A0A3Q0KRX8_SCHMA Loading...

Putative transient receptor potential channel

AlphaFold DB , UniProt , Accession A0A3Q0KRX8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,150 aa.

						>A0A3Q0KRX8_SCHMA|A0A3Q0KRX8
MMVENEGIVKKSPYKMNVPVNYDGAVVGLARRSTLFPFTTPLPGISTAAVQLEHLIGKNKKWTTAGWKLSCESGLVFRTHLQDKEYVYLNAAEFGELEVVRDLLDDIKLDVNCVDYMGRNALLLAMKNENLDLVELLVNRLDFYAVEDALLNAISQQKNHLVKLIVDHPQYIRMEKQCKSKVSGPSSGTNNRSKRSQFSSDISPLMLAAHINNHEIIQLLLDRGLKLEMPHDRACSCLECETIRAEDSLILEQQRLHTYQALSSSAYLALTTSDPVSTAFILRNELYQLASQEKQFKEEYSELAVKCMDFAISCVDLCRTSDELHCLLGGTINSKPHDRGNPLNTIKNAIQSHEKKFVAHPNCQHQMENLFYSLMFCIRDFEGLQRLQFVIIFLSLLPFLYIIYLFFPHFKMPLPQSLIYRDRSVTKYEVTEILRCPVTKFLGHMVSYITFLILITVATFRLDRTAVSDGEDNWEVRYTEILSYDFRTSHVVMTKIQIILLFWILGQLCMECKQVYHYGLRYFFRSYYNFMDWVSIALYLASYSLRIIVDFKVQASMRQYQDVLKVAQSILLNTTCSTSKFCSGTEETTHQNYVNYRNKILIPESAYWLRGCRLWWAPDDPEYISDCLFALGNVLSFSRISYLMPAWELLGPLQISLARMVSDIIRFMALFTVMVIAFVVGLTNLYWYFANIIVSVDAQGQLIRYASGIPSFKSTGATFHTLYWALFGQSSTNVTTIDENLASMYPGHEYLAVDSSPYIVNSLGSILYAIYNACMIIILLNMLIAMMSKSFDEIQGDRLEEWKFARASLWLVYIDQEGVLPVPLNLLPSREAISSLLSRFYNIIQWKKPQIYTKHHCDLQKNDNALIFSQTTPTKYHTVNSQLNQNIRKTHTTTTVSTLLDTNSIHSNEWTSDGSDIDGQNSSCRCDFNNIQVFKLHTDTIRADVMRRYLFKLQKQKEEELKSAEFSVMNIHRQQIQKMMDHEVKRKQELNQDKLSRKESKTQGDEEIDETPPKSATEIGDENRLRGLRSLLMPPSVRKKLEAVASVNHPGNESEKREAAEAAARFYLLQTTRKAYDTNKLSGESFKSRQSYSNQPKDETFTARTERPIKGVHLRELYGVEQEMHDMSEALSSYSLSEATISELNELETY
					

Structure Viewer

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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	28.1	Very low	31.3	Very low	241 Å²	241	160.7 Å²	160.7	100%	1.187	83%	0.834	S	S	*	*				0	125.6	0	-78.5	-161.4	-79.1	0	0	107.8
2	M	32.3	Very low	31	Very low	180 Å²	180	157 Å²	157	89%	0.887	83%	0.832	S	S	*	*			trans	130.2	74.6	177.9	-72	-141.5	177.5	0	0	108.5
3	V	33.4	Very low	31.1	Very low	132 Å²	132	152.6 Å²	152.6	80%	0.8	82%	0.818	S	S	*	*			trans	-99.4	97.3	164.7	176	0	0	0	0	104.5	N5	V3-N5 PolarHBondContact O-N 3.18Å
4	E	33	Very low	31.1	Very low	170 Å²	170	157.6 Å²	157.6	79%	0.794	82%	0.822	S	S	*	*			trans	-73.6	117.3	173.1	-79.1	-178.7	151.2	0	0	109.1	E6	E4-E6 PolarHBondContact O-N 3.23Å
5	N	31.6	Very low	30.9	Very low	157 Å²	157	160.4 Å²	160.4	84%	0.84	83%	0.825	S	S	*	*			trans	-73.3	90.7	173.6	-79.9	-33.1	0	0	0	109.9	V3	V3-N5 PolarHBondContact O-N 3.18Å
6	E	33.9	Very low	30.8	Very low	175 Å²	175	161.8 Å²	161.8	82%	0.818	83%	0.83	S	S	*	*			trans	-93.6	93.9	159.5	-72.9	-153.6	157	0	0	110.1	E4 I8	E4-E6 PolarHBondContact O-N 3.23Å; E6-I8 PolarHBondContact O-N 3.24Å; E6-I8 VanDerWaalsContact O-N 3.09Å
7	G	31.6	Very low	30.7	Very low	73 Å²	73	161 Å²	161	75%	0.753	83%	0.828	S	S	*	*			trans	-68.9	96.1	171.5	0	0	0	0	0	111.2	V9	G7-V9 PolarHBondContact O-N 3.39Å; G7-V9 VanDerWaalsContact O-N 3.16Å
8	I	28.9	Very low	30.6	Very low	137 Å²	137	158.8 Å²	158.8	70%	0.703	82%	0.823	S	S	*	*			trans	-78.7	98.2	167.7	-61.8	176.5	0	0	0	108.5	E6 K10	E6-I8 PolarHBondContact O-N 3.24Å; E6-I8 VanDerWaalsContact O-N 3.09Å; I8-K10 HydrophobicContact CG2-CG 4.25Å; I8-K10 PolarHBondContact O-N 2.91Å
9	V	30.3	Very low	30.6	Very low	122 Å²	122	156.8 Å²	156.8	74%	0.739	82%	0.82	S	S	*	*			trans	-65.1	89.3	170	179.8	0	0	0	0	109.2	G7 K11	G7-V9 PolarHBondContact O-N 3.39Å; G7-V9 VanDerWaalsContact O-N 3.16Å; V9-K11 HydrophobicContact CG1-CG 4.33Å; V9-K11 PolarHBondContact O-N 3.38Å; V9-K11 VanDerWaalsContact O-N 3.16Å
10	K	30.6	Very low	30.5	Very low	190 Å²	190	154.6 Å²	154.6	83%	0.826	81%	0.814	S	S	*	*			trans	-77.4	94.6	165.8	-77.2	-174	178.8	177.5	0	109.1	I8 S12	I8-K10 HydrophobicContact CG2-CG 4.25Å; I8-K10 PolarHBondContact O-N 2.91Å; K10-S12 PolarHBondContact O-N 3.47Å; K10-S12 VanDerWaalsContact O-N 3.14Å
11	K	31	Very low	30.4	Very low	191 Å²	191	154.4 Å²	154.4	83%	0.83	81%	0.813	S	S	*	*			trans	-61.8	107.3	162.4	-76.4	179.9	175.7	177.6	0	108.5	V9 P13	V9-K11 HydrophobicContact CG1-CG 4.33Å; V9-K11 PolarHBondContact O-N 3.38Å; V9-K11 VanDerWaalsContact O-N 3.16Å; K11-P13 WeakPolarHBondContact O-CD 3.48Å
12	S	27.9	Very low	30.3	Very low	116 Å²	116	152.3 Å²	152.3	81%	0.811	79%	0.794	S	S	*	*			trans	-85.6	116.6	167	54.8	0	0	0	0	109.8	K10	K10-S12 PolarHBondContact O-N 3.47Å; K10-S12 VanDerWaalsContact O-N 3.14Å
13	P	32.2	Very low	30.3	Very low	100 Å²	100	151 Å²	151	65%	0.649	79%	0.79	S	S	*	*			trans	-98.3	143.9	168.8	37.3	-28.4	0	0	0	110.7	K11	K11-P13 WeakPolarHBondContact O-CD 3.48Å
14	Y	31	Very low	30	Very low	223 Å²	223	148.7 Å²	148.7	88%	0.875	79%	0.793	S	S	*	*			trans	79.3	80.8	169.3	-54.2	-71	0	0	0	118.1	M16	Y14-M16 PolarHBondContact O-N 2.98Å
15	K	27.8	Very low	29.8	Very low	199 Å²	199	145.1 Å²	145.1	87%	0.865	79%	0.793	S	S	*	*			trans	-59.7	118.1	144.9	-75.2	176.7	173.2	179	0	108.9
16	M	29.3	Very low	29.6	Very low	182 Å²	182	144.5 Å²	144.5	90%	0.897	79%	0.794	S	S	*	*			trans	-110.5	105.7	157.8	-143.4	169.2	-175.4	0	0	106.6	Y14 V18	Y14-M16 PolarHBondContact O-N 2.98Å; M16-V18 PolarHBondContact O-N 3.47Å
17	N	29	Very low	29.2	Very low	149 Å²	149	142.7 Å²	142.7	80%	0.797	80%	0.795	S	S	*	*			trans	-66.7	109.9	177.8	-73.7	-27.4	0	0	0	108.8
18	V	30	Very low	29	Very low	122 Å²	122	142.4 Å²	142.4	74%	0.739	79%	0.792	S	S	*	*			trans	-108.9	121.2	159.3	-177.3	0	0	0	0	106.7	M16 V20	M16-V18 PolarHBondContact O-N 3.47Å; V18-V20 PolarHBondContact O-N 2.9Å
19	P	29.8	Very low	28.7	Very low	120 Å²	120	144.1 Å²	144.1	78%	0.779	80%	0.802	S	S	*	*			trans	-70.7	120.3	-174.1	27.5	-31	0	0	0	110	N21	P19-N21 PolarHBondContact O-N 3.16Å
20	V	28	Very low	28.5	Very low	113 Å²	113	143 Å²	143	69%	0.685	81%	0.805	S	S	*	*			trans	-83.4	102.2	169.9	179.5	0	0	0	0	106.8	V18 Y22	V18-V20 PolarHBondContact O-N 2.9Å; V20-Y22 HydrophobicContact CG1-CD2 3.75Å; V20-Y22 HydrophobicContact CG1-CE2 3.58Å
21	N	28.9	Very low	28.2	Very low	151 Å²	151	145.6 Å²	145.6	81%	0.807	81%	0.81	S	S	*	*			trans	-91.3	106.6	168.2	-136.5	19.1	0	0	0	107.9	P19 D23	P19-N21 PolarHBondContact O-N 3.16Å; N21-D23 PolarHBondContact O-N 3.36Å
22	Y	26.7	Very low	27.9	Very low	197 Å²	197	147.8 Å²	147.8	77%	0.773	81%	0.813	S	S	*	*			trans	-72.6	113.4	168.9	-80.9	-94.8	0	0	0	108.2	V20	V20-Y22 HydrophobicContact CG1-CD2 3.75Å; V20-Y22 HydrophobicContact CG1-CE2 3.58Å
23	D	31.6	Very low	27.6	Very low	151 Å²	151	147.8 Å²	147.8	81%	0.807	81%	0.813	S	S	*	*			trans	-138.6	97.6	150.7	-87.9	-39.4	0	0	0	107.7	N21 A25	N21-D23 PolarHBondContact O-N 3.36Å; D23-A25 PolarHBondContact O-N 3.05Å
24	G	26.4	Very low	27.4	Very low	84 Å²	84	149.1 Å²	149.1	87%	0.866	82%	0.82	S	S	*	*			trans	-75.7	115.1	166.7	0	0	0	0	0	109
25	A	29.8	Very low	27.1	Very low	95 Å²	95	146.1 Å²	146.1	79%	0.785	82%	0.818	S	S	*	*			trans	-126.9	122.6	163.1	0	0	0	0	0	109	D23	D23-A25 PolarHBondContact O-N 3.05Å
26	V	27.6	Very low	26.9	Very low	145 Å²	145	146 Å²	146	88%	0.879	82%	0.818	S	S	*	*			trans	-62.6	133.8	-167	170.9	0	0	0	0	112.2	G28	V26-G28 PolarHBondContact O-N 3.11Å; V26-G28 VanDerWaalsContact O-N 3.16Å
27	V	24.4	Very low	26.8	Very low	137 Å²	137	142.3 Å²	142.3	83%	0.83	81%	0.807	S	S	*	*			trans	-67.9	100.9	173.9	177.3	0	0	0	0	109.4
28	G	27.6	Very low	26.7	Very low	67 Å²	67	143.7 Å²	143.7	69%	0.691	81%	0.806	S	S	*	*			trans	-110.3	114.6	170.4	0	0	0	0	0	110.6	V26 A30	V26-G28 PolarHBondContact O-N 3.11Å; V26-G28 VanDerWaalsContact O-N 3.16Å; G28-A30 PolarHBondContact O-N 2.95Å
29	L	22.4	Very low	26.4	Very low	172 Å²	172	143.6 Å²	143.6	90%	0.901	81%	0.806	S	S	*	*			trans	-55	127.3	176.3	-79.6	87.1	0	0	0	112.3
30	A	27.3	Very low	26.2	Very low	99 Å²	99	144.4 Å²	144.4	82%	0.818	81%	0.809	S	S	*	*			trans	-139.5	104.7	155.6	0	0	0	0	0	110	G28 R32	G28-A30 PolarHBondContact O-N 2.95Å; A30-R32 PolarHBondContact O-N 3.18Å
31	R	22.8	Very low	26.3	Very low	245 Å²	245	145.1 Å²	145.1	93%	0.925	82%	0.816	S	S	*	*			trans	-61.6	122.3	162.1	-81.5	177.1	172.1	177.3	-2.8	108.8
32	R	24.6	Very low	26.2	Very low	236 Å²	236	146 Å²	146	89%	0.891	82%	0.819	S	S	*	*			trans	-162.8	112.8	146.9	-111.9	170.4	-172.9	-176.8	1.8	111	A30	A30-R32 PolarHBondContact O-N 3.18Å
33	S	21.6	Very low	26.3	Very low	117 Å²	117	142 Å²	142	82%	0.818	82%	0.818	S	S	*	*			trans	-68.7	117.2	160.9	49.5	0	0	0	0	109.8
34	T	28.7	Very low	26	Very low	128 Å²	128	138.7 Å²	138.7	79%	0.785	82%	0.82	S	S	*	*			trans	-147.2	138.2	157.6	41.9	0	0	0	0	109.7
35	L	24.4	Very low	26.1	Very low	159 Å²	159	142.2 Å²	142.2	83%	0.832	82%	0.817	S	S	*	*			trans	-60.3	156.8	-174.3	-73	116.2	0	0	0	114.9
36	F	23	Very low	25.9	Very low	198 Å²	198	141.9 Å²	141.9	87%	0.868	81%	0.809	S	S	*	*			trans	-26.2	141.2	161.2	-66.8	-88.3	0	0	0	115.9
37	P	27.1	Very low	26	Very low	103 Å²	103	140.5 Å²	140.5	67%	0.669	80%	0.801	S	S	*	*				-149.7	178.3	98.1	31	-9.4	0	0	0	115.4
38	F	27.4	Very low	26.3	Very low	179 Å²	179	137.5 Å²	137.5	79%	0.785	79%	0.79	S	S	*	*			trans	89.6	90.2	174.1	-62.2	-82.3	0	0	0	116.2
39	T	23.9	Very low	26.3	Very low	119 Å²	119	137.8 Å²	137.8	73%	0.73	79%	0.787	S	S	*	*				63.9	94.2	78.1	69.4	0	0	0	0	114.9
40	T	26.1	Very low	26.8	Very low	138 Å²	138	135.1 Å²	135.1	85%	0.847	78%	0.777	S	S	*	*			trans	-131.4	118.5	147.7	44.3	0	0	0	0	108.2
41	P	29.4	Very low	27	Very low	127 Å²	127	137.8 Å²	137.8	83%	0.825	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-86.3	129.5	-177.4	32.2	-29.2	0	0	0	110.6
42	L	27.1	Very low	27.1	Very low	169 Å²	169	133.4 Å²	133.4	89%	0.885	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-77.2	148.3	167.7	-92.7	122.7	0	0	0	110.9
43	P	29.2	Very low	27.2	Very low	114 Å²	114	130 Å²	130	74%	0.74	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-79	153.9	-162.6	32.5	-34	0	0	0	113.5	I45	P43-I45 PolarHBondContact O-N 3.37Å
44	G	26	Very low	27.6	Very low	82 Å²	82	132.3 Å²	132.3	85%	0.845	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-53.5	120	-172.2	0	0	0	0	0	115.1
45	I	28.5	Very low	27.6	Very low	158 Å²	158	133.9 Å²	133.9	81%	0.81	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-73.5	125.3	157.1	-65.8	170.1	0	0	0	106.8	P43	P43-I45 PolarHBondContact O-N 3.37Å
46	S	24.9	Very low	27.8	Very low	88 Å²	88	133.7 Å²	133.7	62%	0.615	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-54	135.9	-177.8	56.3	0	0	0	0	112	A48	S46-A48 PolarHBondContact O-N 3.21Å
47	T	29.4	Very low	28	Very low	115 Å²	115	127.2 Å²	127.2	71%	0.706	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	15.3	-178.2	45.4	0	0	0	0	114.8
48	A	30.1	Very low	28	Very low	74 Å²	74	131.6 Å²	131.6	61%	0.612	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-29.3	179.8	0	0	0	0	0	113.2	S46	S46-A48 PolarHBondContact O-N 3.21Å
49	A	29.2	Very low	28.1	Very low	74 Å²	74	130.7 Å²	130.7	61%	0.612	76%	0.76	S	S	*	*	S	Bend	trans	-78.2	-21.4	177.7	0	0	0	0	0	113
50	V	32.8	Very low	28.4	Very low	116 Å²	116	132.9 Å²	132.9	70%	0.703	76%	0.759	S	S	*	*	S	Bend	trans	-84	-17.9	-180	177.1	0	0	0	0	112.5
51	Q	29.9	Very low	28.7	Very low	154 Å²	154	135.5 Å²	135.5	72%	0.72	76%	0.759	S	S	*	*	S	Bend	trans	-94.6	-4.6	-177.5	-76.9	-172.8	-25.2	0	0	115.3
52	L	26.1	Very low	28.7	Very low	153 Å²	153	137.7 Å²	137.7	80%	0.801	75%	0.751	S	S	*	*	S	Bend	trans	-92.7	-20.4	179.3	-151.2	74.8	0	0	0	114.6
53	E	27.2	Very low	29.5	Very low	165 Å²	165	133.1 Å²	133.1	77%	0.771	73%	0.73	S	S	*	*	S	Bend	trans	-95.4	-9.1	179.5	-73.1	-169.5	157.8	0	0	114.5	L55 I56	E53-L55 PolarHBondContact O-N 3.13Å; E53-L55 VanDerWaalsContact O-N 3.16Å; E53-I56 PolarHBondContact O-N 3.25Å
54	H	29.7	Very low	30	Very low	166 Å²	166	134 Å²	134	77%	0.769	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	6.8	-177.8	-139.2	-65.8	0	0	0	114.8
55	L	28.9	Very low	30.6	Very low	161 Å²	161	133.2 Å²	133.2	84%	0.843	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.2	-4.3	173.3	-103.8	97.1	0	0	0	115.1	E53 G57	E53-L55 PolarHBondContact O-N 3.13Å; E53-L55 VanDerWaalsContact O-N 3.16Å; L55-G57 PolarHBondContact O-N 2.87Å
56	I	28.8	Very low	31.1	Very low	155 Å²	155	128 Å²	128	80%	0.795	70%	0.704	S	S	*	*	S	Bend	trans	-93.6	92.4	175.6	-57.6	178.1	0	0	0	109.6	E53	E53-I56 PolarHBondContact O-N 3.25Å
57	G	27.2	Very low	31.3	Very low	61 Å²	61	132.2 Å²	132.2	63%	0.629	71%	0.707	S	S	*	*			trans	74	81.3	146.7	0	0	0	0	0	117.6	L55 N59	L55-G57 PolarHBondContact O-N 2.87Å; G57-N59 PolarHBondContact O-N 2.93Å; G57-N59 VanDerWaalsContact O-N 3.11Å
58	K	26.4	Very low	31.6	Very low	196 Å²	196	135.6 Å²	135.6	85%	0.852	71%	0.712	S	S	*	*	S	Bend	trans	-56.3	106.4	148.7	-65.5	175.3	178.4	177.6	0	108.4
59	N	28.8	Very low	31.8	Very low	160 Å²	160	138.7 Å²	138.7	86%	0.856	72%	0.717	S	S	*	*			trans	168	33.6	153.1	-86.2	-18	0	0	0	114	G57	G57-N59 PolarHBondContact O-N 2.93Å; G57-N59 VanDerWaalsContact O-N 3.11Å
60	K	31.4	Very low	32	Very low	164 Å²	164	139.1 Å²	139.1	71%	0.713	72%	0.716	S	S	*	*			trans	-89.7	108.8	170	-72.1	-173.8	176	-176.2	0	109.4	W62	K60-W62 VanDerWaalsContact O-CD1 3.3Å; K60-W62 PolarHBondContact O-NE1 3.26Å
61	K	31.6	Very low	32.2	Very low	194 Å²	194	138.2 Å²	138.2	84%	0.843	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-75.7	134.1	171.9	-71.1	-178.7	177.4	178.8	0	108.3
62	W	29	Very low	32.5	Very low	172 Å²	172	140.4 Å²	140.4	65%	0.652	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-102.5	138.8	-177.8	-53.9	84.4	0	0	0	109.2	K60 H80	K60-W62 VanDerWaalsContact O-CD1 3.3Å; K60-W62 PolarHBondContact O-NE1 3.26Å; W62-H80 AromaticContact CZ3-CE1 3.51Å; W62-H80 AromaticContact CZ3-ND1 3.79Å; W62-H80 AromaticContact CZ3-NE2 3.95Å
63	T	44.2	Very low	32.9	Very low	73 Å²	73	137.5 Å²	137.5	45%	0.448	72%	0.716	S	S	.	*	P	Polyproline II helix	trans	-97.5	144.9	171.3	59.2	0	0	0	0	111.1	A65 G66	T63-A65 PolarHBondContact O-N 3.11Å; T63-G66 PolarHBondContact O-N 2.9Å
64	T	39.9	Very low	33	Very low	132 Å²	132	133.5 Å²	133.5	81%	0.81	72%	0.719	S	S	*	*	H	α-helix	trans	-64.2	-21.8	179.1	34.6	0	0	0	0	113.5	W67 K68	T64-W67 PolarHBondContact O-N 3.31Å; T64-K68 PolarHBondContact O-N 3.07Å
65	A	37.9	Very low	33.1	Very low	66 Å²	66	132.2 Å²	132.2	55%	0.545	72%	0.718	S	S	.	*	H	α-helix	trans	-65.9	-37	174.3	0	0	0	0	0	112.2	T63 W67 K68	T63-A65 PolarHBondContact O-N 3.11Å; A65-W67 VanDerWaalsContact C-N 3.3Å; A65-W67 PolarHBondContact O-N 3.4Å; A65-K68 PolarHBondContact O-N 3.14Å
66	G	39.5	Very low	33.3	Very low	48 Å²	48	130.5 Å²	130.5	50%	0.495	71%	0.713	S	S	.	*	H	α-helix	trans	-66.6	-29.3	176.4	0	0	0	0	0	113.6	T63	T63-G66 PolarHBondContact O-N 2.9Å
67	W	30.4	Very low	33.7	Very low	178 Å²	178	130.6 Å²	130.6	67%	0.674	71%	0.708	S	S	*	*	H	α-helix	trans	-76.7	-28.3	177.5	-85.5	68.9	0	0	0	113.4	T64 A65 S70	T64-W67 PolarHBondContact O-N 3.31Å; A65-W67 VanDerWaalsContact C-N 3.3Å; A65-W67 PolarHBondContact O-N 3.4Å; W67-S70 PolarHBondContact O-OG 3.11Å
68	K	34.4	Very low	34.3	Very low	186 Å²	186	138.4 Å²	138.4	81%	0.809	72%	0.719	S	S	*	*	H	α-helix	trans	-80.8	-22.1	-173.4	-145.8	173.9	-175.1	-178.6	0	113.4	T64 A65	T64-K68 PolarHBondContact O-N 3.07Å; A65-K68 PolarHBondContact O-N 3.14Å
69	L	34	Very low	35.6	Very low	139 Å²	139	132 Å²	132	73%	0.728	70%	0.696	S	S	*	*	H	α-helix	trans	-89.9	-18.2	178.9	-71.8	164.8	0	0	0	113.4	C71	L69-C71 VanDerWaalsContact C-N 3.35Å; L69-C71 PolarHBondContact O-N 2.94Å
70	S	34.3	Very low	37.1	Very low	83 Å²	83	131.5 Å²	131.5	58%	0.58	69%	0.688	S	S	*	*	S	Bend	trans	-80.5	-6.8	-175.3	55.9	0	0	0	0	115.3	W67	W67-S70 PolarHBondContact O-OG 3.11Å
71	C	37	Very low	38.9	Very low	97 Å²	97	126 Å²	126	66%	0.655	67%	0.667	S	S	*	*	S	Bend	trans	-113.1	-8.3	-162.1	-72.8	0	0	0	0	118	L69	L69-C71 VanDerWaalsContact C-N 3.35Å; L69-C71 PolarHBondContact O-N 2.94Å
72	E	36	Very low	41.2	Very low	199 Å²	199	121.3 Å²	121.3	93%	0.93	65%	0.648	S	S	*	*	S	Bend	trans	-128.1	-9.5	-175.4	-75.3	-174.8	166.4	0	0	117.3
73	S	34.5	Very low	43.4	Very low	92 Å²	92	117.7 Å²	117.7	64%	0.643	64%	0.641	S	S	*	*	S	Bend	trans	-131	113.1	172.7	59	0	0	0	0	110.6	L75	S73-L75 PolarHBondContact O-N 3.32Å
74	G	30.1	Very low	45.2	Very low	81 Å²	81	118.9 Å²	118.9	84%	0.835	64%	0.64	S	S	*	*	S	Bend	trans	-68.6	48.8	-167.8	0	0	0	0	0	117.8
75	L	30.2	Very low	47.3	Very low	140 Å²	140	113.6 Å²	113.6	73%	0.733	61%	0.606	S	S	*	*			trans	-118.5	94.9	164.2	-68.9	174.3	0	0	0	108.9	S73 F77	S73-L75 PolarHBondContact O-N 3.32Å; L75-F77 VanDerWaalsContact C-N 3.34Å; L75-F77 HydrophobicContact CB-CD2 4.39Å; L75-F77 HydrophobicContact CB-CE2 4.23Å; L75-F77 PolarHBondContact O-N 3.12Å
76	V	32.8	Very low	49.4	Very low	125 Å²	125	117 Å²	117	76%	0.758	61%	0.606	S	S	*	*			trans	-74	83.8	179.8	-176.2	0	0	0	0	109.3	R78	V76-R78 HydrophobicContact CG1-CG 3.87Å; V76-R78 PolarHBondContact O-N 3.28Å
77	F	38	Very low	51.6	Low	157 Å²	157	118.3 Å²	118.3	69%	0.689	60%	0.604	S	S	*	*			trans	-79.6	99.6	161	-73	-77.5	0	0	0	108.3	L75 T79	L75-F77 VanDerWaalsContact C-N 3.34Å; L75-F77 HydrophobicContact CB-CD2 4.39Å; L75-F77 HydrophobicContact CB-CE2 4.23Å; L75-F77 PolarHBondContact O-N 3.12Å; F77-T79 VanDerWaalsContact C-N 3.26Å; F77-T79 PolarHBondContact O-N 3.01Å
78	R	40.7	Very low	54.3	Low	225 Å²	225	109.8 Å²	109.8	85%	0.849	57%	0.572	S	S	*	*			trans	-72.6	77.8	170.9	-69.2	-169.9	178.3	-174.8	-0.8	109.8	V76	V76-R78 HydrophobicContact CG1-CG 3.87Å; V76-R78 PolarHBondContact O-N 3.28Å
79	T	52.9	Low	56.7	Low	60 Å²	60	101.2 Å²	101.2	37%	0.368	53%	0.534	S	S	.	.			trans	-118	91.1	159.3	55.9	0	0	0	0	107.3	F77 L81 V114	F77-T79 VanDerWaalsContact C-N 3.26Å; F77-T79 PolarHBondContact O-N 3.01Å; T79-L81 WeakPolarHBondContact O-CD1 3.42Å; T79-L81 PolarHBondContact O-N 2.94Å; T79-L81 WeakPolarHBondContact OG1-CD1 3.28Å; T79-V114 HydrophobicContact CG2-CG2 4.19Å
80	H	59.9	Low	59.2	Low	151 Å²	151	96.5 Å²	96.5	70%	0.699	51%	0.51	S	S	*	.			trans	-70.3	82.7	165.2	-79.7	-59.2	0	0	0	107.4	W62 Q82	W62-H80 AromaticContact CZ3-CE1 3.51Å; W62-H80 AromaticContact CZ3-ND1 3.79Å; W62-H80 AromaticContact CZ3-NE2 3.95Å; H80-Q82 PolarHBondContact O-N 3.17Å
81	L	70.1	Confident	61.7	Low	49 Å²	49	92.7 Å²	92.7	26%	0.257	48%	0.483	S	S	.	.			trans	-61.8	133.9	173.5	-83.6	83.2	0	0	0	108.8	T79 E85 L89 V114	T79-L81 WeakPolarHBondContact O-CD1 3.42Å; T79-L81 PolarHBondContact O-N 2.94Å; T79-L81 WeakPolarHBondContact OG1-CD1 3.28Å; L81-E85 WeakPolarHBondContact CA-OE2 3.48Å; L81-E85 HydrophobicContact CB-CB 4.44Å; L81-E85 HydrophobicContact CD2-CB 4.38Å; L81-E85 HydrophobicContact CG-CB 4.48Å; L81-L89 HydrophobicContact CD2-CD1 3.39Å; L81-V114 WeakPolarHBondContact CD1-O 3.48Å
82	Q	78.8	Confident	64.1	Low	95 Å²	95	88 Å²	88	44%	0.444	45%	0.452	S	S	.	.			trans	-68.8	150.6	167.8	-59.6	-178.9	52.7	0	0	109.4	H80 K84 E85 Y86	H80-Q82 PolarHBondContact O-N 3.17Å; Q82-K84 PolarHBondContact O-N 2.83Å; Q82-K84 VanDerWaalsContact O-N 3.07Å; Q82-E85 HydrophobicContact CB-CB 4.45Å; Q82-E85 HydrophobicContact CB-CG 4.1Å; Q82-E85 PolarHBondContact N-OE2 3.23Å; Q82-E85 PolarHBondContact NE2-OE1 3.11Å; Q82-E85 WeakPolarHBondContact O-CB 3.36Å; Q82-E85 PolarHBondContact O-N 2.95Å; Q82-Y86 PolarHBondContact O-N 3.43Å
83	D	76.8	Confident	66.4	Low	96 Å²	96	81 Å²	81	51%	0.513	42%	0.419	S	S	.	.	H	α-helix	trans	-53.1	-35.1	177.8	-65.6	-20.1	0	0	0	111.9	Y86 V87	D83-Y86 PolarHBondContact O-N 3.21Å; D83-V87 WeakPolarHBondContact O-CG2 3.41Å; D83-V87 PolarHBondContact O-N 3.37Å
84	K	80.3	Confident	68.8	Low	98 Å²	98	83.4 Å²	83.4	43%	0.426	42%	0.418	S	S	.	.	H	α-helix	trans	-67.7	-41.1	175	-71.5	-168.5	168.7	-159.9	0	113.7	Q82 Y86 V87 Y88 D106 L109	Q82-K84 PolarHBondContact O-N 2.83Å; Q82-K84 VanDerWaalsContact O-N 3.07Å; K84-Y86 VanDerWaalsContact C-N 3.28Å; K84-V87 PolarHBondContact O-N 3.43Å; K84-Y88 WeakPolarHBondContact O-CB 3.39Å; K84-Y88 PolarHBondContact O-N 3.2Å; K84-D106 IonicContact NZ-OD2 2.68Å; K84-D106 PolarHBondContact NZ-OD2 3.41Å; K84-L109 HydrophobicContact CB-CD1 4.49Å
85	E	83.8	Confident	71.4	Confident	20 Å²	20	80.4 Å²	80.4	9%	0.093	39%	0.388	C	S	.	.	H	α-helix	trans	-65	-37.8	176.6	-67.5	161.1	-169.2	0	0	110.1	L81 Q82 Y88 L89 L109 C113	L81-E85 WeakPolarHBondContact CA-OE2 3.48Å; L81-E85 HydrophobicContact CB-CB 4.44Å; L81-E85 HydrophobicContact CD2-CB 4.38Å; L81-E85 HydrophobicContact CG-CB 4.48Å; Q82-E85 HydrophobicContact CB-CB 4.45Å; Q82-E85 HydrophobicContact CB-CG 4.1Å; Q82-E85 PolarHBondContact N-OE2 3.23Å; Q82-E85 PolarHBondContact NE2-OE1 3.11Å; Q82-E85 WeakPolarHBondContact O-CB 3.36Å; Q82-E85 PolarHBondContact O-N 2.95Å; E85-Y88 PolarHBondContact O-N 2.89Å; E85-L89 WeakPolarHBondContact O-CG 3.47Å; E85-L89 PolarHBondContact O-N 3.42Å; E85-L109 HydrophobicContact CB-CD1 4.36Å; E85-L109 HydrophobicContact CG-CD1 3.73Å; E85-C113 HydrophobicContact CB-CB 4.21Å; E85-C113 HydrophobicContact CG-CB 4.19Å
86	Y	83.8	Confident	74.2	Confident	138 Å²	138	78.3 Å²	78.3	54%	0.541	37%	0.374	S	S	.	.	H	α-helix	trans	-63.6	-44.7	173.4	-177.9	-104.1	0	0	0	112.3	Q82 D83 K84 L89 N90	Q82-Y86 PolarHBondContact O-N 3.43Å; D83-Y86 PolarHBondContact O-N 3.21Å; K84-Y86 VanDerWaalsContact C-N 3.28Å; Y86-L89 PolarHBondContact O-N 3.14Å; Y86-N90 WeakPolarHBondContact CE1-ND2 3.48Å; Y86-N90 WeakPolarHBondContact O-CB 3.46Å; Y86-N90 VanDerWaalsContact O-CG 3.26Å; Y86-N90 PolarHBondContact O-N 3.45Å; Y86-N90 PolarHBondContact OH-ND2 2.95Å
87	V	85.6	Confident	76.7	Confident	75 Å²	75	74.1 Å²	74.1	46%	0.455	35%	0.347	S	S	.	.	H	α-helix	trans	-63.1	-43.1	174.7	174.4	0	0	0	0	111.2	D83 K84 N90 A91 L103	D83-V87 WeakPolarHBondContact O-CG2 3.41Å; D83-V87 PolarHBondContact O-N 3.37Å; K84-V87 PolarHBondContact O-N 3.43Å; V87-N90 PolarHBondContact O-N 3.41Å; V87-A91 VanDerWaalsContact O-CB 3.27Å; V87-A91 WeakPolarHBondContact O-CB 3.37Å; V87-A91 PolarHBondContact O-N 3.33Å; V87-L103 HydrophobicContact CG1-CD1 4.11Å
88	Y	86.7	Confident	79	Confident	0 Å²	0	74 Å²	74	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-60.4	-46.9	177	167.3	-106.9	0	0	0	112.7	K84 E85 A91 A92 V100 L103 L104 L109 V111 C113 A121 L137	K84-Y88 WeakPolarHBondContact O-CB 3.39Å; K84-Y88 PolarHBondContact O-N 3.2Å; E85-Y88 PolarHBondContact O-N 2.89Å; Y88-A91 PolarHBondContact O-N 3.02Å; Y88-A92 WeakPolarHBondContact O-CB 3.44Å; Y88-A92 PolarHBondContact O-N 3.13Å; Y88-V100 HydrophobicContact CD2-CG1 4.48Å; Y88-V100 HydrophobicContact CE2-CG1 3.98Å; Y88-L103 HydrophobicContact CD2-CB 4.21Å; Y88-L104 HydrophobicContact CE2-CD2 3.89Å; Y88-L104 HydrophobicContact CE2-CG 4.16Å; Y88-L109 HydrophobicContact CD1-CD2 4.27Å; Y88-L109 HydrophobicContact CD2-CD2 3.77Å; Y88-L109 HydrophobicContact CE2-CD2 4.24Å; Y88-L109 HydrophobicContact CG-CD1 4.45Å; Y88-L109 HydrophobicContact CG-CD2 3.78Å; Y88-V111 WeakPolarHBondContact OH-CG1 3.5Å; Y88-C113 VanDerWaalsContact CD1-SG 3.55Å; Y88-A121 HydrophobicContact CD1-CB 4.43Å; Y88-A121 HydrophobicContact CE1-CB 3.52Å; Y88-A121 WeakPolarHBondContact OH-CB 3.21Å; Y88-L137 HydrophobicContact CE2-CD2 4.36Å; Y88-L137 VanDerWaalsContact OH-CD2 3.31Å; Y88-L137 WeakPolarHBondContact OH-CD2 3.34Å
89	L	85	Confident	81.2	Confident	5 Å²	5	65.8 Å²	65.8	3%	0.026	32%	0.324	C	S	.	.	H	α-helix	trans	-66	-40.3	177.8	-70.8	174.4	0	0	0	112.3	L81 E85 Y86 A92 E93 D115 A121 L124	L81-L89 HydrophobicContact CD2-CD1 3.39Å; E85-L89 WeakPolarHBondContact O-CG 3.47Å; E85-L89 PolarHBondContact O-N 3.42Å; Y86-L89 PolarHBondContact O-N 3.14Å; L89-A92 PolarHBondContact O-N 3.36Å; L89-E93 PolarHBondContact O-N 3.04Å; L89-D115 HydrophobicContact CD1-CB 4.23Å; L89-A121 HydrophobicContact CD2-CB 3.96Å; L89-L124 HydrophobicContact CB-CD1 4.08Å; L89-L124 HydrophobicContact CD2-CD1 4Å; L89-L124 WeakPolarHBondContact O-CD1 3.4Å
90	N	85.6	Confident	82.8	Confident	41 Å²	41	63 Å²	63	22%	0.219	31%	0.306	C	S	.	.	H	α-helix	trans	-65	-44.5	174.8	-73.4	-11.3	0	0	0	111.4	Y86 V87 A92 E93 F94	Y86-N90 WeakPolarHBondContact CE1-ND2 3.48Å; Y86-N90 WeakPolarHBondContact O-CB 3.46Å; Y86-N90 VanDerWaalsContact O-CG 3.26Å; Y86-N90 PolarHBondContact O-N 3.45Å; Y86-N90 PolarHBondContact OH-ND2 2.95Å; V87-N90 PolarHBondContact O-N 3.41Å; N90-A92 VanDerWaalsContact C-N 3.25Å; N90-A92 PolarHBondContact O-N 3.48Å; N90-E93 CarbonylContact O-C 3.6Å; N90-E93 PolarHBondContact O-N 3.35Å; N90-F94 HydrophobicContact CB-CD2 4.36Å; N90-F94 HydrophobicContact CB-CE2 4.24Å; N90-F94 WeakPolarHBondContact O-CD2 3.3Å; N90-F94 PolarHBondContact O-N 3.26Å
91	A	87.2	Confident	84	Confident	2 Å²	2	61.7 Å²	61.7	2%	0.017	30%	0.295	C	S	.	.	H	α-helix	trans	-59.4	-39.1	176.4	0	0	0	0	0	111.2	V87 Y88 F94 G95 E96 V99 V100	V87-A91 VanDerWaalsContact O-CB 3.27Å; V87-A91 WeakPolarHBondContact O-CB 3.37Å; V87-A91 PolarHBondContact O-N 3.33Å; Y88-A91 PolarHBondContact O-N 3.02Å; A91-F94 PolarHBondContact O-N 3Å; A91-G95 PolarHBondContact O-N 2.91Å; A91-E96 HydrophobicContact CB-CB 4.31Å; A91-E96 PolarHBondContact O-N 2.94Å; A91-V99 HydrophobicContact CB-CB 4.25Å; A91-V99 HydrophobicContact CB-CG1 3.81Å; A91-V100 HydrophobicContact CB-CG2 3.82Å
92	A	86.9	Confident	84.8	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-66.5	-39.1	172.6	0	0	0	0	0	112.9	Y88 L89 N90 G95 V100 A121 L133	Y88-A92 WeakPolarHBondContact O-CB 3.44Å; Y88-A92 PolarHBondContact O-N 3.13Å; L89-A92 PolarHBondContact O-N 3.36Å; N90-A92 VanDerWaalsContact C-N 3.25Å; N90-A92 PolarHBondContact O-N 3.48Å; A92-G95 PolarHBondContact O-N 3.38Å; A92-V100 HydrophobicContact CB-CG2 4.42Å; A92-A121 HydrophobicContact CB-CB 4.02Å; A92-L133 WeakPolarHBondContact O-CD2 3.35Å
93	E	84.7	Confident	85.1	Confident	50 Å²	50	61.6 Å²	61.6	23%	0.234	30%	0.298	C	S	.	.	H	α-helix	trans	-66.2	-35.6	174.4	-177.9	167.4	-156.8	0	0	112.5	L89 N90 L124 K127 N128	L89-E93 PolarHBondContact O-N 3.04Å; N90-E93 CarbonylContact O-C 3.6Å; N90-E93 PolarHBondContact O-N 3.35Å; E93-L124 HydrophobicContact CB-CB 4.25Å; E93-L124 HydrophobicContact CB-CD1 4.4Å; E93-K127 IonicContact OE1-NZ 2.69Å; E93-K127 PolarHBondContact OE1-NZ 3.47Å; E93-N128 PolarHBondContact O-ND2 3.36Å
94	F	85.6	Confident	85.3	Confident	143 Å²	143	58.1 Å²	58.1	63%	0.627	28%	0.279	S	S	*	.	H	α-helix	trans	-85.1	-11.2	178.2	-67.5	-64.8	0	0	0	113.8	N90 A91 E96	N90-F94 HydrophobicContact CB-CD2 4.36Å; N90-F94 HydrophobicContact CB-CE2 4.24Å; N90-F94 WeakPolarHBondContact O-CD2 3.3Å; N90-F94 PolarHBondContact O-N 3.26Å; A91-F94 PolarHBondContact O-N 3Å; F94-E96 HydrophobicContact CB-CG 4.28Å
95	G	83.4	Confident	85.3	Confident	19 Å²	19	59 Å²	59	20%	0.196	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.8	23.3	178.9	0	0	0	0	0	114.3	A91 A92 L97 N130	A91-G95 PolarHBondContact O-N 2.91Å; A92-G95 PolarHBondContact O-N 3.38Å; G95-L97 PolarHBondContact O-N 2.79Å; G95-N130 PolarHBondContact O-ND2 3.38Å
96	E	89.4	Confident	85.2	Confident	95 Å²	95	61 Å²	61	44%	0.444	30%	0.3	S	S	.	.			trans	-77.4	86.1	-178.7	-65.5	-178.9	178.6	0	0	111.2	A91 F94 E98 V99 V100	A91-E96 HydrophobicContact CB-CB 4.31Å; A91-E96 PolarHBondContact O-N 2.94Å; F94-E96 HydrophobicContact CB-CG 4.28Å; E96-E98 PolarHBondContact O-N 3.37Å; E96-V99 HydrophobicContact CB-CB 4.02Å; E96-V99 HydrophobicContact CB-CG2 4.13Å; E96-V99 PolarHBondContact O-N 3.03Å; E96-V99 WeakPolarHBondContact OE2-CG2 3.18Å; E96-V100 WeakPolarHBondContact O-CB 3.31Å; E96-V100 VanDerWaalsContact O-CG2 3.3Å; E96-V100 WeakPolarHBondContact O-CG2 3.29Å; E96-V100 PolarHBondContact O-N 3.32Å
97	L	85.8	Confident	84.8	Confident	38 Å²	38	62.5 Å²	62.5	20%	0.199	32%	0.316	C	S	.	.	H	α-helix	trans	-54.5	-44.9	-176.8	-78.9	162.2	0	0	0	114.3	G95 R101 D132 L133 L136	G95-L97 PolarHBondContact O-N 2.79Å; L97-R101 WeakPolarHBondContact O-CG 3.3Å; L97-R101 PolarHBondContact O-N 2.84Å; L97-D132 HydrophobicContact CD1-CB 3.72Å; L97-D132 HydrophobicContact CD2-CB 3.75Å; L97-D132 HydrophobicContact CG-CB 4.39Å; L97-L133 VanDerWaalsContact CD2-CA 3.46Å; L97-L133 HydrophobicContact CD2-CB 3.68Å; L97-L133 HydrophobicContact CD2-CD1 4.06Å; L97-L133 HydrophobicContact CD2-CG 4.48Å; L97-L133 HydrophobicContact CG-CB 4.43Å; L97-L136 HydrophobicContact CD2-CD1 3.49Å; L97-L136 VanDerWaalsContact CD2-CD1 3.49Å
98	E	85.7	Confident	84.6	Confident	155 Å²	155	67.5 Å²	67.5	72%	0.724	33%	0.331	S	S	*	.	H	α-helix	trans	-69.1	-47.2	-176.2	-63.4	-177.7	169.9	0	0	111.3	E96 V100 R101 D102	E96-E98 PolarHBondContact O-N 3.37Å; E98-V100 VanDerWaalsContact C-N 3.29Å; E98-V100 PolarHBondContact O-N 2.92Å; E98-R101 PolarHBondContact O-N 2.96Å; E98-R101 VanDerWaalsContact O-N 3.13Å; E98-D102 PolarHBondContact O-N 2.87Å
99	V	86.8	Confident	84.3	Confident	52 Å²	52	68.3 Å²	68.3	32%	0.315	34%	0.336	S	S	.	.	H	α-helix	trans	-61.1	-40.5	177.7	179.6	0	0	0	0	110.9	A91 E96 D102 L103	A91-V99 HydrophobicContact CB-CB 4.25Å; A91-V99 HydrophobicContact CB-CG1 3.81Å; E96-V99 HydrophobicContact CB-CB 4.02Å; E96-V99 HydrophobicContact CB-CG2 4.13Å; E96-V99 PolarHBondContact O-N 3.03Å; E96-V99 WeakPolarHBondContact OE2-CG2 3.18Å; V99-D102 PolarHBondContact O-N 3.47Å; V99-L103 HydrophobicContact CG1-CD1 3.8Å; V99-L103 HydrophobicContact CG1-CG 4.44Å; V99-L103 WeakPolarHBondContact O-CB 3.33Å; V99-L103 WeakPolarHBondContact O-CD1 3.03Å; V99-L103 WeakPolarHBondContact O-CG 3.3Å; V99-L103 PolarHBondContact O-N 2.9Å
100	V	86.2	Confident	84	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-65.9	-42.3	175.8	172.2	0	0	0	0	111.3	Y88 A91 A92 E96 E98 L103 L104 L133 L137	Y88-V100 HydrophobicContact CD2-CG1 4.48Å; Y88-V100 HydrophobicContact CE2-CG1 3.98Å; A91-V100 HydrophobicContact CB-CG2 3.82Å; A92-V100 HydrophobicContact CB-CG2 4.42Å; E96-V100 WeakPolarHBondContact O-CB 3.31Å; E96-V100 VanDerWaalsContact O-CG2 3.3Å; E96-V100 WeakPolarHBondContact O-CG2 3.29Å; E96-V100 PolarHBondContact O-N 3.32Å; E98-V100 VanDerWaalsContact C-N 3.29Å; E98-V100 PolarHBondContact O-N 2.92Å; V100-L103 PolarHBondContact O-N 3.29Å; V100-L104 HydrophobicContact CG1-CD1 3.69Å; V100-L104 HydrophobicContact CG1-CG 4.11Å; V100-L104 WeakPolarHBondContact O-CB 3.3Å; V100-L104 WeakPolarHBondContact O-CG 3.44Å; V100-L104 PolarHBondContact O-N 2.84Å; V100-L133 HydrophobicContact CB-CD1 3.94Å; V100-L133 HydrophobicContact CG1-CD1 3.77Å; V100-L133 HydrophobicContact CG2-CD1 4.03Å; V100-L137 HydrophobicContact CG1-CD2 4.01Å
101	R	85.8	Confident	83.6	Confident	124 Å²	124	71.2 Å²	71.2	47%	0.468	35%	0.352	S	S	.	.	H	α-helix	trans	-60	-47.2	175.4	-76.3	178	-174.9	171.6	5.7	111.7	L97 E98 L103 L104 D105 L136	L97-R101 WeakPolarHBondContact O-CG 3.3Å; L97-R101 PolarHBondContact O-N 2.84Å; E98-R101 PolarHBondContact O-N 2.96Å; E98-R101 VanDerWaalsContact O-N 3.13Å; R101-L103 VanDerWaalsContact C-N 3.3Å; R101-L103 PolarHBondContact O-N 3.39Å; R101-L104 PolarHBondContact O-N 3.47Å; R101-L104 VanDerWaalsContact O-N 3.16Å; R101-D105 PolarHBondContact O-N 3.46Å; R101-L136 HydrophobicContact CG-CD1 3.86Å; R101-L136 HydrophobicContact CG-CD2 4.45Å
102	D	86.7	Confident	83.1	Confident	116 Å²	116	72.6 Å²	72.6	62%	0.62	36%	0.359	S	S	*	.	H	α-helix	trans	-61.8	-38.6	179.4	-70.8	-10.1	0	0	0	111.9	E98 V99	E98-D102 PolarHBondContact O-N 2.87Å; V99-D102 PolarHBondContact O-N 3.47Å
103	L	84.3	Confident	82.8	Confident	26 Å²	26	73 Å²	73	14%	0.136	36%	0.361	C	S	.	.	H	α-helix	trans	-74.5	-29.1	176.8	-69.9	169.9	0	0	0	113	V87 Y88 V99 V100 R101 D105 D106 L109	V87-L103 HydrophobicContact CG1-CD1 4.11Å; Y88-L103 HydrophobicContact CD2-CB 4.21Å; V99-L103 HydrophobicContact CG1-CD1 3.8Å; V99-L103 HydrophobicContact CG1-CG 4.44Å; V99-L103 WeakPolarHBondContact O-CB 3.33Å; V99-L103 WeakPolarHBondContact O-CD1 3.03Å; V99-L103 WeakPolarHBondContact O-CG 3.3Å; V99-L103 PolarHBondContact O-N 2.9Å; V100-L103 PolarHBondContact O-N 3.29Å; R101-L103 VanDerWaalsContact C-N 3.3Å; R101-L103 PolarHBondContact O-N 3.39Å; L103-D105 VanDerWaalsContact C-N 3.32Å; L103-D106 VanDerWaalsContact O-CB 3.22Å; L103-D106 WeakPolarHBondContact O-CB 3.41Å; L103-D106 PolarHBondContact O-N 3.47Å; L103-L109 HydrophobicContact CB-CD2 4.09Å; L103-L109 WeakPolarHBondContact O-CD2 3.36Å
104	L	81.9	Confident	82.4	Confident	24 Å²	24	72 Å²	72	13%	0.126	36%	0.359	C	S	.	.	H	α-helix	trans	-72.7	-23.6	176.4	-76	169.8	0	0	0	113	Y88 V100 R101 D106 V111 L137 R140	Y88-L104 HydrophobicContact CE2-CD2 3.89Å; Y88-L104 HydrophobicContact CE2-CG 4.16Å; V100-L104 HydrophobicContact CG1-CD1 3.69Å; V100-L104 HydrophobicContact CG1-CG 4.11Å; V100-L104 WeakPolarHBondContact O-CB 3.3Å; V100-L104 WeakPolarHBondContact O-CG 3.44Å; V100-L104 PolarHBondContact O-N 2.84Å; R101-L104 PolarHBondContact O-N 3.47Å; R101-L104 VanDerWaalsContact O-N 3.16Å; L104-D106 PolarHBondContact O-N 3.16Å; L104-V111 HydrophobicContact CD2-CG1 3.78Å; L104-V111 HydrophobicContact CD2-CG2 4.05Å; L104-L137 HydrophobicContact CD1-CD2 4.3Å; L104-R140 HydrophobicContact CD1-CG 4.22Å; L104-R140 HydrophobicContact CD2-CB 4.06Å; L104-R140 HydrophobicContact CD2-CG 4.19Å
105	D	81.5	Confident	82.2	Confident	115 Å²	115	66 Å²	66	62%	0.615	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-13.9	173.5	-72.3	-20.3	0	0	0	112.3	R101 L103 I107	R101-D105 PolarHBondContact O-N 3.46Å; L103-D105 VanDerWaalsContact C-N 3.32Å; D105-I107 PolarHBondContact O-N 2.91Å
106	D	81.4	Confident	81.8	Confident	63 Å²	63	72.9 Å²	72.9	34%	0.337	36%	0.355	S	S	.	.			trans	-81.1	103.6	-176.9	-122.9	7.9	0	0	0	111.3	K84 L103 L104 K108 L109	K84-D106 IonicContact NZ-OD2 2.68Å; K84-D106 PolarHBondContact NZ-OD2 3.41Å; L103-D106 VanDerWaalsContact O-CB 3.22Å; L103-D106 WeakPolarHBondContact O-CB 3.41Å; L103-D106 PolarHBondContact O-N 3.47Å; L104-D106 PolarHBondContact O-N 3.16Å; D106-K108 PolarHBondContact O-N 2.91Å; D106-L109 WeakPolarHBondContact O-CB 3.27Å; D106-L109 PolarHBondContact O-N 3.37Å
107	I	75.4	Confident	81.2	Confident	170 Å²	170	73.3 Å²	73.3	87%	0.872	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-23.4	-175.1	-55.7	168.7	0	0	0	113.9	D105	D105-I107 PolarHBondContact O-N 2.91Å
108	K	80	Confident	80.7	Confident	179 Å²	179	72.9 Å²	72.9	78%	0.778	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-11.1	-177.4	-68.2	179.8	-178.9	173.7	0	113.8	D106	D106-K108 PolarHBondContact O-N 2.91Å
109	L	80.8	Confident	80.5	Confident	18 Å²	18	67.7 Å²	67.7	9%	0.094	34%	0.336	C	S	.	.	S	Bend	trans	-81.8	129.5	-178.1	-179.6	68.9	0	0	0	110.3	K84 E85 Y88 L103 D106 V111	K84-L109 HydrophobicContact CB-CD1 4.49Å; E85-L109 HydrophobicContact CB-CD1 4.36Å; E85-L109 HydrophobicContact CG-CD1 3.73Å; Y88-L109 HydrophobicContact CD1-CD2 4.27Å; Y88-L109 HydrophobicContact CD2-CD2 3.77Å; Y88-L109 HydrophobicContact CE2-CD2 4.24Å; Y88-L109 HydrophobicContact CG-CD1 4.45Å; Y88-L109 HydrophobicContact CG-CD2 3.78Å; L103-L109 HydrophobicContact CB-CD2 4.09Å; L103-L109 WeakPolarHBondContact O-CD2 3.36Å; D106-L109 WeakPolarHBondContact O-CB 3.27Å; D106-L109 PolarHBondContact O-N 3.37Å; L109-V111 PolarHBondContact O-N 3.4Å
110	D	79.8	Confident	80.3	Confident	78 Å²	78	65.9 Å²	65.9	42%	0.417	33%	0.325	S	S	.	.			trans	-77.9	107.2	165.5	-175.2	5.3	0	0	0	109.6	N112 C113	D110-N112 PolarHBondContact O-N 2.83Å; D110-N112 PolarHBondContact OD1-N 2.68Å; D110-N112 VanDerWaalsContact OD1-N 3.09Å; D110-C113 WeakPolarHBondContact O-CB 3.35Å; D110-C113 PolarHBondContact O-N 3.34Å; D110-C113 PolarHBondContact O-SG 3.47Å
111	V	77.2	Confident	80.3	Confident	28 Å²	28	65.9 Å²	65.9	17%	0.17	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-27.9	-178.8	-175.5	0	0	0	0	111.7	Y88 L104 L109 C113 R140 L141	Y88-V111 WeakPolarHBondContact OH-CG1 3.5Å; L104-V111 HydrophobicContact CD2-CG1 3.78Å; L104-V111 HydrophobicContact CD2-CG2 4.05Å; L109-V111 PolarHBondContact O-N 3.4Å; V111-C113 VanDerWaalsContact C-N 3.26Å; V111-C113 PolarHBondContact O-N 2.89Å; V111-R140 HydrophobicContact CG1-CB 4.25Å; V111-L141 HydrophobicContact CG1-CD2 4.43Å; V111-L141 HydrophobicContact CG1-CG 4.02Å
112	N	76.5	Confident	80.3	Confident	32 Å²	32	60 Å²	60	17%	0.171	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	19.1	-179.8	-58	-60.4	0	0	0	112.9	D110 D142	D110-N112 PolarHBondContact O-N 2.83Å; D110-N112 PolarHBondContact OD1-N 2.68Å; D110-N112 VanDerWaalsContact OD1-N 3.09Å; N112-D142 VanDerWaalsContact ND2-CG 3.29Å; N112-D142 PolarHBondContact ND2-OD2 3.46Å; N112-D142 PolarHBondContact OD1-N 2.99Å
113	C	80	Confident	80.3	Confident	7 Å²	7	55.1 Å²	55.1	5%	0.047	28%	0.277	C	S	.	.			trans	-59.6	144.7	175.1	59.3	0	0	0	0	111.1	E85 Y88 D110 V111	E85-C113 HydrophobicContact CB-CB 4.21Å; E85-C113 HydrophobicContact CG-CB 4.19Å; Y88-C113 VanDerWaalsContact CD1-SG 3.55Å; D110-C113 WeakPolarHBondContact O-CB 3.35Å; D110-C113 PolarHBondContact O-N 3.34Å; D110-C113 PolarHBondContact O-SG 3.47Å; V111-C113 VanDerWaalsContact C-N 3.26Å; V111-C113 PolarHBondContact O-N 2.89Å
114	V	76.3	Confident	80.3	Confident	31 Å²	31	54.1 Å²	54.1	19%	0.188	27%	0.271	C	S	.	.	B	Isolated β-bridge	trans	-119.1	145.7	179.3	-54.8	0	0	0	0	109.4	T79 L81 R119 N120	T79-V114 HydrophobicContact CG2-CG2 4.19Å; L81-V114 WeakPolarHBondContact CD1-O 3.48Å; V114-R119 WeakPolarHBondContact CA-O 3.34Å; V114-N120 WeakPolarHBondContact CG1-OD1 3.22Å
115	D	81.1	Confident	80.5	Confident	15 Å²	15	53 Å²	53	8%	0.08	27%	0.266	C	S	.	.			trans	-71.7	-177.4	172.8	75.3	-4.8	0	0	0	112.3	L89 M117 G118 R119	L89-D115 HydrophobicContact CD1-CB 4.23Å; D115-M117 PolarHBondContact O-N 3Å; D115-M117 VanDerWaalsContact O-N 3.14Å; D115-M117 VanDerWaalsContact OD1-C 3.27Å; D115-M117 VanDerWaalsContact OD1-CA 3.26Å; D115-M117 WeakPolarHBondContact OD1-CA 3.46Å; D115-M117 WeakPolarHBondContact OD1-CB 3.19Å; D115-M117 PolarHBondContact OD1-N 3.44Å; D115-G118 PolarHBondContact O-N 3.44Å; D115-G118 PolarHBondContact OD1-N 2.86Å; D115-R119 PolarHBondContact N-O 2.68Å; D115-R119 VanDerWaalsContact N-O 3.08Å; D115-R119 WeakPolarHBondContact OD1-CB 3.42Å; D115-R119 PolarHBondContact OD1-N 3.35Å; D115-R119 IonicContact OD1-NE 2.8Å; D115-R119 IonicContact OD2-CZ 3.63Å; D115-R119 IonicContact OD2-NE 3.1Å; D115-R119 PolarHBondContact OD2-NE 3.36Å; D115-R119 IonicContact OD2-NH2 3.46Å; D115-R119 PolarHBondContact OD2-NH2 2.95Å
116	Y	75.2	Confident	80.7	Confident	164 Å²	164	47.6 Å²	47.6	64%	0.643	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-13.3	176.6	65.6	-88.9	0	0	0	113.8
117	M	76.8	Confident	80.9	Confident	104 Å²	104	50 Å²	50	51%	0.512	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-2.4	174.6	-55.8	-177.6	64.7	0	0	112.6	D115 R119	D115-M117 PolarHBondContact O-N 3Å; D115-M117 VanDerWaalsContact O-N 3.14Å; D115-M117 VanDerWaalsContact OD1-C 3.27Å; D115-M117 VanDerWaalsContact OD1-CA 3.26Å; D115-M117 WeakPolarHBondContact OD1-CA 3.46Å; D115-M117 WeakPolarHBondContact OD1-CB 3.19Å; D115-M117 PolarHBondContact OD1-N 3.44Å; M117-R119 HydrophobicContact CB-CG 4.13Å
118	G	75.8	Confident	81.3	Confident	29 Å²	29	46 Å²	46	30%	0.299	23%	0.225	S	C	.	.			trans	80	20.1	-175.7	0	0	0	0	0	114.6	D115	D115-G118 PolarHBondContact O-N 3.44Å; D115-G118 PolarHBondContact OD1-N 2.86Å
119	R	81.5	Confident	81.4	Confident	47 Å²	47	42.9 Å²	42.9	18%	0.177	21%	0.213	C	C	.	.			trans	-93.2	127.5	-179.8	-57.1	176.7	-61.7	173.9	8.4	110.9	V114 D115 M117 L123 L124	V114-R119 WeakPolarHBondContact CA-O 3.34Å; D115-R119 PolarHBondContact N-O 2.68Å; D115-R119 VanDerWaalsContact N-O 3.08Å; D115-R119 WeakPolarHBondContact OD1-CB 3.42Å; D115-R119 PolarHBondContact OD1-N 3.35Å; D115-R119 IonicContact OD1-NE 2.8Å; D115-R119 IonicContact OD2-CZ 3.63Å; D115-R119 IonicContact OD2-NE 3.1Å; D115-R119 PolarHBondContact OD2-NE 3.36Å; D115-R119 IonicContact OD2-NH2 3.46Å; D115-R119 PolarHBondContact OD2-NH2 2.95Å; M117-R119 HydrophobicContact CB-CG 4.13Å; R119-L123 HydrophobicContact CB-CB 4.31Å; R119-L123 HydrophobicContact CB-CD1 4.38Å; R119-L124 HydrophobicContact CB-CD2 4.42Å
120	N	82.5	Confident	81.7	Confident	13 Å²	13	43.8 Å²	43.8	7%	0.07	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-72	159.4	172.6	-54.7	-15.6	0	0	0	111.3	V114 L122 L123 L124 A145	V114-N120 WeakPolarHBondContact CG1-OD1 3.22Å; N120-L122 PolarHBondContact O-N 2.95Å; N120-L122 VanDerWaalsContact O-N 3.17Å; N120-L123 HydrophobicContact CB-CD1 4.24Å; N120-L123 WeakPolarHBondContact O-CB 3.38Å; N120-L123 PolarHBondContact O-N 3.38Å; N120-L124 PolarHBondContact O-N 3.01Å; N120-A145 WeakPolarHBondContact ND2-CA 3.04Å; N120-A145 VanDerWaalsContact ND2-CB 3.34Å; N120-A145 WeakPolarHBondContact ND2-CB 3.45Å; N120-A145 PolarHBondContact ND2-O 2.93Å
121	A	85.5	Confident	82.1	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-51.8	-38.9	173.9	0	0	0	0	0	113.4	Y88 L89 A92 L123 L124 A125 L137	Y88-A121 HydrophobicContact CD1-CB 4.43Å; Y88-A121 HydrophobicContact CE1-CB 3.52Å; Y88-A121 WeakPolarHBondContact OH-CB 3.21Å; L89-A121 HydrophobicContact CD2-CB 3.96Å; A92-A121 HydrophobicContact CB-CB 4.02Å; A121-L123 PolarHBondContact O-N 3.06Å; A121-L124 PolarHBondContact O-N 3.38Å; A121-A125 PolarHBondContact O-N 3.47Å; A121-L137 HydrophobicContact CB-CD1 4.41Å; A121-L137 HydrophobicContact CB-CD2 4.4Å
122	L	87.1	Confident	82.5	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-64.1	-39.5	177.2	-172.8	59.5	0	0	0	112.6	N120 L124 A125 M126 V134 L137 V138 L141 V146 A149	N120-L122 PolarHBondContact O-N 2.95Å; N120-L122 VanDerWaalsContact O-N 3.17Å; L122-L124 VanDerWaalsContact C-N 3.3Å; L122-L124 PolarHBondContact O-N 3.35Å; L122-A125 PolarHBondContact O-N 3.48Å; L122-M126 VanDerWaalsContact O-CG 3.31Å; L122-M126 WeakPolarHBondContact O-CG 3.3Å; L122-M126 PolarHBondContact O-N 3.03Å; L122-V134 HydrophobicContact CD1-CB 4.25Å; L122-V134 HydrophobicContact CD1-CG1 3.97Å; L122-V134 HydrophobicContact CD1-CG2 4.21Å; L122-L137 HydrophobicContact CD1-CB 3.87Å; L122-L137 HydrophobicContact CD1-CD1 4.33Å; L122-V138 HydrophobicContact CD1-CG2 4.06Å; L122-V138 HydrophobicContact CD2-CG2 3.98Å; L122-L141 HydrophobicContact CB-CD1 3.85Å; L122-L141 HydrophobicContact CD2-CD1 4.4Å; L122-V146 HydrophobicContact CD2-CB 4.45Å; L122-V146 HydrophobicContact CD2-CG1 4.46Å; L122-V146 HydrophobicContact CD2-CG2 4.18Å; L122-A149 HydrophobicContact CB-CB 4.23Å; L122-A149 HydrophobicContact CD2-CB 3.38Å; L122-A149 HydrophobicContact CG-CB 3.65Å
123	L	85.8	Confident	83	Confident	15 Å²	15	44.5 Å²	44.5	8%	0.079	22%	0.22	C	C	.	.	H	α-helix	trans	-64.9	-36.6	176.9	-72.7	164.8	0	0	0	111.4	R119 N120 A121 M126 K127 A149 N152	R119-L123 HydrophobicContact CB-CB 4.31Å; R119-L123 HydrophobicContact CB-CD1 4.38Å; N120-L123 HydrophobicContact CB-CD1 4.24Å; N120-L123 WeakPolarHBondContact O-CB 3.38Å; N120-L123 PolarHBondContact O-N 3.38Å; A121-L123 PolarHBondContact O-N 3.06Å; L123-M126 HydrophobicContact CD2-CE 4Å; L123-K127 PolarHBondContact O-N 3.16Å; L123-A149 HydrophobicContact CD2-CB 4.27Å; L123-A149 HydrophobicContact CG-CB 4.4Å; L123-N152 HydrophobicContact CD2-CB 3.54Å; L123-N152 WeakPolarHBondContact CD2-ND2 3.4Å
124	L	85.1	Confident	83.3	Confident	4 Å²	4	44.2 Å²	44.2	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-67.7	-44.9	175	-63.7	172.9	0	0	0	111.3	L89 E93 R119 N120 A121 L122 M126 K127	L89-L124 HydrophobicContact CB-CD1 4.08Å; L89-L124 HydrophobicContact CD2-CD1 4Å; L89-L124 WeakPolarHBondContact O-CD1 3.4Å; E93-L124 HydrophobicContact CB-CB 4.25Å; E93-L124 HydrophobicContact CB-CD1 4.4Å; R119-L124 HydrophobicContact CB-CD2 4.42Å; N120-L124 PolarHBondContact O-N 3.01Å; A121-L124 PolarHBondContact O-N 3.38Å; L122-L124 VanDerWaalsContact C-N 3.3Å; L122-L124 PolarHBondContact O-N 3.35Å; L124-M126 VanDerWaalsContact C-N 3.34Å; L124-M126 PolarHBondContact O-N 3.48Å; L124-K127 WeakPolarHBondContact O-CB 3.5Å; L124-K127 PolarHBondContact O-N 3.29Å
