276 PolarHBondContact O-N 3.46Å
277	K	98.6	Very high	95.5	Very high	7 Å²	7	42.6 Å²	42.6	3%	0.03	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	145.5	158.7	-68.2	-171.6	160.8	-151.8	0	110.2	N195 I196 H198 E214 L216 L267 K269	N195-K277 CarbonylContact O-C 3.26Å; N195-K277 WeakPolarHBondContact O-CA 3.4Å; I196-K277 VanDerWaalsContact O-CD 3.31Å; I196-K277 WeakPolarHBondContact O-CD 3.23Å; I196-K277 WeakPolarHBondContact O-CE 3.21Å; I196-K277 PolarHBondContact O-NZ 3.19Å; H198-K277 PolarHBondContact CD2-NZ 3.24Å; H198-K277 PolarHBondContact CE1-NZ 3.22Å; H198-K277 PolarHBondContact ND1-NZ 2.96Å; H198-K277 PolarHBondContact NE2-NZ 3.43Å; E214-K277 VanDerWaalsContact OE1-CD 3.32Å; E214-K277 WeakPolarHBondContact OE1-CD 3.42Å; E214-K277 WeakPolarHBondContact OE1-CE 3.39Å; E214-K277 IonicContact OE1-NZ 3.52Å; E214-K277 PolarHBondContact OE1-NZ 2.95Å; E214-K277 IonicContact OE2-NZ 2.7Å; E214-K277 PolarHBondContact OE2-NZ 3.11Å; L216-K277 HydrophobicContact CD1-CB 3.82Å; L216-K277 HydrophobicContact CD1-CD 4.37Å; L216-K277 HydrophobicContact CD1-CG 4.45Å; L216-K277 HydrophobicContact CD2-CD 4.26Å; L267-K277 PolarHBondContact N-O 3.18Å; L267-K277 PolarHBondContact O-N 3.01Å; K269-K277 HydrophobicContact CD-CG 4.36Å; K269-K277 HydrophobicContact CG-CG 4.04Å
278	V	98.7	Very high	95.2	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	137.1	169.6	-178	0	0	0	0	108.6	N195 I197 C247 L261 F281	N195-V278 PolarHBondContact O-N 2.82Å; I197-V278 PolarHBondContact N-O 3.08Å; C247-V278 HydrophobicContact CB-CB 4.45Å; C247-V278 HydrophobicContact CB-CG2 3.84Å; L261-V278 HydrophobicContact CD1-CG1 3.81Å; L261-V278 HydrophobicContact CD1-CG2 4.36Å; V278-F281 HydrophobicContact CG1-CE2 4.39Å; V278-F281 HydrophobicContact CG1-CZ 4.42Å
279	I	98.1	Very high	94.8	Very high	36 Å²	36	50 Å²	50	19%	0.185	27%	0.269	C	S	.	.			trans	-125.3	174.2	-177.1	73	156.7	0	0	0	111.2	I197 L216 H258 N265 L267	I197-I279 HydrophobicContact CB-CB 4.49Å; I197-I279 HydrophobicContact CB-CG2 4.06Å; I197-I279 HydrophobicContact CD1-CG2 4.22Å; I197-I279 HydrophobicContact CG1-CG2 4.33Å; I197-I279 HydrophobicContact CG2-CB 4.46Å; L216-I279 HydrophobicContact CD1-CG2 4.11Å; H258-I279 PolarHBondContact NE2-O 2.89Å; N265-I279 HydrophobicContact CB-CG1 4.15Å; N265-I279 WeakPolarHBondContact O-CG1 2.99Å; N265-I279 PolarHBondContact O-N 3.06Å; L267-I279 HydrophobicContact CB-CG2 4.36Å; L267-I279 HydrophobicContact CD1-CD1 3.35Å; L267-I279 HydrophobicContact CD1-CG1 3.69Å; L267-I279 HydrophobicContact CD1-CG2 3.98Å; L267-I279 HydrophobicContact CD2-CD1 4.19Å; L267-I279 HydrophobicContact CD2-CG2 4.32Å; L267-I279 HydrophobicContact CG-CD1 4.42Å; L267-I279 HydrophobicContact CG-CG2 4.45Å
280	D	95.2	Very high	94.3	Very high	30 Å²	30	49.9 Å²	49.9	16%	0.16	27%	0.267	C	S	.	.			trans	64.1	74.9	170.2	-163.8	21.7	0	0	0	114.6	K163 H258 G282	K163-D280 IonicContact NZ-OD1 2.78Å; K163-D280 PolarHBondContact NZ-OD1 3.4Å; K163-D280 VanDerWaalsContact NZ-OD1 3.12Å; H258-D280 PolarHBondContact CE1-O 3.42Å; H258-D280 PolarHBondContact NE2-O 2.99Å; D280-G282 VanDerWaalsContact C-N 3.26Å; D280-G282 PolarHBondContact O-N 2.87Å
281	F	96.4	Very high	93.7	Very high	2 Å²	2	50 Å²	50	1%	0.009	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-89.7	13.2	178	-74.1	-104.9	0	0	0	112.4	E178 I181 L182 L185 I196 I197 L251 H258 V278 S283 S284	E178-F281 HydrophobicContact CG-CB 4.05Å; E178-F281 PolarHBondContact OE1-N 2.75Å; I181-F281 HydrophobicContact CG2-CD1 3.92Å; L182-F281 HydrophobicContact CD2-CB 4.35Å; L182-F281 HydrophobicContact CD2-CD2 3.74Å; L182-F281 HydrophobicContact CD2-CE2 4.21Å; L182-F281 HydrophobicContact CD2-CG 4.02Å; L182-F281 HydrophobicContact CG-CB 4.38Å; L185-F281 HydrophobicContact CD1-CD1 4.22Å; L185-F281 HydrophobicContact CD1-CE1 3.83Å; L185-F281 HydrophobicContact CD1-CZ 4.38Å; I196-F281 HydrophobicContact CG2-CE2 3.86Å; I196-F281 HydrophobicContact CG2-CZ 3.85Å; I197-F281 HydrophobicContact CG2-CD2 4.39Å; I197-F281 HydrophobicContact CG2-CE2 4.37Å; L251-F281 HydrophobicContact CD1-CE1 4.09Å; L251-F281 HydrophobicContact CD2-CE1 3.8Å; L251-F281 HydrophobicContact CD2-CZ 4.42Å; H258-F281 AromaticContact CD2-CE1 3.89Å; H258-F281 AromaticContact CD2-CZ 3.92Å; V278-F281 HydrophobicContact CG1-CE2 4.39Å; V278-F281 HydrophobicContact CG1-CZ 4.42Å; F281-S283 PolarHBondContact O-N 3.33Å; F281-S284 VanDerWaalsContact CA-OG 3.32Å; F281-S284 WeakPolarHBondContact CA-OG 3.33Å; F281-S284 VanDerWaalsContact CD1-OG 3.3Å; F281-S284 WeakPolarHBondContact CD1-OG 3.32Å; F281-S284 VanDerWaalsContact O-CB 3.23Å; F281-S284 WeakPolarHBondContact O-CB 3.44Å; F281-S284 PolarHBondContact O-N 3.43Å; F281-S284 PolarHBondContact O-OG 3.37Å
282	G	92.6	Very high	93.5	Very high	5 Å²	5	46.5 Å²	46.5	5%	0.052	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-67.6	-16.2	-178.5	0	0	0	0	0	115.1	D280	D280-G282 VanDerWaalsContact C-N 3.26Å; D280-G282 PolarHBondContact O-N 2.87Å
283	S	93.2	Very high	93.4	Very high	32 Å²	32	48.7 Å²	48.7	22%	0.224	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-102.4	-4.7	172.4	-60.6	0	0	0	0	113.2	C259 F281	C259-S283 VanDerWaalsContact CB-O 3.26Å; C259-S283 WeakPolarHBondContact CB-O 3.45Å; F281-S283 PolarHBondContact O-N 3.33Å
284	S	95.9	Very high	93.3	Very high	9 Å²	9	46.6 Å²	46.6	6%	0.063	24%	0.243	C	C	.	.			trans	-69.3	152.6	-174.1	-59.9	0	0	0	0	111.5	I257 H258 F281	I257-S284 WeakPolarHBondContact O-CA 3.38Å; I257-S284 WeakPolarHBondContact O-CB 3.49Å; H258-S284 WeakPolarHBondContact CA-OG 3.43Å; H258-S284 PolarHBondContact O-OG 2.91Å; F281-S284 VanDerWaalsContact CA-OG 3.32Å; F281-S284 WeakPolarHBondContact CA-OG 3.33Å; F281-S284 VanDerWaalsContact CD1-OG 3.3Å; F281-S284 WeakPolarHBondContact CD1-OG 3.32Å; F281-S284 VanDerWaalsContact O-CB 3.23Å; F281-S284 WeakPolarHBondContact O-CB 3.44Å; F281-S284 PolarHBondContact O-N 3.43Å; F281-S284 PolarHBondContact O-OG 3.37Å
285	C	94.6	Very high	93.4	Very high	15 Å²	15	45.4 Å²	45.4	10%	0.101	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	157.6	174.1	61.5	0	0	0	0	110.8	I257	I257-C285 PolarHBondContact N-O 3.47Å; I257-C285 PolarHBondContact O-N 3.41Å
286	F	94.7	Very high	93.4	Very high	29 Å²	29	44.8 Å²	44.8	13%	0.127	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	145.2	165.2	-66.5	-88.8	0	0	0	109.8	R180 I181 R255 L256 D288 Q289	R180-F286 VanDerWaalsContact NH2-CD2 3.27Å; I181-F286 HydrophobicContact CG1-CE2 3.99Å; I181-F286 HydrophobicContact CG1-CZ 4.46Å; R255-F286 WeakPolarHBondContact O-CA 3.31Å; L256-F286 HydrophobicContact CD1-CE1 4.25Å; L256-F286 HydrophobicContact CD2-CD1 3.55Å; L256-F286 HydrophobicContact CD2-CD2 3.94Å; L256-F286 HydrophobicContact CD2-CE1 3.55Å; L256-F286 HydrophobicContact CD2-CE2 3.91Å; L256-F286 HydrophobicContact CD2-CG 3.77Å; L256-F286 HydrophobicContact CD2-CZ 3.74Å; L256-F286 HydrophobicContact CG-CD1 3.93Å; L256-F286 HydrophobicContact CG-CE1 3.79Å; L256-F286 HydrophobicContact CG-CZ 4.34Å; F286-D288 VanDerWaalsContact CB-OD1 3.23Å; F286-D288 WeakPolarHBondContact CB-OD1 3.36Å; F286-D288 PolarHBondContact O-N 3.17Å; F286-D288 VanDerWaalsContact O-N 3.12Å; F286-Q289 HydrophobicContact CB-CB 4.28Å; F286-Q289 HydrophobicContact CB-CG 4.45Å; F286-Q289 CarbonylContact O-C 3.41Å; F286-Q289 PolarHBondContact O-N 3.43Å
287	D	90.9	Very high	93.4	Very high	22 Å²	22	46.3 Å²	46.3	12%	0.118	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-30.4	-178	175.9	49	0	0	0	112.5	R255 I257 R290	R255-D287 HydrophobicContact CB-CB 4.22Å; R255-D287 IonicContact CZ-OD2 2.98Å; R255-D287 IonicContact NE-OD2 3.4Å; R255-D287 IonicContact NH2-OD2 2.99Å; R255-D287 PolarHBondContact NH2-OD2 3.19Å; R255-D287 WeakPolarHBondContact O-CB 3.44Å; R255-D287 PolarHBondContact O-N 2.94Å; I257-D287 HydrophobicContact CD1-CB 4.38Å; D287-R290 PolarHBondContact O-NE 3Å; D287-R290 PolarHBondContact O-NH1 3.14Å; D287-R290 PolarHBondContact O-NH2 3.46Å; D287-R290 IonicContact OD1-CZ 3.7Å; D287-R290 IonicContact OD1-NH1 2.79Å; D287-R290 PolarHBondContact OD1-NH1 2.88Å
288	D	90.6	Very high	93.4	Very high	105 Å²	105	50 Å²	50	56%	0.561	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-9.7	175.9	63	-22	0	0	0	114.4	F286	F286-D288 VanDerWaalsContact CB-OD1 3.23Å; F286-D288 WeakPolarHBondContact CB-OD1 3.36Å; F286-D288 PolarHBondContact O-N 3.17Å; F286-D288 VanDerWaalsContact O-N 3.12Å
289	Q	90.1	Very high	93.4	Very high	85 Å²	85	53.1 Å²	53.1	40%	0.397	26%	0.261	S	S	.	.			trans	-117.9	36.5	-172.8	-65.5	170.1	24.3	0	0	112.7	F286 I291	F286-Q289 HydrophobicContact CB-CB 4.28Å; F286-Q289 HydrophobicContact CB-CG 4.45Å; F286-Q289 CarbonylContact O-C 3.41Å; F286-Q289 PolarHBondContact O-N 3.43Å; Q289-I291 PolarHBondContact O-N 3.18Å
290	R	86.9	Confident	93.4	Very high	71 Å²	71	51.9 Å²	51.9	27%	0.268	25%	0.254	S	S	.	.			trans	-68.6	120.1	177.8	-67.2	173.8	-67.6	-103	-29	111.8	I257 D287 K310 Y311	I257-R290 HydrophobicContact CD1-CG 4.4Å; D287-R290 PolarHBondContact O-NE 3Å; D287-R290 PolarHBondContact O-NH1 3.14Å; D287-R290 PolarHBondContact O-NH2 3.46Å; D287-R290 IonicContact OD1-CZ 3.7Å; D287-R290 IonicContact OD1-NH1 2.79Å; D287-R290 PolarHBondContact OD1-NH1 2.88Å; R290-K310 VanDerWaalsContact NH2-CE 3.32Å; R290-Y311 HydrophobicContact CB-CE1 4.48Å; R290-Y311 HydrophobicContact CB-CE2 4.46Å; R290-Y311 WeakPolarHBondContact CB-OH 3.5Å; R290-Y311 VanDerWaalsContact CD-O 3.22Å; R290-Y311 WeakPolarHBondContact CD-O 3.42Å; R290-Y311 HydrophobicContact CG-CE1 4.49Å; R290-Y311 HydrophobicContact CG-CE2 3.75Å; R290-Y311 PolarHBondContact NH1-O 2.91Å
291	I	82.5	Confident	93.6	Very high	133 Å²	133	50.8 Å²	50.8	68%	0.682	25%	0.248	S	C	*	.			trans	-104.9	-40.7	-178.7	-60.2	172.1	0	0	0	112.5	Q289	Q289-I291 PolarHBondContact O-N 3.18Å
292	Y	87.6	Confident	93.7	Very high	74 Å²	74	50.7 Å²	50.7	29%	0.29	25%	0.248	S	C	.	.			trans	-105.2	140.2	-167.3	-57.4	-70.5	0	0	0	112	Q174 Y311	Q174-Y292 PolarHBondContact NE2-OH 3.39Å; Y292-Y311 VanDerWaalsContact O-CE1 3.32Å; Y292-Y311 WeakPolarHBondContact O-CE1 3.25Å; Y292-Y311 PolarHBondContact O-OH 3.4Å
293	T	89.8	Confident	94	Very high	122 Å²	122	50.5 Å²	50.5	75%	0.748	25%	0.245	S	C	*	.	S	Bend	trans	-94.9	-24.9	176.6	52.8	0	0	0	0	113
294	Y	93.1	Very high	94.2	Very high	136 Å²	136	49.1 Å²	49.1	53%	0.533	24%	0.236	S	C	.	.	S	Bend	trans	-105.2	94.8	176	-171.5	-95	0	0	0	109.7	R301	Y294-R301 PolarHBondContact OH-NH1 2.85Å; Y294-R301 PolarHBondContact OH-NH2 2.92Å
295	I	95.8	Very high	94.3	Very high	15 Å²	15	49 Å²	49	8%	0.077	24%	0.235	C	C	.	.			trans	-130.2	175.7	-176.2	58.9	166.7	0	0	0	110.9	C259 R301 V305 Y311 I315	C259-I295 HydrophobicContact CB-CD1 4.26Å; I295-R301 PolarHBondContact O-NE 3.05Å; I295-R301 PolarHBondContact O-NH2 3.47Å; I295-V305 HydrophobicContact CD1-CG2 4.22Å; I295-V305 HydrophobicContact CG1-CG1 3.76Å; I295-V305 HydrophobicContact CG1-CG2 4.07Å; I295-Y311 HydrophobicContact CD1-CD1 4.3Å; I295-Y311 HydrophobicContact CD1-CD2 3.76Å; I295-Y311 HydrophobicContact CD1-CE1 3.97Å; I295-Y311 HydrophobicContact CD1-CE2 3.38Å; I295-Y311 HydrophobicContact CD1-CG 4.21Å; I295-Y311 VanDerWaalsContact CD1-CZ 3.5Å; I295-I315 HydrophobicContact CD1-CD1 3.48Å; I295-I315 VanDerWaalsContact CD1-CD1 3.48Å
296	Q	98.1	Very high	94.5	Very high	12 Å²	12	48.4 Å²	48.4	6%	0.056	23%	0.23	C	C	.	.	S	Bend	trans	62.4	147.2	-173.9	-57.1	174.1	-80.8	0	0	114.3	C259 Y300 R301 I315 S319	C259-Q296 WeakPolarHBondContact O-CA 3.35Å; C259-Q296 WeakPolarHBondContact O-CG 3.48Å; C259-Q296 PolarHBondContact O-N 3.29Å; Q296-Y300 PolarHBondContact NE2-O 2.9Å; Q296-R301 HydrophobicContact CB-CB 3.99Å; Q296-R301 HydrophobicContact CB-CG 4.16Å; Q296-R301 PolarHBondContact O-NE 2.77Å; Q296-R301 PolarHBondContact O-NH2 3.37Å; Q296-I315 HydrophobicContact CG-CD1 4.17Å; Q296-I315 PolarHBondContact NE2-O 3Å; Q296-I315 VanDerWaalsContact NE2-O 3.08Å; Q296-S319 PolarHBondContact NE2-OG 2.99Å
297	S	97.7	Very high	94.6	Very high	33 Å²	33	47.2 Å²	47.2	23%	0.231	23%	0.225	C	C	.	.			trans	-68.3	135.4	165.4	-66.2	0	0	0	0	110.2	D260 K262 F299 Y300 R301	D260-S297 WeakPolarHBondContact OD1-CB 3.46Å; D260-S297 PolarHBondContact OD1-N 3.11Å; D260-S297 PolarHBondContact OD1-OG 2.78Å; K262-S297 VanDerWaalsContact CD-OG 3.24Å; K262-S297 WeakPolarHBondContact CD-OG 3.35Å; K262-S297 PolarHBondContact NZ-OG 3.37Å; S297-F299 PolarHBondContact O-N 2.83Å; S297-F299 VanDerWaalsContact O-N 3.14Å; S297-Y300 CarbonylContact O-C 3.41Å; S297-Y300 PolarHBondContact O-N 3.04Å; S297-R301 PolarHBondContact O-N 2.92Å
298	R	98.5	Very high	94.9	Very high	83 Å²	83	47.1 Å²	47.1	31%	0.313	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-50.5	-45.6	-162.5	-173.5	-172.8	-62.7	104.5	0.3	115	Y300 R301 G336 Q342	R298-Y300 PolarHBondContact O-N 3.18Å; R298-R301 WeakPolarHBondContact O-CB 3.44Å; R298-R301 PolarHBondContact O-N 3.2Å; R298-G336 WeakPolarHBondContact CD-O 3.4Å; R298-Q342 HydrophobicContact CG-CB 4.15Å; R298-Q342 HydrophobicContact CG-CG 4.15Å; R298-Q342 PolarHBondContact O-NE2 3.04Å; R298-Q342 PolarHBondContact O-OE1 3.05Å
299	F	98.8	Very high	95.1	Very high	67 Å²	67	43.2 Å²	43.2	29%	0.294	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-66.1	-20.9	-176.1	-56.9	-21.4	0	0	0	113.5	S297 P332 P335 G336	S297-F299 PolarHBondContact O-N 2.83Å; S297-F299 VanDerWaalsContact O-N 3.14Å; F299-P332 HydrophobicContact CB-CB 4.47Å; F299-P332 HydrophobicContact CD2-CB 3.96Å; F299-P332 HydrophobicContact CD2-CG 3.94Å; F299-P332 HydrophobicContact CE2-CG 4.15Å; F299-P332 HydrophobicContact CG-CB 4.35Å; F299-P335 HydrophobicContact CE1-CB 4.36Å; F299-P335 HydrophobicContact CZ-CB 4.48Å; F299-G336 VanDerWaalsContact CE1-O 3.31Å; F299-G336 WeakPolarHBondContact CE1-O 3.47Å
300	Y	98.9	Very high	95.3	Very high	9 Å²	9	46.8 Å²	46.8	4%	0.035	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-110.5	7	-177.9	-43.9	-77.9	0	0	0	111.5	K262 P263 Q296 S297 R298 S319 C322 I323 E326	K262-Y300 HydrophobicContact CB-CD2 3.52Å; K262-Y300 HydrophobicContact CB-CE2 3.55Å; K262-Y300 HydrophobicContact CB-CG 4.14Å; P263-Y300 WeakPolarHBondContact CD-OH 3.44Å; P263-Y300 HydrophobicContact CG-CE1 4.07Å; P263-Y300 WeakPolarHBondContact CG-OH 3.44Å; Q296-Y300 PolarHBondContact NE2-O 2.9Å; S297-Y300 CarbonylContact O-C 3.41Å; S297-Y300 PolarHBondContact O-N 3.04Å; R298-Y300 PolarHBondContact O-N 3.18Å; Y300-S319 PolarHBondContact O-OG 3.05Å; Y300-S319 VanDerWaalsContact O-OG 3.11Å; Y300-C322 HydrophobicContact CD1-CB 3.72Å; Y300-C322 HydrophobicContact CE1-CB 4.42Å; Y300-I323 HydrophobicContact CD1-CG1 3.8Å; Y300-I323 HydrophobicContact CE1-CG1 3.93Å; Y300-E326 VanDerWaalsContact CE1-OE2 3.27Å; Y300-E326 WeakPolarHBondContact CE1-OE2 3.44Å; Y300-E326 VanDerWaalsContact CZ-OE2 3.31Å; Y300-E326 PolarHBondContact OH-OE2 3.39Å
301	R	98.8	Very high	95.7	Very high	7 Å²	7	44.4 Å²	44.4	3%	0.026	22%	0.215	C	C	.	.			trans	-78.7	131.3	-175.4	-176	177.9	-65.5	147.5	-2.1	111.3	Y294 I295 Q296 S297 R298 V305 I306 W318	Y294-R301 PolarHBondContact OH-NH1 2.85Å; Y294-R301 PolarHBondContact OH-NH2 2.92Å; I295-R301 PolarHBondContact O-NE 3.05Å; I295-R301 PolarHBondContact O-NH2 3.47Å; Q296-R301 HydrophobicContact CB-CB 3.99Å; Q296-R301 HydrophobicContact CB-CG 4.16Å; Q296-R301 PolarHBondContact O-NE 2.77Å; Q296-R301 PolarHBondContact O-NH2 3.37Å; S297-R301 PolarHBondContact O-N 2.92Å; R298-R301 WeakPolarHBondContact O-CB 3.44Å; R298-R301 PolarHBondContact O-N 3.2Å; R301-V305 HydrophobicContact CG-CB 3.93Å; R301-V305 HydrophobicContact CG-CG1 3.94Å; R301-I306 HydrophobicContact CG-CD1 4.49Å; R301-I306 HydrophobicContact CG-CG1 4.01Å; R301-W318 PolarHBondContact O-NE1 3.05Å