125	A	86.4	Confident	83.8	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.008	23%	0.231	C	C	.	.	H	α-helix	trans	-60.5	-40.7	176.4	0	0	0	0	0	112.6	A121 L122 K127 N128 E129 N130 L133 V134 L137	A121-A125 PolarHBondContact O-N 3.47Å; L122-A125 PolarHBondContact O-N 3.48Å; A125-K127 VanDerWaalsContact C-N 3.3Å; A125-K127 PolarHBondContact O-N 3.39Å; A125-N128 PolarHBondContact O-N 2.89Å; A125-E129 PolarHBondContact O-N 3.32Å; A125-N130 PolarHBondContact O-N 3.22Å; A125-L133 HydrophobicContact CB-CB 4.43Å; A125-L133 HydrophobicContact CB-CD2 3.53Å; A125-L133 HydrophobicContact CB-CG 3.8Å; A125-V134 HydrophobicContact CB-CG2 4.23Å; A125-L137 HydrophobicContact CB-CD1 3.81Å
126	M	85.3	Confident	83.9	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-67.5	-25.5	178.3	-72.5	-158.2	-42.7	0	0	114.2	L122 L123 L124 N128 E129 V134 A149 N152 A153 K158 L161 I165	L122-M126 VanDerWaalsContact O-CG 3.31Å; L122-M126 WeakPolarHBondContact O-CG 3.3Å; L122-M126 PolarHBondContact O-N 3.03Å; L123-M126 HydrophobicContact CD2-CE 4Å; L124-M126 VanDerWaalsContact C-N 3.34Å; L124-M126 PolarHBondContact O-N 3.48Å; M126-N128 PolarHBondContact O-N 3.21Å; M126-E129 PolarHBondContact O-N 3.12Å; M126-V134 HydrophobicContact CG-CG2 3.96Å; M126-A149 HydrophobicContact CE-CB 4.12Å; M126-A149 WeakPolarHBondContact CE-O 3.35Å; M126-A149 HydrophobicContact SD-CB 4.4Å; M126-N152 HydrophobicContact CE-CB 4.17Å; M126-A153 HydrophobicContact CE-CB 4.13Å; M126-A153 HydrophobicContact SD-CB 3.8Å; M126-K158 PolarHBondContact O-NZ 3.01Å; M126-K158 VanDerWaalsContact O-NZ 3.11Å; M126-L161 HydrophobicContact CB-CD1 4.1Å; M126-L161 HydrophobicContact CG-CD1 4.1Å; M126-L161 HydrophobicContact SD-CD1 4.19Å; M126-I165 HydrophobicContact SD-CD1 3.89Å
127	K	84.5	Confident	84.5	Confident	113 Å²	113	40.8 Å²	40.8	49%	0.491	21%	0.207	S	C	.	.	H	α-helix	trans	-61.2	-37.2	177.1	-175.7	-174.8	167.1	-163.1	0	111.1	E93 L123 L124 A125	E93-K127 IonicContact OE1-NZ 2.69Å; E93-K127 PolarHBondContact OE1-NZ 3.47Å; L123-K127 PolarHBondContact O-N 3.16Å; L124-K127 WeakPolarHBondContact O-CB 3.5Å; L124-K127 PolarHBondContact O-N 3.29Å; A125-K127 VanDerWaalsContact C-N 3.3Å; A125-K127 PolarHBondContact O-N 3.39Å
128	N	84.6	Confident	84.9	Confident	87 Å²	87	35.8 Å²	35.8	47%	0.465	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	4.7	179.3	-65.5	0.2	0	0	0	113.5	E93 A125 M126 N130	E93-N128 PolarHBondContact O-ND2 3.36Å; A125-N128 PolarHBondContact O-N 2.89Å; M126-N128 PolarHBondContact O-N 3.21Å; N128-N130 PolarHBondContact O-N 3.42Å
129	E	82.4	Confident	85.3	Confident	113 Å²	113	37.5 Å²	37.5	53%	0.528	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	33.3	177.8	-57	-174.5	172.6	0	0	114.5	A125 M126 L131 K158	A125-E129 PolarHBondContact O-N 3.32Å; M126-E129 PolarHBondContact O-N 3.12Å; E129-L131 PolarHBondContact O-N 3.48Å; E129-L131 VanDerWaalsContact O-N 3.14Å; E129-K158 HydrophobicContact CG-CD 4.44Å; E129-K158 VanDerWaalsContact CG-NZ 3.29Å; E129-K158 WeakPolarHBondContact OE1-CE 3.15Å; E129-K158 IonicContact OE1-NZ 3.57Å; E129-K158 PolarHBondContact OE1-NZ 2.89Å
130	N	87.3	Confident	85.4	Confident	37 Å²	37	42.4 Å²	42.4	20%	0.198	20%	0.203	C	C	.	.			trans	-79.3	98.8	177.7	-171.6	-14.9	0	0	0	110.9	G95 A125 N128 L133 V134	G95-N130 PolarHBondContact O-ND2 3.38Å; A125-N130 PolarHBondContact O-N 3.22Å; N128-N130 PolarHBondContact O-N 3.42Å; N130-L133 HydrophobicContact CB-CB 4.01Å; N130-L133 PolarHBondContact O-N 3.5Å; N130-L133 PolarHBondContact OD1-N 3.22Å; N130-V134 VanDerWaalsContact O-CG2 3.26Å; N130-V134 WeakPolarHBondContact O-CG2 3.43Å; N130-V134 PolarHBondContact O-N 3.45Å; N130-V134 VanDerWaalsContact O-N 3.08Å
131	L	86.5	Confident	85.4	Confident	62 Å²	62	42 Å²	42	33%	0.325	20%	0.201	S	C	.	.	H	α-helix	trans	-62.2	-46.7	-174	-55.2	179	0	0	0	113.1	E129 L133 V134 E135 H160 L161 L164	E129-L131 PolarHBondContact O-N 3.48Å; E129-L131 VanDerWaalsContact O-N 3.14Å; L131-L133 PolarHBondContact O-N 2.9Å; L131-V134 PolarHBondContact O-N 3.41Å; L131-E135 PolarHBondContact O-N 2.95Å; L131-H160 WeakPolarHBondContact CD1-NE2 3.36Å; L131-L161 HydrophobicContact CD2-CD2 3.61Å; L131-L164 HydrophobicContact CB-CD1 4.22Å; L131-L164 HydrophobicContact CD2-CD1 4.37Å
132	D	86.4	Confident	85.3	Confident	92 Å²	92	46.4 Å²	46.4	49%	0.492	22%	0.224	S	C	.	.	H	α-helix	trans	-62.6	-36	-178.6	-62.9	-20.1	0	0	0	111.1	L97 L136	L97-D132 HydrophobicContact CD1-CB 3.72Å; L97-D132 HydrophobicContact CD2-CB 3.75Å; L97-D132 HydrophobicContact CG-CB 4.39Å; D132-L136 VanDerWaalsContact O-CG 3.31Å; D132-L136 WeakPolarHBondContact O-CG 3.08Å; D132-L136 PolarHBondContact O-N 2.82Å; D132-L136 VanDerWaalsContact O-N 3.12Å
133	L	86.7	Confident	85.1	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-74.6	-40.5	-178.4	-178.3	61.9	0	0	0	110.5	A92 L97 V100 A125 N130 L131 E135 L136 L137	A92-L133 WeakPolarHBondContact O-CD2 3.35Å; L97-L133 VanDerWaalsContact CD2-CA 3.46Å; L97-L133 HydrophobicContact CD2-CB 3.68Å; L97-L133 HydrophobicContact CD2-CD1 4.06Å; L97-L133 HydrophobicContact CD2-CG 4.48Å; L97-L133 HydrophobicContact CG-CB 4.43Å; V100-L133 HydrophobicContact CB-CD1 3.94Å; V100-L133 HydrophobicContact CG1-CD1 3.77Å; V100-L133 HydrophobicContact CG2-CD1 4.03Å; A125-L133 HydrophobicContact CB-CB 4.43Å; A125-L133 HydrophobicContact CB-CD2 3.53Å; A125-L133 HydrophobicContact CB-CG 3.8Å; N130-L133 HydrophobicContact CB-CB 4.01Å; N130-L133 PolarHBondContact O-N 3.5Å; N130-L133 PolarHBondContact OD1-N 3.22Å; L131-L133 PolarHBondContact O-N 2.9Å; L133-E135 VanDerWaalsContact C-N 3.34Å; L133-L136 PolarHBondContact O-N 2.95Å; L133-L137 HydrophobicContact CD1-CD1 4.05Å; L133-L137 HydrophobicContact CD1-CG 4.11Å; L133-L137 HydrophobicContact CD2-CD1 4.48Å; L133-L137 HydrophobicContact CG-CD1 3.84Å; L133-L137 HydrophobicContact CG-CG 4.32Å; L133-L137 VanDerWaalsContact O-CB 3.26Å; L133-L137 WeakPolarHBondContact O-CB 3.29Å; L133-L137 VanDerWaalsContact O-CG 3.23Å; L133-L137 WeakPolarHBondContact O-CG 3.4Å; L133-L137 PolarHBondContact O-N 3.4Å
134	V	86.7	Confident	84.7	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-59.2	-45.9	173.6	171.5	0	0	0	0	110.1	L122 A125 M126 N130 L131 L136 L137 V138 L161 L164 I165	L122-V134 HydrophobicContact CD1-CB 4.25Å; L122-V134 HydrophobicContact CD1-CG1 3.97Å; L122-V134 HydrophobicContact CD1-CG2 4.21Å; A125-V134 HydrophobicContact CB-CG2 4.23Å; M126-V134 HydrophobicContact CG-CG2 3.96Å; N130-V134 VanDerWaalsContact O-CG2 3.26Å; N130-V134 WeakPolarHBondContact O-CG2 3.43Å; N130-V134 PolarHBondContact O-N 3.45Å; N130-V134 VanDerWaalsContact O-N 3.08Å; L131-V134 PolarHBondContact O-N 3.41Å; V134-L136 PolarHBondContact O-N 2.99Å; V134-L137 PolarHBondContact O-N 3.29Å; V134-V138 HydrophobicContact CG1-CG2 4.3Å; V134-V138 WeakPolarHBondContact O-CG2 3.31Å; V134-V138 PolarHBondContact O-N 2.84Å; V134-L161 HydrophobicContact CG2-CD2 4.43Å; V134-L164 HydrophobicContact CB-CD2 4.42Å; V134-L164 HydrophobicContact CG1-CD2 3.67Å; V134-I165 HydrophobicContact CG1-CD1 4.46Å; V134-I165 HydrophobicContact CG1-CG1 4.07Å
135	E	86.1	Confident	84.5	Confident	96 Å²	96	53.1 Å²	53.1	45%	0.449	25%	0.252	S	S	.	.	H	α-helix	trans	-61.3	-44.4	178.1	-169.8	177.9	178.4	0	0	112.5	L131 L133 N139 L164	L131-E135 PolarHBondContact O-N 2.95Å; L133-E135 VanDerWaalsContact C-N 3.34Å; E135-N139 PolarHBondContact O-N 3.21Å; E135-N139 PolarHBondContact O-ND2 3.41Å; E135-L164 HydrophobicContact CB-CD2 4.45Å
136	L	84.5	Confident	84.5	Confident	42 Å²	42	53.1 Å²	53.1	22%	0.22	25%	0.252	C	S	.	.	H	α-helix	trans	-65	-42.1	176.8	-70.6	168	0	0	0	112.9	L97 R101 D132 L133 V134 N139	L97-L136 HydrophobicContact CD2-CD1 3.49Å; L97-L136 VanDerWaalsContact CD2-CD1 3.49Å; R101-L136 HydrophobicContact CG-CD1 3.86Å; R101-L136 HydrophobicContact CG-CD2 4.45Å; D132-L136 VanDerWaalsContact O-CG 3.31Å; D132-L136 WeakPolarHBondContact O-CG 3.08Å; D132-L136 PolarHBondContact O-N 2.82Å; D132-L136 VanDerWaalsContact O-N 3.12Å; L133-L136 PolarHBondContact O-N 2.95Å; V134-L136 PolarHBondContact O-N 2.99Å; L136-N139 WeakPolarHBondContact O-CB 3.32Å; L136-N139 PolarHBondContact O-N 3.07Å
137	L	86.4	Confident	84.4	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-68.1	-42.9	-178.2	-77.3	177.5	0	0	0	111.3	Y88 V100 L104 A121 L122 A125 L133 V134 N139 R140 L141	Y88-L137 HydrophobicContact CE2-CD2 4.36Å; Y88-L137 VanDerWaalsContact OH-CD2 3.31Å; Y88-L137 WeakPolarHBondContact OH-CD2 3.34Å; V100-L137 HydrophobicContact CG1-CD2 4.01Å; L104-L137 HydrophobicContact CD1-CD2 4.3Å; A121-L137 HydrophobicContact CB-CD1 4.41Å; A121-L137 HydrophobicContact CB-CD2 4.4Å; L122-L137 HydrophobicContact CD1-CB 3.87Å; L122-L137 HydrophobicContact CD1-CD1 4.33Å; A125-L137 HydrophobicContact CB-CD1 3.81Å; L133-L137 HydrophobicContact CD1-CD1 4.05Å; L133-L137 HydrophobicContact CD1-CG 4.11Å; L133-L137 HydrophobicContact CD2-CD1 4.48Å; L133-L137 HydrophobicContact CG-CD1 3.84Å; L133-L137 HydrophobicContact CG-CG 4.32Å; L133-L137 VanDerWaalsContact O-CB 3.26Å; L133-L137 WeakPolarHBondContact O-CB 3.29Å; L133-L137 VanDerWaalsContact O-CG 3.23Å; L133-L137 WeakPolarHBondContact O-CG 3.4Å; L133-L137 PolarHBondContact O-N 3.4Å; V134-L137 PolarHBondContact O-N 3.29Å; L137-N139 PolarHBondContact O-N 3.37Å; L137-N139 VanDerWaalsContact O-N 3.09Å; L137-R140 PolarHBondContact O-N 3.41Å; L137-L141 HydrophobicContact CB-CD1 3.6Å; L137-L141 HydrophobicContact CD2-CD1 4.12Å; L137-L141 HydrophobicContact CG-CD1 4.36Å; L137-L141 WeakPolarHBondContact O-CD1 3.43Å; L137-L141 PolarHBondContact O-N 3.22Å
138	V	86.5	Confident	84.4	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-59.7	-24.3	177	177.5	0	0	0	0	111.8	L122 V134 R140 V146 I165 H168	L122-V138 HydrophobicContact CD1-CG2 4.06Å; L122-V138 HydrophobicContact CD2-CG2 3.98Å; V134-V138 HydrophobicContact CG1-CG2 4.3Å; V134-V138 WeakPolarHBondContact O-CG2 3.31Å; V134-V138 PolarHBondContact O-N 2.84Å; V138-R140 VanDerWaalsContact C-N 3.33Å; V138-R140 PolarHBondContact O-N 2.94Å; V138-V146 HydrophobicContact CG1-CG1 4.21Å; V138-V146 HydrophobicContact CG1-CG2 4.48Å; V138-V146 HydrophobicContact CG2-CG1 4.43Å; V138-I165 HydrophobicContact CG2-CG1 4.36Å; V138-H168 HydrophobicContact CG1-CB 4.04Å; V138-H168 VanDerWaalsContact CG1-ND1 3.29Å; V138-H168 WeakPolarHBondContact CG1-ND1 3.43Å
139	N	83.6	Confident	84.4	Confident	64 Å²	64	45.4 Å²	45.4	34%	0.342	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-20.3	174.2	-79	-62.7	0	0	0	115	E135 L136 L137 H168 Q170	E135-N139 PolarHBondContact O-N 3.21Å; E135-N139 PolarHBondContact O-ND2 3.41Å; L136-N139 WeakPolarHBondContact O-CB 3.32Å; L136-N139 PolarHBondContact O-N 3.07Å; L137-N139 PolarHBondContact O-N 3.37Å; L137-N139 VanDerWaalsContact O-N 3.09Å; N139-H168 PolarHBondContact ND2-NE2 3.11Å; N139-H168 VanDerWaalsContact ND2-NE2 3.18Å; N139-H168 PolarHBondContact OD1-CE1 3.41Å; N139-H168 PolarHBondContact OD1-NE2 3.07Å; N139-Q170 VanDerWaalsContact OD1-CG 3.24Å; N139-Q170 WeakPolarHBondContact OD1-CG 3.37Å
140	R	83	Confident	84.8	Confident	151 Å²	151	40 Å²	40	57%	0.57	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-118	-22.2	-170.9	-64.8	-62.4	-168.3	-141.6	3.3	114.7	L104 V111 L137 V138	L104-R140 HydrophobicContact CD1-CG 4.22Å; L104-R140 HydrophobicContact CD2-CB 4.06Å; L104-R140 HydrophobicContact CD2-CG 4.19Å; V111-R140 HydrophobicContact CG1-CB 4.25Å; L137-R140 PolarHBondContact O-N 3.41Å; V138-R140 VanDerWaalsContact C-N 3.33Å; V138-R140 PolarHBondContact O-N 2.94Å
141	L	83.6	Confident	84.8	Confident	5 Å²	5	38.5 Å²	38.5	3%	0.026	18%	0.182	C	C	.	.	S	Bend	trans	-79.4	157.4	-177.4	-83	134.2	0	0	0	113.5	V111 L122 L137 A145 V146 M174	V111-L141 HydrophobicContact CG1-CD2 4.43Å; V111-L141 HydrophobicContact CG1-CG 4.02Å; L122-L141 HydrophobicContact CB-CD1 3.85Å; L122-L141 HydrophobicContact CD2-CD1 4.4Å; L137-L141 HydrophobicContact CB-CD1 3.6Å; L137-L141 HydrophobicContact CD2-CD1 4.12Å; L137-L141 HydrophobicContact CG-CD1 4.36Å; L137-L141 WeakPolarHBondContact O-CD1 3.43Å; L137-L141 PolarHBondContact O-N 3.22Å; L141-A145 HydrophobicContact CB-CB 4.49Å; L141-A145 HydrophobicContact CD2-CB 3.74Å; L141-V146 HydrophobicContact CB-CG2 3.88Å; L141-M174 WeakPolarHBondContact O-CE 3.21Å
142	D	82.7	Confident	84.9	Confident	92 Å²	92	36.9 Å²	36.9	49%	0.492	17%	0.174	S	C	.	.			trans	-73.1	158.6	173.9	-77.1	-22.7	0	0	0	112.9	N112 Y144 A145 V146 M174	N112-D142 VanDerWaalsContact ND2-CG 3.29Å; N112-D142 PolarHBondContact ND2-OD2 3.46Å; N112-D142 PolarHBondContact OD1-N 2.99Å; D142-Y144 VanDerWaalsContact C-N 3.33Å; D142-Y144 PolarHBondContact O-N 2.87Å; D142-A145 PolarHBondContact O-N 3.01Å; D142-A145 VanDerWaalsContact O-N 3.12Å; D142-V146 WeakPolarHBondContact O-CG2 3.43Å; D142-V146 PolarHBondContact O-N 3.4Å; D142-V146 VanDerWaalsContact O-N 3.12Å; D142-M174 VanDerWaalsContact C-CE 3.43Å
143	F	82.4	Confident	85.1	Confident	27 Å²	27	32.5 Å²	32.5	12%	0.118	15%	0.15	C	C	.	.	H	α-helix	trans	-55.4	-46.7	-174.4	176.9	-103.1	0	0	0	112.2	A145 V146 E147 Y171 M174 E175 C178	F143-A145 VanDerWaalsContact C-N 3.35Å; F143-A145 PolarHBondContact O-N 3.49Å; F143-V146 PolarHBondContact O-N 2.88Å; F143-E147 WeakPolarHBondContact O-CB 3.43Å; F143-E147 PolarHBondContact O-N 3.3Å; F143-Y171 HydrophobicContact CE2-CE2 4.05Å; F143-M174 HydrophobicContact CB-CB 4.3Å; F143-M174 HydrophobicContact CB-CE 3.84Å; F143-M174 HydrophobicContact CD2-CB 3.68Å; F143-M174 HydrophobicContact CG-CB 4.39Å; F143-E175 HydrophobicContact CE2-CB 4.2Å; F143-C178 VanDerWaalsContact CD1-SG 3.57Å; F143-C178 HydrophobicContact CE1-CB 4.37Å
144	Y	79	Confident	85.3	Confident	124 Å²	124	32.6 Å²	32.6	49%	0.486	15%	0.151	S	C	.	.	H	α-helix	trans	-65.8	-36.7	-178.2	-57.1	-69.6	0	0	0	112.6	D142 V146 E147 D148	D142-Y144 VanDerWaalsContact C-N 3.33Å; D142-Y144 PolarHBondContact O-N 2.87Å; Y144-V146 VanDerWaalsContact C-N 3.31Å; Y144-V146 PolarHBondContact O-N 3.24Å; Y144-E147 PolarHBondContact O-N 3.46Å; Y144-D148 PolarHBondContact O-N 3.42Å
145	A	81	Confident	85.4	Confident	9 Å²	9	34.7 Å²	34.7	7%	0.074	17%	0.166	C	C	.	.	H	α-helix	trans	-68.1	-34.8	177.8	0	0	0	0	0	111.8	N120 L141 D142 F143 A149	N120-A145 WeakPolarHBondContact ND2-CA 3.04Å; N120-A145 VanDerWaalsContact ND2-CB 3.34Å; N120-A145 WeakPolarHBondContact ND2-CB 3.45Å; N120-A145 PolarHBondContact ND2-O 2.93Å; L141-A145 HydrophobicContact CB-CB 4.49Å; L141-A145 HydrophobicContact CD2-CB 3.74Å; D142-A145 PolarHBondContact O-N 3.01Å; D142-A145 VanDerWaalsContact O-N 3.12Å; F143-A145 VanDerWaalsContact C-N 3.35Å; F143-A145 PolarHBondContact O-N 3.49Å; A145-A149 WeakPolarHBondContact O-CB 3.33Å; A145-A149 PolarHBondContact O-N 3.48Å
146	V	85.7	Confident	85.5	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-73.4	-38.2	173.1	-179.1	0	0	0	0	111.3	L122 V138 L141 D142 F143 Y144 A149 L150 I165 Y171	L122-V146 HydrophobicContact CD2-CB 4.45Å; L122-V146 HydrophobicContact CD2-CG1 4.46Å; L122-V146 HydrophobicContact CD2-CG2 4.18Å; V138-V146 HydrophobicContact CG1-CG1 4.21Å; V138-V146 HydrophobicContact CG1-CG2 4.48Å; V138-V146 HydrophobicContact CG2-CG1 4.43Å; L141-V146 HydrophobicContact CB-CG2 3.88Å; D142-V146 WeakPolarHBondContact O-CG2 3.43Å; D142-V146 PolarHBondContact O-N 3.4Å; D142-V146 VanDerWaalsContact O-N 3.12Å; F143-V146 PolarHBondContact O-N 2.88Å; Y144-V146 VanDerWaalsContact C-N 3.31Å; Y144-V146 PolarHBondContact O-N 3.24Å; V146-A149 PolarHBondContact O-N 3.25Å; V146-L150 WeakPolarHBondContact O-CB 3.34Å; V146-L150 PolarHBondContact O-N 2.94Å; V146-I165 HydrophobicContact CG1-CG2 3.83Å; V146-Y171 HydrophobicContact CG1-CD2 3.62Å; V146-Y171 HydrophobicContact CG1-CE2 4.15Å
147	E	83.5	Confident	85.7	Confident	14 Å²	14	36.2 Å²	36.2	7%	0.065	17%	0.172	C	C	.	.	H	α-helix	trans	-65.6	-44	177.3	-167.9	179	-160.4	0	0	111.7	F143 Y144 A149 L150 L151 R192 P204	F143-E147 WeakPolarHBondContact O-CB 3.43Å; F143-E147 PolarHBondContact O-N 3.3Å; Y144-E147 PolarHBondContact O-N 3.46Å; E147-A149 VanDerWaalsContact C-N 3.29Å; E147-A149 PolarHBondContact O-N 3.21Å; E147-L150 WeakPolarHBondContact O-CB 3.5Å; E147-L150 PolarHBondContact O-N 3.17Å; E147-L150 VanDerWaalsContact O-N 3.13Å; E147-L151 WeakPolarHBondContact O-CG 3.5Å; E147-L151 PolarHBondContact O-N 2.86Å; E147-R192 IonicContact OE1-NH2 3.37Å; E147-R192 PolarHBondContact OE1-NH2 3.28Å; E147-R192 IonicContact OE2-CZ 2.9Å; E147-R192 IonicContact OE2-NE 2.69Å; E147-R192 IonicContact OE2-NH2 3.94Å; E147-R192 PolarHBondContact OE2-NH2 2.98Å; E147-P204 HydrophobicContact CG-CG 4.43Å
148	D	83.5	Confident	85.8	Confident	26 Å²	26	38.1 Å²	38.1	14%	0.139	18%	0.18	C	C	.	.	H	α-helix	trans	-61.5	-38.7	173.9	-77.5	-13.4	0	0	0	111.7	Y144 N152 S196	Y144-D148 PolarHBondContact O-N 3.42Å; D148-N152 WeakPolarHBondContact O-CB 3.32Å; D148-N152 PolarHBondContact O-N 3.46Å; D148-S196 VanDerWaalsContact OD1-CB 3.24Å; D148-S196 WeakPolarHBondContact OD1-CB 3.35Å; D148-S196 WeakPolarHBondContact OD2-CB 3.39Å
149	A	86.1	Confident	85.9	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-66.2	-41.7	172.8	0	0	0	0	0	111.9	L122 L123 M126 A145 V146 E147 N152 A153	L122-A149 HydrophobicContact CB-CB 4.23Å; L122-A149 HydrophobicContact CD2-CB 3.38Å; L122-A149 HydrophobicContact CG-CB 3.65Å; L123-A149 HydrophobicContact CD2-CB 4.27Å; L123-A149 HydrophobicContact CG-CB 4.4Å; M126-A149 HydrophobicContact CE-CB 4.12Å; M126-A149 WeakPolarHBondContact CE-O 3.35Å; M126-A149 HydrophobicContact SD-CB 4.4Å; A145-A149 WeakPolarHBondContact O-CB 3.33Å; A145-A149 PolarHBondContact O-N 3.48Å; V146-A149 PolarHBondContact O-N 3.25Å; E147-A149 VanDerWaalsContact C-N 3.29Å; E147-A149 PolarHBondContact O-N 3.21Å; A149-N152 PolarHBondContact O-N 3.46Å; A149-A153 WeakPolarHBondContact O-CB 3.33Å; A149-A153 PolarHBondContact O-N 3.28Å
150	L	89.3	Confident	86.1	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61.3	-45.9	175.3	178.4	62.7	0	0	0	111.2	V146 E147 N152 A153 I154 V162 I165 V166 Y171 P204	V146-L150 WeakPolarHBondContact O-CB 3.34Å; V146-L150 PolarHBondContact O-N 2.94Å; E147-L150 WeakPolarHBondContact O-CB 3.5Å; E147-L150 PolarHBondContact O-N 3.17Å; E147-L150 VanDerWaalsContact O-N 3.13Å; L150-N152 VanDerWaalsContact C-N 3.3Å; L150-N152 PolarHBondContact O-N 3.18Å; L150-A153 WeakPolarHBondContact O-CB 3.31Å; L150-A153 PolarHBondContact O-N 2.89Å; L150-A153 VanDerWaalsContact O-N 3.14Å; L150-I154 HydrophobicContact CD1-CD1 4.23Å; L150-I154 HydrophobicContact CD1-CG1 4.39Å; L150-I154 HydrophobicContact CG-CD1 4.06Å; L150-I154 VanDerWaalsContact O-CG1 3.28Å; L150-I154 WeakPolarHBondContact O-CG1 3.49Å; L150-I154 PolarHBondContact O-N 3.07Å; L150-V162 HydrophobicContact CD1-CG1 4.03Å; L150-V162 HydrophobicContact CD1-CG2 4.44Å; L150-I165 HydrophobicContact CB-CG2 4.29Å; L150-I165 HydrophobicContact CD1-CB 4.33Å; L150-I165 HydrophobicContact CD1-CG2 4.11Å; L150-V166 HydrophobicContact CD1-CG2 3.88Å; L150-V166 HydrophobicContact CD2-CG2 4.29Å; L150-Y171 HydrophobicContact CD2-CE1 4.33Å; L150-Y171 HydrophobicContact CD2-CE2 4.19Å; L150-Y171 WeakPolarHBondContact CD2-OH 3.46Å; L150-P204 HydrophobicContact CD2-CB 4.15Å; L150-P204 HydrophobicContact CD2-CG 4.24Å
151	L	88.4	Confident	86.3	Confident	5 Å²	5	35.7 Å²	35.7	3%	0.026	17%	0.174	C	C	.	.	H	α-helix	trans	-59.6	-40.9	176.1	-69.1	172.7	0	0	0	111.3	E147 I154 S155 F198 I202 P204 L207	E147-L151 WeakPolarHBondContact O-CG 3.5Å; E147-L151 PolarHBondContact O-N 2.86Å; L151-I154 PolarHBondContact O-N 2.97Å; L151-S155 WeakPolarHBondContact O-CB 3.23Å; L151-S155 PolarHBondContact O-N 3.33Å; L151-F198 HydrophobicContact CB-CD2 3.6Å; L151-F198 HydrophobicContact CB-CE2 3.5Å; L151-F198 VanDerWaalsContact CB-CE2 3.5Å; L151-F198 HydrophobicContact CB-CG 4.27Å; L151-F198 HydrophobicContact CB-CZ 4.1Å; L151-F198 HydrophobicContact CD1-CB 4.12Å; L151-F198 HydrophobicContact CD1-CD2 3.84Å; L151-F198 HydrophobicContact CD1-CG 4.12Å; L151-F198 HydrophobicContact CG-CD2 4.36Å; L151-I202 HydrophobicContact CD2-CG2 4.49Å; L151-P204 HydrophobicContact CD2-CB 4.32Å; L151-P204 HydrophobicContact CD2-CG 4.2Å; L151-L207 HydrophobicContact CB-CD2 3.94Å; L151-L207 HydrophobicContact CD2-CB 4.16Å; L151-L207 HydrophobicContact CD2-CD2 3.75Å; L151-L207 HydrophobicContact CG-CD2 4.46Å; L151-L207 WeakPolarHBondContact O-CD2 3.4Å
152	N	88.2	Confident	86.6	Confident	28 Å²	28	35.4 Å²	35.4	15%	0.15	17%	0.173	C	C	.	.	H	α-helix	trans	-71.2	-31.6	175.4	-166.5	32.8	0	0	0	113.3	L123 M126 D148 A149 L150 I154 S155 Q156 F198	L123-N152 HydrophobicContact CD2-CB 3.54Å; L123-N152 WeakPolarHBondContact CD2-ND2 3.4Å; M126-N152 HydrophobicContact CE-CB 4.17Å; D148-N152 WeakPolarHBondContact O-CB 3.32Å; D148-N152 PolarHBondContact O-N 3.46Å; A149-N152 PolarHBondContact O-N 3.46Å; L150-N152 VanDerWaalsContact C-N 3.3Å; L150-N152 PolarHBondContact O-N 3.18Å; N152-I154 VanDerWaalsContact C-N 3.34Å; N152-S155 WeakPolarHBondContact CA-OG 3.46Å; N152-S155 PolarHBondContact O-N 2.86Å; N152-S155 PolarHBondContact O-OG 3.41Å; N152-S155 PolarHBondContact OD1-OG 2.91Å; N152-Q156 VanDerWaalsContact CG-NE2 3.3Å; N152-Q156 PolarHBondContact ND2-NE2 3.21Å; N152-Q156 WeakPolarHBondContact O-CB 3.49Å; N152-Q156 VanDerWaalsContact O-CG 3.29Å; N152-Q156 WeakPolarHBondContact O-CG 3.39Å; N152-Q156 PolarHBondContact O-N 2.83Å; N152-Q156 VanDerWaalsContact O-N 3.11Å; N152-Q156 PolarHBondContact OD1-NE2 3.27Å; N152-F198 HydrophobicContact CB-CE2 4.35Å
153	A	89.6	Confident	86.9	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-66.7	-39.5	173.1	0	0	0	0	0	111.2	M126 A149 L150 Q157 K158 L161 V162 I165	M126-A153 HydrophobicContact CE-CB 4.13Å; M126-A153 HydrophobicContact SD-CB 3.8Å; A149-A153 WeakPolarHBondContact O-CB 3.33Å; A149-A153 PolarHBondContact O-N 3.28Å; L150-A153 WeakPolarHBondContact O-CB 3.31Å; L150-A153 PolarHBondContact O-N 2.89Å; L150-A153 VanDerWaalsContact O-N 3.14Å; A153-Q157 PolarHBondContact O-N 2.92Å; A153-K158 PolarHBondContact O-N 3.44Å; A153-L161 HydrophobicContact CB-CB 4.4Å; A153-V162 HydrophobicContact CB-CG2 3.72Å; A153-I165 HydrophobicContact CB-CD1 4.45Å
154	I	91	Very high	87.2	Confident	1 Å²	1	37 Å²	37	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-66.4	-45.9	174.6	-66.2	171.1	0	0	0	110.3	L150 L151 N152 Q156 Q157 V162 P204 L207 A208 I211 I216	L150-I154 HydrophobicContact CD1-CD1 4.23Å; L150-I154 HydrophobicContact CD1-CG1 4.39Å; L150-I154 HydrophobicContact CG-CD1 4.06Å; L150-I154 VanDerWaalsContact O-CG1 3.28Å; L150-I154 WeakPolarHBondContact O-CG1 3.49Å; L150-I154 PolarHBondContact O-N 3.07Å; L151-I154 PolarHBondContact O-N 2.97Å; N152-I154 VanDerWaalsContact C-N 3.34Å; I154-Q156 VanDerWaalsContact C-N 3.25Å; I154-Q156 PolarHBondContact O-N 3Å; I154-Q157 WeakPolarHBondContact O-CA 3.44Å; I154-Q157 PolarHBondContact O-N 3.41Å; I154-V162 HydrophobicContact CG1-CG1 4.22Å; I154-V162 HydrophobicContact CG1-CG2 3.74Å; I154-P204 HydrophobicContact CD1-CB 4Å; I154-L207 HydrophobicContact CB-CD2 4.3Å; I154-L207 HydrophobicContact CG2-CB 4.23Å; I154-L207 HydrophobicContact CG2-CD2 4.19Å; I154-L207 HydrophobicContact CG2-CG 3.93Å; I154-A208 HydrophobicContact CG2-CB 4.02Å; I154-I211 HydrophobicContact CG2-CD1 3.92Å; I154-I211 WeakPolarHBondContact O-CD1 3.29Å; I154-I216 HydrophobicContact CD1-CG2 4.44Å; I154-I216 HydrophobicContact CG1-CG2 4.2Å
155	S	89.5	Confident	87.6	Confident	45 Å²	45	31 Å²	31	32%	0.315	15%	0.153	S	C	.	.	H	α-helix	trans	-58.5	-36.9	178.2	77.9	0	0	0	0	112.7	L151 N152 Q157	L151-S155 WeakPolarHBondContact O-CB 3.23Å; L151-S155 PolarHBondContact O-N 3.33Å; N152-S155 WeakPolarHBondContact CA-OG 3.46Å; N152-S155 PolarHBondContact O-N 2.86Å; N152-S155 PolarHBondContact O-OG 3.41Å; N152-S155 PolarHBondContact OD1-OG 2.91Å; S155-Q157 VanDerWaalsContact C-N 3.28Å; S155-Q157 PolarHBondContact O-N 2.91Å
156	Q	89	Confident	87.8	Confident	79 Å²	79	30.7 Å²	30.7	37%	0.369	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	2.3	176	-65.5	174.6	32	0	0	113.8	N152 I154 K158	N152-Q156 VanDerWaalsContact CG-NE2 3.3Å; N152-Q156 PolarHBondContact ND2-NE2 3.21Å; N152-Q156 WeakPolarHBondContact O-CB 3.49Å; N152-Q156 VanDerWaalsContact O-CG 3.29Å; N152-Q156 WeakPolarHBondContact O-CG 3.39Å; N152-Q156 PolarHBondContact O-N 2.83Å; N152-Q156 VanDerWaalsContact O-N 3.11Å; N152-Q156 PolarHBondContact OD1-NE2 3.27Å; I154-Q156 VanDerWaalsContact C-N 3.25Å; I154-Q156 PolarHBondContact O-N 3Å; Q156-K158 HydrophobicContact CB-CD 4.26Å; Q156-K158 HydrophobicContact CB-CG 3.97Å; Q156-K158 PolarHBondContact O-N 3.35Å
157	Q	88.2	Confident	87.8	Confident	91 Å²	91	34.1 Å²	34.1	43%	0.425	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	28.4	-179.7	-55.6	-178	17.9	0	0	114.2	A153 I154 S155 N159 I211	A153-Q157 PolarHBondContact O-N 2.92Å; I154-Q157 WeakPolarHBondContact O-CA 3.44Å; I154-Q157 PolarHBondContact O-N 3.41Å; S155-Q157 VanDerWaalsContact C-N 3.28Å; S155-Q157 PolarHBondContact O-N 2.91Å; Q157-N159 PolarHBondContact O-N 3.35Å; Q157-I211 HydrophobicContact CG-CG2 3.68Å; Q157-I211 VanDerWaalsContact NE2-CG2 3.25Å
158	K	88.5	Confident	87.9	Confident	39 Å²	39	33.8 Å²	33.8	17%	0.17	17%	0.167	C	C	.	.			trans	-83.1	79	-178.5	-66.9	-173.2	179.1	-165.3	0	111	M126 E129 A153 Q156 H160 L161 V162	M126-K158 PolarHBondContact O-NZ 3.01Å; M126-K158 VanDerWaalsContact O-NZ 3.11Å; E129-K158 HydrophobicContact CG-CD 4.44Å; E129-K158 VanDerWaalsContact CG-NZ 3.29Å; E129-K158 WeakPolarHBondContact OE1-CE 3.15Å; E129-K158 IonicContact OE1-NZ 3.57Å; E129-K158 PolarHBondContact OE1-NZ 2.89Å; A153-K158 PolarHBondContact O-N 3.44Å; Q156-K158 HydrophobicContact CB-CD 4.26Å; Q156-K158 HydrophobicContact CB-CG 3.97Å; Q156-K158 PolarHBondContact O-N 3.35Å; K158-H160 PolarHBondContact O-N 3.39Å; K158-H160 VanDerWaalsContact O-N 3.14Å; K158-L161 HydrophobicContact CB-CB 4.19Å; K158-L161 HydrophobicContact CB-CD1 4.06Å; K158-L161 HydrophobicContact CB-CG 4.26Å; K158-L161 HydrophobicContact CD-CD1 3.53Å; K158-L161 HydrophobicContact CD-CG 4.47Å; K158-L161 HydrophobicContact CG-CD1 4.44Å; K158-L161 PolarHBondContact O-N 3.23Å; K158-L161 VanDerWaalsContact O-N 3.15Å; K158-V162 WeakPolarHBondContact O-CG2 3.03Å; K158-V162 PolarHBondContact O-N 3.22Å
159	N	87.9	Confident	87.8	Confident	42 Å²	42	36.7 Å²	36.7	23%	0.225	19%	0.187	C	C	.	.	H	α-helix	trans	-48.9	-42.3	-177.3	-64	-28.3	0	0	0	113.6	Q157 V162 K163 N213 E215 I216 K957	Q157-N159 PolarHBondContact O-N 3.35Å; N159-V162 PolarHBondContact O-N 2.99Å; N159-K163 WeakPolarHBondContact O-CB 3.43Å; N159-K163 PolarHBondContact O-N 3.14Å; N159-N213 PolarHBondContact OD1-ND2 3.46Å; N159-E215 VanDerWaalsContact CG-OE2 3.31Å; N159-E215 PolarHBondContact ND2-OE1 3.06Å; N159-E215 PolarHBondContact ND2-OE2 2.93Å; N159-I216 WeakPolarHBondContact OD1-CG1 3.37Å; N159-K957 PolarHBondContact ND2-NZ 3.38Å
160	H	87.9	Confident	87.5	Confident	118 Å²	118	39.4 Å²	39.4	55%	0.546	20%	0.2	S	C	.	.	H	α-helix	trans	-68.4	-42.2	-176.9	-168.5	70	0	0	0	112.7	L131 K158 K163 L164	L131-H160 WeakPolarHBondContact CD1-NE2 3.36Å; K158-H160 PolarHBondContact O-N 3.39Å; K158-H160 VanDerWaalsContact O-N 3.14Å; H160-K163 PolarHBondContact O-N 3.39Å; H160-L164 WeakPolarHBondContact O-CB 3.26Å; H160-L164 PolarHBondContact O-N 3.47Å
161	L	88.6	Confident	87.2	Confident	4 Å²	4	40 Å²	40	2%	0.021	20%	0.202	C	C	.	.	H	α-helix	trans	-67.2	-42	175.8	-67.2	-178.5	0	0	0	111.5	M126 L131 V134 A153 K158 K163 L164 I165	M126-L161 HydrophobicContact CB-CD1 4.1Å; M126-L161 HydrophobicContact CG-CD1 4.1Å; M126-L161 HydrophobicContact SD-CD1 4.19Å; L131-L161 HydrophobicContact CD2-CD2 3.61Å; V134-L161 HydrophobicContact CG2-CD2 4.43Å; A153-L161 HydrophobicContact CB-CB 4.4Å; K158-L161 HydrophobicContact CB-CB 4.19Å; K158-L161 HydrophobicContact CB-CD1 4.06Å; K158-L161 HydrophobicContact CB-CG 4.26Å; K158-L161 HydrophobicContact CD-CD1 3.53Å; K158-L161 HydrophobicContact CD-CG 4.47Å; K158-L161 HydrophobicContact CG-CD1 4.44Å; K158-L161 PolarHBondContact O-N 3.23Å; K158-L161 VanDerWaalsContact O-N 3.15Å; L161-K163 VanDerWaalsContact C-N 3.3Å; L161-K163 PolarHBondContact O-N 3.22Å; L161-L164 PolarHBondContact O-N 3.41Å; L161-I165 VanDerWaalsContact O-CG1 3.31Å; L161-I165 WeakPolarHBondContact O-CG1 3.26Å; L161-I165 PolarHBondContact O-N 3.34Å
162	V	89.4	Confident	86.9	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-59.7	-45.3	175.7	174.9	0	0	0	0	110.1	L150 A153 I154 K158 N159 L164 I165 V166 I216 L219	L150-V162 HydrophobicContact CD1-CG1 4.03Å; L150-V162 HydrophobicContact CD1-CG2 4.44Å; A153-V162 HydrophobicContact CB-CG2 3.72Å; I154-V162 HydrophobicContact CG1-CG1 4.22Å; I154-V162 HydrophobicContact CG1-CG2 3.74Å; K158-V162 WeakPolarHBondContact O-CG2 3.03Å; K158-V162 PolarHBondContact O-N 3.22Å; N159-V162 PolarHBondContact O-N 2.99Å; V162-L164 PolarHBondContact O-N 2.8Å; V162-I165 PolarHBondContact O-N 3.27Å; V162-V166 HydrophobicContact CG1-CG2 4.14Å; V162-V166 VanDerWaalsContact O-CB 3.23Å; V162-V166 WeakPolarHBondContact O-CB 3.18Å; V162-V166 WeakPolarHBondContact O-CG2 3.41Å; V162-V166 PolarHBondContact O-N 2.94Å; V162-I216 HydrophobicContact CG1-CG1 4.39Å; V162-I216 HydrophobicContact CG1-CG2 3.98Å; V162-I216 HydrophobicContact CG2-CD1 4.2Å; V162-L219 HydrophobicContact CG1-CD2 4.23Å
163	K	88.7	Confident	86.6	Confident	113 Å²	113	47.3 Å²	47.3	49%	0.491	23%	0.23	S	C	.	.	H	α-helix	trans	-59.4	-46.9	175.2	-170.8	173.5	-178.5	176.3	0	112.2	N159 H160 L161 D167 L219	N159-K163 WeakPolarHBondContact O-CB 3.43Å; N159-K163 PolarHBondContact O-N 3.14Å; H160-K163 PolarHBondContact O-N 3.39Å; L161-K163 VanDerWaalsContact C-N 3.3Å; L161-K163 PolarHBondContact O-N 3.22Å; K163-D167 WeakPolarHBondContact CE-OD2 3.42Å; K163-D167 VanDerWaalsContact CG-OD2 3.24Å; K163-D167 WeakPolarHBondContact CG-OD2 3.24Å; K163-D167 WeakPolarHBondContact O-CB 3.44Å; K163-D167 VanDerWaalsContact O-CG 3.3Å; K163-D167 PolarHBondContact O-N 2.98Å; K163-L219 HydrophobicContact CB-CD2 4.09Å; K163-L219 HydrophobicContact CG-CD1 4.34Å; K163-L219 HydrophobicContact CG-CD2 4.31Å
164	L	87.7	Confident	86.1	Confident	38 Å²	38	48.8 Å²	48.8	20%	0.199	24%	0.237	C	C	.	.	H	α-helix	trans	-61.4	-47.2	178.6	-173.8	152	0	0	0	112.2	L131 V134 E135 H160 L161 V162 H168	L131-L164 HydrophobicContact CB-CD1 4.22Å; L131-L164 HydrophobicContact CD2-CD1 4.37Å; V134-L164 HydrophobicContact CB-CD2 4.42Å; V134-L164 HydrophobicContact CG1-CD2 3.67Å; E135-L164 HydrophobicContact CB-CD2 4.45Å; H160-L164 WeakPolarHBondContact O-CB 3.26Å; H160-L164 PolarHBondContact O-N 3.47Å; L161-L164 PolarHBondContact O-N 3.41Å; V162-L164 PolarHBondContact O-N 2.8Å; L164-H168 WeakPolarHBondContact O-CB 3.5Å; L164-H168 PolarHBondContact O-N 3.08Å; L164-H168 VanDerWaalsContact O-N 3.11Å
165	I	88.3	Confident	85.6	Confident	0 Å²	0	50 Å²	50	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-66.5	-45.1	-179.5	-65.7	167.4	0	0	0	110.8	M126 V134 V138 V146 L150 A153 L161 V162 H168 Y171	M126-I165 HydrophobicContact SD-CD1 3.89Å; V134-I165 HydrophobicContact CG1-CD1 4.46Å; V134-I165 HydrophobicContact CG1-CG1 4.07Å; V138-I165 HydrophobicContact CG2-CG1 4.36Å; V146-I165 HydrophobicContact CG1-CG2 3.83Å; L150-I165 HydrophobicContact CB-CG2 4.29Å; L150-I165 HydrophobicContact CD1-CB 4.33Å; L150-I165 HydrophobicContact CD1-CG2 4.11Å; A153-I165 HydrophobicContact CB-CD1 4.45Å; L161-I165 VanDerWaalsContact O-CG1 3.31Å; L161-I165 WeakPolarHBondContact O-CG1 3.26Å; L161-I165 PolarHBondContact O-N 3.34Å; V162-I165 PolarHBondContact O-N 3.27Å; I165-H168 VanDerWaalsContact O-CB 3.29Å; I165-H168 WeakPolarHBondContact O-CB 3.36Å; I165-H168 PolarHBondContact O-N 3.36Å; I165-Y171 HydrophobicContact CG2-CD2 4.43Å; I165-Y171 WeakPolarHBondContact O-CB 3.29Å
166	V	85.7	Confident	85	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.012	26%	0.259	C	S	.	.	H	α-helix	trans	-68.1	-41.1	-179.2	171.5	0	0	0	0	110.9	L150 V162 H168 L219 L220 R223	L150-V166 HydrophobicContact CD1-CG2 3.88Å; L150-V166 HydrophobicContact CD2-CG2 4.29Å; V162-V166 HydrophobicContact CG1-CG2 4.14Å; V162-V166 VanDerWaalsContact O-CB 3.23Å; V162-V166 WeakPolarHBondContact O-CB 3.18Å; V162-V166 WeakPolarHBondContact O-CG2 3.41Å; V162-V166 PolarHBondContact O-N 2.94Å; V166-H168 PolarHBondContact O-N 3.39Å; V166-L219 HydrophobicContact CB-CD2 4.19Å; V166-L219 HydrophobicContact CG1-CD2 4.27Å; V166-L219 HydrophobicContact CG1-CG 4.41Å; V166-L220 HydrophobicContact CG2-CD2 4.19Å; V166-R223 PolarHBondContact O-NH1 2.95Å; V166-R223 PolarHBondContact O-NH2 3.48Å
167	D	85.3	Confident	84.3	Confident	71 Å²	71	56.6 Å²	56.6	38%	0.38	27%	0.267	S	S	.	.	H	α-helix	trans	-72.7	-10.6	177	-67.9	-22	0	0	0	114	K163 R223	K163-D167 WeakPolarHBondContact CE-OD2 3.42Å; K163-D167 VanDerWaalsContact CG-OD2 3.24Å; K163-D167 WeakPolarHBondContact CG-OD2 3.24Å; K163-D167 WeakPolarHBondContact O-CB 3.44Å; K163-D167 VanDerWaalsContact O-CG 3.3Å; K163-D167 PolarHBondContact O-N 2.98Å; D167-R223 VanDerWaalsContact CA-NH2 3.3Å; D167-R223 IonicContact OD1-CZ 2.72Å; D167-R223 IonicContact OD1-NH2 3.78Å; D167-R223 PolarHBondContact OD1-NH2 3.44Å
168	H	84.7	Confident	83.1	Confident	8 Å²	8	54.1 Å²	54.1	4%	0.037	26%	0.259	C	S	.	.			trans	-68.8	129.6	-178.5	-164.8	-93.7	0	0	0	113.1	V138 N139 L164 I165 V166 Q170 Y171 I172	V138-H168 HydrophobicContact CG1-CB 4.04Å; V138-H168 VanDerWaalsContact CG1-ND1 3.29Å; V138-H168 WeakPolarHBondContact CG1-ND1 3.43Å; N139-H168 PolarHBondContact ND2-NE2 3.11Å; N139-H168 VanDerWaalsContact ND2-NE2 3.18Å; N139-H168 PolarHBondContact OD1-CE1 3.41Å; N139-H168 PolarHBondContact OD1-NE2 3.07Å; L164-H168 WeakPolarHBondContact O-CB 3.5Å; L164-H168 PolarHBondContact O-N 3.08Å; L164-H168 VanDerWaalsContact O-N 3.11Å; I165-H168 VanDerWaalsContact O-CB 3.29Å; I165-H168 WeakPolarHBondContact O-CB 3.36Å; I165-H168 PolarHBondContact O-N 3.36Å; V166-H168 PolarHBondContact O-N 3.39Å; H168-Q170 VanDerWaalsContact C-N 3.34Å; H168-Q170 PolarHBondContact ND1-N 2.87Å; H168-Q170 PolarHBondContact O-N 2.97Å; H168-Y171 PolarHBondContact O-N 3.18Å; H168-Y171 VanDerWaalsContact O-N 3.17Å; H168-I172 WeakPolarHBondContact O-CG1 3.43Å; H168-I172 PolarHBondContact O-N 3.31Å
169	P	82.4	Confident	81.7	Confident	87 Å²	87	57.7 Å²	57.7	57%	0.565	27%	0.274	S	S	*	.	H	α-helix	trans	-64.2	-32.9	-172.8	24.5	-35	0	0	0	114	R173	P169-R173 PolarHBondContact O-N 3.17Å; P169-R173 VanDerWaalsContact O-N 3.11Å
170	Q	79.2	Confident	80	Confident	56 Å²	56	60.3 Å²	60.3	26%	0.262	30%	0.296	S	S	.	.	H	α-helix	trans	-69.4	-40	176.9	-61.7	-59.6	-17.4	0	0	111.7	N139 H168 I172 R173 M174	N139-Q170 VanDerWaalsContact OD1-CG 3.24Å; N139-Q170 WeakPolarHBondContact OD1-CG 3.37Å; H168-Q170 VanDerWaalsContact C-N 3.34Å; H168-Q170 PolarHBondContact ND1-N 2.87Å; H168-Q170 PolarHBondContact O-N 2.97Å; Q170-I172 VanDerWaalsContact C-N 3.29Å; Q170-I172 PolarHBondContact O-N 3.44Å; Q170-R173 PolarHBondContact O-N 3.07Å; Q170-R173 VanDerWaalsContact O-N 3.14Å; Q170-M174 HydrophobicContact CB-SD 4.31Å; Q170-M174 WeakPolarHBondContact O-CB 3.44Å; Q170-M174 WeakPolarHBondContact O-CG 3.3Å; Q170-M174 PolarHBondContact O-N 2.9Å; Q170-M174 VanDerWaalsContact O-SD 3.42Å
171	Y	83.8	Confident	78	Confident	13 Å²	13	62.8 Å²	62.8	5%	0.051	31%	0.305	C	S	.	.	H	α-helix	trans	-59.9	-43.9	177.6	179.3	-101.9	0	0	0	110.6	F143 V146 L150 I165 H168 R173 M174 E175	F143-Y171 HydrophobicContact CE2-CE2 4.05Å; V146-Y171 HydrophobicContact CG1-CD2 3.62Å; V146-Y171 HydrophobicContact CG1-CE2 4.15Å; L150-Y171 HydrophobicContact CD2-CE1 4.33Å; L150-Y171 HydrophobicContact CD2-CE2 4.19Å; L150-Y171 WeakPolarHBondContact CD2-OH 3.46Å; I165-Y171 HydrophobicContact CG2-CD2 4.43Å; I165-Y171 WeakPolarHBondContact O-CB 3.29Å; H168-Y171 PolarHBondContact O-N 3.18Å; H168-Y171 VanDerWaalsContact O-N 3.17Å; Y171-R173 PolarHBondContact O-N 3.43Å; Y171-M174 PolarHBondContact O-N 3.44Å; Y171-E175 WeakPolarHBondContact O-CB 3.39Å; Y171-E175 PolarHBondContact O-N 3.49Å
172	I	81.1	Confident	75.9	Confident	44 Å²	44	68.2 Å²	68.2	23%	0.226	34%	0.339	C	S	.	.	H	α-helix	trans	-59.9	-44.3	175.5	-59.4	175.3	0	0	0	112	H168 Q170 K176	H168-I172 WeakPolarHBondContact O-CG1 3.43Å; H168-I172 PolarHBondContact O-N 3.31Å; Q170-I172 VanDerWaalsContact C-N 3.29Å; Q170-I172 PolarHBondContact O-N 3.44Å; I172-K176 HydrophobicContact CG2-CD 4.38Å; I172-K176 WeakPolarHBondContact O-CG 3.46Å; I172-K176 PolarHBondContact O-N 3.2Å; I172-K176 VanDerWaalsContact O-N 3.17Å
173	R	82.2	Confident	73.4	Confident	143 Å²	143	73.9 Å²	73.9	54%	0.54	38%	0.378	S	S	.	.	H	α-helix	trans	-63.4	-45.1	178.3	178.1	-177.5	-83	166.3	-8.4	110.7	P169 Q170 Y171 K176 Q177	P169-R173 PolarHBondContact O-N 3.17Å; P169-R173 VanDerWaalsContact O-N 3.11Å; Q170-R173 PolarHBondContact O-N 3.07Å; Q170-R173 VanDerWaalsContact O-N 3.14Å; Y171-R173 PolarHBondContact O-N 3.43Å; R173-K176 PolarHBondContact O-N 3.2Å; R173-Q177 VanDerWaalsContact O-CG 3.32Å; R173-Q177 WeakPolarHBondContact O-CG 3.31Å; R173-Q177 PolarHBondContact O-N 3.45Å; R173-Q177 VanDerWaalsContact O-N 3.09Å
174	M	79.8	Confident	70.5	Confident	30 Å²	30	70.7 Å²	70.7	15%	0.148	38%	0.377	C	S	.	.	H	α-helix	trans	-67	-41.5	-178.6	-64.5	160.5	88.7	0	0	111.5	L141 D142 F143 Q170 Y171 K176 Q177 C178	L141-M174 WeakPolarHBondContact O-CE 3.21Å; D142-M174 VanDerWaalsContact C-CE 3.43Å; F143-M174 HydrophobicContact CB-CB 4.3Å; F143-M174 HydrophobicContact CB-CE 3.84Å; F143-M174 HydrophobicContact CD2-CB 3.68Å; F143-M174 HydrophobicContact CG-CB 4.39Å; Q170-M174 HydrophobicContact CB-SD 4.31Å; Q170-M174 WeakPolarHBondContact O-CB 3.44Å; Q170-M174 WeakPolarHBondContact O-CG 3.3Å; Q170-M174 PolarHBondContact O-N 2.9Å; Q170-M174 VanDerWaalsContact O-SD 3.42Å; Y171-M174 PolarHBondContact O-N 3.44Å; M174-K176 PolarHBondContact O-N 3.2Å; M174-Q177 PolarHBondContact O-N 3.4Å; M174-C178 PolarHBondContact O-N 3.28Å
175	E	79.2	Confident	67.9	Low	28 Å²	28	74.5 Å²	74.5	13%	0.131	40%	0.404	C	S	.	.	H	α-helix	trans	-59.8	-47	175.9	-169.4	-163.6	170	0	0	111.6	F143 Y171 Q177 C178 K179	F143-E175 HydrophobicContact CE2-CB 4.2Å; Y171-E175 WeakPolarHBondContact O-CB 3.39Å; Y171-E175 PolarHBondContact O-N 3.49Å; E175-Q177 VanDerWaalsContact C-N 3.33Å; E175-Q177 PolarHBondContact O-N 3.3Å; E175-C178 PolarHBondContact O-N 3.35Å; E175-K179 WeakPolarHBondContact O-CG 3.4Å; E175-K179 PolarHBondContact O-N 3.43Å; E175-K179 WeakPolarHBondContact OE1-CE 3.48Å; E175-K179 IonicContact OE1-NZ 3.62Å; E175-K179 PolarHBondContact OE1-NZ 3.45Å
176	K	76.9	Confident	65.2	Low	146 Å²	146	79.8 Å²	79.8	64%	0.635	44%	0.441	S	S	*	.	H	α-helix	trans	-62.6	-38.6	177.1	-72	178.9	-178.5	-177.6	0	112.2	I172 R173 M174 S180	I172-K176 HydrophobicContact CG2-CD 4.38Å; I172-K176 WeakPolarHBondContact O-CG 3.46Å; I172-K176 PolarHBondContact O-N 3.2Å; I172-K176 VanDerWaalsContact O-N 3.17Å; R173-K176 PolarHBondContact O-N 3.2Å; M174-K176 PolarHBondContact O-N 3.2Å; K176-S180 PolarHBondContact O-N 2.88Å
177	Q	74.5	Confident	62.7	Low	115 Å²	115	86 Å²	86	54%	0.537	49%	0.485	S	S	.	.	H	α-helix	trans	-68	-38.6	176.4	-73.9	177.5	-1	0	0	112.4	R173 M174 E175 S180	R173-Q177 VanDerWaalsContact O-CG 3.32Å; R173-Q177 WeakPolarHBondContact O-CG 3.31Å; R173-Q177 PolarHBondContact O-N 3.45Å; R173-Q177 VanDerWaalsContact O-N 3.09Å; M174-Q177 PolarHBondContact O-N 3.4Å; E175-Q177 VanDerWaalsContact C-N 3.33Å; E175-Q177 PolarHBondContact O-N 3.3Å; Q177-S180 PolarHBondContact O-N 3.44Å
178	C	63.4	Low	60.2	Low	39 Å²	39	84.6 Å²	84.6	26%	0.264	49%	0.487	S	S	.	.	H	α-helix	trans	-66.4	-45.3	174.9	-75.9	0	0	0	0	111.7	F143 M174 E175 S180 K181 V182	F143-C178 VanDerWaalsContact CD1-SG 3.57Å; F143-C178 HydrophobicContact CE1-CB 4.37Å; M174-C178 PolarHBondContact O-N 3.28Å; E175-C178 PolarHBondContact O-N 3.35Å; C178-S180 PolarHBondContact O-N 3.14Å; C178-K181 PolarHBondContact O-N 3.41Å; C178-V182 PolarHBondContact O-N 3.31Å
179	K	59.7	Low	58.1	Low	114 Å²	114	90 Å²	90	50%	0.496	52%	0.52	S	S	.	.	H	α-helix	trans	-56.3	-38.1	176.1	-73.2	179.8	-175.5	171.3	0	112.3	E175 K181 V182	E175-K179 WeakPolarHBondContact O-CG 3.4Å; E175-K179 PolarHBondContact O-N 3.43Å; E175-K179 WeakPolarHBondContact OE1-CE 3.48Å; E175-K179 IonicContact OE1-NZ 3.62Å; E175-K179 PolarHBondContact OE1-NZ 3.45Å; K179-K181 VanDerWaalsContact C-N 3.25Å; K179-K181 PolarHBondContact O-N 2.89Å; K179-V182 PolarHBondContact O-N 2.72Å
180	S	52.7	Low	56.1	Low	97 Å²	97	91.9 Å²	91.9	68%	0.678	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-19.9	177.2	-175.2	0	0	0	0	114.4	K176 Q177 C178	K176-S180 PolarHBondContact O-N 2.88Å; Q177-S180 PolarHBondContact O-N 3.44Å; C178-S180 PolarHBondContact O-N 3.14Å
181	K	45.4	Very low	54.4	Low	170 Å²	170	95.8 Å²	95.8	74%	0.739	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-12	-179	-72.3	-176.8	178.8	177.8	0	113.8	C178 K179 S183 G184	C178-K181 PolarHBondContact O-N 3.41Å; K179-K181 VanDerWaalsContact C-N 3.25Å; K179-K181 PolarHBondContact O-N 2.89Å; K181-S183 VanDerWaalsContact C-N 3.32Å; K181-S183 PolarHBondContact O-N 3.08Å; K181-G184 PolarHBondContact O-N 2.67Å
182	V	44.4	Very low	52.8	Low	119 Å²	119	98.8 Å²	98.8	72%	0.721	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	-21.1	-177.9	177.5	0	0	0	0	112.7	C178 K179 G184	C178-V182 PolarHBondContact O-N 3.31Å; K179-V182 PolarHBondContact O-N 2.72Å; V182-G184 PolarHBondContact O-N 2.91Å
183	S	36	Very low	51.3	Low	118 Å²	118	100.8 Å²	100.8	83%	0.825	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	4.5	173.4	-48.1	0	0	0	0	114.4	K181	K181-S183 VanDerWaalsContact C-N 3.32Å; K181-S183 PolarHBondContact O-N 3.08Å
184	G	27.8	Very low	49.7	Very low	46 Å²	46	102.8 Å²	102.8	47%	0.474	59%	0.59	S	S	.	*	S	Bend	trans	-108.1	128.8	174.7	0	0	0	0	0	111.7	K181 V182 S186	K181-G184 PolarHBondContact O-N 2.67Å; V182-G184 PolarHBondContact O-N 2.91Å; G184-S186 PolarHBondContact O-N 3.26Å
185	P	32.9	Very low	48.6	Very low	118 Å²	118	110.7 Å²	110.7	77%	0.766	62%	0.618	S	S	*	*			trans	-71	131.9	172.6	30.9	-30.7	0	0	0	108.9
186	S	32.5	Very low	47.8	Very low	111 Å²	111	110.5 Å²	110.5	78%	0.776	62%	0.62	S	S	*	*	S	Bend	trans	74.9	104.6	164.1	-41.9	0	0	0	0	117.8	G184	G184-S186 PolarHBondContact O-N 3.26Å
187	S	34	Very low	47.4	Very low	134 Å²	134	109.5 Å²	109.5	94%	0.937	62%	0.618	S	S	*	*	S	Bend	trans	-174.6	-12.8	139.5	-123	0	0	0	0	116.5
188	G	32.8	Very low	47.4	Very low	41 Å²	41	106 Å²	106	42%	0.423	60%	0.601	S	S	.	*	S	Bend	trans	-118.9	-13	-168.4	0	0	0	0	0	117.8	N190 N191	G188-N190 PolarHBondContact O-N 3.19Å; G188-N190 VanDerWaalsContact O-N 3.09Å; G188-N191 PolarHBondContact O-N 3.33Å
189	T	40.4	Very low	48	Very low	120 Å²	120	106.2 Å²	106.2	74%	0.736	60%	0.603	S	S	*	*	H	α-helix	trans	-61.6	-25.6	-167.1	7.9	0	0	0	0	114	N191	T189-N191 PolarHBondContact O-N 3.21Å
190	N	40.1	Very low	48.5	Very low	128 Å²	128	103 Å²	103	68%	0.684	60%	0.595	S	S	*	*	H	α-helix	trans	-77.4	-17.9	-176.6	-73.4	-14	0	0	0	115.3	G188	G188-N190 PolarHBondContact O-N 3.19Å; G188-N190 VanDerWaalsContact O-N 3.09Å
191	N	44.2	Very low	49.5	Very low	138 Å²	138	99.9 Å²	99.9	74%	0.738	57%	0.571	S	S	*	*	H	α-helix	trans	-91.9	-20.7	-177.5	-82.9	-7.4	0	0	0	114.1	G188 T189	G188-N191 PolarHBondContact O-N 3.33Å; T189-N191 PolarHBondContact O-N 3.21Å
192	R	48.9	Very low	51.3	Low	76 Å²	76	92.8 Å²	92.8	29%	0.287	54%	0.541	S	S	.	.	H	α-helix	trans	-67.5	-40.8	175.2	-151.6	-177	-163.6	-163.7	8.5	111.5	E147 K194 S196 S200	E147-R192 IonicContact OE1-NH2 3.37Å; E147-R192 PolarHBondContact OE1-NH2 3.28Å; E147-R192 IonicContact OE2-CZ 2.9Å; E147-R192 IonicContact OE2-NE 2.69Å; E147-R192 IonicContact OE2-NH2 3.94Å; E147-R192 PolarHBondContact OE2-NH2 2.98Å; R192-K194 PolarHBondContact O-N 3.17Å; R192-S196 PolarHBondContact O-OG 3.21Å; R192-S200 PolarHBondContact NH1-O 3.46Å
193	S	48.9	Very low	53.3	Low	85 Å²	85	89 Å²	89	59%	0.594	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-27.3	-170.1	-176.8	0	0	0	0	114.4
194	K	49.9	Very low	55.7	Low	185 Å²	185	84 Å²	84	80%	0.804	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-10.8	-172.4	-70.2	-174.3	179.6	177.5	0	115.6	R192	R192-K194 PolarHBondContact O-N 3.17Å
195	R	55.5	Low	58.6	Low	196 Å²	196	82.2 Å²	82.2	74%	0.74	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.1	-24.5	-170.3	-69.7	-174.1	177.4	-177.7	-1.9	115.5
196	S	63.8	Low	61.3	Low	25 Å²	25	77.2 Å²	77.2	18%	0.175	43%	0.43	C	S	.	.			trans	-82.1	145.7	-177.2	55.4	0	0	0	0	111.8	D148 R192 F198	D148-S196 VanDerWaalsContact OD1-CB 3.24Å; D148-S196 WeakPolarHBondContact OD1-CB 3.35Å; D148-S196 WeakPolarHBondContact OD2-CB 3.39Å; R192-S196 PolarHBondContact O-OG 3.21Å; S196-F198 VanDerWaalsContact C-N 3.3Å; S196-F198 PolarHBondContact OG-O 3.41Å
197	Q	68.1	Low	64.1	Low	124 Å²	124	72.8 Å²	72.8	58%	0.579	40%	0.398	S	S	*	.	S	Bend	trans	-76.1	-21.9	174.7	-68.6	-179.5	-5.5	0	0	112.5
198	F	74.5	Confident	66.8	Low	42 Å²	42	66.4 Å²	66.4	18%	0.184	35%	0.353	C	S	.	.	S	Bend	trans	-96.9	152.8	-179.3	-60.3	-78.3	0	0	0	110.1	L151 N152 S196 I202 L207	L151-F198 HydrophobicContact CB-CD2 3.6Å; L151-F198 HydrophobicContact CB-CE2 3.5Å; L151-F198 VanDerWaalsContact CB-CE2 3.5Å; L151-F198 HydrophobicContact CB-CG 4.27Å; L151-F198 HydrophobicContact CB-CZ 4.1Å; L151-F198 HydrophobicContact CD1-CB 4.12Å; L151-F198 HydrophobicContact CD1-CD2 3.84Å; L151-F198 HydrophobicContact CD1-CG 4.12Å; L151-F198 HydrophobicContact CG-CD2 4.36Å; N152-F198 HydrophobicContact CB-CE2 4.35Å; S196-F198 VanDerWaalsContact C-N 3.3Å; S196-F198 PolarHBondContact OG-O 3.41Å; F198-I202 HydrophobicContact CB-CD1 4.5Å; F198-L207 HydrophobicContact CD1-CD2 4.46Å; F198-L207 HydrophobicContact CE1-CD2 4.08Å; F198-L207 HydrophobicContact CZ-CD2 4.4Å
199	S	75.5	Confident	69.6	Low	44 Å²	44	64.5 Å²	64.5	31%	0.308	33%	0.333	S	S	.	.			trans	-58.9	145	171.3	179.1	0	0	0	0	110	D201 I202	S199-D201 PolarHBondContact O-N 3.09Å; S199-D201 PolarHBondContact OG-OD2 3.37Å; S199-I202 PolarHBondContact O-N 3.3Å
200	S	69.8	Low	72	Confident	47 Å²	47	61.5 Å²	61.5	33%	0.329	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-15.2	176.6	50.1	0	0	0	0	114	R192	R192-S200 PolarHBondContact NH1-O 3.46Å
201	D	74.2	Confident	74.4	Confident	31 Å²	31	57.6 Å²	57.6	17%	0.166	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-17	-171.3	-49.3	-24.4	0	0	0	112.8	S199 S203 Q254	S199-D201 PolarHBondContact O-N 3.09Å; S199-D201 PolarHBondContact OG-OD2 3.37Å; D201-S203 PolarHBondContact O-N 3.32Å; D201-Q254 HydrophobicContact CB-CG 3.68Å; D201-Q254 PolarHBondContact OD1-NE2 3.39Å; D201-Q254 WeakPolarHBondContact OD2-CG 3.2Å; D201-Q254 PolarHBondContact OD2-NE2 3.14Å
202	I	83.6	Confident	76.6	Confident	21 Å²	21	53.8 Å²	53.8	11%	0.108	27%	0.269	C	S	.	.			trans	-82.7	110.2	-173.4	-60.9	172	0	0	0	108.5	L151 F198 S199 L207	L151-I202 HydrophobicContact CD2-CG2 4.49Å; F198-I202 HydrophobicContact CB-CD1 4.5Å; S199-I202 PolarHBondContact O-N 3.3Å; I202-L207 HydrophobicContact CG2-CB 3.77Å; I202-L207 HydrophobicContact CG2-CD1 4.4Å
203	S	85.2	Confident	78.6	Confident	38 Å²	38	50.5 Å²	50.5	27%	0.266	26%	0.257	S	S	.	.			trans	-77.5	155.6	169.2	73	0	0	0	0	111.5	D201 L205 M206 L207	D201-S203 PolarHBondContact O-N 3.32Å; S203-L205 PolarHBondContact O-N 3.32Å; S203-M206 WeakPolarHBondContact O-CB 3.02Å; S203-M206 PolarHBondContact O-N 2.91Å; S203-M206 VanDerWaalsContact O-N 3.07Å; S203-M206 WeakPolarHBondContact OG-CB 3.47Å; S203-M206 WeakPolarHBondContact OG-CG 3.22Å; S203-M206 PolarHBondContact OG-N 3.47Å; S203-M206 VanDerWaalsContact OG-N 3.11Å; S203-M206 PolarHBondContact OG-SD 3.47Å; S203-L207 PolarHBondContact O-N 3.07Å
204	P	87.3	Confident	80.5	Confident	15 Å²	15	46.9 Å²	46.9	10%	0.097	23%	0.231	C	C	.	.	H	α-helix	trans	-56	-37	175.4	-26.7	34.7	0	0	0	113.6	E147 L150 L151 I154 A208	E147-P204 HydrophobicContact CG-CG 4.43Å; L150-P204 HydrophobicContact CD2-CB 4.15Å; L150-P204 HydrophobicContact CD2-CG 4.24Å; L151-P204 HydrophobicContact CD2-CB 4.32Å; L151-P204 HydrophobicContact CD2-CG 4.2Å; I154-P204 HydrophobicContact CD1-CB 4Å; P204-A208 WeakPolarHBondContact O-CB 3.46Å; P204-A208 PolarHBondContact O-N 2.99Å; P204-A208 VanDerWaalsContact O-N 3.08Å
205	L	88.1	Confident	82.3	Confident	8 Å²	8	41.3 Å²	41.3	4%	0.042	21%	0.208	C	C	.	.	H	α-helix	trans	-69.2	-40.2	175.9	-178.4	61.9	0	0	0	111.9	S203 A208 A209 I217 L220 L221 L225 L227 Y267	S203-L205 PolarHBondContact O-N 3.32Å; L205-A208 PolarHBondContact O-N 3.16Å; L205-A209 WeakPolarHBondContact O-CB 3.35Å; L205-A209 PolarHBondContact O-N 2.93Å; L205-I217 HydrophobicContact CD1-CG2 4.37Å; L205-L220 HydrophobicContact CB-CD1 4.33Å; L205-L220 HydrophobicContact CD1-CB 3.93Å; L205-L220 HydrophobicContact CD1-CD1 4.18Å; L205-L221 HydrophobicContact CD1-CD2 4.46Å; L205-L221 HydrophobicContact CD2-CD2 4.43Å; L205-L225 HydrophobicContact CD2-CB 4.1Å; L205-L227 HydrophobicContact CD2-CB 4.45Å; L205-Y267 HydrophobicContact CD2-CE2 4.42Å
206	M	90	Very high	83.9	Confident	12 Å²	12	32.1 Å²	32.1	6%	0.059	17%	0.173	C	C	.	.	H	α-helix	trans	-61.9	-46.1	175.2	-73.5	160.4	74	0	0	111.3	S203 A208 A209 H210 L227 H257 A261	S203-M206 WeakPolarHBondContact O-CB 3.02Å; S203-M206 PolarHBondContact O-N 2.91Å; S203-M206 VanDerWaalsContact O-N 3.07Å; S203-M206 WeakPolarHBondContact OG-CB 3.47Å; S203-M206 WeakPolarHBondContact OG-CG 3.22Å; S203-M206 PolarHBondContact OG-N 3.47Å; S203-M206 VanDerWaalsContact OG-N 3.11Å; S203-M206 PolarHBondContact OG-SD 3.47Å; M206-A208 VanDerWaalsContact C-N 3.35Å; M206-A208 PolarHBondContact O-N 3.37Å; M206-A209 CarbonylContact O-C 3.54Å; M206-A209 WeakPolarHBondContact O-CB 3.41Å; M206-A209 PolarHBondContact O-N 3.42Å; M206-A209 VanDerWaalsContact O-N 3.14Å; M206-H210 PolarHBondContact O-CD2 3.43Å; M206-H210 VanDerWaalsContact O-CG 3.27Å; M206-H210 PolarHBondContact O-N 3.27Å; M206-L227 HydrophobicContact CG-CD1 3.5Å; M206-L227 HydrophobicContact CG-CD2 4.46Å; M206-L227 HydrophobicContact SD-CD1 4Å; M206-H257 HydrophobicContact CE-CB 3.78Å; M206-A261 HydrophobicContact CB-CB 4.15Å; M206-A261 HydrophobicContact CG-CB 4.01Å
207	L	90.4	Very high	85.1	Confident	18 Å²	18	31 Å²	31	9%	0.094	17%	0.165	C	C	.	.	H	α-helix	trans	-62.7	-42.1	178.3	-171.2	59.5	0	0	0	112.2	L151 I154 F198 I202 S203 A209 H210 I211	L151-L207 HydrophobicContact CB-CD2 3.94Å; L151-L207 HydrophobicContact CD2-CB 4.16Å; L151-L207 HydrophobicContact CD2-CD2 3.75Å; L151-L207 HydrophobicContact CG-CD2 4.46Å; L151-L207 WeakPolarHBondContact O-CD2 3.4Å; I154-L207 HydrophobicContact CB-CD2 4.3Å; I154-L207 HydrophobicContact CG2-CB 4.23Å; I154-L207 HydrophobicContact CG2-CD2 4.19Å; I154-L207 HydrophobicContact CG2-CG 3.93Å; F198-L207 HydrophobicContact CD1-CD2 4.46Å; F198-L207 HydrophobicContact CE1-CD2 4.08Å; F198-L207 HydrophobicContact CZ-CD2 4.4Å; I202-L207 HydrophobicContact CG2-CB 3.77Å; I202-L207 HydrophobicContact CG2-CD1 4.4Å; S203-L207 PolarHBondContact O-N 3.07Å; L207-A209 VanDerWaalsContact C-N 3.28Å; L207-A209 PolarHBondContact O-N 3.13Å; L207-H210 PolarHBondContact O-N 2.65Å; L207-I211 HydrophobicContact CD1-CD1 4.38Å; L207-I211 HydrophobicContact CG-CD1 4.23Å; L207-I211 WeakPolarHBondContact O-CG1 3.47Å; L207-I211 PolarHBondContact O-N 3.11Å
208	A	91.1	Very high	86.1	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-60.8	-39	174.7	0	0	0	0	0	112.1	I154 P204 L205 M206 N212 N213 I216 I217 L220	I154-A208 HydrophobicContact CG2-CB 4.02Å; P204-A208 WeakPolarHBondContact O-CB 3.46Å; P204-A208 PolarHBondContact O-N 2.99Å; P204-A208 VanDerWaalsContact O-N 3.08Å; L205-A208 PolarHBondContact O-N 3.16Å; M206-A208 VanDerWaalsContact C-N 3.35Å; M206-A208 PolarHBondContact O-N 3.37Å; A208-N212 PolarHBondContact O-N 3.49Å; A208-N213 PolarHBondContact O-N 3.27Å; A208-I216 HydrophobicContact CB-CB 4.32Å; A208-I216 HydrophobicContact CB-CG2 3.58Å; A208-I217 HydrophobicContact CB-CG1 3.98Å; A208-L220 HydrophobicContact CB-CD1 3.97Å
209	A	91.7	Very high	86.7	Confident	1 Å²	1	27.9 Å²	27.9	1%	0.008	15%	0.152	C	C	.	.	H	α-helix	trans	-68.9	-41.9	176	0	0	0	0	0	112.4	L205 M206 L207 I211 N212 A261 S264	L205-A209 WeakPolarHBondContact O-CB 3.35Å; L205-A209 PolarHBondContact O-N 2.93Å; M206-A209 CarbonylContact O-C 3.54Å; M206-A209 WeakPolarHBondContact O-CB 3.41Å; M206-A209 PolarHBondContact O-N 3.42Å; M206-A209 VanDerWaalsContact O-N 3.14Å; L207-A209 VanDerWaalsContact C-N 3.28Å; L207-A209 PolarHBondContact O-N 3.13Å; A209-I211 PolarHBondContact O-N 2.99Å; A209-N212 WeakPolarHBondContact O-CA 3.29Å; A209-N212 PolarHBondContact O-N 3.44Å; A209-A261 HydrophobicContact CB-CB 3.68Å; A209-S264 WeakPolarHBondContact O-CB 3.31Å; A209-S264 PolarHBondContact O-OG 3Å
210	H	92	Very high	87.3	Confident	58 Å²	58	26 Å²	26	27%	0.269	14%	0.139	S	C	.	.	H	α-helix	trans	-57	-38.8	175.7	-69	-51.5	0	0	0	112.7	M206 L207 N212 H257 Q260	M206-H210 PolarHBondContact O-CD2 3.43Å; M206-H210 VanDerWaalsContact O-CG 3.27Å; M206-H210 PolarHBondContact O-N 3.27Å; L207-H210 PolarHBondContact O-N 2.65Å; H210-N212 VanDerWaalsContact C-N 3.27Å; H210-H257 PolarHBondContact CE1-O 3.34Å; H210-Q260 VanDerWaalsContact CE1-CB 3.41Å; H210-Q260 WeakPolarHBondContact CE1-CB 3.39Å; H210-Q260 PolarHBondContact CE1-OE1 3.49Å; H210-Q260 VanDerWaalsContact CE1-OE1 3.32Å; H210-Q260 WeakPolarHBondContact ND1-CB 3.28Å
211	I	90.1	Very high	88.1	Confident	46 Å²	46	25.6 Å²	25.6	24%	0.236	13%	0.132	C	C	.	.	H	α-helix	trans	-78.8	-15.6	178.8	-61	168.3	0	0	0	111.9	I154 Q157 L207 A209 N213	I154-I211 HydrophobicContact CG2-CD1 3.92Å; I154-I211 WeakPolarHBondContact O-CD1 3.29Å; Q157-I211 HydrophobicContact CG-CG2 3.68Å; Q157-I211 VanDerWaalsContact NE2-CG2 3.25Å; L207-I211 HydrophobicContact CD1-CD1 4.38Å; L207-I211 HydrophobicContact CG-CD1 4.23Å; L207-I211 WeakPolarHBondContact O-CG1 3.47Å; L207-I211 PolarHBondContact O-N 3.11Å; A209-I211 PolarHBondContact O-N 2.99Å; I211-N213 VanDerWaalsContact C-N 3.35Å; I211-N213 HydrophobicContact CG2-CB 4.44Å; I211-N213 PolarHBondContact O-N 3Å
212	N	90.2	Very high	88.6	Confident	58 Å²	58	30.8 Å²	30.8	31%	0.31	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	63	34.5	-179.8	-161.3	27.2	0	0	0	113.9	A208 A209 H210 S264 S265 A266	A208-N212 PolarHBondContact O-N 3.49Å; A209-N212 WeakPolarHBondContact O-CA 3.29Å; A209-N212 PolarHBondContact O-N 3.44Å; H210-N212 VanDerWaalsContact C-N 3.27Å; N212-S264 PolarHBondContact OD1-OG 2.97Å; N212-S264 VanDerWaalsContact OD1-OG 3.06Å; N212-S265 PolarHBondContact ND2-OG 3.47Å; N212-S265 PolarHBondContact OD1-N 2.9Å; N212-S265 PolarHBondContact OD1-OG 3.3Å; N212-A266 WeakPolarHBondContact OD1-CB 3.12Å; N212-A266 PolarHBondContact OD1-N 2.97Å
213	N	90.4	Very high	88.5	Confident	6 Å²	6	33.9 Å²	33.9	3%	0.032	17%	0.171	C	C	.	.			trans	-92.7	103.7	178.6	-173.9	-2.2	0	0	0	111.8	N159 A208 I211 E215 I216 I217 K957	N159-N213 PolarHBondContact OD1-ND2 3.46Å; A208-N213 PolarHBondContact O-N 3.27Å; I211-N213 VanDerWaalsContact C-N 3.35Å; I211-N213 HydrophobicContact CG2-CB 4.44Å; I211-N213 PolarHBondContact O-N 3Å; N213-E215 VanDerWaalsContact C-N 3.34Å; N213-E215 PolarHBondContact O-N 3.46Å; N213-E215 PolarHBondContact OD1-N 2.89Å; N213-I216 HydrophobicContact CB-CD1 4.4Å; N213-I216 VanDerWaalsContact ND2-CD1 3.28Å; N213-I216 WeakPolarHBondContact ND2-CD1 3.15Å; N213-I216 PolarHBondContact O-N 3.09Å; N213-I217 WeakPolarHBondContact O-CD1 3.46Å; N213-I217 VanDerWaalsContact O-CG1 3.25Å; N213-I217 WeakPolarHBondContact O-CG1 3.42Å; N213-I217 PolarHBondContact O-N 3.5Å; N213-K957 PolarHBondContact ND2-NZ 3.29Å; N213-K957 PolarHBondContact OD1-NZ 2.64Å
214	H	88.7	Confident	88.2	Confident	10 Å²	10	34.8 Å²	34.8	5%	0.046	19%	0.186	C	C	.	.	H	α-helix	trans	-58.7	-36.1	-175	69.7	-78.3	0	0	0	114.8	I217 Q218 A266 L950	H214-I217 PolarHBondContact O-N 2.99Å; H214-Q218 WeakPolarHBondContact O-CB 3.34Å; H214-Q218 VanDerWaalsContact O-CG 3.27Å; H214-Q218 WeakPolarHBondContact O-CG 3.26Å; H214-Q218 PolarHBondContact O-N 3.43Å; H214-A266 HydrophobicContact CB-CB 3.93Å; H214-L950 HydrophobicContact CB-CD2 4.07Å
215	E	87.5	Confident	87.7	Confident	68 Å²	68	36 Å²	36	32%	0.318	19%	0.191	S	C	.	.	H	α-helix	trans	-67.3	-43.7	-177.4	-65.1	165.8	-124	0	0	112.1	N159 N213 Q218 L219 K957	N159-E215 VanDerWaalsContact CG-OE2 3.31Å; N159-E215 PolarHBondContact ND2-OE1 3.06Å; N159-E215 PolarHBondContact ND2-OE2 2.93Å; N213-E215 VanDerWaalsContact C-N 3.34Å; N213-E215 PolarHBondContact O-N 3.46Å; N213-E215 PolarHBondContact OD1-N 2.89Å; E215-Q218 PolarHBondContact O-N 3.2Å; E215-L219 WeakPolarHBondContact O-CB 3.24Å; E215-L219 PolarHBondContact O-N 2.83Å; E215-K957 IonicContact OE1-NZ 3.83Å; E215-K957 PolarHBondContact OE1-NZ 2.85Å; E215-K957 IonicContact OE2-NZ 2.67Å
216	I	89.6	Confident	87.4	Confident	3 Å²	3	44.1 Å²	44.1	2%	0.015	23%	0.226	C	C	.	.	H	α-helix	trans	-68.1	-42.2	178.1	-63.7	175.1	0	0	0	109.8	I154 N159 V162 A208 N213 L219 L220	I154-I216 HydrophobicContact CD1-CG2 4.44Å; I154-I216 HydrophobicContact CG1-CG2 4.2Å; N159-I216 WeakPolarHBondContact OD1-CG1 3.37Å; V162-I216 HydrophobicContact CG1-CG1 4.39Å; V162-I216 HydrophobicContact CG1-CG2 3.98Å; V162-I216 HydrophobicContact CG2-CD1 4.2Å; A208-I216 HydrophobicContact CB-CB 4.32Å; A208-I216 HydrophobicContact CB-CG2 3.58Å; N213-I216 HydrophobicContact CB-CD1 4.4Å; N213-I216 VanDerWaalsContact ND2-CD1 3.28Å; N213-I216 WeakPolarHBondContact ND2-CD1 3.15Å; N213-I216 PolarHBondContact O-N 3.09Å; I216-L219 PolarHBondContact O-N 3.49Å; I216-L220 HydrophobicContact CG2-CD1 3.97Å; I216-L220 HydrophobicContact CG2-CG 4.36Å; I216-L220 WeakPolarHBondContact O-CG 3.48Å; I216-L220 PolarHBondContact O-N 3Å
217	I	89.3	Confident	87	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-61.4	-46.7	178	-63.3	164.1	0	0	0	109.9	L205 A208 N213 H214 L219 L220 L221 A266 Y267 L270	L205-I217 HydrophobicContact CD1-CG2 4.37Å; A208-I217 HydrophobicContact CB-CG1 3.98Å; N213-I217 WeakPolarHBondContact O-CD1 3.46Å; N213-I217 VanDerWaalsContact O-CG1 3.25Å; N213-I217 WeakPolarHBondContact O-CG1 3.42Å; N213-I217 PolarHBondContact O-N 3.5Å; H214-I217 PolarHBondContact O-N 2.99Å; I217-L219 PolarHBondContact O-N 3.14Å; I217-L220 PolarHBondContact O-N 3.05Å; I217-L221 HydrophobicContact CG2-CD1 3.72Å; I217-L221 HydrophobicContact CG2-CG 4.02Å; I217-L221 WeakPolarHBondContact O-CB 3.45Å; I217-L221 VanDerWaalsContact O-CG 3.26Å; I217-L221 WeakPolarHBondContact O-CG 3.43Å; I217-L221 PolarHBondContact O-N 3.5Å; I217-A266 HydrophobicContact CD1-CB 3.75Å; I217-Y267 HydrophobicContact CG2-CD2 4.18Å; I217-L270 HydrophobicContact CB-CD1 4.08Å; I217-L270 HydrophobicContact CG2-CD1 3.66Å
218	Q	88.2	Confident	86.5	Confident	70 Å²	70	51.7 Å²	51.7	33%	0.327	26%	0.262	S	S	.	.	H	α-helix	trans	-55.7	-50.3	174.7	-78	176.6	-14	0	0	111.7	H214 E215 L220 L221 D222 L270	H214-Q218 WeakPolarHBondContact O-CB 3.34Å; H214-Q218 VanDerWaalsContact O-CG 3.27Å; H214-Q218 WeakPolarHBondContact O-CG 3.26Å; H214-Q218 PolarHBondContact O-N 3.43Å; E215-Q218 PolarHBondContact O-N 3.2Å; Q218-L220 VanDerWaalsContact C-N 3.26Å; Q218-L220 PolarHBondContact O-N 3.15Å; Q218-L221 PolarHBondContact O-N 3.45Å; Q218-D222 WeakPolarHBondContact O-CB 3.41Å; Q218-D222 PolarHBondContact O-N 3.24Å; Q218-L270 HydrophobicContact CG-CD1 3.56Å; Q218-L270 HydrophobicContact CG-CD2 3.6Å; Q218-L270 HydrophobicContact CG-CG 4.23Å; Q218-L270 VanDerWaalsContact NE2-CD2 3.3Å
219	L	87.5	Confident	85.9	Confident	32 Å²	32	57.7 Å²	57.7	17%	0.168	29%	0.291	C	S	.	.	H	α-helix	trans	-57.4	-38.9	179.2	-175.5	75	0	0	0	112.4	V162 K163 V166 E215 I216 I217	V162-L219 HydrophobicContact CG1-CD2 4.23Å; K163-L219 HydrophobicContact CB-CD2 4.09Å; K163-L219 HydrophobicContact CG-CD1 4.34Å; K163-L219 HydrophobicContact CG-CD2 4.31Å; V166-L219 HydrophobicContact CB-CD2 4.19Å; V166-L219 HydrophobicContact CG1-CD2 4.27Å; V166-L219 HydrophobicContact CG1-CG 4.41Å; E215-L219 WeakPolarHBondContact O-CB 3.24Å; E215-L219 PolarHBondContact O-N 2.83Å; I216-L219 PolarHBondContact O-N 3.49Å; I217-L219 PolarHBondContact O-N 3.14Å
220	L	87.7	Confident	85.3	Confident	4 Å²	4	58.6 Å²	58.6	2%	0.021	30%	0.297	C	S	.	.	H	α-helix	trans	-76.2	-37.8	178.4	-67.4	176.3	0	0	0	112.6	V166 L205 A208 I216 I217 Q218 R223 L225	V166-L220 HydrophobicContact CG2-CD2 4.19Å; L205-L220 HydrophobicContact CB-CD1 4.33Å; L205-L220 HydrophobicContact CD1-CB 3.93Å; L205-L220 HydrophobicContact CD1-CD1 4.18Å; A208-L220 HydrophobicContact CB-CD1 3.97Å; I216-L220 HydrophobicContact CG2-CD1 3.97Å; I216-L220 HydrophobicContact CG2-CG 4.36Å; I216-L220 WeakPolarHBondContact O-CG 3.48Å; I216-L220 PolarHBondContact O-N 3Å; I217-L220 PolarHBondContact O-N 3.05Å; Q218-L220 VanDerWaalsContact C-N 3.26Å; Q218-L220 PolarHBondContact O-N 3.15Å; L220-R223 PolarHBondContact O-N 2.89Å; L220-L225 HydrophobicContact CB-CD1 4.26Å; L220-L225 HydrophobicContact CD2-CD1 4.06Å
221	L	86.9	Confident	84.9	Confident	38 Å²	38	59.8 Å²	59.8	20%	0.199	30%	0.302	C	S	.	.	H	α-helix	trans	-67.3	-37.7	176.3	-72.7	179.5	0	0	0	111.9	L205 I217 Q218 R223 G224 L225 Y267 L270 T271	L205-L221 HydrophobicContact CD1-CD2 4.46Å; L205-L221 HydrophobicContact CD2-CD2 4.43Å; I217-L221 HydrophobicContact CG2-CD1 3.72Å; I217-L221 HydrophobicContact CG2-CG 4.02Å; I217-L221 WeakPolarHBondContact O-CB 3.45Å; I217-L221 VanDerWaalsContact O-CG 3.26Å; I217-L221 WeakPolarHBondContact O-CG 3.43Å; I217-L221 PolarHBondContact O-N 3.5Å; Q218-L221 PolarHBondContact O-N 3.45Å; L221-R223 PolarHBondContact O-N 3.4Å; L221-G224 PolarHBondContact O-N 3.34Å; L221-L225 WeakPolarHBondContact CD2-O 3.41Å; L221-Y267 HydrophobicContact CD2-CE2 4.2Å; L221-L270 HydrophobicContact CD1-CB 3.69Å; L221-L270 HydrophobicContact CD1-CD1 4.12Å; L221-T271 HydrophobicContact CD1-CG2 3.9Å; L221-T271 HydrophobicContact CD2-CG2 4.14Å
222	D	85.8	Confident	84.2	Confident	140 Å²	140	63.4 Å²	63.4	75%	0.749	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-20.7	176.5	-74.4	-17.5	0	0	0	112.5	Q218	Q218-D222 WeakPolarHBondContact O-CB 3.41Å; Q218-D222 PolarHBondContact O-N 3.24Å
223	R	81.1	Confident	83.3	Confident	87 Å²	87	64.5 Å²	64.5	33%	0.328	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-2	175.1	-61.1	-147.7	165.6	-160.2	-4.9	114.8	V166 D167 L220 L221	V166-R223 PolarHBondContact O-NH1 2.95Å; V166-R223 PolarHBondContact O-NH2 3.48Å; D167-R223 VanDerWaalsContact CA-NH2 3.3Å; D167-R223 IonicContact OD1-CZ 2.72Å; D167-R223 IonicContact OD1-NH2 3.78Å; D167-R223 PolarHBondContact OD1-NH2 3.44Å; L220-R223 PolarHBondContact O-N 2.89Å; L221-R223 PolarHBondContact O-N 3.4Å
224	G	78	Confident	82.6	Confident	56 Å²	56	68.9 Å²	68.9	58%	0.577	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.5	16.2	-179.5	0	0	0	0	0	114.4	L221 K226	L221-G224 PolarHBondContact O-N 3.34Å; G224-K226 PolarHBondContact O-N 2.93Å
225	L	78.3	Confident	82.4	Confident	42 Å²	42	69.9 Å²	69.9	22%	0.22	37%	0.367	C	S	.	.			trans	-70.2	127.8	168.3	-63.5	176.2	0	0	0	108.8	L205 L220 L221	L205-L225 HydrophobicContact CD2-CB 4.1Å; L220-L225 HydrophobicContact CB-CD1 4.26Å; L220-L225 HydrophobicContact CD2-CD1 4.06Å; L221-L225 WeakPolarHBondContact CD2-O 3.41Å
226	K	80.5	Confident	81.9	Confident	177 Å²	177	71.3 Å²	71.3	77%	0.77	39%	0.385	S	S	*	.			trans	-124.1	142.6	174.2	-67.4	-177.3	179.6	178.2	0	108.7	G224	G224-K226 PolarHBondContact O-N 2.93Å
227	L	83	Confident	81.6	Confident	26 Å²	26	73 Å²	73	14%	0.136	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-79.3	126	172.4	-170.9	56.7	0	0	0	108.9	L205 M206 T258 A261 L262 Y267	L205-L227 HydrophobicContact CD2-CB 4.45Å; M206-L227 HydrophobicContact CG-CD1 3.5Å; M206-L227 HydrophobicContact CG-CD2 4.46Å; M206-L227 HydrophobicContact SD-CD1 4Å; L227-T258 HydrophobicContact CD1-CG2 4.14Å; L227-T258 HydrophobicContact CD2-CG2 4.27Å; L227-T258 HydrophobicContact CG-CG2 4.11Å; L227-A261 HydrophobicContact CD2-CB 3.5Å; L227-L262 HydrophobicContact CB-CD2 4.28Å; L227-L262 HydrophobicContact CD2-CD2 3.67Å; L227-L262 HydrophobicContact CD2-CG 3.67Å; L227-L262 HydrophobicContact CG-CD2 4.07Å; L227-L262 HydrophobicContact CG-CG 4.34Å; L227-Y267 HydrophobicContact CB-CE2 4.34Å; L227-Y267 WeakPolarHBondContact CB-OH 3.2Å
228	E	79.4	Confident	81.5	Confident	164 Å²	164	79.6 Å²	79.6	77%	0.766	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-78.5	143.6	176.3	-65.3	-171.8	167.9	0	0	110.9	T258	E228-T258 WeakPolarHBondContact O-CG2 3.47Å
229	M	78.1	Confident	81.1	Confident	126 Å²	126	82.7 Å²	82.7	62%	0.621	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-65.8	129.4	175.4	-172.2	100.3	86.3	0	0	108.8
230	P	79.9	Confident	80.9	Confident	20 Å²	20	81.5 Å²	81.5	13%	0.13	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-65.4	150.6	179.6	27.6	-33	0	0	0	110.8	R255 T258 Y259	P230-R255 HydrophobicContact CB-CG 4.17Å; P230-R255 HydrophobicContact CG-CG 4.4Å; P230-T258 HydrophobicContact CB-CG2 4.14Å; P230-T258 HydrophobicContact CG-CG2 4.02Å; P230-Y259 HydrophobicContact CB-CE2 4.38Å; P230-Y259 HydrophobicContact CG-CD2 3.8Å; P230-Y259 HydrophobicContact CG-CE1 4.38Å; P230-Y259 HydrophobicContact CG-CE2 3.31Å; P230-Y259 HydrophobicContact CG-CG 4.49Å
231	H	82.1	Confident	80.7	Confident	82 Å²	82	85.4 Å²	85.4	38%	0.38	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-69.3	143.3	176.7	-67.1	173	0	0	0	112.2	C235 C237 C240 R255	H231-C235 HydrophobicContact CB-CB 3.76Å; H231-C237 PolarHBondContact CE1-SG 2.83Å; H231-C237 PolarHBondContact ND1-SG 3.11Å; H231-C240 PolarHBondContact ND1-SG 3.02Å; H231-R255 PolarHBondContact O-NE 3.4Å
232	D	75.6	Confident	80.5	Confident	123 Å²	123	87 Å²	87	66%	0.658	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-56.5	153.2	172	-77.4	-27.4	0	0	0	111.8	A234 C235	D232-A234 PolarHBondContact O-N 3.33Å; D232-A234 VanDerWaalsContact O-N 3.15Å; D232-C235 WeakPolarHBondContact O-CB 3.45Å; D232-C235 PolarHBondContact O-N 3.27Å
233	R	72.6	Confident	80.2	Confident	80 Å²	80	82.1 Å²	82.1	30%	0.302	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-29.9	176.9	-87.4	-156.5	-62.6	-70	-41	114.1	C235 R255 Q292 E293	R233-C235 PolarHBondContact O-N 3.27Å; R233-R255 VanDerWaalsContact CG-NH1 3.32Å; R233-Q292 VanDerWaalsContact NH1-CB 3.34Å; R233-E293 VanDerWaalsContact CD-OE1 3.27Å; R233-E293 WeakPolarHBondContact CD-OE1 3.33Å; R233-E293 IonicContact CZ-OE1 2.64Å; R233-E293 IonicContact NE-OE1 3.83Å; R233-E293 VanDerWaalsContact NH1-CG 3.34Å; R233-E293 IonicContact NH1-OE1 4Å; R233-E293 PolarHBondContact NH1-OE1 2.97Å
234	A	75.5	Confident	80.3	Confident	98 Å²	98	82.3 Å²	82.3	81%	0.81	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	8	178.4	0	0	0	0	0	113	D232 S236	D232-A234 PolarHBondContact O-N 3.33Å; D232-A234 VanDerWaalsContact O-N 3.15Å; A234-S236 PolarHBondContact O-N 3.42Å
235	C	83	Confident	80.5	Confident	32 Å²	32	83.7 Å²	83.7	22%	0.216	45%	0.449	C	S	.	.			trans	-66.7	128.5	179.8	-175.6	0	0	0	0	111.3	H231 D232 R233 C237	H231-C235 HydrophobicContact CB-CB 3.76Å; D232-C235 WeakPolarHBondContact O-CB 3.45Å; D232-C235 PolarHBondContact O-N 3.27Å; R233-C235 PolarHBondContact O-N 3.27Å; C235-C237 PolarHBondContact SG-N 3.16Å; C235-C237 VanDerWaalsContact SG-N 3.43Å
236	S	78.1	Confident	80.5	Confident	98 Å²	98	89 Å²	89	69%	0.685	47%	0.473	S	S	*	.			trans	-108.8	28.2	177.5	66.3	0	0	0	0	112.3	A234	A234-S236 PolarHBondContact O-N 3.42Å
237	C	83.9	Confident	80.5	Confident	37 Å²	37	84 Å²	84	25%	0.25	46%	0.455	C	S	.	.			trans	-70.8	156.7	175.7	77.7	0	0	0	0	110.9	H231 C235 E239 C240 E241	H231-C237 PolarHBondContact CE1-SG 2.83Å; H231-C237 PolarHBondContact ND1-SG 3.11Å; C235-C237 PolarHBondContact SG-N 3.16Å; C235-C237 VanDerWaalsContact SG-N 3.43Å; C237-E239 VanDerWaalsContact C-N 3.28Å; C237-E239 PolarHBondContact O-N 2.97Å; C237-C240 PolarHBondContact O-N 2.77Å; C237-C240 VanDerWaalsContact SG-CB 3.59Å; C237-C240 PolarHBondContact SG-N 2.91Å; C237-C240 PolarHBondContact SG-SG 2.85Å; C237-E241 PolarHBondContact O-N 3.14Å
238	L	86.7	Confident	80.6	Confident	140 Å²	140	85.7 Å²	85.7	73%	0.733	47%	0.469	S	S	*	.	H	α-helix	trans	-57.7	-41.5	-177.8	-176.9	64	0	0	0	111.9	E241 T242	L238-E241 PolarHBondContact O-N 3.45Å; L238-T242 HydrophobicContact CD1-CG2 4.46Å; L238-T242 VanDerWaalsContact O-CG2 3.32Å; L238-T242 WeakPolarHBondContact O-CG2 3.08Å; L238-T242 PolarHBondContact O-N 3.28Å; L238-T242 PolarHBondContact O-OG1 3.48Å
239	E	79.5	Confident	80.9	Confident	134 Å²	134	81.2 Å²	81.2	63%	0.626	45%	0.45	S	S	*	.	H	α-helix	trans	-63.4	-50.3	-180	-63.6	173.9	175.2	0	0	111.8	C237 E241 T242 I243	C237-E239 VanDerWaalsContact C-N 3.28Å; C237-E239 PolarHBondContact O-N 2.97Å; E239-E241 VanDerWaalsContact C-N 3.32Å; E239-E241 PolarHBondContact O-N 3.47Å; E239-T242 WeakPolarHBondContact CA-OG1 3.45Å; E239-T242 PolarHBondContact O-N 3.13Å; E239-T242 PolarHBondContact O-OG1 3.33Å; E239-I243 WeakPolarHBondContact O-CG1 3.29Å; E239-I243 PolarHBondContact O-N 3.18Å
240	C	83.7	Confident	81.2	Confident	8 Å²	8	77.9 Å²	77.9	5%	0.054	43%	0.434	C	S	.	.	H	α-helix	trans	-65.1	-34.9	177.6	-69.7	0	0	0	0	112.5	H231 C237 R244 L251	H231-C240 PolarHBondContact ND1-SG 3.02Å; C237-C240 PolarHBondContact O-N 2.77Å; C237-C240 VanDerWaalsContact SG-CB 3.59Å; C237-C240 PolarHBondContact SG-N 2.91Å; C237-C240 PolarHBondContact SG-SG 2.85Å; C240-R244 WeakPolarHBondContact O-CB 3.17Å; C240-R244 PolarHBondContact O-N 3.47Å; C240-L251 HydrophobicContact CB-CD2 4.31Å
241	E	83.3	Confident	81.3	Confident	85 Å²	85	78 Å²	78	40%	0.397	43%	0.433	S	S	.	.	H	α-helix	trans	-66.9	-41.3	175.3	-163.5	72	-130.9	0	0	111	C237 L238 E239 R244 A245	C237-E241 PolarHBondContact O-N 3.14Å; L238-E241 PolarHBondContact O-N 3.45Å; E239-E241 VanDerWaalsContact C-N 3.32Å; E239-E241 PolarHBondContact O-N 3.47Å; E241-R244 VanDerWaalsContact CD-NH2 3.28Å; E241-R244 IonicContact OE1-CZ 2.84Å; E241-R244 IonicContact OE1-NH1 2.78Å; E241-R244 PolarHBondContact OE1-NH1 3.05Å; E241-R244 IonicContact OE1-NH2 2.89Å; E241-R244 IonicContact OE2-CZ 3.89Å; E241-R244 IonicContact OE2-NH1 3.94Å; E241-R244 PolarHBondContact OE2-NH1 3.08Å; E241-R244 IonicContact OE2-NH2 3.46Å; E241-R244 PolarHBondContact OE2-NH2 3.19Å; E241-A245 VanDerWaalsContact O-CB 3.24Å; E241-A245 WeakPolarHBondContact O-CB 3.49Å; E241-A245 PolarHBondContact O-N 3.4Å
242	T	83.3	Confident	81.6	Confident	73 Å²	73	75.6 Å²	75.6	45%	0.448	42%	0.422	S	S	.	.	H	α-helix	trans	-63.6	-45	176.8	53.3	0	0	0	0	112.3	L238 E239 A245 E246	L238-T242 HydrophobicContact CD1-CG2 4.46Å; L238-T242 VanDerWaalsContact O-CG2 3.32Å; L238-T242 WeakPolarHBondContact O-CG2 3.08Å; L238-T242 PolarHBondContact O-N 3.28Å; L238-T242 PolarHBondContact O-OG1 3.48Å; E239-T242 WeakPolarHBondContact CA-OG1 3.45Å; E239-T242 PolarHBondContact O-N 3.13Å; E239-T242 PolarHBondContact O-OG1 3.33Å; T242-A245 PolarHBondContact O-N 3.21Å; T242-E246 PolarHBondContact O-N 3.32Å
243	I	79.6	Confident	82.2	Confident	37 Å²	37	73.3 Å²	73.3	19%	0.19	41%	0.407	C	S	.	.	H	α-helix	trans	-68.1	-43.4	179.3	-62	164.6	0	0	0	110.3	E239 A245 E246 D247 I250 L251	E239-I243 WeakPolarHBondContact O-CG1 3.29Å; E239-I243 PolarHBondContact O-N 3.18Å; I243-A245 PolarHBondContact O-N 3.21Å; I243-E246 WeakPolarHBondContact O-CB 3.41Å; I243-E246 PolarHBondContact O-N 3.27Å; I243-E246 VanDerWaalsContact O-N 3.09Å; I243-D247 CarbonylContact O-C 3.24Å; I243-D247 PolarHBondContact O-N 3.47Å; I243-D247 VanDerWaalsContact O-O 3.07Å; I243-I250 HydrophobicContact CG2-CB 4.43Å; I243-I250 HydrophobicContact CG2-CG2 4.13Å; I243-L251 HydrophobicContact CG2-CB 4.03Å; I243-L251 HydrophobicContact CG2-CD1 4.43Å
244	R	82.9	Confident	82.8	Confident	90 Å²	90	71.3 Å²	71.3	34%	0.34	40%	0.401	S	S	.	.	H	α-helix	trans	-64.7	-28.7	176.6	177.3	162.2	40	89.4	-2.3	112.7	C240 E241 L251	C240-R244 WeakPolarHBondContact O-CB 3.17Å; C240-R244 PolarHBondContact O-N 3.47Å; E241-R244 VanDerWaalsContact CD-NH2 3.28Å; E241-R244 IonicContact OE1-CZ 2.84Å; E241-R244 IonicContact OE1-NH1 2.78Å; E241-R244 PolarHBondContact OE1-NH1 3.05Å; E241-R244 IonicContact OE1-NH2 2.89Å; E241-R244 IonicContact OE2-CZ 3.89Å; E241-R244 IonicContact OE2-NH1 3.94Å; E241-R244 PolarHBondContact OE2-NH1 3.08Å; E241-R244 IonicContact OE2-NH2 3.46Å; E241-R244 PolarHBondContact OE2-NH2 3.19Å; R244-L251 HydrophobicContact CB-CD2 4.37Å
245	A	81.4	Confident	83.5	Confident	85 Å²	85	67.1 Å²	67.1	70%	0.702	37%	0.365	S	S	*	.	H	α-helix	trans	-72.6	-28.7	173.7	0	0	0	0	0	112.7	E241 T242 I243	E241-A245 VanDerWaalsContact O-CB 3.24Å; E241-A245 WeakPolarHBondContact O-CB 3.49Å; E241-A245 PolarHBondContact O-N 3.4Å; T242-A245 PolarHBondContact O-N 3.21Å; I243-A245 PolarHBondContact O-N 3.21Å
246	E	79.4	Confident	83.9	Confident	155 Å²	155	66 Å²	66	72%	0.724	36%	0.356	S	S	*	.	H	α-helix	trans	-75.9	-60.6	170.7	-67.1	-179.7	175.6	0	0	110.7	T242 I243	T242-E246 PolarHBondContact O-N 3.32Å; I243-E246 WeakPolarHBondContact O-CB 3.41Å; I243-E246 PolarHBondContact O-N 3.27Å; I243-E246 VanDerWaalsContact O-N 3.09Å
247	D	80.5	Confident	84.4	Confident	72 Å²	72	62.5 Å²	62.5	39%	0.385	33%	0.329	S	S	.	.			trans	-156.9	128.6	175.5	-167.5	-13.5	0	0	0	111.4	I243 L249 I250	I243-D247 CarbonylContact O-C 3.24Å; I243-D247 PolarHBondContact O-N 3.47Å; I243-D247 VanDerWaalsContact O-O 3.07Å; D247-L249 VanDerWaalsContact C-N 3.28Å; D247-L249 PolarHBondContact O-N 3.44Å; D247-L249 WeakPolarHBondContact OD1-CB 3.11Å; D247-L249 PolarHBondContact OD1-N 3.12Å; D247-I250 HydrophobicContact CB-CB 4.38Å; D247-I250 HydrophobicContact CB-CD1 3.73Å; D247-I250 HydrophobicContact CB-CG1 3.85Å
248	S	84.7	Confident	84.7	Confident	61 Å²	61	61.7 Å²	61.7	43%	0.427	32%	0.323	S	S	.	.	H	α-helix	trans	-65.4	-31.4	175.2	-171.4	0	0	0	0	112.6	E252	S248-E252 PolarHBondContact O-N 2.73Å
249	L	86	Confident	85	Confident	70 Å²	70	55.6 Å²	55.6	37%	0.366	29%	0.29	S	S	.	.	H	α-helix	trans	-71.6	-34.9	-176.7	-176.4	62.7	0	0	0	112	D247 L251 E252 Q253 Q295 F296	D247-L249 VanDerWaalsContact C-N 3.28Å; D247-L249 PolarHBondContact O-N 3.44Å; D247-L249 WeakPolarHBondContact OD1-CB 3.11Å; D247-L249 PolarHBondContact OD1-N 3.12Å; L249-L251 VanDerWaalsContact C-N 3.31Å; L249-L251 PolarHBondContact O-N 3.23Å; L249-E252 PolarHBondContact O-N 2.71Å; L249-Q253 PolarHBondContact O-N 3.26Å; L249-Q295 VanDerWaalsContact CD1-OE1 3.31Å; L249-F296 HydrophobicContact CD1-CE2 3.93Å; L249-F296 HydrophobicContact CD1-CZ 3.95Å
250	I	83.2	Confident	85.6	Confident	56 Å²	56	51.8 Å²	51.8	29%	0.287	27%	0.273	S	S	.	.	H	α-helix	trans	-60.3	-44.1	177.1	-64.8	174.5	0	0	0	109.9	I243 D247 E252 Q253 Q254	I243-I250 HydrophobicContact CG2-CB 4.43Å; I243-I250 HydrophobicContact CG2-CG2 4.13Å; D247-I250 HydrophobicContact CB-CB 4.38Å; D247-I250 HydrophobicContact CB-CD1 3.73Å; D247-I250 HydrophobicContact CB-CG1 3.85Å; I250-E252 VanDerWaalsContact C-N 3.31Å; I250-E252 PolarHBondContact O-N 3.5Å; I250-Q253 PolarHBondContact O-N 3.47Å; I250-Q254 HydrophobicContact CG2-CG 4.32Å; I250-Q254 WeakPolarHBondContact O-CB 3.49Å; I250-Q254 VanDerWaalsContact O-CG 3.26Å; I250-Q254 WeakPolarHBondContact O-CG 3.34Å; I250-Q254 PolarHBondContact O-N 3.3Å
251	L	83.4	Confident	85.9	Confident	21 Å²	21	51.4 Å²	51.4	11%	0.11	27%	0.27	C	S	.	.	H	α-helix	trans	-62.7	-37.1	177.4	-175.5	64.9	0	0	0	112.6	C240 I243 R244 L249 R255	C240-L251 HydrophobicContact CB-CD2 4.31Å; I243-L251 HydrophobicContact CG2-CB 4.03Å; I243-L251 HydrophobicContact CG2-CD1 4.43Å; R244-L251 HydrophobicContact CB-CD2 4.37Å; L249-L251 VanDerWaalsContact C-N 3.31Å; L249-L251 PolarHBondContact O-N 3.23Å; L251-R255 WeakPolarHBondContact O-CB 3.35Å; L251-R255 PolarHBondContact O-N 2.83Å; L251-R255 VanDerWaalsContact O-N 3.12Å
252	E	87	Confident	86.3	Confident	32 Å²	32	48.3 Å²	48.3	15%	0.15	26%	0.256	C	S	.	.	H	α-helix	trans	-68.5	-41.3	175	-67.4	-178.2	173.7	0	0	111.5	S248 L249 I250 R255 L256 E293 F296	S248-E252 PolarHBondContact O-N 2.73Å; L249-E252 PolarHBondContact O-N 2.71Å; I250-E252 VanDerWaalsContact C-N 3.31Å; I250-E252 PolarHBondContact O-N 3.5Å; E252-R255 PolarHBondContact O-N 3.17Å; E252-L256 PolarHBondContact O-N 3.04Å; E252-E293 HydrophobicContact CG-CG 4.4Å; E252-F296 HydrophobicContact CB-CD2 4.45Å; E252-F296 HydrophobicContact CB-CE2 4.03Å
253	Q	87.8	Confident	86.6	Confident	75 Å²	75	45.1 Å²	45.1	35%	0.35	24%	0.237	S	C	.	.	H	α-helix	trans	-65.8	-41	176.2	-174.6	172.8	17	0	0	112.3	L249 I250 L256 H257	L249-Q253 PolarHBondContact O-N 3.26Å; I250-Q253 PolarHBondContact O-N 3.47Å; Q253-L256 WeakPolarHBondContact O-CB 3.48Å; Q253-L256 PolarHBondContact O-N 2.92Å; Q253-H257 VanDerWaalsContact CG-CE1 3.48Å; Q253-H257 WeakPolarHBondContact CG-CE1 3.47Å; Q253-H257 PolarHBondContact NE2-CE1 3.45Å; Q253-H257 VanDerWaalsContact O-CG 3.29Å; Q253-H257 PolarHBondContact O-N 3.25Å
254	Q	86.5	Confident	87.2	Confident	38 Å²	38	43.9 Å²	43.9	18%	0.178	23%	0.232	C	C	.	.	H	α-helix	trans	-57.8	-48.7	173.2	-76.2	-179.7	-1.4	0	0	111.4	D201 I250 L256 H257 T258	D201-Q254 HydrophobicContact CB-CG 3.68Å; D201-Q254 PolarHBondContact OD1-NE2 3.39Å; D201-Q254 WeakPolarHBondContact OD2-CG 3.2Å; D201-Q254 PolarHBondContact OD2-NE2 3.14Å; I250-Q254 HydrophobicContact CG2-CG 4.32Å; I250-Q254 WeakPolarHBondContact O-CB 3.49Å; I250-Q254 VanDerWaalsContact O-CG 3.26Å; I250-Q254 WeakPolarHBondContact O-CG 3.34Å; I250-Q254 PolarHBondContact O-N 3.3Å; Q254-L256 VanDerWaalsContact C-N 3.33Å; Q254-L256 PolarHBondContact O-N 3.11Å; Q254-H257 PolarHBondContact O-N 3.12Å; Q254-T258 PolarHBondContact O-N 3.17Å; Q254-T258 PolarHBondContact O-OG1 2.91Å; Q254-T258 VanDerWaalsContact O-OG1 3.07Å
255	R	90.4	Very high	87.5	Confident	11 Å²	11	40.4 Å²	40.4	4%	0.042	22%	0.221	C	C	.	.	H	α-helix	trans	-57.9	-47.1	176.2	-177.1	-177.9	-59.2	107.7	12.5	110.8	P230 H231 R233 L251 E252 H257 T258 Y259 E293	P230-R255 HydrophobicContact CB-CG 4.17Å; P230-R255 HydrophobicContact CG-CG 4.4Å; H231-R255 PolarHBondContact O-NE 3.4Å; R233-R255 VanDerWaalsContact CG-NH1 3.32Å; L251-R255 WeakPolarHBondContact O-CB 3.35Å; L251-R255 PolarHBondContact O-N 2.83Å; L251-R255 VanDerWaalsContact O-N 3.12Å; E252-R255 PolarHBondContact O-N 3.17Å; R255-H257 PolarHBondContact O-N 3.26Å; R255-T258 PolarHBondContact O-N 3.42Å; R255-Y259 HydrophobicContact CG-CD2 3.72Å; R255-Y259 HydrophobicContact CG-CE2 3.7Å; R255-Y259 VanDerWaalsContact O-CD2 3.29Å; R255-Y259 WeakPolarHBondContact O-CD2 3.3Å; R255-Y259 PolarHBondContact O-N 3.5Å; R255-E293 IonicContact CZ-OE1 2.75Å; R255-E293 IonicContact NH1-OE1 3.69Å; R255-E293 PolarHBondContact NH1-OE1 3.39Å
256	L	89.7	Confident	87.9	Confident	8 Å²	8	36.3 Å²	36.3	4%	0.042	19%	0.187	C	C	.	.	H	α-helix	trans	-58.1	-48.2	177.1	178.3	64.2	0	0	0	111.4	E252 Q253 Q254 T258 Y259 Q260 F296 E299 Y300 L303	E252-L256 PolarHBondContact O-N 3.04Å; Q253-L256 WeakPolarHBondContact O-CB 3.48Å; Q253-L256 PolarHBondContact O-N 2.92Å; Q254-L256 VanDerWaalsContact C-N 3.33Å; Q254-L256 PolarHBondContact O-N 3.11Å; L256-T258 VanDerWaalsContact C-N 3.35Å; L256-T258 PolarHBondContact O-N 2.78Å; L256-Y259 PolarHBondContact O-N 3.13Å; L256-Q260 HydrophobicContact CD1-CG 4.28Å; L256-Q260 HydrophobicContact CG-CG 4.37Å; L256-Q260 WeakPolarHBondContact O-CB 3.43Å; L256-Q260 VanDerWaalsContact O-CG 3.28Å; L256-Q260 WeakPolarHBondContact O-CG 3.49Å; L256-Q260 PolarHBondContact O-N 3.26Å; L256-F296 HydrophobicContact CD2-CB 4.29Å; L256-F296 HydrophobicContact CD2-CD1 3.74Å; L256-F296 HydrophobicContact CD2-CE1 4.15Å; L256-F296 HydrophobicContact CD2-CG 3.93Å; L256-E299 HydrophobicContact CD1-CB 4.18Å; L256-E299 HydrophobicContact CD2-CB 4.46Å; L256-Y300 HydrophobicContact CB-CE1 4.47Å; L256-Y300 HydrophobicContact CD1-CD1 3.89Å; L256-Y300 HydrophobicContact CD1-CE1 3.65Å; L256-Y300 HydrophobicContact CD1-CG 4.43Å; L256-L303 HydrophobicContact CD1-CD1 3.98Å
257	H	89.8	Confident	88.4	Confident	24 Å²	24	29.8 Å²	29.8	11%	0.111	16%	0.156	C	C	.	.	H	α-helix	trans	-61.6	-41.7	178.8	-66.3	165.6	0	0	0	112	M206 H210 Q253 Q254 R255 Y259 Q260 A261	M206-H257 HydrophobicContact CE-CB 3.78Å; H210-H257 PolarHBondContact CE1-O 3.34Å; Q253-H257 VanDerWaalsContact CG-CE1 3.48Å; Q253-H257 WeakPolarHBondContact CG-CE1 3.47Å; Q253-H257 PolarHBondContact NE2-CE1 3.45Å; Q253-H257 VanDerWaalsContact O-CG 3.29Å; Q253-H257 PolarHBondContact O-N 3.25Å; Q254-H257 PolarHBondContact O-N 3.12Å; R255-H257 PolarHBondContact O-N 3.26Å; H257-Y259 PolarHBondContact O-N 2.95Å; H257-Q260 PolarHBondContact O-N 2.87Å; H257-A261 PolarHBondContact O-N 3.31Å
258	T	90.6	Very high	88.8	Confident	20 Å²	20	26.7 Å²	26.7	12%	0.123	14%	0.139	C	C	.	.	H	α-helix	trans	-62.8	-43.5	176	-55.3	0	0	0	0	111.4	L227 E228 P230 Q254 R255 L256 A261 L262	L227-T258 HydrophobicContact CD1-CG2 4.14Å; L227-T258 HydrophobicContact CD2-CG2 4.27Å; L227-T258 HydrophobicContact CG-CG2 4.11Å; E228-T258 WeakPolarHBondContact O-CG2 3.47Å; P230-T258 HydrophobicContact CB-CG2 4.14Å; P230-T258 HydrophobicContact CG-CG2 4.02Å; Q254-T258 PolarHBondContact O-N 3.17Å; Q254-T258 PolarHBondContact O-OG1 2.91Å; Q254-T258 VanDerWaalsContact O-OG1 3.07Å; R255-T258 PolarHBondContact O-N 3.42Å; L256-T258 VanDerWaalsContact C-N 3.35Å; L256-T258 PolarHBondContact O-N 2.78Å; T258-A261 PolarHBondContact O-N 3.26Å; T258-L262 HydrophobicContact CG2-CD1 4.18Å; T258-L262 WeakPolarHBondContact O-CG 3.46Å; T258-L262 PolarHBondContact O-N 3.42Å
259	Y	91.8	Very high	88.9	Confident	12 Å²	12	24.1 Å²	24.1	5%	0.047	12%	0.122	C	C	.	.	H	α-helix	trans	-68.2	-35.4	176.3	-86.5	-66.3	0	0	0	113.7	P230 R255 L256 H257 A261 L262 S263 L286 L289 Y300	P230-Y259 HydrophobicContact CB-CE2 4.38Å; P230-Y259 HydrophobicContact CG-CD2 3.8Å; P230-Y259 HydrophobicContact CG-CE1 4.38Å; P230-Y259 HydrophobicContact CG-CE2 3.31Å; P230-Y259 HydrophobicContact CG-CG 4.49Å; R255-Y259 HydrophobicContact CG-CD2 3.72Å; R255-Y259 HydrophobicContact CG-CE2 3.7Å; R255-Y259 VanDerWaalsContact O-CD2 3.29Å; R255-Y259 WeakPolarHBondContact O-CD2 3.3Å; R255-Y259 PolarHBondContact O-N 3.5Å; L256-Y259 PolarHBondContact O-N 3.13Å; H257-Y259 PolarHBondContact O-N 2.95Å; Y259-A261 VanDerWaalsContact C-N 3.27Å; Y259-A261 PolarHBondContact O-N 2.87Å; Y259-L262 HydrophobicContact CD1-CD1 4.29Å; Y259-L262 HydrophobicContact CE1-CD1 4.49Å; Y259-L262 PolarHBondContact O-N 3.17Å; Y259-S263 VanDerWaalsContact O-CB 3.29Å; Y259-S263 WeakPolarHBondContact O-CB 3.28Å; Y259-S263 PolarHBondContact O-N 2.84Å; Y259-S263 PolarHBondContact O-OG 3.14Å; Y259-L286 HydrophobicContact CD1-CD2 3.94Å; Y259-L286 HydrophobicContact CG-CD2 4Å; Y259-L289 HydrophobicContact CD2-CD1 3.71Å; Y259-L289 HydrophobicContact CE1-CD1 4.31Å; Y259-L289 HydrophobicContact CE2-CD1 3.17Å; Y259-L289 HydrophobicContact CG-CD1 4.47Å; Y259-Y300 HydrophobicContact CD2-CE1 4.37Å
260	Q	92	Very high	88.9	Confident	55 Å²	55	23.2 Å²	23.2	26%	0.257	12%	0.117	S	C	.	.	H	α-helix	trans	-61	-38.2	171.7	-77.7	178.2	-11.5	0	0	111.6	H210 L256 H257 S263 S264 L303	H210-Q260 VanDerWaalsContact CE1-CB 3.41Å; H210-Q260 WeakPolarHBondContact CE1-CB 3.39Å; H210-Q260 PolarHBondContact CE1-OE1 3.49Å; H210-Q260 VanDerWaalsContact CE1-OE1 3.32Å; H210-Q260 WeakPolarHBondContact ND1-CB 3.28Å; L256-Q260 HydrophobicContact CD1-CG 4.28Å; L256-Q260 HydrophobicContact CG-CG 4.37Å; L256-Q260 WeakPolarHBondContact O-CB 3.43Å; L256-Q260 VanDerWaalsContact O-CG 3.28Å; L256-Q260 WeakPolarHBondContact O-CG 3.49Å; L256-Q260 PolarHBondContact O-N 3.26Å; H257-Q260 PolarHBondContact O-N 2.87Å; Q260-S263 WeakPolarHBondContact CA-OG 3.18Å; Q260-S263 PolarHBondContact O-OG 3.39Å; Q260-S264 PolarHBondContact O-N 2.91Å; Q260-L303 HydrophobicContact CB-CD1 4.23Å; Q260-L303 HydrophobicContact CB-CD2 4.32Å; Q260-L303 HydrophobicContact CG-CD1 3.36Å; Q260-L303 HydrophobicContact CG-CD2 3.77Å; Q260-L303 HydrophobicContact CG-CG 4.14Å
261	A	90.9	Very high	89	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-71.7	-43.2	174.7	0	0	0	0	0	112.2	M206 A209 L227 H257 T258 Y259 S263 S264	M206-A261 HydrophobicContact CB-CB 4.15Å; M206-A261 HydrophobicContact CG-CB 4.01Å; A209-A261 HydrophobicContact CB-CB 3.68Å; L227-A261 HydrophobicContact CD2-CB 3.5Å; H257-A261 PolarHBondContact O-N 3.31Å; T258-A261 PolarHBondContact O-N 3.26Å; Y259-A261 VanDerWaalsContact C-N 3.27Å; Y259-A261 PolarHBondContact O-N 2.87Å; A261-S263 VanDerWaalsContact C-N 3.32Å; A261-S263 PolarHBondContact O-N 2.87Å; A261-S264 WeakPolarHBondContact O-CB 3.23Å; A261-S264 PolarHBondContact O-N 3.37Å
262	L	90.8	Very high	89	Confident	19 Å²	19	23.8 Å²	23.8	10%	0.099	12%	0.124	C	C	.	.	H	α-helix	trans	-64.4	-33.5	177.3	-71.3	171.2	0	0	0	113.3	L227 T258 Y259 S264 Y267 L268	L227-L262 HydrophobicContact CB-CD2 4.28Å; L227-L262 HydrophobicContact CD2-CD2 3.67Å; L227-L262 HydrophobicContact CD2-CG 3.67Å; L227-L262 HydrophobicContact CG-CD2 4.07Å; L227-L262 HydrophobicContact CG-CG 4.34Å; T258-L262 HydrophobicContact CG2-CD1 4.18Å; T258-L262 WeakPolarHBondContact O-CG 3.46Å; T258-L262 PolarHBondContact O-N 3.42Å; Y259-L262 HydrophobicContact CD1-CD1 4.29Å; Y259-L262 HydrophobicContact CE1-CD1 4.49Å; Y259-L262 PolarHBondContact O-N 3.17Å; L262-S264 VanDerWaalsContact C-N 3.29Å; L262-Y267 HydrophobicContact CD2-CE1 3.79Å; L262-L268 VanDerWaalsContact O-CD2 3.29Å; L262-L268 WeakPolarHBondContact O-CD2 3.4Å; L262-L268 WeakPolarHBondContact O-CG 3.19Å
263	S	91.3	Very high	88.5	Confident	7 Å²	7	26.3 Å²	26.3	5%	0.049	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-6.7	178.5	54.7	0	0	0	0	113.9	Y259 Q260 A261 S265 C307	Y259-S263 VanDerWaalsContact O-CB 3.29Å; Y259-S263 WeakPolarHBondContact O-CB 3.28Å; Y259-S263 PolarHBondContact O-N 2.84Å; Y259-S263 PolarHBondContact O-OG 3.14Å; Q260-S263 WeakPolarHBondContact CA-OG 3.18Å; Q260-S263 PolarHBondContact O-OG 3.39Å; A261-S263 VanDerWaalsContact C-N 3.32Å; A261-S263 PolarHBondContact O-N 2.87Å; S263-S265 PolarHBondContact O-N 3.28Å; S263-C307 WeakPolarHBondContact CB-SG 3.4Å
264	S	91	Very high	88.1	Confident	11 Å²	11	23.2 Å²	23.2	8%	0.077	13%	0.132	C	C	.	.			trans	-61.2	130.7	178.6	-176.8	0	0	0	0	111	A209 N212 Q260 A261 L262 A266 Y267 L268	A209-S264 WeakPolarHBondContact O-CB 3.31Å; A209-S264 PolarHBondContact O-OG 3Å; N212-S264 PolarHBondContact OD1-OG 2.97Å; N212-S264 VanDerWaalsContact OD1-OG 3.06Å; Q260-S264 PolarHBondContact O-N 2.91Å; A261-S264 WeakPolarHBondContact O-CB 3.23Å; A261-S264 PolarHBondContact O-N 3.37Å; L262-S264 VanDerWaalsContact C-N 3.29Å; S264-A266 PolarHBondContact O-N 3.29Å; S264-Y267 PolarHBondContact O-N 3.01Å; S264-L268 WeakPolarHBondContact O-CG 3.39Å; S264-L268 PolarHBondContact O-N 2.95Å