302	A	98.8	Very high	96.4	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.187	C	C	.	.			trans	-73.6	150.9	-179.8	0	0	0	0	0	112.3	E304 V305 I306 I315 W318	A302-E304 VanDerWaalsContact C-N 3.32Å; A302-E304 HydrophobicContact CB-CG 4.15Å; A302-E304 WeakPolarHBondContact CB-OE2 3.49Å; A302-E304 PolarHBondContact O-N 2.84Å; A302-V305 PolarHBondContact O-N 2.8Å; A302-I306 PolarHBondContact O-N 2.93Å; A302-I315 HydrophobicContact CB-CB 3.86Å; A302-I315 HydrophobicContact CB-CG2 3.79Å; A302-W318 HydrophobicContact CB-CB 3.85Å; A302-W318 HydrophobicContact CB-CD2 4.27Å; A302-W318 HydrophobicContact CB-CG 3.76Å
303	P	98.4	Very high	96.9	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.006	18%	0.183	C	C	.	.	H	α-helix	trans	-63.2	-35.1	-176.6	23.4	-33	0	0	0	113	V305 I306 L307 W318 I346 W430	P303-V305 PolarHBondContact O-N 2.9Å; P303-I306 PolarHBondContact O-N 3.06Å; P303-I306 VanDerWaalsContact O-N 3.11Å; P303-L307 HydrophobicContact CB-CD1 4.49Å; P303-L307 VanDerWaalsContact O-CB 3.31Å; P303-L307 WeakPolarHBondContact O-CB 3.27Å; P303-L307 WeakPolarHBondContact O-CG 3.18Å; P303-L307 PolarHBondContact O-N 3.26Å; P303-W318 VanDerWaalsContact CD-CE3 3.44Å; P303-W318 VanDerWaalsContact CD-CZ3 3.49Å; P303-W318 HydrophobicContact CG-CE3 4.1Å; P303-W318 HydrophobicContact CG-CH2 3.96Å; P303-W318 HydrophobicContact CG-CZ2 4.5Å; P303-W318 HydrophobicContact CG-CZ3 3.74Å; P303-I346 HydrophobicContact CB-CD1 4.4Å; P303-W430 HydrophobicContact CB-CE3 3.61Å; P303-W430 HydrophobicContact CB-CH2 4.48Å; P303-W430 HydrophobicContact CB-CZ3 3.41Å; P303-W430 VanDerWaalsContact CB-CZ3 3.41Å; P303-W430 HydrophobicContact CG-CE3 3.81Å; P303-W430 HydrophobicContact CG-CZ3 4.11Å
304	E	98.1	Very high	97.4	Very high	4 Å²	4	33 Å²	33	2%	0.019	16%	0.158	C	C	.	.	H	α-helix	trans	-57.7	-35.6	175.7	54	-94.1	-141.3	0	0	113.1	A302 G308 T309 I315 R435	A302-E304 VanDerWaalsContact C-N 3.32Å; A302-E304 HydrophobicContact CB-CG 4.15Å; A302-E304 WeakPolarHBondContact CB-OE2 3.49Å; A302-E304 PolarHBondContact O-N 2.84Å; E304-G308 PolarHBondContact O-N 2.91Å; E304-T309 WeakPolarHBondContact CA-OG1 3.27Å; E304-T309 WeakPolarHBondContact CB-OG1 3.32Å; E304-T309 PolarHBondContact O-N 3.41Å; E304-T309 PolarHBondContact O-OG1 3.15Å; E304-I315 HydrophobicContact CG-CG2 3.88Å; E304-I315 WeakPolarHBondContact OE1-CG2 3.27Å; E304-R435 IonicContact OE1-CZ 3.7Å; E304-R435 IonicContact OE1-NH1 2.74Å; E304-R435 PolarHBondContact OE1-NH1 3.34Å; E304-R435 IonicContact OE1-NH2 2.85Å; E304-R435 PolarHBondContact OE1-NH2 2.91Å; E304-R435 IonicContact OE2-CZ 3.32Å; E304-R435 IonicContact OE2-NH1 3.82Å; E304-R435 PolarHBondContact OE2-NH1 2.91Å; E304-R435 IonicContact OE2-NH2 3.69Å; E304-R435 PolarHBondContact OE2-NH2 3.34Å
305	V	98.2	Very high	97.6	Very high	7 Å²	7	26.5 Å²	26.5	4%	0.042	13%	0.133	C	C	.	.	H	α-helix	trans	-70.3	-41.2	177.2	178.8	0	0	0	0	110.2	I295 R301 A302 P303 Y311 I315	I295-V305 HydrophobicContact CD1-CG2 4.22Å; I295-V305 HydrophobicContact CG1-CG1 3.76Å; I295-V305 HydrophobicContact CG1-CG2 4.07Å; R301-V305 HydrophobicContact CG-CB 3.93Å; R301-V305 HydrophobicContact CG-CG1 3.94Å; A302-V305 PolarHBondContact O-N 2.8Å; P303-V305 PolarHBondContact O-N 2.9Å; V305-Y311 HydrophobicContact CG2-CG 4.3Å; V305-I315 HydrophobicContact CG2-CG2 3.98Å
306	I	98.4	Very high	97.8	Very high	2 Å²	2	26 Å²	26	1%	0.01	13%	0.131	C	C	.	.	H	α-helix	trans	-67.2	-47.9	178.3	-59.5	171.7	0	0	0	110.5	R301 A302 P303 G308 E339 Q342 L343 I346 R363 F367	R301-I306 HydrophobicContact CG-CD1 4.49Å; R301-I306 HydrophobicContact CG-CG1 4.01Å; A302-I306 PolarHBondContact O-N 2.93Å; P303-I306 PolarHBondContact O-N 3.06Å; P303-I306 VanDerWaalsContact O-N 3.11Å; I306-G308 PolarHBondContact O-N 3.43Å; I306-E339 HydrophobicContact CG2-CB 4.36Å; I306-Q342 HydrophobicContact CD1-CB 4.12Å; I306-Q342 HydrophobicContact CD1-CG 3.69Å; I306-L343 HydrophobicContact CG2-CB 4.26Å; I306-L343 HydrophobicContact CG2-CD2 4.41Å; I306-I346 HydrophobicContact CD1-CD1 4.15Å; I306-R363 PolarHBondContact O-NH1 3.1Å; I306-F367 HydrophobicContact CG2-CE1 4.07Å; I306-F367 HydrophobicContact CG2-CE2 3.89Å; I306-F367 HydrophobicContact CG2-CZ 3.55Å; I306-F367 WeakPolarHBondContact O-CE2 3.22Å
307	L	97.7	Very high	97.8	Very high	4 Å²	4	25.6 Å²	25.6	2%	0.021	13%	0.129	C	C	.	.	H	α-helix	trans	-72.7	-13.6	-178.6	-68.8	173.3	0	0	0	113.4	P303 L343 L358 A361 K362 R363 F367 W430	P303-L307 HydrophobicContact CB-CD1 4.49Å; P303-L307 VanDerWaalsContact O-CB 3.31Å; P303-L307 WeakPolarHBondContact O-CB 3.27Å; P303-L307 WeakPolarHBondContact O-CG 3.18Å; P303-L307 PolarHBondContact O-N 3.26Å; L307-L343 HydrophobicContact CD2-CD2 3.84Å; L307-L358 HydrophobicContact CD1-CD2 4.45Å; L307-L358 HydrophobicContact CD2-CD2 4.4Å; L307-A361 HydrophobicContact CB-CB 3.96Å; L307-A361 CarbonylContact O-C 3.34Å; L307-K362 PolarHBondContact O-N 3.41Å; L307-R363 WeakPolarHBondContact O-CA 3.43Å; L307-R363 WeakPolarHBondContact O-CB 2.99Å; L307-R363 PolarHBondContact O-N 3.16Å; L307-F367 HydrophobicContact CD2-CD2 3.97Å; L307-W430 HydrophobicContact CD1-CZ3 4.35Å
308	G	96.2	Very high	97.9	Very high	19 Å²	19	24 Å²	24	20%	0.196	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.1	32.9	178.3	0	0	0	0	0	113.4	E304 I306 K362	E304-G308 PolarHBondContact O-N 2.91Å; I306-G308 PolarHBondContact O-N 3.43Å; G308-K362 WeakPolarHBondContact O-CG 3.29Å
309	T	94.4	Very high	97.9	Very high	24 Å²	24	20 Å²	20	15%	0.147	10%	0.103	C	C	.	.	P	Polyproline II helix	trans	-82.6	173.7	167.1	59.7	0	0	0	0	109.9	E304 Y311 A361	E304-T309 WeakPolarHBondContact CA-OG1 3.27Å; E304-T309 WeakPolarHBondContact CB-OG1 3.32Å; E304-T309 PolarHBondContact O-N 3.41Å; E304-T309 PolarHBondContact O-OG1 3.15Å; T309-Y311 PolarHBondContact O-N 3.11Å; T309-A361 VanDerWaalsContact CG2-CA 3.42Å; T309-A361 HydrophobicContact CG2-CB 3.59Å
310	K	93.8	Very high	97.9	Very high	160 Å²	160	16.9 Å²	16.9	70%	0.696	9%	0.089	S	C	*	.	P	Polyproline II helix	trans	-67.7	119.9	173.7	-175.8	-179	178.6	-175.1	0	108.9	R290	R290-K310 VanDerWaalsContact NH2-CE 3.32Å
311	Y	96.4	Very high	97.9	Very high	21 Å²	21	16.4 Å²	16.4	8%	0.082	9%	0.087	C	C	.	.	P	Polyproline II helix	trans	-96.6	162.4	175.7	74.2	-96.6	0	0	0	111.7	I257 R290 Y292 I295 V305 T309 I315	I257-Y311 HydrophobicContact CD1-CD2 4.25Å; I257-Y311 HydrophobicContact CD1-CE2 4.09Å; R290-Y311 HydrophobicContact CB-CE1 4.48Å; R290-Y311 HydrophobicContact CB-CE2 4.46Å; R290-Y311 WeakPolarHBondContact CB-OH 3.5Å; R290-Y311 VanDerWaalsContact CD-O 3.22Å; R290-Y311 WeakPolarHBondContact CD-O 3.42Å; R290-Y311 HydrophobicContact CG-CE1 4.49Å; R290-Y311 HydrophobicContact CG-CE2 3.75Å; R290-Y311 PolarHBondContact NH1-O 2.91Å; Y292-Y311 VanDerWaalsContact O-CE1 3.32Å; Y292-Y311 WeakPolarHBondContact O-CE1 3.25Å; Y292-Y311 PolarHBondContact O-OH 3.4Å; I295-Y311 HydrophobicContact CD1-CD1 4.3Å; I295-Y311 HydrophobicContact CD1-CD2 3.76Å; I295-Y311 HydrophobicContact CD1-CE1 3.97Å; I295-Y311 HydrophobicContact CD1-CE2 3.38Å; I295-Y311 HydrophobicContact CD1-CG 4.21Å; I295-Y311 VanDerWaalsContact CD1-CZ 3.5Å; V305-Y311 HydrophobicContact CG2-CG 4.3Å; T309-Y311 PolarHBondContact O-N 3.11Å; Y311-I315 HydrophobicContact CD2-CD1 3.92Å; Y311-I315 HydrophobicContact CD2-CG2 4.47Å; Y311-I315 HydrophobicContact CE2-CD1 4.35Å
312	G	97.6	Very high	97.9	Very high	10 Å²	10	16.2 Å²	16.2	10%	0.103	9%	0.087	C	C	.	.			trans	-155.7	-160.8	178.2	0	0	0	0	0	111.7	P314 I315	G312-P314 VanDerWaalsContact O-N 3.14Å; G312-I315 WeakPolarHBondContact O-CG1 3.18Å; G312-I315 WeakPolarHBondContact O-CG2 3.4Å; G312-I315 PolarHBondContact O-N 3.07Å
313	M	98.3	Very high	97.9	Very high	43 Å²	43	16.2 Å²	16.2	21%	0.212	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-32.1	176.3	-59.4	171.9	-71.6	0	0	115.2	Q252 I257 I315 D316	Q252-M313 HydrophobicContact CB-SD 4.24Å; Q252-M313 HydrophobicContact CG-CE 4.32Å; Q252-M313 HydrophobicContact CG-SD 3.88Å; I257-M313 HydrophobicContact CG1-CG 3.91Å; M313-I315 PolarHBondContact O-N 3.17Å; M313-D316 PolarHBondContact O-N 3.11Å; M313-D316 VanDerWaalsContact O-N 3.1Å
314	P	98.7	Very high	97.9	Very high	35 Å²	35	16.1 Å²	16.1	23%	0.227	9%	0.086	C	C	.	.	H	α-helix	trans	-58.8	-16.9	178.4	-28.6	37.4	0	0	0	115.7	G312 D316 M317 W318 P432 R435	G312-P314 VanDerWaalsContact O-N 3.14Å; P314-D316 PolarHBondContact O-N 3.08Å; P314-M317 PolarHBondContact O-N 3.05Å; P314-W318 PolarHBondContact O-N 3.29Å; P314-P432 HydrophobicContact CB-CB 3.8Å; P314-P432 HydrophobicContact CG-CB 4.11Å; P314-P432 VanDerWaalsContact CG-O 3.3Å; P314-P432 WeakPolarHBondContact CG-O 2.98Å; P314-R435 WeakPolarHBondContact O-CD 3.31Å; P314-R435 PolarHBondContact O-NH1 3.42Å
315	I	98.8	Very high	98	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-65.4	-28.8	176	73.5	178.7	0	0	0	112.5	I257 I295 Q296 A302 E304 V305 Y311 G312 M313 W318 S319	I257-I315 HydrophobicContact CG2-CD1 3.57Å; I257-I315 HydrophobicContact CG2-CG1 3.68Å; I295-I315 HydrophobicContact CD1-CD1 3.48Å; I295-I315 VanDerWaalsContact CD1-CD1 3.48Å; Q296-I315 HydrophobicContact CG-CD1 4.17Å; Q296-I315 PolarHBondContact NE2-O 3Å; Q296-I315 VanDerWaalsContact NE2-O 3.08Å; A302-I315 HydrophobicContact CB-CB 3.86Å; A302-I315 HydrophobicContact CB-CG2 3.79Å; E304-I315 HydrophobicContact CG-CG2 3.88Å; E304-I315 WeakPolarHBondContact OE1-CG2 3.27Å; V305-I315 HydrophobicContact CG2-CG2 3.98Å; Y311-I315 HydrophobicContact CD2-CD1 3.92Å; Y311-I315 HydrophobicContact CD2-CG2 4.47Å; Y311-I315 HydrophobicContact CE2-CD1 4.35Å; G312-I315 WeakPolarHBondContact O-CG1 3.18Å; G312-I315 WeakPolarHBondContact O-CG2 3.4Å; G312-I315 PolarHBondContact O-N 3.07Å; M313-I315 PolarHBondContact O-N 3.17Å; I315-W318 WeakPolarHBondContact O-CB 3.5Å; I315-W318 PolarHBondContact O-N 3.29Å; I315-S319 PolarHBondContact O-N 3.33Å; I315-S319 PolarHBondContact O-OG 3.03Å
316	D	98.9	Very high	98	Very high	5 Å²	5	15.8 Å²	15.8	3%	0.027	8%	0.084	C	C	.	.	H	α-helix	trans	-76.2	-30.5	179.3	-65.7	-32.5	0	0	0	110.9	L248 H258 C259 M313 P314 S319 L320	L248-D316 HydrophobicContact CD2-CB 3.89Å; H258-D316 WeakPolarHBondContact CB-OD2 3.26Å; H258-D316 PolarHBondContact N-OD2 3.48Å; C259-D316 PolarHBondContact N-OD1 2.76Å; M313-D316 PolarHBondContact O-N 3.11Å; M313-D316 VanDerWaalsContact O-N 3.1Å; P314-D316 PolarHBondContact O-N 3.08Å; D316-S319 WeakPolarHBondContact O-CB 3.33Å; D316-S319 PolarHBondContact O-N 2.89Å; D316-L320 WeakPolarHBondContact O-CB 3.47Å; D316-L320 PolarHBondContact O-N 3.3Å
317	M	98.9	Very high	98	Very high	3 Å²	3	15.7 Å²	15.7	2%	0.015	8%	0.083	C	C	.	.	H	α-helix	trans	-68.9	-34.6	171.7	-72.8	-59.7	-64.5	0	0	112.2	L245 L248 P314 L320 G321 M436 P438 A441	L245-M317 HydrophobicContact CD2-CE 4.04Å; L245-M317 HydrophobicContact CD2-SD 3.97Å; L248-M317 HydrophobicContact CD1-SD 3.94Å; P314-M317 PolarHBondContact O-N 3.05Å; M317-L320 HydrophobicContact CE-CD2 3.96Å; M317-L320 PolarHBondContact O-N 3.16Å; M317-L320 HydrophobicContact SD-CD2 3.95Å; M317-G321 PolarHBondContact O-N 3.36Å; M317-G321 VanDerWaalsContact O-N 3.09Å; M317-M436 HydrophobicContact CE-CE 4.44Å; M317-M436 WeakPolarHBondContact CE-O 3.46Å; M317-M436 VanDerWaalsContact CG-O 3.28Å; M317-M436 WeakPolarHBondContact CG-O 3.34Å; M317-P438 HydrophobicContact CG-CG 4.22Å; M317-P438 HydrophobicContact SD-CB 4.3Å; M317-P438 HydrophobicContact SD-CG 3.72Å; M317-A441 HydrophobicContact CE-CB 3.78Å
318	W	98.9	Very high	98.1	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-61.3	-51.1	169	179	-80.3	0	0	0	111.2	R301 A302 P303 P314 I315 L320 G321 C322 L334 I346 L350 L428	R301-W318 PolarHBondContact O-NE1 3.05Å; A302-W318 HydrophobicContact CB-CB 3.85Å; A302-W318 HydrophobicContact CB-CD2 4.27Å; A302-W318 HydrophobicContact CB-CG 3.76Å; P303-W318 VanDerWaalsContact CD-CE3 3.44Å; P303-W318 VanDerWaalsContact CD-CZ3 3.49Å; P303-W318 HydrophobicContact CG-CE3 4.1Å; P303-W318 HydrophobicContact CG-CH2 3.96Å; P303-W318 HydrophobicContact CG-CZ2 4.5Å; P303-W318 HydrophobicContact CG-CZ3 3.74Å; P314-W318 PolarHBondContact O-N 3.29Å; I315-W318 WeakPolarHBondContact O-CB 3.5Å; I315-W318 PolarHBondContact O-N 3.29Å; W318-L320 VanDerWaalsContact C-N 3.28Å; W318-L320 PolarHBondContact O-N 3.23Å; W318-G321 PolarHBondContact O-N 3.39Å; W318-G321 VanDerWaalsContact O-N 3.07Å; W318-C322 PolarHBondContact O-N 3.44Å; W318-C322 VanDerWaalsContact O-N 3.12Å; W318-L334 HydrophobicContact CZ2-CD1 3.93Å; W318-I346 HydrophobicContact CH2-CD1 4.15Å; W318-I346 HydrophobicContact CH2-CG1 4.23Å; W318-I346 HydrophobicContact CH2-CG2 3.75Å; W318-I346 HydrophobicContact CZ2-CD1 3.64Å; W318-I346 HydrophobicContact CZ2-CG1 3.84Å; W318-I346 HydrophobicContact CZ2-CG2 4.22Å; W318-L350 HydrophobicContact CH2-CD1 3.73Å; W318-L350 HydrophobicContact CZ3-CD1 4.11Å; W318-L428 HydrophobicContact CD2-CD2 3.57Å; W318-L428 HydrophobicContact CE3-CB 4.3Å; W318-L428 HydrophobicContact CE3-CD2 3.75Å; W318-L428 HydrophobicContact CG-CD2 4.05Å; W318-L428 HydrophobicContact CH2-CB 4.41Å; W318-L428 HydrophobicContact CH2-CD2 4.17Å; W318-L428 HydrophobicContact CZ2-CD2 4.01Å; W318-L428 HydrophobicContact CZ3-CB 4.03Å; W318-L428 HydrophobicContact CZ3-CD2 4.05Å; W318-L428 WeakPolarHBondContact CZ3-O 3.35Å
319	S	98.9	Very high	98.2	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-54.2	-45.1	176.7	-52.2	0	0	0	0	111.7	L261 Q296 Y300 I315 D316 G321 C322 I323	L261-S319 WeakPolarHBondContact O-CB 3.1Å; Q296-S319 PolarHBondContact NE2-OG 2.99Å; Y300-S319 PolarHBondContact O-OG 3.05Å; Y300-S319 VanDerWaalsContact O-OG 3.11Å; I315-S319 PolarHBondContact O-N 3.33Å; I315-S319 PolarHBondContact O-OG 3.03Å; D316-S319 WeakPolarHBondContact O-CB 3.33Å; D316-S319 PolarHBondContact O-N 2.89Å; S319-G321 PolarHBondContact O-N 2.81Å; S319-C322 PolarHBondContact O-N 3.17Å; S319-I323 VanDerWaalsContact O-CG1 3.25Å; S319-I323 WeakPolarHBondContact O-CG1 3.32Å; S319-I323 PolarHBondContact O-N 3.2Å
320	L	98.9	Very high	98.4	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-56.2	-48.8	175.9	177.7	69.4	0	0	0	111.3	M244 L245 L248 L261 D316 M317 W318 C322 I323 L324	M244-L320 HydrophobicContact CB-CD1 3.92Å; M244-L320 HydrophobicContact CE-CD1 3.56Å; M244-L320 HydrophobicContact SD-CD1 3.89Å; L245-L320 HydrophobicContact CD2-CD2 3.6Å; L245-L320 HydrophobicContact CG-CD2 3.93Å; L248-L320 HydrophobicContact CD1-CB 4.24Å; L248-L320 HydrophobicContact CD1-CD2 4.12Å; L261-L320 HydrophobicContact CD2-CB 4.38Å; D316-L320 WeakPolarHBondContact O-CB 3.47Å; D316-L320 PolarHBondContact O-N 3.3Å; M317-L320 HydrophobicContact CE-CD2 3.96Å; M317-L320 PolarHBondContact O-N 3.16Å; M317-L320 HydrophobicContact SD-CD2 3.95Å; W318-L320 VanDerWaalsContact C-N 3.28Å; W318-L320 PolarHBondContact O-N 3.23Å; L320-C322 VanDerWaalsContact C-N 3.33Å; L320-C322 PolarHBondContact O-N 2.83Å; L320-I323 PolarHBondContact O-N 3.44Å; L320-L324 HydrophobicContact CD1-CD1 4.19Å; L320-L324 HydrophobicContact CD1-CD2 4.28Å; L320-L324 HydrophobicContact CD1-CG 4.07Å; L320-L324 HydrophobicContact CG-CD1 4.06Å; L320-L324 HydrophobicContact CG-CG 4.27Å; L320-L324 VanDerWaalsContact O-CG 3.28Å; L320-L324 WeakPolarHBondContact O-CG 3.31Å; L320-L324 PolarHBondContact O-N 3.08Å
321	G	98.9	Very high	98.6	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-55.3	-46.7	177.3	0	0	0	0	0	112.6	M317 W318 S319 L324 A325 L424	M317-G321 PolarHBondContact O-N 3.36Å; M317-G321 VanDerWaalsContact O-N 3.09Å; W318-G321 PolarHBondContact O-N 3.39Å; W318-G321 VanDerWaalsContact O-N 3.07Å; S319-G321 PolarHBondContact O-N 2.81Å; G321-L324 PolarHBondContact O-N 2.87Å; G321-A325 PolarHBondContact O-N 2.92Å; G321-L424 VanDerWaalsContact O-CD2 3.29Å; G321-L424 WeakPolarHBondContact O-CD2 3.43Å
322	C	98.9	Very high	98.7	Very high	2 Å²	2	12.3 Å²	12.3	1%	0.014	6%	0.064	C	C	.	.	H	α-helix	trans	-61.9	-44.7	176.2	-65.7	0	0	0	0	112.6	Y300 W318 S319 L320 A325 E326	Y300-C322 HydrophobicContact CD1-CB 3.72Å; Y300-C322 HydrophobicContact CE1-CB 4.42Å; W318-C322 PolarHBondContact O-N 3.44Å; W318-C322 VanDerWaalsContact O-N 3.12Å; S319-C322 PolarHBondContact O-N 3.17Å; L320-C322 VanDerWaalsContact C-N 3.33Å; L320-C322 PolarHBondContact O-N 2.83Å; C322-A325 PolarHBondContact O-N 2.67Å; C322-E326 PolarHBondContact O-N 2.92Å; C322-E326 VanDerWaalsContact O-N 3.1Å
323	I	98.9	Very high	98.8	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-60.9	-46.1	177.9	-68.6	163.2	0	0	0	110.8	M244 L261 P263 Y300 S319 L320 A325 E326 L327	M244-I323 HydrophobicContact CE-CG2 4.06Å; M244-I323 HydrophobicContact SD-CG2 4.21Å; L261-I323 HydrophobicContact CB-CD1 4.48Å; L261-I323 HydrophobicContact CD2-CD1 3.98Å; L261-I323 HydrophobicContact CG-CD1 3.71Å; P263-I323 HydrophobicContact CG-CG1 4.24Å; P263-I323 HydrophobicContact CG-CG2 4.43Å; Y300-I323 HydrophobicContact CD1-CG1 3.8Å; Y300-I323 HydrophobicContact CE1-CG1 3.93Å; S319-I323 VanDerWaalsContact O-CG1 3.25Å; S319-I323 WeakPolarHBondContact O-CG1 3.32Å; S319-I323 PolarHBondContact O-N 3.2Å; L320-I323 PolarHBondContact O-N 3.44Å; I323-A325 VanDerWaalsContact C-N 3.34Å; I323-A325 PolarHBondContact O-N 2.91Å; I323-E326 PolarHBondContact O-N 3.38Å; I323-E326 VanDerWaalsContact O-N 3.16Å; I323-L327 HydrophobicContact CG2-CD1 3.79Å; I323-L327 HydrophobicContact CG2-CG 4.13Å; I323-L327 VanDerWaalsContact O-CG 3.29Å; I323-L327 WeakPolarHBondContact O-CG 3.32Å; I323-L327 PolarHBondContact O-N 3.46Å
324	L	98.9	Very high	98.8	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-64.5	-39	-177.2	-66.2	-178.5	0	0	0	112.3	V237 A241 M244 L320 G321 E326 L327 L328 F420 F423 L424 W446	V237-L324 HydrophobicContact CG1-CB 4.21Å; V237-L324 HydrophobicContact CG1-CD2 3.95Å; A241-L324 HydrophobicContact CB-CD1 3.77Å; A241-L324 HydrophobicContact CB-CD2 3.61Å; A241-L324 HydrophobicContact CB-CG 4.35Å; M244-L324 HydrophobicContact CE-CD2 3.62Å; L320-L324 HydrophobicContact CD1-CD1 4.19Å; L320-L324 HydrophobicContact CD1-CD2 4.28Å; L320-L324 HydrophobicContact CD1-CG 4.07Å; L320-L324 HydrophobicContact CG-CD1 4.06Å; L320-L324 HydrophobicContact CG-CG 4.27Å; L320-L324 VanDerWaalsContact O-CG 3.28Å; L320-L324 WeakPolarHBondContact O-CG 3.31Å; L320-L324 PolarHBondContact O-N 3.08Å; G321-L324 PolarHBondContact O-N 2.87Å; L324-E326 VanDerWaalsContact C-N 3.34Å; L324-L327 HydrophobicContact CD2-CD1 4.24Å; L324-L327 PolarHBondContact O-N 2.85Å; L324-L328 WeakPolarHBondContact O-CB 3.49Å; L324-L328 PolarHBondContact O-N 3.44Å; L324-F420 HydrophobicContact CB-CE2 4.04Å; L324-F420 HydrophobicContact CB-CZ 4.05Å; L324-F423 HydrophobicContact CD1-CD1 4.13Å; L324-F423 HydrophobicContact CD1-CE1 3.58Å; L324-F423 HydrophobicContact CD1-CZ 4.49Å; L324-L424 HydrophobicContact CB-CD2 4.06Å; L324-W446 HydrophobicContact CD1-CH2 4.14Å; L324-W446 HydrophobicContact CD1-CZ3 4.04Å
325	A	98.9	Very high	98.8	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-64.4	-38.6	173.7	0	0	0	0	0	112.1	G321 C322 I323 L328 T329 L333 L412 L424	G321-A325 PolarHBondContact O-N 2.92Å; C322-A325 PolarHBondContact O-N 2.67Å; I323-A325 VanDerWaalsContact C-N 3.34Å; I323-A325 PolarHBondContact O-N 2.91Å; A325-L328 PolarHBondContact O-N 3.19Å; A325-T329 WeakPolarHBondContact O-CB 3.3Å; A325-T329 WeakPolarHBondContact O-CG2 3.07Å; A325-T329 PolarHBondContact O-N 3.42Å; A325-T329 PolarHBondContact O-OG1 3.37Å; A325-L333 HydrophobicContact CB-CB 3.91Å; A325-L333 HydrophobicContact CB-CD1 4.15Å; A325-L333 HydrophobicContact CB-CD2 3.87Å; A325-L333 HydrophobicContact CB-CG 4.19Å; A325-L412 HydrophobicContact CB-CD2 3.85Å; A325-L424 HydrophobicContact CB-CD1 3.99Å
326	E	98.9	Very high	98.8	Very high	3 Å²	3	10.4 Å²	10.4	1%	0.014	5%	0.053	C	C	.	.	H	α-helix	trans	-69.2	-41.2	176.4	178.9	169.1	-168.1	0	0	112.6	I224 Y300 C322 I323 L324 L328 T329 G330 Y331	I224-E326 HydrophobicContact CD1-CG 3.91Å; Y300-E326 VanDerWaalsContact CE1-OE2 3.27Å; Y300-E326 WeakPolarHBondContact CE1-OE2 3.44Å; Y300-E326 VanDerWaalsContact CZ-OE2 3.31Å; Y300-E326 PolarHBondContact OH-OE2 3.39Å; C322-E326 PolarHBondContact O-N 2.92Å; C322-E326 VanDerWaalsContact O-N 3.1Å; I323-E326 PolarHBondContact O-N 3.38Å; I323-E326 VanDerWaalsContact O-N 3.16Å; L324-E326 VanDerWaalsContact C-N 3.34Å; E326-L328 VanDerWaalsContact C-N 3.28Å; E326-L328 PolarHBondContact O-N 3.29Å; E326-T329 PolarHBondContact O-N 3.48Å; E326-G330 WeakPolarHBondContact O-CA 3.47Å; E326-G330 PolarHBondContact O-N 3.1Å; E326-Y331 WeakPolarHBondContact CA-O 3.36Å
327	L	98.9	Very high	98.7	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-60.1	-40.3	173.2	-70.4	172.8	0	0	0	111.3	L220 I224 F232 V237 F240 M244 I323 L324	L220-L327 HydrophobicContact CB-CD2 4.13Å; L220-L327 HydrophobicContact CD1-CD1 4.07Å; L220-L327 HydrophobicContact CD1-CD2 4.03Å; I224-L327 HydrophobicContact CD1-CD2 3.99Å; I224-L327 HydrophobicContact CG1-CD2 4.15Å; F232-L327 WeakPolarHBondContact CB-O 3.46Å; F232-L327 HydrophobicContact CD2-CB 4.08Å; F232-L327 HydrophobicContact CD2-CD2 3.92Å; F232-L327 WeakPolarHBondContact CD2-O 3.44Å; F232-L327 HydrophobicContact CE2-CD2 3.72Å; F232-L327 PolarHBondContact N-O 3.02Å; V237-L327 HydrophobicContact CG1-CB 4.48Å; V237-L327 HydrophobicContact CG2-CB 4.08Å; F240-L327 HydrophobicContact CB-CD1 4.13Å; F240-L327 HydrophobicContact CD2-CD1 4.06Å; F240-L327 HydrophobicContact CG-CD1 4.46Å; M244-L327 HydrophobicContact CE-CD1 4.31Å; I323-L327 HydrophobicContact CG2-CD1 3.79Å; I323-L327 HydrophobicContact CG2-CG 4.13Å; I323-L327 VanDerWaalsContact O-CG 3.29Å; I323-L327 WeakPolarHBondContact O-CG 3.32Å; I323-L327 PolarHBondContact O-N 3.46Å; L324-L327 HydrophobicContact CD2-CD1 4.24Å; L324-L327 PolarHBondContact O-N 2.85Å
328	L	98.8	Very high	98.7	Very high	2 Å²	2	12.9 Å²	12.9	1%	0.01	7%	0.065	C	C	.	.	H	α-helix	trans	-67.7	-45.8	178.2	-179.9	62.9	0	0	0	112.1	G231 F232 L234 V237 L324 A325 E326 M415 F420	G231-L328 WeakPolarHBondContact CA-O 3.47Å; F232-L328 PolarHBondContact N-O 2.89Å; F232-L328 WeakPolarHBondContact O-CD1 3.33Å; L234-L328 HydrophobicContact CD2-CD1 3.72Å; L234-L328 HydrophobicContact CD2-CD2 3.98Å; L234-L328 HydrophobicContact CD2-CG 4.47Å; L234-L328 HydrophobicContact CG-CD1 3.87Å; V237-L328 HydrophobicContact CG2-CB 4.18Å; V237-L328 HydrophobicContact CG2-CD1 4.41Å; L324-L328 WeakPolarHBondContact O-CB 3.49Å; L324-L328 PolarHBondContact O-N 3.44Å; A325-L328 PolarHBondContact O-N 3.19Å; E326-L328 VanDerWaalsContact C-N 3.28Å; E326-L328 PolarHBondContact O-N 3.29Å; L328-M415 HydrophobicContact CD1-CB 4Å; L328-M415 HydrophobicContact CD1-CE 4.43Å; L328-M415 HydrophobicContact CD2-CB 4.04Å; L328-M415 HydrophobicContact CG-CB 3.89Å; L328-M415 WeakPolarHBondContact O-CE 3.35Å; L328-F420 HydrophobicContact CB-CE1 4.34Å; L328-F420 HydrophobicContact CB-CZ 4.42Å; L328-F420 HydrophobicContact CD2-CD1 3.72Å; L328-F420 HydrophobicContact CD2-CE1 3.3Å; L328-F420 HydrophobicContact CD2-CZ 4.12Å; L328-F420 HydrophobicContact CG-CE1 4.43Å
329	T	98.7	Very high	98.6	Very high	5 Å²	5	15 Å²	15	3%	0.031	8%	0.075	C	C	.	.	H	α-helix	trans	-97.8	-17.1	-167.8	62.7	0	0	0	0	114.6	A325 E326 Y331 L412 K413	A325-T329 WeakPolarHBondContact O-CB 3.3Å; A325-T329 WeakPolarHBondContact O-CG2 3.07Å; A325-T329 PolarHBondContact O-N 3.42Å; A325-T329 PolarHBondContact O-OG1 3.37Å; E326-T329 PolarHBondContact O-N 3.48Å; T329-Y331 VanDerWaalsContact C-N 3.33Å; T329-Y331 WeakPolarHBondContact O-CD2 3.45Å; T329-Y331 PolarHBondContact OG1-N 3Å; T329-Y331 PolarHBondContact OG1-O 3.43Å; T329-Y331 VanDerWaalsContact OG1-O 3.06Å; T329-L412 HydrophobicContact CG2-CB 4.43Å; T329-L412 HydrophobicContact CG2-CD2 4.28Å; T329-K413 PolarHBondContact O-NZ 3.35Å; T329-K413 VanDerWaalsContact O-NZ 3.15Å
330	G	98.6	Very high	98.5	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.01	9%	0.093	C	C	.	.	S	Bend	trans	81.2	-0.3	-170.4	0	0	0	0	0	115	F229 E326	F229-G330 WeakPolarHBondContact CD1-O 3.33Å; E326-G330 WeakPolarHBondContact O-CA 3.47Å; E326-G330 PolarHBondContact O-N 3.1Å
331	Y	98.5	Very high	98.5	Very high	115 Å²	115	19 Å²	19	45%	0.451	10%	0.096	S	C	.	.	S	Bend	trans	-136.1	146.7	-174.8	-63.4	-100.3	0	0	0	111.3	F229 E326 T329 L333	F229-Y331 HydrophobicContact CB-CE2 3.89Å; F229-Y331 VanDerWaalsContact O-CE2 3.32Å; F229-Y331 WeakPolarHBondContact O-CE2 3.43Å; E326-Y331 WeakPolarHBondContact CA-O 3.36Å; T329-Y331 VanDerWaalsContact C-N 3.33Å; T329-Y331 WeakPolarHBondContact O-CD2 3.45Å; T329-Y331 PolarHBondContact OG1-N 3Å; T329-Y331 PolarHBondContact OG1-O 3.43Å; T329-Y331 VanDerWaalsContact OG1-O 3.06Å; Y331-L333 PolarHBondContact O-N 3.09Å
332	P	98.8	Very high	98.4	Very high	34 Å²	34	19 Å²	19	22%	0.221	10%	0.096	C	C	.	.			trans	-56.9	134.2	177.5	-21.4	29.3	0	0	0	111.6	F299 L334 P335	F299-P332 HydrophobicContact CB-CB 4.47Å; F299-P332 HydrophobicContact CD2-CB 3.96Å; F299-P332 HydrophobicContact CD2-CG 3.94Å; F299-P332 HydrophobicContact CE2-CG 4.15Å; F299-P332 HydrophobicContact CG-CB 4.35Å; P332-L334 VanDerWaalsContact C-N 3.34Å; P332-L334 PolarHBondContact O-N 2.92Å; P332-P335 HydrophobicContact CB-CB 4.2Å
333	L	98.8	Very high	98.4	Very high	4 Å²	4	19 Å²	19	2%	0.021	10%	0.096	C	C	.	.	S	Bend	trans	-63.2	-41.7	-179.7	-178.6	63.9	0	0	0	112	A325 Y331 P335 L349 R406 A411 L412 L428	A325-L333 HydrophobicContact CB-CB 3.91Å; A325-L333 HydrophobicContact CB-CD1 4.15Å; A325-L333 HydrophobicContact CB-CD2 3.87Å; A325-L333 HydrophobicContact CB-CG 4.19Å; Y331-L333 PolarHBondContact O-N 3.09Å; L333-P335 WeakPolarHBondContact O-CD 3.26Å; L333-L349 HydrophobicContact CD1-CD2 4.14Å; L333-L349 HydrophobicContact CD2-CD2 4.05Å; L333-L349 HydrophobicContact CG-CD2 4.12Å; L333-R406 PolarHBondContact O-NH1 2.83Å; L333-A411 HydrophobicContact CD1-CB 3.93Å; L333-L412 HydrophobicContact CD1-CD2 4.45Å; L333-L428 HydrophobicContact CD2-CD1 3.64Å
334	L	98.7	Very high	98.4	Very high	2 Å²	2	19.1 Å²	19.1	1%	0.01	10%	0.097	C	C	.	.	S	Bend	trans	-127.7	74.2	-173.7	-56.9	170.8	0	0	0	110.3	W318 P332 G336 Q342 L345 I346 L349	W318-L334 HydrophobicContact CZ2-CD1 3.93Å; P332-L334 VanDerWaalsContact C-N 3.34Å; P332-L334 PolarHBondContact O-N 2.92Å; L334-G336 VanDerWaalsContact C-N 3.32Å; L334-G336 PolarHBondContact O-N 2.92Å; L334-Q342 VanDerWaalsContact CB-NE2 3.28Å; L334-Q342 PolarHBondContact O-NE2 2.68Å; L334-Q342 VanDerWaalsContact O-NE2 3.11Å; L334-Q342 PolarHBondContact O-OE1 3.47Å; L334-L345 HydrophobicContact CB-CB 4.5Å; L334-L345 HydrophobicContact CD2-CB 3.97Å; L334-I346 HydrophobicContact CD1-CG1 3.77Å; L334-L349 HydrophobicContact CD2-CD2 4.1Å
335	P	98.4	Very high	98.4	Very high	40 Å²	40	19.3 Å²	19.3	26%	0.26	10%	0.098	S	C	.	.			trans	-83.6	64.3	-174.8	34.8	-36.2	0	0	0	112.8	F299 P332 L333 L345	F299-P335 HydrophobicContact CE1-CB 4.36Å; F299-P335 HydrophobicContact CZ-CB 4.48Å; P332-P335 HydrophobicContact CB-CB 4.2Å; L333-P335 WeakPolarHBondContact O-CD 3.26Å; P335-L345 HydrophobicContact CG-CD1 4.47Å
336	G	98.3	Very high	98.4	Very high	2 Å²	2	19.3 Å²	19.3	2%	0.021	10%	0.098	C	C	.	.			trans	-71	141	-177.3	0	0	0	0	0	114.2	R298 F299 L334 D341 Q342 L345	R298-G336 WeakPolarHBondContact CD-O 3.4Å; F299-G336 VanDerWaalsContact CE1-O 3.31Å; F299-G336 WeakPolarHBondContact CE1-O 3.47Å; L334-G336 VanDerWaalsContact C-N 3.32Å; L334-G336 PolarHBondContact O-N 2.92Å; G336-D341 WeakPolarHBondContact CA-OD2 3.43Å; G336-Q342 VanDerWaalsContact CA-OE1 3.26Å; G336-L345 VanDerWaalsContact N-CD1 3.34Å
337	E	97.8	Very high	98.4	Very high	28 Å²	28	19.2 Å²	19.2	13%	0.131	10%	0.098	C	C	.	.	S	Bend	trans	-75.8	-38.1	-179.3	-68.3	167	-161.4	0	0	112.9	D341 S394 K395 R396	E337-D341 HydrophobicContact CB-CB 4.29Å; E337-D341 PolarHBondContact N-OD2 3.37Å; E337-S394 VanDerWaalsContact CD-OG 3.23Å; E337-S394 VanDerWaalsContact OE1-CB 3.3Å; E337-S394 WeakPolarHBondContact OE1-CB 3.45Å; E337-S394 PolarHBondContact OE1-OG 3.35Å; E337-S394 WeakPolarHBondContact OE2-CB 3.27Å; E337-S394 PolarHBondContact OE2-OG 3.09Å; E337-K395 PolarHBondContact OE2-N 2.87Å; E337-R396 HydrophobicContact CG-CG 4.37Å; E337-R396 VanDerWaalsContact OE1-CB 3.32Å; E337-R396 WeakPolarHBondContact OE1-CB 3.34Å; E337-R396 WeakPolarHBondContact OE2-CG 3.21Å; E337-R396 PolarHBondContact OE2-N 3.31Å
338	D	97.6	Very high	98.4	Very high	32 Å²	32	20.3 Å²	20.3	17%	0.171	10%	0.103	C	C	.	.	S	Bend	trans	-142.8	-174.3	174.3	61.1	39.4	0	0	0	109.8	N340 D341 Q342 K395	D338-N340 VanDerWaalsContact C-N 3.31Å; D338-N340 PolarHBondContact O-N 3.34Å; D338-N340 WeakPolarHBondContact OD1-CB 3.11Å; D338-N340 PolarHBondContact OD1-N 3.42Å; D338-D341 PolarHBondContact O-N 3.44Å; D338-D341 PolarHBondContact OD1-N 3.46Å; D338-Q342 VanDerWaalsContact O-CB 3.27Å; D338-Q342 WeakPolarHBondContact O-CB 3.35Å; D338-Q342 PolarHBondContact O-N 3.39Å; D338-K395 WeakPolarHBondContact OD2-CE 3.21Å; D338-K395 IonicContact OD2-NZ 3.38Å; D338-K395 PolarHBondContact OD2-NZ 3.18Å
339	E	96.9	Very high	98.4	Very high	46 Å²	46	20.6 Å²	20.6	22%	0.215	10%	0.104	C	C	.	.	H	α-helix	trans	-66.2	-29.6	-178.2	62.1	-179.4	173	0	0	114.1	I306 L343 R363 F367	I306-E339 HydrophobicContact CG2-CB 4.36Å; E339-L343 PolarHBondContact O-N 2.89Å; E339-L343 VanDerWaalsContact O-N 3.16Å; E339-R363 IonicContact OE1-CZ 3.11Å; E339-R363 IonicContact OE1-NH2 3.61Å; E339-R363 PolarHBondContact OE1-NH2 2.98Å; E339-R363 IonicContact OE2-CZ 3.47Å; E339-R363 VanDerWaalsContact OE2-CZ 3.26Å; E339-R363 IonicContact OE2-NH1 3.66Å; E339-R363 PolarHBondContact OE2-NH1 3.43Å; E339-R363 IonicContact OE2-NH2 3.05Å; E339-R363 PolarHBondContact OE2-NH2 3.45Å; E339-F367 HydrophobicContact CG-CE1 4.27Å; E339-F367 HydrophobicContact CG-CZ 4.34Å
340	N	96.9	Very high	98.4	Very high	70 Å²	70	22.4 Å²	22.4	37%	0.374	11%	0.113	S	C	.	.	H	α-helix	trans	-72.1	-47.2	177.3	-68.3	-80	0	0	0	110	D338 Q342 L343 A344 F367	D338-N340 VanDerWaalsContact C-N 3.31Å; D338-N340 PolarHBondContact O-N 3.34Å; D338-N340 WeakPolarHBondContact OD1-CB 3.11Å; D338-N340 PolarHBondContact OD1-N 3.42Å; N340-Q342 VanDerWaalsContact C-N 3.3Å; N340-Q342 PolarHBondContact O-N 3.15Å; N340-L343 PolarHBondContact O-N 3.28Å; N340-A344 PolarHBondContact O-N 3.14Å; N340-F367 HydrophobicContact CB-CD1 4.49Å; N340-F367 HydrophobicContact CB-CE1 4.38Å; N340-F367 WeakPolarHBondContact OD1-CD1 3.49Å; N340-F367 WeakPolarHBondContact OD1-CE1 3.14Å