265	S	90.4	Very high	87.9	Confident	16 Å²	16	21.5 Å²	21.5	11%	0.112	12%	0.124	C	C	.	.	H	α-helix	trans	-70	-34.4	-170.1	71.9	0	0	0	0	113	N212 S263 A269 Y949	N212-S265 PolarHBondContact ND2-OG 3.47Å; N212-S265 PolarHBondContact OD1-N 2.9Å; N212-S265 PolarHBondContact OD1-OG 3.3Å; S263-S265 PolarHBondContact O-N 3.28Å; S265-A269 WeakPolarHBondContact O-CB 3.49Å; S265-A269 PolarHBondContact O-N 3.45Å; S265-A269 VanDerWaalsContact O-N 3.09Å; S265-Y949 WeakPolarHBondContact CB-OH 3.32Å; S265-Y949 PolarHBondContact OG-OH 3.24Å
266	A	88	Confident	87.6	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-68	-40.4	172.7	0	0	0	0	0	111.6	N212 H214 I217 S264 A269 L270 L953	N212-A266 WeakPolarHBondContact OD1-CB 3.12Å; N212-A266 PolarHBondContact OD1-N 2.97Å; H214-A266 HydrophobicContact CB-CB 3.93Å; I217-A266 HydrophobicContact CD1-CB 3.75Å; S264-A266 PolarHBondContact O-N 3.29Å; A266-A269 PolarHBondContact O-N 2.99Å; A266-L270 WeakPolarHBondContact O-CD1 3.4Å; A266-L270 VanDerWaalsContact O-CG 3.22Å; A266-L270 WeakPolarHBondContact O-CG 3.44Å; A266-L270 PolarHBondContact O-N 2.84Å; A266-L953 HydrophobicContact CB-CD1 4.08Å
267	Y	90.5	Very high	87.3	Confident	18 Å²	18	22.9 Å²	22.9	7%	0.071	14%	0.136	C	C	.	.	H	α-helix	trans	-62	-50.9	176.6	-177.3	-97.9	0	0	0	110.7	L205 I217 L221 L227 L262 S264 A269 L270 T271	L205-Y267 HydrophobicContact CD2-CE2 4.42Å; I217-Y267 HydrophobicContact CG2-CD2 4.18Å; L221-Y267 HydrophobicContact CD2-CE2 4.2Å; L227-Y267 HydrophobicContact CB-CE2 4.34Å; L227-Y267 WeakPolarHBondContact CB-OH 3.2Å; L262-Y267 HydrophobicContact CD2-CE1 3.79Å; S264-Y267 PolarHBondContact O-N 3.01Å; Y267-A269 VanDerWaalsContact C-N 3.31Å; Y267-A269 PolarHBondContact O-N 3.5Å; Y267-L270 PolarHBondContact O-N 3.03Å; Y267-L270 VanDerWaalsContact O-N 3.08Å; Y267-T271 HydrophobicContact CD1-CG2 4.33Å; Y267-T271 HydrophobicContact CD2-CG2 4.04Å; Y267-T271 HydrophobicContact CE1-CG2 3.94Å; Y267-T271 HydrophobicContact CE2-CG2 3.64Å; Y267-T271 HydrophobicContact CG-CG2 4.37Å; Y267-T271 PolarHBondContact O-N 3.04Å; Y267-T271 PolarHBondContact O-OG1 3.11Å; Y267-T271 VanDerWaalsContact O-OG1 3.1Å
268	L	88.5	Confident	87	Confident	6 Å²	6	23.6 Å²	23.6	3%	0.031	14%	0.142	C	C	.	.	H	α-helix	trans	-57	-42.4	177.9	-72.2	175.1	0	0	0	112.7	L262 S264 L270 T272 L282 F310	L262-L268 VanDerWaalsContact O-CD2 3.29Å; L262-L268 WeakPolarHBondContact O-CD2 3.4Å; L262-L268 WeakPolarHBondContact O-CG 3.19Å; S264-L268 WeakPolarHBondContact O-CG 3.39Å; S264-L268 PolarHBondContact O-N 2.95Å; L268-L270 PolarHBondContact O-N 2.74Å; L268-T272 WeakPolarHBondContact O-CB 3.36Å; L268-T272 PolarHBondContact O-N 2.97Å; L268-T272 PolarHBondContact O-OG1 2.71Å; L268-L282 HydrophobicContact CD1-CD1 4.46Å; L268-L282 HydrophobicContact CD2-CD1 3.59Å; L268-F310 HydrophobicContact CB-CD1 4.22Å; L268-F310 HydrophobicContact CB-CE1 3.77Å; L268-F310 HydrophobicContact CB-CZ 3.94Å; L268-F310 HydrophobicContact CD1-CD1 3.91Å; L268-F310 HydrophobicContact CD1-CE1 4.22Å; L268-F310 HydrophobicContact CD1-CG 4.49Å
269	A	87.5	Confident	86.9	Confident	8 Å²	8	22.7 Å²	22.7	7%	0.066	14%	0.136	C	C	.	.	H	α-helix	trans	-63.9	-27	179.6	0	0	0	0	0	113.8	S265 A266 Y267 F310 M946 Y949 L950	S265-A269 WeakPolarHBondContact O-CB 3.49Å; S265-A269 PolarHBondContact O-N 3.45Å; S265-A269 VanDerWaalsContact O-N 3.09Å; A266-A269 PolarHBondContact O-N 2.99Å; Y267-A269 VanDerWaalsContact C-N 3.31Å; Y267-A269 PolarHBondContact O-N 3.5Å; A269-F310 HydrophobicContact CB-CE2 4.03Å; A269-F310 HydrophobicContact CB-CZ 4.31Å; A269-M946 HydrophobicContact CB-SD 3.94Å; A269-Y949 HydrophobicContact CB-CD1 3.84Å; A269-Y949 HydrophobicContact CB-CE1 4.21Å; A269-L950 HydrophobicContact CB-CD2 4.01Å; A269-L950 HydrophobicContact CB-CG 4.37Å
270	L	86.5	Confident	86.7	Confident	50 Å²	50	22.7 Å²	22.7	26%	0.262	14%	0.137	S	C	.	.	H	α-helix	trans	-94.2	-34.9	-175.7	-65	168.4	0	0	0	113.1	I217 Q218 L221 A266 Y267 L268 L950	I217-L270 HydrophobicContact CB-CD1 4.08Å; I217-L270 HydrophobicContact CG2-CD1 3.66Å; Q218-L270 HydrophobicContact CG-CD1 3.56Å; Q218-L270 HydrophobicContact CG-CD2 3.6Å; Q218-L270 HydrophobicContact CG-CG 4.23Å; Q218-L270 VanDerWaalsContact NE2-CD2 3.3Å; L221-L270 HydrophobicContact CD1-CB 3.69Å; L221-L270 HydrophobicContact CD1-CD1 4.12Å; A266-L270 WeakPolarHBondContact O-CD1 3.4Å; A266-L270 VanDerWaalsContact O-CG 3.22Å; A266-L270 WeakPolarHBondContact O-CG 3.44Å; A266-L270 PolarHBondContact O-N 2.84Å; Y267-L270 PolarHBondContact O-N 3.03Å; Y267-L270 VanDerWaalsContact O-N 3.08Å; L268-L270 PolarHBondContact O-N 2.74Å; L270-L950 HydrophobicContact CD2-CD1 3.63Å; L270-L950 HydrophobicContact CD2-CD2 4.07Å; L270-L950 HydrophobicContact CG-CD2 4.29Å
271	T	85.3	Confident	86.5	Confident	62 Å²	62	24.5 Å²	24.5	38%	0.38	15%	0.147	S	C	.	.	H	α-helix	trans	-91.5	-22.5	-174	59.4	0	0	0	0	114.1	L221 Y267	L221-T271 HydrophobicContact CD1-CG2 3.9Å; L221-T271 HydrophobicContact CD2-CG2 4.14Å; Y267-T271 HydrophobicContact CD1-CG2 4.33Å; Y267-T271 HydrophobicContact CD2-CG2 4.04Å; Y267-T271 HydrophobicContact CE1-CG2 3.94Å; Y267-T271 HydrophobicContact CE2-CG2 3.64Å; Y267-T271 HydrophobicContact CG-CG2 4.37Å; Y267-T271 PolarHBondContact O-N 3.04Å; Y267-T271 PolarHBondContact O-OG1 3.11Å; Y267-T271 VanDerWaalsContact O-OG1 3.1Å
272	T	82.2	Confident	86.4	Confident	27 Å²	27	25.5 Å²	25.5	17%	0.166	15%	0.152	C	C	.	.			trans	-99.4	133.1	-162.4	-58.7	0	0	0	0	113	L268 D274 T278	L268-T272 WeakPolarHBondContact O-CB 3.36Å; L268-T272 PolarHBondContact O-N 2.97Å; L268-T272 PolarHBondContact O-OG1 2.71Å; T272-D274 VanDerWaalsContact CG2-N 3.34Å; T272-D274 WeakPolarHBondContact CG2-O 3.49Å; T272-T278 HydrophobicContact CG2-CG2 3.6Å; T272-T278 WeakPolarHBondContact CG2-OG1 3.15Å
273	S	77	Confident	86.4	Confident	85 Å²	85	25.8 Å²	25.8	59%	0.594	15%	0.152	S	C	*	.	S	Bend	trans	-76.4	-36.6	169.1	58.2	0	0	0	0	113.1
274	D	79.6	Confident	86.3	Confident	11 Å²	11	28.9 Å²	28.9	6%	0.059	17%	0.168	C	C	.	.			trans	-126.9	91.1	-176.3	-55.5	-86.4	0	0	0	110.9	T272 V276 S277 T278 T331 R942	T272-D274 VanDerWaalsContact CG2-N 3.34Å; T272-D274 WeakPolarHBondContact CG2-O 3.49Å; D274-V276 VanDerWaalsContact C-N 3.35Å; D274-V276 PolarHBondContact O-N 2.72Å; D274-S277 WeakPolarHBondContact CB-OG 3.48Å; D274-S277 PolarHBondContact O-OG 3.31Å; D274-T278 WeakPolarHBondContact O-CG2 3.48Å; D274-T278 PolarHBondContact O-N 3.04Å; D274-T278 PolarHBondContact O-OG1 2.82Å; D274-T331 HydrophobicContact CB-CG2 4.33Å; D274-T331 WeakPolarHBondContact OD1-CG2 3.3Å; D274-T331 WeakPolarHBondContact OD2-CG2 3.47Å; D274-R942 IonicContact OD1-CZ 2.64Å; D274-R942 IonicContact OD1-NE 3.87Å; D274-R942 IonicContact OD1-NH1 3.42Å; D274-R942 PolarHBondContact OD1-NH1 3.26Å; D274-R942 IonicContact OD1-NH2 3.5Å
275	P	81.6	Confident	86.2	Confident	2 Å²	2	30.9 Å²	30.9	1%	0.013	18%	0.176	C	C	.	.	H	α-helix	trans	-64.8	-38.2	-169.6	28.3	-40.4	0	0	0	113.2	T278 A279 F310 L327 M946	P275-T278 PolarHBondContact O-OG1 2.91Å; P275-A279 WeakPolarHBondContact O-CB 3.36Å; P275-A279 PolarHBondContact O-N 3.07Å; P275-F310 HydrophobicContact CB-CE1 3.77Å; P275-F310 HydrophobicContact CB-CZ 3.97Å; P275-L327 HydrophobicContact CG-CD1 3.54Å; P275-M946 HydrophobicContact CB-CE 3.18Å; P275-M946 HydrophobicContact CG-CE 3.18Å
276	V	84.6	Confident	86.3	Confident	3 Å²	3	30.1 Å²	30.1	2%	0.018	17%	0.171	C	C	.	.	H	α-helix	trans	-74.7	-46.4	-173.2	175.2	0	0	0	0	110	D274 A279 F280 L327 L328 T345 F357	D274-V276 VanDerWaalsContact C-N 3.35Å; D274-V276 PolarHBondContact O-N 2.72Å; V276-A279 PolarHBondContact O-N 3.44Å; V276-F280 HydrophobicContact CG1-CD2 3.71Å; V276-F280 HydrophobicContact CG1-CE2 3.31Å; V276-F280 HydrophobicContact CG1-CZ 4.41Å; V276-F280 WeakPolarHBondContact O-CD2 3.34Å; V276-F280 PolarHBondContact O-N 2.79Å; V276-L327 HydrophobicContact CG2-CD1 4.35Å; V276-L327 HydrophobicContact CG2-CD2 4.25Å; V276-L327 HydrophobicContact CG2-CG 4.06Å; V276-L328 HydrophobicContact CG1-CD2 4.32Å; V276-T345 HydrophobicContact CB-CG2 4.5Å; V276-T345 HydrophobicContact CG1-CG2 3.49Å; V276-T345 VanDerWaalsContact CG1-CG2 3.49Å; V276-F357 HydrophobicContact CG1-CE2 4.15Å; V276-F357 HydrophobicContact CG1-CZ 3.87Å
277	S	83	Confident	86.4	Confident	45 Å²	45	34.5 Å²	34.5	32%	0.315	19%	0.188	S	C	.	.	H	α-helix	trans	-66.7	-41.5	-179.5	59	0	0	0	0	112.4	D274 F280 I281	D274-S277 WeakPolarHBondContact CB-OG 3.48Å; D274-S277 PolarHBondContact O-OG 3.31Å; S277-F280 WeakPolarHBondContact O-CB 3.19Å; S277-F280 PolarHBondContact O-N 2.96Å; S277-I281 VanDerWaalsContact O-CG1 3.27Å; S277-I281 WeakPolarHBondContact O-CG1 3.24Å; S277-I281 PolarHBondContact O-N 2.93Å
278	T	84	Confident	86.4	Confident	38 Å²	38	39.1 Å²	39.1	23%	0.233	21%	0.21	C	C	.	.	H	α-helix	trans	-65.7	-41	175.1	52.9	0	0	0	0	112	T272 D274 P275 F280 I281 L282	T272-T278 HydrophobicContact CG2-CG2 3.6Å; T272-T278 WeakPolarHBondContact CG2-OG1 3.15Å; D274-T278 WeakPolarHBondContact O-CG2 3.48Å; D274-T278 PolarHBondContact O-N 3.04Å; D274-T278 PolarHBondContact O-OG1 2.82Å; P275-T278 PolarHBondContact O-OG1 2.91Å; T278-F280 VanDerWaalsContact C-N 3.29Å; T278-F280 PolarHBondContact O-N 3.28Å; T278-I281 PolarHBondContact O-N 2.96Å; T278-L282 WeakPolarHBondContact O-CB 3.43Å; T278-L282 WeakPolarHBondContact O-CG 3.45Å; T278-L282 PolarHBondContact O-N 3.05Å
279	A	88	Confident	86.3	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.008	21%	0.212	C	C	.	.	H	α-helix	trans	-59.1	-40.8	173.2	0	0	0	0	0	111.7	P275 V276 R283 A311	P275-A279 WeakPolarHBondContact O-CB 3.36Å; P275-A279 PolarHBondContact O-N 3.07Å; V276-A279 PolarHBondContact O-N 3.44Å; A279-R283 WeakPolarHBondContact O-CB 3.16Å; A279-R283 PolarHBondContact O-N 2.92Å; A279-A311 HydrophobicContact CB-CB 4.06Å
280	F	87.7	Confident	86.5	Confident	13 Å²	13	39.4 Å²	39.4	6%	0.057	21%	0.211	C	C	.	.	H	α-helix	trans	-64.3	-42.2	173.9	-79.6	-63.6	0	0	0	113.1	V276 S277 T278 N284 M308 T345 A349 E354 F357	V276-F280 HydrophobicContact CG1-CD2 3.71Å; V276-F280 HydrophobicContact CG1-CE2 3.31Å; V276-F280 HydrophobicContact CG1-CZ 4.41Å; V276-F280 WeakPolarHBondContact O-CD2 3.34Å; V276-F280 PolarHBondContact O-N 2.79Å; S277-F280 WeakPolarHBondContact O-CB 3.19Å; S277-F280 PolarHBondContact O-N 2.96Å; T278-F280 VanDerWaalsContact C-N 3.29Å; T278-F280 PolarHBondContact O-N 3.28Å; F280-N284 WeakPolarHBondContact O-CB 3.32Å; F280-N284 VanDerWaalsContact O-CG 3.29Å; F280-N284 PolarHBondContact O-N 2.83Å; F280-N284 PolarHBondContact O-ND2 3.48Å; F280-M308 HydrophobicContact CE1-CE 4.14Å; F280-M308 HydrophobicContact CE1-SD 4.45Å; F280-M308 HydrophobicContact CZ-CE 4.19Å; F280-T345 HydrophobicContact CD2-CG2 4.47Å; F280-T345 HydrophobicContact CE2-CG2 3.95Å; F280-A349 HydrophobicContact CE1-CB 3.79Å; F280-A349 HydrophobicContact CE2-CB 4.34Å; F280-A349 HydrophobicContact CZ-CB 3.41Å; F280-A349 VanDerWaalsContact CZ-CB 3.41Å; F280-E354 HydrophobicContact CD1-CG 4.35Å; F280-E354 HydrophobicContact CE1-CB 4.37Å; F280-E354 HydrophobicContact CE1-CG 3.57Å; F280-E354 HydrophobicContact CZ-CG 4.47Å; F280-F357 HydrophobicContact CE2-CE1 4.37Å; F280-F357 HydrophobicContact CE2-CZ 4.35Å; F280-F357 HydrophobicContact CZ-CD1 4.13Å; F280-F357 HydrophobicContact CZ-CE1 4.04Å; F280-F357 HydrophobicContact CZ-CZ 4.36Å
281	I	87.5	Confident	86.6	Confident	92 Å²	92	41 Å²	41	47%	0.472	23%	0.226	S	C	.	.	H	α-helix	trans	-63.5	-54.1	178.5	-68.4	162.9	0	0	0	109.9	S277 T278 R283 N284 E285	S277-I281 VanDerWaalsContact O-CG1 3.27Å; S277-I281 WeakPolarHBondContact O-CG1 3.24Å; S277-I281 PolarHBondContact O-N 2.93Å; T278-I281 PolarHBondContact O-N 2.96Å; I281-R283 VanDerWaalsContact C-N 3.28Å; I281-R283 PolarHBondContact O-N 3.32Å; I281-N284 PolarHBondContact O-N 2.82Å; I281-N284 VanDerWaalsContact O-N 3.1Å; I281-E285 WeakPolarHBondContact CG2-OE1 3.42Å; I281-E285 PolarHBondContact O-N 3.45Å
282	L	89.3	Confident	86.7	Confident	21 Å²	21	43.1 Å²	43.1	11%	0.11	23%	0.232	C	C	.	.	H	α-helix	trans	-58.5	-41.7	179.3	-73	173.2	0	0	0	111.6	L268 T278 N284 E285 L286	L268-L282 HydrophobicContact CD1-CD1 4.46Å; L268-L282 HydrophobicContact CD2-CD1 3.59Å; T278-L282 WeakPolarHBondContact O-CB 3.43Å; T278-L282 WeakPolarHBondContact O-CG 3.45Å; T278-L282 PolarHBondContact O-N 3.05Å; L282-N284 PolarHBondContact O-N 2.89Å; L282-E285 PolarHBondContact O-N 3.03Å; L282-L286 WeakPolarHBondContact O-CB 3.25Å; L282-L286 WeakPolarHBondContact O-CG 3.33Å; L282-L286 PolarHBondContact O-N 2.91Å
283	R	90.3	Very high	86.9	Confident	26 Å²	26	42 Å²	42	10%	0.098	23%	0.225	C	C	.	.	H	α-helix	trans	-60.9	-44.2	176.3	174.8	165.1	175.3	138.3	3.3	112.7	A279 I281 E285 L286 Y287 A304 M308 E354	A279-R283 WeakPolarHBondContact O-CB 3.16Å; A279-R283 PolarHBondContact O-N 2.92Å; I281-R283 VanDerWaalsContact C-N 3.28Å; I281-R283 PolarHBondContact O-N 3.32Å; R283-E285 VanDerWaalsContact C-N 3.33Å; R283-L286 PolarHBondContact O-N 3.48Å; R283-Y287 HydrophobicContact CG-CD2 3.98Å; R283-Y287 HydrophobicContact CG-CE2 3.91Å; R283-Y287 PolarHBondContact NH2-OH 3.42Å; R283-Y287 PolarHBondContact O-N 3.25Å; R283-A304 HydrophobicContact CG-CB 4.22Å; R283-M308 VanDerWaalsContact NH1-CG 3.26Å; R283-E354 IonicContact CZ-OE1 4Å; R283-E354 IonicContact CZ-OE2 3.67Å; R283-E354 IonicContact NE-OE1 3.07Å; R283-E354 PolarHBondContact NE-OE1 3.49Å; R283-E354 IonicContact NE-OE2 2.86Å; R283-E354 PolarHBondContact NE-OE2 3.09Å; R283-E354 IonicContact NH1-OE1 2.9Å; R283-E354 IonicContact NH1-OE2 2.7Å; R283-E354 PolarHBondContact NH1-OE2 3.47Å; R283-E354 IonicContact NH2-OE1 2.76Å; R283-E354 PolarHBondContact NH2-OE1 2.87Å; R283-E354 IonicContact NH2-OE2 3Å; R283-E354 PolarHBondContact NH2-OE2 2.92Å
284	N	89.1	Confident	87.3	Confident	71 Å²	71	46.6 Å²	46.6	38%	0.38	23%	0.234	S	C	.	.	H	α-helix	trans	-64.5	-39.5	177.7	-74.9	-28.9	0	0	0	111.7	F280 I281 L282 Q288	F280-N284 WeakPolarHBondContact O-CB 3.32Å; F280-N284 VanDerWaalsContact O-CG 3.29Å; F280-N284 PolarHBondContact O-N 2.83Å; F280-N284 PolarHBondContact O-ND2 3.48Å; I281-N284 PolarHBondContact O-N 2.82Å; I281-N284 VanDerWaalsContact O-N 3.1Å; L282-N284 PolarHBondContact O-N 2.89Å; N284-Q288 VanDerWaalsContact O-CG 3.28Å; N284-Q288 WeakPolarHBondContact O-CG 3.18Å; N284-Q288 PolarHBondContact O-N 3.18Å
285	E	89.6	Confident	87.6	Confident	53 Å²	53	52.4 Å²	52.4	25%	0.248	26%	0.261	C	S	.	.	H	α-helix	trans	-63.4	-46.9	174.3	-70.3	176.2	-171.2	0	0	111.5	I281 L282 R283 Y287 Q288 L289	I281-E285 WeakPolarHBondContact CG2-OE1 3.42Å; I281-E285 PolarHBondContact O-N 3.45Å; L282-E285 PolarHBondContact O-N 3.03Å; R283-E285 VanDerWaalsContact C-N 3.33Å; E285-Y287 VanDerWaalsContact C-N 3.34Å; E285-Y287 PolarHBondContact O-N 3.45Å; E285-Q288 WeakPolarHBondContact O-CB 3.05Å; E285-Q288 PolarHBondContact O-N 3.45Å; E285-Q288 VanDerWaalsContact O-N 3.16Å; E285-L289 WeakPolarHBondContact O-CG 3.43Å; E285-L289 PolarHBondContact O-N 3.29Å
286	L	92.1	Very high	88	Confident	1 Å²	1	54 Å²	54	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-59.7	-41.5	178.3	-71.9	167.4	0	0	0	112.2	Y259 L282 R283 L289 A290 Y300 L303 A304	Y259-L286 HydrophobicContact CD1-CD2 3.94Å; Y259-L286 HydrophobicContact CG-CD2 4Å; L282-L286 WeakPolarHBondContact O-CB 3.25Å; L282-L286 WeakPolarHBondContact O-CG 3.33Å; L282-L286 PolarHBondContact O-N 2.91Å; R283-L286 PolarHBondContact O-N 3.48Å; L286-L289 PolarHBondContact O-N 2.99Å; L286-A290 VanDerWaalsContact O-CB 3.31Å; L286-A290 WeakPolarHBondContact O-CB 3.38Å; L286-A290 PolarHBondContact O-N 3.3Å; L286-Y300 HydrophobicContact CD2-CD1 3.69Å; L286-Y300 HydrophobicContact CD2-CE1 4.36Å; L286-L303 HydrophobicContact CD1-CB 4.06Å; L286-L303 HydrophobicContact CD2-CB 4.36Å; L286-A304 HydrophobicContact CB-CB 4.05Å; L286-A304 HydrophobicContact CD1-CB 4.22Å
287	Y	90.5	Very high	88.3	Confident	92 Å²	92	59.7 Å²	59.7	36%	0.361	29%	0.292	S	S	.	.	H	α-helix	trans	-70.7	-34.4	176	-81.4	-47.4	0	0	0	113.6	R283 E285 L289 A290 S291 A304	R283-Y287 HydrophobicContact CG-CD2 3.98Å; R283-Y287 HydrophobicContact CG-CE2 3.91Å; R283-Y287 PolarHBondContact NH2-OH 3.42Å; R283-Y287 PolarHBondContact O-N 3.25Å; E285-Y287 VanDerWaalsContact C-N 3.34Å; E285-Y287 PolarHBondContact O-N 3.45Å; Y287-L289 VanDerWaalsContact C-N 3.35Å; Y287-A290 PolarHBondContact O-N 2.69Å; Y287-S291 PolarHBondContact O-N 3.17Å; Y287-A304 HydrophobicContact CD1-CB 4.49Å; Y287-A304 HydrophobicContact CD2-CB 4.46Å; Y287-A304 HydrophobicContact CE1-CB 4.11Å; Y287-A304 HydrophobicContact CE2-CB 4.13Å
288	Q	89.9	Confident	88.8	Confident	115 Å²	115	64.9 Å²	64.9	54%	0.537	31%	0.312	S	S	.	.	H	α-helix	trans	-62	-48.1	171.8	-73.6	175.8	40	0	0	109.8	N284 E285 A290 S291 Q292	N284-Q288 VanDerWaalsContact O-CG 3.28Å; N284-Q288 WeakPolarHBondContact O-CG 3.18Å; N284-Q288 PolarHBondContact O-N 3.18Å; E285-Q288 WeakPolarHBondContact O-CB 3.05Å; E285-Q288 PolarHBondContact O-N 3.45Å; E285-Q288 VanDerWaalsContact O-N 3.16Å; Q288-A290 PolarHBondContact O-N 3.48Å; Q288-S291 PolarHBondContact O-N 3.09Å; Q288-S291 VanDerWaalsContact O-N 3.13Å; Q288-S291 PolarHBondContact O-OG 3.37Å; Q288-Q292 VanDerWaalsContact O-CD 3.27Å; Q288-Q292 VanDerWaalsContact O-CG 3.29Å; Q288-Q292 WeakPolarHBondContact O-CG 3.4Å; Q288-Q292 PolarHBondContact O-N 3.21Å; Q288-Q292 PolarHBondContact O-OE1 3.39Å
289	L	88.2	Confident	89.2	Confident	13 Å²	13	66.5 Å²	66.5	7%	0.068	32%	0.316	C	S	.	.	H	α-helix	trans	-60.1	-44.5	176.2	-68.1	172.9	0	0	0	112.2	Y259 E285 L286 Y287 S291 Q292 E293 Y300	Y259-L289 HydrophobicContact CD2-CD1 3.71Å; Y259-L289 HydrophobicContact CE1-CD1 4.31Å; Y259-L289 HydrophobicContact CE2-CD1 3.17Å; Y259-L289 HydrophobicContact CG-CD1 4.47Å; E285-L289 WeakPolarHBondContact O-CG 3.43Å; E285-L289 PolarHBondContact O-N 3.29Å; L286-L289 PolarHBondContact O-N 2.99Å; Y287-L289 VanDerWaalsContact C-N 3.35Å; L289-S291 PolarHBondContact O-N 3.15Å; L289-Q292 PolarHBondContact O-N 3.25Å; L289-E293 PolarHBondContact O-N 3.22Å; L289-Y300 HydrophobicContact CB-CD2 4.45Å; L289-Y300 HydrophobicContact CB-CE1 4.41Å; L289-Y300 HydrophobicContact CB-CE2 4.37Å; L289-Y300 HydrophobicContact CD1-CE1 4.32Å
290	A	90.6	Very high	89.5	Confident	6 Å²	6	66.4 Å²	66.4	5%	0.05	32%	0.316	C	S	.	.	H	α-helix	trans	-60	-32.3	176.3	0	0	0	0	0	113.1	L286 Y287 Q288 Q292 K297	L286-A290 VanDerWaalsContact O-CB 3.31Å; L286-A290 WeakPolarHBondContact O-CB 3.38Å; L286-A290 PolarHBondContact O-N 3.3Å; Y287-A290 PolarHBondContact O-N 2.69Å; Q288-A290 PolarHBondContact O-N 3.48Å; A290-Q292 VanDerWaalsContact C-N 3.31Å; A290-K297 HydrophobicContact CB-CG 4.19Å; A290-K297 WeakPolarHBondContact O-CG 3.48Å
291	S	89.1	Confident	89.6	Confident	83 Å²	83	67.9 Å²	67.9	58%	0.58	33%	0.328	S	S	*	.	H	α-helix	trans	-74.2	-24.8	176.5	76.9	0	0	0	0	113	Y287 Q288 L289	Y287-S291 PolarHBondContact O-N 3.17Å; Q288-S291 PolarHBondContact O-N 3.09Å; Q288-S291 VanDerWaalsContact O-N 3.13Å; Q288-S291 PolarHBondContact O-OG 3.37Å; L289-S291 PolarHBondContact O-N 3.15Å
292	Q	87.7	Confident	89.9	Confident	107 Å²	107	68.4 Å²	68.4	50%	0.5	33%	0.328	S	S	.	.	H	α-helix	trans	-100.4	-42.7	-172.6	-66.6	159.5	-40.3	0	0	111.7	R233 Q288 L289 A290	R233-Q292 VanDerWaalsContact NH1-CB 3.34Å; Q288-Q292 VanDerWaalsContact O-CD 3.27Å; Q288-Q292 VanDerWaalsContact O-CG 3.29Å; Q288-Q292 WeakPolarHBondContact O-CG 3.4Å; Q288-Q292 PolarHBondContact O-N 3.21Å; Q288-Q292 PolarHBondContact O-OE1 3.39Å; L289-Q292 PolarHBondContact O-N 3.25Å; A290-Q292 VanDerWaalsContact C-N 3.31Å
293	E	85.8	Confident	90.1	Very high	5 Å²	5	67.9 Å²	67.9	2%	0.023	33%	0.326	C	S	.	.			trans	-93	94.7	171.9	-85.5	162	-130.7	0	0	110.2	R233 E252 R255 L289 Q295 Y300	R233-E293 VanDerWaalsContact CD-OE1 3.27Å; R233-E293 WeakPolarHBondContact CD-OE1 3.33Å; R233-E293 IonicContact CZ-OE1 2.64Å; R233-E293 IonicContact NE-OE1 3.83Å; R233-E293 VanDerWaalsContact NH1-CG 3.34Å; R233-E293 IonicContact NH1-OE1 4Å; R233-E293 PolarHBondContact NH1-OE1 2.97Å; E252-E293 HydrophobicContact CG-CG 4.4Å; R255-E293 IonicContact CZ-OE1 2.75Å; R255-E293 IonicContact NH1-OE1 3.69Å; R255-E293 PolarHBondContact NH1-OE1 3.39Å; L289-E293 PolarHBondContact O-N 3.22Å; E293-Q295 VanDerWaalsContact C-N 3.26Å; E293-Q295 PolarHBondContact O-N 3.5Å; E293-Y300 HydrophobicContact CB-CE2 4.04Å; E293-Y300 WeakPolarHBondContact OE2-CE2 3.41Å; E293-Y300 PolarHBondContact OE2-OH 3.41Å
294	K	85.6	Confident	90.2	Very high	180 Å²	180	66.7 Å²	66.7	78%	0.783	32%	0.321	S	S	*	.	S	Bend	trans	-68.4	-23.9	-178.3	-67.9	-174.8	-179.1	178.4	0	113.9
295	Q	86.2	Confident	90.3	Very high	133 Å²	133	66 Å²	66	62%	0.621	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-41	-174.5	-58.8	-177.2	24.9	0	0	111.7	L249 E293	L249-Q295 VanDerWaalsContact CD1-OE1 3.31Å; E293-Q295 VanDerWaalsContact C-N 3.26Å; E293-Q295 PolarHBondContact O-N 3.5Å
296	F	88.4	Confident	90.4	Very high	35 Å²	35	68.2 Å²	68.2	15%	0.154	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107	24.9	-179.1	-58.3	-65	0	0	0	113.5	L249 E252 L256 E298 E299 Y300	L249-F296 HydrophobicContact CD1-CE2 3.93Å; L249-F296 HydrophobicContact CD1-CZ 3.95Å; E252-F296 HydrophobicContact CB-CD2 4.45Å; E252-F296 HydrophobicContact CB-CE2 4.03Å; L256-F296 HydrophobicContact CD2-CB 4.29Å; L256-F296 HydrophobicContact CD2-CD1 3.74Å; L256-F296 HydrophobicContact CD2-CE1 4.15Å; L256-F296 HydrophobicContact CD2-CG 3.93Å; F296-E298 VanDerWaalsContact C-N 3.27Å; F296-E298 PolarHBondContact O-N 3.24Å; F296-E299 WeakPolarHBondContact CA-OE2 3.27Å; F296-E299 PolarHBondContact O-N 2.97Å; F296-Y300 HydrophobicContact CB-CD2 3.93Å; F296-Y300 HydrophobicContact CB-CE2 3.78Å; F296-Y300 WeakPolarHBondContact O-CD2 3.47Å; F296-Y300 PolarHBondContact O-N 2.93Å
297	K	91.6	Very high	90.3	Very high	123 Å²	123	68.1 Å²	68.1	54%	0.535	33%	0.328	S	S	.	.	H	α-helix	trans	-60.5	-38.8	-173.2	177	-179.4	175.2	-165.2	0	111.9	A290 S301	A290-K297 HydrophobicContact CB-CG 4.19Å; A290-K297 WeakPolarHBondContact O-CG 3.48Å; K297-S301 WeakPolarHBondContact O-CB 3.44Å; K297-S301 PolarHBondContact O-N 2.98Å; K297-S301 VanDerWaalsContact O-N 3.14Å; K297-S301 PolarHBondContact O-OG 3.28Å
298	E	92.9	Very high	90.2	Very high	155 Å²	155	64 Å²	64	72%	0.724	31%	0.311	S	S	*	.	H	α-helix	trans	-70.5	-44.5	-178.4	-66.3	-173.1	175.4	0	0	110.5	F296 S301 E302	F296-E298 VanDerWaalsContact C-N 3.27Å; F296-E298 PolarHBondContact O-N 3.24Å; E298-S301 CarbonylContact O-C 3.24Å; E298-S301 WeakPolarHBondContact O-CB 3.26Å; E298-S301 PolarHBondContact O-N 2.93Å; E298-S301 VanDerWaalsContact O-N 3.11Å; E298-S301 PolarHBondContact O-OG 2.89Å; E298-E302 PolarHBondContact O-N 2.86Å
299	E	92.6	Very high	90.2	Very high	71 Å²	71	61.6 Å²	61.6	33%	0.332	30%	0.302	S	S	.	.	H	α-helix	trans	-62.1	-48.2	178.8	-63.1	86.4	159.3	0	0	111.2	L256 F296 S301 E302 L303	L256-E299 HydrophobicContact CD1-CB 4.18Å; L256-E299 HydrophobicContact CD2-CB 4.46Å; F296-E299 WeakPolarHBondContact CA-OE2 3.27Å; F296-E299 PolarHBondContact O-N 2.97Å; E299-S301 VanDerWaalsContact C-N 3.26Å; E299-S301 PolarHBondContact O-N 3.39Å; E299-E302 PolarHBondContact O-N 3.04Å; E299-L303 VanDerWaalsContact O-CG 3.29Å; E299-L303 WeakPolarHBondContact O-CG 3.38Å; E299-L303 PolarHBondContact O-N 3.05Å
300	Y	93.9	Very high	90.3	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-60.7	-37.2	174.6	-74.4	-57.4	0	0	0	112.2	L256 Y259 L286 L289 E293 F296 L303 A304	L256-Y300 HydrophobicContact CB-CE1 4.47Å; L256-Y300 HydrophobicContact CD1-CD1 3.89Å; L256-Y300 HydrophobicContact CD1-CE1 3.65Å; L256-Y300 HydrophobicContact CD1-CG 4.43Å; Y259-Y300 HydrophobicContact CD2-CE1 4.37Å; L286-Y300 HydrophobicContact CD2-CD1 3.69Å; L286-Y300 HydrophobicContact CD2-CE1 4.36Å; L289-Y300 HydrophobicContact CB-CD2 4.45Å; L289-Y300 HydrophobicContact CB-CE1 4.41Å; L289-Y300 HydrophobicContact CB-CE2 4.37Å; L289-Y300 HydrophobicContact CD1-CE1 4.32Å; E293-Y300 HydrophobicContact CB-CE2 4.04Å; E293-Y300 WeakPolarHBondContact OE2-CE2 3.41Å; E293-Y300 PolarHBondContact OE2-OH 3.41Å; F296-Y300 HydrophobicContact CB-CD2 3.93Å; F296-Y300 HydrophobicContact CB-CE2 3.78Å; F296-Y300 WeakPolarHBondContact O-CD2 3.47Å; F296-Y300 PolarHBondContact O-N 2.93Å; Y300-L303 PolarHBondContact O-N 2.83Å; Y300-A304 WeakPolarHBondContact O-CB 3.47Å; Y300-A304 PolarHBondContact O-N 3.07Å
301	S	91.8	Very high	90.3	Very high	43 Å²	43	60.9 Å²	60.9	30%	0.301	30%	0.298	S	S	.	.	H	α-helix	trans	-68.5	-36	177.4	77.8	0	0	0	0	112.5	K297 E298 E299 A304 V305	K297-S301 WeakPolarHBondContact O-CB 3.44Å; K297-S301 PolarHBondContact O-N 2.98Å; K297-S301 VanDerWaalsContact O-N 3.14Å; K297-S301 PolarHBondContact O-OG 3.28Å; E298-S301 CarbonylContact O-C 3.24Å; E298-S301 WeakPolarHBondContact O-CB 3.26Å; E298-S301 PolarHBondContact O-N 2.93Å; E298-S301 VanDerWaalsContact O-N 3.11Å; E298-S301 PolarHBondContact O-OG 2.89Å; E299-S301 VanDerWaalsContact C-N 3.26Å; E299-S301 PolarHBondContact O-N 3.39Å; S301-A304 WeakPolarHBondContact O-CB 3.01Å; S301-A304 PolarHBondContact O-N 2.9Å; S301-V305 WeakPolarHBondContact O-CG2 3.39Å; S301-V305 PolarHBondContact O-N 3.11Å; S301-V305 VanDerWaalsContact O-N 3.12Å
302	E	93.6	Very high	90.3	Very high	103 Å²	103	58 Å²	58	48%	0.481	28%	0.276	S	S	.	.	H	α-helix	trans	-66.9	-42.7	175.2	-166.5	-166.4	148.7	0	0	111.1	E298 E299 A304 V305 K306	E298-E302 PolarHBondContact O-N 2.86Å; E299-E302 PolarHBondContact O-N 3.04Å; E302-A304 VanDerWaalsContact C-N 3.32Å; E302-A304 PolarHBondContact O-N 3.18Å; E302-V305 WeakPolarHBondContact O-CB 3.3Å; E302-V305 PolarHBondContact O-N 3.43Å; E302-V305 VanDerWaalsContact O-N 3.17Å; E302-K306 WeakPolarHBondContact O-CG 3.46Å; E302-K306 PolarHBondContact O-N 3.19Å; E302-K306 WeakPolarHBondContact OE1-CE 3.17Å; E302-K306 IonicContact OE1-NZ 3.6Å; E302-K306 PolarHBondContact OE1-NZ 3.28Å
303	L	92.8	Very high	90.3	Very high	11 Å²	11	54 Å²	54	6%	0.058	26%	0.26	C	S	.	.	H	α-helix	trans	-63.6	-38.5	175.3	-61.7	170.4	0	0	0	111.9	L256 Q260 L286 E299 Y300 V305 K306 C307	L256-L303 HydrophobicContact CD1-CD1 3.98Å; Q260-L303 HydrophobicContact CB-CD1 4.23Å; Q260-L303 HydrophobicContact CB-CD2 4.32Å; Q260-L303 HydrophobicContact CG-CD1 3.36Å; Q260-L303 HydrophobicContact CG-CD2 3.77Å; Q260-L303 HydrophobicContact CG-CG 4.14Å; L286-L303 HydrophobicContact CD1-CB 4.06Å; L286-L303 HydrophobicContact CD2-CB 4.36Å; E299-L303 VanDerWaalsContact O-CG 3.29Å; E299-L303 WeakPolarHBondContact O-CG 3.38Å; E299-L303 PolarHBondContact O-N 3.05Å; Y300-L303 PolarHBondContact O-N 2.83Å; L303-V305 VanDerWaalsContact C-N 3.27Å; L303-V305 PolarHBondContact O-N 3.24Å; L303-K306 HydrophobicContact CD2-CD 4.33Å; L303-K306 PolarHBondContact O-N 3.28Å; L303-C307 PolarHBondContact O-N 3.46Å; L303-C307 PolarHBondContact O-SG 3.32Å
304	A	91.9	Very high	90.4	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61.9	-35.6	174.8	0	0	0	0	0	112.2	R283 L286 Y287 Y300 S301 E302 M308	R283-A304 HydrophobicContact CG-CB 4.22Å; L286-A304 HydrophobicContact CB-CB 4.05Å; L286-A304 HydrophobicContact CD1-CB 4.22Å; Y287-A304 HydrophobicContact CD1-CB 4.49Å; Y287-A304 HydrophobicContact CD2-CB 4.46Å; Y287-A304 HydrophobicContact CE1-CB 4.11Å; Y287-A304 HydrophobicContact CE2-CB 4.13Å; Y300-A304 WeakPolarHBondContact O-CB 3.47Å; Y300-A304 PolarHBondContact O-N 3.07Å; S301-A304 WeakPolarHBondContact O-CB 3.01Å; S301-A304 PolarHBondContact O-N 2.9Å; E302-A304 VanDerWaalsContact C-N 3.32Å; E302-A304 PolarHBondContact O-N 3.18Å; A304-M308 PolarHBondContact O-N 2.98Å
305	V	91.5	Very high	90.5	Very high	56 Å²	56	45.2 Å²	45.2	34%	0.339	22%	0.222	S	C	.	.	H	α-helix	trans	-69.4	-45	172.9	174.4	0	0	0	0	110.8	S301 E302 L303 C307 M308 D309	S301-V305 WeakPolarHBondContact O-CG2 3.39Å; S301-V305 PolarHBondContact O-N 3.11Å; S301-V305 VanDerWaalsContact O-N 3.12Å; E302-V305 WeakPolarHBondContact O-CB 3.3Å; E302-V305 PolarHBondContact O-N 3.43Å; E302-V305 VanDerWaalsContact O-N 3.17Å; L303-V305 VanDerWaalsContact C-N 3.27Å; L303-V305 PolarHBondContact O-N 3.24Å; V305-C307 PolarHBondContact O-N 3.05Å; V305-M308 CarbonylContact O-C 3.6Å; V305-M308 WeakPolarHBondContact O-CA 3.48Å; V305-M308 VanDerWaalsContact O-CB 3.31Å; V305-M308 WeakPolarHBondContact O-CB 3.46Å; V305-M308 PolarHBondContact O-N 3.32Å; V305-D309 PolarHBondContact O-N 3.14Å
306	K	91.4	Very high	90.6	Very high	100 Å²	100	42.8 Å²	42.8	44%	0.435	21%	0.213	S	C	.	.	H	α-helix	trans	-58.2	-44	176.7	-71.6	174.4	-175.7	164.8	0	112.8	E302 L303 M308 D309 F310	E302-K306 WeakPolarHBondContact O-CG 3.46Å; E302-K306 PolarHBondContact O-N 3.19Å; E302-K306 WeakPolarHBondContact OE1-CE 3.17Å; E302-K306 IonicContact OE1-NZ 3.6Å; E302-K306 PolarHBondContact OE1-NZ 3.28Å; L303-K306 HydrophobicContact CD2-CD 4.33Å; L303-K306 PolarHBondContact O-N 3.28Å; K306-M308 PolarHBondContact O-N 2.65Å; K306-D309 PolarHBondContact O-N 3.05Å; K306-F310 PolarHBondContact O-N 3.01Å
307	C	90.2	Very high	90.6	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-56.8	-36.5	172.9	-75.4	0	0	0	0	112.2	S263 L303 V305 F310 A311	S263-C307 WeakPolarHBondContact CB-SG 3.4Å; L303-C307 PolarHBondContact O-N 3.46Å; L303-C307 PolarHBondContact O-SG 3.32Å; V305-C307 PolarHBondContact O-N 3.05Å; C307-F310 WeakPolarHBondContact O-CB 3.33Å; C307-A311 PolarHBondContact O-N 2.81Å
308	M	88.8	Confident	90.3	Very high	4 Å²	4	37.1 Å²	37.1	2%	0.02	19%	0.19	C	C	.	.	H	α-helix	trans	-77	-40.1	-179.6	-162.2	69.2	-160.9	0	0	112.9	F280 R283 A304 V305 K306 F310 A311 I312 E354 F357	F280-M308 HydrophobicContact CE1-CE 4.14Å; F280-M308 HydrophobicContact CE1-SD 4.45Å; F280-M308 HydrophobicContact CZ-CE 4.19Å; R283-M308 VanDerWaalsContact NH1-CG 3.26Å; A304-M308 PolarHBondContact O-N 2.98Å; V305-M308 CarbonylContact O-C 3.6Å; V305-M308 WeakPolarHBondContact O-CA 3.48Å; V305-M308 VanDerWaalsContact O-CB 3.31Å; V305-M308 WeakPolarHBondContact O-CB 3.46Å; V305-M308 PolarHBondContact O-N 3.32Å; K306-M308 PolarHBondContact O-N 2.65Å; M308-F310 PolarHBondContact O-N 3.35Å; M308-A311 WeakPolarHBondContact O-CB 3.39Å; M308-A311 PolarHBondContact O-N 3.04Å; M308-I312 HydrophobicContact CG-CD1 4.22Å; M308-I312 WeakPolarHBondContact O-CG1 3.47Å; M308-I312 PolarHBondContact O-N 2.99Å; M308-E354 HydrophobicContact CE-CB 3.7Å; M308-E354 HydrophobicContact CE-CG 3.55Å; M308-E354 HydrophobicContact SD-CG 3.83Å; M308-E354 VanDerWaalsContact SD-OE2 3.39Å; M308-F357 HydrophobicContact CE-CB 3.06Å; M308-F357 HydrophobicContact CE-CD1 4.39Å; M308-F357 HydrophobicContact CE-CD2 3.8Å; M308-F357 HydrophobicContact CE-CG 3.54Å
309	D	89.8	Confident	90	Very high	65 Å²	65	39 Å²	39	35%	0.348	19%	0.191	S	C	.	.	H	α-helix	trans	-63.6	-31.5	175.8	-68.7	-22.8	0	0	0	111.1	V305 K306 S313	V305-D309 PolarHBondContact O-N 3.14Å; K306-D309 PolarHBondContact O-N 3.05Å; D309-S313 VanDerWaalsContact O-CB 3.28Å; D309-S313 WeakPolarHBondContact O-CB 3.48Å; D309-S313 PolarHBondContact O-N 3.33Å; D309-S313 PolarHBondContact O-OG 3.19Å
310	F	91	Very high	89.5	Confident	3 Å²	3	38.9 Å²	38.9	1%	0.013	20%	0.195	C	C	.	.	H	α-helix	trans	-60.6	-52	166.8	168.2	-108	0	0	0	111.7	L268 A269 P275 K306 C307 M308 I312 S313 C314 M946 Y949	L268-F310 HydrophobicContact CB-CD1 4.22Å; L268-F310 HydrophobicContact CB-CE1 3.77Å; L268-F310 HydrophobicContact CB-CZ 3.94Å; L268-F310 HydrophobicContact CD1-CD1 3.91Å; L268-F310 HydrophobicContact CD1-CE1 4.22Å; L268-F310 HydrophobicContact CD1-CG 4.49Å; A269-F310 HydrophobicContact CB-CE2 4.03Å; A269-F310 HydrophobicContact CB-CZ 4.31Å; P275-F310 HydrophobicContact CB-CE1 3.77Å; P275-F310 HydrophobicContact CB-CZ 3.97Å; K306-F310 PolarHBondContact O-N 3.01Å; C307-F310 WeakPolarHBondContact O-CB 3.33Å; M308-F310 PolarHBondContact O-N 3.35Å; F310-I312 VanDerWaalsContact C-N 3.32Å; F310-I312 PolarHBondContact O-N 3.44Å; F310-S313 WeakPolarHBondContact O-CB 3.4Å; F310-S313 PolarHBondContact O-N 2.71Å; F310-S313 VanDerWaalsContact O-N 3.14Å; F310-C314 PolarHBondContact O-N 3.21Å; F310-C314 PolarHBondContact O-SG 3.27Å; F310-M946 HydrophobicContact CZ-CE 4.16Å; F310-M946 HydrophobicContact CZ-SD 4.21Å; F310-Y949 HydrophobicContact CD2-CD1 4.32Å; F310-Y949 AromaticContact CD2-CE1 3.64Å; F310-Y949 HydrophobicContact CD2-CE1 3.64Å; F310-Y949 HydrophobicContact CD2-CE2 4.18Å; F310-Y949 AromaticContact CD2-CZ 3.59Å; F310-Y949 AromaticContact CE2-CD1 3.86Å; F310-Y949 HydrophobicContact CE2-CD1 3.86Å; F310-Y949 AromaticContact CE2-CE1 3.57Å; F310-Y949 HydrophobicContact CE2-CE1 3.57Å; F310-Y949 HydrophobicContact CE2-CG 4.45Å; F310-Y949 AromaticContact CE2-CZ 3.99Å
311	A	89.7	Confident	88.7	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.008	21%	0.213	C	C	.	.	H	α-helix	trans	-60.3	-40.5	179.1	0	0	0	0	0	112.5	A279 C307 M308 C314 V315	A279-A311 HydrophobicContact CB-CB 4.06Å; C307-A311 PolarHBondContact O-N 2.81Å; M308-A311 WeakPolarHBondContact O-CB 3.39Å; M308-A311 PolarHBondContact O-N 3.04Å; A311-C314 WeakPolarHBondContact O-CB 3.47Å; A311-C314 PolarHBondContact O-N 3.29Å; A311-V315 WeakPolarHBondContact O-CG2 3.49Å; A311-V315 PolarHBondContact O-N 3.29Å
312	I	89.5	Confident	88	Confident	24 Å²	24	44.8 Å²	44.8	12%	0.123	23%	0.227	C	C	.	.	H	α-helix	trans	-63.7	-45.6	174.7	-66.1	162.8	0	0	0	110.3	M308 F310 C314 V315 D316 K356 F357	M308-I312 HydrophobicContact CG-CD1 4.22Å; M308-I312 WeakPolarHBondContact O-CG1 3.47Å; M308-I312 PolarHBondContact O-N 2.99Å; F310-I312 VanDerWaalsContact C-N 3.32Å; F310-I312 PolarHBondContact O-N 3.44Å; I312-C314 VanDerWaalsContact C-N 3.25Å; I312-C314 PolarHBondContact O-N 3.19Å; I312-V315 CarbonylContact O-C 3.59Å; I312-V315 WeakPolarHBondContact O-CA 3.13Å; I312-V315 WeakPolarHBondContact O-CB 3.12Å; I312-V315 PolarHBondContact O-N 2.76Å; I312-D316 PolarHBondContact O-N 2.8Å; I312-K356 HydrophobicContact CD1-CB 3.56Å; I312-K356 HydrophobicContact CD1-CD 4.32Å; I312-F357 HydrophobicContact CG1-CB 4.17Å; I312-F357 HydrophobicContact CG1-CD2 4.31Å
313	S	88.4	Confident	87.5	Confident	23 Å²	23	41.3 Å²	41.3	16%	0.161	21%	0.211	C	C	.	.	H	α-helix	trans	-60.8	-33.5	176.8	-65.9	0	0	0	0	112.8	D309 F310 V315 L317	D309-S313 VanDerWaalsContact O-CB 3.28Å; D309-S313 WeakPolarHBondContact O-CB 3.48Å; D309-S313 PolarHBondContact O-N 3.33Å; D309-S313 PolarHBondContact O-OG 3.19Å; F310-S313 WeakPolarHBondContact O-CB 3.4Å; F310-S313 PolarHBondContact O-N 2.71Å; F310-S313 VanDerWaalsContact O-N 3.14Å; S313-V315 VanDerWaalsContact C-N 3.34Å; S313-L317 WeakPolarHBondContact O-CD1 3.38Å; S313-L317 VanDerWaalsContact O-CG 3.28Å; S313-L317 WeakPolarHBondContact O-CG 3.41Å; S313-L317 PolarHBondContact O-N 2.96Å
314	C	87	Confident	87.1	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-65.4	-38.9	172.5	-64.8	0	0	0	0	111.7	F310 A311 I312 L317 L327	F310-C314 PolarHBondContact O-N 3.21Å; F310-C314 PolarHBondContact O-SG 3.27Å; A311-C314 WeakPolarHBondContact O-CB 3.47Å; A311-C314 PolarHBondContact O-N 3.29Å; I312-C314 VanDerWaalsContact C-N 3.25Å; I312-C314 PolarHBondContact O-N 3.19Å; C314-L317 PolarHBondContact O-N 3.14Å; C314-L327 HydrophobicContact CB-CD2 4.22Å
315	V	87.9	Confident	86.4	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-71.4	-34.8	177.3	176.9	0	0	0	0	112	A311 I312 S313 L317 C318 L324 L327 F357 H360 N362	A311-V315 WeakPolarHBondContact O-CG2 3.49Å; A311-V315 PolarHBondContact O-N 3.29Å; I312-V315 CarbonylContact O-C 3.59Å; I312-V315 WeakPolarHBondContact O-CA 3.13Å; I312-V315 WeakPolarHBondContact O-CB 3.12Å; I312-V315 PolarHBondContact O-N 2.76Å; S313-V315 VanDerWaalsContact C-N 3.34Å; V315-L317 PolarHBondContact O-N 3.31Å; V315-C318 WeakPolarHBondContact O-CB 3.38Å; V315-C318 PolarHBondContact O-N 2.83Å; V315-L324 HydrophobicContact CG1-CD1 3.86Å; V315-L324 HydrophobicContact CG2-CD1 4.31Å; V315-L327 HydrophobicContact CG2-CD2 4.1Å; V315-F357 HydrophobicContact CG2-CD2 4.27Å; V315-F357 HydrophobicContact CG2-CE2 3.56Å; V315-F357 HydrophobicContact CG2-CZ 4.23Å; V315-H360 VanDerWaalsContact CG1-ND1 3.3Å; V315-H360 WeakPolarHBondContact CG1-ND1 3.33Å; V315-N362 HydrophobicContact CG1-CB 3.98Å; V315-N362 PolarHBondContact O-ND2 3.48Å
316	D	88.2	Confident	85.8	Confident	82 Å²	82	42 Å²	42	44%	0.439	21%	0.211	S	C	.	.	H	α-helix	trans	-59	-32.7	173.4	-72.5	-30.1	0	0	0	112.1	I312 C318 H360	I312-D316 PolarHBondContact O-N 2.8Å; D316-C318 VanDerWaalsContact C-N 3.32Å; D316-H360 IonicContact OD1-CD2 3.36Å; D316-H360 PolarHBondContact OD1-CD2 2.66Å; D316-H360 IonicContact OD1-CE1 2.8Å; D316-H360 IonicContact OD1-NE2 3.34Å; D316-H360 PolarHBondContact OD1-NE2 3.41Å
317	L	87.7	Confident	85.2	Confident	33 Å²	33	37.5 Å²	37.5	17%	0.173	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-10.8	-177.1	-68.7	166	0	0	0	113.5	S313 C314 V315 R319 V945 R948 Y949	S313-L317 WeakPolarHBondContact O-CD1 3.38Å; S313-L317 VanDerWaalsContact O-CG 3.28Å; S313-L317 WeakPolarHBondContact O-CG 3.41Å; S313-L317 PolarHBondContact O-N 2.96Å; C314-L317 PolarHBondContact O-N 3.14Å; V315-L317 PolarHBondContact O-N 3.31Å; L317-R319 PolarHBondContact O-N 2.96Å; L317-V945 HydrophobicContact CB-CG1 4.23Å; L317-R948 HydrophobicContact CD1-CB 4.44Å; L317-R948 HydrophobicContact CD2-CB 4.16Å; L317-R948 PolarHBondContact O-NH1 2.87Å; L317-Y949 VanDerWaalsContact CD1-CA 3.42Å; L317-Y949 VanDerWaalsContact CD1-CB 3.49Å; L317-Y949 HydrophobicContact CD1-CD2 3.74Å; L317-Y949 HydrophobicContact CD1-CG 4.12Å
318	C	86.7	Confident	84.6	Confident	6 Å²	6	37.6 Å²	37.6	4%	0.041	19%	0.193	C	C	.	.			trans	-73.8	121	172.3	-64.8	0	0	0	0	109.9	V315 D316 E323 L324 L327 N362	V315-C318 WeakPolarHBondContact O-CB 3.38Å; V315-C318 PolarHBondContact O-N 2.83Å; D316-C318 VanDerWaalsContact C-N 3.32Å; C318-E323 HydrophobicContact CB-CB 4.32Å; C318-L324 HydrophobicContact CB-CB 4.37Å; C318-L327 VanDerWaalsContact SG-CD2 3.58Å; C318-N362 PolarHBondContact O-ND2 3.21Å
319	R	85.4	Confident	83.6	Confident	194 Å²	194	37.7 Å²	37.7	73%	0.732	20%	0.195	S	C	*	.			trans	-94.7	-25.1	-177.9	-64.8	176.4	178.7	166.9	-1.2	113.2	L317 E323	L317-R319 PolarHBondContact O-N 2.96Å; R319-E323 PolarHBondContact N-OE2 3.45Å
320	T	82.1	Confident	82.2	Confident	69 Å²	69	36.3 Å²	36.3	42%	0.423	20%	0.196	S	C	.	.	S	Bend	trans	-124	156.5	-178.8	67.3	0	0	0	0	110.7	D322 E323 L324	T320-D322 PolarHBondContact O-N 3.07Å; T320-E323 PolarHBondContact O-N 3.41Å; T320-E323 WeakPolarHBondContact OG1-CG 3.22Å; T320-E323 PolarHBondContact OG1-N 3.08Å; T320-E323 VanDerWaalsContact OG1-N 3.08Å; T320-L324 PolarHBondContact O-N 3.49Å; T320-L324 VanDerWaalsContact O-N 3.17Å
321	S	77.5	Confident	80.5	Confident	55 Å²	55	38.8 Å²	38.8	39%	0.385	21%	0.211	S	C	.	.	H	α-helix	trans	-59.9	-30.1	171.6	52	0	0	0	0	112.2	L324 H325	S321-L324 WeakPolarHBondContact O-CB 3.48Å; S321-L324 PolarHBondContact O-N 3.25Å; S321-H325 WeakPolarHBondContact O-CB 3.35Å; S321-H325 PolarHBondContact O-N 2.97Å
322	D	77.7	Confident	78.6	Confident	112 Å²	112	43 Å²	43	60%	0.599	23%	0.233	S	C	*	.	H	α-helix	trans	-74	-41.3	-179.4	-57.6	-17.4	0	0	0	111.1	T320 L324 H325 C326	T320-D322 PolarHBondContact O-N 3.07Å; D322-L324 VanDerWaalsContact C-N 3.29Å; D322-L324 PolarHBondContact O-N 2.97Å; D322-H325 WeakPolarHBondContact O-CB 3.48Å; D322-H325 PolarHBondContact O-N 3.48Å; D322-H325 VanDerWaalsContact O-N 3.17Å; D322-C326 PolarHBondContact O-N 3.39Å; D322-C326 PolarHBondContact O-SG 3.11Å
323	E	82.7	Confident	76.6	Confident	29 Å²	29	49.3 Å²	49.3	14%	0.136	27%	0.267	C	S	.	.	H	α-helix	trans	-58.1	-44.2	171	-75.9	-178.2	175.1	0	0	110.7	C318 R319 T320 C326 L327 I941 R948	C318-E323 HydrophobicContact CB-CB 4.32Å; R319-E323 PolarHBondContact N-OE2 3.45Å; T320-E323 PolarHBondContact O-N 3.41Å; T320-E323 WeakPolarHBondContact OG1-CG 3.22Å; T320-E323 PolarHBondContact OG1-N 3.08Å; T320-E323 VanDerWaalsContact OG1-N 3.08Å; E323-C326 PolarHBondContact O-N 3.24Å; E323-L327 WeakPolarHBondContact O-CB 3.46Å; E323-L327 PolarHBondContact O-N 2.96Å; E323-I941 HydrophobicContact CB-CG2 4.26Å; E323-I941 HydrophobicContact CG-CG2 4.04Å; E323-R948 IonicContact OE1-CZ 2.65Å; E323-R948 IonicContact OE1-NH1 2.8Å; E323-R948 PolarHBondContact OE1-NH1 3.28Å; E323-R948 IonicContact OE1-NH2 3.74Å; E323-R948 PolarHBondContact OE1-NH2 3.35Å; E323-R948 IonicContact OE2-CZ 3.28Å; E323-R948 IonicContact OE2-NH1 2.76Å; E323-R948 PolarHBondContact OE2-NH1 3.13Å; E323-R948 IonicContact OE2-NH2 3.88Å
324	L	83.8	Confident	74.7	Confident	3 Å²	3	49.8 Å²	49.8	2%	0.016	27%	0.27	C	S	.	.	H	α-helix	trans	-62.3	-43.6	175.3	-178.7	69.9	0	0	0	111.6	V315 C318 T320 S321 D322 C326 L327 L328 N362 Q366	V315-L324 HydrophobicContact CG1-CD1 3.86Å; V315-L324 HydrophobicContact CG2-CD1 4.31Å; C318-L324 HydrophobicContact CB-CB 4.37Å; T320-L324 PolarHBondContact O-N 3.49Å; T320-L324 VanDerWaalsContact O-N 3.17Å; S321-L324 WeakPolarHBondContact O-CB 3.48Å; S321-L324 PolarHBondContact O-N 3.25Å; D322-L324 VanDerWaalsContact C-N 3.29Å; D322-L324 PolarHBondContact O-N 2.97Å; L324-C326 VanDerWaalsContact C-N 3.31Å; L324-C326 PolarHBondContact O-N 3.28Å; L324-L327 PolarHBondContact O-N 3.43Å; L324-L328 HydrophobicContact CD1-CD1 3.74Å; L324-L328 HydrophobicContact CD1-CD2 4.45Å; L324-L328 HydrophobicContact CD1-CG 3.84Å; L324-L328 HydrophobicContact CD2-CD1 4.16Å; L324-L328 HydrophobicContact CG-CD1 3.72Å; L324-L328 HydrophobicContact CG-CG 4.1Å; L324-L328 WeakPolarHBondContact O-CB 3.32Å; L324-L328 WeakPolarHBondContact O-CG 3.29Å; L324-L328 PolarHBondContact O-N 3.3Å; L324-N362 HydrophobicContact CD2-CB 4.03Å; L324-N362 WeakPolarHBondContact CD2-O 3.42Å; L324-Q366 HydrophobicContact CD2-CB 4.02Å; L324-Q366 HydrophobicContact CD2-CG 4.49Å
325	H	77.5	Confident	72.6	Confident	66 Å²	66	57.3 Å²	57.3	31%	0.306	30%	0.303	S	S	.	.	H	α-helix	trans	-61.2	-40.9	178.4	-171.8	-70.6	0	0	0	111.5	S321 D322 G329 G340 P342	S321-H325 WeakPolarHBondContact O-CB 3.35Å; S321-H325 PolarHBondContact O-N 2.97Å; D322-H325 WeakPolarHBondContact O-CB 3.48Å; D322-H325 PolarHBondContact O-N 3.48Å; D322-H325 VanDerWaalsContact O-N 3.17Å; H325-G329 WeakPolarHBondContact O-CA 3.09Å; H325-G329 PolarHBondContact O-N 2.95Å; H325-G340 PolarHBondContact CE1-O 2.93Å; H325-P342 VanDerWaalsContact NE2-CD 3.31Å; H325-P342 WeakPolarHBondContact NE2-CD 3.41Å
326	C	77.9	Confident	70.4	Confident	12 Å²	12	61.3 Å²	61.3	8%	0.081	33%	0.329	C	S	.	.	H	α-helix	trans	-68.8	-36.9	175.3	-65.5	0	0	0	0	112.8	D322 E323 L324 T938 I941 R942	D322-C326 PolarHBondContact O-N 3.39Å; D322-C326 PolarHBondContact O-SG 3.11Å; E323-C326 PolarHBondContact O-N 3.24Å; L324-C326 VanDerWaalsContact C-N 3.31Å; L324-C326 PolarHBondContact O-N 3.28Å; C326-T938 HydrophobicContact CB-CG2 4.39Å; C326-I941 HydrophobicContact CB-CB 4.23Å; C326-I941 HydrophobicContact CB-CD1 4.33Å; C326-I941 HydrophobicContact CB-CG2 3.84Å; C326-R942 PolarHBondContact O-NE 2.75Å; C326-R942 PolarHBondContact O-NH2 3.1Å
327	L	79.6	Confident	68.4	Low	7 Å²	7	65.8 Å²	65.8	4%	0.037	35%	0.347	C	S	.	.	H	α-helix	trans	-68.1	-44.5	176.9	-178.4	67.7	0	0	0	112.3	P275 V276 C314 V315 C318 E323 L324	P275-L327 HydrophobicContact CG-CD1 3.54Å; V276-L327 HydrophobicContact CG2-CD1 4.35Å; V276-L327 HydrophobicContact CG2-CD2 4.25Å; V276-L327 HydrophobicContact CG2-CG 4.06Å; C314-L327 HydrophobicContact CB-CD2 4.22Å; V315-L327 HydrophobicContact CG2-CD2 4.1Å; C318-L327 VanDerWaalsContact SG-CD2 3.58Å; E323-L327 WeakPolarHBondContact O-CB 3.46Å; E323-L327 PolarHBondContact O-N 2.96Å; L324-L327 PolarHBondContact O-N 3.43Å
328	L	77.8	Confident	66.4	Low	1 Å²	1	67.5 Å²	67.5	1%	0.005	36%	0.356	C	S	.	.	H	α-helix	trans	-82.2	-19.9	-179	-64	-177.6	0	0	0	112.9	V276 L324 G330 P342 T345 I346 F357	V276-L328 HydrophobicContact CG1-CD2 4.32Å; L324-L328 HydrophobicContact CD1-CD1 3.74Å; L324-L328 HydrophobicContact CD1-CD2 4.45Å; L324-L328 HydrophobicContact CD1-CG 3.84Å; L324-L328 HydrophobicContact CD2-CD1 4.16Å; L324-L328 HydrophobicContact CG-CD1 3.72Å; L324-L328 HydrophobicContact CG-CG 4.1Å; L324-L328 WeakPolarHBondContact O-CB 3.32Å; L324-L328 WeakPolarHBondContact O-CG 3.29Å; L324-L328 PolarHBondContact O-N 3.3Å; L328-G330 PolarHBondContact O-N 3.02Å; L328-P342 HydrophobicContact CB-CB 3.56Å; L328-P342 HydrophobicContact CD1-CB 3.96Å; L328-P342 HydrophobicContact CG-CB 4.42Å; L328-T345 HydrophobicContact CD2-CG2 3.92Å; L328-T345 WeakPolarHBondContact O-CB 3.5Å; L328-T345 PolarHBondContact O-OG1 3.08Å; L328-I346 HydrophobicContact CD1-CD1 4.08Å; L328-I346 HydrophobicContact CD1-CG1 4.14Å; L328-F357 HydrophobicContact CD2-CE1 4.46Å; L328-F357 HydrophobicContact CD2-CZ 3.69Å
329	G	67.6	Low	64.4	Low	6 Å²	6	73.7 Å²	73.7	6%	0.062	38%	0.379	C	S	.	.	S	Bend	trans	-60.4	124.5	172.9	0	0	0	0	0	109.7	H325 R942	H325-G329 WeakPolarHBondContact O-CA 3.09Å; H325-G329 PolarHBondContact O-N 2.95Å; G329-R942 PolarHBondContact O-NH2 3.47Å
330	G	60.9	Low	62.8	Low	36 Å²	36	65.3 Å²	65.3	37%	0.371	35%	0.353	S	S	.	.			trans	-68.1	175.5	179.4	0	0	0	0	0	113.9	L328	L328-G330 PolarHBondContact O-N 3.02Å
331	T	55	Low	61.8	Low	55 Å²	55	66 Å²	66	34%	0.337	35%	0.354	S	S	.	.			trans	-72.4	159	172.9	53.5	0	0	0	0	112.3	D274 N333 S334	D274-T331 HydrophobicContact CB-CG2 4.33Å; D274-T331 WeakPolarHBondContact OD1-CG2 3.3Å; D274-T331 WeakPolarHBondContact OD2-CG2 3.47Å; T331-N333 PolarHBondContact O-N 2.99Å; T331-S334 PolarHBondContact O-N 3Å; T331-S334 PolarHBondContact O-OG 3.3Å
332	I	48.9	Very low	61.2	Low	90 Å²	90	63.7 Å²	63.7	46%	0.462	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-17.3	-178.7	-55	129.7	0	0	0	113.1	S334 K935	I332-S334 PolarHBondContact O-N 3.21Å; I332-S334 VanDerWaalsContact O-N 3.14Å; I332-K935 HydrophobicContact CD1-CD 3.5Å; I332-K935 VanDerWaalsContact CD1-CD 3.5Å; I332-K935 HydrophobicContact CD1-CG 3.78Å; I332-K935 HydrophobicContact CG1-CD 4.21Å; I332-K935 HydrophobicContact CG1-CG 4.2Å
333	N	48.5	Very low	60.9	Low	156 Å²	156	59.5 Å²	59.5	83%	0.834	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-11.6	176.9	-66.3	-5.8	0	0	0	112.1	T331	T331-N333 PolarHBondContact O-N 2.99Å
334	S	47.5	Very low	60.5	Low	34 Å²	34	60 Å²	60	24%	0.238	32%	0.318	C	S	.	.	S	Bend	trans	-68.8	136.9	165.3	75.9	0	0	0	0	111.1	T331 I332	T331-S334 PolarHBondContact O-N 3Å; T331-S334 PolarHBondContact O-OG 3.3Å; I332-S334 PolarHBondContact O-N 3.21Å; I332-S334 VanDerWaalsContact O-N 3.14Å
335	K	43.3	Very low	60.3	Low	158 Å²	158	60.6 Å²	60.6	69%	0.687	32%	0.322	S	S	*	.			trans	-48	152.8	176.6	-70.2	175.3	-178.7	173.4	0	111.7	H337 D338 R339	K335-H337 PolarHBondContact O-N 2.86Å; K335-D338 WeakPolarHBondContact O-CA 3.41Å; K335-D338 PolarHBondContact O-N 3.43Å; K335-R339 PolarHBondContact O-N 3.06Å
336	P	43.1	Very low	60.5	Low	83 Å²	83	57.5 Å²	57.5	54%	0.539	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-28.2	-175.7	18	-30.9	0	0	0	115.6	R339	P336-R339 WeakPolarHBondContact O-CG 3.45Å
337	H	44.9	Very low	60.7	Low	177 Å²	177	58.7 Å²	58.7	82%	0.819	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-15.4	176	-68.6	-68.9	0	0	0	114.4	K335	K335-H337 PolarHBondContact O-N 2.86Å
338	D	45.5	Very low	60.7	Low	69 Å²	69	62.5 Å²	62.5	37%	0.369	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-0.7	176.2	-76.5	-45.1	0	0	0	112.9	K335 G340 N344	K335-D338 WeakPolarHBondContact O-CA 3.41Å; K335-D338 PolarHBondContact O-N 3.43Å; D338-G340 PolarHBondContact O-N 3.45Å; D338-N344 PolarHBondContact OD1-ND2 3.31Å
339	R	45.7	Very low	60.9	Low	136 Å²	136	62.4 Å²	62.4	51%	0.513	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	111.1	-175.4	-78.7	177.1	-178.7	177.2	5.7	110.8	K335 P336 N341	K335-R339 PolarHBondContact O-N 3.06Å; P336-R339 WeakPolarHBondContact O-CG 3.45Å; R339-N341 VanDerWaalsContact C-N 3.29Å; R339-N341 PolarHBondContact O-N 3.23Å
340	G	51.4	Low	61.6	Low	18 Å²	18	62.7 Å²	62.7	19%	0.186	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	74	8.3	161.4	0	0	0	0	0	116.3	H325 D338 P342	H325-G340 PolarHBondContact CE1-O 2.93Å; D338-G340 PolarHBondContact O-N 3.45Å; G340-P342 WeakPolarHBondContact O-CD 3.47Å
341	N	60.9	Low	62.5	Low	84 Å²	84	66.7 Å²	66.7	45%	0.449	34%	0.34	S	S	.	.			trans	-77.7	111.6	175.2	-73.8	-12.3	0	0	0	109.3	R339 L343 N344	R339-N341 VanDerWaalsContact C-N 3.29Å; R339-N341 PolarHBondContact O-N 3.23Å; N341-L343 HydrophobicContact CB-CB 4.49Å; N341-L343 PolarHBondContact O-N 3.44Å; N341-N344 PolarHBondContact O-N 3.44Å
342	P	64.9	Low	63.5	Low	6 Å²	6	65.3 Å²	65.3	4%	0.039	33%	0.333	C	S	.	.	H	α-helix	trans	-57.6	-19.6	178.3	26.7	-37.9	0	0	0	112.2	H325 L328 G340 N344 T345 I346	H325-P342 VanDerWaalsContact NE2-CD 3.31Å; H325-P342 WeakPolarHBondContact NE2-CD 3.41Å; L328-P342 HydrophobicContact CB-CB 3.56Å; L328-P342 HydrophobicContact CD1-CB 3.96Å; L328-P342 HydrophobicContact CG-CB 4.42Å; G340-P342 WeakPolarHBondContact O-CD 3.47Å; P342-N344 VanDerWaalsContact C-N 3.29Å; P342-N344 PolarHBondContact O-N 2.92Å; P342-T345 PolarHBondContact O-N 3.27Å; P342-I346 WeakPolarHBondContact O-CG1 3.08Å; P342-I346 PolarHBondContact O-N 3.3Å; P342-I346 VanDerWaalsContact O-N 3.15Å
343	L	71.4	Confident	64.9	Low	24 Å²	24	65.5 Å²	65.5	13%	0.126	33%	0.332	C	S	.	.	H	α-helix	trans	-57.2	-35.9	174.6	-172.2	68.8	0	0	0	113	N341 T345 I346 K347 M367 L370 L811 I814	N341-L343 HydrophobicContact CB-CB 4.49Å; N341-L343 PolarHBondContact O-N 3.44Å; L343-T345 VanDerWaalsContact C-N 3.34Å; L343-T345 PolarHBondContact O-N 2.9Å; L343-I346 PolarHBondContact O-N 3.49Å; L343-K347 HydrophobicContact CD2-CD 4.45Å; L343-K347 HydrophobicContact CG-CD 4.03Å; L343-K347 HydrophobicContact CG-CG 4.27Å; L343-K347 VanDerWaalsContact O-CB 3.28Å; L343-K347 WeakPolarHBondContact O-CB 3.38Å; L343-K347 WeakPolarHBondContact O-CG 3.46Å; L343-K347 PolarHBondContact O-N 2.88Å; L343-M367 HydrophobicContact CD1-SD 4.05Å; L343-L370 HydrophobicContact CD1-CD1 4.32Å; L343-L811 HydrophobicContact CD1-CD1 4.01Å; L343-I814 HydrophobicContact CD1-CG2 4.31Å; L343-I814 HydrophobicContact CD2-CG2 3.78Å
344	N	73.9	Confident	66.6	Low	39 Å²	39	58.3 Å²	58.3	21%	0.209	29%	0.293	C	S	.	.	H	α-helix	trans	-67.1	-37.7	-179.5	-76.1	-7.6	0	0	0	111.7	D338 N341 P342 K347 N348	D338-N344 PolarHBondContact OD1-ND2 3.31Å; N341-N344 PolarHBondContact O-N 3.44Å; P342-N344 VanDerWaalsContact C-N 3.29Å; P342-N344 PolarHBondContact O-N 2.92Å; N344-K347 WeakPolarHBondContact O-CB 3.32Å; N344-K347 PolarHBondContact O-N 3.1Å; N344-N348 WeakPolarHBondContact O-CB 3.28Å; N344-N348 PolarHBondContact O-N 3.42Å; N344-N348 PolarHBondContact O-OD1 2.83Å
345	T	80.6	Confident	68.4	Low	16 Å²	16	60.5 Å²	60.5	10%	0.098	30%	0.299	C	S	.	.	H	α-helix	trans	-68.4	-41.4	174.4	-56.6	0	0	0	0	111.2	V276 F280 L328 P342 L343 N348 A349	V276-T345 HydrophobicContact CB-CG2 4.5Å; V276-T345 HydrophobicContact CG1-CG2 3.49Å; V276-T345 VanDerWaalsContact CG1-CG2 3.49Å; F280-T345 HydrophobicContact CD2-CG2 4.47Å; F280-T345 HydrophobicContact CE2-CG2 3.95Å; L328-T345 HydrophobicContact CD2-CG2 3.92Å; L328-T345 WeakPolarHBondContact O-CB 3.5Å; L328-T345 PolarHBondContact O-OG1 3.08Å; P342-T345 PolarHBondContact O-N 3.27Å; L343-T345 VanDerWaalsContact C-N 3.34Å; L343-T345 PolarHBondContact O-N 2.9Å; T345-N348 PolarHBondContact O-N 2.87Å; T345-A349 PolarHBondContact O-N 3.5Å
346	I	82.4	Confident	70.4	Confident	1 Å²	1	58 Å²	58	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-66.9	-37.2	175.1	-61.4	169.7	0	0	0	111.4	L328 P342 L343 A349 I350 M367	L328-I346 HydrophobicContact CD1-CD1 4.08Å; L328-I346 HydrophobicContact CD1-CG1 4.14Å; P342-I346 WeakPolarHBondContact O-CG1 3.08Å; P342-I346 PolarHBondContact O-N 3.3Å; P342-I346 VanDerWaalsContact O-N 3.15Å; L343-I346 PolarHBondContact O-N 3.49Å; I346-A349 VanDerWaalsContact O-CB 3.32Å; I346-A349 WeakPolarHBondContact O-CB 3.46Å; I346-A349 PolarHBondContact O-N 2.76Å; I346-I350 HydrophobicContact CG2-CD1 4.06Å; I346-I350 WeakPolarHBondContact O-CG1 3.2Å; I346-I350 PolarHBondContact O-N 3.04Å; I346-M367 HydrophobicContact CD1-CG 4.19Å; I346-M367 HydrophobicContact CD1-SD 4.06Å; I346-M367 HydrophobicContact CG2-CE 3.78Å; I346-M367 HydrophobicContact CG2-CG 4.23Å; I346-M367 HydrophobicContact CG2-SD 3.78Å
347	K	81.2	Confident	72.6	Confident	37 Å²	37	54 Å²	54	16%	0.161	26%	0.262	C	S	.	.	H	α-helix	trans	-59.3	-48.6	172.3	-81.1	166.8	172.3	-175.4	0	111	L343 N344 A349 I350 Q351 L811 D815	L343-K347 HydrophobicContact CD2-CD 4.45Å; L343-K347 HydrophobicContact CG-CD 4.03Å; L343-K347 HydrophobicContact CG-CG 4.27Å; L343-K347 VanDerWaalsContact O-CB 3.28Å; L343-K347 WeakPolarHBondContact O-CB 3.38Å; L343-K347 WeakPolarHBondContact O-CG 3.46Å; L343-K347 PolarHBondContact O-N 2.88Å; N344-K347 WeakPolarHBondContact O-CB 3.32Å; N344-K347 PolarHBondContact O-N 3.1Å; K347-A349 VanDerWaalsContact C-N 3.25Å; K347-A349 PolarHBondContact O-N 2.9Å; K347-I350 PolarHBondContact O-N 3.23Å; K347-Q351 WeakPolarHBondContact O-CB 3.36Å; K347-Q351 VanDerWaalsContact O-CG 3.29Å; K347-Q351 WeakPolarHBondContact O-CG 3.38Å; K347-Q351 PolarHBondContact O-N 3.21Å; K347-L811 HydrophobicContact CD-CD1 4.3Å; K347-L811 HydrophobicContact CG-CD1 3.56Å; K347-L811 HydrophobicContact CG-CD2 3.97Å; K347-L811 HydrophobicContact CG-CG 4.38Å; K347-D815 WeakPolarHBondContact CE-OD1 3.26Å; K347-D815 WeakPolarHBondContact CE-OD2 3.43Å; K347-D815 IonicContact NZ-OD1 3.36Å; K347-D815 PolarHBondContact NZ-OD1 2.97Å; K347-D815 IonicContact NZ-OD2 3.67Å; K347-D815 PolarHBondContact NZ-OD2 3Å
348	N	79.4	Confident	74.5	Confident	86 Å²	86	45.7 Å²	45.7	46%	0.46	22%	0.224	S	C	.	.	H	α-helix	trans	-61.9	-36.9	176.5	-68.4	-6	0	0	0	111	N344 T345 Q351 S352	N344-N348 WeakPolarHBondContact O-CB 3.28Å; N344-N348 PolarHBondContact O-N 3.42Å; N344-N348 PolarHBondContact O-OD1 2.83Å; T345-N348 PolarHBondContact O-N 2.87Å; N348-Q351 PolarHBondContact O-N 2.97Å; N348-S352 WeakPolarHBondContact O-CB 3.28Å; N348-S352 PolarHBondContact O-N 3.36Å; N348-S352 PolarHBondContact O-OG 2.92Å
349	A	83.2	Confident	76.5	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62.9	-43	173.7	0	0	0	0	0	112.6	F280 T345 I346 K347 S352 H353 E354 F357 V358	F280-A349 HydrophobicContact CE1-CB 3.79Å; F280-A349 HydrophobicContact CE2-CB 4.34Å; F280-A349 HydrophobicContact CZ-CB 3.41Å; F280-A349 VanDerWaalsContact CZ-CB 3.41Å; T345-A349 PolarHBondContact O-N 3.5Å; I346-A349 VanDerWaalsContact O-CB 3.32Å; I346-A349 WeakPolarHBondContact O-CB 3.46Å; I346-A349 PolarHBondContact O-N 2.76Å; K347-A349 VanDerWaalsContact C-N 3.25Å; K347-A349 PolarHBondContact O-N 2.9Å; A349-S352 WeakPolarHBondContact CA-OG 3.48Å; A349-S352 PolarHBondContact O-N 3.22Å; A349-S352 PolarHBondContact O-OG 3.07Å; A349-S352 VanDerWaalsContact O-OG 3.11Å; A349-H353 PolarHBondContact O-N 3.48Å; A349-H353 VanDerWaalsContact O-N 3.16Å; A349-E354 HydrophobicContact CB-CB 4.32Å; A349-E354 PolarHBondContact O-N 2.86Å; A349-F357 HydrophobicContact CB-CD1 3.75Å; A349-F357 HydrophobicContact CB-CE1 3.97Å; A349-V358 HydrophobicContact CB-CG2 3.97Å
350	I	82.2	Confident	78.6	Confident	12 Å²	12	37.1 Å²	37.1	6%	0.062	19%	0.188	C	C	.	.	H	α-helix	trans	-67.7	-41.1	176.7	-68.6	167.2	0	0	0	110.7	I346 K347 S352 H353 V358 M367 F804 L811	I346-I350 HydrophobicContact CG2-CD1 4.06Å; I346-I350 WeakPolarHBondContact O-CG1 3.2Å; I346-I350 PolarHBondContact O-N 3.04Å; K347-I350 PolarHBondContact O-N 3.23Å; I350-S352 VanDerWaalsContact C-N 3.33Å; I350-S352 PolarHBondContact O-N 3.43Å; I350-H353 WeakPolarHBondContact O-CA 3.43Å; I350-H353 PolarHBondContact O-N 2.9Å; I350-V358 HydrophobicContact CG1-CG1 4.38Å; I350-V358 HydrophobicContact CG1-CG2 3.83Å; I350-M367 HydrophobicContact CD1-CE 4.04Å; I350-F804 HydrophobicContact CG1-CE2 4.33Å; I350-F804 HydrophobicContact CG2-CE2 4.47Å; I350-F804 HydrophobicContact CG2-CZ 4.31Å; I350-L811 HydrophobicContact CB-CD2 4.26Å; I350-L811 HydrophobicContact CD1-CB 4.24Å; I350-L811 HydrophobicContact CD1-CD2 3.74Å; I350-L811 HydrophobicContact CG2-CD2 4.15Å
351	Q	79.1	Confident	80.2	Confident	119 Å²	119	40.2 Å²	40.2	56%	0.556	21%	0.205	S	C	*	.	H	α-helix	trans	-64.6	-35.8	176.6	-72.5	176.2	9.4	0	0	112.7	K347 N348 H353	K347-Q351 WeakPolarHBondContact O-CB 3.36Å; K347-Q351 VanDerWaalsContact O-CG 3.29Å; K347-Q351 WeakPolarHBondContact O-CG 3.38Å; K347-Q351 PolarHBondContact O-N 3.21Å; N348-Q351 PolarHBondContact O-N 2.97Å; Q351-H353 PolarHBondContact O-N 3.32Å
352	S	75.5	Confident	81.4	Confident	27 Å²	27	38.8 Å²	38.8	19%	0.189	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	0.1	172.5	47	0	0	0	0	113.5	N348 A349 I350	N348-S352 WeakPolarHBondContact O-CB 3.28Å; N348-S352 PolarHBondContact O-N 3.36Å; N348-S352 PolarHBondContact O-OG 2.92Å; A349-S352 WeakPolarHBondContact CA-OG 3.48Å; A349-S352 PolarHBondContact O-N 3.22Å; A349-S352 PolarHBondContact O-OG 3.07Å; A349-S352 VanDerWaalsContact O-OG 3.11Å; I350-S352 VanDerWaalsContact C-N 3.33Å; I350-S352 PolarHBondContact O-N 3.43Å
353	H	79.1	Confident	82.4	Confident	93 Å²	93	38.5 Å²	38.5	43%	0.431	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	37.8	-178.4	-65.2	-76.7	0	0	0	114.3	A349 I350 Q351 K355 R525 F804	A349-H353 PolarHBondContact O-N 3.48Å; A349-H353 VanDerWaalsContact O-N 3.16Å; I350-H353 WeakPolarHBondContact O-CA 3.43Å; I350-H353 PolarHBondContact O-N 2.9Å; Q351-H353 PolarHBondContact O-N 3.32Å; H353-K355 PolarHBondContact O-N 3.18Å; H353-K355 VanDerWaalsContact O-N 3.07Å; H353-R525 PolarHBondContact NE2-NH2 2.63Å; H353-F804 HydrophobicContact CB-CZ 4.49Å; H353-F804 AromaticContact ND1-CZ 3.93Å
354	E	83.1	Confident	83.2	Confident	5 Å²	5	37.7 Å²	37.7	2%	0.023	19%	0.191	C	C	.	.			trans	-78.9	89.8	177.4	-65.8	-43.6	126.8	0	0	113.9	F280 R283 M308 A349 F357 V358	F280-E354 HydrophobicContact CD1-CG 4.35Å; F280-E354 HydrophobicContact CE1-CB 4.37Å; F280-E354 HydrophobicContact CE1-CG 3.57Å; F280-E354 HydrophobicContact CZ-CG 4.47Å; R283-E354 IonicContact CZ-OE1 4Å; R283-E354 IonicContact CZ-OE2 3.67Å; R283-E354 IonicContact NE-OE1 3.07Å; R283-E354 PolarHBondContact NE-OE1 3.49Å; R283-E354 IonicContact NE-OE2 2.86Å; R283-E354 PolarHBondContact NE-OE2 3.09Å; R283-E354 IonicContact NH1-OE1 2.9Å; R283-E354 IonicContact NH1-OE2 2.7Å; R283-E354 PolarHBondContact NH1-OE2 3.47Å; R283-E354 IonicContact NH2-OE1 2.76Å; R283-E354 PolarHBondContact NH2-OE1 2.87Å; R283-E354 IonicContact NH2-OE2 3Å; R283-E354 PolarHBondContact NH2-OE2 2.92Å; M308-E354 HydrophobicContact CE-CB 3.7Å; M308-E354 HydrophobicContact CE-CG 3.55Å; M308-E354 HydrophobicContact SD-CG 3.83Å; M308-E354 VanDerWaalsContact SD-OE2 3.39Å; A349-E354 HydrophobicContact CB-CB 4.32Å; A349-E354 PolarHBondContact O-N 2.86Å; E354-F357 HydrophobicContact CB-CB 4.29Å; E354-V358 WeakPolarHBondContact O-CB 3.45Å; E354-V358 VanDerWaalsContact O-CG2 3.23Å; E354-V358 WeakPolarHBondContact O-CG2 3.03Å; E354-V358 PolarHBondContact O-N 3.32Å
355	K	85.6	Confident	83.8	Confident	81 Å²	81	39.8 Å²	39.8	35%	0.352	20%	0.199	S	C	.	.	H	α-helix	trans	-63.2	-53.8	-178	-60.8	172.6	178.1	-176	0	112.6	H353 F357 V358 A359 E801 F804	H353-K355 PolarHBondContact O-N 3.18Å; H353-K355 VanDerWaalsContact O-N 3.07Å; K355-F357 PolarHBondContact O-N 3.18Å; K355-V358 PolarHBondContact O-N 3.07Å; K355-A359 WeakPolarHBondContact O-CB 3.38Å; K355-A359 PolarHBondContact O-N 3.07Å; K355-E801 HydrophobicContact CD-CG 4.24Å; K355-E801 IonicContact NZ-OE1 3.44Å; K355-E801 PolarHBondContact NZ-OE1 3.38Å; K355-F804 HydrophobicContact CB-CB 4.43Å; K355-F804 HydrophobicContact CB-CG 4.48Å; K355-F804 HydrophobicContact CG-CB 4.39Å; K355-F804 HydrophobicContact CG-CD1 4.35Å; K355-F804 HydrophobicContact CG-CD2 4.27Å; K355-F804 HydrophobicContact CG-CG 4.07Å
356	K	86.1	Confident	83.8	Confident	105 Å²	105	40.1 Å²	40.1	46%	0.457	20%	0.2	S	C	.	.	H	α-helix	trans	-60.4	-45.3	-174.6	-69.9	-175.8	176.4	-175.3	0	113.2	I312 A359 H360 E800	I312-K356 HydrophobicContact CD1-CB 3.56Å; I312-K356 HydrophobicContact CD1-CD 4.32Å; K356-A359 PolarHBondContact O-N 2.83Å; K356-H360 PolarHBondContact O-N 3.48Å; K356-H360 VanDerWaalsContact O-N 3.09Å; K356-E800 WeakPolarHBondContact CG-OE2 3.24Å
357	F	88.2	Confident	83.9	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-70.1	-38.7	-178.5	177.4	-89	0	0	0	113.4	V276 F280 M308 I312 V315 L328 A349 E354 K355 H360 C363	V276-F357 HydrophobicContact CG1-CE2 4.15Å; V276-F357 HydrophobicContact CG1-CZ 3.87Å; F280-F357 HydrophobicContact CE2-CE1 4.37Å; F280-F357 HydrophobicContact CE2-CZ 4.35Å; F280-F357 HydrophobicContact CZ-CD1 4.13Å; F280-F357 HydrophobicContact CZ-CE1 4.04Å; F280-F357 HydrophobicContact CZ-CZ 4.36Å; M308-F357 HydrophobicContact CE-CB 3.06Å; M308-F357 HydrophobicContact CE-CD1 4.39Å; M308-F357 HydrophobicContact CE-CD2 3.8Å; M308-F357 HydrophobicContact CE-CG 3.54Å; I312-F357 HydrophobicContact CG1-CB 4.17Å; I312-F357 HydrophobicContact CG1-CD2 4.31Å; V315-F357 HydrophobicContact CG2-CD2 4.27Å; V315-F357 HydrophobicContact CG2-CE2 3.56Å; V315-F357 HydrophobicContact CG2-CZ 4.23Å; L328-F357 HydrophobicContact CD2-CE1 4.46Å; L328-F357 HydrophobicContact CD2-CZ 3.69Å; A349-F357 HydrophobicContact CB-CD1 3.75Å; A349-F357 HydrophobicContact CB-CE1 3.97Å; E354-F357 HydrophobicContact CB-CB 4.29Å; K355-F357 PolarHBondContact O-N 3.18Å; F357-H360 WeakPolarHBondContact O-CB 3.44Å; F357-H360 PolarHBondContact O-N 3.4Å; F357-C363 WeakPolarHBondContact O-CB 3.45Å; F357-C363 PolarHBondContact O-SG 2.69Å
358	V	86.2	Confident	83.9	Confident	2 Å²	2	40.3 Å²	40.3	1%	0.012	20%	0.201	C	C	.	.	H	α-helix	trans	-70.8	-38.1	174.9	175.8	0	0	0	0	110.2	A349 I350 E354 K355 H360 Q364 F804 A807	A349-V358 HydrophobicContact CB-CG2 3.97Å; I350-V358 HydrophobicContact CG1-CG1 4.38Å; I350-V358 HydrophobicContact CG1-CG2 3.83Å; E354-V358 WeakPolarHBondContact O-CB 3.45Å; E354-V358 VanDerWaalsContact O-CG2 3.23Å; E354-V358 WeakPolarHBondContact O-CG2 3.03Å; E354-V358 PolarHBondContact O-N 3.32Å; K355-V358 PolarHBondContact O-N 3.07Å; V358-H360 PolarHBondContact O-N 3.13Å; V358-Q364 WeakPolarHBondContact O-CG 3.48Å; V358-Q364 PolarHBondContact O-NE2 3.44Å; V358-F804 HydrophobicContact CB-CD2 3.99Å; V358-F804 HydrophobicContact CG1-CD2 4.23Å; V358-F804 HydrophobicContact CG2-CD2 4.16Å; V358-F804 HydrophobicContact CG2-CE2 4.41Å; V358-A807 HydrophobicContact CG1-CB 3.45Å; V358-A807 VanDerWaalsContact CG1-CB 3.45Å
359	A	86.5	Confident	84	Confident	6 Å²	6	38.2 Å²	38.2	5%	0.05	19%	0.19	C	C	.	.	H	α-helix	trans	-68.4	-13.8	177.1	0	0	0	0	0	114.3	K355 K356 E800 K803	K355-A359 WeakPolarHBondContact O-CB 3.38Å; K355-A359 PolarHBondContact O-N 3.07Å; K356-A359 PolarHBondContact O-N 2.83Å; A359-E800 HydrophobicContact CB-CB 3.91Å; A359-E800 HydrophobicContact CB-CG 4.25Å; A359-K803 HydrophobicContact CB-CB 3.93Å; A359-K803 HydrophobicContact CB-CD 4.11Å; A359-K803 WeakPolarHBondContact O-CD 3.41Å
360	H	89.1	Confident	83.8	Confident	19 Å²	19	41.1 Å²	41.1	9%	0.088	21%	0.205	C	C	.	.	S	Bend	trans	-56.3	135.6	179	-173.7	-86.3	0	0	0	111.5	V315 D316 K356 F357 V358 N362 C363 Q364	V315-H360 VanDerWaalsContact CG1-ND1 3.3Å; V315-H360 WeakPolarHBondContact CG1-ND1 3.33Å; D316-H360 IonicContact OD1-CD2 3.36Å; D316-H360 PolarHBondContact OD1-CD2 2.66Å; D316-H360 IonicContact OD1-CE1 2.8Å; D316-H360 IonicContact OD1-NE2 3.34Å; D316-H360 PolarHBondContact OD1-NE2 3.41Å; K356-H360 PolarHBondContact O-N 3.48Å; K356-H360 VanDerWaalsContact O-N 3.09Å; F357-H360 WeakPolarHBondContact O-CB 3.44Å; F357-H360 PolarHBondContact O-N 3.4Å; V358-H360 PolarHBondContact O-N 3.13Å; H360-N362 VanDerWaalsContact C-N 3.33Å; H360-N362 PolarHBondContact CE1-N 3.45Å; H360-N362 PolarHBondContact CE1-ND2 3.47Å; H360-N362 WeakPolarHBondContact ND1-CB 3.38Å; H360-N362 PolarHBondContact ND1-N 3.15Å; H360-N362 PolarHBondContact O-N 3.24Å; H360-C363 HydrophobicContact CB-CB 4.33Å; H360-C363 PolarHBondContact O-N 2.94Å; H360-C363 VanDerWaalsContact O-N 3.08Å; H360-Q364 PolarHBondContact O-N 3.36Å
361	P	86.7	Confident	83.8	Confident	82 Å²	82	40.8 Å²	40.8	53%	0.532	20%	0.203	S	C	.	.	H	α-helix	trans	-53	-44	-177	-28.1	34.9	0	0	0	114.3	C363 Q364 H365	P361-C363 PolarHBondContact O-N 2.9Å; P361-Q364 PolarHBondContact O-N 3Å; P361-H365 VanDerWaalsContact O-CB 3.27Å; P361-H365 WeakPolarHBondContact O-CB 3.37Å; P361-H365 PolarHBondContact O-N 3.45Å
362	N	86.1	Confident	83.7	Confident	54 Å²	54	36.2 Å²	36.2	29%	0.289	18%	0.181	S	C	.	.	H	α-helix	trans	-64.5	-39	179.6	-66.8	-14.3	0	0	0	112	V315 C318 L324 H360 Q366	V315-N362 HydrophobicContact CG1-CB 3.98Å; V315-N362 PolarHBondContact O-ND2 3.48Å; C318-N362 PolarHBondContact O-ND2 3.21Å; L324-N362 HydrophobicContact CD2-CB 4.03Å; L324-N362 WeakPolarHBondContact CD2-O 3.42Å; H360-N362 VanDerWaalsContact C-N 3.33Å; H360-N362 PolarHBondContact CE1-N 3.45Å; H360-N362 PolarHBondContact CE1-ND2 3.47Å; H360-N362 WeakPolarHBondContact ND1-CB 3.38Å; H360-N362 PolarHBondContact ND1-N 3.15Å; H360-N362 PolarHBondContact O-N 3.24Å; N362-Q366 WeakPolarHBondContact O-CB 3.44Å; N362-Q366 PolarHBondContact O-N 3.34Å
363	C	85.5	Confident	83.3	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.007	20%	0.198	C	C	.	.	H	α-helix	trans	-71.4	-42.8	177.4	-64.1	0	0	0	0	111.4	F357 H360 P361 Q366 M367	F357-C363 WeakPolarHBondContact O-CB 3.45Å; F357-C363 PolarHBondContact O-SG 2.69Å; H360-C363 HydrophobicContact CB-CB 4.33Å; H360-C363 PolarHBondContact O-N 2.94Å; H360-C363 VanDerWaalsContact O-N 3.08Å; P361-C363 PolarHBondContact O-N 2.9Å; C363-Q366 PolarHBondContact O-N 2.89Å; C363-M367 WeakPolarHBondContact O-CG 3.44Å; C363-M367 PolarHBondContact O-N 3.04Å
364	Q	88.1	Confident	82.6	Confident	7 Å²	7	36 Å²	36	3%	0.033	19%	0.187	C	C	.	.	H	α-helix	trans	-61.3	-44.5	174.8	-72.7	-67.4	-53.3	0	0	111.3	V358 H360 P361 Q366 M367 E368 K803	V358-Q364 WeakPolarHBondContact O-CG 3.48Å; V358-Q364 PolarHBondContact O-NE2 3.44Å; H360-Q364 PolarHBondContact O-N 3.36Å; P361-Q364 PolarHBondContact O-N 3Å; Q364-Q366 VanDerWaalsContact C-N 3.34Å; Q364-Q366 PolarHBondContact O-N 2.82Å; Q364-M367 PolarHBondContact O-N 3.37Å; Q364-E368 WeakPolarHBondContact O-CB 3.21Å; Q364-E368 WeakPolarHBondContact O-CG 3.41Å; Q364-E368 PolarHBondContact O-N 3.42Å; Q364-K803 HydrophobicContact CG-CB 4.4Å; Q364-K803 HydrophobicContact CG-CD 4.28Å; Q364-K803 HydrophobicContact CG-CG 4.48Å; Q364-K803 PolarHBondContact NE2-O 2.91Å
365	H	85.2	Confident	82	Confident	82 Å²	82	36.1 Å²	36.1	38%	0.38	19%	0.188	S	C	.	.	H	α-helix	trans	-61.2	-42.7	176.8	-175.7	66.3	0	0	0	111.8	P361 M367 E368 N369	P361-H365 VanDerWaalsContact O-CB 3.27Å; P361-H365 WeakPolarHBondContact O-CB 3.37Å; P361-H365 PolarHBondContact O-N 3.45Å; H365-M367 PolarHBondContact O-N 3.4Å; H365-E368 PolarHBondContact O-N 3.44Å; H365-N369 PolarHBondContact CD2-ND2 2.87Å; H365-N369 VanDerWaalsContact CD2-ND2 3.3Å; H365-N369 PolarHBondContact CE1-ND2 3.38Å; H365-N369 PolarHBondContact NE2-ND2 3.48Å; H365-N369 WeakPolarHBondContact O-CB 3.48Å; H365-N369 PolarHBondContact O-N 3.38Å; H365-N369 PolarHBondContact O-ND2 3.42Å
366	Q	82	Confident	81	Confident	23 Å²	23	34.8 Å²	34.8	11%	0.107	18%	0.182	C	C	.	.	H	α-helix	trans	-62.2	-42.8	175.3	-171.9	63.5	24.6	0	0	111.9	L324 N362 C363 Q364 N369 L370	L324-Q366 HydrophobicContact CD2-CB 4.02Å; L324-Q366 HydrophobicContact CD2-CG 4.49Å; N362-Q366 WeakPolarHBondContact O-CB 3.44Å; N362-Q366 PolarHBondContact O-N 3.34Å; C363-Q366 PolarHBondContact O-N 2.89Å; Q364-Q366 VanDerWaalsContact C-N 3.34Å; Q364-Q366 PolarHBondContact O-N 2.82Å; Q366-N369 PolarHBondContact O-N 2.84Å; Q366-L370 HydrophobicContact CG-CD1 4.47Å; Q366-L370 VanDerWaalsContact O-CG 3.28Å; Q366-L370 WeakPolarHBondContact O-CG 3.31Å; Q366-L370 PolarHBondContact O-N 2.9Å; Q366-L370 VanDerWaalsContact O-N 3.09Å
367	M	83.2	Confident	80	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-67.4	-39.8	177.5	-71.3	-69	-94.6	0	0	112.3	L343 I346 I350 C363 Q364 H365 L370 F371 A807 W810 L811	L343-M367 HydrophobicContact CD1-SD 4.05Å; I346-M367 HydrophobicContact CD1-CG 4.19Å; I346-M367 HydrophobicContact CD1-SD 4.06Å; I346-M367 HydrophobicContact CG2-CE 3.78Å; I346-M367 HydrophobicContact CG2-CG 4.23Å; I346-M367 HydrophobicContact CG2-SD 3.78Å; I350-M367 HydrophobicContact CD1-CE 4.04Å; C363-M367 WeakPolarHBondContact O-CG 3.44Å; C363-M367 PolarHBondContact O-N 3.04Å; Q364-M367 PolarHBondContact O-N 3.37Å; H365-M367 PolarHBondContact O-N 3.4Å; M367-L370 PolarHBondContact O-N 2.95Å; M367-F371 WeakPolarHBondContact O-CB 3.05Å; M367-F371 PolarHBondContact O-N 3.23Å; M367-A807 HydrophobicContact CE-CB 4.33Å; M367-W810 HydrophobicContact CB-CE3 4.14Å; M367-W810 HydrophobicContact CB-CZ3 4.29Å; M367-L811 HydrophobicContact CE-CB 4.49Å
368	E	82.6	Confident	79.2	Confident	41 Å²	41	31.3 Å²	31.3	19%	0.192	17%	0.17	C	C	.	.	H	α-helix	trans	-63.1	-45.1	174.8	-77.3	174	-172.6	0	0	111.3	Q364 H365 L370 F371 Y372 R806 W810	Q364-E368 WeakPolarHBondContact O-CB 3.21Å; Q364-E368 WeakPolarHBondContact O-CG 3.41Å; Q364-E368 PolarHBondContact O-N 3.42Å; H365-E368 PolarHBondContact O-N 3.44Å; E368-L370 PolarHBondContact O-N 3.33Å; E368-F371 PolarHBondContact O-N 2.93Å; E368-Y372 HydrophobicContact CB-CD2 4.41Å; E368-Y372 WeakPolarHBondContact O-CB 3.28Å; E368-Y372 WeakPolarHBondContact O-CD2 3.49Å; E368-Y372 PolarHBondContact O-N 3.39Å; E368-R806 IonicContact OE1-CZ 3.44Å; E368-R806 IonicContact OE1-NH1 3.96Å; E368-R806 IonicContact OE1-NH2 2.69Å; E368-R806 PolarHBondContact OE1-NH2 2.86Å; E368-W810 HydrophobicContact CG-CH2 3.32Å; E368-W810 HydrophobicContact CG-CZ2 4.39Å; E368-W810 HydrophobicContact CG-CZ3 3.51Å
369	N	80.4	Confident	78.4	Confident	42 Å²	42	34.8 Å²	34.8	23%	0.225	18%	0.182	C	C	.	.	H	α-helix	trans	-61.2	-35.4	176.3	-70.4	-19.6	0	0	0	111.8	H365 Q366 S373 R379	H365-N369 PolarHBondContact CD2-ND2 2.87Å; H365-N369 VanDerWaalsContact CD2-ND2 3.3Å; H365-N369 PolarHBondContact CE1-ND2 3.38Å; H365-N369 PolarHBondContact NE2-ND2 3.48Å; H365-N369 WeakPolarHBondContact O-CB 3.48Å; H365-N369 PolarHBondContact O-N 3.38Å; H365-N369 PolarHBondContact O-ND2 3.42Å; Q366-N369 PolarHBondContact O-N 2.84Å; N369-S373 VanDerWaalsContact O-CA 3.25Å; N369-S373 WeakPolarHBondContact O-CA 3.29Å; N369-S373 PolarHBondContact O-N 3.28Å; N369-S373 VanDerWaalsContact O-N 3.09Å; N369-R379 PolarHBondContact OD1-NH1 3.1Å
370	L	79.2	Confident	77.7	Confident	62 Å²	62	39.1 Å²	39.1	33%	0.325	21%	0.205	S	C	.	.	H	α-helix	trans	-72.1	-41.6	174.7	-70.5	170	0	0	0	112.2	L343 Q366 M367 E368 I814	L343-L370 HydrophobicContact CD1-CD1 4.32Å; Q366-L370 HydrophobicContact CG-CD1 4.47Å; Q366-L370 VanDerWaalsContact O-CG 3.28Å; Q366-L370 WeakPolarHBondContact O-CG 3.31Å; Q366-L370 PolarHBondContact O-N 2.9Å; Q366-L370 VanDerWaalsContact O-N 3.09Å; M367-L370 PolarHBondContact O-N 2.95Å; E368-L370 PolarHBondContact O-N 3.33Å; L370-I814 HydrophobicContact CB-CD1 4.5Å
371	F	82.5	Confident	77	Confident	4 Å²	4	40.9 Å²	40.9	2%	0.018	21%	0.213	C	C	.	.	H	α-helix	trans	-66.5	-46.2	179.9	-170.5	-111.6	0	0	0	111.3	M367 E368 P437 V438 F441 W810	M367-F371 WeakPolarHBondContact O-CB 3.05Å; M367-F371 PolarHBondContact O-N 3.23Å; E368-F371 PolarHBondContact O-N 2.93Å; F371-P437 HydrophobicContact CD2-CB 3.56Å; F371-P437 HydrophobicContact CE2-CB 3.82Å; F371-P437 HydrophobicContact CG-CB 4.47Å; F371-V438 HydrophobicContact CD1-CG2 3.3Å; F371-V438 HydrophobicContact CD2-CG2 4.43Å; F371-V438 HydrophobicContact CE1-CB 4.14Å; F371-V438 HydrophobicContact CE1-CG2 3.24Å; F371-V438 HydrophobicContact CE2-CG2 4.36Å; F371-V438 HydrophobicContact CG-CG2 3.93Å; F371-V438 HydrophobicContact CZ-CB 4.31Å; F371-V438 HydrophobicContact CZ-CG2 3.79Å; F371-V438 WeakPolarHBondContact O-CG2 3.49Å; F371-F441 HydrophobicContact CE2-CB 4.47Å; F371-F441 HydrophobicContact CZ-CB 4.06Å; F371-F441 HydrophobicContact CZ-CD1 4.34Å; F371-F441 HydrophobicContact CZ-CG 4.35Å; F371-W810 HydrophobicContact CB-CD2 4.42Å; F371-W810 AromaticContact CD1-CD1 3.99Å; F371-W810 HydrophobicContact CD1-CD2 4.37Å; F371-W810 HydrophobicContact CD1-CG 4.35Å; F371-W810 AromaticContact CD1-NE1 3.77Å; F371-W810 HydrophobicContact CD2-CB 3.87Å; F371-W810 AromaticContact CD2-CD1 3.68Å; F371-W810 HydrophobicContact CD2-CD2 4.43Å; F371-W810 AromaticContact CD2-CG 3.74Å; F371-W810 HydrophobicContact CD2-CG 3.74Å; F371-W810 AromaticContact CE1-CD1 3.79Å; F371-W810 AromaticContact CE1-NE1 3.56Å; F371-W810 HydrophobicContact CE2-CB 4.27Å; F371-W810 AromaticContact CE2-CD1 3.49Å; F371-W810 VanDerWaalsContact CE2-CD1 3.49Å; F371-W810 HydrophobicContact CE2-CG 4.01Å; F371-W810 HydrophobicContact CG-CB 4.42Å; F371-W810 AromaticContact CG-CD1 3.95Å; F371-W810 HydrophobicContact CG-CD2 4.17Å; F371-W810 AromaticContact CG-CG 3.95Å; F371-W810 HydrophobicContact CG-CG 3.95Å; F371-W810 AromaticContact CZ-CD1 3.55Å; F371-W810 HydrophobicContact CZ-CG 4.41Å; F371-W810 AromaticContact CZ-NE1 3.78Å
372	Y	76.7	Confident	76.4	Confident	23 Å²	23	43.9 Å²	43.9	9%	0.09	22%	0.219	C	C	.	.	S	Bend	trans	-90	5.2	-178.1	-68.5	-73.2	0	0	0	115	E368 L374 M375 F376 I378 V438	E368-Y372 HydrophobicContact CB-CD2 4.41Å; E368-Y372 WeakPolarHBondContact O-CB 3.28Å; E368-Y372 WeakPolarHBondContact O-CD2 3.49Å; E368-Y372 PolarHBondContact O-N 3.39Å; Y372-L374 VanDerWaalsContact C-N 3.33Å; Y372-L374 PolarHBondContact O-N 3.14Å; Y372-M375 CarbonylContact O-C 3.6Å; Y372-M375 VanDerWaalsContact O-C 3.24Å; Y372-M375 PolarHBondContact O-N 2.97Å; Y372-F376 PolarHBondContact O-N 2.88Å; Y372-F376 VanDerWaalsContact O-N 3.16Å; Y372-I378 HydrophobicContact CD1-CB 4.32Å; Y372-I378 HydrophobicContact CE1-CB 4.17Å; Y372-I378 HydrophobicContact CE1-CG2 3.99Å; Y372-V438 HydrophobicContact CD1-CG2 3.49Å; Y372-V438 VanDerWaalsContact CD1-CG2 3.49Å; Y372-V438 HydrophobicContact CE1-CG1 4.45Å; Y372-V438 HydrophobicContact CE1-CG2 3.69Å; Y372-V438 HydrophobicContact CG-CG2 4.15Å
373	S	67.1	Low	75.8	Confident	79 Å²	79	44.2 Å²	44.2	55%	0.552	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-30.1	-56.1	-170.1	178.3	0	0	0	0	116.1	N369	N369-S373 VanDerWaalsContact O-CA 3.25Å; N369-S373 WeakPolarHBondContact O-CA 3.29Å; N369-S373 PolarHBondContact O-N 3.28Å; N369-S373 VanDerWaalsContact O-N 3.09Å
374	L	64	Low	75.6	Confident	38 Å²	38	50.1 Å²	50.1	20%	0.199	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-18.1	-178.2	-70.1	153.6	0	0	0	114.4	Y372 Y428 E432 C436	Y372-L374 VanDerWaalsContact C-N 3.33Å; Y372-L374 PolarHBondContact O-N 3.14Å; L374-Y428 HydrophobicContact CD2-CE1 4.4Å; L374-E432 HydrophobicContact CD1-CG 3.79Å; L374-E432 VanDerWaalsContact CD1-O 3.3Å; L374-E432 WeakPolarHBondContact CD1-O 3.47Å; L374-E432 HydrophobicContact CD2-CG 4.21Å; L374-C436 HydrophobicContact CD1-CB 4.14Å
375	M	70.7	Confident	75.2	Confident	7 Å²	7	54.6 Å²	54.6	3%	0.034	29%	0.287	C	S	.	.			trans	-120	45.4	-171.1	-73.6	-90.4	132.2	0	0	110.6	Y372 C377 I378 F389 I433 T439	Y372-M375 CarbonylContact O-C 3.6Å; Y372-M375 VanDerWaalsContact O-C 3.24Å; Y372-M375 PolarHBondContact O-N 2.97Å; M375-C377 VanDerWaalsContact C-N 3.27Å; M375-C377 PolarHBondContact O-N 3.37Å; M375-I378 HydrophobicContact CB-CD1 3.83Å; M375-I378 HydrophobicContact CB-CG1 4.37Å; M375-I378 HydrophobicContact CG-CD1 4.46Å; M375-I378 PolarHBondContact O-N 3.31Å; M375-I378 HydrophobicContact SD-CD1 4.29Å; M375-F389 HydrophobicContact SD-CZ 4.13Å; M375-I433 HydrophobicContact CE-CG2 4.25Å; M375-T439 HydrophobicContact CG-CG2 4.46Å
376	F	65	Low	74.9	Confident	53 Å²	53	54.8 Å²	54.8	23%	0.232	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-33.5	-173.4	-167.5	-96.6	0	0	0	113.1	Y372 I378 R379 D380	Y372-F376 PolarHBondContact O-N 2.88Å; Y372-F376 VanDerWaalsContact O-N 3.16Å; F376-I378 PolarHBondContact O-N 3.29Å; F376-I378 VanDerWaalsContact O-N 3.09Å; F376-R379 VanDerWaalsContact O-CB 3.24Å; F376-R379 WeakPolarHBondContact O-CB 3.28Å; F376-R379 PolarHBondContact O-N 3.26Å; F376-D380 WeakPolarHBondContact CD1-OD2 3.45Å; F376-D380 WeakPolarHBondContact CE1-OD2 3.35Å
377	C	65.3	Low	74.8	Confident	20 Å²	20	58.2 Å²	58.2	14%	0.135	30%	0.303	C	S	.	.	H	α-helix	trans	-57.1	-29	-178.6	-58.9	0	0	0	0	113.5	M375 R379 D380 F381 L418	M375-C377 VanDerWaalsContact C-N 3.27Å; M375-C377 PolarHBondContact O-N 3.37Å; C377-R379 PolarHBondContact O-N 2.87Å; C377-D380 PolarHBondContact O-N 3.04Å; C377-D380 VanDerWaalsContact O-N 3.12Å; C377-F381 HydrophobicContact CB-CE1 4.33Å; C377-F381 HydrophobicContact CB-CE2 3.92Å; C377-F381 HydrophobicContact CB-CZ 3.7Å; C377-F381 WeakPolarHBondContact O-CD2 3.29Å; C377-F381 VanDerWaalsContact O-CG 3.24Å; C377-F381 WeakPolarHBondContact O-CG 3.48Å; C377-F381 PolarHBondContact O-N 3.01Å; C377-F381 VanDerWaalsContact O-N 3.15Å; C377-L418 PolarHBondContact SG-O 3.09Å
378	I	70.7	Confident	74.7	Confident	11 Å²	11	63.4 Å²	63.4	6%	0.056	33%	0.327	C	S	.	.	H	α-helix	trans	-58.7	-33.7	177.6	-59.8	176.8	0	0	0	111.5	Y372 M375 F376 R386 F389 V438	Y372-I378 HydrophobicContact CD1-CB 4.32Å; Y372-I378 HydrophobicContact CE1-CB 4.17Å; Y372-I378 HydrophobicContact CE1-CG2 3.99Å; M375-I378 HydrophobicContact CB-CD1 3.83Å; M375-I378 HydrophobicContact CB-CG1 4.37Å; M375-I378 HydrophobicContact CG-CD1 4.46Å; M375-I378 PolarHBondContact O-N 3.31Å; M375-I378 HydrophobicContact SD-CD1 4.29Å; F376-I378 PolarHBondContact O-N 3.29Å; F376-I378 VanDerWaalsContact O-N 3.09Å; I378-R386 HydrophobicContact CG2-CG 4.4Å; I378-F389 HydrophobicContact CD1-CD1 4.16Å; I378-F389 HydrophobicContact CD1-CE1 3.46Å; I378-F389 VanDerWaalsContact CD1-CE1 3.46Å; I378-F389 HydrophobicContact CD1-CZ 4.26Å; I378-F389 HydrophobicContact CG1-CD1 3.82Å; I378-F389 HydrophobicContact CG1-CE1 3.43Å; I378-F389 VanDerWaalsContact CG1-CE1 3.43Å; I378-F389 HydrophobicContact CG1-CZ 4.12Å; I378-V438 HydrophobicContact CD1-CG1 4.07Å
379	R	70.7	Confident	74.5	Confident	75 Å²	75	62.7 Å²	62.7	28%	0.283	32%	0.324	S	S	.	.	H	α-helix	trans	-71.7	-35	-179.6	-168.9	-170.2	68.3	165.5	15.5	112	N369 F376 C377	N369-R379 PolarHBondContact OD1-NH1 3.1Å; F376-R379 VanDerWaalsContact O-CB 3.24Å; F376-R379 WeakPolarHBondContact O-CB 3.28Å; F376-R379 PolarHBondContact O-N 3.26Å; C377-R379 PolarHBondContact O-N 2.87Å
380	D	70.2	Confident	74.5	Confident	98 Å²	98	62.9 Å²	62.9	52%	0.524	33%	0.326	S	S	.	.	H	α-helix	trans	-88.5	-12.3	-175.4	-56.5	-24.3	0	0	0	112.5	F376 C377	F376-D380 WeakPolarHBondContact CD1-OD2 3.45Å; F376-D380 WeakPolarHBondContact CE1-OD2 3.35Å; C377-D380 PolarHBondContact O-N 3.04Å; C377-D380 VanDerWaalsContact O-N 3.12Å
381	F	74.9	Confident	74.7	Confident	56 Å²	56	64.6 Å²	64.6	25%	0.246	33%	0.334	C	S	.	.	S	Bend	trans	-73.1	133.7	178.4	-67.6	-36.9	0	0	0	113.2	C377 Q385 R386 F389 L418	C377-F381 HydrophobicContact CB-CE1 4.33Å; C377-F381 HydrophobicContact CB-CE2 3.92Å; C377-F381 HydrophobicContact CB-CZ 3.7Å; C377-F381 WeakPolarHBondContact O-CD2 3.29Å; C377-F381 VanDerWaalsContact O-CG 3.24Å; C377-F381 WeakPolarHBondContact O-CG 3.48Å; C377-F381 PolarHBondContact O-N 3.01Å; C377-F381 VanDerWaalsContact O-N 3.15Å; F381-Q385 HydrophobicContact CB-CB 4.22Å; F381-R386 HydrophobicContact CB-CB 3.95Å; F381-F389 HydrophobicContact CD2-CB 4.19Å; F381-F389 HydrophobicContact CD2-CG 4.28Å; F381-F389 HydrophobicContact CE2-CB 4.17Å; F381-F389 AromaticContact CE2-CD2 3.89Å; F381-F389 HydrophobicContact CE2-CD2 3.89Å; F381-F389 HydrophobicContact CE2-CE2 4.49Å; F381-F389 AromaticContact CE2-CG 3.92Å; F381-F389 HydrophobicContact CE2-CG 3.92Å; F381-L418 HydrophobicContact CZ-CD2 4.19Å
382	E	74.8	Confident	74.7	Confident	145 Å²	145	69.5 Å²	69.5	68%	0.678	36%	0.36	S	S	*	.			trans	-66.8	153.9	170.9	-66.1	177.8	179.9	0	0	111.6	L384 Q385 R386	E382-L384 PolarHBondContact O-N 3.39Å; E382-Q385 CarbonylContact O-C 3.59Å; E382-Q385 WeakPolarHBondContact O-CA 3.43Å; E382-Q385 WeakPolarHBondContact O-CB 3.25Å; E382-Q385 PolarHBondContact O-N 3.5Å; E382-R386 PolarHBondContact O-N 3.25Å
383	G	72.7	Confident	75	Confident	60 Å²	60	69.4 Å²	69.4	62%	0.619	36%	0.36	S	S	*	.	H	α-helix	trans	-46.8	-46.5	-164.8	0	0	0	0	0	116	R386 L387	G383-R386 PolarHBondContact O-N 3.21Å; G383-L387 WeakPolarHBondContact O-CB 3.29Å; G383-L387 PolarHBondContact O-N 3.31Å
384	L	81	Confident	75.8	Confident	125 Å²	125	68.4 Å²	68.4	65%	0.654	35%	0.348	S	S	*	.	H	α-helix	trans	-71.5	-39.7	179.4	-168.6	71.2	0	0	0	112.5	E382 R386 L387 Q388	E382-L384 PolarHBondContact O-N 3.39Å; L384-R386 VanDerWaalsContact C-N 3.33Å; L384-L387 PolarHBondContact O-N 3.36Å; L384-Q388 WeakPolarHBondContact O-CG 3.34Å; L384-Q388 PolarHBondContact O-N 3.42Å
385	Q	79.9	Confident	76.7	Confident	102 Å²	102	70.4 Å²	70.4	48%	0.477	37%	0.365	S	S	.	.	H	α-helix	trans	-65.5	-40.5	175.4	-65.2	179.6	-11.5	0	0	110.9	F381 E382 L387 Q388 F389	F381-Q385 HydrophobicContact CB-CB 4.22Å; E382-Q385 CarbonylContact O-C 3.59Å; E382-Q385 WeakPolarHBondContact O-CA 3.43Å; E382-Q385 WeakPolarHBondContact O-CB 3.25Å; E382-Q385 PolarHBondContact O-N 3.5Å; Q385-L387 VanDerWaalsContact C-N 3.35Å; Q385-Q388 PolarHBondContact O-N 3.45Å; Q385-F389 WeakPolarHBondContact O-CB 3.4Å; Q385-F389 PolarHBondContact O-N 3.17Å
386	R	79.8	Confident	77.3	Confident	85 Å²	85	74.1 Å²	74.1	32%	0.321	39%	0.385	S	S	.	.	H	α-helix	trans	-61.1	-44.2	174.4	-174.4	172.9	173.5	-179.8	-2	110.9	I378 F381 E382 G383 L384 F389 V390	I378-R386 HydrophobicContact CG2-CG 4.4Å; F381-R386 HydrophobicContact CB-CB 3.95Å; E382-R386 PolarHBondContact O-N 3.25Å; G383-R386 PolarHBondContact O-N 3.21Å; L384-R386 VanDerWaalsContact C-N 3.33Å; R386-F389 PolarHBondContact O-N 3.31Å; R386-V390 WeakPolarHBondContact O-CB 3.36Å; R386-V390 WeakPolarHBondContact O-CG2 3.48Å; R386-V390 PolarHBondContact O-N 3.32Å
387	L	79.5	Confident	78.2	Confident	95 Å²	95	71.6 Å²	71.6	50%	0.497	37%	0.374	S	S	.	.	H	α-helix	trans	-62.5	-47	175.7	-176.5	67.6	0	0	0	111.7	G383 L384 Q385 F389 V390 I391	G383-L387 WeakPolarHBondContact O-CB 3.29Å; G383-L387 PolarHBondContact O-N 3.31Å; L384-L387 PolarHBondContact O-N 3.36Å; Q385-L387 VanDerWaalsContact C-N 3.35Å; L387-F389 PolarHBondContact O-N 3.08Å; L387-V390 PolarHBondContact O-N 2.95Å; L387-I391 HydrophobicContact CD1-CD1 4.16Å; L387-I391 HydrophobicContact CD1-CG1 4.44Å; L387-I391 HydrophobicContact CD2-CD1 4.45Å; L387-I391 HydrophobicContact CG-CD1 3.85Å; L387-I391 HydrophobicContact CG-CG1 4.48Å; L387-I391 VanDerWaalsContact O-CG1 3.27Å; L387-I391 WeakPolarHBondContact O-CG1 3.26Å; L387-I391 PolarHBondContact O-N 3.4Å
388	Q	80.2	Confident	78.8	Confident	110 Å²	110	73.8 Å²	73.8	51%	0.514	39%	0.388	S	S	.	.	H	α-helix	trans	-59.2	-46.4	176.8	-74.8	179.4	-3.6	0	0	111.8	L384 Q385 V390 I391 I392	L384-Q388 WeakPolarHBondContact O-CG 3.34Å; L384-Q388 PolarHBondContact O-N 3.42Å; Q385-Q388 PolarHBondContact O-N 3.45Å; Q388-V390 PolarHBondContact O-N 3.4Å; Q388-I391 PolarHBondContact O-N 2.99Å; Q388-I392 VanDerWaalsContact O-CG1 3.29Å; Q388-I392 WeakPolarHBondContact O-CG1 3.43Å; Q388-I392 PolarHBondContact O-N 2.98Å
389	F	79.6	Confident	79.4	Confident	27 Å²	27	79.5 Å²	79.5	12%	0.118	41%	0.412	C	S	.	.	H	α-helix	trans	-59.2	-47.6	175.7	178.1	-90.1	0	0	0	111.3	M375 I378 F381 Q385 R386 L387 I391 I392 F393 L418	M375-F389 HydrophobicContact SD-CZ 4.13Å; I378-F389 HydrophobicContact CD1-CD1 4.16Å; I378-F389 HydrophobicContact CD1-CE1 3.46Å; I378-F389 VanDerWaalsContact CD1-CE1 3.46Å; I378-F389 HydrophobicContact CD1-CZ 4.26Å; I378-F389 HydrophobicContact CG1-CD1 3.82Å; I378-F389 HydrophobicContact CG1-CE1 3.43Å; I378-F389 VanDerWaalsContact CG1-CE1 3.43Å; I378-F389 HydrophobicContact CG1-CZ 4.12Å; F381-F389 HydrophobicContact CD2-CB 4.19Å; F381-F389 HydrophobicContact CD2-CG 4.28Å; F381-F389 HydrophobicContact CE2-CB 4.17Å; F381-F389 AromaticContact CE2-CD2 3.89Å; F381-F389 HydrophobicContact CE2-CD2 3.89Å; F381-F389 HydrophobicContact CE2-CE2 4.49Å; F381-F389 AromaticContact CE2-CG 3.92Å; F381-F389 HydrophobicContact CE2-CG 3.92Å; Q385-F389 WeakPolarHBondContact O-CB 3.4Å; Q385-F389 PolarHBondContact O-N 3.17Å; R386-F389 PolarHBondContact O-N 3.31Å; L387-F389 PolarHBondContact O-N 3.08Å; F389-I391 VanDerWaalsContact C-N 3.34Å; F389-I391 PolarHBondContact O-N 2.78Å; F389-I392 PolarHBondContact O-N 3.36Å; F389-F393 HydrophobicContact CD1-CB 4.45Å; F389-F393 HydrophobicContact CE1-CB 4.05Å; F389-F393 HydrophobicContact CE1-CG 4.23Å; F389-F393 HydrophobicContact CZ-CB 4.28Å; F389-F393 HydrophobicContact CZ-CD2 4.31Å; F389-F393 HydrophobicContact CZ-CG 4.34Å; F389-F393 WeakPolarHBondContact O-CB 3.31Å; F389-F393 PolarHBondContact O-N 3.1Å; F389-L418 HydrophobicContact CD2-CD2 4.02Å; F389-L418 HydrophobicContact CE2-CD1 4.03Å; F389-L418 HydrophobicContact CE2-CD2 3.6Å; F389-L418 HydrophobicContact CE2-CG 4.42Å
390	V	80.7	Confident	79.7	Confident	45 Å²	45	77 Å²	77	27%	0.273	40%	0.404	S	S	.	.	H	α-helix	trans	-60.5	-43.8	178.7	169	0	0	0	0	110.7	R386 L387 Q388 L394 L442	R386-V390 WeakPolarHBondContact O-CB 3.36Å; R386-V390 WeakPolarHBondContact O-CG2 3.48Å; R386-V390 PolarHBondContact O-N 3.32Å; L387-V390 PolarHBondContact O-N 2.95Å; Q388-V390 PolarHBondContact O-N 3.4Å; V390-L394 WeakPolarHBondContact O-CA 3.21Å; V390-L394 WeakPolarHBondContact O-CB 3.45Å; V390-L394 PolarHBondContact O-N 3.48Å; V390-L442 HydrophobicContact CG1-CD2 4.35Å
391	I	83.1	Confident	80.2	Confident	98 Å²	98	72.8 Å²	72.8	50%	0.503	38%	0.381	S	S	.	.	H	α-helix	trans	-63.6	-46.7	178.7	-69.1	167.3	0	0	0	111.4	L387 Q388 F389 L394 S395	L387-I391 HydrophobicContact CD1-CD1 4.16Å; L387-I391 HydrophobicContact CD1-CG1 4.44Å; L387-I391 HydrophobicContact CD2-CD1 4.45Å; L387-I391 HydrophobicContact CG-CD1 3.85Å; L387-I391 HydrophobicContact CG-CG1 4.48Å; L387-I391 VanDerWaalsContact O-CG1 3.27Å; L387-I391 WeakPolarHBondContact O-CG1 3.26Å; L387-I391 PolarHBondContact O-N 3.4Å; Q388-I391 PolarHBondContact O-N 2.99Å; F389-I391 VanDerWaalsContact C-N 3.34Å; F389-I391 PolarHBondContact O-N 2.78Å; I391-L394 PolarHBondContact O-N 2.87Å; I391-S395 PolarHBondContact O-N 3.13Å
392	I	82.2	Confident	80.3	Confident	108 Å²	108	74.1 Å²	74.1	55%	0.554	39%	0.39	S	S	*	.	H	α-helix	trans	-64.5	-49.7	179.6	-67.5	167	0	0	0	110.2	Q388 F389 L394 S395 L396	Q388-I392 VanDerWaalsContact O-CG1 3.29Å; Q388-I392 WeakPolarHBondContact O-CG1 3.43Å; Q388-I392 PolarHBondContact O-N 2.98Å; F389-I392 PolarHBondContact O-N 3.36Å; I392-L394 VanDerWaalsContact C-N 3.29Å; I392-L394 PolarHBondContact O-N 2.98Å; I392-S395 PolarHBondContact O-N 2.93Å; I392-L396 HydrophobicContact CG2-CD1 4.1Å; I392-L396 WeakPolarHBondContact O-CG 3.31Å; I392-L396 PolarHBondContact O-N 3.27Å