341	D	98.5	Very high	98.4	Very high	13 Å²	13	22.8 Å²	22.8	7%	0.07	12%	0.117	C	C	.	.	H	α-helix	trans	-66.3	-33.5	177.3	-169.3	54.3	0	0	0	111.9	G336 E337 D338 A344 L345 S394 R400	G336-D341 WeakPolarHBondContact CA-OD2 3.43Å; E337-D341 HydrophobicContact CB-CB 4.29Å; E337-D341 PolarHBondContact N-OD2 3.37Å; D338-D341 PolarHBondContact O-N 3.44Å; D338-D341 PolarHBondContact OD1-N 3.46Å; D341-A344 PolarHBondContact O-N 3.11Å; D341-L345 WeakPolarHBondContact O-CG 3.35Å; D341-L345 PolarHBondContact O-N 2.83Å; D341-S394 WeakPolarHBondContact OD1-CB 3.27Å; D341-R400 IonicContact OD1-CZ 3.65Å; D341-R400 IonicContact OD1-NE 3.36Å; D341-R400 PolarHBondContact OD1-NE 3.03Å; D341-R400 IonicContact OD1-NH2 3.72Å; D341-R400 PolarHBondContact OD1-NH2 3.41Å; D341-R400 IonicContact OD2-CZ 2.61Å; D341-R400 IonicContact OD2-NE 3.01Å; D341-R400 IonicContact OD2-NH2 3.8Å; D341-R400 PolarHBondContact OD2-NH2 3.16Å
342	Q	98.8	Very high	98.3	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-61	-47.8	173.3	-172.5	65.6	30.7	0	0	111.2	R298 I306 L334 G336 D338 N340 L345 I346	R298-Q342 HydrophobicContact CG-CB 4.15Å; R298-Q342 HydrophobicContact CG-CG 4.15Å; R298-Q342 PolarHBondContact O-NE2 3.04Å; R298-Q342 PolarHBondContact O-OE1 3.05Å; I306-Q342 HydrophobicContact CD1-CB 4.12Å; I306-Q342 HydrophobicContact CD1-CG 3.69Å; L334-Q342 VanDerWaalsContact CB-NE2 3.28Å; L334-Q342 PolarHBondContact O-NE2 2.68Å; L334-Q342 VanDerWaalsContact O-NE2 3.11Å; L334-Q342 PolarHBondContact O-OE1 3.47Å; G336-Q342 VanDerWaalsContact CA-OE1 3.26Å; D338-Q342 VanDerWaalsContact O-CB 3.27Å; D338-Q342 WeakPolarHBondContact O-CB 3.35Å; D338-Q342 PolarHBondContact O-N 3.39Å; N340-Q342 VanDerWaalsContact C-N 3.3Å; N340-Q342 PolarHBondContact O-N 3.15Å; Q342-L345 PolarHBondContact O-N 3.33Å; Q342-I346 WeakPolarHBondContact O-CG1 3.3Å; Q342-I346 PolarHBondContact O-N 3.24Å
343	L	98.5	Very high	98.2	Very high	3 Å²	3	19 Å²	19	2%	0.016	10%	0.102	C	C	.	.	H	α-helix	trans	-69.1	-34.3	178.2	-170.1	64.7	0	0	0	112.2	I306 L307 E339 N340 L345 I346 I347 F367 W430	I306-L343 HydrophobicContact CG2-CB 4.26Å; I306-L343 HydrophobicContact CG2-CD2 4.41Å; L307-L343 HydrophobicContact CD2-CD2 3.84Å; E339-L343 PolarHBondContact O-N 2.89Å; E339-L343 VanDerWaalsContact O-N 3.16Å; N340-L343 PolarHBondContact O-N 3.28Å; L343-L345 VanDerWaalsContact C-N 3.34Å; L343-L345 PolarHBondContact O-N 3.46Å; L343-I346 HydrophobicContact CD1-CD1 4.29Å; L343-I346 WeakPolarHBondContact O-CB 3.37Å; L343-I346 PolarHBondContact O-N 3.35Å; L343-I347 HydrophobicContact CG-CD1 4.06Å; L343-I347 WeakPolarHBondContact O-CG1 3.46Å; L343-I347 PolarHBondContact O-N 3.14Å; L343-F367 HydrophobicContact CD2-CB 3.43Å; L343-F367 VanDerWaalsContact CD2-CB 3.43Å; L343-F367 HydrophobicContact CD2-CD1 3.79Å; L343-F367 HydrophobicContact CD2-CD2 3.83Å; L343-F367 HydrophobicContact CD2-CE1 4.5Å; L343-F367 HydrophobicContact CD2-CG 3.4Å; L343-W430 HydrophobicContact CD1-CH2 3.72Å; L343-W430 HydrophobicContact CD1-CZ3 3.87Å
344	A	98.6	Very high	97.9	Very high	2 Å²	2	21.3 Å²	21.3	2%	0.017	12%	0.117	C	C	.	.	H	α-helix	trans	-58.6	-44.7	173.6	0	0	0	0	0	111.8	N340 D341 I346 I347 E348 Y376 R400	N340-A344 PolarHBondContact O-N 3.14Å; D341-A344 PolarHBondContact O-N 3.11Å; A344-I346 VanDerWaalsContact C-N 3.33Å; A344-I346 PolarHBondContact O-N 3.23Å; A344-I347 PolarHBondContact O-N 2.92Å; A344-E348 VanDerWaalsContact O-CB 3.32Å; A344-E348 WeakPolarHBondContact O-CB 3.38Å; A344-E348 PolarHBondContact O-N 2.72Å; A344-Y376 HydrophobicContact CB-CD1 3.59Å; A344-Y376 HydrophobicContact CB-CD2 3.88Å; A344-Y376 HydrophobicContact CB-CE1 3.94Å; A344-Y376 HydrophobicContact CB-CE2 4.19Å; A344-Y376 HydrophobicContact CB-CG 3.58Å; A344-R400 HydrophobicContact CB-CG 4.42Å
345	L	98.8	Very high	97.6	Very high	3 Å²	3	26 Å²	26	2%	0.016	15%	0.148	C	C	.	.	H	α-helix	trans	-64.2	-36	175.5	-75.4	165.5	0	0	0	112.9	L334 P335 G336 D341 Q342 L343 L349	L334-L345 HydrophobicContact CB-CB 4.5Å; L334-L345 HydrophobicContact CD2-CB 3.97Å; P335-L345 HydrophobicContact CG-CD1 4.47Å; G336-L345 VanDerWaalsContact N-CD1 3.34Å; D341-L345 WeakPolarHBondContact O-CG 3.35Å; D341-L345 PolarHBondContact O-N 2.83Å; Q342-L345 PolarHBondContact O-N 3.33Å; L343-L345 VanDerWaalsContact C-N 3.34Å; L343-L345 PolarHBondContact O-N 3.46Å; L345-L349 PolarHBondContact O-N 3.38Å
346	I	98.8	Very high	97.1	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-63.5	-49	174.5	-64.9	170.4	0	0	0	109.6	P303 I306 W318 L334 Q342 L343 A344 E348 L349 L350 W430	P303-I346 HydrophobicContact CB-CD1 4.4Å; I306-I346 HydrophobicContact CD1-CD1 4.15Å; W318-I346 HydrophobicContact CH2-CD1 4.15Å; W318-I346 HydrophobicContact CH2-CG1 4.23Å; W318-I346 HydrophobicContact CH2-CG2 3.75Å; W318-I346 HydrophobicContact CZ2-CD1 3.64Å; W318-I346 HydrophobicContact CZ2-CG1 3.84Å; W318-I346 HydrophobicContact CZ2-CG2 4.22Å; L334-I346 HydrophobicContact CD1-CG1 3.77Å; Q342-I346 WeakPolarHBondContact O-CG1 3.3Å; Q342-I346 PolarHBondContact O-N 3.24Å; L343-I346 HydrophobicContact CD1-CD1 4.29Å; L343-I346 WeakPolarHBondContact O-CB 3.37Å; L343-I346 PolarHBondContact O-N 3.35Å; A344-I346 VanDerWaalsContact C-N 3.33Å; A344-I346 PolarHBondContact O-N 3.23Å; I346-E348 PolarHBondContact O-N 3.06Å; I346-L349 PolarHBondContact O-N 3.25Å; I346-L350 HydrophobicContact CG2-CD1 3.79Å; I346-L350 HydrophobicContact CG2-CG 4.35Å; I346-L350 WeakPolarHBondContact O-CB 3.29Å; I346-L350 PolarHBondContact O-N 3.01Å; I346-W430 HydrophobicContact CB-CH2 4.21Å; I346-W430 HydrophobicContact CB-CZ2 4.44Å; I346-W430 HydrophobicContact CG2-CH2 3.41Å; I346-W430 VanDerWaalsContact CG2-CH2 3.41Å; I346-W430 HydrophobicContact CG2-CZ2 3.43Å; I346-W430 VanDerWaalsContact CG2-CZ2 3.43Å; I346-W430 HydrophobicContact CG2-CZ3 4.03Å
347	I	98.8	Very high	96.6	Very high	2 Å²	2	29.8 Å²	29.8	1%	0.01	16%	0.162	C	C	.	.	H	α-helix	trans	-64.4	-40.7	-179.4	-68.4	170.1	0	0	0	111.5	L343 A344 L349 G351 M352 I368 P374 Y376 P403 A404 W430	L343-I347 HydrophobicContact CG-CD1 4.06Å; L343-I347 WeakPolarHBondContact O-CG1 3.46Å; L343-I347 PolarHBondContact O-N 3.14Å; A344-I347 PolarHBondContact O-N 2.92Å; I347-L349 VanDerWaalsContact C-N 3.26Å; I347-L349 PolarHBondContact O-N 3.12Å; I347-G351 WeakPolarHBondContact CA-O 3.5Å; I347-G351 WeakPolarHBondContact O-CA 3.42Å; I347-G351 PolarHBondContact O-N 3.2Å; I347-M352 HydrophobicContact CD1-SD 4.42Å; I347-M352 HydrophobicContact CG2-SD 3.75Å; I347-I368 HydrophobicContact CD1-CD1 4.15Å; I347-P374 HydrophobicContact CD1-CB 4.07Å; I347-Y376 HydrophobicContact CB-CE1 4.15Å; I347-Y376 HydrophobicContact CD1-CE1 4.37Å; I347-Y376 HydrophobicContact CG2-CE1 3.98Å; I347-P403 HydrophobicContact CG2-CB 3.7Å; I347-P403 HydrophobicContact CG2-CG 3.61Å; I347-P403 WeakPolarHBondContact O-CA 3.35Å; I347-A404 PolarHBondContact O-N 3.25Å; I347-W430 HydrophobicContact CG1-CH2 3.84Å; I347-W430 HydrophobicContact CG1-CZ2 3.89Å
348	E	98.8	Very high	96.4	Very high	23 Å²	23	30.3 Å²	30.3	11%	0.107	17%	0.166	C	C	.	.	H	α-helix	trans	-58.9	-36.7	176.3	-174.2	-171.3	-153.5	0	0	112.2	A344 I346 G401 A404 S405 R406	A344-E348 VanDerWaalsContact O-CB 3.32Å; A344-E348 WeakPolarHBondContact O-CB 3.38Å; A344-E348 PolarHBondContact O-N 2.72Å; I346-E348 PolarHBondContact O-N 3.06Å; E348-G401 PolarHBondContact OE1-N 2.83Å; E348-A404 CarbonylContact O-C 3.58Å; E348-A404 VanDerWaalsContact O-C 3.26Å; E348-A404 WeakPolarHBondContact O-CA 3.18Å; E348-A404 PolarHBondContact O-N 3.49Å; E348-S405 PolarHBondContact O-N 2.94Å; E348-R406 HydrophobicContact CG-CB 3.8Å; E348-R406 PolarHBondContact O-N 2.83Å
349	L	98.8	Very high	96	Very high	8 Å²	8	36.2 Å²	36.2	4%	0.042	19%	0.192	C	C	.	.	H	α-helix	trans	-87.6	-43.3	-179	-179.5	62.8	0	0	0	113.4	L333 L334 L345 I346 I347 R406 W408 A411	L333-L349 HydrophobicContact CD1-CD2 4.14Å; L333-L349 HydrophobicContact CD2-CD2 4.05Å; L333-L349 HydrophobicContact CG-CD2 4.12Å; L334-L349 HydrophobicContact CD2-CD2 4.1Å; L345-L349 PolarHBondContact O-N 3.38Å; I346-L349 PolarHBondContact O-N 3.25Å; I347-L349 VanDerWaalsContact C-N 3.26Å; I347-L349 PolarHBondContact O-N 3.12Å; L349-R406 HydrophobicContact CD1-CG 4.44Å; L349-R406 WeakPolarHBondContact CD1-O 3.44Å; L349-W408 HydrophobicContact CD1-CD2 4.3Å; L349-W408 HydrophobicContact CD2-CH2 4.16Å; L349-W408 HydrophobicContact CD2-CZ2 4.45Å; L349-W408 HydrophobicContact CD2-CZ3 4.32Å; L349-W408 HydrophobicContact CG-CZ2 4.37Å; L349-A411 HydrophobicContact CD1-CB 3.81Å
350	L	98.5	Very high	95.7	Very high	42 Å²	42	38.7 Å²	38.7	22%	0.22	21%	0.211	C	C	.	.	H	α-helix	trans	-104	-9.8	-168.7	-56.1	-175.6	0	0	0	113.8	W318 I346 W408 L428	W318-L350 HydrophobicContact CH2-CD1 3.73Å; W318-L350 HydrophobicContact CZ3-CD1 4.11Å; I346-L350 HydrophobicContact CG2-CD1 3.79Å; I346-L350 HydrophobicContact CG2-CG 4.35Å; I346-L350 WeakPolarHBondContact O-CB 3.29Å; I346-L350 PolarHBondContact O-N 3.01Å; L350-W408 HydrophobicContact CD2-CH2 4.02Å; L350-W408 HydrophobicContact CD2-CZ2 3.44Å; L350-W408 VanDerWaalsContact CD2-CZ2 3.44Å; L350-L428 HydrophobicContact CD1-CB 4.28Å; L350-L428 WeakPolarHBondContact CD1-O 3.28Å
351	G	98.3	Very high	95.6	Very high	9 Å²	9	36 Å²	36	9%	0.093	20%	0.197	C	C	.	.			trans	80.9	-173.9	-168	0	0	0	0	0	112.3	I347 W430	I347-G351 WeakPolarHBondContact CA-O 3.5Å; I347-G351 WeakPolarHBondContact O-CA 3.42Å; I347-G351 PolarHBondContact O-N 3.2Å; G351-W430 VanDerWaalsContact O-CZ2 3.26Å; G351-W430 WeakPolarHBondContact O-CZ2 3.29Å; G351-W430 PolarHBondContact O-NE1 3.43Å
352	M	97.6	Very high	95.5	Very high	62 Å²	62	44.5 Å²	44.5	31%	0.305	23%	0.234	S	C	.	.	S	Bend	trans	-67.3	146.3	-177.1	-69.3	-64.6	-68.6	0	0	112.1	I347 I368 G372 P374 P403	I347-M352 HydrophobicContact CD1-SD 4.42Å; I347-M352 HydrophobicContact CG2-SD 3.75Å; M352-I368 HydrophobicContact CE-CD1 3.94Å; M352-G372 WeakPolarHBondContact CE-O 3.43Å; M352-P374 HydrophobicContact CE-CB 4.48Å; M352-P374 HydrophobicContact CE-CG 4.5Å; M352-P374 HydrophobicContact SD-CB 4.13Å; M352-P374 HydrophobicContact SD-CG 3.84Å; M352-P403 HydrophobicContact CG-CB 3.96Å; M352-P403 HydrophobicContact CG-CG 3.93Å; M352-P403 HydrophobicContact SD-CB 4.26Å; M352-P403 HydrophobicContact SD-CG 3.72Å
353	P	95.5	Very high	95.4	Very high	8 Å²	8	48.3 Å²	48.3	5%	0.052	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-59.1	142.9	169.3	23.9	-32.7	0	0	0	110.7	L358 W430	P353-L358 HydrophobicContact CB-CD2 4.22Å; P353-L358 HydrophobicContact CB-CG 4.38Å; P353-L358 HydrophobicContact CG-CD1 4.18Å; P353-L358 HydrophobicContact CG-CD2 3.76Å; P353-L358 HydrophobicContact CG-CG 4.09Å; P353-W430 HydrophobicContact CB-CD2 3.91Å; P353-W430 HydrophobicContact CB-CE3 3.69Å; P353-W430 HydrophobicContact CB-CH2 4.07Å; P353-W430 HydrophobicContact CB-CZ2 4.27Å; P353-W430 HydrophobicContact CB-CZ3 3.78Å; P353-W430 HydrophobicContact CG-CH2 4.24Å; P353-W430 HydrophobicContact CG-CZ3 4.3Å
354	P	93.5	Very high	95.3	Very high	52 Å²	52	48.8 Å²	48.8	34%	0.338	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-57.4	148.2	172.2	-23.1	32.8	0	0	0	111.9	K356 S357 W430	P354-K356 VanDerWaalsContact C-N 3.3Å; P354-K356 PolarHBondContact O-N 3.45Å; P354-S357 WeakPolarHBondContact O-CB 3.33Å; P354-S357 PolarHBondContact O-N 3.31Å; P354-W430 VanDerWaalsContact CD-CB 3.49Å; P354-W430 HydrophobicContact CG-CB 4.16Å
355	P	91.3	Very high	95.1	Very high	100 Å²	100	59.1 Å²	59.1	65%	0.649	29%	0.291	S	S	*	.	H	α-helix	trans	-53.5	-42.7	179	-28.6	35.6	0	0	0	113.9	S357 L358 E359	P355-S357 PolarHBondContact O-N 2.93Å; P355-L358 WeakPolarHBondContact O-CA 3.42Å; P355-L358 WeakPolarHBondContact O-CB 3.49Å; P355-L358 PolarHBondContact O-N 3.45Å; P355-E359 PolarHBondContact O-N 2.94Å; P355-E359 VanDerWaalsContact O-N 3.16Å
356	K	88.9	Confident	95	Very high	106 Å²	106	62.1 Å²	62.1	46%	0.461	31%	0.31	S	S	.	.	H	α-helix	trans	-53.1	-39	175.7	-175.3	-170.5	169.8	-150.9	0	112.4	P354 L358 E359 D431 E433	P354-K356 VanDerWaalsContact C-N 3.3Å; P354-K356 PolarHBondContact O-N 3.45Å; K356-L358 PolarHBondContact O-N 3.07Å; K356-E359 PolarHBondContact O-N 3.07Å; K356-D431 IonicContact NZ-OD2 2.74Å; K356-D431 PolarHBondContact NZ-OD2 2.91Å; K356-E433 IonicContact NZ-OE2 2.71Å; K356-E433 PolarHBondContact NZ-OE2 3.2Å
357	S	88.7	Confident	94.9	Very high	16 Å²	16	62.6 Å²	62.6	11%	0.112	31%	0.312	C	S	.	.	H	α-helix	trans	-69.1	-23.2	178.6	-51.9	0	0	0	0	112.8	P354 P355	P354-S357 WeakPolarHBondContact O-CB 3.33Å; P354-S357 PolarHBondContact O-N 3.31Å; P355-S357 PolarHBondContact O-N 2.93Å
358	L	91.6	Very high	94.8	Very high	40 Å²	40	62.9 Å²	62.9	21%	0.209	31%	0.314	C	S	.	.	H	α-helix	trans	-89.6	-26.2	179.3	-62.7	179.6	0	0	0	113.2	L307 P353 P355 K356 T360 A361 A364 I368	L307-L358 HydrophobicContact CD1-CD2 4.45Å; L307-L358 HydrophobicContact CD2-CD2 4.4Å; P353-L358 HydrophobicContact CB-CD2 4.22Å; P353-L358 HydrophobicContact CB-CG 4.38Å; P353-L358 HydrophobicContact CG-CD1 4.18Å; P353-L358 HydrophobicContact CG-CD2 3.76Å; P353-L358 HydrophobicContact CG-CG 4.09Å; P355-L358 WeakPolarHBondContact O-CA 3.42Å; P355-L358 WeakPolarHBondContact O-CB 3.49Å; P355-L358 PolarHBondContact O-N 3.45Å; K356-L358 PolarHBondContact O-N 3.07Å; L358-T360 VanDerWaalsContact C-N 3.31Å; L358-T360 PolarHBondContact O-N 3.38Å; L358-A361 WeakPolarHBondContact O-CB 3.28Å; L358-A361 PolarHBondContact O-N 3.41Å; L358-A364 HydrophobicContact CD2-CB 4.06Å; L358-I368 HydrophobicContact CD1-CG1 4.49Å; L358-I368 HydrophobicContact CD1-CG2 4.49Å; L358-I368 HydrophobicContact CD2-CG1 4.21Å
359	E	89.8	Confident	94.7	Very high	156 Å²	156	63.7 Å²	63.7	73%	0.729	32%	0.32	S	S	*	.	H	α-helix	trans	-58.7	-40.5	-178.2	-74	170.8	-164.5	0	0	112.8	P355 K356	P355-E359 PolarHBondContact O-N 2.94Å; P355-E359 VanDerWaalsContact O-N 3.16Å; K356-E359 PolarHBondContact O-N 3.07Å
360	T	90.8	Very high	94.4	Very high	98 Å²	98	69.5 Å²	69.5	60%	0.601	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-0.1	-179.4	62.3	0	0	0	0	113.4	L358 K362	L358-T360 VanDerWaalsContact C-N 3.31Å; L358-T360 PolarHBondContact O-N 3.38Å; T360-K362 PolarHBondContact O-N 3.43Å
361	A	95.1	Very high	94	Very high	12 Å²	12	75.2 Å²	75.2	10%	0.099	38%	0.384	C	S	.	.			trans	-82.9	101.7	-173.3	0	0	0	0	0	111.8	L307 T309 L358 R363 A364	L307-A361 HydrophobicContact CB-CB 3.96Å; L307-A361 CarbonylContact O-C 3.34Å; T309-A361 VanDerWaalsContact CG2-CA 3.42Å; T309-A361 HydrophobicContact CG2-CB 3.59Å; L358-A361 WeakPolarHBondContact O-CB 3.28Å; L358-A361 PolarHBondContact O-N 3.41Å; A361-R363 PolarHBondContact O-N 2.9Å; A361-A364 HydrophobicContact CB-CB 3.73Å; A361-A364 WeakPolarHBondContact O-CB 3.49Å; A361-A364 PolarHBondContact O-N 3.28Å; A361-A364 VanDerWaalsContact O-N 3.14Å
362	K	96.1	Very high	93.8	Very high	193 Å²	193	76.5 Å²	76.5	84%	0.839	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-25.8	-179.5	-62.5	-179.9	-178.3	-179.7	0	113.5	L307 G308 T360	L307-K362 PolarHBondContact O-N 3.41Å; G308-K362 WeakPolarHBondContact O-CG 3.29Å; T360-K362 PolarHBondContact O-N 3.43Å