393	F	83.1	Confident	80.3	Confident	20 Å²	20	69.7 Å²	69.7	9%	0.088	37%	0.37	C	S	.	.	H	α-helix	trans	-61.7	-41.3	179.5	-174.4	-106.2	0	0	0	111.2	F389 S395 L396 L397 L400 T439 L442	F389-F393 HydrophobicContact CD1-CB 4.45Å; F389-F393 HydrophobicContact CE1-CB 4.05Å; F389-F393 HydrophobicContact CE1-CG 4.23Å; F389-F393 HydrophobicContact CZ-CB 4.28Å; F389-F393 HydrophobicContact CZ-CD2 4.31Å; F389-F393 HydrophobicContact CZ-CG 4.34Å; F389-F393 WeakPolarHBondContact O-CB 3.31Å; F389-F393 PolarHBondContact O-N 3.1Å; F393-S395 PolarHBondContact O-N 3.02Å; F393-L396 WeakPolarHBondContact O-CB 3.29Å; F393-L396 PolarHBondContact O-N 3.34Å; F393-L396 VanDerWaalsContact O-N 3.07Å; F393-L397 HydrophobicContact CD1-CD1 4.29Å; F393-L397 HydrophobicContact CD1-CD2 4.3Å; F393-L397 HydrophobicContact CD1-CG 4.15Å; F393-L397 HydrophobicContact CE1-CD1 4.16Å; F393-L397 HydrophobicContact CE1-CD2 3.58Å; F393-L397 HydrophobicContact CE1-CG 3.93Å; F393-L397 HydrophobicContact CZ-CD2 3.78Å; F393-L397 HydrophobicContact CZ-CG 4.46Å; F393-L397 WeakPolarHBondContact O-CG 3.34Å; F393-L397 PolarHBondContact O-N 3.39Å; F393-L400 HydrophobicContact CE2-CD1 4.28Å; F393-T439 HydrophobicContact CE1-CG2 3.87Å; F393-T439 HydrophobicContact CZ-CG2 3.57Å; F393-L442 HydrophobicContact CD1-CD2 4.02Å; F393-L442 HydrophobicContact CE1-CD2 4.43Å
394	L	83.4	Confident	80.5	Confident	59 Å²	59	68.8 Å²	68.8	31%	0.309	35%	0.349	S	S	.	.	H	α-helix	trans	-57.9	-47.3	175.5	172	52.7	0	0	0	112.3	V390 I391 I392 L396 L397 P398 V446	V390-L394 WeakPolarHBondContact O-CA 3.21Å; V390-L394 WeakPolarHBondContact O-CB 3.45Å; V390-L394 PolarHBondContact O-N 3.48Å; I391-L394 PolarHBondContact O-N 2.87Å; I392-L394 VanDerWaalsContact C-N 3.29Å; I392-L394 PolarHBondContact O-N 2.98Å; L394-L396 PolarHBondContact O-N 3.48Å; L394-L397 HydrophobicContact CD1-CD1 4.27Å; L394-L397 PolarHBondContact O-N 3.34Å; L394-P398 VanDerWaalsContact O-CD 3.28Å; L394-P398 WeakPolarHBondContact O-CD 3.2Å; L394-V446 HydrophobicContact CD1-CB 3.8Å; L394-V446 HydrophobicContact CD1-CG1 3.5Å; L394-V446 VanDerWaalsContact CD1-CG1 3.5Å; L394-V446 HydrophobicContact CD1-CG2 2.96Å; L394-V446 HydrophobicContact CD2-CG2 4.27Å; L394-V446 HydrophobicContact CG-CG2 4.23Å
395	S	82.5	Confident	80	Confident	80 Å²	80	64.2 Å²	64.2	56%	0.559	33%	0.325	S	S	*	.	H	α-helix	trans	-63.7	-25.6	177.3	-170.1	0	0	0	0	112.7	I391 I392 F393 F399	I391-S395 PolarHBondContact O-N 3.13Å; I392-S395 PolarHBondContact O-N 2.93Å; F393-S395 PolarHBondContact O-N 3.02Å; S395-F399 WeakPolarHBondContact O-CD2 3.47Å
396	L	83.3	Confident	79.6	Confident	84 Å²	84	65.8 Å²	65.8	44%	0.44	33%	0.33	S	S	.	.	H	α-helix	trans	-84.3	-24.1	178.1	-68.2	167.7	0	0	0	113.2	I392 F393 L394 F399 L400	I392-L396 HydrophobicContact CG2-CD1 4.1Å; I392-L396 WeakPolarHBondContact O-CG 3.31Å; I392-L396 PolarHBondContact O-N 3.27Å; F393-L396 WeakPolarHBondContact O-CB 3.29Å; F393-L396 PolarHBondContact O-N 3.34Å; F393-L396 VanDerWaalsContact O-N 3.07Å; L394-L396 PolarHBondContact O-N 3.48Å; L396-F399 WeakPolarHBondContact O-CB 3.27Å; L396-F399 PolarHBondContact O-N 2.79Å; L396-F399 VanDerWaalsContact O-N 3.12Å; L396-L400 WeakPolarHBondContact O-CG 3.15Å; L396-L400 PolarHBondContact O-N 3.35Å
397	L	83.7	Confident	79.3	Confident	1 Å²	1	67.9 Å²	67.9	1%	0.005	34%	0.342	C	S	.	.	H	α-helix	trans	-54.1	-46.6	-177.4	-79.9	176.1	0	0	0	114.4	F393 L394 F399 L400 Y401 L442	F393-L397 HydrophobicContact CD1-CD1 4.29Å; F393-L397 HydrophobicContact CD1-CD2 4.3Å; F393-L397 HydrophobicContact CD1-CG 4.15Å; F393-L397 HydrophobicContact CE1-CD1 4.16Å; F393-L397 HydrophobicContact CE1-CD2 3.58Å; F393-L397 HydrophobicContact CE1-CG 3.93Å; F393-L397 HydrophobicContact CZ-CD2 3.78Å; F393-L397 HydrophobicContact CZ-CG 4.46Å; F393-L397 WeakPolarHBondContact O-CG 3.34Å; F393-L397 PolarHBondContact O-N 3.39Å; L394-L397 HydrophobicContact CD1-CD1 4.27Å; L394-L397 PolarHBondContact O-N 3.34Å; L397-F399 VanDerWaalsContact C-N 3.27Å; L397-F399 PolarHBondContact O-N 2.84Å; L397-L400 HydrophobicContact CD2-CD1 4.44Å; L397-L400 PolarHBondContact O-N 3.31Å; L397-L400 VanDerWaalsContact O-N 3.11Å; L397-Y401 HydrophobicContact CB-CE2 4.07Å; L397-Y401 HydrophobicContact CD2-CE2 4.39Å; L397-Y401 WeakPolarHBondContact O-CD2 3.17Å; L397-Y401 PolarHBondContact O-N 2.79Å; L397-L442 HydrophobicContact CD1-CB 4.05Å
398	P	79.4	Confident	78.5	Confident	65 Å²	65	64.7 Å²	64.7	42%	0.422	33%	0.327	S	S	.	.	H	α-helix	trans	-57.4	-40.8	177.3	-24.9	34	0	0	0	112.7	L394 Y401 I402	L394-P398 VanDerWaalsContact O-CD 3.28Å; L394-P398 WeakPolarHBondContact O-CD 3.2Å; P398-Y401 PolarHBondContact O-N 3.47Å; P398-I402 WeakPolarHBondContact O-CG1 3.35Å; P398-I402 PolarHBondContact O-N 3.19Å; P398-I402 VanDerWaalsContact O-N 3.12Å
399	F	81.6	Confident	77.8	Confident	132 Å²	132	65.2 Å²	65.2	58%	0.579	33%	0.329	S	S	*	.	H	α-helix	trans	-67	-40.7	176.8	-61.8	-78.5	0	0	0	111.3	S395 L396 L397 Y401 I402 I403	S395-F399 WeakPolarHBondContact O-CD2 3.47Å; L396-F399 WeakPolarHBondContact O-CB 3.27Å; L396-F399 PolarHBondContact O-N 2.79Å; L396-F399 VanDerWaalsContact O-N 3.12Å; L397-F399 VanDerWaalsContact C-N 3.27Å; L397-F399 PolarHBondContact O-N 2.84Å; F399-Y401 PolarHBondContact O-N 3.22Å; F399-I402 PolarHBondContact O-N 3.34Å; F399-I403 VanDerWaalsContact O-CG1 3.25Å; F399-I403 WeakPolarHBondContact O-CG1 3.3Å; F399-I403 PolarHBondContact O-N 3.49Å
400	L	78.3	Confident	77.2	Confident	21 Å²	21	68.8 Å²	68.8	11%	0.11	35%	0.345	C	S	.	.	H	α-helix	trans	-63	-38.8	175.8	-67.3	173.7	0	0	0	112.4	F393 L396 L397 I403 Y404 M412 V430 L434	F393-L400 HydrophobicContact CE2-CD1 4.28Å; L396-L400 WeakPolarHBondContact O-CG 3.15Å; L396-L400 PolarHBondContact O-N 3.35Å; L397-L400 HydrophobicContact CD2-CD1 4.44Å; L397-L400 PolarHBondContact O-N 3.31Å; L397-L400 VanDerWaalsContact O-N 3.11Å; L400-I403 PolarHBondContact O-N 3.02Å; L400-Y404 WeakPolarHBondContact O-CB 3.44Å; L400-Y404 PolarHBondContact O-N 3.27Å; L400-M412 HydrophobicContact CD2-SD 4.4Å; L400-V430 HydrophobicContact CD2-CG1 4.42Å; L400-L434 HydrophobicContact CB-CD2 4.5Å
401	Y	80.9	Confident	76.2	Confident	10 Å²	10	72.4 Å²	72.4	4%	0.039	36%	0.357	C	S	.	.	H	α-helix	trans	-66.2	-39.9	175	-70	-56.8	0	0	0	112.7	L397 P398 F399 Y404 L405 L434 G443 P821 L824	L397-Y401 HydrophobicContact CB-CE2 4.07Å; L397-Y401 HydrophobicContact CD2-CE2 4.39Å; L397-Y401 WeakPolarHBondContact O-CD2 3.17Å; L397-Y401 PolarHBondContact O-N 2.79Å; P398-Y401 PolarHBondContact O-N 3.47Å; F399-Y401 PolarHBondContact O-N 3.22Å; Y401-Y404 PolarHBondContact O-N 3.27Å; Y401-L405 WeakPolarHBondContact O-CG 3.5Å; Y401-L405 PolarHBondContact O-N 2.82Å; Y401-L434 HydrophobicContact CD1-CD2 3.79Å; Y401-L434 HydrophobicContact CE1-CD2 3.44Å; Y401-L434 VanDerWaalsContact CE1-CD2 3.44Å; Y401-G443 WeakPolarHBondContact OH-CA 3.1Å; Y401-P821 HydrophobicContact CD2-CG 4.25Å; Y401-P821 HydrophobicContact CE1-CG 4.22Å; Y401-P821 HydrophobicContact CE2-CG 3.78Å; Y401-L824 HydrophobicContact CG-CD1 4.3Å
402	I	76.6	Confident	75.1	Confident	85 Å²	85	71 Å²	71	44%	0.436	35%	0.349	S	S	.	.	H	α-helix	trans	-62.9	-45.3	174	-67.8	169.1	0	0	0	109.9	P398 F399 Y404 L405 F406	P398-I402 WeakPolarHBondContact O-CG1 3.35Å; P398-I402 PolarHBondContact O-N 3.19Å; P398-I402 VanDerWaalsContact O-N 3.12Å; F399-I402 PolarHBondContact O-N 3.34Å; I402-Y404 VanDerWaalsContact C-N 3.34Å; I402-Y404 PolarHBondContact O-N 2.89Å; I402-L405 PolarHBondContact O-N 3.24Å; I402-F406 HydrophobicContact CG2-CD2 3.79Å; I402-F406 HydrophobicContact CG2-CE2 3.9Å; I402-F406 VanDerWaalsContact O-CD2 3.27Å; I402-F406 WeakPolarHBondContact O-CD2 3.36Å; I402-F406 PolarHBondContact O-N 3Å; I402-F406 VanDerWaalsContact O-N 3.15Å
403	I	75.7	Confident	73.8	Confident	51 Å²	51	71.6 Å²	71.6	26%	0.262	36%	0.36	S	S	.	.	H	α-helix	trans	-60.2	-43.9	176.1	-67.6	164.3	0	0	0	110.7	F399 L400 L405 F406 F407 F410 V430	F399-I403 VanDerWaalsContact O-CG1 3.25Å; F399-I403 WeakPolarHBondContact O-CG1 3.3Å; F399-I403 PolarHBondContact O-N 3.49Å; L400-I403 PolarHBondContact O-N 3.02Å; I403-L405 VanDerWaalsContact C-N 3.32Å; I403-L405 PolarHBondContact O-N 3.44Å; I403-F406 PolarHBondContact O-N 3.31Å; I403-F407 CarbonylContact O-C 3.59Å; I403-F407 VanDerWaalsContact O-C 3.24Å; I403-F407 VanDerWaalsContact O-CA 3.31Å; I403-F407 WeakPolarHBondContact O-CA 3.34Å; I403-F407 PolarHBondContact O-N 2.96Å; I403-F410 HydrophobicContact CG2-CB 3.94Å; I403-F410 HydrophobicContact CG2-CD1 4.13Å; I403-F410 HydrophobicContact CG2-CG 4.2Å; I403-V430 HydrophobicContact CG2-CG1 4.38Å; I403-V430 HydrophobicContact CG2-CG2 4.4Å
404	Y	74.9	Confident	72.2	Confident	42 Å²	42	73.3 Å²	73.3	17%	0.165	37%	0.369	C	S	.	.	H	α-helix	trans	-61.1	-38.1	177.4	176.9	-87	0	0	0	113.1	L400 Y401 I402 T431 L434 V819 L820	L400-Y404 WeakPolarHBondContact O-CB 3.44Å; L400-Y404 PolarHBondContact O-N 3.27Å; Y401-Y404 PolarHBondContact O-N 3.27Å; I402-Y404 VanDerWaalsContact C-N 3.34Å; I402-Y404 PolarHBondContact O-N 2.89Å; Y404-T431 HydrophobicContact CD2-CG2 3.96Å; Y404-T431 HydrophobicContact CE2-CG2 3.8Å; Y404-L434 HydrophobicContact CD2-CD1 3.68Å; Y404-L434 HydrophobicContact CG-CD1 3.88Å; Y404-V819 HydrophobicContact CE2-CG1 4.46Å; Y404-L820 HydrophobicContact CD1-CD1 3.55Å; Y404-L820 HydrophobicContact CE1-CD1 3.29Å
405	L	71.9	Confident	70.8	Confident	28 Å²	28	73.9 Å²	73.9	15%	0.147	38%	0.377	C	S	.	.	H	α-helix	trans	-66.7	-41.3	178	-79.4	170.5	0	0	0	112.6	Y401 I402 I403 L820 L824 L827	Y401-L405 WeakPolarHBondContact O-CG 3.5Å; Y401-L405 PolarHBondContact O-N 2.82Å; I402-L405 PolarHBondContact O-N 3.24Å; I403-L405 VanDerWaalsContact C-N 3.32Å; I403-L405 PolarHBondContact O-N 3.44Å; L405-L820 HydrophobicContact CD1-CD2 4.48Å; L405-L820 HydrophobicContact CD2-CD2 3.64Å; L405-L820 HydrophobicContact CG-CD2 4.15Å; L405-L824 HydrophobicContact CD1-CD2 4.45Å; L405-L827 HydrophobicContact CD1-CD1 4.27Å; L405-L827 HydrophobicContact CD2-CB 4.44Å
406	F	72.2	Confident	69.1	Low	135 Å²	135	78.3 Å²	78.3	59%	0.592	39%	0.389	S	S	*	.	H	α-helix	trans	-91.9	-36.8	-176.3	-70.9	-71.5	0	0	0	114	I402 I403	I402-F406 HydrophobicContact CG2-CD2 3.79Å; I402-F406 HydrophobicContact CG2-CE2 3.9Å; I402-F406 VanDerWaalsContact O-CD2 3.27Å; I402-F406 WeakPolarHBondContact O-CD2 3.36Å; I402-F406 PolarHBondContact O-N 3Å; I402-F406 VanDerWaalsContact O-N 3.15Å; I403-F406 PolarHBondContact O-N 3.31Å
407	F	71.7	Confident	67.7	Low	130 Å²	130	78.7 Å²	78.7	57%	0.57	40%	0.399	S	S	*	.			trans	-138.6	75.6	-171.2	-57.5	-75	0	0	0	111.6	I403 H409 F410	I403-F407 CarbonylContact O-C 3.59Å; I403-F407 VanDerWaalsContact O-C 3.24Å; I403-F407 VanDerWaalsContact O-CA 3.31Å; I403-F407 WeakPolarHBondContact O-CA 3.34Å; I403-F407 PolarHBondContact O-N 2.96Å; F407-H409 PolarHBondContact O-N 2.97Å; F407-F410 HydrophobicContact CB-CB 3.99Å; F407-F410 WeakPolarHBondContact O-CB 3.39Å; F407-F410 PolarHBondContact O-N 3.07Å
408	P	64.5	Low	66.1	Low	27 Å²	27	80.4 Å²	80.4	18%	0.175	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-41.8	-178.8	22.5	-32.7	0	0	0	112.6	F410 T431	P408-F410 PolarHBondContact O-N 3.44Å; P408-F410 VanDerWaalsContact O-N 3.17Å; P408-T431 HydrophobicContact CB-CG2 4.01Å; P408-T431 WeakPolarHBondContact O-CG2 3.47Å
409	H	65.2	Low	64.7	Low	122 Å²	122	79.1 Å²	79.1	57%	0.565	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	19.4	-180	-59.7	-60.4	0	0	0	114.4	F407 K411 E429 E831	F407-H409 PolarHBondContact O-N 2.97Å; H409-K411 PolarHBondContact O-N 3.27Å; H409-E429 IonicContact ND1-OE2 2.7Å; H409-E429 PolarHBondContact ND1-OE2 2.84Å; H409-E831 IonicContact NE2-OE1 3.7Å
410	F	66.6	Low	63	Low	102 Å²	102	81.2 Å²	81.2	45%	0.447	40%	0.402	S	S	.	.			trans	-66.9	122.2	176.7	-167	-102.8	0	0	0	110	I403 F407 P408 M412 V430	I403-F410 HydrophobicContact CG2-CB 3.94Å; I403-F410 HydrophobicContact CG2-CD1 4.13Å; I403-F410 HydrophobicContact CG2-CG 4.2Å; F407-F410 HydrophobicContact CB-CB 3.99Å; F407-F410 WeakPolarHBondContact O-CB 3.39Å; F407-F410 PolarHBondContact O-N 3.07Å; P408-F410 PolarHBondContact O-N 3.44Å; P408-F410 VanDerWaalsContact O-N 3.17Å; F410-M412 HydrophobicContact CD1-CB 4.46Å; F410-M412 HydrophobicContact CE1-CB 4.45Å; F410-V430 HydrophobicContact CB-CG2 4.49Å; F410-V430 HydrophobicContact CD1-CG2 4.25Å; F410-V430 WeakPolarHBondContact O-CG2 2.75Å; F410-V430 PolarHBondContact O-N 3.21Å; F410-V430 VanDerWaalsContact O-N 3.14Å
411	K	58.9	Low	61.6	Low	120 Å²	120	90.8 Å²	90.8	52%	0.522	44%	0.437	S	S	.	.	B	Isolated β-bridge	trans	-93.6	110.3	178.6	-65.8	179.4	-178.7	-176.6	0	108.2	H409 E429	H409-K411 PolarHBondContact O-N 3.27Å; K411-E429 HydrophobicContact CG-CG 4.33Å
412	M	61.3	Low	59.7	Low	68 Å²	68	95.4 Å²	95.4	34%	0.335	46%	0.462	S	S	.	.			trans	-99.6	128.9	-179	-171.8	-173.2	-179	0	0	110.3	L400 F410 L414 V430	L400-M412 HydrophobicContact CD2-SD 4.4Å; F410-M412 HydrophobicContact CD1-CB 4.46Å; F410-M412 HydrophobicContact CE1-CB 4.45Å; M412-L414 HydrophobicContact CE-CD2 3.83Å; M412-L414 HydrophobicContact CE-CG 4.45Å; M412-L414 HydrophobicContact CG-CG 4.35Å; M412-L414 PolarHBondContact O-N 3.49Å; M412-L414 HydrophobicContact SD-CD1 4.49Å; M412-L414 HydrophobicContact SD-CD2 3.9Å; M412-L414 HydrophobicContact SD-CG 4.01Å; M412-V430 HydrophobicContact CB-CG2 4.08Å
413	P	54.2	Low	58.2	Low	121 Å²	121	103.4 Å²	103.4	79%	0.786	49%	0.487	S	S	*	.			trans	-75.9	102.5	168	30.3	-30.2	0	0	0	108.7
414	L	49.4	Very low	56.7	Low	56 Å²	56	105.1 Å²	105.1	29%	0.293	50%	0.503	S	S	.	.			trans	-91.7	152.8	170.2	-78.7	165.5	0	0	0	110.4	M412 Q416 I419 I433	M412-L414 HydrophobicContact CE-CD2 3.83Å; M412-L414 HydrophobicContact CE-CG 4.45Å; M412-L414 HydrophobicContact CG-CG 4.35Å; M412-L414 PolarHBondContact O-N 3.49Å; M412-L414 HydrophobicContact SD-CD1 4.49Å; M412-L414 HydrophobicContact SD-CD2 3.9Å; M412-L414 HydrophobicContact SD-CG 4.01Å; L414-Q416 PolarHBondContact O-N 2.8Å; L414-I419 HydrophobicContact CB-CD1 4.22Å; L414-I419 HydrophobicContact CD1-CD1 4.37Å; L414-I433 HydrophobicContact CD1-CD1 3.34Å
415	P	53	Low	55.2	Low	72 Å²	72	106.6 Å²	106.6	47%	0.468	52%	0.517	S	S	.	.			trans	-62.3	130.8	179.4	24.6	-31.9	0	0	0	110.4	S417 L418	P415-S417 PolarHBondContact O-N 3.42Å; P415-L418 HydrophobicContact CG-CD1 3.72Å; P415-L418 HydrophobicContact CG-CG 4.11Å; P415-L418 PolarHBondContact O-N 3.47Å; P415-L418 VanDerWaalsContact O-N 3.09Å
416	Q	48.1	Very low	54	Low	172 Å²	172	110.8 Å²	110.8	80%	0.804	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-57	-16.5	-179.7	-76.9	170.9	-23.8	0	0	113.8	L414 L418	L414-Q416 PolarHBondContact O-N 2.8Å; Q416-L418 PolarHBondContact O-N 2.83Å
417	S	52.9	Low	52.7	Low	93 Å²	93	111.4 Å²	111.4	65%	0.65	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-69.1	-15	176.1	60.9	0	0	0	0	114.3	P415	P415-S417 PolarHBondContact O-N 3.42Å
418	L	50.4	Low	51.8	Low	37 Å²	37	107.3 Å²	107.3	19%	0.194	53%	0.527	C	S	.	.	G	3₁₀ helix	trans	-100.9	-9.3	-173.4	-66.2	178.9	0	0	0	114.9	C377 F381 F389 P415 Q416	C377-L418 PolarHBondContact SG-O 3.09Å; F381-L418 HydrophobicContact CZ-CD2 4.19Å; F389-L418 HydrophobicContact CD2-CD2 4.02Å; F389-L418 HydrophobicContact CE2-CD1 4.03Å; F389-L418 HydrophobicContact CE2-CD2 3.6Å; F389-L418 HydrophobicContact CE2-CG 4.42Å; P415-L418 HydrophobicContact CG-CD1 3.72Å; P415-L418 HydrophobicContact CG-CG 4.11Å; P415-L418 PolarHBondContact O-N 3.47Å; P415-L418 VanDerWaalsContact O-N 3.09Å; Q416-L418 PolarHBondContact O-N 2.83Å
419	I	51.4	Low	51.8	Low	38 Å²	38	108.9 Å²	108.9	20%	0.195	53%	0.532	C	S	.	.			trans	-136.1	110.3	-167.7	-53.2	173.1	0	0	0	109.8	L414 Y428	L414-I419 HydrophobicContact CB-CD1 4.22Å; L414-I419 HydrophobicContact CD1-CD1 4.37Å; I419-Y428 HydrophobicContact CB-CE2 4.47Å; I419-Y428 HydrophobicContact CD1-CD2 3.88Å; I419-Y428 HydrophobicContact CD1-CE2 4.06Å; I419-Y428 HydrophobicContact CG2-CD2 4.48Å; I419-Y428 HydrophobicContact CG2-CE2 3.67Å
420	Y	45.4	Very low	51.9	Low	176 Å²	176	103.2 Å²	103.2	69%	0.69	51%	0.506	S	S	*	.			trans	-126.4	122.7	179.5	-177.5	-93.9	0	0	0	111.6
421	R	47.6	Very low	51.9	Low	222 Å²	222	98.9 Å²	98.9	84%	0.838	49%	0.488	S	S	*	.	S	Bend	trans	168.9	-13.9	131.2	-175.8	163	156.3	95.2	-3	111.6
422	D	42.5	Very low	52.5	Low	107 Å²	107	97.3 Å²	97.3	57%	0.572	48%	0.482	S	S	*	.			trans	-121.4	111.2	176.3	-143.3	-32.3	0	0	0	112.7	S424	D422-S424 PolarHBondContact O-N 3.1Å; D422-S424 PolarHBondContact OD1-OG 2.98Å
423	R	43.8	Very low	53.1	Low	252 Å²	252	94.7 Å²	94.7	95%	0.951	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-7.5	-176.3	-158.9	173.1	-161.4	169.2	6.2	112.5
424	S	44.9	Very low	54.1	Low	88 Å²	88	89.1 Å²	89.1	62%	0.615	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-17.3	-168.2	64	0	0	0	0	115.1	D422	D422-S424 PolarHBondContact O-N 3.1Å; D422-S424 PolarHBondContact OD1-OG 2.98Å
425	V	43.5	Very low	55.4	Low	73 Å²	73	93.8 Å²	93.8	44%	0.442	45%	0.447	S	S	.	.			trans	-118.6	92	-176.6	-171.1	0	0	0	0	110.9	K427 Y428	V425-K427 VanDerWaalsContact C-N 3.26Å; V425-K427 PolarHBondContact O-N 3.44Å; V425-Y428 WeakPolarHBondContact O-CE2 3.5Å
426	T	46.8	Very low	56.6	Low	116 Å²	116	90.4 Å²	90.4	71%	0.712	43%	0.425	S	S	*	.			trans	-79.7	1.4	179.8	30	0	0	0	0	114.4
427	K	44.9	Very low	58.2	Low	148 Å²	148	83 Å²	83	64%	0.643	39%	0.392	S	S	*	.			trans	-132.8	98.7	-176	-65.1	-179.1	-177.5	176.9	0	110.4	V425	V425-K427 VanDerWaalsContact C-N 3.26Å; V425-K427 PolarHBondContact O-N 3.44Å
428	Y	52.9	Low	59.7	Low	43 Å²	43	78.8 Å²	78.8	17%	0.169	36%	0.362	C	S	.	.			trans	-88	141.5	173.4	-65.8	-78.3	0	0	0	111.1	L374 I419 V425	L374-Y428 HydrophobicContact CD2-CE1 4.4Å; I419-Y428 HydrophobicContact CB-CE2 4.47Å; I419-Y428 HydrophobicContact CD1-CD2 3.88Å; I419-Y428 HydrophobicContact CD1-CE2 4.06Å; I419-Y428 HydrophobicContact CG2-CD2 4.48Å; I419-Y428 HydrophobicContact CG2-CE2 3.67Å; V425-Y428 WeakPolarHBondContact O-CE2 3.5Å
429	E	64.7	Low	61.2	Low	61 Å²	61	77.1 Å²	77.1	29%	0.285	35%	0.353	S	S	.	.	B	Isolated β-bridge	trans	-84.9	140.8	171.1	-60.5	-170.2	174.1	0	0	109.4	H409 K411 T431 E432	H409-E429 IonicContact ND1-OE2 2.7Å; H409-E429 PolarHBondContact ND1-OE2 2.84Å; K411-E429 HydrophobicContact CG-CG 4.33Å; E429-T431 WeakPolarHBondContact CB-OG1 3.46Å; E429-T431 PolarHBondContact O-N 3.39Å; E429-T431 VanDerWaalsContact O-N 3.09Å; E429-E432 PolarHBondContact O-N 3.17Å
430	V	65.9	Low	62.8	Low	3 Å²	3	76 Å²	76	2%	0.018	35%	0.347	C	S	.	.	H	α-helix	trans	-54.9	-30.7	178.4	168.1	0	0	0	0	111.9	L400 I403 F410 M412 E432 I433 L434	L400-V430 HydrophobicContact CD2-CG1 4.42Å; I403-V430 HydrophobicContact CG2-CG1 4.38Å; I403-V430 HydrophobicContact CG2-CG2 4.4Å; F410-V430 HydrophobicContact CB-CG2 4.49Å; F410-V430 HydrophobicContact CD1-CG2 4.25Å; F410-V430 WeakPolarHBondContact O-CG2 2.75Å; F410-V430 PolarHBondContact O-N 3.21Å; F410-V430 VanDerWaalsContact O-N 3.14Å; M412-V430 HydrophobicContact CB-CG2 4.08Å; V430-E432 VanDerWaalsContact C-N 3.32Å; V430-E432 PolarHBondContact O-N 2.95Å; V430-I433 PolarHBondContact O-N 3.12Å; V430-L434 HydrophobicContact CG1-CD1 3.54Å; V430-L434 HydrophobicContact CG1-CG 4.46Å; V430-L434 WeakPolarHBondContact O-CD1 3.35Å; V430-L434 PolarHBondContact O-N 3.47Å; V430-L434 VanDerWaalsContact O-N 3.17Å
431	T	68	Low	64.8	Low	10 Å²	10	68.7 Å²	68.7	6%	0.061	32%	0.319	C	S	.	.	H	α-helix	trans	-58.6	-37.5	175.1	50.4	0	0	0	0	113.5	Y404 P408 E429 R435	Y404-T431 HydrophobicContact CD2-CG2 3.96Å; Y404-T431 HydrophobicContact CE2-CG2 3.8Å; P408-T431 HydrophobicContact CB-CG2 4.01Å; P408-T431 WeakPolarHBondContact O-CG2 3.47Å; E429-T431 WeakPolarHBondContact CB-OG1 3.46Å; E429-T431 PolarHBondContact O-N 3.39Å; E429-T431 VanDerWaalsContact O-N 3.09Å; T431-R435 WeakPolarHBondContact O-CB 3.21Å; T431-R435 WeakPolarHBondContact O-CD 3.37Å; T431-R435 WeakPolarHBondContact O-CG 3.26Å; T431-R435 PolarHBondContact O-N 3.46Å
432	E	70.9	Confident	66.6	Low	87 Å²	87	59.5 Å²	59.5	41%	0.407	29%	0.287	S	S	.	.	H	α-helix	trans	-72.8	-40.1	-176	-169.3	163.7	-156.5	0	0	111.3	L374 E429 V430 R435 C436	L374-E432 HydrophobicContact CD1-CG 3.79Å; L374-E432 VanDerWaalsContact CD1-O 3.3Å; L374-E432 WeakPolarHBondContact CD1-O 3.47Å; L374-E432 HydrophobicContact CD2-CG 4.21Å; E429-E432 PolarHBondContact O-N 3.17Å; V430-E432 VanDerWaalsContact C-N 3.32Å; V430-E432 PolarHBondContact O-N 2.95Å; E432-R435 PolarHBondContact O-N 2.71Å; E432-C436 PolarHBondContact O-N 2.89Å
433	I	74.3	Confident	68.6	Low	14 Å²	14	54.6 Å²	54.6	7%	0.072	26%	0.261	C	S	.	.	H	α-helix	trans	-64.2	-45.3	175.4	-62.1	164.6	0	0	0	110.9	M375 L414 V430 R435 C436 T439	M375-I433 HydrophobicContact CE-CG2 4.25Å; L414-I433 HydrophobicContact CD1-CD1 3.34Å; V430-I433 PolarHBondContact O-N 3.12Å; I433-R435 VanDerWaalsContact C-N 3.28Å; I433-R435 PolarHBondContact O-N 2.94Å; I433-C436 WeakPolarHBondContact O-CB 2.9Å; I433-C436 PolarHBondContact O-N 3.47Å; I433-C436 VanDerWaalsContact O-N 3.14Å; I433-T439 HydrophobicContact CG2-CG2 4.2Å; I433-T439 WeakPolarHBondContact O-CG2 3.49Å; I433-T439 PolarHBondContact O-OG1 3.06Å
434	L	74.7	Confident	70.6	Confident	4 Å²	4	43.5 Å²	43.5	2%	0.021	22%	0.22	C	C	.	.	H	α-helix	trans	-71.4	-23.1	179.4	-75.8	160.3	0	0	0	112.9	L400 Y401 Y404 V430 T439 V819	L400-L434 HydrophobicContact CB-CD2 4.5Å; Y401-L434 HydrophobicContact CD1-CD2 3.79Å; Y401-L434 HydrophobicContact CE1-CD2 3.44Å; Y401-L434 VanDerWaalsContact CE1-CD2 3.44Å; Y404-L434 HydrophobicContact CD2-CD1 3.68Å; Y404-L434 HydrophobicContact CG-CD1 3.88Å; V430-L434 HydrophobicContact CG1-CD1 3.54Å; V430-L434 HydrophobicContact CG1-CG 4.46Å; V430-L434 WeakPolarHBondContact O-CD1 3.35Å; V430-L434 PolarHBondContact O-N 3.47Å; V430-L434 VanDerWaalsContact O-N 3.17Å; L434-T439 PolarHBondContact O-OG1 2.96Å; L434-V819 HydrophobicContact CB-CG1 3.59Å; L434-V819 HydrophobicContact CD2-CG1 4.48Å; L434-V819 WeakPolarHBondContact O-CG1 3.44Å
435	R	75.9	Confident	72.6	Confident	153 Å²	153	40.8 Å²	40.8	58%	0.577	20%	0.198	S	C	*	.	H	α-helix	trans	-74.8	-15.6	171.4	-78.1	170.5	-176.7	172.7	2.8	112.8	T431 E432 I433 K440 V819	T431-R435 WeakPolarHBondContact O-CB 3.21Å; T431-R435 WeakPolarHBondContact O-CD 3.37Å; T431-R435 WeakPolarHBondContact O-CG 3.26Å; T431-R435 PolarHBondContact O-N 3.46Å; E432-R435 PolarHBondContact O-N 2.71Å; I433-R435 VanDerWaalsContact C-N 3.28Å; I433-R435 PolarHBondContact O-N 2.94Å; R435-K440 WeakPolarHBondContact O-CE 3.4Å; R435-K440 PolarHBondContact O-NZ 3.28Å; R435-V819 HydrophobicContact CG-CG2 4.03Å
436	C	79.7	Confident	74.7	Confident	2 Å²	2	38.8 Å²	38.8	1%	0.014	19%	0.186	C	C	.	.	S	Bend	trans	-60.4	133.6	176.8	-168.6	0	0	0	0	111	L374 E432 I433 V438 T439 K440	L374-C436 HydrophobicContact CD1-CB 4.14Å; E432-C436 PolarHBondContact O-N 2.89Å; I433-C436 WeakPolarHBondContact O-CB 2.9Å; I433-C436 PolarHBondContact O-N 3.47Å; I433-C436 VanDerWaalsContact O-N 3.14Å; C436-V438 VanDerWaalsContact C-N 3.31Å; C436-V438 PolarHBondContact O-N 3.06Å; C436-T439 HydrophobicContact CB-CG2 4.11Å; C436-T439 PolarHBondContact O-N 2.87Å; C436-T439 PolarHBondContact O-OG1 3.4Å; C436-K440 PolarHBondContact O-N 3.28Å; C436-K440 VanDerWaalsContact O-N 3.15Å
437	P	82.3	Confident	76.8	Confident	17 Å²	17	33.8 Å²	33.8	11%	0.11	16%	0.155	C	C	.	.	H	α-helix	trans	-58	-38.8	-177.7	-27.1	35.5	0	0	0	114.1	F371 T439 K440 F441 I814	F371-P437 HydrophobicContact CD2-CB 3.56Å; F371-P437 HydrophobicContact CE2-CB 3.82Å; F371-P437 HydrophobicContact CG-CB 4.47Å; P437-T439 VanDerWaalsContact C-N 3.35Å; P437-T439 PolarHBondContact O-N 3.32Å; P437-K440 PolarHBondContact O-N 3.35Å; P437-F441 PolarHBondContact O-N 3.04Å; P437-I814 HydrophobicContact CB-CG1 4Å; P437-I814 HydrophobicContact CG-CG1 3.87Å
438	V	83.4	Confident	79	Confident	4 Å²	4	28.2 Å²	28.2	2%	0.024	13%	0.131	C	C	.	.	H	α-helix	trans	-60.5	-44.3	177.6	173.3	0	0	0	0	111.4	F371 Y372 I378 C436 F441 L442	F371-V438 HydrophobicContact CD1-CG2 3.3Å; F371-V438 HydrophobicContact CD2-CG2 4.43Å; F371-V438 HydrophobicContact CE1-CB 4.14Å; F371-V438 HydrophobicContact CE1-CG2 3.24Å; F371-V438 HydrophobicContact CE2-CG2 4.36Å; F371-V438 HydrophobicContact CG-CG2 3.93Å; F371-V438 HydrophobicContact CZ-CB 4.31Å; F371-V438 HydrophobicContact CZ-CG2 3.79Å; F371-V438 WeakPolarHBondContact O-CG2 3.49Å; Y372-V438 HydrophobicContact CD1-CG2 3.49Å; Y372-V438 VanDerWaalsContact CD1-CG2 3.49Å; Y372-V438 HydrophobicContact CE1-CG1 4.45Å; Y372-V438 HydrophobicContact CE1-CG2 3.69Å; Y372-V438 HydrophobicContact CG-CG2 4.15Å; I378-V438 HydrophobicContact CD1-CG1 4.07Å; C436-V438 VanDerWaalsContact C-N 3.31Å; C436-V438 PolarHBondContact O-N 3.06Å; V438-F441 PolarHBondContact O-N 3.4Å; V438-L442 HydrophobicContact CG1-CD1 3.82Å; V438-L442 VanDerWaalsContact O-CD1 3.22Å; V438-L442 WeakPolarHBondContact O-CD1 3.13Å; V438-L442 PolarHBondContact O-N 3.5Å
439	T	82.3	Confident	80.7	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.006	14%	0.143	C	C	.	.	H	α-helix	trans	-71.3	-34.9	-177.1	62.4	0	0	0	0	111	M375 F393 I433 L434 C436 P437 G443	M375-T439 HydrophobicContact CG-CG2 4.46Å; F393-T439 HydrophobicContact CE1-CG2 3.87Å; F393-T439 HydrophobicContact CZ-CG2 3.57Å; I433-T439 HydrophobicContact CG2-CG2 4.2Å; I433-T439 WeakPolarHBondContact O-CG2 3.49Å; I433-T439 PolarHBondContact O-OG1 3.06Å; L434-T439 PolarHBondContact O-OG1 2.96Å; C436-T439 HydrophobicContact CB-CG2 4.11Å; C436-T439 PolarHBondContact O-N 2.87Å; C436-T439 PolarHBondContact O-OG1 3.4Å; P437-T439 VanDerWaalsContact C-N 3.35Å; P437-T439 PolarHBondContact O-N 3.32Å; T439-G443 PolarHBondContact O-N 2.88Å
440	K	84.7	Confident	81.9	Confident	15 Å²	15	29.6 Å²	29.6	7%	0.065	14%	0.144	C	C	.	.	H	α-helix	trans	-59.7	-51.3	168	-64.6	176.5	-174.8	166.9	0	111.3	R435 C436 P437 L442 G443 H444 Y813 Q816	R435-K440 WeakPolarHBondContact O-CE 3.4Å; R435-K440 PolarHBondContact O-NZ 3.28Å; C436-K440 PolarHBondContact O-N 3.28Å; C436-K440 VanDerWaalsContact O-N 3.15Å; P437-K440 PolarHBondContact O-N 3.35Å; K440-L442 PolarHBondContact O-N 3.06Å; K440-G443 PolarHBondContact O-N 2.84Å; K440-G443 VanDerWaalsContact O-N 3.14Å; K440-H444 PolarHBondContact O-CD2 3.08Å; K440-H444 PolarHBondContact O-N 3.45Å; K440-Y813 HydrophobicContact CB-CD1 4.18Å; K440-Q816 PolarHBondContact NZ-O 3.2Å
441	F	87.3	Confident	83.2	Confident	22 Å²	22	30.2 Å²	30.2	10%	0.096	15%	0.146	C	C	.	.	H	α-helix	trans	-55.8	-51.8	179.2	172.6	-113.5	0	0	0	111.5	F371 P437 V438 G443 H444 M445 L643 A646 L809 Y813	F371-F441 HydrophobicContact CE2-CB 4.47Å; F371-F441 HydrophobicContact CZ-CB 4.06Å; F371-F441 HydrophobicContact CZ-CD1 4.34Å; F371-F441 HydrophobicContact CZ-CG 4.35Å; P437-F441 PolarHBondContact O-N 3.04Å; V438-F441 PolarHBondContact O-N 3.4Å; F441-G443 VanDerWaalsContact C-N 3.32Å; F441-G443 PolarHBondContact O-N 3.04Å; F441-H444 PolarHBondContact O-N 2.79Å; F441-M445 HydrophobicContact CD1-CG 4.38Å; F441-M445 HydrophobicContact CD2-CG 4.19Å; F441-M445 HydrophobicContact CE1-CG 4Å; F441-M445 HydrophobicContact CE1-SD 4.46Å; F441-M445 HydrophobicContact CE2-CG 3.83Å; F441-M445 HydrophobicContact CE2-SD 3.88Å; F441-M445 HydrophobicContact CG-CG 4.47Å; F441-M445 HydrophobicContact CZ-CG 3.71Å; F441-M445 HydrophobicContact CZ-SD 3.7Å; F441-M445 VanDerWaalsContact O-CG 3.25Å; F441-M445 WeakPolarHBondContact O-CG 3.36Å; F441-M445 PolarHBondContact O-N 3.25Å; F441-L643 HydrophobicContact CE2-CD2 4.2Å; F441-A646 HydrophobicContact CE1-CB 4.21Å; F441-A646 HydrophobicContact CZ-CB 3.72Å; F441-L809 HydrophobicContact CE2-CD2 4.09Å; F441-L809 HydrophobicContact CZ-CD2 4.45Å; F441-Y813 HydrophobicContact CB-CD1 4.25Å; F441-Y813 HydrophobicContact CB-CD2 4.15Å; F441-Y813 HydrophobicContact CB-CE1 4.4Å; F441-Y813 HydrophobicContact CB-CE2 4.32Å; F441-Y813 HydrophobicContact CB-CG 4.12Å; F441-Y813 AromaticContact CD2-CD2 3.94Å; F441-Y813 HydrophobicContact CD2-CD2 3.94Å; F441-Y813 HydrophobicContact CD2-CE1 4.41Å; F441-Y813 AromaticContact CD2-CE2 3.4Å; F441-Y813 HydrophobicContact CD2-CE2 3.4Å; F441-Y813 VanDerWaalsContact CD2-CE2 3.4Å; F441-Y813 AromaticContact CD2-CZ 3.66Å; F441-Y813 HydrophobicContact CE2-CE2 4.16Å; F441-Y813 HydrophobicContact CG-CD2 4.46Å; F441-Y813 HydrophobicContact CG-CE2 4.3Å
442	L	84.7	Confident	84.3	Confident	30 Å²	30	30.3 Å²	30.3	16%	0.157	15%	0.146	C	C	.	.	H	α-helix	trans	-59	-43.3	175.9	-91.4	75.4	0	0	0	111.3	V390 F393 L397 V438 K440 H444 M445 V446	V390-L442 HydrophobicContact CG1-CD2 4.35Å; F393-L442 HydrophobicContact CD1-CD2 4.02Å; F393-L442 HydrophobicContact CE1-CD2 4.43Å; L397-L442 HydrophobicContact CD1-CB 4.05Å; V438-L442 HydrophobicContact CG1-CD1 3.82Å; V438-L442 VanDerWaalsContact O-CD1 3.22Å; V438-L442 WeakPolarHBondContact O-CD1 3.13Å; V438-L442 PolarHBondContact O-N 3.5Å; K440-L442 PolarHBondContact O-N 3.06Å; L442-H444 VanDerWaalsContact C-N 3.35Å; L442-H444 PolarHBondContact O-N 3.4Å; L442-M445 WeakPolarHBondContact O-CB 3.45Å; L442-M445 PolarHBondContact O-N 3.22Å; L442-V446 WeakPolarHBondContact O-CB 3.45Å; L442-V446 WeakPolarHBondContact O-CG2 3.44Å; L442-V446 PolarHBondContact O-N 3.43Å
443	G	84.8	Confident	85.3	Confident	3 Å²	3	30.5 Å²	30.5	3%	0.031	15%	0.149	C	C	.	.	H	α-helix	trans	-54	-48.4	175.9	0	0	0	0	0	114	Y401 T439 K440 F441 V446 S447 P821	Y401-G443 WeakPolarHBondContact OH-CA 3.1Å; T439-G443 PolarHBondContact O-N 2.88Å; K440-G443 PolarHBondContact O-N 2.84Å; K440-G443 VanDerWaalsContact O-N 3.14Å; F441-G443 VanDerWaalsContact C-N 3.32Å; F441-G443 PolarHBondContact O-N 3.04Å; G443-V446 PolarHBondContact O-N 2.87Å; G443-S447 WeakPolarHBondContact O-CB 3.37Å; G443-S447 PolarHBondContact O-N 2.98Å; G443-S447 VanDerWaalsContact O-N 3.08Å; G443-P821 WeakPolarHBondContact O-CB 3.26Å
444	H	86.7	Confident	86	Confident	19 Å²	19	31.8 Å²	31.8	9%	0.088	16%	0.156	C	C	.	.	H	α-helix	trans	-67.4	-41.5	178.2	-76.5	-73.5	0	0	0	112.4	K440 F441 L442 V446 Y448 M510 Y813	K440-H444 PolarHBondContact O-CD2 3.08Å; K440-H444 PolarHBondContact O-N 3.45Å; F441-H444 PolarHBondContact O-N 2.79Å; L442-H444 VanDerWaalsContact C-N 3.35Å; L442-H444 PolarHBondContact O-N 3.4Å; H444-V446 PolarHBondContact O-N 3.23Å; H444-Y448 WeakPolarHBondContact O-CB 3.17Å; H444-Y448 PolarHBondContact O-N 2.9Å; H444-M510 WeakPolarHBondContact CE1-CE 3.22Å; H444-M510 PolarHBondContact CE1-SD 3.38Å; H444-Y813 HydrophobicContact CB-CE1 4.1Å; H444-Y813 AromaticContact CD2-CE1 3.61Å
445	M	87.3	Confident	86.8	Confident	31 Å²	31	31.7 Å²	31.7	15%	0.153	16%	0.155	C	C	.	.	H	α-helix	trans	-53.7	-45.4	174.1	-74.2	-73	-66.8	0	0	111.7	F441 L442 Y448 I449 L643	F441-M445 HydrophobicContact CD1-CG 4.38Å; F441-M445 HydrophobicContact CD2-CG 4.19Å; F441-M445 HydrophobicContact CE1-CG 4Å; F441-M445 HydrophobicContact CE1-SD 4.46Å; F441-M445 HydrophobicContact CE2-CG 3.83Å; F441-M445 HydrophobicContact CE2-SD 3.88Å; F441-M445 HydrophobicContact CG-CG 4.47Å; F441-M445 HydrophobicContact CZ-CG 3.71Å; F441-M445 HydrophobicContact CZ-SD 3.7Å; F441-M445 VanDerWaalsContact O-CG 3.25Å; F441-M445 WeakPolarHBondContact O-CG 3.36Å; F441-M445 PolarHBondContact O-N 3.25Å; L442-M445 WeakPolarHBondContact O-CB 3.45Å; L442-M445 PolarHBondContact O-N 3.22Å; M445-Y448 PolarHBondContact O-N 3.24Å; M445-I449 WeakPolarHBondContact O-CG1 3.41Å; M445-I449 PolarHBondContact O-N 3.07Å; M445-L643 HydrophobicContact CE-CB 3.92Å; M445-L643 HydrophobicContact CE-CD1 3.71Å; M445-L643 HydrophobicContact CE-CG 4.21Å; M445-L643 HydrophobicContact SD-CB 3.64Å; M445-L643 HydrophobicContact SD-CD1 3.17Å; M445-L643 WeakPolarHBondContact SD-CD1 3.32Å; M445-L643 HydrophobicContact SD-CD2 3.23Å; M445-L643 WeakPolarHBondContact SD-CD2 3.21Å; M445-L643 HydrophobicContact SD-CG 3.43Å; M445-L643 WeakPolarHBondContact SD-CG 3.49Å
446	V	87.7	Confident	87.3	Confident	32 Å²	32	26.3 Å²	26.3	19%	0.194	14%	0.14	C	C	.	.	H	α-helix	trans	-74.3	-45	-171.2	171.5	0	0	0	0	110.5	L394 L442 G443 H444 Y448 I449 T450	L394-V446 HydrophobicContact CD1-CB 3.8Å; L394-V446 HydrophobicContact CD1-CG1 3.5Å; L394-V446 VanDerWaalsContact CD1-CG1 3.5Å; L394-V446 HydrophobicContact CD1-CG2 2.96Å; L394-V446 HydrophobicContact CD2-CG2 4.27Å; L394-V446 HydrophobicContact CG-CG2 4.23Å; L442-V446 WeakPolarHBondContact O-CB 3.45Å; L442-V446 WeakPolarHBondContact O-CG2 3.44Å; L442-V446 PolarHBondContact O-N 3.43Å; G443-V446 PolarHBondContact O-N 2.87Å; H444-V446 PolarHBondContact O-N 3.23Å; V446-Y448 PolarHBondContact O-N 3.5Å; V446-I449 PolarHBondContact O-N 2.93Å; V446-T450 WeakPolarHBondContact O-CB 3.49Å; V446-T450 WeakPolarHBondContact O-CG2 3.41Å; V446-T450 PolarHBondContact O-N 3.17Å; V446-T450 PolarHBondContact O-OG1 3.42Å
447	S	89.8	Confident	87.6	Confident	10 Å²	10	28.4 Å²	28.4	7%	0.07	15%	0.152	C	C	.	.	H	α-helix	trans	-51.8	-47.5	170.1	166.7	0	0	0	0	111.1	G443 T450 F451 W503 V822	G443-S447 WeakPolarHBondContact O-CB 3.37Å; G443-S447 PolarHBondContact O-N 2.98Å; G443-S447 VanDerWaalsContact O-N 3.08Å; S447-T450 VanDerWaalsContact C-OG1 3.28Å; S447-T450 VanDerWaalsContact CA-OG1 3.3Å; S447-T450 WeakPolarHBondContact CA-OG1 3.18Å; S447-T450 PolarHBondContact O-N 3.32Å; S447-T450 PolarHBondContact O-OG1 3.29Å; S447-F451 PolarHBondContact O-N 2.86Å; S447-W503 WeakPolarHBondContact O-CZ2 3.36Å; S447-W503 PolarHBondContact OG-NE1 3.49Å; S447-V822 VanDerWaalsContact CB-O 3.23Å; S447-V822 WeakPolarHBondContact CB-O 3.49Å; S447-V822 PolarHBondContact OG-O 2.97Å
448	Y	90.9	Very high	87.6	Confident	32 Å²	32	28.2 Å²	28.2	13%	0.125	15%	0.152	C	C	.	.	H	α-helix	trans	-69.8	-39	-177.9	-180	-106.9	0	0	0	113.2	H444 M445 V446 T450 F451 L452 S636 R639 I640 L643	H444-Y448 WeakPolarHBondContact O-CB 3.17Å; H444-Y448 PolarHBondContact O-N 2.9Å; M445-Y448 PolarHBondContact O-N 3.24Å; V446-Y448 PolarHBondContact O-N 3.5Å; Y448-T450 VanDerWaalsContact C-N 3.35Å; Y448-T450 PolarHBondContact O-N 3.3Å; Y448-F451 HydrophobicContact CD2-CD1 4.36Å; Y448-F451 HydrophobicContact CE2-CD1 4.39Å; Y448-F451 WeakPolarHBondContact O-CB 3.48Å; Y448-F451 PolarHBondContact O-N 2.86Å; Y448-L452 HydrophobicContact CD1-CD1 4.4Å; Y448-L452 HydrophobicContact CE1-CD1 3.95Å; Y448-L452 WeakPolarHBondContact O-CG 3.45Å; Y448-L452 PolarHBondContact O-N 3.43Å; Y448-S636 PolarHBondContact OH-O 3.19Å; Y448-R639 HydrophobicContact CE2-CG 4.02Å; Y448-R639 WeakPolarHBondContact OH-CA 3.43Å; Y448-R639 WeakPolarHBondContact OH-CB 3.31Å; Y448-R639 VanDerWaalsContact OH-CG 3.25Å; Y448-R639 WeakPolarHBondContact OH-CG 3.39Å; Y448-I640 HydrophobicContact CE1-CB 4.44Å; Y448-I640 HydrophobicContact CE1-CG1 3.71Å; Y448-I640 PolarHBondContact OH-N 3.14Å; Y448-L643 HydrophobicContact CD1-CD1 3.81Å; Y448-L643 HydrophobicContact CE1-CD1 4.08Å
449	I	89.9	Confident	87.5	Confident	82 Å²	82	31.6 Å²	31.6	42%	0.421	17%	0.173	S	C	.	.	H	α-helix	trans	-62.7	-42.2	171.6	-69.8	169.2	0	0	0	110.7	M445 V446 F451 L452 I453	M445-I449 WeakPolarHBondContact O-CG1 3.41Å; M445-I449 PolarHBondContact O-N 3.07Å; V446-I449 PolarHBondContact O-N 2.93Å; I449-F451 VanDerWaalsContact C-N 3.29Å; I449-F451 PolarHBondContact O-N 3.17Å; I449-L452 PolarHBondContact O-N 3.19Å; I449-I453 HydrophobicContact CG2-CD1 3.96Å; I449-I453 HydrophobicContact CG2-CG1 4.47Å; I449-I453 WeakPolarHBondContact O-CG1 3.46Å; I449-I453 PolarHBondContact O-N 2.97Å
450	T	89.3	Confident	87.2	Confident	50 Å²	50	39 Å²	39	31%	0.307	21%	0.205	S	C	.	.	H	α-helix	trans	-64.7	-33.5	176.2	51.9	0	0	0	0	112.5	V446 S447 Y448 I453 L454 W503	V446-T450 WeakPolarHBondContact O-CB 3.49Å; V446-T450 WeakPolarHBondContact O-CG2 3.41Å; V446-T450 PolarHBondContact O-N 3.17Å; V446-T450 PolarHBondContact O-OG1 3.42Å; S447-T450 VanDerWaalsContact C-OG1 3.28Å; S447-T450 VanDerWaalsContact CA-OG1 3.3Å; S447-T450 WeakPolarHBondContact CA-OG1 3.18Å; S447-T450 PolarHBondContact O-N 3.32Å; S447-T450 PolarHBondContact O-OG1 3.29Å; Y448-T450 VanDerWaalsContact C-N 3.35Å; Y448-T450 PolarHBondContact O-N 3.3Å; T450-I453 PolarHBondContact O-N 3.26Å; T450-L454 WeakPolarHBondContact O-CB 3.44Å; T450-L454 WeakPolarHBondContact O-CG 3.46Å; T450-L454 PolarHBondContact O-N 3.38Å; T450-W503 WeakPolarHBondContact OG1-CH2 3.41Å; T450-W503 WeakPolarHBondContact OG1-CZ2 3.39Å
451	F	92.5	Very high	86.3	Confident	17 Å²	17	45.3 Å²	45.3	8%	0.075	23%	0.229	C	C	.	.	H	α-helix	trans	-62.3	-45.4	171.6	172.8	-109.5	0	0	0	111.8	S447 Y448 I449 L454 I455 L500 W503 I504 Y539	S447-F451 PolarHBondContact O-N 2.86Å; Y448-F451 HydrophobicContact CD2-CD1 4.36Å; Y448-F451 HydrophobicContact CE2-CD1 4.39Å; Y448-F451 WeakPolarHBondContact O-CB 3.48Å; Y448-F451 PolarHBondContact O-N 2.86Å; I449-F451 VanDerWaalsContact C-N 3.29Å; I449-F451 PolarHBondContact O-N 3.17Å; F451-L454 PolarHBondContact O-N 2.96Å; F451-I455 HydrophobicContact CD1-CD1 3.92Å; F451-I455 HydrophobicContact CD2-CD1 4.49Å; F451-I455 HydrophobicContact CE1-CD1 3.39Å; F451-I455 HydrophobicContact CE1-CG1 4.47Å; F451-I455 HydrophobicContact CE2-CD1 4.03Å; F451-I455 HydrophobicContact CE2-CG1 4.38Å; F451-I455 HydrophobicContact CG-CD1 4.46Å; F451-I455 HydrophobicContact CZ-CD1 3.46Å; F451-I455 VanDerWaalsContact CZ-CD1 3.46Å; F451-I455 HydrophobicContact CZ-CG1 4.28Å; F451-I455 WeakPolarHBondContact O-CG1 3.46Å; F451-I455 PolarHBondContact O-N 3.37Å; F451-L500 HydrophobicContact CD2-CD2 3.89Å; F451-L500 HydrophobicContact CE2-CD2 3.88Å; F451-W503 HydrophobicContact CB-CD2 4.18Å; F451-W503 HydrophobicContact CB-CG 4.27Å; F451-W503 HydrophobicContact CB-CZ2 4.37Å; F451-W503 HydrophobicContact CD2-CB 3.86Å; F451-W503 AromaticContact CD2-CD1 3.61Å; F451-W503 HydrophobicContact CD2-CD2 4.18Å; F451-W503 AromaticContact CD2-CG 3.59Å; F451-W503 HydrophobicContact CD2-CG 3.59Å; F451-W503 HydrophobicContact CE2-CB 4.2Å; F451-W503 HydrophobicContact CE2-CG 4.37Å; F451-W503 AromaticContact CG-CD1 3.98Å; F451-W503 HydrophobicContact CG-CG 4.31Å; F451-I504 HydrophobicContact CE2-CG1 4.26Å; F451-Y539 AromaticContact CZ-CE2 3.98Å; F451-Y539 HydrophobicContact CZ-CE2 3.98Å
452	L	92.3	Very high	84.7	Confident	11 Å²	11	50.6 Å²	50.6	6%	0.058	26%	0.257	C	S	.	.	H	α-helix	trans	-63.7	-42.8	176	-65.9	175.6	0	0	0	112.2	Y448 I449 L454 I455 T456 F637 I640	Y448-L452 HydrophobicContact CD1-CD1 4.4Å; Y448-L452 HydrophobicContact CE1-CD1 3.95Å; Y448-L452 WeakPolarHBondContact O-CG 3.45Å; Y448-L452 PolarHBondContact O-N 3.43Å; I449-L452 PolarHBondContact O-N 3.19Å; L452-L454 VanDerWaalsContact C-N 3.31Å; L452-L454 PolarHBondContact O-N 2.93Å; L452-I455 WeakPolarHBondContact O-CB 3.27Å; L452-I455 PolarHBondContact O-N 2.95Å; L452-T456 WeakPolarHBondContact O-CG2 3.48Å; L452-T456 PolarHBondContact O-N 3Å; L452-F637 HydrophobicContact CB-CE1 4.05Å; L452-F637 HydrophobicContact CB-CZ 4.32Å; L452-F637 HydrophobicContact CD1-CD1 4.28Å; L452-F637 HydrophobicContact CD1-CE1 4.32Å; L452-F637 HydrophobicContact CD2-CD1 3.9Å; L452-F637 HydrophobicContact CD2-CD2 4.36Å; L452-F637 HydrophobicContact CD2-CE1 3.88Å; L452-F637 HydrophobicContact CD2-CE2 4.34Å; L452-F637 HydrophobicContact CD2-CG 4.13Å; L452-F637 HydrophobicContact CD2-CZ 4.08Å; L452-F637 HydrophobicContact CG-CE1 4.31Å; L452-I640 HydrophobicContact CD1-CD1 3.34Å; L452-I640 HydrophobicContact CD1-CG1 3.46Å; L452-I640 VanDerWaalsContact CD1-CG1 3.46Å
453	I	90.5	Very high	83.1	Confident	92 Å²	92	55.8 Å²	55.8	47%	0.472	29%	0.285	S	S	.	.	H	α-helix	trans	-59.1	-45.3	174.3	-67.6	168.2	0	0	0	109.9	I449 T450 I455 T456 V457	I449-I453 HydrophobicContact CG2-CD1 3.96Å; I449-I453 HydrophobicContact CG2-CG1 4.47Å; I449-I453 WeakPolarHBondContact O-CG1 3.46Å; I449-I453 PolarHBondContact O-N 2.97Å; T450-I453 PolarHBondContact O-N 3.26Å; I453-I455 VanDerWaalsContact C-N 3.34Å; I453-I455 PolarHBondContact O-N 2.99Å; I453-T456 WeakPolarHBondContact CA-OG1 3.18Å; I453-T456 PolarHBondContact O-N 3.23Å; I453-T456 VanDerWaalsContact O-N 3.15Å; I453-T456 PolarHBondContact O-OG1 3.43Å; I453-V457 HydrophobicContact CG2-CG2 4.28Å; I453-V457 WeakPolarHBondContact O-CG2 3.11Å; I453-V457 PolarHBondContact O-N 2.88Å
454	L	90.1	Very high	81.3	Confident	41 Å²	41	66.7 Å²	66.7	22%	0.215	33%	0.325	C	S	.	.	H	α-helix	trans	-63.4	-37.2	176.8	-74.7	173.7	0	0	0	113.1	T450 F451 L452 V457 A458 I496 I499 L500 W503	T450-L454 WeakPolarHBondContact O-CB 3.44Å; T450-L454 WeakPolarHBondContact O-CG 3.46Å; T450-L454 PolarHBondContact O-N 3.38Å; F451-L454 PolarHBondContact O-N 2.96Å; L452-L454 VanDerWaalsContact C-N 3.31Å; L452-L454 PolarHBondContact O-N 2.93Å; L454-V457 PolarHBondContact O-N 3.42Å; L454-A458 VanDerWaalsContact O-CB 3.24Å; L454-A458 WeakPolarHBondContact O-CB 3.43Å; L454-A458 PolarHBondContact O-N 3.09Å; L454-I496 HydrophobicContact CD2-CG2 4.46Å; L454-I499 HydrophobicContact CD1-CG2 4.02Å; L454-L500 HydrophobicContact CB-CD2 3.73Å; L454-L500 HydrophobicContact CB-CG 4.35Å; L454-W503 HydrophobicContact CD1-CE3 3.54Å; L454-W503 HydrophobicContact CD1-CH2 4.27Å; L454-W503 HydrophobicContact CD1-CZ3 3.32Å
455	I	90.3	Very high	79.5	Confident	1 Å²	1	70.8 Å²	70.8	1%	0.005	35%	0.352	C	S	.	.	H	α-helix	trans	-60.3	-50	171.2	-71.8	170.4	0	0	0	109.6	F451 L452 I453 V457 A458 T459 L500 Y539 N633 F637	F451-I455 HydrophobicContact CD1-CD1 3.92Å; F451-I455 HydrophobicContact CD2-CD1 4.49Å; F451-I455 HydrophobicContact CE1-CD1 3.39Å; F451-I455 HydrophobicContact CE1-CG1 4.47Å; F451-I455 HydrophobicContact CE2-CD1 4.03Å; F451-I455 HydrophobicContact CE2-CG1 4.38Å; F451-I455 HydrophobicContact CG-CD1 4.46Å; F451-I455 HydrophobicContact CZ-CD1 3.46Å; F451-I455 VanDerWaalsContact CZ-CD1 3.46Å; F451-I455 HydrophobicContact CZ-CG1 4.28Å; F451-I455 WeakPolarHBondContact O-CG1 3.46Å; F451-I455 PolarHBondContact O-N 3.37Å; L452-I455 WeakPolarHBondContact O-CB 3.27Å; L452-I455 PolarHBondContact O-N 2.95Å; I453-I455 VanDerWaalsContact C-N 3.34Å; I453-I455 PolarHBondContact O-N 2.99Å; I455-V457 VanDerWaalsContact C-N 3.33Å; I455-V457 PolarHBondContact O-N 2.88Å; I455-A458 CarbonylContact O-C 3.42Å; I455-A458 WeakPolarHBondContact O-CB 2.99Å; I455-A458 PolarHBondContact O-N 3.19Å; I455-A458 VanDerWaalsContact O-N 3.1Å; I455-T459 HydrophobicContact CG2-CG2 4.18Å; I455-T459 WeakPolarHBondContact O-CG2 3.48Å; I455-T459 PolarHBondContact O-N 3.36Å; I455-T459 PolarHBondContact O-OG1 3.22Å; I455-L500 HydrophobicContact CG1-CD2 3.99Å; I455-Y539 WeakPolarHBondContact CD1-OH 3.41Å; I455-N633 HydrophobicContact CG2-CB 4.32Å; I455-F637 HydrophobicContact CG2-CE2 4.13Å
456	T	87.3	Confident	77.5	Confident	40 Å²	40	74.1 Å²	74.1	25%	0.245	38%	0.384	C	S	.	.	H	α-helix	trans	-59.5	-42.7	179.2	61.4	0	0	0	0	112.1	L452 I453 A458 T459 F460 F637	L452-T456 WeakPolarHBondContact O-CG2 3.48Å; L452-T456 PolarHBondContact O-N 3Å; I453-T456 WeakPolarHBondContact CA-OG1 3.18Å; I453-T456 PolarHBondContact O-N 3.23Å; I453-T456 VanDerWaalsContact O-N 3.15Å; I453-T456 PolarHBondContact O-OG1 3.43Å; T456-A458 VanDerWaalsContact C-N 3.31Å; T456-A458 PolarHBondContact O-N 2.83Å; T456-T459 WeakPolarHBondContact CA-OG1 3.27Å; T456-T459 PolarHBondContact O-N 3.32Å; T456-T459 PolarHBondContact O-OG1 2.89Å; T456-F460 HydrophobicContact CG2-CE2 4.47Å; T456-F460 VanDerWaalsContact O-CB 3.26Å; T456-F460 WeakPolarHBondContact O-CB 3.4Å; T456-F460 WeakPolarHBondContact O-CD2 3.18Å; T456-F460 PolarHBondContact O-N 3.36Å; T456-F637 HydrophobicContact CG2-CE1 4.36Å; T456-F637 HydrophobicContact CG2-CZ 3.64Å
457	V	86.5	Confident	75.8	Confident	47 Å²	47	76.7 Å²	76.7	29%	0.285	40%	0.4	S	S	.	.	H	α-helix	trans	-66.4	-36.2	177.3	176.4	0	0	0	0	111	I453 L454 I455 R461 I496	I453-V457 HydrophobicContact CG2-CG2 4.28Å; I453-V457 WeakPolarHBondContact O-CG2 3.11Å; I453-V457 PolarHBondContact O-N 2.88Å; L454-V457 PolarHBondContact O-N 3.42Å; I455-V457 VanDerWaalsContact C-N 3.33Å; I455-V457 PolarHBondContact O-N 2.88Å; V457-R461 PolarHBondContact O-N 2.94Å; V457-I496 HydrophobicContact CG1-CD1 3.93Å
458	A	82.5	Confident	73.8	Confident	13 Å²	13	81 Å²	81	11%	0.107	43%	0.429	C	S	.	.	H	α-helix	trans	-70.2	-33.7	175.9	0	0	0	0	0	113	L454 I455 T456 R461 I496 L500	L454-A458 VanDerWaalsContact O-CB 3.24Å; L454-A458 WeakPolarHBondContact O-CB 3.43Å; L454-A458 PolarHBondContact O-N 3.09Å; I455-A458 CarbonylContact O-C 3.42Å; I455-A458 WeakPolarHBondContact O-CB 2.99Å; I455-A458 PolarHBondContact O-N 3.19Å; I455-A458 VanDerWaalsContact O-N 3.1Å; T456-A458 VanDerWaalsContact C-N 3.31Å; T456-A458 PolarHBondContact O-N 2.83Å; A458-R461 WeakPolarHBondContact O-CG 3.34Å; A458-I496 HydrophobicContact CB-CG2 3.95Å; A458-L500 HydrophobicContact CB-CD1 3.74Å
459	T	80.9	Confident	71.8	Confident	74 Å²	74	88 Å²	88	45%	0.454	47%	0.469	S	S	.	.	H	α-helix	trans	-79.7	-45.6	177.6	54.9	0	0	0	0	111.9	I455 T456 R461	I455-T459 HydrophobicContact CG2-CG2 4.18Å; I455-T459 WeakPolarHBondContact O-CG2 3.48Å; I455-T459 PolarHBondContact O-N 3.36Å; I455-T459 PolarHBondContact O-OG1 3.22Å; T456-T459 WeakPolarHBondContact CA-OG1 3.27Å; T456-T459 PolarHBondContact O-N 3.32Å; T456-T459 PolarHBondContact O-OG1 2.89Å; T459-R461 PolarHBondContact O-N 3.01Å
460	F	74.5	Confident	69.9	Low	156 Å²	156	85.9 Å²	85.9	68%	0.684	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-2.6	180	-74.4	-59.8	0	0	0	113.4	T456 L462	T456-F460 HydrophobicContact CG2-CE2 4.47Å; T456-F460 VanDerWaalsContact O-CB 3.26Å; T456-F460 WeakPolarHBondContact O-CB 3.4Å; T456-F460 WeakPolarHBondContact O-CD2 3.18Å; T456-F460 PolarHBondContact O-N 3.36Å; F460-L462 VanDerWaalsContact C-N 3.28Å; F460-L462 PolarHBondContact O-N 3.38Å
461	R	67.4	Low	68.1	Low	149 Å²	149	92 Å²	92	56%	0.562	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	18.1	74.7	-178.8	-74.3	-172.4	179.1	-174.4	1.3	109.1	V457 A458 T459 D463	V457-R461 PolarHBondContact O-N 2.94Å; A458-R461 WeakPolarHBondContact O-CG 3.34Å; T459-R461 PolarHBondContact O-N 3.01Å; R461-D463 VanDerWaalsContact O-CA 3.27Å; R461-D463 WeakPolarHBondContact O-CA 3.42Å; R461-D463 PolarHBondContact O-N 3.17Å
462	L	53.5	Low	66.3	Low	133 Å²	133	98.3 Å²	98.3	70%	0.696	53%	0.527	S	S	*	.			trans	-47.9	98.3	-175.6	-77.6	165.6	0	0	0	107.2	F460 R464	F460-L462 VanDerWaalsContact C-N 3.28Å; F460-L462 PolarHBondContact O-N 3.38Å; L462-R464 PolarHBondContact O-N 3.43Å
463	D	50.7	Low	64.8	Low	138 Å²	138	101.9 Å²	101.9	74%	0.738	55%	0.546	S	S	*	.			trans	-76.3	81.6	-164.2	-109.3	-18.4	0	0	0	104.3	R461 T465	R461-D463 VanDerWaalsContact O-CA 3.27Å; R461-D463 WeakPolarHBondContact O-CA 3.42Å; R461-D463 PolarHBondContact O-N 3.17Å; D463-T465 PolarHBondContact O-N 3.4Å
464	R	46.9	Very low	63.6	Low	233 Å²	233	102.8 Å²	102.8	88%	0.879	54%	0.544	S	S	*	.			trans	-79.7	62.9	168.5	-77.5	-165.8	175.1	-177.5	-0.3	107.9	L462	L462-R464 PolarHBondContact O-N 3.43Å
465	T	49.4	Very low	62.4	Low	105 Å²	105	106.6 Å²	106.6	64%	0.644	56%	0.561	S	S	*	*			trans	-130.5	71.5	135.1	55	0	0	0	0	105.3	D463 V467	D463-T465 PolarHBondContact O-N 3.4Å; T465-V467 PolarHBondContact O-N 3.34Å
466	A	45.2	Very low	61.3	Low	100 Å²	100	108.9 Å²	108.9	83%	0.826	58%	0.575	S	S	*	*			trans	-61.1	78.5	146.2	0	0	0	0	0	105	S468	A466-S468 VanDerWaalsContact C-N 3.32Å; A466-S468 PolarHBondContact O-N 3.03Å
467	V	51.2	Low	60.6	Low	87 Å²	87	114.2 Å²	114.2	53%	0.527	59%	0.59	S	S	.	*			trans	-62.2	107.6	171.5	179.3	0	0	0	0	102.5	T465 D469	T465-V467 PolarHBondContact O-N 3.34Å; V467-D469 PolarHBondContact O-N 3.3Å; V467-D469 VanDerWaalsContact O-N 3.13Å
468	S	48.1	Very low	60	Low	99 Å²	99	113.5 Å²	113.5	69%	0.692	58%	0.583	S	S	*	*			trans	-44.5	123.4	165.9	-178	0	0	0	0	106.2	A466 G470	A466-S468 VanDerWaalsContact C-N 3.32Å; A466-S468 PolarHBondContact O-N 3.03Å; S468-G470 PolarHBondContact O-N 3.22Å
469	D	49.2	Very low	59.5	Low	180 Å²	180	116.4 Å²	116.4	96%	0.963	60%	0.599	S	S	*	*	S	Bend	trans	-63.1	40.7	172.2	-66.9	-45.8	0	0	0	111.5	V467	V467-D469 PolarHBondContact O-N 3.3Å; V467-D469 VanDerWaalsContact O-N 3.13Å
470	G	49.7	Very low	59.3	Low	37 Å²	37	118.3 Å²	118.3	38%	0.381	60%	0.603	S	S	.	*			trans	-105.8	105.8	-176	0	0	0	0	0	109.6	S468	S468-G470 PolarHBondContact O-N 3.22Å
471	E	52.1	Low	59.6	Low	179 Å²	179	113.8 Å²	113.8	84%	0.836	59%	0.585	S	S	*	*	S	Bend	trans	60.8	136.8	170.6	-69.9	-179.9	151.7	0	0	115.9	N473	E471-N473 PolarHBondContact O-N 2.71Å
472	D	53.1	Low	60.3	Low	149 Å²	149	107 Å²	107	80%	0.797	56%	0.56	S	S	*	*			trans	-58.5	70.4	177	-69.3	-49.9	0	0	0	112.3	W474	D472-W474 VanDerWaalsContact C-N 3.33Å; D472-W474 PolarHBondContact O-N 3.23Å
473	N	61.3	Low	61.5	Low	86 Å²	86	103.4 Å²	103.4	46%	0.46	55%	0.546	S	S	.	.			trans	-70.2	95.9	176.1	-72.1	-30.3	0	0	0	106.6	E471 E475 V476 R477	E471-N473 PolarHBondContact O-N 2.71Å; N473-E475 PolarHBondContact O-N 3.11Å; N473-V476 HydrophobicContact CB-CG2 3.8Å; N473-V476 WeakPolarHBondContact O-CA 3.41Å; N473-V476 VanDerWaalsContact O-CB 3.3Å; N473-V476 WeakPolarHBondContact O-CB 3.35Å; N473-V476 PolarHBondContact O-N 2.8Å; N473-R477 PolarHBondContact O-N 3.48Å
474	W	64.7	Low	63	Low	112 Å²	112	102.5 Å²	102.5	42%	0.424	53%	0.533	S	S	.	.	H	α-helix	trans	-53.8	-22.1	173	64.2	-89.7	0	0	0	111.8	D472 V476 R477 Y478 L572	D472-W474 VanDerWaalsContact C-N 3.33Å; D472-W474 PolarHBondContact O-N 3.23Å; W474-V476 VanDerWaalsContact C-N 3.31Å; W474-V476 PolarHBondContact O-N 3.01Å; W474-R477 PolarHBondContact O-N 3.48Å; W474-Y478 WeakPolarHBondContact O-CB 3.47Å; W474-Y478 PolarHBondContact O-N 3.44Å; W474-L572 HydrophobicContact CE3-CD1 4.3Å; W474-L572 HydrophobicContact CH2-CD1 3.41Å; W474-L572 VanDerWaalsContact CH2-CD1 3.41Å; W474-L572 HydrophobicContact CZ3-CD1 3.17Å
475	E	66.4	Low	64.6	Low	121 Å²	121	91.6 Å²	91.6	57%	0.565	49%	0.492	S	S	*	.	H	α-helix	trans	-57.7	-39.9	168.9	-65.4	-172.7	172.3	0	0	112.4	N473 T479	N473-E475 PolarHBondContact O-N 3.11Å; E475-T479 WeakPolarHBondContact O-CB 3.46Å; E475-T479 WeakPolarHBondContact O-CG2 3.43Å; E475-T479 PolarHBondContact O-N 3.32Å; E475-T479 PolarHBondContact O-OG1 3.45Å
476	V	67.6	Low	66.1	Low	49 Å²	49	86.6 Å²	86.6	30%	0.297	46%	0.462	S	S	.	.	H	α-helix	trans	-66.1	-52.5	175.1	-179	0	0	0	0	109.8	N473 W474 Y478 T479 E480	N473-V476 HydrophobicContact CB-CG2 3.8Å; N473-V476 WeakPolarHBondContact O-CA 3.41Å; N473-V476 VanDerWaalsContact O-CB 3.3Å; N473-V476 WeakPolarHBondContact O-CB 3.35Å; N473-V476 PolarHBondContact O-N 2.8Å; W474-V476 VanDerWaalsContact C-N 3.31Å; W474-V476 PolarHBondContact O-N 3.01Å; V476-Y478 VanDerWaalsContact C-N 3.31Å; V476-Y478 PolarHBondContact O-N 3.11Å; V476-T479 WeakPolarHBondContact CA-OG1 3.43Å; V476-T479 PolarHBondContact O-N 3.33Å; V476-T479 VanDerWaalsContact O-N 3.13Å; V476-T479 PolarHBondContact O-OG1 2.86Å; V476-E480 HydrophobicContact CG1-CG 4.43Å; V476-E480 WeakPolarHBondContact CG1-OE1 3.33Å; V476-E480 WeakPolarHBondContact O-CG 3.44Å; V476-E480 PolarHBondContact O-N 3.47Å
477	R	71.9	Confident	67.6	Low	151 Å²	151	83.3 Å²	83.3	57%	0.57	43%	0.428	S	S	*	.	H	α-helix	trans	-58.3	-41.9	177.8	-171.9	-180	-66.5	170.8	2.2	112.6	N473 W474 E480 I481	N473-R477 PolarHBondContact O-N 3.48Å; W474-R477 PolarHBondContact O-N 3.48Å; R477-E480 PolarHBondContact O-N 2.87Å; R477-I481 HydrophobicContact CG-CD1 4.07Å; R477-I481 VanDerWaalsContact O-CG1 3.31Å; R477-I481 WeakPolarHBondContact O-CG1 3.13Å; R477-I481 PolarHBondContact O-N 2.65Å
478	Y	73.3	Confident	68.2	Low	33 Å²	33	82 Å²	82	13%	0.129	42%	0.42	C	S	.	.	H	α-helix	trans	-61	-47.3	175.9	164.4	-89.1	0	0	0	111.5	W474 V476 L482 Q568 L571 L572	W474-Y478 WeakPolarHBondContact O-CB 3.47Å; W474-Y478 PolarHBondContact O-N 3.44Å; V476-Y478 VanDerWaalsContact C-N 3.31Å; V476-Y478 PolarHBondContact O-N 3.11Å; Y478-L482 HydrophobicContact CE1-CD2 4.36Å; Y478-L482 WeakPolarHBondContact O-CB 3.24Å; Y478-L482 PolarHBondContact O-N 3.31Å; Y478-Q568 WeakPolarHBondContact CE2-O 3.28Å; Y478-Q568 WeakPolarHBondContact OH-CA 3.31Å; Y478-Q568 WeakPolarHBondContact OH-CB 3.15Å; Y478-Q568 VanDerWaalsContact OH-CG 3.28Å; Y478-Q568 WeakPolarHBondContact OH-CG 3.21Å; Y478-Q568 PolarHBondContact OH-O 3.14Å; Y478-L571 HydrophobicContact CD2-CB 4.15Å; Y478-L571 HydrophobicContact CD2-CD2 3.48Å; Y478-L571 VanDerWaalsContact CD2-CD2 3.48Å; Y478-L571 HydrophobicContact CD2-CG 3.65Å; Y478-L571 HydrophobicContact CE2-CB 3.82Å; Y478-L571 HydrophobicContact CE2-CD2 3.58Å; Y478-L571 HydrophobicContact CE2-CG 3.81Å; Y478-L571 HydrophobicContact CG-CD2 4.26Å; Y478-L572 HydrophobicContact CD2-CB 4.47Å; Y478-L572 HydrophobicContact CE2-CB 3.98Å
479	T	72.4	Confident	68.9	Low	74 Å²	74	80.3 Å²	80.3	45%	0.454	41%	0.408	S	S	.	.	H	α-helix	trans	-67.2	-35.9	179.6	47.9	0	0	0	0	112.2	E475 V476 S483	E475-T479 WeakPolarHBondContact O-CB 3.46Å; E475-T479 WeakPolarHBondContact O-CG2 3.43Å; E475-T479 PolarHBondContact O-N 3.32Å; E475-T479 PolarHBondContact O-OG1 3.45Å; V476-T479 WeakPolarHBondContact CA-OG1 3.43Å; V476-T479 PolarHBondContact O-N 3.33Å; V476-T479 VanDerWaalsContact O-N 3.13Å; V476-T479 PolarHBondContact O-OG1 2.86Å; T479-S483 WeakPolarHBondContact O-CB 3.42Å; T479-S483 PolarHBondContact O-N 2.66Å; T479-S483 PolarHBondContact O-OG 3.12Å
480	E	76.7	Confident	69.4	Low	113 Å²	113	77.8 Å²	77.8	53%	0.528	39%	0.39	S	S	.	.	H	α-helix	trans	-61.2	-55.2	173.4	-74.5	172.1	173.8	0	0	111.9	V476 R477 L482 S483 Y484	V476-E480 HydrophobicContact CG1-CG 4.43Å; V476-E480 WeakPolarHBondContact CG1-OE1 3.33Å; V476-E480 WeakPolarHBondContact O-CG 3.44Å; V476-E480 PolarHBondContact O-N 3.47Å; R477-E480 PolarHBondContact O-N 2.87Å; E480-L482 VanDerWaalsContact C-N 3.3Å; E480-L482 PolarHBondContact O-N 3.2Å; E480-S483 PolarHBondContact O-N 3.34Å; E480-S483 PolarHBondContact O-OG 3.3Å; E480-Y484 WeakPolarHBondContact O-CB 3.45Å; E480-Y484 PolarHBondContact O-N 3.4Å
481	I	81.4	Confident	70.2	Confident	61 Å²	61	80.3 Å²	80.3	31%	0.313	40%	0.398	S	S	.	.	H	α-helix	trans	-57.3	-46.1	178.9	-66.3	164.9	0	0	0	110.4	R477 S483 Y484 D485 L571 Y593	R477-I481 HydrophobicContact CG-CD1 4.07Å; R477-I481 VanDerWaalsContact O-CG1 3.31Å; R477-I481 WeakPolarHBondContact O-CG1 3.13Å; R477-I481 PolarHBondContact O-N 2.65Å; I481-S483 PolarHBondContact O-N 3.48Å; I481-Y484 PolarHBondContact O-N 3.47Å; I481-D485 PolarHBondContact O-N 3.22Å; I481-L571 HydrophobicContact CB-CD2 4.31Å; I481-L571 HydrophobicContact CG2-CD1 3.87Å; I481-L571 HydrophobicContact CG2-CD2 4.12Å; I481-Y593 HydrophobicContact CG2-CE1 4.22Å
482	L	81.7	Confident	71.2	Confident	7 Å²	7	72.9 Å²	72.9	4%	0.037	37%	0.365	C	S	.	.	H	α-helix	trans	-64.4	-41.3	-180	-171.1	75.4	0	0	0	112.1	Y478 E480 Y484 D485 F486 T488 Q568 L571	Y478-L482 HydrophobicContact CE1-CD2 4.36Å; Y478-L482 WeakPolarHBondContact O-CB 3.24Å; Y478-L482 PolarHBondContact O-N 3.31Å; E480-L482 VanDerWaalsContact C-N 3.3Å; E480-L482 PolarHBondContact O-N 3.2Å; L482-Y484 VanDerWaalsContact C-N 3.32Å; L482-D485 PolarHBondContact O-N 3.37Å; L482-F486 HydrophobicContact CD1-CD2 3.85Å; L482-F486 WeakPolarHBondContact O-CA 3.35Å; L482-F486 PolarHBondContact O-N 2.91Å; L482-T488 HydrophobicContact CB-CG2 4.29Å; L482-T488 HydrophobicContact CD2-CG2 3.71Å; L482-T488 HydrophobicContact CG-CG2 3.72Å; L482-Q568 HydrophobicContact CD1-CG 3.94Å; L482-Q568 HydrophobicContact CD2-CG 3.71Å; L482-L571 HydrophobicContact CB-CD2 4.03Å; L482-L571 HydrophobicContact CD1-CD2 4.31Å
483	S	79	Confident	72.4	Confident	57 Å²	57	67 Å²	67	40%	0.399	33%	0.333	S	S	.	.	H	α-helix	trans	-69.8	-28.5	178.6	72.7	0	0	0	0	113.5	T479 E480 I481 F486	T479-S483 WeakPolarHBondContact O-CB 3.42Å; T479-S483 PolarHBondContact O-N 2.66Å; T479-S483 PolarHBondContact O-OG 3.12Å; E480-S483 PolarHBondContact O-N 3.34Å; E480-S483 PolarHBondContact O-OG 3.3Å; I481-S483 PolarHBondContact O-N 3.48Å; S483-F486 CarbonylContact C-O 3.5Å; S483-F486 WeakPolarHBondContact CA-O 3.39Å
484	Y	81.8	Confident	73.3	Confident	119 Å²	119	65.3 Å²	65.3	47%	0.467	33%	0.326	S	S	.	.	H	α-helix	trans	-70.7	-44.2	172.8	-176.8	-95.5	0	0	0	110.9	E480 I481 L482 G611 C612 W615	E480-Y484 WeakPolarHBondContact O-CB 3.45Å; E480-Y484 PolarHBondContact O-N 3.4Å; I481-Y484 PolarHBondContact O-N 3.47Å; L482-Y484 VanDerWaalsContact C-N 3.32Å; Y484-G611 CarbonylContact O-C 3.59Å; Y484-C612 HydrophobicContact CD2-CB 4.27Å; Y484-C612 HydrophobicContact CE1-CB 4.23Å; Y484-C612 HydrophobicContact CE2-CB 3.98Å; Y484-C612 VanDerWaalsContact CE2-SG 3.51Å; Y484-C612 VanDerWaalsContact CZ-SG 3.58Å; Y484-C612 WeakPolarHBondContact O-CA 3.24Å; Y484-C612 VanDerWaalsContact O-CB 3.32Å; Y484-C612 WeakPolarHBondContact O-CB 3.44Å; Y484-C612 PolarHBondContact O-N 3.26Å; Y484-W615 HydrophobicContact CE1-CH2 4.17Å; Y484-W615 HydrophobicContact CE1-CZ2 4.11Å
485	D	81.4	Confident	74.3	Confident	4 Å²	4	68.6 Å²	68.6	2%	0.021	34%	0.343	C	S	.	.	H	α-helix	trans	-80	-43.8	-175.9	-76.3	-12.2	0	0	0	113.1	I481 L482 Y593 R597 G611 W615	I481-D485 PolarHBondContact O-N 3.22Å; L482-D485 PolarHBondContact O-N 3.37Å; D485-Y593 WeakPolarHBondContact OD2-CE1 3.23Å; D485-Y593 PolarHBondContact OD2-OH 3.39Å; D485-Y593 VanDerWaalsContact OD2-OH 3.08Å; D485-R597 IonicContact OD1-CZ 3.65Å; D485-R597 IonicContact OD1-NE 3.78Å; D485-R597 IonicContact OD1-NH1 3.72Å; D485-R597 PolarHBondContact OD1-NH1 3.08Å; D485-R597 WeakPolarHBondContact OD2-CD 3.43Å; D485-R597 IonicContact OD2-CZ 2.8Å; D485-R597 IonicContact OD2-NE 2.73Å; D485-R597 IonicContact OD2-NH1 3.89Å; D485-R597 PolarHBondContact OD2-NH1 3.32Å; D485-G611 PolarHBondContact O-N 3.15Å; D485-W615 WeakPolarHBondContact OD1-CH2 3.36Å
486	F	80.3	Confident	75.2	Confident	1 Å²	1	65.5 Å²	65.5	0%	0.004	33%	0.33	C	S	.	.	B	Isolated β-bridge	trans	-124.6	145.2	-176.4	-60.5	-77.3	0	0	0	111.1	L482 S483 T488 L564 A567 R597 I600 L601 L609	L482-F486 HydrophobicContact CD1-CD2 3.85Å; L482-F486 WeakPolarHBondContact O-CA 3.35Å; L482-F486 PolarHBondContact O-N 2.91Å; S483-F486 CarbonylContact C-O 3.5Å; S483-F486 WeakPolarHBondContact CA-O 3.39Å; F486-T488 PolarHBondContact O-N 2.98Å; F486-L564 HydrophobicContact CB-CD1 3.79Å; F486-L564 HydrophobicContact CD1-CD1 3.99Å; F486-L564 HydrophobicContact CD2-CD1 3.87Å; F486-L564 HydrophobicContact CE1-CD1 4.45Å; F486-L564 HydrophobicContact CE2-CD1 4.4Å; F486-L564 HydrophobicContact CG-CD1 3.62Å; F486-A567 HydrophobicContact CE2-CB 3.98Å; F486-A567 HydrophobicContact CZ-CB 4.16Å; F486-R597 HydrophobicContact CE2-CG 4.28Å; F486-R597 HydrophobicContact CZ-CG 4.09Å; F486-I600 HydrophobicContact CE1-CG2 4.06Å; F486-I600 HydrophobicContact CZ-CD1 4.36Å; F486-L601 HydrophobicContact CD1-CD1 3.79Å; F486-L601 HydrophobicContact CE1-CD1 3.15Å; F486-L601 HydrophobicContact CZ-CD1 3.71Å; F486-L609 WeakPolarHBondContact CA-O 3.19Å; F486-L609 HydrophobicContact CD1-CD2 3.56Å; F486-L609 HydrophobicContact CD1-CG 3.76Å; F486-L609 HydrophobicContact CE1-CD2 3.68Å; F486-L609 HydrophobicContact CE1-CG 4.38Å
487	R	77.4	Confident	76.1	Confident	30 Å²	30	63.8 Å²	63.8	11%	0.113	32%	0.319	C	S	.	.			trans	-68.2	98.5	172.8	-170.9	175	-73.7	-148.2	0.1	109.9	M557 L609 E622	R487-M557 WeakPolarHBondContact O-CE 3.39Å; R487-L609 PolarHBondContact N-O 3.47Å; R487-E622 IonicContact CZ-OE2 2.74Å; R487-E622 IonicContact NH1-OE2 3.93Å; R487-E622 PolarHBondContact NH1-OE2 2.91Å; R487-E622 VanDerWaalsContact NH1-OE2 3.08Å; R487-E622 IonicContact NH2-OE1 2.87Å; R487-E622 IonicContact NH2-OE2 3.75Å; R487-E622 PolarHBondContact NH2-OE2 3.33Å
488	T	62.1	Low	76.8	Confident	61 Å²	61	60.6 Å²	60.6	37%	0.374	31%	0.312	S	S	.	.			trans	-81.3	-29.5	-177.6	52.1	0	0	0	0	113.5	L482 F486 H490	L482-T488 HydrophobicContact CB-CG2 4.29Å; L482-T488 HydrophobicContact CD2-CG2 3.71Å; L482-T488 HydrophobicContact CG-CG2 3.72Å; F486-T488 PolarHBondContact O-N 2.98Å; T488-H490 PolarHBondContact O-N 3.24Å
489	S	62.6	Low	77.6	Confident	63 Å²	63	63 Å²	63	44%	0.441	33%	0.327	S	S	.	.			trans	-77	119.8	179	-176.7	0	0	0	0	111	V491	S489-V491 PolarHBondContact O-N 3.22Å; S489-V491 PolarHBondContact OG-N 3.12Å; S489-V491 VanDerWaalsContact OG-N 3.16Å; S489-V491 PolarHBondContact OG-O 3.21Å; S489-V491 VanDerWaalsContact OG-O 3.06Å
490	H	61.5	Low	78.5	Confident	127 Å²	127	59.6 Å²	59.6	59%	0.588	31%	0.305	S	S	*	.	S	Bend	trans	-65.5	-13.6	168.7	-70.6	-67.7	0	0	0	113.3	T488	T488-H490 PolarHBondContact O-N 3.24Å
491	V	66.7	Low	79.1	Confident	89 Å²	89	56.8 Å²	56.8	54%	0.539	29%	0.293	S	S	.	.			trans	-112.4	102	-171.7	-177.2	0	0	0	0	108.7	S489 M493	S489-V491 PolarHBondContact O-N 3.22Å; S489-V491 PolarHBondContact OG-N 3.12Å; S489-V491 VanDerWaalsContact OG-N 3.16Å; S489-V491 PolarHBondContact OG-O 3.21Å; S489-V491 VanDerWaalsContact OG-O 3.06Å; V491-M493 WeakPolarHBondContact CG1-O 3.09Å
492	V	71.5	Confident	79.6	Confident	24 Å²	24	59.5 Å²	59.5	15%	0.145	30%	0.303	C	S	.	.	S	Bend	trans	-74.4	-42.3	171.1	-173.5	0	0	0	0	109.4	D550 V553	V492-D550 HydrophobicContact CB-CB 4.11Å; V492-D550 WeakPolarHBondContact CB-OD1 3.08Å; V492-D550 HydrophobicContact CG2-CB 4.25Å; V492-D550 WeakPolarHBondContact CG2-OD1 3.18Å; V492-D550 PolarHBondContact N-OD1 2.81Å; V492-V553 HydrophobicContact CG2-CB 4.31Å; V492-V553 HydrophobicContact CG2-CG1 4.19Å; V492-V553 HydrophobicContact CG2-CG2 4.4Å
493	M	78.4	Confident	80.1	Confident	24 Å²	24	60.4 Å²	60.4	12%	0.118	31%	0.306	C	S	.	.	S	Bend	trans	-93.7	113.8	-178.6	-69.9	-63.1	96.8	0	0	113.2	V491 Y543 R546	V491-M493 WeakPolarHBondContact CG1-O 3.09Å; M493-Y543 HydrophobicContact SD-CD1 4.43Å; M493-Y543 HydrophobicContact SD-CE1 4.43Å; M493-R546 HydrophobicContact CE-CB 3.5Å; M493-R546 HydrophobicContact CE-CG 3.55Å; M493-R546 HydrophobicContact SD-CB 3.72Å; M493-R546 HydrophobicContact SD-CG 4.22Å
494	T	81.4	Confident	80.8	Confident	52 Å²	52	58 Å²	58	32%	0.319	29%	0.289	S	S	.	.			trans	-68.3	157	178.7	64.5	0	0	0	0	112.3	I496 Q497 I498	T494-I496 PolarHBondContact O-N 2.95Å; T494-Q497 WeakPolarHBondContact O-CB 3.27Å; T494-Q497 PolarHBondContact O-N 3.06Å; T494-Q497 WeakPolarHBondContact OG1-CB 3.46Å; T494-Q497 VanDerWaalsContact OG1-CG 3.25Å; T494-Q497 WeakPolarHBondContact OG1-CG 3.3Å; T494-Q497 PolarHBondContact OG1-N 3.4Å; T494-Q497 PolarHBondContact OG1-OE1 2.67Å; T494-I498 PolarHBondContact O-N 2.82Å; T494-I498 VanDerWaalsContact O-N 3.07Å
495	K	84.4	Confident	81.2	Confident	181 Å²	181	55.9 Å²	55.9	79%	0.787	29%	0.285	S	S	*	.	H	α-helix	trans	-55.3	-37.7	175.4	-65.4	-179.5	-179.2	176.3	0	112.4	I498 I499	K495-I498 PolarHBondContact O-N 2.68Å; K495-I499 WeakPolarHBondContact O-CG1 3.32Å; K495-I499 PolarHBondContact O-N 3.31Å
496	I	86.8	Confident	81.7	Confident	56 Å²	56	55.7 Å²	55.7	29%	0.287	28%	0.284	S	S	.	.	H	α-helix	trans	-67.6	-41.6	178.2	-55.2	177.6	0	0	0	110.7	L454 V457 A458 T494 I498 I499 L500	L454-I496 HydrophobicContact CD2-CG2 4.46Å; V457-I496 HydrophobicContact CG1-CD1 3.93Å; A458-I496 HydrophobicContact CB-CG2 3.95Å; T494-I496 PolarHBondContact O-N 2.95Å; I496-I498 VanDerWaalsContact C-N 3.29Å; I496-I498 PolarHBondContact O-N 3.31Å; I496-I499 WeakPolarHBondContact O-CB 3.31Å; I496-I499 PolarHBondContact O-N 3.47Å; I496-I499 VanDerWaalsContact O-N 3.14Å; I496-L500 PolarHBondContact O-N 2.88Å
497	Q	85.6	Confident	82.2	Confident	13 Å²	13	57.8 Å²	57.8	6%	0.061	29%	0.294	C	S	.	.	H	α-helix	trans	-64.1	-33	176	-76.9	169	-17.7	0	0	112.9	T494 L500 L501 Y543	T494-Q497 WeakPolarHBondContact O-CB 3.27Å; T494-Q497 PolarHBondContact O-N 3.06Å; T494-Q497 WeakPolarHBondContact OG1-CB 3.46Å; T494-Q497 VanDerWaalsContact OG1-CG 3.25Å; T494-Q497 WeakPolarHBondContact OG1-CG 3.3Å; T494-Q497 PolarHBondContact OG1-N 3.4Å; T494-Q497 PolarHBondContact OG1-OE1 2.67Å; Q497-L500 PolarHBondContact O-N 3.27Å; Q497-L501 PolarHBondContact O-N 2.88Å; Q497-Y543 HydrophobicContact CB-CE1 4.22Å; Q497-Y543 WeakPolarHBondContact O-CE1 3.36Å; Q497-Y543 PolarHBondContact O-OH 3.16Å
498	I	86.4	Confident	82.8	Confident	83 Å²	83	58.8 Å²	58.8	43%	0.426	30%	0.301	S	S	.	.	H	α-helix	trans	-65.4	-41.8	172.9	-63.4	169.1	0	0	0	110.4	T494 K495 I496 L501 F502	T494-I498 PolarHBondContact O-N 2.82Å; T494-I498 VanDerWaalsContact O-N 3.07Å; K495-I498 PolarHBondContact O-N 2.68Å; I496-I498 VanDerWaalsContact C-N 3.29Å; I496-I498 PolarHBondContact O-N 3.31Å; I498-L501 WeakPolarHBondContact O-CB 3.4Å; I498-L501 PolarHBondContact O-N 3.4Å; I498-F502 HydrophobicContact CG2-CD2 4.33Å; I498-F502 HydrophobicContact CG2-CE2 4.04Å; I498-F502 VanDerWaalsContact O-CD2 3.3Å; I498-F502 WeakPolarHBondContact O-CD2 3.48Å; I498-F502 PolarHBondContact O-N 3.28Å
499	I	90	Very high	84.1	Confident	85 Å²	85	58.5 Å²	58.5	44%	0.436	30%	0.301	S	S	.	.	H	α-helix	trans	-62.4	-44	174.6	-64.3	166.8	0	0	0	110.6	L454 K495 I496 L501 F502 W503	L454-I499 HydrophobicContact CD1-CG2 4.02Å; K495-I499 WeakPolarHBondContact O-CG1 3.32Å; K495-I499 PolarHBondContact O-N 3.31Å; I496-I499 WeakPolarHBondContact O-CB 3.31Å; I496-I499 PolarHBondContact O-N 3.47Å; I496-I499 VanDerWaalsContact O-N 3.14Å; I499-L501 VanDerWaalsContact C-N 3.3Å; I499-L501 PolarHBondContact O-N 3.3Å; I499-F502 WeakPolarHBondContact O-CB 3.34Å; I499-F502 PolarHBondContact O-N 2.97Å; I499-W503 PolarHBondContact O-N 3.39Å
500	L	90.6	Very high	85.3	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-60.2	-38.2	175.1	-77.2	170.1	0	0	0	112.3	F451 L454 I455 A458 I496 Q497 F502 W503 I504 Y543	F451-L500 HydrophobicContact CD2-CD2 3.89Å; F451-L500 HydrophobicContact CE2-CD2 3.88Å; L454-L500 HydrophobicContact CB-CD2 3.73Å; L454-L500 HydrophobicContact CB-CG 4.35Å; I455-L500 HydrophobicContact CG1-CD2 3.99Å; A458-L500 HydrophobicContact CB-CD1 3.74Å; I496-L500 PolarHBondContact O-N 2.88Å; Q497-L500 PolarHBondContact O-N 3.27Å; L500-F502 VanDerWaalsContact C-N 3.33Å; L500-F502 PolarHBondContact O-N 3.43Å; L500-W503 WeakPolarHBondContact O-CA 3.5Å; L500-W503 WeakPolarHBondContact O-CB 3.25Å; L500-W503 PolarHBondContact O-N 3.09Å; L500-I504 WeakPolarHBondContact O-CD1 3.49Å; L500-I504 WeakPolarHBondContact O-CG1 3.4Å; L500-I504 PolarHBondContact O-N 3.38Å; L500-Y543 VanDerWaalsContact CB-OH 3.28Å; L500-Y543 WeakPolarHBondContact CB-OH 3.44Å
501	L	90.5	Very high	86.6	Confident	54 Å²	54	51.5 Å²	51.5	28%	0.283	26%	0.262	S	S	.	.	H	α-helix	trans	-60.7	-41.4	176.2	179.4	63	0	0	0	111.9	Q497 I498 I499 W503 I504 L505 Y543	Q497-L501 PolarHBondContact O-N 2.88Å; I498-L501 WeakPolarHBondContact O-CB 3.4Å; I498-L501 PolarHBondContact O-N 3.4Å; I499-L501 VanDerWaalsContact C-N 3.3Å; I499-L501 PolarHBondContact O-N 3.3Å; L501-W503 VanDerWaalsContact C-N 3.27Å; L501-W503 PolarHBondContact O-N 3.01Å; L501-I504 PolarHBondContact O-N 2.96Å; L501-L505 WeakPolarHBondContact O-CB 3.08Å; L501-L505 PolarHBondContact O-N 2.8Å; L501-Y543 HydrophobicContact CB-CD1 4.3Å; L501-Y543 HydrophobicContact CB-CE1 4.11Å; L501-Y543 HydrophobicContact CD1-CD1 4.04Å; L501-Y543 HydrophobicContact CD1-CD2 4.47Å; L501-Y543 HydrophobicContact CD1-CG 3.94Å
502	F	90.7	Very high	87.6	Confident	118 Å²	118	50.7 Å²	50.7	52%	0.518	26%	0.259	S	S	.	.	H	α-helix	trans	-62.3	-35.7	172.6	-79.6	-72.5	0	0	0	112.2	I498 I499 L500 G506 L826	I498-F502 HydrophobicContact CG2-CD2 4.33Å; I498-F502 HydrophobicContact CG2-CE2 4.04Å; I498-F502 VanDerWaalsContact O-CD2 3.3Å; I498-F502 WeakPolarHBondContact O-CD2 3.48Å; I498-F502 PolarHBondContact O-N 3.28Å; I499-F502 WeakPolarHBondContact O-CB 3.34Å; I499-F502 PolarHBondContact O-N 2.97Å; L500-F502 VanDerWaalsContact C-N 3.33Å; L500-F502 PolarHBondContact O-N 3.43Å; F502-G506 PolarHBondContact O-N 3.43Å; F502-L826 HydrophobicContact CD1-CD1 4.23Å; F502-L826 WeakPolarHBondContact O-CD1 3.24Å
503	W	92.6	Very high	88.2	Confident	27 Å²	27	53.6 Å²	53.6	10%	0.102	27%	0.27	C	S	.	.	H	α-helix	trans	-63.9	-48.7	174.5	-136.9	-66.8	0	0	0	112.1	S447 T450 F451 L454 I499 L500 L501 L505 G506 Q507 V822 P823	S447-W503 WeakPolarHBondContact O-CZ2 3.36Å; S447-W503 PolarHBondContact OG-NE1 3.49Å; T450-W503 WeakPolarHBondContact OG1-CH2 3.41Å; T450-W503 WeakPolarHBondContact OG1-CZ2 3.39Å; F451-W503 HydrophobicContact CB-CD2 4.18Å; F451-W503 HydrophobicContact CB-CG 4.27Å; F451-W503 HydrophobicContact CB-CZ2 4.37Å; F451-W503 HydrophobicContact CD2-CB 3.86Å; F451-W503 AromaticContact CD2-CD1 3.61Å; F451-W503 HydrophobicContact CD2-CD2 4.18Å; F451-W503 AromaticContact CD2-CG 3.59Å; F451-W503 HydrophobicContact CD2-CG 3.59Å; F451-W503 HydrophobicContact CE2-CB 4.2Å; F451-W503 HydrophobicContact CE2-CG 4.37Å; F451-W503 AromaticContact CG-CD1 3.98Å; F451-W503 HydrophobicContact CG-CG 4.31Å; L454-W503 HydrophobicContact CD1-CE3 3.54Å; L454-W503 HydrophobicContact CD1-CH2 4.27Å; L454-W503 HydrophobicContact CD1-CZ3 3.32Å; I499-W503 PolarHBondContact O-N 3.39Å; L500-W503 WeakPolarHBondContact O-CA 3.5Å; L500-W503 WeakPolarHBondContact O-CB 3.25Å; L500-W503 PolarHBondContact O-N 3.09Å; L501-W503 VanDerWaalsContact C-N 3.27Å; L501-W503 PolarHBondContact O-N 3.01Å; W503-L505 VanDerWaalsContact C-N 3.32Å; W503-L505 PolarHBondContact O-N 3.39Å; W503-G506 PolarHBondContact O-N 3.29Å; W503-Q507 PolarHBondContact O-N 3.18Å; W503-V822 HydrophobicContact CG-CG1 3.98Å; W503-V822 WeakPolarHBondContact O-CG1 3.47Å; W503-P823 HydrophobicContact CD2-CG 4.43Å; W503-P823 HydrophobicContact CE3-CG 4.27Å; W503-P823 HydrophobicContact CZ3-CG 4.41Å
504	I	93.4	Very high	88.5	Confident	5 Å²	5	54.1 Å²	54.1	3%	0.026	27%	0.272	C	S	.	.	H	α-helix	trans	-62.8	-41.5	179.7	-66.9	154.3	0	0	0	110.5	F451 L500 L501 Q507 L508 Y539 L540 Y543	F451-I504 HydrophobicContact CE2-CG1 4.26Å; L500-I504 WeakPolarHBondContact O-CD1 3.49Å; L500-I504 WeakPolarHBondContact O-CG1 3.4Å; L500-I504 PolarHBondContact O-N 3.38Å; L501-I504 PolarHBondContact O-N 2.96Å; I504-Q507 PolarHBondContact O-N 3.08Å; I504-L508 WeakPolarHBondContact O-CB 3.49Å; I504-L508 PolarHBondContact O-N 2.82Å; I504-Y539 HydrophobicContact CD1-CD1 4.13Å; I504-Y539 HydrophobicContact CD1-CD2 4.39Å; I504-Y539 HydrophobicContact CD1-CG 3.88Å; I504-Y539 HydrophobicContact CG1-CD2 4.26Å; I504-Y539 HydrophobicContact CG1-CG 4.21Å; I504-L540 HydrophobicContact CG2-CD2 4.14Å; I504-L540 HydrophobicContact CG2-CG 4.37Å; I504-Y543 HydrophobicContact CD1-CD2 3.72Å; I504-Y543 HydrophobicContact CD1-CE2 3.23Å
505	L	91.4	Very high	88.7	Confident	75 Å²	75	53.5 Å²	53.5	39%	0.393	27%	0.268	S	S	.	.	H	α-helix	trans	-65	-40.3	175.9	-173.7	63	0	0	0	111.7	L501 W503 L508 C509 L826	L501-L505 WeakPolarHBondContact O-CB 3.08Å; L501-L505 PolarHBondContact O-N 2.8Å; W503-L505 VanDerWaalsContact C-N 3.32Å; W503-L505 PolarHBondContact O-N 3.39Å; L505-L508 HydrophobicContact CD1-CD2 4.22Å; L505-L508 WeakPolarHBondContact O-CB 3.5Å; L505-L508 PolarHBondContact O-N 3.49Å; L505-C509 PolarHBondContact O-N 3.21Å; L505-C509 PolarHBondContact O-SG 2.75Å; L505-C509 VanDerWaalsContact O-SG 3.4Å; L505-L826 HydrophobicContact CB-CD1 4.41Å; L505-L826 HydrophobicContact CD2-CD1 4.39Å; L505-L826 HydrophobicContact CG-CD1 4.42Å; L505-L826 HydrophobicContact CG-CD2 4.21Å
506	G	90.3	Very high	88.8	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-65.3	-37.7	174.9	0	0	0	0	0	113	F502 W503 C509 M510	F502-G506 PolarHBondContact O-N 3.43Å; W503-G506 PolarHBondContact O-N 3.29Å; G506-C509 PolarHBondContact O-N 2.96Å; G506-M510 PolarHBondContact O-N 3.33Å
507	Q	91	Very high	88.4	Confident	46 Å²	46	57 Å²	57	22%	0.215	28%	0.279	C	S	.	.	H	α-helix	trans	-63.7	-45.7	172.2	-167.5	71.4	19.6	0	0	110.8	W503 I504 C509 M510 E511 I536	W503-Q507 PolarHBondContact O-N 3.18Å; I504-Q507 PolarHBondContact O-N 3.08Å; Q507-C509 VanDerWaalsContact C-N 3.33Å; Q507-C509 PolarHBondContact O-N 3.45Å; Q507-M510 WeakPolarHBondContact O-CB 3.48Å; Q507-M510 PolarHBondContact O-N 3.32Å; Q507-M510 VanDerWaalsContact O-N 3.08Å; Q507-E511 PolarHBondContact NE2-OE1 3.4Å; Q507-E511 WeakPolarHBondContact O-CG 3.29Å; Q507-E511 PolarHBondContact O-N 3.29Å; Q507-I536 HydrophobicContact CB-CD1 4.44Å; Q507-I536 HydrophobicContact CG-CD1 3.75Å; Q507-I536 HydrophobicContact CG-CG1 4.14Å
508	L	91.5	Very high	88	Confident	51 Å²	51	60.5 Å²	60.5	27%	0.267	29%	0.292	S	S	.	.	H	α-helix	trans	-56.9	-45.4	175.4	177.7	69.1	0	0	0	111.6	I504 L505 M510 E511 C512 I536 L540	I504-L508 WeakPolarHBondContact O-CB 3.49Å; I504-L508 PolarHBondContact O-N 2.82Å; L505-L508 HydrophobicContact CD1-CD2 4.22Å; L505-L508 WeakPolarHBondContact O-CB 3.5Å; L505-L508 PolarHBondContact O-N 3.49Å; L508-M510 VanDerWaalsContact C-N 3.3Å; L508-M510 PolarHBondContact O-N 2.92Å; L508-E511 PolarHBondContact O-N 2.64Å; L508-C512 VanDerWaalsContact O-CB 3.3Å; L508-C512 WeakPolarHBondContact O-CB 3.23Å; L508-C512 PolarHBondContact O-N 3.18Å; L508-C512 PolarHBondContact O-SG 3.28Å; L508-I536 HydrophobicContact CB-CG2 4.21Å; L508-I536 HydrophobicContact CD1-CG2 3.9Å; L508-L540 HydrophobicContact CD1-CD1 4.27Å; L508-L540 HydrophobicContact CD2-CD1 4.04Å
509	C	88.9	Confident	87.8	Confident	54 Å²	54	58 Å²	58	37%	0.365	29%	0.287	S	S	.	.	H	α-helix	trans	-61.9	-37.9	176.5	-72.3	0	0	0	0	112.4	L505 G506 Q507 K513 L826	L505-C509 PolarHBondContact O-N 3.21Å; L505-C509 PolarHBondContact O-SG 2.75Å; L505-C509 VanDerWaalsContact O-SG 3.4Å; G506-C509 PolarHBondContact O-N 2.96Å; Q507-C509 VanDerWaalsContact C-N 3.33Å; Q507-C509 PolarHBondContact O-N 3.45Å; C509-K513 WeakPolarHBondContact O-CB 3.47Å; C509-K513 PolarHBondContact O-N 2.82Å; C509-L826 HydrophobicContact CB-CD2 4.22Å; C509-L826 VanDerWaalsContact SG-CD2 3.6Å
510	M	87.6	Confident	87.5	Confident	30 Å²	30	59 Å²	59	15%	0.148	29%	0.292	C	S	.	.	H	α-helix	trans	-65.3	-47.3	176.7	-175.9	163	173.3	0	0	111.7	H444 G506 Q507 L508 K513 Q514 V822	H444-M510 WeakPolarHBondContact CE1-CE 3.22Å; H444-M510 PolarHBondContact CE1-SD 3.38Å; G506-M510 PolarHBondContact O-N 3.33Å; Q507-M510 WeakPolarHBondContact O-CB 3.48Å; Q507-M510 PolarHBondContact O-N 3.32Å; Q507-M510 VanDerWaalsContact O-N 3.08Å; L508-M510 VanDerWaalsContact C-N 3.3Å; L508-M510 PolarHBondContact O-N 2.92Å; M510-K513 WeakPolarHBondContact O-CB 3.32Å; M510-K513 PolarHBondContact O-N 3.36Å; M510-Q514 PolarHBondContact O-N 2.92Å; M510-V822 HydrophobicContact CB-CG2 4.45Å; M510-V822 HydrophobicContact SD-CG2 4.15Å
511	E	87.9	Confident	87.2	Confident	13 Å²	13	70 Å²	70	6%	0.061	33%	0.334	C	S	.	.	H	α-helix	trans	-65.4	-41.4	177.2	-62.8	-50.3	142.7	0	0	112.1	Q507 L508 K513 Q514 V515 F523 I536	Q507-E511 PolarHBondContact NE2-OE1 3.4Å; Q507-E511 WeakPolarHBondContact O-CG 3.29Å; Q507-E511 PolarHBondContact O-N 3.29Å; L508-E511 PolarHBondContact O-N 2.64Å; E511-K513 VanDerWaalsContact C-N 3.27Å; E511-K513 PolarHBondContact O-N 3.31Å; E511-Q514 WeakPolarHBondContact O-CB 3.36Å; E511-Q514 PolarHBondContact O-N 2.74Å; E511-Q514 VanDerWaalsContact O-N 3.09Å; E511-V515 WeakPolarHBondContact O-CG2 3.41Å; E511-V515 PolarHBondContact O-N 2.87Å; E511-F523 VanDerWaalsContact OE2-CE2 3.3Å; E511-F523 WeakPolarHBondContact OE2-CE2 3.46Å; E511-I536 HydrophobicContact CB-CD1 4.36Å; E511-I536 HydrophobicContact CG-CD1 3.54Å
512	C	87.9	Confident	86.6	Confident	72 Å²	72	73.5 Å²	73.5	49%	0.486	34%	0.344	S	S	.	.	H	α-helix	trans	-58.2	-40.4	174.4	-76.4	0	0	0	0	111.8	L508 Y516	L508-C512 VanDerWaalsContact O-CB 3.3Å; L508-C512 WeakPolarHBondContact O-CB 3.23Å; L508-C512 PolarHBondContact O-N 3.18Å; L508-C512 PolarHBondContact O-SG 3.28Å; C512-Y516 WeakPolarHBondContact O-CB 3.4Å; C512-Y516 PolarHBondContact O-N 3.23Å
513	K	84.9	Confident	86.1	Confident	86 Å²	86	68.1 Å²	68.1	37%	0.374	32%	0.321	S	S	.	.	H	α-helix	trans	-64.9	-43	174.5	-178.7	175.8	178.9	-178.2	0	111.1	C509 M510 E511 Y516 H517	C509-K513 WeakPolarHBondContact O-CB 3.47Å; C509-K513 PolarHBondContact O-N 2.82Å; M510-K513 WeakPolarHBondContact O-CB 3.32Å; M510-K513 PolarHBondContact O-N 3.36Å; E511-K513 VanDerWaalsContact C-N 3.27Å; E511-K513 PolarHBondContact O-N 3.31Å; K513-Y516 PolarHBondContact O-N 3.48Å; K513-H517 PolarHBondContact O-CD2 3.05Å; K513-H517 PolarHBondContact O-N 3.09Å; K513-H517 VanDerWaalsContact O-N 3.09Å
514	Q	84.2	Confident	85.6	Confident	34 Å²	34	70.7 Å²	70.7	16%	0.159	33%	0.333	C	S	.	.	H	α-helix	trans	-62	-44.4	177.4	-174.7	172	-21	0	0	112.1	M510 E511 Y516 H517 Y518 F523	M510-Q514 PolarHBondContact O-N 2.92Å; E511-Q514 WeakPolarHBondContact O-CB 3.36Å; E511-Q514 PolarHBondContact O-N 2.74Å; E511-Q514 VanDerWaalsContact O-N 3.09Å; Q514-Y516 VanDerWaalsContact C-N 3.32Å; Q514-Y516 PolarHBondContact O-N 3.15Å; Q514-H517 PolarHBondContact O-N 3.12Å; Q514-Y518 HydrophobicContact CG-CD2 3.85Å; Q514-Y518 HydrophobicContact CG-CE2 4.29Å; Q514-Y518 WeakPolarHBondContact O-CD2 3.47Å; Q514-Y518 PolarHBondContact O-N 3.03Å; Q514-F523 HydrophobicContact CG-CD2 4.37Å
515	V	86.8	Confident	84.9	Confident	39 Å²	39	79.1 Å²	79.1	24%	0.236	36%	0.364	C	S	.	.	H	α-helix	trans	-63	-38.5	175.6	174.3	0	0	0	0	111.4	E511 G519 L520 F523	E511-V515 WeakPolarHBondContact O-CG2 3.41Å; E511-V515 PolarHBondContact O-N 2.87Å; V515-G519 WeakPolarHBondContact O-CA 3.45Å; V515-G519 PolarHBondContact O-N 3.21Å; V515-L520 HydrophobicContact CG1-CB 4.31Å; V515-F523 HydrophobicContact CG2-CB 4.21Å; V515-F523 HydrophobicContact CG2-CD1 4Å; V515-F523 HydrophobicContact CG2-CD2 3.67Å; V515-F523 HydrophobicContact CG2-CE1 4.28Å; V515-F523 HydrophobicContact CG2-CE2 3.96Å; V515-F523 HydrophobicContact CG2-CG 3.68Å; V515-F523 HydrophobicContact CG2-CZ 4.26Å
516	Y	85	Confident	84.5	Confident	197 Å²	197	77.5 Å²	77.5	77%	0.773	36%	0.359	S	S	*	.	H	α-helix	trans	-64.1	-41.2	177.7	-177.8	-99.6	0	0	0	112.6	C512 K513 Q514	C512-Y516 WeakPolarHBondContact O-CB 3.4Å; C512-Y516 PolarHBondContact O-N 3.23Å; K513-Y516 PolarHBondContact O-N 3.48Å; Q514-Y516 VanDerWaalsContact C-N 3.32Å; Q514-Y516 PolarHBondContact O-N 3.15Å
517	H	78.7	Confident	84.2	Confident	115 Å²	115	85.4 Å²	85.4	53%	0.532	39%	0.39	S	S	.	.	H	α-helix	trans	-79	-43.9	-178.5	-74.2	-72.4	0	0	0	113.8	K513 Q514	K513-H517 PolarHBondContact O-CD2 3.05Å; K513-H517 PolarHBondContact O-N 3.09Å; K513-H517 VanDerWaalsContact O-N 3.09Å; Q514-H517 PolarHBondContact O-N 3.12Å
518	Y	76.9	Confident	83.9	Confident	85 Å²	85	85.9 Å²	85.9	33%	0.333	39%	0.39	S	S	.	.	H	α-helix	trans	-96.6	-15.9	-174.5	-65.3	-77.1	0	0	0	114.1	Q514 Y522 D815	Q514-Y518 HydrophobicContact CG-CD2 3.85Å; Q514-Y518 HydrophobicContact CG-CE2 4.29Å; Q514-Y518 WeakPolarHBondContact O-CD2 3.47Å; Q514-Y518 PolarHBondContact O-N 3.03Å; Y518-Y522 HydrophobicContact CD1-CD1 4.46Å; Y518-Y522 HydrophobicContact CD1-CE1 4.38Å; Y518-Y522 HydrophobicContact CG-CD1 4.39Å; Y518-D815 WeakPolarHBondContact OH-CB 3.1Å
519	G	83.7	Confident	83.8	Confident	30 Å²	30	84 Å²	84	31%	0.309	38%	0.381	S	S	.	.			trans	83.9	155.8	-176	0	0	0	0	0	114.2	V515 R521 F523	V515-G519 WeakPolarHBondContact O-CA 3.45Å; V515-G519 PolarHBondContact O-N 3.21Å; G519-R521 PolarHBondContact O-N 3.04Å; G519-F523 PolarHBondContact O-N 3.05Å
520	L	82.6	Confident	83.8	Confident	106 Å²	106	86 Å²	86	56%	0.555	38%	0.383	S	S	*	.	H	α-helix	trans	-69.1	-35.7	-170.8	-173.2	135.4	0	0	0	114.1	V515 F523 F524	V515-L520 HydrophobicContact CG1-CB 4.31Å; L520-F523 PolarHBondContact O-N 3.28Å; L520-F524 HydrophobicContact CD1-CE2 4.04Å; L520-F524 HydrophobicContact CD2-CD2 3.79Å; L520-F524 HydrophobicContact CD2-CE2 3.75Å; L520-F524 HydrophobicContact CG-CD2 3.88Å; L520-F524 HydrophobicContact CG-CE2 3.65Å; L520-F524 WeakPolarHBondContact O-CD2 3.38Å; L520-F524 PolarHBondContact O-N 3.29Å
521	R	83.8	Confident	83.9	Confident	232 Å²	232	85 Å²	85	88%	0.875	38%	0.378	S	S	*	.	H	α-helix	trans	-67.5	-40.4	179.7	-70.6	-174.3	178.8	179.1	-0.2	112.4	G519	G519-R521 PolarHBondContact O-N 3.04Å
522	Y	77.8	Confident	84	Confident	129 Å²	129	84.6 Å²	84.6	51%	0.506	38%	0.377	S	S	.	.	H	α-helix	trans	-70.1	-38.4	177.4	-175.4	-98	0	0	0	111	Y518 F524 R525	Y518-Y522 HydrophobicContact CD1-CD1 4.46Å; Y518-Y522 HydrophobicContact CD1-CE1 4.38Å; Y518-Y522 HydrophobicContact CG-CD1 4.39Å; Y522-F524 PolarHBondContact O-N 3Å; Y522-R525 WeakPolarHBondContact O-CB 3.16Å; Y522-R525 PolarHBondContact O-N 3.09Å
523	F	81.4	Confident	84.2	Confident	5 Å²	5	87.6 Å²	87.6	2%	0.022	38%	0.378	C	S	.	.	H	α-helix	trans	-55.7	-52.4	178.5	-178.4	-97.8	0	0	0	113	E511 Q514 V515 G519 L520 R525 S526 N529 W533	E511-F523 VanDerWaalsContact OE2-CE2 3.3Å; E511-F523 WeakPolarHBondContact OE2-CE2 3.46Å; Q514-F523 HydrophobicContact CG-CD2 4.37Å; V515-F523 HydrophobicContact CG2-CB 4.21Å; V515-F523 HydrophobicContact CG2-CD1 4Å; V515-F523 HydrophobicContact CG2-CD2 3.67Å; V515-F523 HydrophobicContact CG2-CE1 4.28Å; V515-F523 HydrophobicContact CG2-CE2 3.96Å; V515-F523 HydrophobicContact CG2-CG 3.68Å; V515-F523 HydrophobicContact CG2-CZ 4.26Å; G519-F523 PolarHBondContact O-N 3.05Å; L520-F523 PolarHBondContact O-N 3.28Å; F523-R525 PolarHBondContact O-N 3.44Å; F523-S526 PolarHBondContact O-N 2.97Å; F523-N529 HydrophobicContact CD1-CB 4.38Å; F523-N529 HydrophobicContact CD2-CB 4Å; F523-N529 HydrophobicContact CE1-CB 4.08Å; F523-N529 HydrophobicContact CE2-CB 3.68Å; F523-N529 HydrophobicContact CG-CB 4.34Å; F523-N529 HydrophobicContact CZ-CB 3.73Å; F523-N529 WeakPolarHBondContact CZ-O 3.24Å; F523-N529 WeakPolarHBondContact O-CB 3.4Å; F523-N529 PolarHBondContact O-ND2 3.06Å; F523-W533 HydrophobicContact CE1-CB 4.25Å
524	F	82.4	Confident	84.6	Confident	80 Å²	80	85.4 Å²	85.4	35%	0.351	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-8.6	-177.7	-75.1	-60.5	0	0	0	115	L520 Y522 S526 F530 W533	L520-F524 HydrophobicContact CD1-CE2 4.04Å; L520-F524 HydrophobicContact CD2-CD2 3.79Å; L520-F524 HydrophobicContact CD2-CE2 3.75Å; L520-F524 HydrophobicContact CG-CD2 3.88Å; L520-F524 HydrophobicContact CG-CE2 3.65Å; L520-F524 WeakPolarHBondContact O-CD2 3.38Å; L520-F524 PolarHBondContact O-N 3.29Å; Y522-F524 PolarHBondContact O-N 3Å; F524-S526 VanDerWaalsContact C-N 3.28Å; F524-S526 PolarHBondContact O-N 3.27Å; F524-F530 AromaticContact CD1-CD2 3.84Å; F524-F530 HydrophobicContact CD1-CD2 3.84Å; F524-F530 AromaticContact CE1-CD2 4Å; F524-F530 HydrophobicContact CE1-CD2 4Å; F524-W533 HydrophobicContact CE1-CD2 4.27Å; F524-W533 HydrophobicContact CE1-CE3 4.46Å; F524-W533 HydrophobicContact CE1-CG 4.32Å; F524-W533 HydrophobicContact CZ-CD2 4.47Å
525	R	78.5	Confident	85	Confident	182 Å²	182	84.2 Å²	84.2	69%	0.687	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-26.3	176	-174.2	170.7	171.2	137.5	-7	112.3	H353 Y522 F523	H353-R525 PolarHBondContact NE2-NH2 2.63Å; Y522-R525 WeakPolarHBondContact O-CB 3.16Å; Y522-R525 PolarHBondContact O-N 3.09Å; F523-R525 PolarHBondContact O-N 3.44Å
526	S	82.6	Confident	85.4	Confident	41 Å²	41	82.8 Å²	82.8	29%	0.287	36%	0.358	S	S	.	.	S	Bend	trans	-89.1	124.7	176.2	-179.8	0	0	0	0	110.9	F523 F524 Y528 N529 F530	F523-S526 PolarHBondContact O-N 2.97Å; F524-S526 VanDerWaalsContact C-N 3.28Å; F524-S526 PolarHBondContact O-N 3.27Å; S526-Y528 VanDerWaalsContact C-N 3.25Å; S526-Y528 PolarHBondContact O-N 2.91Å; S526-N529 WeakPolarHBondContact CB-ND2 3.34Å; S526-N529 PolarHBondContact O-N 2.89Å; S526-F530 PolarHBondContact O-N 3.18Å
527	Y	83.2	Confident	85.9	Confident	166 Å²	166	75.4 Å²	75.4	65%	0.651	34%	0.338	S	S	*	.	H	α-helix	trans	-57.6	-37.8	177.4	177.5	-100.1	0	0	0	112.6	F530 M531	Y527-F530 WeakPolarHBondContact O-CB 3.39Å; Y527-F530 PolarHBondContact O-N 3.29Å; Y527-M531 HydrophobicContact CD1-CE 4.37Å; Y527-M531 HydrophobicContact CE1-CE 4.01Å; Y527-M531 PolarHBondContact O-N 3.44Å
528	Y	86.2	Confident	86.7	Confident	56 Å²	56	71.4 Å²	71.4	22%	0.22	32%	0.32	C	S	.	.	H	α-helix	trans	-67.6	-41	-179.7	-62.1	-72.8	0	0	0	112.8	S526 F530 M531 D532 Y642 Q654	S526-Y528 VanDerWaalsContact C-N 3.25Å; S526-Y528 PolarHBondContact O-N 2.91Å; Y528-F530 VanDerWaalsContact C-N 3.28Å; Y528-F530 PolarHBondContact O-N 2.76Å; Y528-M531 HydrophobicContact CD1-CE 3.68Å; Y528-M531 HydrophobicContact CE1-CE 4.29Å; Y528-M531 WeakPolarHBondContact O-CB 3.25Å; Y528-M531 PolarHBondContact O-N 3.47Å; Y528-D532 PolarHBondContact O-N 3.38Å; Y528-Y642 HydrophobicContact CD1-CD2 4.1Å; Y528-Y642 HydrophobicContact CD1-CG 4.48Å; Y528-Y642 AromaticContact CD2-CD2 3.67Å; Y528-Y642 HydrophobicContact CD2-CD2 3.67Å; Y528-Y642 HydrophobicContact CD2-CE2 4.24Å; Y528-Y642 HydrophobicContact CE2-CD2 4.13Å; Y528-Y642 AromaticContact CG-CD2 3.66Å; Y528-Y642 HydrophobicContact CG-CD2 3.66Å; Y528-Y642 HydrophobicContact CG-CE2 4.43Å; Y528-Y642 HydrophobicContact CG-CG 4.41Å; Y528-Q654 PolarHBondContact OH-NE2 3.24Å
529	N	87.9	Confident	87.6	Confident	13 Å²	13	67.6 Å²	67.6	7%	0.07	31%	0.305	C	S	.	.	H	α-helix	trans	-65.5	-35.8	176.8	-66.2	-7.5	0	0	0	111.1	F523 S526 D532 W533	F523-N529 HydrophobicContact CD1-CB 4.38Å; F523-N529 HydrophobicContact CD2-CB 4Å; F523-N529 HydrophobicContact CE1-CB 4.08Å; F523-N529 HydrophobicContact CE2-CB 3.68Å; F523-N529 HydrophobicContact CG-CB 4.34Å; F523-N529 HydrophobicContact CZ-CB 3.73Å; F523-N529 WeakPolarHBondContact CZ-O 3.24Å; F523-N529 WeakPolarHBondContact O-CB 3.4Å; F523-N529 PolarHBondContact O-ND2 3.06Å; S526-N529 WeakPolarHBondContact CB-ND2 3.34Å; S526-N529 PolarHBondContact O-N 2.89Å; N529-D532 PolarHBondContact O-N 3.34Å; N529-W533 PolarHBondContact O-N 3.45Å
530	F	89.4	Confident	88.2	Confident	95 Å²	95	68.8 Å²	68.8	42%	0.417	30%	0.304	S	S	.	.	H	α-helix	trans	-64.9	-43.5	172.8	179.9	-106.8	0	0	0	111.7	F524 S526 Y527 Y528 D532 W533 V534	F524-F530 AromaticContact CD1-CD2 3.84Å; F524-F530 HydrophobicContact CD1-CD2 3.84Å; F524-F530 AromaticContact CE1-CD2 4Å; F524-F530 HydrophobicContact CE1-CD2 4Å; S526-F530 PolarHBondContact O-N 3.18Å; Y527-F530 WeakPolarHBondContact O-CB 3.39Å; Y527-F530 PolarHBondContact O-N 3.29Å; Y528-F530 VanDerWaalsContact C-N 3.28Å; Y528-F530 PolarHBondContact O-N 2.76Å; F530-D532 VanDerWaalsContact C-N 3.33Å; F530-D532 PolarHBondContact O-N 3.04Å; F530-W533 HydrophobicContact CE2-CE3 4.31Å; F530-W533 PolarHBondContact O-N 3Å; F530-V534 HydrophobicContact CD1-CG2 4.37Å; F530-V534 HydrophobicContact CE1-CG2 3.96Å; F530-V534 HydrophobicContact CE2-CG2 4.21Å; F530-V534 HydrophobicContact CZ-CG2 3.88Å; F530-V534 WeakPolarHBondContact O-CG2 3.44Å; F530-V534 PolarHBondContact O-N 3.27Å
531	M	89.5	Confident	88.8	Confident	8 Å²	8	65.6 Å²	65.6	4%	0.039	29%	0.293	C	S	.	.	H	α-helix	trans	-58.5	-43	174.9	-167.5	-162.8	-27.7	0	0	112.2	Y527 Y528 V534 S535 L635 R639	Y527-M531 HydrophobicContact CD1-CE 4.37Å; Y527-M531 HydrophobicContact CE1-CE 4.01Å; Y527-M531 PolarHBondContact O-N 3.44Å; Y528-M531 HydrophobicContact CD1-CE 3.68Å; Y528-M531 HydrophobicContact CE1-CE 4.29Å; Y528-M531 WeakPolarHBondContact O-CB 3.25Å; Y528-M531 PolarHBondContact O-N 3.47Å; M531-V534 PolarHBondContact O-N 3.23Å; M531-S535 PolarHBondContact O-N 2.85Å; M531-S535 PolarHBondContact O-OG 3.03Å; M531-L635 HydrophobicContact CG-CB 4.47Å; M531-L635 HydrophobicContact CG-CD2 4.25Å; M531-R639 HydrophobicContact SD-CB 3.96Å