363	R	96.5	Very high	93.7	Very high	79 Å²	79	77 Å²	77	30%	0.298	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	5.7	-176.6	-53.3	179.3	67.2	-152.6	5.2	113.7	I306 L307 E339 A361 R365 T366 F367	I306-R363 PolarHBondContact O-NH1 3.1Å; L307-R363 WeakPolarHBondContact O-CA 3.43Å; L307-R363 WeakPolarHBondContact O-CB 2.99Å; L307-R363 PolarHBondContact O-N 3.16Å; E339-R363 IonicContact OE1-CZ 3.11Å; E339-R363 IonicContact OE1-NH2 3.61Å; E339-R363 PolarHBondContact OE1-NH2 2.98Å; E339-R363 IonicContact OE2-CZ 3.47Å; E339-R363 VanDerWaalsContact OE2-CZ 3.26Å; E339-R363 IonicContact OE2-NH1 3.66Å; E339-R363 PolarHBondContact OE2-NH1 3.43Å; E339-R363 IonicContact OE2-NH2 3.05Å; E339-R363 PolarHBondContact OE2-NH2 3.45Å; A361-R363 PolarHBondContact O-N 2.9Å; R363-R365 PolarHBondContact O-N 2.84Å; R363-R365 VanDerWaalsContact O-N 3.15Å; R363-T366 WeakPolarHBondContact O-CB 3.46Å; R363-T366 PolarHBondContact O-N 2.86Å; R363-T366 PolarHBondContact O-OG1 3Å; R363-F367 HydrophobicContact CB-CE2 4.08Å; R363-F367 WeakPolarHBondContact O-CD2 3.34Å
364	A	96	Very high	93.8	Very high	13 Å²	13	76.7 Å²	76.7	11%	0.107	40%	0.395	C	S	.	.	H	α-helix	trans	-52	-41.7	-177.1	0	0	0	0	0	113.1	L358 A361 T366 F367 I368	L358-A364 HydrophobicContact CD2-CB 4.06Å; A361-A364 HydrophobicContact CB-CB 3.73Å; A361-A364 WeakPolarHBondContact O-CB 3.49Å; A361-A364 PolarHBondContact O-N 3.28Å; A361-A364 VanDerWaalsContact O-N 3.14Å; A364-T366 PolarHBondContact O-N 3.38Å; A364-T366 VanDerWaalsContact O-N 3.09Å; A364-F367 PolarHBondContact O-N 3.03Å; A364-I368 PolarHBondContact O-N 3.49Å
365	R	95.6	Very high	93.9	Very high	219 Å²	219	81 Å²	81	83%	0.826	40%	0.404	S	S	*	.	H	α-helix	trans	-61.8	-19.2	-179.7	-64.8	-177	-178.8	179.4	0.9	114.3	R363 F367 R375	R363-R365 PolarHBondContact O-N 2.84Å; R363-R365 VanDerWaalsContact O-N 3.15Å; R365-F367 VanDerWaalsContact C-N 3.29Å; R365-R375 PolarHBondContact O-NE 3.46Å; R365-R375 PolarHBondContact O-NH2 2.78Å; R365-R375 VanDerWaalsContact O-NH2 3.14Å
366	T	96.6	Very high	94.2	Very high	67 Å²	67	78.3 Å²	78.3	41%	0.411	38%	0.382	S	S	.	.	H	α-helix	trans	-69.2	-30.8	174	-43.7	0	0	0	0	111.5	R363 A364 R375	R363-T366 WeakPolarHBondContact O-CB 3.46Å; R363-T366 PolarHBondContact O-N 2.86Å; R363-T366 PolarHBondContact O-OG1 3Å; A364-T366 PolarHBondContact O-N 3.38Å; A364-T366 VanDerWaalsContact O-N 3.09Å; T366-R375 VanDerWaalsContact O-CD 3.23Å; T366-R375 WeakPolarHBondContact O-CD 3.08Å
367	F	97.1	Very high	94.6	Very high	9 Å²	9	74 Å²	74	4%	0.039	37%	0.365	C	S	.	.	H	α-helix	trans	-116.4	-28.1	-169.2	-53.2	-73.4	0	0	0	113.4	I306 L307 E339 N340 L343 R363 A364 R365 R375	I306-F367 HydrophobicContact CG2-CE1 4.07Å; I306-F367 HydrophobicContact CG2-CE2 3.89Å; I306-F367 HydrophobicContact CG2-CZ 3.55Å; I306-F367 WeakPolarHBondContact O-CE2 3.22Å; L307-F367 HydrophobicContact CD2-CD2 3.97Å; E339-F367 HydrophobicContact CG-CE1 4.27Å; E339-F367 HydrophobicContact CG-CZ 4.34Å; N340-F367 HydrophobicContact CB-CD1 4.49Å; N340-F367 HydrophobicContact CB-CE1 4.38Å; N340-F367 WeakPolarHBondContact OD1-CD1 3.49Å; N340-F367 WeakPolarHBondContact OD1-CE1 3.14Å; L343-F367 HydrophobicContact CD2-CB 3.43Å; L343-F367 VanDerWaalsContact CD2-CB 3.43Å; L343-F367 HydrophobicContact CD2-CD1 3.79Å; L343-F367 HydrophobicContact CD2-CD2 3.83Å; L343-F367 HydrophobicContact CD2-CE1 4.5Å; L343-F367 HydrophobicContact CD2-CG 3.4Å; R363-F367 HydrophobicContact CB-CE2 4.08Å; R363-F367 WeakPolarHBondContact O-CD2 3.34Å; A364-F367 PolarHBondContact O-N 3.03Å; R365-F367 VanDerWaalsContact C-N 3.29Å; F367-R375 WeakPolarHBondContact O-CB 3.47Å; F367-R375 WeakPolarHBondContact O-CG 3.15Å; F367-R375 PolarHBondContact O-N 3.4Å
368	I	96.8	Very high	94.9	Very high	9 Å²	9	77.4 Å²	77.4	5%	0.046	39%	0.385	C	S	.	.	B	Isolated β-bridge	trans	-118.9	137.1	-177	-49	-59.6	0	0	0	108.7	I347 M352 L358 A364 P374 R375	I347-I368 HydrophobicContact CD1-CD1 4.15Å; M352-I368 HydrophobicContact CE-CD1 3.94Å; L358-I368 HydrophobicContact CD1-CG1 4.49Å; L358-I368 HydrophobicContact CD1-CG2 4.49Å; L358-I368 HydrophobicContact CD2-CG1 4.21Å; A364-I368 PolarHBondContact O-N 3.49Å; I368-P374 HydrophobicContact CD1-CB 4.19Å; I368-R375 PolarHBondContact O-NE 2.97Å
369	T	95.4	Very high	95.1	Very high	40 Å²	40	77.8 Å²	77.8	25%	0.245	39%	0.394	C	S	.	.			trans	-73.1	165.4	175.6	64.3	0	0	0	0	111.1	K371 G372 Y373 R375	T369-K371 PolarHBondContact O-N 3.15Å; T369-G372 PolarHBondContact O-N 3.41Å; T369-Y373 WeakPolarHBondContact CG2-O 3.48Å; T369-Y373 PolarHBondContact N-O 3.41Å; T369-Y373 PolarHBondContact OG1-N 2.87Å; T369-Y373 PolarHBondContact OG1-O 2.79Å; T369-R375 HydrophobicContact CG2-CG 3.67Å
370	S	92	Very high	95.3	Very high	129 Å²	129	73.7 Å²	73.7	90%	0.902	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-24.7	174.6	50.6	0	0	0	0	113.6	G372	S370-G372 PolarHBondContact O-N 2.77Å
371	K	91.6	Very high	95.5	Very high	162 Å²	162	73.5 Å²	73.5	70%	0.704	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	2.1	175.5	-62.2	-174.3	178.9	-176.4	0	113.3	T369 Y373	T369-K371 PolarHBondContact O-N 3.15Å; K371-Y373 HydrophobicContact CB-CD2 3.69Å; K371-Y373 HydrophobicContact CB-CE2 3.57Å; K371-Y373 HydrophobicContact CD-CD2 4.5Å; K371-Y373 HydrophobicContact CD-CE2 4.02Å; K371-Y373 HydrophobicContact CG-CE2 4.45Å
372	G	92.6	Very high	95.5	Very high	37 Å²	37	76.5 Å²	76.5	38%	0.381	40%	0.395	S	S	.	.	S	Bend	trans	84.8	1.5	-179.6	0	0	0	0	0	115	M352 T369 S370	M352-G372 WeakPolarHBondContact CE-O 3.43Å; T369-G372 PolarHBondContact O-N 3.41Å; S370-G372 PolarHBondContact O-N 2.77Å
373	Y	95.7	Very high	95.4	Very high	72 Å²	72	74.1 Å²	74.1	28%	0.282	40%	0.399	S	S	.	.			trans	-83.5	145.1	177.7	-51.9	-52.2	0	0	0	112.1	T369 K371 A379 V387 L389	T369-Y373 WeakPolarHBondContact CG2-O 3.48Å; T369-Y373 PolarHBondContact N-O 3.41Å; T369-Y373 PolarHBondContact OG1-N 2.87Å; T369-Y373 PolarHBondContact OG1-O 2.79Å; K371-Y373 HydrophobicContact CB-CD2 3.69Å; K371-Y373 HydrophobicContact CB-CE2 3.57Å; K371-Y373 HydrophobicContact CD-CD2 4.5Å; K371-Y373 HydrophobicContact CD-CE2 4.02Å; K371-Y373 HydrophobicContact CG-CE2 4.45Å; Y373-A379 HydrophobicContact CD2-CB 3.99Å; Y373-A379 HydrophobicContact CE2-CB 4.39Å; Y373-A379 HydrophobicContact CG-CB 4.37Å; Y373-V387 HydrophobicContact CE1-CG1 4.22Å; Y373-V387 HydrophobicContact CE2-CG1 4.26Å; Y373-L389 HydrophobicContact CD1-CD1 4.29Å; Y373-L389 HydrophobicContact CD1-CD2 3.91Å; Y373-L389 HydrophobicContact CG-CD2 4.05Å
374	P	97.1	Very high	95.2	Very high	2 Å²	2	76.3 Å²	76.3	1%	0.013	42%	0.417	C	S	.	.	B	Isolated β-bridge	trans	-70.2	133.7	175.7	31.2	-33.7	0	0	0	110.3	I347 M352 I368 Y376 C377 L389 P403	I347-P374 HydrophobicContact CD1-CB 4.07Å; M352-P374 HydrophobicContact CE-CB 4.48Å; M352-P374 HydrophobicContact CE-CG 4.5Å; M352-P374 HydrophobicContact SD-CB 4.13Å; M352-P374 HydrophobicContact SD-CG 3.84Å; I368-P374 HydrophobicContact CD1-CB 4.19Å; P374-Y376 HydrophobicContact CB-CD1 3.69Å; P374-Y376 HydrophobicContact CB-CE1 3.61Å; P374-Y376 HydrophobicContact CG-CD1 4.28Å; P374-Y376 HydrophobicContact CG-CE1 3.87Å; P374-Y376 PolarHBondContact O-N 3.25Å; P374-C377 HydrophobicContact CG-CB 4.02Å; P374-C377 PolarHBondContact O-N 3.17Å; P374-L389 HydrophobicContact CG-CD1 4.43Å; P374-P403 HydrophobicContact CG-CG 4.06Å
375	R	97.1	Very high	94.9	Very high	141 Å²	141	78.8 Å²	78.8	53%	0.532	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-17.5	-175	-73.4	178.9	178.1	-80.6	5.3	114.3	R365 T366 F367 I368 T369	R365-R375 PolarHBondContact O-NE 3.46Å; R365-R375 PolarHBondContact O-NH2 2.78Å; R365-R375 VanDerWaalsContact O-NH2 3.14Å; T366-R375 VanDerWaalsContact O-CD 3.23Å; T366-R375 WeakPolarHBondContact O-CD 3.08Å; F367-R375 WeakPolarHBondContact O-CB 3.47Å; F367-R375 WeakPolarHBondContact O-CG 3.15Å; F367-R375 PolarHBondContact O-N 3.4Å; I368-R375 PolarHBondContact O-NE 2.97Å; T369-R375 HydrophobicContact CG2-CG 3.67Å
376	Y	96.9	Very high	94.8	Very high	44 Å²	44	70.6 Å²	70.6	17%	0.173	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-16.8	173.4	84.8	-90	0	0	0	111.9	A344 I347 P374 A392 R400 G401	A344-Y376 HydrophobicContact CB-CD1 3.59Å; A344-Y376 HydrophobicContact CB-CD2 3.88Å; A344-Y376 HydrophobicContact CB-CE1 3.94Å; A344-Y376 HydrophobicContact CB-CE2 4.19Å; A344-Y376 HydrophobicContact CB-CG 3.58Å; I347-Y376 HydrophobicContact CB-CE1 4.15Å; I347-Y376 HydrophobicContact CD1-CE1 4.37Å; I347-Y376 HydrophobicContact CG2-CE1 3.98Å; P374-Y376 HydrophobicContact CB-CD1 3.69Å; P374-Y376 HydrophobicContact CB-CE1 3.61Å; P374-Y376 HydrophobicContact CG-CD1 4.28Å; P374-Y376 HydrophobicContact CG-CE1 3.87Å; P374-Y376 PolarHBondContact O-N 3.25Å; Y376-A392 WeakPolarHBondContact O-CB 3.23Å; Y376-R400 HydrophobicContact CD2-CB 4.08Å; Y376-R400 HydrophobicContact CE2-CB 3.87Å; Y376-G401 VanDerWaalsContact CE2-O 3.27Å; Y376-G401 WeakPolarHBondContact CE2-O 3.49Å; Y376-G401 PolarHBondContact OH-O 3.12Å
377	C	97.2	Very high	94.7	Very high	17 Å²	17	69.9 Å²	69.9	12%	0.115	42%	0.416	C	S	.	.	S	Bend	trans	-92.8	153.6	177	-71.8	0	0	0	0	112	P374 L389 A390	P374-C377 HydrophobicContact CG-CB 4.02Å; P374-C377 PolarHBondContact O-N 3.17Å; C377-L389 HydrophobicContact CB-CB 4.32Å; C377-L389 HydrophobicContact CB-CD2 4.39Å; C377-A390 CarbonylContact C-O 3.58Å; C377-A390 WeakPolarHBondContact CA-O 3.11Å; C377-A390 VanDerWaalsContact CB-O 3.27Å; C377-A390 WeakPolarHBondContact CB-O 3.47Å
378	T	95.5	Very high	94.6	Very high	86 Å²	86	72.8 Å²	72.8	53%	0.528	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	123.7	164.3	-55.6	0	0	0	0	108.8	L389 A390	T378-L389 WeakPolarHBondContact O-CA 3.5Å; T378-A390 PolarHBondContact N-O 3.43Å; T378-A390 PolarHBondContact O-N 2.92Å
379	A	94.9	Very high	94.5	Very high	49 Å²	49	74.1 Å²	74.1	41%	0.405	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	121.3	176.4	0	0	0	0	0	110.1	Y373 V387 L389	Y373-A379 HydrophobicContact CD2-CB 3.99Å; Y373-A379 HydrophobicContact CE2-CB 4.39Å; Y373-A379 HydrophobicContact CG-CB 4.37Å; A379-V387 HydrophobicContact CB-CG1 3.93Å; A379-L389 HydrophobicContact CB-CD2 3.65Å
380	T	95.1	Very high	94.6	Very high	70 Å²	70	74.5 Å²	74.5	43%	0.429	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	122.3	178.5	-51.7	0	0	0	0	109.5	V387 V388	T380-V387 WeakPolarHBondContact O-CA 3.34Å; T380-V388 PolarHBondContact N-O 3.17Å; T380-V388 PolarHBondContact O-N 3.07Å
381	S	94.4	Very high	94.7	Very high	93 Å²	93	69.4 Å²	69.4	65%	0.65	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.3	128.1	172.4	-67.1	0	0	0	0	109.9
382	M	94.2	Very high	94.9	Very high	76 Å²	76	63.2 Å²	63.2	37%	0.374	40%	0.395	S	S	.	.			trans	-89.9	160.3	177.1	-65.5	-59	-171.5	0	0	111	D384 G385 S386 V388	M382-D384 WeakPolarHBondContact CB-OD1 3.37Å; M382-D384 PolarHBondContact O-N 3.28Å; M382-G385 PolarHBondContact O-N 2.98Å; M382-S386 WeakPolarHBondContact CB-OG 3.28Å; M382-S386 PolarHBondContact N-O 3.35Å; M382-V388 HydrophobicContact CE-CB 3.82Å; M382-V388 HydrophobicContact CE-CG1 4.46Å; M382-V388 HydrophobicContact CE-CG2 3.44Å; M382-V388 VanDerWaalsContact CE-CG2 3.44Å; M382-V388 HydrophobicContact CG-CG2 3.93Å
383	P	94.1	Very high	95	Very high	142 Å²	142	69.5 Å²	69.5	92%	0.922	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-24.9	178.9	-25.5	35.4	0	0	0	114.6	G385	P383-G385 PolarHBondContact O-N 3.2Å
384	D	93.6	Very high	95	Very high	126 Å²	126	66.8 Å²	66.8	67%	0.674	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	2.7	176.4	67.9	-3	0	0	0	113.6	M382 S386	M382-D384 WeakPolarHBondContact CB-OD1 3.37Å; M382-D384 PolarHBondContact O-N 3.28Å; D384-S386 VanDerWaalsContact C-N 3.28Å; D384-S386 PolarHBondContact O-N 3.01Å; D384-S386 WeakPolarHBondContact OD1-CB 3.19Å; D384-S386 PolarHBondContact OD1-N 3.44Å; D384-S386 PolarHBondContact OD1-OG 3.32Å; D384-S386 PolarHBondContact OD2-OG 2.67Å
385	G	89.9	Confident	94.9	Very high	64 Å²	64	75.1 Å²	75.1	66%	0.66	44%	0.435	S	S	*	.	S	Bend	trans	83	-4.2	-177.8	0	0	0	0	0	114.6	M382 P383	M382-G385 PolarHBondContact O-N 2.98Å; P383-G385 PolarHBondContact O-N 3.2Å
386	S	92.9	Very high	94.9	Very high	48 Å²	48	77.8 Å²	77.8	34%	0.336	45%	0.445	S	S	.	.			trans	-71.7	158.3	173.8	72.9	0	0	0	0	111.4	M382 D384	M382-S386 WeakPolarHBondContact CB-OG 3.28Å; M382-S386 PolarHBondContact N-O 3.35Å; D384-S386 VanDerWaalsContact C-N 3.28Å; D384-S386 PolarHBondContact O-N 3.01Å; D384-S386 WeakPolarHBondContact OD1-CB 3.19Å; D384-S386 PolarHBondContact OD1-N 3.44Å; D384-S386 PolarHBondContact OD1-OG 3.32Å; D384-S386 PolarHBondContact OD2-OG 2.67Å
387	V	93.9	Very high	94.8	Very high	52 Å²	52	77.1 Å²	77.1	32%	0.315	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	124.3	176.4	176.8	0	0	0	0	109.2	Y373 A379 T380 L389	Y373-V387 HydrophobicContact CE1-CG1 4.22Å; Y373-V387 HydrophobicContact CE2-CG1 4.26Å; A379-V387 HydrophobicContact CB-CG1 3.93Å; T380-V387 WeakPolarHBondContact O-CA 3.34Å; V387-L389 HydrophobicContact CG1-CD2 4.39Å
388	V	94.6	Very high	94.7	Very high	69 Å²	69	81.6 Å²	81.6	42%	0.418	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	129.7	174.3	179.2	0	0	0	0	109.2	T380 M382	T380-V388 PolarHBondContact N-O 3.17Å; T380-V388 PolarHBondContact O-N 3.07Å; M382-V388 HydrophobicContact CE-CB 3.82Å; M382-V388 HydrophobicContact CE-CG1 4.46Å; M382-V388 HydrophobicContact CE-CG2 3.44Å; M382-V388 VanDerWaalsContact CE-CG2 3.44Å; M382-V388 HydrophobicContact CG-CG2 3.93Å
389	L	96.6	Very high	94.8	Very high	37 Å²	37	82.4 Å²	82.4	19%	0.194	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	121.9	173.8	-62.1	-178.1	0	0	0	109.7	Y373 P374 C377 T378 A379 V387 P402 P403	Y373-L389 HydrophobicContact CD1-CD1 4.29Å; Y373-L389 HydrophobicContact CD1-CD2 3.91Å; Y373-L389 HydrophobicContact CG-CD2 4.05Å; P374-L389 HydrophobicContact CG-CD1 4.43Å; C377-L389 HydrophobicContact CB-CB 4.32Å; C377-L389 HydrophobicContact CB-CD2 4.39Å; T378-L389 WeakPolarHBondContact O-CA 3.5Å; A379-L389 HydrophobicContact CB-CD2 3.65Å; V387-L389 HydrophobicContact CG1-CD2 4.39Å; L389-P402 HydrophobicContact CB-CB 4.19Å; L389-P402 WeakPolarHBondContact O-CB 3.18Å; L389-P403 HydrophobicContact CD1-CG 4.04Å
390	A	96.1	Very high	94.9	Very high	49 Å²	49	81 Å²	81	41%	0.405	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	137.9	167.7	0	0	0	0	0	109.8	C377 T378	C377-A390 CarbonylContact C-O 3.58Å; C377-A390 WeakPolarHBondContact CA-O 3.11Å; C377-A390 VanDerWaalsContact CB-O 3.27Å; C377-A390 WeakPolarHBondContact CB-O 3.47Å; T378-A390 PolarHBondContact N-O 3.43Å; T378-A390 PolarHBondContact O-N 2.92Å
391	G	94.8	Very high	95.1	Very high	22 Å²	22	78.1 Å²	78.1	23%	0.227	44%	0.437	C	S	.	.			trans	-62.4	176.2	171.2	0	0	0	0	0	113.5	R400	G391-R400 CarbonylContact C-O 3.58Å; G391-R400 WeakPolarHBondContact CA-O 3.32Å
392	A	94.9	Very high	95.2	Very high	31 Å²	31	75.8 Å²	75.8	26%	0.256	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	168.2	175.8	0	0	0	0	0	112	Y376 R400	Y376-A392 WeakPolarHBondContact O-CB 3.23Å; A392-R400 PolarHBondContact N-O 2.98Å; A392-R400 PolarHBondContact O-N 3.17Å
393	R	96	Very high	95.4	Very high	169 Å²	169	73.7 Å²	73.7	64%	0.638	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.3	140.6	174.6	-67	-176.4	-179	-87.5	1.3	110.8	G397 K398 M399	R393-G397 PolarHBondContact NH1-O 2.63Å; R393-K398 CarbonylContact C-O 3.55Å; R393-K398 VanDerWaalsContact CA-O 3.3Å; R393-K398 WeakPolarHBondContact CA-O 3.22Å; R393-M399 HydrophobicContact CG-CE 4.02Å; R393-M399 HydrophobicContact CG-SD 4.22Å
394	S	95.9	Very high	95.6	Very high	16 Å²	16	69.9 Å²	69.9	11%	0.112	39%	0.392	C	S	.	.			trans	-64.2	172.8	167.2	75.1	0	0	0	0	111.2	E337 D341 R396 G397 K398	E337-S394 VanDerWaalsContact CD-OG 3.23Å; E337-S394 VanDerWaalsContact OE1-CB 3.3Å; E337-S394 WeakPolarHBondContact OE1-CB 3.45Å; E337-S394 PolarHBondContact OE1-OG 3.35Å; E337-S394 WeakPolarHBondContact OE2-CB 3.27Å; E337-S394 PolarHBondContact OE2-OG 3.09Å; D341-S394 WeakPolarHBondContact OD1-CB 3.27Å; S394-R396 PolarHBondContact O-N 3.37Å; S394-R396 PolarHBondContact OG-N 2.88Å; S394-G397 WeakPolarHBondContact O-CA 3.21Å; S394-G397 PolarHBondContact O-N 2.88Å; S394-K398 PolarHBondContact N-O 3.06Å; S394-K398 WeakPolarHBondContact OG-CB 3.47Å; S394-K398 PolarHBondContact OG-N 3.46Å; S394-K398 VanDerWaalsContact OG-N 3.07Å
395	K	94.9	Very high	95.9	Very high	176 Å²	176	66.9 Å²	66.9	77%	0.765	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-30.7	177	-70.5	174.3	177.7	161.5	0	112.5	E337 D338 G397	E337-K395 PolarHBondContact OE2-N 2.87Å; D338-K395 WeakPolarHBondContact OD2-CE 3.21Å; D338-K395 IonicContact OD2-NZ 3.38Å; D338-K395 PolarHBondContact OD2-NZ 3.18Å; K395-G397 VanDerWaalsContact C-N 3.31Å
396	R	95.6	Very high	96.2	Very high	197 Å²	197	66.6 Å²	66.6	74%	0.743	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	13.4	173.6	-54.6	173.6	-172.6	-174.7	1.2	113.6	E337 S394	E337-R396 HydrophobicContact CG-CG 4.37Å; E337-R396 VanDerWaalsContact OE1-CB 3.32Å; E337-R396 WeakPolarHBondContact OE1-CB 3.34Å; E337-R396 WeakPolarHBondContact OE2-CG 3.21Å; E337-R396 PolarHBondContact OE2-N 3.31Å; S394-R396 PolarHBondContact O-N 3.37Å; S394-R396 PolarHBondContact OG-N 2.88Å
397	G	95.4	Very high	96.5	Very high	31 Å²	31	66.6 Å²	66.6	32%	0.32	36%	0.36	S	S	.	.	S	Bend	trans	83	6.7	173.3	0	0	0	0	0	115.8	R393 S394 K395	R393-G397 PolarHBondContact NH1-O 2.63Å; S394-G397 WeakPolarHBondContact O-CA 3.21Å; S394-G397 PolarHBondContact O-N 2.88Å; K395-G397 VanDerWaalsContact C-N 3.31Å
398	K	96.2	Very high	96.7	Very high	111 Å²	111	65.9 Å²	65.9	48%	0.483	35%	0.352	S	S	.	.			trans	-77.6	130.3	179.1	-64.5	-175	176.7	-177.1	0	110.4	R393 S394	R393-K398 CarbonylContact C-O 3.55Å; R393-K398 VanDerWaalsContact CA-O 3.3Å; R393-K398 WeakPolarHBondContact CA-O 3.22Å; S394-K398 PolarHBondContact N-O 3.06Å; S394-K398 WeakPolarHBondContact OG-CB 3.47Å; S394-K398 PolarHBondContact OG-N 3.46Å; S394-K398 VanDerWaalsContact OG-N 3.07Å
399	M	96.9	Very high	96.8	Very high	103 Å²	103	65.5 Å²	65.5	51%	0.507	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	139.8	177.6	-168.6	62	75.8	0	0	111.1	R393	R393-M399 HydrophobicContact CG-CE 4.02Å; R393-M399 HydrophobicContact CG-SD 4.22Å
400	R	97.6	Very high	96.9	Very high	18 Å²	18	68.2 Å²	68.2	7%	0.068	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	117.7	166.9	-52.5	-59	176.6	-139.9	7.5	107.4	D341 A344 Y376 G391 A392	D341-R400 IonicContact OD1-CZ 3.65Å; D341-R400 IonicContact OD1-NE 3.36Å; D341-R400 PolarHBondContact OD1-NE 3.03Å; D341-R400 IonicContact OD1-NH2 3.72Å; D341-R400 PolarHBondContact OD1-NH2 3.41Å; D341-R400 IonicContact OD2-CZ 2.61Å; D341-R400 IonicContact OD2-NE 3.01Å; D341-R400 IonicContact OD2-NH2 3.8Å; D341-R400 PolarHBondContact OD2-NH2 3.16Å; A344-R400 HydrophobicContact CB-CG 4.42Å; Y376-R400 HydrophobicContact CD2-CB 4.08Å; Y376-R400 HydrophobicContact CE2-CB 3.87Å; G391-R400 CarbonylContact C-O 3.58Å; G391-R400 WeakPolarHBondContact CA-O 3.32Å; A392-R400 PolarHBondContact N-O 2.98Å; A392-R400 PolarHBondContact O-N 3.17Å
401	G	97.8	Very high	97	Very high	11 Å²	11	66.1 Å²	66.1	11%	0.113	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-71.4	172	177	0	0	0	0	0	113.3	E348 Y376 S405	E348-G401 PolarHBondContact OE1-N 2.83Å; Y376-G401 VanDerWaalsContact CE2-O 3.27Å; Y376-G401 WeakPolarHBondContact CE2-O 3.49Å; Y376-G401 PolarHBondContact OH-O 3.12Å; G401-S405 VanDerWaalsContact CA-OG 3.28Å; G401-S405 WeakPolarHBondContact CA-OG 3.34Å
402	P	98.1	Very high	97.1	Very high	43 Å²	43	65.2 Å²	65.2	28%	0.279	34%	0.343	S	S	.	.	S	Bend	trans	-64.6	172.8	176	27.3	-32.4	0	0	0	112.3	L389 A404 S405	L389-P402 HydrophobicContact CB-CB 4.19Å; L389-P402 WeakPolarHBondContact O-CB 3.18Å; P402-A404 PolarHBondContact O-N 3.47Å; P402-S405 WeakPolarHBondContact CD-OG 3.26Å; P402-S405 VanDerWaalsContact O-CB 3.3Å; P402-S405 WeakPolarHBondContact O-CB 3.38Å; P402-S405 PolarHBondContact O-N 3.33Å; P402-S405 VanDerWaalsContact O-N 3.14Å; P402-S405 PolarHBondContact O-OG 3.16Å
403	P	98.4	Very high	97.2	Very high	32 Å²	32	68.6 Å²	68.6	21%	0.208	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	134	-179.9	-27.2	33.9	0	0	0	113.5	I347 M352 P374 L389 S405	I347-P403 HydrophobicContact CG2-CB 3.7Å; I347-P403 HydrophobicContact CG2-CG 3.61Å; I347-P403 WeakPolarHBondContact O-CA 3.35Å; M352-P403 HydrophobicContact CG-CB 3.96Å; M352-P403 HydrophobicContact CG-CG 3.93Å; M352-P403 HydrophobicContact SD-CB 4.26Å; M352-P403 HydrophobicContact SD-CG 3.72Å; P374-P403 HydrophobicContact CG-CG 4.06Å; L389-P403 HydrophobicContact CD1-CG 4.04Å; P403-S405 PolarHBondContact O-N 3.48Å; P403-S405 VanDerWaalsContact O-N 3.16Å
404	A	98.1	Very high	97.2	Very high	63 Å²	63	66.9 Å²	66.9	52%	0.521	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.5	18.3	-179.4	0	0	0	0	0	115.8	I347 E348 P402	I347-A404 PolarHBondContact O-N 3.25Å; E348-A404 CarbonylContact O-C 3.58Å; E348-A404 VanDerWaalsContact O-C 3.26Å; E348-A404 WeakPolarHBondContact O-CA 3.18Å; E348-A404 PolarHBondContact O-N 3.49Å; P402-A404 PolarHBondContact O-N 3.47Å
405	S	98.3	Very high	97.2	Very high	62 Å²	62	69.4 Å²	69.4	43%	0.434	37%	0.366	S	S	.	.			trans	-76.6	-20.2	179.1	68.8	0	0	0	0	114.1	E348 G401 P402 P403	E348-S405 PolarHBondContact O-N 2.94Å; G401-S405 VanDerWaalsContact CA-OG 3.28Å; G401-S405 WeakPolarHBondContact CA-OG 3.34Å; P402-S405 WeakPolarHBondContact CD-OG 3.26Å; P402-S405 VanDerWaalsContact O-CB 3.3Å; P402-S405 WeakPolarHBondContact O-CB 3.38Å; P402-S405 PolarHBondContact O-N 3.33Å; P402-S405 VanDerWaalsContact O-N 3.14Å; P402-S405 PolarHBondContact O-OG 3.16Å; P403-S405 PolarHBondContact O-N 3.48Å; P403-S405 VanDerWaalsContact O-N 3.16Å
406	R	98	Very high	97	Very high	58 Å²	58	62.2 Å²	62.2	22%	0.219	34%	0.343	C	S	.	.	S	Bend	trans	-92.8	114.4	178	-176.9	179.3	-177.3	-158.5	-0.9	109.9	L333 E348 L349 A411	L333-R406 PolarHBondContact O-NH1 2.83Å; E348-R406 HydrophobicContact CG-CB 3.8Å; E348-R406 PolarHBondContact O-N 2.83Å; L349-R406 HydrophobicContact CD1-CG 4.44Å; L349-R406 WeakPolarHBondContact CD1-O 3.44Å; R406-A411 HydrophobicContact CG-CB 4.44Å
407	S	98.1	Very high	97	Very high	49 Å²	49	54.7 Å²	54.7	34%	0.343	32%	0.317	S	S	.	.			trans	-71.2	153.8	177.4	72.5	0	0	0	0	112.4	S409 T410 A411	S407-S409 VanDerWaalsContact C-N 3.29Å; S407-S409 PolarHBondContact O-N 3.23Å; S407-S409 PolarHBondContact OG-OG 3.05Å; S407-T410 PolarHBondContact O-N 2.92Å; S407-T410 WeakPolarHBondContact OG-CB 3.37Å; S407-T410 PolarHBondContact OG-N 3.34Å; S407-T410 PolarHBondContact OG-OG1 3.48Å; S407-A411 WeakPolarHBondContact O-CB 3.21Å; S407-A411 PolarHBondContact O-N 3.47Å
408	W	98.2	Very high	97.1	Very high	36 Å²	36	61.2 Å²	61.2	14%	0.136	34%	0.339	C	S	.	.	H	α-helix	trans	-62.6	-34.9	173.7	-75.5	92	0	0	0	113	L349 L350 A411 L412 V421 L424 K425 L428	L349-W408 HydrophobicContact CD1-CD2 4.3Å; L349-W408 HydrophobicContact CD2-CH2 4.16Å; L349-W408 HydrophobicContact CD2-CZ2 4.45Å; L349-W408 HydrophobicContact CD2-CZ3 4.32Å; L349-W408 HydrophobicContact CG-CZ2 4.37Å; L350-W408 HydrophobicContact CD2-CH2 4.02Å; L350-W408 HydrophobicContact CD2-CZ2 3.44Å; L350-W408 VanDerWaalsContact CD2-CZ2 3.44Å; W408-A411 PolarHBondContact O-N 3.42Å; W408-L412 HydrophobicContact CE3-CD1 4.28Å; W408-L412 WeakPolarHBondContact O-CB 3.36Å; W408-L412 WeakPolarHBondContact O-CG 3.49Å; W408-L412 PolarHBondContact O-N 2.89Å; W408-V421 HydrophobicContact CB-CG1 4.09Å; W408-V421 HydrophobicContact CD2-CG1 4.18Å; W408-V421 HydrophobicContact CE3-CG1 4.48Å; W408-V421 HydrophobicContact CG-CG1 4Å; W408-L424 HydrophobicContact CH2-CB 4.29Å; W408-L424 HydrophobicContact CZ3-CB 3.96Å; W408-L424 HydrophobicContact CZ3-CD1 4.15Å; W408-K425 VanDerWaalsContact CD1-CE 3.41Å; W408-K425 HydrophobicContact CD2-CG 4.44Å; W408-K425 HydrophobicContact CH2-CG 4.16Å; W408-K425 HydrophobicContact CZ2-CG 3.5Å; W408-K425 VanDerWaalsContact CZ2-CG 3.5Å; W408-L428 HydrophobicContact CH2-CD1 3.82Å; W408-L428 HydrophobicContact CZ3-CD1 4.33Å
409	S	97.5	Very high	97.2	Very high	61 Å²	61	58.3 Å²	58.3	43%	0.427	33%	0.329	S	S	.	.	H	α-helix	trans	-62.6	-47	177	55.3	0	0	0	0	111	S407 L412 K413 N414	S407-S409 VanDerWaalsContact C-N 3.29Å; S407-S409 PolarHBondContact O-N 3.23Å; S407-S409 PolarHBondContact OG-OG 3.05Å; S409-L412 CarbonylContact O-C 3.47Å; S409-L412 PolarHBondContact O-N 3.37Å; S409-K413 PolarHBondContact O-N 3.42Å; S409-N414 WeakPolarHBondContact CB-OD1 3.46Å; S409-N414 PolarHBondContact O-N 3.38Å; S409-N414 PolarHBondContact O-OD1 2.98Å
410	T	97.4	Very high	97.2	Very high	94 Å²	94	53.4 Å²	53.4	58%	0.577	31%	0.305	S	S	*	.	H	α-helix	trans	-65.1	-43.1	173.4	-59.3	0	0	0	0	111.7	S407 L412 K413	S407-T410 PolarHBondContact O-N 2.92Å; S407-T410 WeakPolarHBondContact OG-CB 3.37Å; S407-T410 PolarHBondContact OG-N 3.34Å; S407-T410 PolarHBondContact OG-OG1 3.48Å; T410-L412 VanDerWaalsContact C-N 3.25Å; T410-L412 PolarHBondContact O-N 2.86Å; T410-K413 PolarHBondContact O-N 3.05Å
411	A	97.9	Very high	97.3	Very high	6 Å²	6	53.8 Å²	53.8	5%	0.05	31%	0.309	C	S	.	.	H	α-helix	trans	-61.5	-34.5	180	0	0	0	0	0	113	L333 L349 R406 S407 W408	L333-A411 HydrophobicContact CD1-CB 3.93Å; L349-A411 HydrophobicContact CD1-CB 3.81Å; R406-A411 HydrophobicContact CG-CB 4.44Å; S407-A411 WeakPolarHBondContact O-CB 3.21Å; S407-A411 PolarHBondContact O-N 3.47Å; W408-A411 PolarHBondContact O-N 3.42Å
412	L	98.3	Very high	97.3	Very high	2 Å²	2	55.8 Å²	55.8	1%	0.01	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	12.6	-179.7	-58.9	177.5	0	0	0	113.7	A325 T329 L333 W408 S409 T410 N414 M415 F420 V421 L424	A325-L412 HydrophobicContact CB-CD2 3.85Å; T329-L412 HydrophobicContact CG2-CB 4.43Å; T329-L412 HydrophobicContact CG2-CD2 4.28Å; L333-L412 HydrophobicContact CD1-CD2 4.45Å; W408-L412 HydrophobicContact CE3-CD1 4.28Å; W408-L412 WeakPolarHBondContact O-CB 3.36Å; W408-L412 WeakPolarHBondContact O-CG 3.49Å; W408-L412 PolarHBondContact O-N 2.89Å; S409-L412 CarbonylContact O-C 3.47Å; S409-L412 PolarHBondContact O-N 3.37Å; T410-L412 VanDerWaalsContact C-N 3.25Å; T410-L412 PolarHBondContact O-N 2.86Å; L412-N414 PolarHBondContact O-N 3.33Å; L412-N414 VanDerWaalsContact O-N 3.13Å; L412-M415 VanDerWaalsContact O-CB 3.3Å; L412-M415 WeakPolarHBondContact O-CB 3.5Å; L412-M415 WeakPolarHBondContact O-CG 3.45Å; L412-M415 PolarHBondContact O-N 3.48Å; L412-F420 HydrophobicContact CD1-CD1 4.23Å; L412-F420 HydrophobicContact CD1-CE1 4.24Å; L412-F420 HydrophobicContact CD2-CE1 4.43Å; L412-V421 HydrophobicContact CD1-CG2 3.75Å; L412-L424 HydrophobicContact CD1-CD1 3.99Å; L412-L424 HydrophobicContact CD2-CD1 3.86Å
413	K	96.8	Very high	97.4	Very high	103 Å²	103	53.8 Å²	53.8	45%	0.448	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	51	34.6	-178.6	-55.7	-179.6	178.9	176.5	0	114.1	T329 S409 T410 M415	T329-K413 PolarHBondContact O-NZ 3.35Å; T329-K413 VanDerWaalsContact O-NZ 3.15Å; S409-K413 PolarHBondContact O-N 3.42Å; T410-K413 PolarHBondContact O-N 3.05Å; K413-M415 HydrophobicContact CB-CG 4.17Å; K413-M415 HydrophobicContact CB-SD 4.21Å; K413-M415 WeakPolarHBondContact O-CG 3.4Å; K413-M415 PolarHBondContact O-N 3.2Å
414	N	95.4	Very high	97.4	Very high	133 Å²	133	52.2 Å²	52.2	71%	0.711	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	19.9	-174.4	-52.7	-47.5	0	0	0	114.8	S409 L412	S409-N414 WeakPolarHBondContact CB-OD1 3.46Å; S409-N414 PolarHBondContact O-N 3.38Å; S409-N414 PolarHBondContact O-OD1 2.98Å; L412-N414 PolarHBondContact O-N 3.33Å; L412-N414 VanDerWaalsContact O-N 3.13Å
415	M	95.6	Very high	97.4	Very high	68 Å²	68	54.2 Å²	54.2	34%	0.335	29%	0.291	S	S	.	.			trans	-93.3	-11.7	-176.9	-58.1	176.8	70.1	0	0	113.8	L328 L412 K413	L328-M415 HydrophobicContact CD1-CB 4Å; L328-M415 HydrophobicContact CD1-CE 4.43Å; L328-M415 HydrophobicContact CD2-CB 4.04Å; L328-M415 HydrophobicContact CG-CB 3.89Å; L328-M415 WeakPolarHBondContact O-CE 3.35Å; L412-M415 VanDerWaalsContact O-CB 3.3Å; L412-M415 WeakPolarHBondContact O-CB 3.5Å; L412-M415 WeakPolarHBondContact O-CG 3.45Å; L412-M415 PolarHBondContact O-N 3.48Å; K413-M415 HydrophobicContact CB-CG 4.17Å; K413-M415 HydrophobicContact CB-SD 4.21Å; K413-M415 WeakPolarHBondContact O-CG 3.4Å; K413-M415 PolarHBondContact O-N 3.2Å
416	G	92.4	Very high	97.4	Very high	26 Å²	26	57.1 Å²	57.1	27%	0.268	29%	0.292	S	S	.	.			trans	-93	134.7	-176.9	0	0	0	0	0	112.9
417	D	95.2	Very high	97.5	Very high	38 Å²	38	54.4 Å²	54.4	20%	0.203	28%	0.282	C	S	.	.			trans	-81	165.1	168.6	73.8	5.8	0	0	0	111.5	L234 L419 F420 V421 R449	L234-D417 HydrophobicContact CD1-CB 4.1Å; D417-L419 VanDerWaalsContact C-N 3.27Å; D417-L419 PolarHBondContact O-N 3.09Å; D417-L419 PolarHBondContact OD1-N 3.19Å; D417-F420 PolarHBondContact O-N 3.04Å; D417-F420 VanDerWaalsContact O-N 3.14Å; D417-F420 WeakPolarHBondContact OD1-CB 3.41Å; D417-F420 PolarHBondContact OD1-N 3.25Å; D417-V421 WeakPolarHBondContact O-CG2 3.38Å; D417-V421 PolarHBondContact O-N 3.02Å; D417-R449 IonicContact OD2-NH1 3.49Å; D417-R449 PolarHBondContact OD2-NH1 2.98Å
418	E	97.1	Very high	97.5	Very high	169 Å²	169	52.2 Å²	52.2	79%	0.79	27%	0.267	S	S	*	.	H	α-helix	trans	-55.8	-41.5	-176.9	-172.1	-173	169.4	0	0	112.5	V421 D422	E418-V421 PolarHBondContact O-N 3.32Å; E418-D422 PolarHBondContact O-N 2.9Å
419	L	97.6	Very high	97.5	Very high	50 Å²	50	53.1 Å²	53.1	26%	0.262	27%	0.274	S	S	.	.	H	α-helix	trans	-68.4	-36.1	-179.8	-65.4	179.9	0	0	0	112.3	D417 F423 H444 K445 W446	D417-L419 VanDerWaalsContact C-N 3.27Å; D417-L419 PolarHBondContact O-N 3.09Å; D417-L419 PolarHBondContact OD1-N 3.19Å; L419-F423 WeakPolarHBondContact O-CB 3.35Å; L419-F423 PolarHBondContact O-N 3.48Å; L419-H444 PolarHBondContact O-CE1 3.01Å; L419-K445 HydrophobicContact CD1-CB 4.49Å; L419-K445 HydrophobicContact CD2-CB 4.07Å; L419-W446 HydrophobicContact CB-CB 3.93Å; L419-W446 HydrophobicContact CB-CG 4.43Å
420	F	98.4	Very high	97.5	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-68.9	-41.3	174.1	-178.7	-114.1	0	0	0	111.4	L234 V237 L324 L328 L412 D417 F423 L424 W446	L234-F420 HydrophobicContact CD2-CB 4.1Å; L234-F420 HydrophobicContact CD2-CD1 3.98Å; L234-F420 HydrophobicContact CD2-CD2 4.26Å; L234-F420 HydrophobicContact CD2-CE1 4.48Å; L234-F420 HydrophobicContact CD2-CG 3.84Å; V237-F420 HydrophobicContact CG1-CE2 4.07Å; V237-F420 HydrophobicContact CG1-CZ 4.29Å; L324-F420 HydrophobicContact CB-CE2 4.04Å; L324-F420 HydrophobicContact CB-CZ 4.05Å; L328-F420 HydrophobicContact CB-CE1 4.34Å; L328-F420 HydrophobicContact CB-CZ 4.42Å; L328-F420 HydrophobicContact CD2-CD1 3.72Å; L328-F420 HydrophobicContact CD2-CE1 3.3Å; L328-F420 HydrophobicContact CD2-CZ 4.12Å; L328-F420 HydrophobicContact CG-CE1 4.43Å; L412-F420 HydrophobicContact CD1-CD1 4.23Å; L412-F420 HydrophobicContact CD1-CE1 4.24Å; L412-F420 HydrophobicContact CD2-CE1 4.43Å; D417-F420 PolarHBondContact O-N 3.04Å; D417-F420 VanDerWaalsContact O-N 3.14Å; D417-F420 WeakPolarHBondContact OD1-CB 3.41Å; D417-F420 PolarHBondContact OD1-N 3.25Å; F420-F423 WeakPolarHBondContact O-CB 3.5Å; F420-F423 PolarHBondContact O-N 2.83Å; F420-L424 HydrophobicContact CD1-CD1 4Å; F420-L424 HydrophobicContact CD1-CG 4.29Å; F420-L424 HydrophobicContact CD2-CG 4.45Å; F420-L424 HydrophobicContact CE1-CD1 3.36Å; F420-L424 HydrophobicContact CE1-CD2 4.43Å; F420-L424 HydrophobicContact CE1-CG 3.86Å; F420-L424 HydrophobicContact CE2-CD1 4.43Å; F420-L424 HydrophobicContact CE2-CD2 4.1Å; F420-L424 HydrophobicContact CE2-CG 4.09Å; F420-L424 HydrophobicContact CZ-CD1 3.65Å; F420-L424 HydrophobicContact CZ-CD2 3.88Å; F420-L424 HydrophobicContact CZ-CG 3.79Å; F420-L424 WeakPolarHBondContact O-CG 3.3Å; F420-L424 PolarHBondContact O-N 2.9Å; F420-W446 HydrophobicContact CB-CG 4.46Å; F420-W446 AromaticContact CD2-CD2 3.95Å; F420-W446 HydrophobicContact CD2-CD2 3.95Å; F420-W446 AromaticContact CD2-CE2 3.37Å; F420-W446 HydrophobicContact CD2-CE3 4.3Å; F420-W446 AromaticContact CD2-CH2 3.67Å; F420-W446 HydrophobicContact CD2-CH2 3.67Å; F420-W446 AromaticContact CD2-CZ2 3.25Å; F420-W446 HydrophobicContact CD2-CZ2 3.25Å; F420-W446 HydrophobicContact CD2-CZ3 4.16Å; F420-W446 AromaticContact CD2-NE1 3.73Å; F420-W446 AromaticContact CE2-CH2 3.64Å; F420-W446 HydrophobicContact CE2-CH2 3.64Å; F420-W446 AromaticContact CE2-CZ2 3.59Å; F420-W446 HydrophobicContact CE2-CZ2 3.59Å; F420-W446 HydrophobicContact CE2-CZ3 4.3Å; F420-W446 HydrophobicContact CG-CZ2 4.31Å
421	V	98.6	Very high	97.5	Very high	25 Å²	25	47.7 Å²	47.7	15%	0.152	24%	0.235	C	C	.	.	H	α-helix	trans	-62.8	-42.9	175.7	175.2	0	0	0	0	110.9	W408 L412 D417 E418 L424 K425	W408-V421 HydrophobicContact CB-CG1 4.09Å; W408-V421 HydrophobicContact CD2-CG1 4.18Å; W408-V421 HydrophobicContact CE3-CG1 4.48Å; W408-V421 HydrophobicContact CG-CG1 4Å; L412-V421 HydrophobicContact CD1-CG2 3.75Å; D417-V421 WeakPolarHBondContact O-CG2 3.38Å; D417-V421 PolarHBondContact O-N 3.02Å; E418-V421 PolarHBondContact O-N 3.32Å; V421-L424 PolarHBondContact O-N 3.44Å; V421-K425 HydrophobicContact CG1-CD 4.16Å; V421-K425 HydrophobicContact CG1-CG 4.46Å; V421-K425 WeakPolarHBondContact O-CB 3.42Å; V421-K425 WeakPolarHBondContact O-CG 3.48Å; V421-K425 PolarHBondContact O-N 3.13Å
422	D	98.6	Very high	97.5	Very high	54 Å²	54	48.8 Å²	48.8	29%	0.289	24%	0.242	S	C	.	.	H	α-helix	trans	-59.5	-45.8	172.6	-179.3	45.4	0	0	0	111.3	E418 L424 K425 R426 H444	E418-D422 PolarHBondContact O-N 2.9Å; D422-L424 PolarHBondContact O-N 3.33Å; D422-K425 PolarHBondContact O-N 2.9Å; D422-R426 VanDerWaalsContact O-CG 3.3Å; D422-R426 WeakPolarHBondContact O-CG 3.47Å; D422-R426 PolarHBondContact O-N 3.34Å; D422-R426 IonicContact OD1-CZ 2.98Å; D422-R426 IonicContact OD1-NE 2.72Å; D422-R426 PolarHBondContact OD1-NE 2.91Å; D422-R426 IonicContact OD1-NH2 3.46Å; D422-R426 IonicContact OD2-CZ 2.7Å; D422-R426 IonicContact OD2-NE 3.32Å; D422-R426 PolarHBondContact OD2-NE 3.42Å; D422-R426 IonicContact OD2-NH2 3.52Å; D422-R426 PolarHBondContact OD2-NH2 3.2Å; D422-H444 IonicContact OD2-CE1 3.35Å; D422-H444 PolarHBondContact OD2-CE1 3.39Å; D422-H444 IonicContact OD2-NE2 2.96Å; D422-H444 PolarHBondContact OD2-NE2 3.18Å
423	F	98.8	Very high	97.3	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-58.2	-46.9	176.1	-172.7	-83.2	0	0	0	112	L245 L324 L419 F420 R426 C427 M436 A441 H444 W446 L447	L245-F423 HydrophobicContact CD1-CZ 4.15Å; L324-F423 HydrophobicContact CD1-CD1 4.13Å; L324-F423 HydrophobicContact CD1-CE1 3.58Å; L324-F423 HydrophobicContact CD1-CZ 4.49Å; L419-F423 WeakPolarHBondContact O-CB 3.35Å; L419-F423 PolarHBondContact O-N 3.48Å; F420-F423 WeakPolarHBondContact O-CB 3.5Å; F420-F423 PolarHBondContact O-N 2.83Å; F423-R426 PolarHBondContact O-N 3.01Å; F423-C427 VanDerWaalsContact CE1-SG 3.52Å; F423-C427 PolarHBondContact O-N 2.65Å; F423-C427 PolarHBondContact O-SG 3.35Å; F423-M436 HydrophobicContact CD1-CE 4.12Å; F423-M436 HydrophobicContact CD2-CE 3.62Å; F423-M436 HydrophobicContact CD2-SD 4.43Å; F423-M436 HydrophobicContact CE1-CE 4.01Å; F423-M436 HydrophobicContact CE2-CE 3.53Å; F423-M436 HydrophobicContact CE2-SD 4.37Å; F423-M436 HydrophobicContact CG-CE 3.93Å; F423-M436 HydrophobicContact CZ-CE 3.72Å; F423-A441 HydrophobicContact CE2-CB 3.74Å; F423-A441 HydrophobicContact CZ-CB 3.81Å; F423-H444 HydrophobicContact CD2-CB 3.8Å; F423-H444 AromaticContact CD2-CG 3.61Å; F423-H444 AromaticContact CD2-ND1 3.57Å; F423-H444 HydrophobicContact CE2-CB 4.05Å; F423-W446 HydrophobicContact CB-CB 4.31Å; F423-W446 HydrophobicContact CB-CD2 4.42Å; F423-W446 HydrophobicContact CB-CE3 4.04Å; F423-W446 AromaticContact CD1-CE3 3.87Å; F423-W446 HydrophobicContact CD1-CE3 3.87Å; F423-W446 AromaticContact CD1-CZ3 3.86Å; F423-W446 HydrophobicContact CD1-CZ3 3.86Å; F423-W446 AromaticContact CD2-CE3 3.6Å; F423-W446 HydrophobicContact CD2-CE3 3.6Å; F423-W446 HydrophobicContact CD2-CZ3 4.26Å; F423-W446 HydrophobicContact CE1-CE3 4.22Å; F423-W446 AromaticContact CE1-CZ3 3.93Å; F423-W446 HydrophobicContact CE1-CZ3 3.93Å; F423-W446 AromaticContact CE2-CE3 3.96Å; F423-W446 HydrophobicContact CE2-CE3 3.96Å; F423-W446 HydrophobicContact CE2-CZ3 4.29Å; F423-W446 HydrophobicContact CG-CD2 4.38Å; F423-W446 AromaticContact CG-CE3 3.55Å; F423-W446 HydrophobicContact CG-CE3 3.55Å; F423-W446 HydrophobicContact CG-CZ3 4.05Å; F423-W446 HydrophobicContact CZ-CE3 4.26Å; F423-W446 HydrophobicContact CZ-CZ3 4.14Å; F423-L447 HydrophobicContact CE2-CD1 4.12Å; F423-L447 HydrophobicContact CE2-CG 4.2Å
424	L	98.9	Very high	97.3	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-64.6	-43.9	178.5	-73.1	-171.4	0	0	0	112.4	G321 L324 A325 W408 L412 F420 V421 D422 R426 C427 L428	G321-L424 VanDerWaalsContact O-CD2 3.29Å; G321-L424 WeakPolarHBondContact O-CD2 3.43Å; L324-L424 HydrophobicContact CB-CD2 4.06Å; A325-L424 HydrophobicContact CB-CD1 3.99Å; W408-L424 HydrophobicContact CH2-CB 4.29Å; W408-L424 HydrophobicContact CZ3-CB 3.96Å; W408-L424 HydrophobicContact CZ3-CD1 4.15Å; L412-L424 HydrophobicContact CD1-CD1 3.99Å; L412-L424 HydrophobicContact CD2-CD1 3.86Å; F420-L424 HydrophobicContact CD1-CD1 4Å; F420-L424 HydrophobicContact CD1-CG 4.29Å; F420-L424 HydrophobicContact CD2-CG 4.45Å; F420-L424 HydrophobicContact CE1-CD1 3.36Å; F420-L424 HydrophobicContact CE1-CD2 4.43Å; F420-L424 HydrophobicContact CE1-CG 3.86Å; F420-L424 HydrophobicContact CE2-CD1 4.43Å; F420-L424 HydrophobicContact CE2-CD2 4.1Å; F420-L424 HydrophobicContact CE2-CG 4.09Å; F420-L424 HydrophobicContact CZ-CD1 3.65Å; F420-L424 HydrophobicContact CZ-CD2 3.88Å; F420-L424 HydrophobicContact CZ-CG 3.79Å; F420-L424 WeakPolarHBondContact O-CG 3.3Å; F420-L424 PolarHBondContact O-N 2.9Å; V421-L424 PolarHBondContact O-N 3.44Å; D422-L424 PolarHBondContact O-N 3.33Å; L424-R426 VanDerWaalsContact C-N 3.25Å; L424-R426 PolarHBondContact O-N 3.06Å; L424-C427 PolarHBondContact O-N 2.9Å; L424-C427 VanDerWaalsContact O-N 3.16Å; L424-L428 WeakPolarHBondContact O-CB 3.47Å; L424-L428 WeakPolarHBondContact O-CG 3.46Å; L424-L428 PolarHBondContact O-N 3.18Å
425	K	98.8	Very high	97.5	Very high	104 Å²	104	49.1 Å²	49.1	45%	0.452	25%	0.246	S	C	.	.	H	α-helix	trans	-57.7	-40.1	176.6	-78	175.6	174.1	-177.6	0	111.7	W408 V421 D422 L428 D429	W408-K425 VanDerWaalsContact CD1-CE 3.41Å; W408-K425 HydrophobicContact CD2-CG 4.44Å; W408-K425 HydrophobicContact CH2-CG 4.16Å; W408-K425 HydrophobicContact CZ2-CG 3.5Å; W408-K425 VanDerWaalsContact CZ2-CG 3.5Å; V421-K425 HydrophobicContact CG1-CD 4.16Å; V421-K425 HydrophobicContact CG1-CG 4.46Å; V421-K425 WeakPolarHBondContact O-CB 3.42Å; V421-K425 WeakPolarHBondContact O-CG 3.48Å; V421-K425 PolarHBondContact O-N 3.13Å; D422-K425 PolarHBondContact O-N 2.9Å; K425-L428 CarbonylContact O-C 3.55Å; K425-L428 PolarHBondContact O-N 3.43Å; K425-D429 PolarHBondContact O-N 3.34Å
426	R	98.8	Very high	97.6	Very high	124 Å²	124	46.2 Å²	46.2	47%	0.468	23%	0.232	S	C	.	.	H	α-helix	trans	-71.7	-31.5	177.2	-68.5	173.5	-173.4	-115.9	3.4	113.8	D422 F423 L424 R435 M436	D422-R426 VanDerWaalsContact O-CG 3.3Å; D422-R426 WeakPolarHBondContact O-CG 3.47Å; D422-R426 PolarHBondContact O-N 3.34Å; D422-R426 IonicContact OD1-CZ 2.98Å; D422-R426 IonicContact OD1-NE 2.72Å; D422-R426 PolarHBondContact OD1-NE 2.91Å; D422-R426 IonicContact OD1-NH2 3.46Å; D422-R426 IonicContact OD2-CZ 2.7Å; D422-R426 IonicContact OD2-NE 3.32Å; D422-R426 PolarHBondContact OD2-NE 3.42Å; D422-R426 IonicContact OD2-NH2 3.52Å; D422-R426 PolarHBondContact OD2-NH2 3.2Å; F423-R426 PolarHBondContact O-N 3.01Å; L424-R426 VanDerWaalsContact C-N 3.25Å; L424-R426 PolarHBondContact O-N 3.06Å; R426-R435 WeakPolarHBondContact O-CG 3.44Å; R426-M436 HydrophobicContact CB-CB 3.84Å; R426-M436 HydrophobicContact CB-CE 3.92Å; R426-M436 HydrophobicContact CB-SD 4.04Å; R426-M436 PolarHBondContact O-N 3.24Å
427	C	98.9	Very high	97.9	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-71.7	-31.9	170.4	-73.1	0	0	0	0	112.3	F423 L424 R435 M436	F423-C427 VanDerWaalsContact CE1-SG 3.52Å; F423-C427 PolarHBondContact O-N 2.65Å; F423-C427 PolarHBondContact O-SG 3.35Å; L424-C427 PolarHBondContact O-N 2.9Å; L424-C427 VanDerWaalsContact O-N 3.16Å; C427-R435 WeakPolarHBondContact O-CD 3.47Å; C427-R435 WeakPolarHBondContact O-CG 3.4Å; C427-M436 WeakPolarHBondContact SG-CE 3.44Å
428	L	98.8	Very high	98.1	Very high	4 Å²	4	45.3 Å²	45.3	2%	0.021	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.6	28.2	-174.4	-60.8	173	0	0	0	111.9	W318 L333 L350 W408 L424 K425	W318-L428 HydrophobicContact CD2-CD2 3.57Å; W318-L428 HydrophobicContact CE3-CB 4.3Å; W318-L428 HydrophobicContact CE3-CD2 3.75Å; W318-L428 HydrophobicContact CG-CD2 4.05Å; W318-L428 HydrophobicContact CH2-CB 4.41Å; W318-L428 HydrophobicContact CH2-CD2 4.17Å; W318-L428 HydrophobicContact CZ2-CD2 4.01Å; W318-L428 HydrophobicContact CZ3-CB 4.03Å; W318-L428 HydrophobicContact CZ3-CD2 4.05Å; W318-L428 WeakPolarHBondContact CZ3-O 3.35Å; L333-L428 HydrophobicContact CD2-CD1 3.64Å; L350-L428 HydrophobicContact CD1-CB 4.28Å; L350-L428 WeakPolarHBondContact CD1-O 3.28Å; W408-L428 HydrophobicContact CH2-CD1 3.82Å; W408-L428 HydrophobicContact CZ3-CD1 4.33Å; L424-L428 WeakPolarHBondContact O-CB 3.47Å; L424-L428 WeakPolarHBondContact O-CG 3.46Å; L424-L428 PolarHBondContact O-N 3.18Å; K425-L428 CarbonylContact O-C 3.55Å; K425-L428 PolarHBondContact O-N 3.43Å
429	D	98.4	Very high	98.2	Very high	54 Å²	54	38.9 Å²	38.9	29%	0.289	20%	0.199	S	C	.	.			trans	-65.9	138.8	172.3	-163.1	-18.7	0	0	0	110.1	K425 D431 T434 R435	K425-D429 PolarHBondContact O-N 3.34Å; D429-D431 PolarHBondContact OD1-N 3.06Å; D429-T434 VanDerWaalsContact CG-OG1 3.27Å; D429-T434 WeakPolarHBondContact OD2-CB 3.38Å; D429-T434 PolarHBondContact OD2-OG1 3.13Å; D429-R435 HydrophobicContact CB-CB 4.08Å; D429-R435 HydrophobicContact CB-CG 4.29Å; D429-R435 VanDerWaalsContact O-CZ 3.3Å; D429-R435 PolarHBondContact O-NE 2.89Å; D429-R435 PolarHBondContact O-NH2 2.86Å
430	W	97.8	Very high	98.2	Very high	19 Å²	19	41.6 Å²	41.6	7%	0.072	21%	0.21	C	C	.	.	S	Bend	trans	-64.4	-42.3	177.9	-82.2	107.6	0	0	0	111.9	P303 L307 L343 I346 I347 G351 P353 P354 P432	P303-W430 HydrophobicContact CB-CE3 3.61Å; P303-W430 HydrophobicContact CB-CH2 4.48Å; P303-W430 HydrophobicContact CB-CZ3 3.41Å; P303-W430 VanDerWaalsContact CB-CZ3 3.41Å; P303-W430 HydrophobicContact CG-CE3 3.81Å; P303-W430 HydrophobicContact CG-CZ3 4.11Å; L307-W430 HydrophobicContact CD1-CZ3 4.35Å; L343-W430 HydrophobicContact CD1-CH2 3.72Å; L343-W430 HydrophobicContact CD1-CZ3 3.87Å; I346-W430 HydrophobicContact CB-CH2 4.21Å; I346-W430 HydrophobicContact CB-CZ2 4.44Å; I346-W430 HydrophobicContact CG2-CH2 3.41Å; I346-W430 VanDerWaalsContact CG2-CH2 3.41Å; I346-W430 HydrophobicContact CG2-CZ2 3.43Å; I346-W430 VanDerWaalsContact CG2-CZ2 3.43Å; I346-W430 HydrophobicContact CG2-CZ3 4.03Å; I347-W430 HydrophobicContact CG1-CH2 3.84Å; I347-W430 HydrophobicContact CG1-CZ2 3.89Å; G351-W430 VanDerWaalsContact O-CZ2 3.26Å; G351-W430 WeakPolarHBondContact O-CZ2 3.29Å; G351-W430 PolarHBondContact O-NE1 3.43Å; P353-W430 HydrophobicContact CB-CD2 3.91Å; P353-W430 HydrophobicContact CB-CE3 3.69Å; P353-W430 HydrophobicContact CB-CH2 4.07Å; P353-W430 HydrophobicContact CB-CZ2 4.27Å; P353-W430 HydrophobicContact CB-CZ3 3.78Å; P353-W430 HydrophobicContact CG-CH2 4.24Å; P353-W430 HydrophobicContact CG-CZ3 4.3Å; P354-W430 VanDerWaalsContact CD-CB 3.49Å; P354-W430 HydrophobicContact CG-CB 4.16Å; W430-P432 WeakPolarHBondContact O-CD 3.3Å
431	D	96.5	Very high	98.2	Very high	22 Å²	22	41.6 Å²	41.6	12%	0.118	21%	0.21	C	C	.	.	S	Bend	trans	-83.9	113.8	179.9	-171.9	-13.4	0	0	0	109.3	K356 D429 E433 T434 R435	K356-D431 IonicContact NZ-OD2 2.74Å; K356-D431 PolarHBondContact NZ-OD2 2.91Å; D429-D431 PolarHBondContact OD1-N 3.06Å; D431-E433 PolarHBondContact O-N 3.37Å; D431-E433 VanDerWaalsContact O-N 3.17Å; D431-E433 WeakPolarHBondContact OD1-CB 3.46Å; D431-E433 PolarHBondContact OD1-N 2.86Å; D431-T434 WeakPolarHBondContact CB-OG1 3.5Å; D431-T434 PolarHBondContact O-N 3.2Å; D431-T434 VanDerWaalsContact O-N 3.17Å; D431-T434 PolarHBondContact O-OG1 3.34Å; D431-R435 PolarHBondContact O-N 3.05Å
432	P	97	Very high	98.1	Very high	30 Å²	30	42.2 Å²	42.2	20%	0.195	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-19.8	178.6	26.8	-35.2	0	0	0	113.2	P314 W430	P314-P432 HydrophobicContact CB-CB 3.8Å; P314-P432 HydrophobicContact CG-CB 4.11Å; P314-P432 VanDerWaalsContact CG-O 3.3Å; P314-P432 WeakPolarHBondContact CG-O 2.98Å; W430-P432 WeakPolarHBondContact O-CD 3.3Å
433	E	95.6	Very high	98.1	Very high	154 Å²	154	47.2 Å²	47.2	72%	0.72	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-31.3	176.8	-61.3	-177.2	157.1	0	0	112.5	K356 D431	K356-E433 IonicContact NZ-OE2 2.71Å; K356-E433 PolarHBondContact NZ-OE2 3.2Å; D431-E433 PolarHBondContact O-N 3.37Å; D431-E433 VanDerWaalsContact O-N 3.17Å; D431-E433 WeakPolarHBondContact OD1-CB 3.46Å; D431-E433 PolarHBondContact OD1-N 2.86Å
434	T	96.7	Very high	98	Very high	86 Å²	86	47.9 Å²	47.9	53%	0.528	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-16	178.2	58.7	0	0	0	0	112.9	D429 D431 M436	D429-T434 VanDerWaalsContact CG-OG1 3.27Å; D429-T434 WeakPolarHBondContact OD2-CB 3.38Å; D429-T434 PolarHBondContact OD2-OG1 3.13Å; D431-T434 WeakPolarHBondContact CB-OG1 3.5Å; D431-T434 PolarHBondContact O-N 3.2Å; D431-T434 VanDerWaalsContact O-N 3.17Å; D431-T434 PolarHBondContact O-OG1 3.34Å; T434-M436 PolarHBondContact O-N 3Å
435	R	98.5	Very high	97.9	Very high	4 Å²	4	55.4 Å²	55.4	2%	0.015	27%	0.267	C	S	.	.	S	Bend	trans	-55.4	135.1	175.8	-167.1	-180	-64.8	149.3	8.9	111.2	E304 P314 R426 C427 D429 D431 T437	E304-R435 IonicContact OE1-CZ 3.7Å; E304-R435 IonicContact OE1-NH1 2.74Å; E304-R435 PolarHBondContact OE1-NH1 3.34Å; E304-R435 IonicContact OE1-NH2 2.85Å; E304-R435 PolarHBondContact OE1-NH2 2.91Å; E304-R435 IonicContact OE2-CZ 3.32Å; E304-R435 IonicContact OE2-NH1 3.82Å; E304-R435 PolarHBondContact OE2-NH1 2.91Å; E304-R435 IonicContact OE2-NH2 3.69Å; E304-R435 PolarHBondContact OE2-NH2 3.34Å; P314-R435 WeakPolarHBondContact O-CD 3.31Å; P314-R435 PolarHBondContact O-NH1 3.42Å; R426-R435 WeakPolarHBondContact O-CG 3.44Å; C427-R435 WeakPolarHBondContact O-CD 3.47Å; C427-R435 WeakPolarHBondContact O-CG 3.4Å; D429-R435 HydrophobicContact CB-CB 4.08Å; D429-R435 HydrophobicContact CB-CG 4.29Å; D429-R435 VanDerWaalsContact O-CZ 3.3Å; D429-R435 PolarHBondContact O-NE 2.89Å; D429-R435 PolarHBondContact O-NH2 2.86Å; D431-R435 PolarHBondContact O-N 3.05Å; R435-T437 PolarHBondContact O-N 3.47Å
436	M	98.7	Very high	97.8	Very high	8 Å²	8	50.5 Å²	50.5	4%	0.039	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-59.8	128.9	-176.4	177.1	171.2	64.9	0	0	111.9	M317 F423 R426 C427 T434 Q440 A441	M317-M436 HydrophobicContact CE-CE 4.44Å; M317-M436 WeakPolarHBondContact CE-O 3.46Å; M317-M436 VanDerWaalsContact CG-O 3.28Å; M317-M436 WeakPolarHBondContact CG-O 3.34Å; F423-M436 HydrophobicContact CD1-CE 4.12Å; F423-M436 HydrophobicContact CD2-CE 3.62Å; F423-M436 HydrophobicContact CD2-SD 4.43Å; F423-M436 HydrophobicContact CE1-CE 4.01Å; F423-M436 HydrophobicContact CE2-CE 3.53Å; F423-M436 HydrophobicContact CE2-SD 4.37Å; F423-M436 HydrophobicContact CG-CE 3.93Å; F423-M436 HydrophobicContact CZ-CE 3.72Å; R426-M436 HydrophobicContact CB-CB 3.84Å; R426-M436 HydrophobicContact CB-CE 3.92Å; R426-M436 HydrophobicContact CB-SD 4.04Å; R426-M436 PolarHBondContact O-N 3.24Å; C427-M436 WeakPolarHBondContact SG-CE 3.44Å; T434-M436 PolarHBondContact O-N 3Å; M436-Q440 HydrophobicContact CG-CB 3.81Å; M436-A441 HydrophobicContact CE-CB 3.87Å; M436-A441 HydrophobicContact CG-CB 4Å; M436-A441 VanDerWaalsContact SD-CA 3.58Å; M436-A441 HydrophobicContact SD-CB 3.89Å
437	T	98.9	Very high	97.6	Very high	40 Å²	40	45.7 Å²	45.7	25%	0.245	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-79	161.8	174.5	62.3	0	0	0	0	111.6	R435 A439 Q440 A441	R435-T437 PolarHBondContact O-N 3.47Å; T437-A439 VanDerWaalsContact C-N 3.31Å; T437-A439 PolarHBondContact O-N 2.95Å; T437-Q440 PolarHBondContact O-N 3.33Å; T437-Q440 WeakPolarHBondContact OG1-CB 3.11Å; T437-Q440 VanDerWaalsContact OG1-CD 3.23Å; T437-Q440 VanDerWaalsContact OG1-CG 3.29Å; T437-Q440 WeakPolarHBondContact OG1-CG 3.23Å; T437-Q440 PolarHBondContact OG1-N 3.27Å; T437-Q440 PolarHBondContact OG1-OE1 3.18Å; T437-A441 WeakPolarHBondContact O-CB 3.41Å; T437-A441 PolarHBondContact O-N 2.99Å
438	P	98.7	Very high	97	Very high	4 Å²	4	54.5 Å²	54.5	3%	0.026	26%	0.263	C	S	.	.	H	α-helix	trans	-56.7	-41.8	175.5	-24	34.9	0	0	0	113.2	L245 L248 D249 Q252 M317 Q440 A441 L442	L245-P438 HydrophobicContact CD2-CB 3.99Å; L248-P438 HydrophobicContact CB-CB 4.05Å; L248-P438 HydrophobicContact CB-CG 3.71Å; D249-P438 HydrophobicContact CB-CB 3.99Å; Q252-P438 HydrophobicContact CB-CG 4.45Å; M317-P438 HydrophobicContact CG-CG 4.22Å; M317-P438 HydrophobicContact SD-CB 4.3Å; M317-P438 HydrophobicContact SD-CG 3.72Å; P438-Q440 PolarHBondContact O-N 3.14Å; P438-A441 WeakPolarHBondContact O-CB 3.14Å; P438-A441 PolarHBondContact O-N 2.95Å; P438-L442 WeakPolarHBondContact O-CG 3.36Å; P438-L442 PolarHBondContact O-N 3.14Å
439	A	98.2	Very high	95.8	Very high	34 Å²	34	61.5 Å²	61.5	28%	0.281	29%	0.289	S	S	.	.	H	α-helix	trans	-63.4	-38.3	178.2	0	0	0	0	0	112.8	T437 K443	T437-A439 VanDerWaalsContact C-N 3.31Å; T437-A439 PolarHBondContact O-N 2.95Å; A439-K443 WeakPolarHBondContact O-CG 3.43Å
440	Q	98.4	Very high	93.8	Very high	107 Å²	107	69 Å²	69	50%	0.5	31%	0.313	S	S	.	.	H	α-helix	trans	-70.2	-41.9	173.2	-72.6	163	-28.4	0	0	111	M436 T437 P438 L442 K443 H444	M436-Q440 HydrophobicContact CG-CB 3.81Å; T437-Q440 PolarHBondContact O-N 3.33Å; T437-Q440 WeakPolarHBondContact OG1-CB 3.11Å; T437-Q440 VanDerWaalsContact OG1-CD 3.23Å; T437-Q440 VanDerWaalsContact OG1-CG 3.29Å; T437-Q440 WeakPolarHBondContact OG1-CG 3.23Å; T437-Q440 PolarHBondContact OG1-N 3.27Å; T437-Q440 PolarHBondContact OG1-OE1 3.18Å; P438-Q440 PolarHBondContact O-N 3.14Å; Q440-L442 PolarHBondContact O-N 2.79Å; Q440-K443 CarbonylContact O-C 3.58Å; Q440-K443 PolarHBondContact O-N 2.82Å; Q440-H444 PolarHBondContact O-N 3.36Å; Q440-H444 VanDerWaalsContact O-N 3.13Å
441	A	98.5	Very high	91.7	Very high	0 Å²	0	72.5 Å²	72.5	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-59.5	-45.5	178.2	0	0	0	0	0	112	L245 M317 F423 M436 T437 P438 K443 H444 L447	L245-A441 HydrophobicContact CD1-CB 3.82Å; L245-A441 HydrophobicContact CD2-CB 3.58Å; L245-A441 HydrophobicContact CG-CB 4.38Å; M317-A441 HydrophobicContact CE-CB 3.78Å; F423-A441 HydrophobicContact CE2-CB 3.74Å; F423-A441 HydrophobicContact CZ-CB 3.81Å; M436-A441 HydrophobicContact CE-CB 3.87Å; M436-A441 HydrophobicContact CG-CB 4Å; M436-A441 VanDerWaalsContact SD-CA 3.58Å; M436-A441 HydrophobicContact SD-CB 3.89Å; T437-A441 WeakPolarHBondContact O-CB 3.41Å; T437-A441 PolarHBondContact O-N 2.99Å; P438-A441 WeakPolarHBondContact O-CB 3.14Å; P438-A441 PolarHBondContact O-N 2.95Å; A441-K443 PolarHBondContact O-N 2.98Å; A441-K443 VanDerWaalsContact O-N 3.14Å; A441-H444 WeakPolarHBondContact O-CB 3.26Å; A441-H444 PolarHBondContact O-N 3.4Å; A441-L447 VanDerWaalsContact O-CD1 3.23Å; A441-L447 WeakPolarHBondContact O-CD1 3.44Å
442	L	97.6	Very high	89.2	Confident	39 Å²	39	76.9 Å²	76.9	20%	0.204	36%	0.362	C	S	.	.	H	α-helix	trans	-57.6	-26.4	174.8	-75.1	168.8	0	0	0	113.2	Y242 L245 L246 D249 P438 Q440	Y242-L442 HydrophobicContact CD2-CD2 3.73Å; Y242-L442 HydrophobicContact CE2-CD2 3.73Å; L245-L442 HydrophobicContact CB-CD2 3.73Å; L245-L442 HydrophobicContact CB-CG 3.97Å; L245-L442 HydrophobicContact CD1-CD2 4.25Å; L245-L442 HydrophobicContact CD1-CG 4.42Å; L246-L442 HydrophobicContact CD2-CD2 4.43Å; D249-L442 HydrophobicContact CB-CD1 4.13Å; P438-L442 WeakPolarHBondContact O-CG 3.36Å; P438-L442 PolarHBondContact O-N 3.14Å; Q440-L442 PolarHBondContact O-N 2.79Å
443	K	97	Very high	86.5	Confident	158 Å²	158	80.8 Å²	80.8	69%	0.687	38%	0.381	S	S	*	.	H	α-helix	trans	-93.8	-5.3	177.6	-64.8	174.3	-176.1	177.6	0	113.3	A439 Q440 A441 R448	A439-K443 WeakPolarHBondContact O-CG 3.43Å; Q440-K443 CarbonylContact O-C 3.58Å; Q440-K443 PolarHBondContact O-N 2.82Å; A441-K443 PolarHBondContact O-N 2.98Å; A441-K443 VanDerWaalsContact O-N 3.14Å; K443-R448 VanDerWaalsContact O-CD 3.22Å; K443-R448 WeakPolarHBondContact O-CD 3.22Å
444	H	98.1	Very high	83.9	Confident	15 Å²	15	78.5 Å²	78.5	7%	0.069	38%	0.38	C	S	.	.	S	Bend	trans	-64.2	144.1	-176.5	-165.9	-92.3	0	0	0	112.4	L419 D422 F423 Q440 A441 W446 L447 R448	L419-H444 PolarHBondContact O-CE1 3.01Å; D422-H444 IonicContact OD2-CE1 3.35Å; D422-H444 PolarHBondContact OD2-CE1 3.39Å; D422-H444 IonicContact OD2-NE2 2.96Å; D422-H444 PolarHBondContact OD2-NE2 3.18Å; F423-H444 HydrophobicContact CD2-CB 3.8Å; F423-H444 AromaticContact CD2-CG 3.61Å; F423-H444 AromaticContact CD2-ND1 3.57Å; F423-H444 HydrophobicContact CE2-CB 4.05Å; Q440-H444 PolarHBondContact O-N 3.36Å; Q440-H444 VanDerWaalsContact O-N 3.13Å; A441-H444 WeakPolarHBondContact O-CB 3.26Å; A441-H444 PolarHBondContact O-N 3.4Å; H444-W446 WeakPolarHBondContact ND1-CB 3.41Å; H444-W446 PolarHBondContact ND1-N 3.19Å; H444-W446 VanDerWaalsContact ND1-N 3.19Å; H444-W446 PolarHBondContact O-N 3.35Å; H444-L447 PolarHBondContact O-N 3.48Å; H444-R448 PolarHBondContact O-N 3.47Å
445	K	96.4	Very high	81.4	Confident	158 Å²	158	80 Å²	80	69%	0.687	39%	0.392	S	S	*	.	H	α-helix	trans	-55.5	-37.8	-177.6	-68.9	-177.5	-179.5	178.3	0	112.8	L419 L447 R448 R449	L419-K445 HydrophobicContact CD1-CB 4.49Å; L419-K445 HydrophobicContact CD2-CB 4.07Å; K445-L447 VanDerWaalsContact C-N 3.32Å; K445-L447 PolarHBondContact O-N 3.18Å; K445-R448 PolarHBondContact O-N 3.3Å; K445-R449 PolarHBondContact O-N 3.02Å
446	W	97.1	Very high	79	Confident	0 Å²	0	90.9 Å²	90.9	0%	0	43%	0.433	C	S	.	.	H	α-helix	trans	-58.2	-39.3	176.5	179.3	66.9	0	0	0	113.5	V237 R238 A241 L324 L419 F420 F423 H444	V237-W446 HydrophobicContact CG1-CH2 4.18Å; V237-W446 HydrophobicContact CG1-CZ2 4.28Å; R238-W446 HydrophobicContact CB-CH2 4.34Å; R238-W446 HydrophobicContact CB-CZ2 3.93Å; R238-W446 WeakPolarHBondContact CD-O 3.35Å; R238-W446 HydrophobicContact CG-CZ2 4.42Å; R238-W446 PolarHBondContact NE-O 2.81Å; A241-W446 HydrophobicContact CB-CH2 3.65Å; A241-W446 HydrophobicContact CB-CZ3 3.6Å; L324-W446 HydrophobicContact CD1-CH2 4.14Å; L324-W446 HydrophobicContact CD1-CZ3 4.04Å; L419-W446 HydrophobicContact CB-CB 3.93Å; L419-W446 HydrophobicContact CB-CG 4.43Å; F420-W446 HydrophobicContact CB-CG 4.46Å; F420-W446 AromaticContact CD2-CD2 3.95Å; F420-W446 HydrophobicContact CD2-CD2 3.95Å; F420-W446 AromaticContact CD2-CE2 3.37Å; F420-W446 HydrophobicContact CD2-CE3 4.3Å; F420-W446 AromaticContact CD2-CH2 3.67Å; F420-W446 HydrophobicContact CD2-CH2 3.67Å; F420-W446 AromaticContact CD2-CZ2 3.25Å; F420-W446 HydrophobicContact CD2-CZ2 3.25Å; F420-W446 HydrophobicContact CD2-CZ3 4.16Å; F420-W446 AromaticContact CD2-NE1 3.73Å; F420-W446 AromaticContact CE2-CH2 3.64Å; F420-W446 HydrophobicContact CE2-CH2 3.64Å; F420-W446 AromaticContact CE2-CZ2 3.59Å; F420-W446 HydrophobicContact CE2-CZ2 3.59Å; F420-W446 HydrophobicContact CE2-CZ3 4.3Å; F420-W446 HydrophobicContact CG-CZ2 4.31Å; F423-W446 HydrophobicContact CB-CB 4.31Å; F423-W446 HydrophobicContact CB-CD2 4.42Å; F423-W446 HydrophobicContact CB-CE3 4.04Å; F423-W446 AromaticContact CD1-CE3 3.87Å; F423-W446 HydrophobicContact CD1-CE3 3.87Å; F423-W446 AromaticContact CD1-CZ3 3.86Å; F423-W446 HydrophobicContact CD1-CZ3 3.86Å; F423-W446 AromaticContact CD2-CE3 3.6Å; F423-W446 HydrophobicContact CD2-CE3 3.6Å; F423-W446 HydrophobicContact CD2-CZ3 4.26Å; F423-W446 HydrophobicContact CE1-CE3 4.22Å; F423-W446 AromaticContact CE1-CZ3 3.93Å; F423-W446 HydrophobicContact CE1-CZ3 3.93Å; F423-W446 AromaticContact CE2-CE3 3.96Å; F423-W446 HydrophobicContact CE2-CE3 3.96Å; F423-W446 HydrophobicContact CE2-CZ3 4.29Å; F423-W446 HydrophobicContact CG-CD2 4.38Å; F423-W446 AromaticContact CG-CE3 3.55Å; F423-W446 HydrophobicContact CG-CE3 3.55Å; F423-W446 HydrophobicContact CG-CZ3 4.05Å; F423-W446 HydrophobicContact CZ-CE3 4.26Å; F423-W446 HydrophobicContact CZ-CZ3 4.14Å; H444-W446 WeakPolarHBondContact ND1-CB 3.41Å; H444-W446 PolarHBondContact ND1-N 3.19Å; H444-W446 VanDerWaalsContact ND1-N 3.19Å; H444-W446 PolarHBondContact O-N 3.35Å
447	L	94	Very high	76.6	Confident	23 Å²	23	97.8 Å²	97.8	12%	0.12	47%	0.469	C	S	.	.	H	α-helix	trans	-82.8	-34	177.6	-69.2	-173.7	0	0	0	112.7	R238 A241 L245 F423 A441 H444 K445 R449	R238-L447 HydrophobicContact CG-CD2 3.66Å; A241-L447 HydrophobicContact CB-CD2 4.05Å; L245-L447 HydrophobicContact CD1-CD1 3.26Å; F423-L447 HydrophobicContact CE2-CD1 4.12Å; F423-L447 HydrophobicContact CE2-CG 4.2Å; A441-L447 VanDerWaalsContact O-CD1 3.23Å; A441-L447 WeakPolarHBondContact O-CD1 3.44Å; H444-L447 PolarHBondContact O-N 3.48Å; K445-L447 VanDerWaalsContact C-N 3.32Å; K445-L447 PolarHBondContact O-N 3.18Å; L447-R449 VanDerWaalsContact C-N 3.27Å; L447-R449 PolarHBondContact O-N 3.37Å
448	R	86.4	Confident	74.1	Confident	186 Å²	186	99.4 Å²	99.4	70%	0.702	49%	0.494	S	S	*	.	H	α-helix	trans	-73.7	-12.2	-179.3	-68.2	-169.6	75.2	-176.5	4.4	114.4	K443 H444 K445 R450	K443-R448 VanDerWaalsContact O-CD 3.22Å; K443-R448 WeakPolarHBondContact O-CD 3.22Å; H444-R448 PolarHBondContact O-N 3.47Å; K445-R448 PolarHBondContact O-N 3.3Å; R448-R450 PolarHBondContact O-N 3.24Å
449	R	74.3	Confident	71.6	Confident	150 Å²	150	107.5 Å²	107.5	57%	0.566	54%	0.536	S	S	*	.	S	Bend	trans	-58.5	106.8	175.7	-162	172.5	-175.2	174.2	2.6	108.2	D417 K445 L447 L451	D417-R449 IonicContact OD2-NH1 3.49Å; D417-R449 PolarHBondContact OD2-NH1 2.98Å; K445-R449 PolarHBondContact O-N 3.02Å; L447-R449 VanDerWaalsContact C-N 3.27Å; L447-R449 PolarHBondContact O-N 3.37Å; R449-L451 PolarHBondContact O-N 3.49Å
450	R	56.6	Low	69	Low	213 Å²	213	114.9 Å²	114.9	80%	0.804	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-49.8	130.2	-174.4	-71.6	-175.8	176.8	179.3	-0.9	109.5	R448	R448-R450 PolarHBondContact O-N 3.24Å
451	L	53.4	Low	66.2	Low	91 Å²	91	115.1 Å²	115.1	48%	0.476	58%	0.578	S	S	.	*	P	Polyproline II helix	trans	-56.1	135.2	157.1	-69.3	165.2	0	0	0	106.3	M235 R449 N453	M235-L451 HydrophobicContact CG-CD2 3.98Å; M235-L451 HydrophobicContact SD-CD2 4.06Å; R449-L451 PolarHBondContact O-N 3.49Å; L451-N453 PolarHBondContact O-N 2.94Å
452	P	43.8	Very low	63.5	Low	114 Å²	114	124.8 Å²	124.8	74%	0.74	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-53.2	131.8	179.4	14.6	-24.3	0	0	0	109.6
453	N	40.7	Very low	60.7	Low	112 Å²	112	126.7 Å²	126.7	60%	0.599	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-60.8	142.7	171.5	-75	-19.7	0	0	0	107.9	L451	L451-N453 PolarHBondContact O-N 2.94Å
454	P	39.1	Very low	57.6	Low	107 Å²	107	123 Å²	123	70%	0.695	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-55	145.5	163.8	24.6	-30.7	0	0	0	108.9	R456	P454-R456 PolarHBondContact O-N 3.26Å
455	P	44.4	Very low	54.8	Low	118 Å²	118	130.6 Å²	130.6	77%	0.766	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-53.5	127.4	176.9	21.6	-30.4	0	0	0	108.3	D457	P455-D457 PolarHBondContact O-N 3.17Å
456	R	49.3	Very low	52	Low	232 Å²	232	127.2 Å²	127.2	88%	0.875	70%	0.704	S	S	*	*			trans	-70.2	115.2	168.7	-74.6	-177.2	167.8	-171.9	-5.8	105.6	P454 G458	P454-R456 PolarHBondContact O-N 3.26Å; R456-G458 PolarHBondContact O-N 3.01Å
457	D	48.7	Very low	49.4	Very low	152 Å²	152	134.9 Å²	134.9	81%	0.813	75%	0.745	S	S	*	*			trans	-52.8	123.5	167.6	-71.7	-37.8	0	0	0	107.9	P455 L459	P455-D457 PolarHBondContact O-N 3.17Å; D457-L459 PolarHBondContact O-N 3.18Å
458	G	45.8	Very low	47	Very low	74 Å²	74	142.8 Å²	142.8	76%	0.763	78%	0.781	S	S	*	*			trans	-64.2	103.7	-178.9	0	0	0	0	0	110.2	R456	R456-G458 PolarHBondContact O-N 3.01Å
459	L	45.9	Very low	44.8	Very low	174 Å²	174	146.7 Å²	146.7	91%	0.911	81%	0.807	S	S	*	*			trans	-97	81.2	143.1	-88.8	94.3	0	0	0	106.8	D457	D457-L459 PolarHBondContact O-N 3.18Å
460	E	43	Very low	43.3	Very low	189 Å²	189	146.6 Å²	146.6	88%	0.883	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-77.8	133.5	154.6	-79.8	-174.1	164.5	0	0	108.4
461	S	40.8	Very low	42.6	Very low	112 Å²	112	143.1 Å²	143.1	78%	0.783	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-59.9	122.3	-172.2	51.9	0	0	0	0	113.5
462	M	41.8	Very low	42	Very low	204 Å²	204	145.9 Å²	145.9	100%	1.005	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-77.8	116.4	143.4	-80.7	-140.3	-145.8	0	0	108.3
463	G	37.8	Very low	41.9	Very low	78 Å²	78	147.8 Å²	147.8	80%	0.804	85%	0.845	S	S	*	*			trans	160.7	87.7	170.6	0	0	0	0	0	112.6
464	G	33.1	Very low	42	Very low	82 Å²	82	150.1 Å²	150.1	85%	0.845	86%	0.86	S	S	*	*			trans	174.2	70.6	173.4	0	0	0	0	0	112.7
465	L	38.9	Very low	42.2	Very low	173 Å²	173	152.9 Å²	152.9	91%	0.906	87%	0.871	S	S	*	*			trans	-120.5	143.8	160.7	-91.2	162.9	0	0	0	107.3
466	A	37.1	Very low	42	Very low	87 Å²	87	155.4 Å²	155.4	72%	0.719	88%	0.879	S	S	*	*			trans	79	127.9	178.9	0	0	0	0	0	114.4
467	D	42	Very low	41.5	Very low	161 Å²	161	149.5 Å²	149.5	86%	0.861	88%	0.879	S	S	*	*			cis	-146.8	155.7	23.9	-85.6	-48.7	0	0	0	113
468	H	45	Very low	40.9	Very low	189 Å²	189	149.3 Å²	149.3	88%	0.875	88%	0.884	S	S	*	*			trans	-81.2	135.1	168.4	-87.1	-83.6	0	0	0	111.2
469	E	39.2	Very low	40.4	Very low	269 Å²	269	156.2 Å²	156.2	100%	1.257	90%	0.895	S	S	*	*				-154	0	127.1	-109.2	-176.9	177.1	0	0	110

Retrieved 469 of 469 residues in 448.5 ms (Link to these results)

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