532	D	90.2	Very high	89.3	Confident	6 Å²	6	54.6 Å²	54.6	3%	0.032	25%	0.252	C	S	.	.	H	α-helix	trans	-63	-42.5	176.5	-74.8	-21.5	0	0	0	112.1	Y528 N529 F530 V534 S535 I536 R639	Y528-D532 PolarHBondContact O-N 3.38Å; N529-D532 PolarHBondContact O-N 3.34Å; F530-D532 VanDerWaalsContact C-N 3.33Å; F530-D532 PolarHBondContact O-N 3.04Å; D532-V534 VanDerWaalsContact C-N 3.33Å; D532-V534 PolarHBondContact O-N 2.94Å; D532-S535 WeakPolarHBondContact CA-OG 3.49Å; D532-S535 PolarHBondContact O-N 3.13Å; D532-S535 PolarHBondContact O-OG 3.47Å; D532-I536 WeakPolarHBondContact O-CB 3.33Å; D532-I536 WeakPolarHBondContact O-CD1 3.49Å; D532-I536 WeakPolarHBondContact O-CG1 3.45Å; D532-I536 PolarHBondContact O-N 2.82Å; D532-R639 WeakPolarHBondContact OD1-CD 3.24Å; D532-R639 WeakPolarHBondContact OD1-CG 3.39Å; D532-R639 IonicContact OD1-CZ 3.49Å; D532-R639 IonicContact OD1-NE 2.8Å; D532-R639 PolarHBondContact OD1-NE 3.26Å; D532-R639 IonicContact OD1-NH2 3.08Å; D532-R639 IonicContact OD2-CZ 3.85Å; D532-R639 IonicContact OD2-NE 2.81Å; D532-R639 PolarHBondContact OD2-NE 3.16Å; D532-R639 IonicContact OD2-NH2 3.99Å; D532-R639 PolarHBondContact OD2-NH2 2.89Å
533	W	91.7	Very high	90	Very high	135 Å²	135	48.6 Å²	48.6	51%	0.511	23%	0.228	S	C	.	.	H	α-helix	trans	-62.1	-42.4	175.9	-177.5	80.3	0	0	0	111.9	F523 F524 N529 F530 A537	F523-W533 HydrophobicContact CE1-CB 4.25Å; F524-W533 HydrophobicContact CE1-CD2 4.27Å; F524-W533 HydrophobicContact CE1-CE3 4.46Å; F524-W533 HydrophobicContact CE1-CG 4.32Å; F524-W533 HydrophobicContact CZ-CD2 4.47Å; N529-W533 PolarHBondContact O-N 3.45Å; F530-W533 HydrophobicContact CE2-CE3 4.31Å; F530-W533 PolarHBondContact O-N 3Å; W533-A537 VanDerWaalsContact O-CB 3.28Å; W533-A537 WeakPolarHBondContact O-CB 3.21Å; W533-A537 PolarHBondContact O-N 2.91Å
534	V	94.2	Very high	90.6	Very high	39 Å²	39	51.3 Å²	51.3	24%	0.236	25%	0.248	C	C	.	.	H	α-helix	trans	-65	-45.4	176.4	174.9	0	0	0	0	111	F530 M531 D532 I536 A537 L538 L635	F530-V534 HydrophobicContact CD1-CG2 4.37Å; F530-V534 HydrophobicContact CE1-CG2 3.96Å; F530-V534 HydrophobicContact CE2-CG2 4.21Å; F530-V534 HydrophobicContact CZ-CG2 3.88Å; F530-V534 WeakPolarHBondContact O-CG2 3.44Å; F530-V534 PolarHBondContact O-N 3.27Å; M531-V534 PolarHBondContact O-N 3.23Å; D532-V534 VanDerWaalsContact C-N 3.33Å; D532-V534 PolarHBondContact O-N 2.94Å; V534-I536 PolarHBondContact O-N 3.29Å; V534-A537 PolarHBondContact O-N 2.97Å; V534-L538 HydrophobicContact CG1-CD1 4.02Å; V534-L538 HydrophobicContact CG1-CG 4.33Å; V534-L538 VanDerWaalsContact O-CG 3.29Å; V534-L538 WeakPolarHBondContact O-CG 3.38Å; V534-L538 PolarHBondContact O-N 3.26Å; V534-L635 HydrophobicContact CB-CD1 4.34Å; V534-L635 HydrophobicContact CG1-CD1 3.66Å
535	S	93.4	Very high	91.1	Very high	10 Å²	10	49.7 Å²	49.7	7%	0.07	24%	0.243	C	C	.	.	H	α-helix	trans	-63.8	-43.7	-179.9	69.2	0	0	0	0	111.5	M531 D532 A537 L538 Y539	M531-S535 PolarHBondContact O-N 2.85Å; M531-S535 PolarHBondContact O-OG 3.03Å; D532-S535 WeakPolarHBondContact CA-OG 3.49Å; D532-S535 PolarHBondContact O-N 3.13Å; D532-S535 PolarHBondContact O-OG 3.47Å; S535-A537 PolarHBondContact O-N 3.05Å; S535-L538 PolarHBondContact O-N 3.44Å; S535-Y539 WeakPolarHBondContact O-CD2 3.45Å; S535-Y539 PolarHBondContact O-N 2.78Å
536	I	93.8	Very high	91.6	Very high	9 Å²	9	41.6 Å²	41.6	5%	0.046	21%	0.212	C	C	.	.	H	α-helix	trans	-62.2	-43.6	174.9	-66.2	164.2	0	0	0	110.6	Q507 L508 E511 D532 V534 Y539 L540	Q507-I536 HydrophobicContact CB-CD1 4.44Å; Q507-I536 HydrophobicContact CG-CD1 3.75Å; Q507-I536 HydrophobicContact CG-CG1 4.14Å; L508-I536 HydrophobicContact CB-CG2 4.21Å; L508-I536 HydrophobicContact CD1-CG2 3.9Å; E511-I536 HydrophobicContact CB-CD1 4.36Å; E511-I536 HydrophobicContact CG-CD1 3.54Å; D532-I536 WeakPolarHBondContact O-CB 3.33Å; D532-I536 WeakPolarHBondContact O-CD1 3.49Å; D532-I536 WeakPolarHBondContact O-CG1 3.45Å; D532-I536 PolarHBondContact O-N 2.82Å; V534-I536 PolarHBondContact O-N 3.29Å; I536-Y539 PolarHBondContact O-N 2.8Å; I536-L540 HydrophobicContact CG2-CD1 3.74Å; I536-L540 HydrophobicContact CG2-CG 4.14Å; I536-L540 WeakPolarHBondContact O-CB 3.26Å; I536-L540 VanDerWaalsContact O-CG 3.26Å; I536-L540 WeakPolarHBondContact O-CG 3.4Å; I536-L540 PolarHBondContact O-N 2.97Å
537	A	95.7	Very high	92	Very high	41 Å²	41	42.9 Å²	42.9	34%	0.339	22%	0.215	S	C	.	.	H	α-helix	trans	-62.1	-44.3	177.7	0	0	0	0	0	112.1	W533 V534 S535 L540 A541	W533-A537 VanDerWaalsContact O-CB 3.28Å; W533-A537 WeakPolarHBondContact O-CB 3.21Å; W533-A537 PolarHBondContact O-N 2.91Å; V534-A537 PolarHBondContact O-N 2.97Å; S535-A537 PolarHBondContact O-N 3.05Å; A537-L540 PolarHBondContact O-N 3.39Å; A537-A541 VanDerWaalsContact O-CB 3.3Å; A537-A541 WeakPolarHBondContact O-CB 3.3Å; A537-A541 PolarHBondContact O-N 3Å
538	L	96.6	Very high	92.4	Very high	31 Å²	31	38.9 Å²	38.9	16%	0.162	20%	0.204	C	C	.	.	H	α-helix	trans	-61.7	-43.9	176.1	-70.7	173.7	0	0	0	111.6	V534 S535 S542 L628 L631 L635	V534-L538 HydrophobicContact CG1-CD1 4.02Å; V534-L538 HydrophobicContact CG1-CG 4.33Å; V534-L538 VanDerWaalsContact O-CG 3.29Å; V534-L538 WeakPolarHBondContact O-CG 3.38Å; V534-L538 PolarHBondContact O-N 3.26Å; S535-L538 PolarHBondContact O-N 3.44Å; L538-S542 WeakPolarHBondContact O-CB 3.29Å; L538-S542 PolarHBondContact O-N 2.66Å; L538-L628 HydrophobicContact CD2-CD2 3.53Å; L538-L631 HydrophobicContact CD1-CB 4Å; L538-L635 HydrophobicContact CD1-CD1 3.85Å
539	Y	95.2	Very high	92.6	Very high	5 Å²	5	36.3 Å²	36.3	2%	0.02	19%	0.194	C	C	.	.	H	α-helix	trans	-64.5	-48.8	175.6	-76.6	-51.5	0	0	0	112.2	F451 I455 I504 S535 I536 A541 S542 Y543 F629 G632 N633 S636	F451-Y539 AromaticContact CZ-CE2 3.98Å; F451-Y539 HydrophobicContact CZ-CE2 3.98Å; I455-Y539 WeakPolarHBondContact CD1-OH 3.41Å; I504-Y539 HydrophobicContact CD1-CD1 4.13Å; I504-Y539 HydrophobicContact CD1-CD2 4.39Å; I504-Y539 HydrophobicContact CD1-CG 3.88Å; I504-Y539 HydrophobicContact CG1-CD2 4.26Å; I504-Y539 HydrophobicContact CG1-CG 4.21Å; S535-Y539 WeakPolarHBondContact O-CD2 3.45Å; S535-Y539 PolarHBondContact O-N 2.78Å; I536-Y539 PolarHBondContact O-N 2.8Å; Y539-A541 VanDerWaalsContact C-N 3.3Å; Y539-A541 PolarHBondContact O-N 2.73Å; Y539-S542 PolarHBondContact O-N 2.69Å; Y539-Y543 HydrophobicContact CD1-CE2 4.48Å; Y539-Y543 WeakPolarHBondContact O-CB 3.42Å; Y539-Y543 VanDerWaalsContact O-CD2 3.27Å; Y539-Y543 WeakPolarHBondContact O-CD2 3.22Å; Y539-Y543 PolarHBondContact O-N 3.39Å; Y539-F629 AromaticContact CD1-CD2 3.83Å; Y539-F629 HydrophobicContact CD1-CD2 3.83Å; Y539-F629 HydrophobicContact CD1-CE2 4.01Å; Y539-F629 AromaticContact CE1-CD2 3.77Å; Y539-F629 HydrophobicContact CE1-CD2 3.77Å; Y539-F629 AromaticContact CE1-CE2 3.74Å; Y539-F629 HydrophobicContact CE1-CE2 3.74Å; Y539-G632 VanDerWaalsContact OH-C 3.29Å; Y539-G632 PolarHBondContact OH-O 3.49Å; Y539-N633 WeakPolarHBondContact CE1-OD1 3.32Å; Y539-N633 WeakPolarHBondContact OH-CA 3.22Å; Y539-N633 PolarHBondContact OH-N 3.09Å; Y539-N633 PolarHBondContact OH-OD1 3.29Å; Y539-S636 WeakPolarHBondContact CE2-OG 3.1Å; Y539-S636 WeakPolarHBondContact OH-CB 3.44Å; Y539-S636 PolarHBondContact OH-OG 3.34Å
540	L	95.3	Very high	92.5	Very high	55 Å²	55	37 Å²	37	29%	0.288	20%	0.197	S	C	.	.	H	α-helix	trans	-60.3	-41.1	178.9	-72	175.1	0	0	0	111.6	I504 L508 I536 A537 S544	I504-L540 HydrophobicContact CG2-CD2 4.14Å; I504-L540 HydrophobicContact CG2-CG 4.37Å; L508-L540 HydrophobicContact CD1-CD1 4.27Å; L508-L540 HydrophobicContact CD2-CD1 4.04Å; I536-L540 HydrophobicContact CG2-CD1 3.74Å; I536-L540 HydrophobicContact CG2-CG 4.14Å; I536-L540 WeakPolarHBondContact O-CB 3.26Å; I536-L540 VanDerWaalsContact O-CG 3.26Å; I536-L540 WeakPolarHBondContact O-CG 3.4Å; I536-L540 PolarHBondContact O-N 2.97Å; A537-L540 PolarHBondContact O-N 3.39Å; L540-S544 WeakPolarHBondContact O-CB 3.4Å; L540-S544 PolarHBondContact O-N 3.01Å; L540-S544 PolarHBondContact O-OG 3.43Å
541	A	95.9	Very high	92.5	Very high	40 Å²	40	39 Å²	39	33%	0.331	21%	0.206	S	C	.	.	H	α-helix	trans	-62.5	-47.6	174.4	0	0	0	0	0	111.5	A537 Y539 Y543 S544 L545 L628	A537-A541 VanDerWaalsContact O-CB 3.3Å; A537-A541 WeakPolarHBondContact O-CB 3.3Å; A537-A541 PolarHBondContact O-N 3Å; Y539-A541 VanDerWaalsContact C-N 3.3Å; Y539-A541 PolarHBondContact O-N 2.73Å; A541-Y543 PolarHBondContact O-N 2.86Å; A541-S544 PolarHBondContact O-N 2.72Å; A541-L545 WeakPolarHBondContact O-CG 3.45Å; A541-L545 PolarHBondContact O-N 3.06Å; A541-L628 HydrophobicContact CB-CD1 3.94Å
542	S	93.9	Very high	92.5	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-58.3	-49.4	176.6	177.6	0	0	0	0	112.2	L538 Y539 S544 L545 R546 S625	L538-S542 WeakPolarHBondContact O-CB 3.29Å; L538-S542 PolarHBondContact O-N 2.66Å; Y539-S542 PolarHBondContact O-N 2.69Å; S542-S544 PolarHBondContact O-N 3.07Å; S542-L545 PolarHBondContact O-N 3.39Å; S542-R546 WeakPolarHBondContact O-CB 3.31Å; S542-R546 VanDerWaalsContact O-CG 3.31Å; S542-R546 WeakPolarHBondContact O-CG 3.48Å; S542-R546 PolarHBondContact O-N 3.43Å; S542-S625 WeakPolarHBondContact CB-O 3.36Å; S542-S625 PolarHBondContact OG-O 3.5Å
543	Y	92.8	Very high	92.3	Very high	4 Å²	4	43 Å²	43	2%	0.016	22%	0.223	C	C	.	.	H	α-helix	trans	-68.4	-34.4	179.6	-84.1	-80.7	0	0	0	112.4	M493 Q497 L500 L501 I504 Y539 A541 R546 I547 F629	M493-Y543 HydrophobicContact SD-CD1 4.43Å; M493-Y543 HydrophobicContact SD-CE1 4.43Å; Q497-Y543 HydrophobicContact CB-CE1 4.22Å; Q497-Y543 WeakPolarHBondContact O-CE1 3.36Å; Q497-Y543 PolarHBondContact O-OH 3.16Å; L500-Y543 VanDerWaalsContact CB-OH 3.28Å; L500-Y543 WeakPolarHBondContact CB-OH 3.44Å; L501-Y543 HydrophobicContact CB-CD1 4.3Å; L501-Y543 HydrophobicContact CB-CE1 4.11Å; L501-Y543 HydrophobicContact CD1-CD1 4.04Å; L501-Y543 HydrophobicContact CD1-CD2 4.47Å; L501-Y543 HydrophobicContact CD1-CG 3.94Å; I504-Y543 HydrophobicContact CD1-CD2 3.72Å; I504-Y543 HydrophobicContact CD1-CE2 3.23Å; Y539-Y543 HydrophobicContact CD1-CE2 4.48Å; Y539-Y543 WeakPolarHBondContact O-CB 3.42Å; Y539-Y543 VanDerWaalsContact O-CD2 3.27Å; Y539-Y543 WeakPolarHBondContact O-CD2 3.22Å; Y539-Y543 PolarHBondContact O-N 3.39Å; A541-Y543 PolarHBondContact O-N 2.86Å; Y543-R546 PolarHBondContact O-N 3.26Å; Y543-I547 WeakPolarHBondContact O-CB 3.5Å; Y543-I547 WeakPolarHBondContact O-CD1 3.29Å; Y543-I547 WeakPolarHBondContact O-CG1 3.46Å; Y543-I547 PolarHBondContact O-N 2.88Å; Y543-F629 HydrophobicContact CE2-CD2 4.41Å; Y543-F629 HydrophobicContact CE2-CE2 4.12Å
544	S	94.3	Very high	92.1	Very high	62 Å²	62	39.3 Å²	39.3	43%	0.434	21%	0.212	S	C	.	.	H	α-helix	trans	-63	-47	174.5	-61.3	0	0	0	0	111	L540 A541 S542 I547 I548	L540-S544 WeakPolarHBondContact O-CB 3.4Å; L540-S544 PolarHBondContact O-N 3.01Å; L540-S544 PolarHBondContact O-OG 3.43Å; A541-S544 PolarHBondContact O-N 2.72Å; S542-S544 PolarHBondContact O-N 3.07Å; S544-I547 PolarHBondContact O-N 3.38Å; S544-I548 WeakPolarHBondContact O-CD1 3.36Å; S544-I548 VanDerWaalsContact O-CG1 3.27Å; S544-I548 WeakPolarHBondContact O-CG1 3.28Å; S544-I548 PolarHBondContact O-N 3.02Å
545	L	92.9	Very high	91.7	Very high	46 Å²	46	40 Å²	40	24%	0.241	22%	0.222	C	C	.	.	H	α-helix	trans	-61.4	-44.5	175.1	-70.8	174.1	0	0	0	111.2	A541 S542 I547 I548 V549 P621 I624 L628	A541-L545 WeakPolarHBondContact O-CG 3.45Å; A541-L545 PolarHBondContact O-N 3.06Å; S542-L545 PolarHBondContact O-N 3.39Å; L545-I547 PolarHBondContact O-N 2.87Å; L545-I548 PolarHBondContact O-N 2.94Å; L545-V549 WeakPolarHBondContact O-CB 3.43Å; L545-V549 VanDerWaalsContact O-CG2 3.27Å; L545-V549 WeakPolarHBondContact O-CG2 3.28Å; L545-V549 PolarHBondContact O-N 3.07Å; L545-P621 HydrophobicContact CD2-CB 3.9Å; L545-I624 HydrophobicContact CD1-CB 4.25Å; L545-I624 HydrophobicContact CD1-CG2 3.88Å; L545-L628 HydrophobicContact CD1-CD1 4.17Å
546	R	90.1	Very high	91.4	Very high	12 Å²	12	39.9 Å²	39.9	5%	0.045	22%	0.221	C	C	.	.	H	α-helix	trans	-60.7	-41.9	177.7	-80.6	169.5	167.8	-177.2	5.8	113.4	M493 S542 Y543 V549 D550 D626	M493-R546 HydrophobicContact CE-CB 3.5Å; M493-R546 HydrophobicContact CE-CG 3.55Å; M493-R546 HydrophobicContact SD-CB 3.72Å; M493-R546 HydrophobicContact SD-CG 4.22Å; S542-R546 WeakPolarHBondContact O-CB 3.31Å; S542-R546 VanDerWaalsContact O-CG 3.31Å; S542-R546 WeakPolarHBondContact O-CG 3.48Å; S542-R546 PolarHBondContact O-N 3.43Å; Y543-R546 PolarHBondContact O-N 3.26Å; R546-V549 PolarHBondContact O-N 2.88Å; R546-D550 WeakPolarHBondContact O-CB 3.43Å; R546-D550 PolarHBondContact O-N 3Å; R546-D626 IonicContact CZ-OD1 3.4Å; R546-D626 IonicContact NE-OD1 2.81Å; R546-D626 IonicContact NH2-OD1 2.82Å; R546-D626 PolarHBondContact NH2-OD1 3.17Å
547	I	90.6	Very high	90.9	Very high	67 Å²	67	40 Å²	40	34%	0.344	22%	0.222	S	C	.	.	H	α-helix	trans	-65	-43	175.6	-70.5	165.1	0	0	0	110.5	Y543 S544 L545 D550 F551	Y543-I547 WeakPolarHBondContact O-CB 3.5Å; Y543-I547 WeakPolarHBondContact O-CD1 3.29Å; Y543-I547 WeakPolarHBondContact O-CG1 3.46Å; Y543-I547 PolarHBondContact O-N 2.88Å; S544-I547 PolarHBondContact O-N 3.38Å; L545-I547 PolarHBondContact O-N 2.87Å; I547-D550 PolarHBondContact O-N 3.1Å; I547-F551 HydrophobicContact CG2-CD2 3.74Å; I547-F551 HydrophobicContact CG2-CE2 3.5Å; I547-F551 WeakPolarHBondContact O-CD2 3.15Å; I547-F551 PolarHBondContact O-N 3.34Å
548	I	91.2	Very high	90.4	Very high	83 Å²	83	46.6 Å²	46.6	43%	0.426	24%	0.237	S	C	.	.	H	α-helix	trans	-63	-44.3	176.7	-67.8	164.8	0	0	0	110.9	S544 L545 F551 K552	S544-I548 WeakPolarHBondContact O-CD1 3.36Å; S544-I548 VanDerWaalsContact O-CG1 3.27Å; S544-I548 WeakPolarHBondContact O-CG1 3.28Å; S544-I548 PolarHBondContact O-N 3.02Å; L545-I548 PolarHBondContact O-N 2.94Å; I548-F551 PolarHBondContact O-N 2.83Å; I548-K552 HydrophobicContact CG2-CD 4.39Å; I548-K552 WeakPolarHBondContact O-CG 3.44Å; I548-K552 PolarHBondContact O-N 3.3Å
549	V	89.4	Confident	89.9	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.006	26%	0.261	C	S	.	.	H	α-helix	trans	-61	-45.5	175.8	170.2	0	0	0	0	110.2	L545 R546 F551 K552 V553 W608 P621	L545-V549 WeakPolarHBondContact O-CB 3.43Å; L545-V549 VanDerWaalsContact O-CG2 3.27Å; L545-V549 WeakPolarHBondContact O-CG2 3.28Å; L545-V549 PolarHBondContact O-N 3.07Å; R546-V549 PolarHBondContact O-N 2.88Å; V549-F551 PolarHBondContact O-N 3.44Å; V549-K552 PolarHBondContact O-N 3.02Å; V549-V553 HydrophobicContact CG1-CG2 3.99Å; V549-V553 VanDerWaalsContact O-CB 3.31Å; V549-V553 WeakPolarHBondContact O-CB 3.29Å; V549-V553 WeakPolarHBondContact O-CG2 3.27Å; V549-V553 PolarHBondContact O-N 3.16Å; V549-W608 HydrophobicContact CG1-CZ3 4.31Å; V549-W608 HydrophobicContact CG2-CZ3 4.09Å; V549-P621 HydrophobicContact CG2-CB 4Å; V549-P621 HydrophobicContact CG2-CG 3.72Å
550	D	87.4	Confident	89.5	Confident	27 Å²	27	53.2 Å²	53.2	14%	0.144	27%	0.266	C	S	.	.	H	α-helix	trans	-58.3	-45.3	176.9	-171.7	65.5	0	0	0	111.8	V492 R546 I547 V553 Q554	V492-D550 HydrophobicContact CB-CB 4.11Å; V492-D550 WeakPolarHBondContact CB-OD1 3.08Å; V492-D550 HydrophobicContact CG2-CB 4.25Å; V492-D550 WeakPolarHBondContact CG2-OD1 3.18Å; V492-D550 PolarHBondContact N-OD1 2.81Å; R546-D550 WeakPolarHBondContact O-CB 3.43Å; R546-D550 PolarHBondContact O-N 3Å; I547-D550 PolarHBondContact O-N 3.1Å; D550-V553 PolarHBondContact O-N 2.82Å; D550-Q554 WeakPolarHBondContact O-CB 3.33Å; D550-Q554 VanDerWaalsContact O-CG 3.25Å; D550-Q554 WeakPolarHBondContact O-CG 3.44Å; D550-Q554 PolarHBondContact O-N 3.21Å; D550-Q554 PolarHBondContact OD2-NE2 3.05Å
551	F	89	Confident	88.9	Confident	137 Å²	137	55.5 Å²	55.5	60%	0.601	28%	0.276	S	S	*	.	H	α-helix	trans	-62.1	-44.2	174.5	-80.6	-62.4	0	0	0	113.2	I547 I548 V549 Q554 A555	I547-F551 HydrophobicContact CG2-CD2 3.74Å; I547-F551 HydrophobicContact CG2-CE2 3.5Å; I547-F551 WeakPolarHBondContact O-CD2 3.15Å; I547-F551 PolarHBondContact O-N 3.34Å; I548-F551 PolarHBondContact O-N 2.83Å; V549-F551 PolarHBondContact O-N 3.44Å; F551-Q554 PolarHBondContact O-N 3.36Å; F551-A555 WeakPolarHBondContact O-CB 2.83Å; F551-A555 PolarHBondContact O-N 2.82Å
552	K	88.7	Confident	88.5	Confident	98 Å²	98	58.8 Å²	58.8	43%	0.426	29%	0.288	S	S	.	.	H	α-helix	trans	-66.3	-41.4	179.1	-74.5	-172.6	178.9	-177.6	0	112	I548 V549 A555 S556 W608	I548-K552 HydrophobicContact CG2-CD 4.39Å; I548-K552 WeakPolarHBondContact O-CG 3.44Å; I548-K552 PolarHBondContact O-N 3.3Å; V549-K552 PolarHBondContact O-N 3.02Å; K552-A555 PolarHBondContact O-N 3.48Å; K552-S556 PolarHBondContact O-N 2.83Å; K552-S556 PolarHBondContact O-OG 2.89Å; K552-W608 HydrophobicContact CB-CD2 4.01Å; K552-W608 HydrophobicContact CB-CE3 4.37Å; K552-W608 HydrophobicContact CB-CG 4.33Å; K552-W608 HydrophobicContact CD-CD2 4.32Å; K552-W608 HydrophobicContact CD-CH2 3.97Å; K552-W608 HydrophobicContact CD-CZ2 3.42Å; K552-W608 VanDerWaalsContact CD-CZ2 3.42Å
553	V	87.2	Confident	88.1	Confident	1 Å²	1	61 Å²	61	1%	0.006	30%	0.301	C	S	.	.	H	α-helix	trans	-62.3	-49.9	175.5	168.6	0	0	0	0	109.8	V492 V549 D550 A555 S556 M557 W608	V492-V553 HydrophobicContact CG2-CB 4.31Å; V492-V553 HydrophobicContact CG2-CG1 4.19Å; V492-V553 HydrophobicContact CG2-CG2 4.4Å; V549-V553 HydrophobicContact CG1-CG2 3.99Å; V549-V553 VanDerWaalsContact O-CB 3.31Å; V549-V553 WeakPolarHBondContact O-CB 3.29Å; V549-V553 WeakPolarHBondContact O-CG2 3.27Å; V549-V553 PolarHBondContact O-N 3.16Å; D550-V553 PolarHBondContact O-N 2.82Å; V553-A555 VanDerWaalsContact C-N 3.28Å; V553-A555 PolarHBondContact O-N 2.88Å; V553-S556 PolarHBondContact O-N 2.96Å; V553-S556 VanDerWaalsContact O-N 3.17Å; V553-S556 PolarHBondContact O-OG 3.44Å; V553-M557 HydrophobicContact CG1-CG 4.23Å; V553-M557 WeakPolarHBondContact O-CB 3.4Å; V553-M557 VanDerWaalsContact O-CG 3.31Å; V553-M557 WeakPolarHBondContact O-CG 3.16Å; V553-M557 PolarHBondContact O-N 3.11Å; V553-W608 HydrophobicContact CG2-CE3 4.39Å
554	Q	86.4	Confident	87.6	Confident	57 Å²	57	61.6 Å²	61.6	27%	0.266	30%	0.304	S	S	.	.	H	α-helix	trans	-59.2	-38.3	177.3	-73.7	180	26.2	0	0	112.6	D550 F551 R558	D550-Q554 WeakPolarHBondContact O-CB 3.33Å; D550-Q554 VanDerWaalsContact O-CG 3.25Å; D550-Q554 WeakPolarHBondContact O-CG 3.44Å; D550-Q554 PolarHBondContact O-N 3.21Å; D550-Q554 PolarHBondContact OD2-NE2 3.05Å; F551-Q554 PolarHBondContact O-N 3.36Å; Q554-R558 VanDerWaalsContact O-CG 3.32Å; Q554-R558 WeakPolarHBondContact O-CG 3.21Å; Q554-R558 PolarHBondContact O-N 2.9Å; Q554-R558 VanDerWaalsContact O-N 3.17Å
555	A	87.2	Confident	87.2	Confident	55 Å²	55	63.5 Å²	63.5	46%	0.455	31%	0.305	S	S	.	.	H	α-helix	trans	-65.1	-46.4	175.2	0	0	0	0	0	112	F551 K552 V553 R558 Q559	F551-A555 WeakPolarHBondContact O-CB 2.83Å; F551-A555 PolarHBondContact O-N 2.82Å; K552-A555 PolarHBondContact O-N 3.48Å; V553-A555 VanDerWaalsContact C-N 3.28Å; V553-A555 PolarHBondContact O-N 2.88Å; A555-R558 PolarHBondContact O-N 3.39Å; A555-Q559 PolarHBondContact O-N 3.35Å; A555-Q559 VanDerWaalsContact O-N 3.14Å
556	S	85.8	Confident	86.8	Confident	6 Å²	6	64.2 Å²	64.2	4%	0.042	31%	0.311	C	S	.	.	H	α-helix	trans	-64.7	-39.8	178	69.4	0	0	0	0	112.7	K552 V553 R558 Q559 Y560	K552-S556 PolarHBondContact O-N 2.83Å; K552-S556 PolarHBondContact O-OG 2.89Å; V553-S556 PolarHBondContact O-N 2.96Å; V553-S556 VanDerWaalsContact O-N 3.17Å; V553-S556 PolarHBondContact O-OG 3.44Å; S556-R558 VanDerWaalsContact C-N 3.32Å; S556-R558 PolarHBondContact O-N 3.22Å; S556-Q559 PolarHBondContact O-N 3.18Å; S556-Q559 VanDerWaalsContact O-N 3.17Å; S556-Y560 WeakPolarHBondContact O-CD2 3.07Å; S556-Y560 PolarHBondContact O-N 3.18Å
557	M	83.5	Confident	86.4	Confident	13 Å²	13	63.7 Å²	63.7	6%	0.064	31%	0.309	C	S	.	.	H	α-helix	trans	-64	-36.6	177.2	-73	-65	-83.1	0	0	112	R487 V553 Q561 L564 L609	R487-M557 WeakPolarHBondContact O-CE 3.39Å; V553-M557 HydrophobicContact CG1-CG 4.23Å; V553-M557 WeakPolarHBondContact O-CB 3.4Å; V553-M557 VanDerWaalsContact O-CG 3.31Å; V553-M557 WeakPolarHBondContact O-CG 3.16Å; V553-M557 PolarHBondContact O-N 3.11Å; M557-Q561 WeakPolarHBondContact O-CA 3.17Å; M557-Q561 WeakPolarHBondContact O-CB 3.29Å; M557-Q561 PolarHBondContact O-N 2.68Å; M557-Q561 VanDerWaalsContact O-N 3.09Å; M557-L564 HydrophobicContact CE-CD2 3.82Å; M557-L564 HydrophobicContact SD-CD2 4.35Å; M557-L609 HydrophobicContact SD-CD1 3.48Å; M557-L609 WeakPolarHBondContact SD-CD1 3.48Å
558	R	85.8	Confident	86	Confident	178 Å²	178	63.5 Å²	63.5	67%	0.672	31%	0.307	S	S	*	.	H	α-helix	trans	-67.5	-38.9	173.8	-72.1	173.6	-170.3	154.4	8.2	111.9	Q554 A555 S556	Q554-R558 VanDerWaalsContact O-CG 3.32Å; Q554-R558 WeakPolarHBondContact O-CG 3.21Å; Q554-R558 PolarHBondContact O-N 2.9Å; Q554-R558 VanDerWaalsContact O-N 3.17Å; A555-R558 PolarHBondContact O-N 3.39Å; S556-R558 VanDerWaalsContact C-N 3.32Å; S556-R558 PolarHBondContact O-N 3.22Å
559	Q	86.2	Confident	85.6	Confident	139 Å²	139	62.7 Å²	62.7	65%	0.65	31%	0.309	S	S	*	.	H	α-helix	trans	-70.4	-39.8	-179.5	-176	176.8	0.8	0	0	112.7	A555 S556	A555-Q559 PolarHBondContact O-N 3.35Å; A555-Q559 VanDerWaalsContact O-N 3.14Å; S556-Q559 PolarHBondContact O-N 3.18Å; S556-Q559 VanDerWaalsContact O-N 3.17Å
560	Y	85.2	Confident	85.3	Confident	36 Å²	36	64.7 Å²	64.7	14%	0.141	32%	0.319	C	S	.	.	S	Bend	trans	-100.4	11.8	-176.2	-71.2	-82.1	0	0	0	113.6	S556 D562 V563 L564 S605	S556-Y560 WeakPolarHBondContact O-CD2 3.07Å; S556-Y560 PolarHBondContact O-N 3.18Å; Y560-D562 VanDerWaalsContact C-N 3.33Å; Y560-D562 PolarHBondContact O-N 2.97Å; Y560-V563 HydrophobicContact CD1-CB 4.35Å; Y560-V563 HydrophobicContact CD1-CG2 4.27Å; Y560-V563 PolarHBondContact O-N 3.4Å; Y560-V563 VanDerWaalsContact O-N 3.15Å; Y560-L564 PolarHBondContact O-N 3.2Å; Y560-S605 WeakPolarHBondContact OH-CB 3.34Å; Y560-S605 PolarHBondContact OH-OG 3.37Å
561	Q	84.4	Confident	84.9	Confident	104 Å²	104	63.6 Å²	63.6	49%	0.486	31%	0.313	S	S	.	.	H	α-helix	trans	-55.3	-45.5	-173.6	-168.4	179.2	-12.1	0	0	112.7	M557 L564 K565	M557-Q561 WeakPolarHBondContact O-CA 3.17Å; M557-Q561 WeakPolarHBondContact O-CB 3.29Å; M557-Q561 PolarHBondContact O-N 2.68Å; M557-Q561 VanDerWaalsContact O-N 3.09Å; Q561-L564 PolarHBondContact O-N 2.91Å; Q561-K565 WeakPolarHBondContact O-CG 3.3Å; Q561-K565 PolarHBondContact O-N 2.93Å; Q561-K565 VanDerWaalsContact O-N 3.16Å
562	D	86	Confident	84.4	Confident	109 Å²	109	60.6 Å²	60.6	58%	0.583	30%	0.303	S	S	*	.	H	α-helix	trans	-73.2	-34.5	-178.6	-65.9	-29.3	0	0	0	112.4	Y560 L564 K565 V566	Y560-D562 VanDerWaalsContact C-N 3.33Å; Y560-D562 PolarHBondContact O-N 2.97Å; D562-L564 VanDerWaalsContact C-N 3.33Å; D562-K565 PolarHBondContact O-N 2.74Å; D562-K565 IonicContact OD1-NZ 3.75Å; D562-K565 PolarHBondContact OD1-NZ 3.42Å; D562-V566 WeakPolarHBondContact O-CG2 3.28Å; D562-V566 PolarHBondContact O-N 3.31Å
563	V	85.4	Confident	83.7	Confident	47 Å²	47	60.9 Å²	60.9	29%	0.285	31%	0.309	S	S	.	.	H	α-helix	trans	-64.7	-40.7	174.8	-179.6	0	0	0	0	110.6	Y560 V566 A567 I600	Y560-V563 HydrophobicContact CD1-CB 4.35Å; Y560-V563 HydrophobicContact CD1-CG2 4.27Å; Y560-V563 PolarHBondContact O-N 3.4Å; Y560-V563 VanDerWaalsContact O-N 3.15Å; V563-V566 PolarHBondContact O-N 3.15Å; V563-A567 PolarHBondContact O-N 3.06Å; V563-I600 HydrophobicContact CG1-CD1 3.37Å; V563-I600 HydrophobicContact CG1-CG1 3.66Å; V563-I600 HydrophobicContact CG1-CG2 4.19Å
564	L	83.2	Confident	82.9	Confident	15 Å²	15	61.3 Å²	61.3	8%	0.079	31%	0.312	C	S	.	.	H	α-helix	trans	-65.6	-39.6	177.1	-172.2	63.9	0	0	0	111.6	F486 M557 Y560 Q561 D562 V566 A567 Q568	F486-L564 HydrophobicContact CB-CD1 3.79Å; F486-L564 HydrophobicContact CD1-CD1 3.99Å; F486-L564 HydrophobicContact CD2-CD1 3.87Å; F486-L564 HydrophobicContact CE1-CD1 4.45Å; F486-L564 HydrophobicContact CE2-CD1 4.4Å; F486-L564 HydrophobicContact CG-CD1 3.62Å; M557-L564 HydrophobicContact CE-CD2 3.82Å; M557-L564 HydrophobicContact SD-CD2 4.35Å; Y560-L564 PolarHBondContact O-N 3.2Å; Q561-L564 PolarHBondContact O-N 2.91Å; D562-L564 VanDerWaalsContact C-N 3.33Å; L564-V566 VanDerWaalsContact C-N 3.28Å; L564-V566 PolarHBondContact O-N 3.39Å; L564-A567 PolarHBondContact O-N 3.33Å; L564-Q568 WeakPolarHBondContact O-CB 3.15Å; L564-Q568 WeakPolarHBondContact O-CG 3.34Å; L564-Q568 PolarHBondContact O-N 3.5Å
565	K	85	Confident	81.9	Confident	102 Å²	102	59.3 Å²	59.3	44%	0.443	30%	0.303	S	S	.	.	H	α-helix	trans	-60.5	-35.6	173.8	-69.3	171.8	-164.9	153.6	0	112.5	Q561 D562 Q568 S569	Q561-K565 WeakPolarHBondContact O-CG 3.3Å; Q561-K565 PolarHBondContact O-N 2.93Å; Q561-K565 VanDerWaalsContact O-N 3.16Å; D562-K565 PolarHBondContact O-N 2.74Å; D562-K565 IonicContact OD1-NZ 3.75Å; D562-K565 PolarHBondContact OD1-NZ 3.42Å; K565-Q568 WeakPolarHBondContact O-CB 3.44Å; K565-S569 PolarHBondContact O-N 3.02Å
566	V	85	Confident	80.7	Confident	62 Å²	62	60.1 Å²	60.1	38%	0.376	31%	0.305	S	S	.	.	H	α-helix	trans	-71.6	-42.5	175.5	177	0	0	0	0	111.1	D562 V563 L564 Q568 S569 I570 Y596	D562-V566 WeakPolarHBondContact O-CG2 3.28Å; D562-V566 PolarHBondContact O-N 3.31Å; V563-V566 PolarHBondContact O-N 3.15Å; L564-V566 VanDerWaalsContact C-N 3.28Å; L564-V566 PolarHBondContact O-N 3.39Å; V566-Q568 VanDerWaalsContact C-N 3.25Å; V566-Q568 PolarHBondContact O-N 2.84Å; V566-S569 PolarHBondContact O-N 3.48Å; V566-S569 PolarHBondContact O-OG 2.95Å; V566-I570 HydrophobicContact CG1-CD1 3.93Å; V566-I570 HydrophobicContact CG1-CG1 4.47Å; V566-I570 WeakPolarHBondContact O-CG1 3.41Å; V566-I570 PolarHBondContact O-N 3.33Å; V566-Y596 HydrophobicContact CB-CE1 4.32Å; V566-Y596 HydrophobicContact CG1-CE1 3.97Å; V566-Y596 HydrophobicContact CG1-CE2 4.41Å; V566-Y596 WeakPolarHBondContact CG1-OH 3.24Å
567	A	81.9	Confident	79.3	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-59.3	-41	174.4	0	0	0	0	0	111.4	F486 V563 L564 I570 L571 Y596 I600	F486-A567 HydrophobicContact CE2-CB 3.98Å; F486-A567 HydrophobicContact CZ-CB 4.16Å; V563-A567 PolarHBondContact O-N 3.06Å; L564-A567 PolarHBondContact O-N 3.33Å; A567-I570 PolarHBondContact O-N 2.95Å; A567-L571 WeakPolarHBondContact O-CB 3.48Å; A567-L571 PolarHBondContact O-N 3.34Å; A567-Y596 HydrophobicContact CB-CD1 4.08Å; A567-Y596 HydrophobicContact CB-CE1 3.9Å; A567-I600 HydrophobicContact CB-CD1 4.49Å
568	Q	83.1	Confident	77.8	Confident	63 Å²	63	64.7 Å²	64.7	29%	0.294	34%	0.335	S	S	.	.	H	α-helix	trans	-59.3	-47.2	173.9	-76.6	176.3	-3.3	0	0	112.2	Y478 L482 L564 K565 V566 I570 L571 L572	Y478-Q568 WeakPolarHBondContact CE2-O 3.28Å; Y478-Q568 WeakPolarHBondContact OH-CA 3.31Å; Y478-Q568 WeakPolarHBondContact OH-CB 3.15Å; Y478-Q568 VanDerWaalsContact OH-CG 3.28Å; Y478-Q568 WeakPolarHBondContact OH-CG 3.21Å; Y478-Q568 PolarHBondContact OH-O 3.14Å; L482-Q568 HydrophobicContact CD1-CG 3.94Å; L482-Q568 HydrophobicContact CD2-CG 3.71Å; L564-Q568 WeakPolarHBondContact O-CB 3.15Å; L564-Q568 WeakPolarHBondContact O-CG 3.34Å; L564-Q568 PolarHBondContact O-N 3.5Å; K565-Q568 WeakPolarHBondContact O-CB 3.44Å; V566-Q568 VanDerWaalsContact C-N 3.25Å; V566-Q568 PolarHBondContact O-N 2.84Å; Q568-I570 PolarHBondContact O-N 3.28Å; Q568-L571 PolarHBondContact O-N 2.93Å; Q568-L572 VanDerWaalsContact O-CB 3.26Å; Q568-L572 WeakPolarHBondContact O-CB 3.32Å; Q568-L572 PolarHBondContact O-N 3.2Å
569	S	82.6	Confident	76.1	Confident	67 Å²	67	60.7 Å²	60.7	47%	0.469	33%	0.334	S	S	.	.	H	α-helix	trans	-67.7	-34.8	179.7	67.7	0	0	0	0	113.3	K565 V566 N573	K565-S569 PolarHBondContact O-N 3.02Å; V566-S569 PolarHBondContact O-N 3.48Å; V566-S569 PolarHBondContact O-OG 2.95Å; S569-N573 WeakPolarHBondContact O-CB 3.45Å; S569-N573 PolarHBondContact O-N 3.33Å
570	I	81.5	Confident	74.3	Confident	43 Å²	43	61.5 Å²	61.5	22%	0.221	34%	0.335	C	S	.	.	H	α-helix	trans	-66.5	-46.1	174.7	-65	166.2	0	0	0	110.7	V566 A567 Q568 L572 N573 T574 Y593 Y596	V566-I570 HydrophobicContact CG1-CD1 3.93Å; V566-I570 HydrophobicContact CG1-CG1 4.47Å; V566-I570 WeakPolarHBondContact O-CG1 3.41Å; V566-I570 PolarHBondContact O-N 3.33Å; A567-I570 PolarHBondContact O-N 2.95Å; Q568-I570 PolarHBondContact O-N 3.28Å; I570-L572 VanDerWaalsContact C-N 3.34Å; I570-N573 PolarHBondContact O-N 2.87Å; I570-T574 PolarHBondContact O-N 3.09Å; I570-T574 PolarHBondContact O-OG1 3.22Å; I570-Y593 HydrophobicContact CG2-CD2 4.32Å; I570-Y596 HydrophobicContact CD1-CD1 3.68Å; I570-Y596 HydrophobicContact CD1-CD2 4.13Å; I570-Y596 HydrophobicContact CD1-CE1 3.98Å; I570-Y596 HydrophobicContact CD1-CE2 4.44Å; I570-Y596 HydrophobicContact CD1-CG 3.75Å
571	L	79.8	Confident	72.3	Confident	4 Å²	4	69.3 Å²	69.3	2%	0.021	37%	0.371	C	S	.	.	H	α-helix	trans	-62.9	-43.3	177.5	-174.1	72.1	0	0	0	110.6	Y478 I481 L482 A567 Q568 N573 T574 T575 Y593	Y478-L571 HydrophobicContact CD2-CB 4.15Å; Y478-L571 HydrophobicContact CD2-CD2 3.48Å; Y478-L571 VanDerWaalsContact CD2-CD2 3.48Å; Y478-L571 HydrophobicContact CD2-CG 3.65Å; Y478-L571 HydrophobicContact CE2-CB 3.82Å; Y478-L571 HydrophobicContact CE2-CD2 3.58Å; Y478-L571 HydrophobicContact CE2-CG 3.81Å; Y478-L571 HydrophobicContact CG-CD2 4.26Å; I481-L571 HydrophobicContact CB-CD2 4.31Å; I481-L571 HydrophobicContact CG2-CD1 3.87Å; I481-L571 HydrophobicContact CG2-CD2 4.12Å; L482-L571 HydrophobicContact CB-CD2 4.03Å; L482-L571 HydrophobicContact CD1-CD2 4.31Å; A567-L571 WeakPolarHBondContact O-CB 3.48Å; A567-L571 PolarHBondContact O-N 3.34Å; Q568-L571 PolarHBondContact O-N 2.93Å; L571-N573 VanDerWaalsContact C-N 3.34Å; L571-N573 PolarHBondContact O-N 2.98Å; L571-T574 WeakPolarHBondContact O-CB 3.38Å; L571-T574 PolarHBondContact O-N 3.21Å; L571-T574 VanDerWaalsContact O-N 3.14Å; L571-T575 PolarHBondContact O-N 3.36Å; L571-T575 PolarHBondContact O-OG1 2.84Å; L571-Y593 HydrophobicContact CB-CD2 3.8Å; L571-Y593 HydrophobicContact CB-CE2 3.71Å; L571-Y593 HydrophobicContact CD1-CD1 3.86Å; L571-Y593 HydrophobicContact CD1-CD2 3.98Å; L571-Y593 HydrophobicContact CD1-CE1 3.77Å; L571-Y593 HydrophobicContact CD1-CE2 3.89Å; L571-Y593 HydrophobicContact CD1-CG 3.96Å; L571-Y593 HydrophobicContact CD2-CE2 4.43Å; L571-Y593 HydrophobicContact CG-CD2 4.47Å; L571-Y593 HydrophobicContact CG-CE2 4.21Å
572	L	77.7	Confident	70.4	Confident	73 Å²	73	66.9 Å²	66.9	38%	0.382	36%	0.364	S	S	.	.	H	α-helix	trans	-60.6	-40.6	177.5	-178.7	64.4	0	0	0	112.3	W474 Y478 Q568 I570 T575 C576	W474-L572 HydrophobicContact CE3-CD1 4.3Å; W474-L572 HydrophobicContact CH2-CD1 3.41Å; W474-L572 VanDerWaalsContact CH2-CD1 3.41Å; W474-L572 HydrophobicContact CZ3-CD1 3.17Å; Y478-L572 HydrophobicContact CD2-CB 4.47Å; Y478-L572 HydrophobicContact CE2-CB 3.98Å; Q568-L572 VanDerWaalsContact O-CB 3.26Å; Q568-L572 WeakPolarHBondContact O-CB 3.32Å; Q568-L572 PolarHBondContact O-N 3.2Å; I570-L572 VanDerWaalsContact C-N 3.34Å; L572-T575 PolarHBondContact O-OG1 2.83Å; L572-C576 WeakPolarHBondContact O-CB 3.45Å; L572-C576 PolarHBondContact O-N 3Å
573	N	75.1	Confident	68.4	Low	104 Å²	104	66.7 Å²	66.7	56%	0.556	37%	0.371	S	S	*	.	H	α-helix	trans	-66.7	-40.7	174.6	-175.1	11.1	0	0	0	111.7	S569 I570 L571 S577	S569-N573 WeakPolarHBondContact O-CB 3.45Å; S569-N573 PolarHBondContact O-N 3.33Å; I570-N573 PolarHBondContact O-N 2.87Å; L571-N573 VanDerWaalsContact C-N 3.34Å; L571-N573 PolarHBondContact O-N 2.98Å; N573-S577 WeakPolarHBondContact O-CB 3.41Å; N573-S577 PolarHBondContact O-N 3.14Å; N573-S577 PolarHBondContact O-OG 3.16Å
574	T	69.7	Low	66.9	Low	10 Å²	10	68 Å²	68	6%	0.061	39%	0.394	C	S	.	.	H	α-helix	trans	-61.7	-45.3	176.7	-54.8	0	0	0	0	111	I570 L571 S577 T589 H590	I570-T574 PolarHBondContact O-N 3.09Å; I570-T574 PolarHBondContact O-OG1 3.22Å; L571-T574 WeakPolarHBondContact O-CB 3.38Å; L571-T574 PolarHBondContact O-N 3.21Å; L571-T574 VanDerWaalsContact O-N 3.14Å; T574-S577 PolarHBondContact O-OG 2.89Å; T574-T589 PolarHBondContact OG1-O 3.24Å; T574-H590 HydrophobicContact CG2-CB 3.94Å
575	T	66.2	Low	65.3	Low	15 Å²	15	71.3 Å²	71.3	9%	0.092	42%	0.416	C	S	.	.	H	α-helix	trans	-74.1	-39.5	178.8	56	0	0	0	0	112.1	L571 L572 S577 T578	L571-T575 PolarHBondContact O-N 3.36Å; L571-T575 PolarHBondContact O-OG1 2.84Å; L572-T575 PolarHBondContact O-OG1 2.83Å; T575-S577 VanDerWaalsContact C-N 3.34Å; T575-S577 PolarHBondContact O-N 3.33Å; T575-T578 PolarHBondContact O-N 2.79Å; T575-T578 PolarHBondContact O-OG1 3.09Å
576	C	62.5	Low	63.7	Low	73 Å²	73	71.1 Å²	71.1	49%	0.493	42%	0.416	S	S	.	.	H	α-helix	trans	-64.8	-34.8	180	-174.4	0	0	0	0	112.9	L572 T578 S579	L572-C576 WeakPolarHBondContact O-CB 3.45Å; L572-C576 PolarHBondContact O-N 3Å; C576-T578 VanDerWaalsContact C-N 3.27Å; C576-T578 PolarHBondContact O-N 2.94Å; C576-S579 PolarHBondContact O-OG 3.37Å
577	S	54.7	Low	62.2	Low	27 Å²	27	76 Å²	76	19%	0.189	44%	0.435	C	S	.	.	H	α-helix	trans	-67.4	-24.4	177.4	46.9	0	0	0	0	113.7	N573 T574 T575 S579	N573-S577 WeakPolarHBondContact O-CB 3.41Å; N573-S577 PolarHBondContact O-N 3.14Å; N573-S577 PolarHBondContact O-OG 3.16Å; T574-S577 PolarHBondContact O-OG 2.89Å; T575-S577 VanDerWaalsContact C-N 3.34Å; T575-S577 PolarHBondContact O-N 3.33Å; S577-S579 PolarHBondContact O-N 3.33Å
578	T	52.2	Low	61.1	Low	87 Å²	87	79.7 Å²	79.7	53%	0.534	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-16.1	-179.2	61.2	0	0	0	0	115.1	T575 C576	T575-T578 PolarHBondContact O-N 2.79Å; T575-T578 PolarHBondContact O-OG1 3.09Å; C576-T578 VanDerWaalsContact C-N 3.27Å; C576-T578 PolarHBondContact O-N 2.94Å
579	S	51.6	Low	60.2	Low	95 Å²	95	78 Å²	78	66%	0.664	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-13.5	179.4	75.7	0	0	0	0	114	C576 S577	C576-S579 PolarHBondContact O-OG 3.37Å; S577-S579 PolarHBondContact O-N 3.33Å
580	K	47.9	Very low	59.6	Low	155 Å²	155	80.1 Å²	80.1	67%	0.674	45%	0.454	S	S	*	.	S	Bend	trans	-107.5	130.2	174.2	-71	-178.9	-179.6	175.4	0	108.3	C582	K580-C582 VanDerWaalsContact C-N 3.29Å; K580-C582 VanDerWaalsContact O-CB 3.27Å; K580-C582 WeakPolarHBondContact O-CB 3.48Å; K580-C582 PolarHBondContact O-N 3.36Å; K580-C582 PolarHBondContact O-SG 3.32Å; K580-C582 VanDerWaalsContact O-SG 3.35Å
581	F	41.9	Very low	59.3	Low	201 Å²	201	83.6 Å²	83.6	88%	0.882	47%	0.469	S	S	*	.			trans	-43.5	86.2	170.9	-170.1	-93.2	0	0	0	111.4
582	C	45.8	Very low	59.2	Low	52 Å²	52	87.7 Å²	87.7	35%	0.351	49%	0.491	S	S	.	.			trans	-128.8	76.5	-171.7	-77.4	0	0	0	0	109.2	K580 G584	K580-C582 VanDerWaalsContact C-N 3.29Å; K580-C582 VanDerWaalsContact O-CB 3.27Å; K580-C582 WeakPolarHBondContact O-CB 3.48Å; K580-C582 PolarHBondContact O-N 3.36Å; K580-C582 PolarHBondContact O-SG 3.32Å; K580-C582 VanDerWaalsContact O-SG 3.35Å; C582-G584 PolarHBondContact O-N 3.34Å
583	S	44.4	Very low	59.4	Low	105 Å²	105	84.4 Å²	84.4	73%	0.734	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	113.5	174.1	-46.1	0	0	0	0	111.2
584	G	52.9	Low	59.7	Low	74 Å²	74	81.3 Å²	81.3	76%	0.763	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	115.9	-14.7	157.2	0	0	0	0	0	118.5	C582	C582-G584 PolarHBondContact O-N 3.34Å
585	T	50.1	Low	60.4	Low	86 Å²	86	85.4 Å²	85.4	53%	0.528	48%	0.48	S	S	.	.	S	Bend	trans	-100.1	-5.6	176.5	50.3	0	0	0	0	114.3	T588	T585-T588 PolarHBondContact O-N 3.46Å; T585-T588 PolarHBondContact O-OG1 3.38Å
586	E	50.3	Low	61.3	Low	97 Å²	97	87.7 Å²	87.7	45%	0.453	49%	0.487	S	S	.	.	H	α-helix	trans	-63.8	-45.6	-169.7	-62.9	176.2	177.3	0	0	114.1	T588 T589	E586-T588 PolarHBondContact O-N 3.37Å; E586-T589 PolarHBondContact O-N 2.96Å; E586-T589 PolarHBondContact O-OG1 2.87Å
587	E	53.8	Low	62.3	Low	166 Å²	166	86.3 Å²	86.3	78%	0.776	47%	0.472	S	S	*	.	H	α-helix	trans	-60.4	-33.5	-178.5	-69.1	-176.1	163.6	0	0	111.3	Q591	E587-Q591 WeakPolarHBondContact O-CB 3.48Å; E587-Q591 PolarHBondContact O-N 2.95Å
588	T	60.1	Low	63.7	Low	77 Å²	77	88 Å²	88	47%	0.472	48%	0.478	S	S	.	.	H	α-helix	trans	-73.8	-37.2	-175.9	69.5	0	0	0	0	113.4	T585 E586 N592	T585-T588 PolarHBondContact O-N 3.46Å; T585-T588 PolarHBondContact O-OG1 3.38Å; E586-T588 PolarHBondContact O-N 3.37Å; T588-N592 WeakPolarHBondContact O-CB 3.25Å; T588-N592 PolarHBondContact O-N 2.91Å; T588-N592 PolarHBondContact O-ND2 3.49Å; T588-N592 VanDerWaalsContact O-ND2 3.08Å; T588-N592 PolarHBondContact O-OD1 3.43Å
589	T	63.8	Low	65.3	Low	26 Å²	26	91.5 Å²	91.5	16%	0.16	49%	0.486	C	S	.	.	H	α-helix	trans	-75.4	-44.2	-174.4	52.6	0	0	0	0	112.2	T574 E586 Q591 N592 Y593	T574-T589 PolarHBondContact OG1-O 3.24Å; E586-T589 PolarHBondContact O-N 2.96Å; E586-T589 PolarHBondContact O-OG1 2.87Å; T589-Q591 VanDerWaalsContact C-N 3.31Å; T589-Q591 PolarHBondContact O-N 2.85Å; T589-N592 WeakPolarHBondContact O-CB 3.45Å; T589-N592 PolarHBondContact O-N 2.78Å; T589-Y593 PolarHBondContact O-N 3.13Å
590	H	69	Low	66.8	Low	113 Å²	113	87.7 Å²	87.7	52%	0.523	46%	0.458	S	S	.	.	H	α-helix	trans	-61.8	-42.4	174.9	-176.6	-87.3	0	0	0	111.1	T574 N592 Y593 V594	T574-H590 HydrophobicContact CG2-CB 3.94Å; H590-N592 VanDerWaalsContact C-N 3.33Å; H590-N592 PolarHBondContact O-N 3.47Å; H590-Y593 WeakPolarHBondContact O-CB 3.48Å; H590-Y593 PolarHBondContact O-N 2.92Å; H590-V594 WeakPolarHBondContact O-CG2 3.46Å; H590-V594 PolarHBondContact O-N 3.08Å
591	Q	75	Confident	68.5	Low	115 Å²	115	80.9 Å²	80.9	54%	0.537	43%	0.429	S	S	.	.	H	α-helix	trans	-68	-34	177.5	-155.3	155.2	5.2	0	0	111.8	E587 T589 V594 N595	E587-Q591 WeakPolarHBondContact O-CB 3.48Å; E587-Q591 PolarHBondContact O-N 2.95Å; T589-Q591 VanDerWaalsContact C-N 3.31Å; T589-Q591 PolarHBondContact O-N 2.85Å; Q591-V594 PolarHBondContact O-N 3.43Å; Q591-N595 VanDerWaalsContact O-CB 3.22Å; Q591-N595 WeakPolarHBondContact O-CB 3.25Å; Q591-N595 PolarHBondContact O-N 2.9Å; Q591-N595 PolarHBondContact O-ND2 2.8Å
592	N	78.9	Confident	70.4	Confident	91 Å²	91	77.2 Å²	77.2	49%	0.487	42%	0.418	S	S	.	.	H	α-helix	trans	-62.2	-42.8	170.5	-72	-23	0	0	0	112.1	T588 T589 H590 Y596	T588-N592 WeakPolarHBondContact O-CB 3.25Å; T588-N592 PolarHBondContact O-N 2.91Å; T588-N592 PolarHBondContact O-ND2 3.49Å; T588-N592 VanDerWaalsContact O-ND2 3.08Å; T588-N592 PolarHBondContact O-OD1 3.43Å; T589-N592 WeakPolarHBondContact O-CB 3.45Å; T589-N592 PolarHBondContact O-N 2.78Å; H590-N592 VanDerWaalsContact C-N 3.33Å; H590-N592 PolarHBondContact O-N 3.47Å; N592-Y596 VanDerWaalsContact O-CB 3.23Å; N592-Y596 WeakPolarHBondContact O-CB 3.45Å; N592-Y596 PolarHBondContact O-N 3.34Å
593	Y	81.2	Confident	72.2	Confident	4 Å²	4	77.3 Å²	77.3	2%	0.016	42%	0.418	C	S	.	.	H	α-helix	trans	-61.2	-51.5	174	174.2	-104.2	0	0	0	111.6	I481 D485 I570 L571 T589 H590 N595 Y596 R597	I481-Y593 HydrophobicContact CG2-CE1 4.22Å; D485-Y593 WeakPolarHBondContact OD2-CE1 3.23Å; D485-Y593 PolarHBondContact OD2-OH 3.39Å; D485-Y593 VanDerWaalsContact OD2-OH 3.08Å; I570-Y593 HydrophobicContact CG2-CD2 4.32Å; L571-Y593 HydrophobicContact CB-CD2 3.8Å; L571-Y593 HydrophobicContact CB-CE2 3.71Å; L571-Y593 HydrophobicContact CD1-CD1 3.86Å; L571-Y593 HydrophobicContact CD1-CD2 3.98Å; L571-Y593 HydrophobicContact CD1-CE1 3.77Å; L571-Y593 HydrophobicContact CD1-CE2 3.89Å; L571-Y593 HydrophobicContact CD1-CG 3.96Å; L571-Y593 HydrophobicContact CD2-CE2 4.43Å; L571-Y593 HydrophobicContact CG-CD2 4.47Å; L571-Y593 HydrophobicContact CG-CE2 4.21Å; T589-Y593 PolarHBondContact O-N 3.13Å; H590-Y593 WeakPolarHBondContact O-CB 3.48Å; H590-Y593 PolarHBondContact O-N 2.92Å; Y593-N595 VanDerWaalsContact C-N 3.32Å; Y593-N595 PolarHBondContact O-N 2.71Å; Y593-Y596 PolarHBondContact O-N 3.15Å; Y593-Y596 VanDerWaalsContact O-N 3.17Å; Y593-R597 WeakPolarHBondContact O-CB 3.17Å; Y593-R597 PolarHBondContact O-N 3.25Å
594	V	82.4	Confident	73.9	Confident	39 Å²	39	81 Å²	81	24%	0.236	42%	0.423	C	S	.	.	H	α-helix	trans	-60.1	-42.8	-179.5	174.1	0	0	0	0	111.2	H590 Q591 R597 N598	H590-V594 WeakPolarHBondContact O-CG2 3.46Å; H590-V594 PolarHBondContact O-N 3.08Å; Q591-V594 PolarHBondContact O-N 3.43Å; V594-R597 PolarHBondContact O-N 2.86Å; V594-N598 WeakPolarHBondContact O-CB 3.34Å; V594-N598 PolarHBondContact O-N 3.11Å; V594-N598 PolarHBondContact O-ND2 3.48Å
595	N	83.9	Confident	75.2	Confident	95 Å²	95	80.5 Å²	80.5	51%	0.508	41%	0.408	S	S	.	.	H	α-helix	trans	-64	-42.8	176.3	-72.2	-20.6	0	0	0	111.9	Q591 Y593 K599	Q591-N595 VanDerWaalsContact O-CB 3.22Å; Q591-N595 WeakPolarHBondContact O-CB 3.25Å; Q591-N595 PolarHBondContact O-N 2.9Å; Q591-N595 PolarHBondContact O-ND2 2.8Å; Y593-N595 VanDerWaalsContact C-N 3.32Å; Y593-N595 PolarHBondContact O-N 2.71Å; N595-K599 WeakPolarHBondContact O-CB 3.19Å; N595-K599 PolarHBondContact O-N 2.76Å
596	Y	84.2	Confident	76.7	Confident	63 Å²	63	76.4 Å²	76.4	25%	0.247	38%	0.383	C	S	.	.	H	α-helix	trans	-65.7	-44.5	177.2	-170.2	-104.9	0	0	0	111.7	V566 A567 I570 N592 Y593 K599 I600	V566-Y596 HydrophobicContact CB-CE1 4.32Å; V566-Y596 HydrophobicContact CG1-CE1 3.97Å; V566-Y596 HydrophobicContact CG1-CE2 4.41Å; V566-Y596 WeakPolarHBondContact CG1-OH 3.24Å; A567-Y596 HydrophobicContact CB-CD1 4.08Å; A567-Y596 HydrophobicContact CB-CE1 3.9Å; I570-Y596 HydrophobicContact CD1-CD1 3.68Å; I570-Y596 HydrophobicContact CD1-CD2 4.13Å; I570-Y596 HydrophobicContact CD1-CE1 3.98Å; I570-Y596 HydrophobicContact CD1-CE2 4.44Å; I570-Y596 HydrophobicContact CD1-CG 3.75Å; N592-Y596 VanDerWaalsContact O-CB 3.23Å; N592-Y596 WeakPolarHBondContact O-CB 3.45Å; N592-Y596 PolarHBondContact O-N 3.34Å; Y593-Y596 PolarHBondContact O-N 3.15Å; Y593-Y596 VanDerWaalsContact O-N 3.17Å; Y596-K599 WeakPolarHBondContact O-CB 3.25Å; Y596-K599 PolarHBondContact O-N 2.65Å; Y596-I600 HydrophobicContact CD1-CD1 3.55Å; Y596-I600 HydrophobicContact CE1-CD1 3.26Å; Y596-I600 HydrophobicContact CE1-CG1 4.41Å; Y596-I600 HydrophobicContact CG-CD1 4.33Å; Y596-I600 WeakPolarHBondContact O-CG1 3.46Å; Y596-I600 PolarHBondContact O-N 3.47Å
597	R	85.3	Confident	78.4	Confident	45 Å²	45	73.7 Å²	73.7	17%	0.17	37%	0.369	C	S	.	.	H	α-helix	trans	-55.7	-53.5	173.8	-178.2	-168.6	96.3	179.9	12.6	111.1	D485 F486 Y593 V594 K599 I600 L601 W615	D485-R597 IonicContact OD1-CZ 3.65Å; D485-R597 IonicContact OD1-NE 3.78Å; D485-R597 IonicContact OD1-NH1 3.72Å; D485-R597 PolarHBondContact OD1-NH1 3.08Å; D485-R597 WeakPolarHBondContact OD2-CD 3.43Å; D485-R597 IonicContact OD2-CZ 2.8Å; D485-R597 IonicContact OD2-NE 2.73Å; D485-R597 IonicContact OD2-NH1 3.89Å; D485-R597 PolarHBondContact OD2-NH1 3.32Å; F486-R597 HydrophobicContact CE2-CG 4.28Å; F486-R597 HydrophobicContact CZ-CG 4.09Å; Y593-R597 WeakPolarHBondContact O-CB 3.17Å; Y593-R597 PolarHBondContact O-N 3.25Å; V594-R597 PolarHBondContact O-N 2.86Å; R597-K599 VanDerWaalsContact C-N 3.28Å; R597-K599 PolarHBondContact O-N 3.04Å; R597-I600 PolarHBondContact O-N 3.05Å; R597-L601 HydrophobicContact CG-CD1 3.98Å; R597-L601 HydrophobicContact CG-CD2 4.41Å; R597-L601 WeakPolarHBondContact O-CD1 3.47Å; R597-L601 PolarHBondContact O-N 3.26Å; R597-W615 VanDerWaalsContact CZ-CH2 3.43Å; R597-W615 VanDerWaalsContact NH2-CZ2 3.32Å
598	N	83.8	Confident	79.9	Confident	62 Å²	62	68.3 Å²	68.3	33%	0.332	34%	0.341	S	S	.	.	H	α-helix	trans	-59.2	-42.3	-178.8	-72.1	-17.1	0	0	0	110.6	V594 I600 L601 I602	V594-N598 WeakPolarHBondContact O-CB 3.34Å; V594-N598 PolarHBondContact O-N 3.11Å; V594-N598 PolarHBondContact O-ND2 3.48Å; N598-I600 PolarHBondContact O-N 3.24Å; N598-L601 PolarHBondContact O-N 2.66Å; N598-I602 HydrophobicContact CB-CD1 4.33Å; N598-I602 WeakPolarHBondContact O-CB 3.23Å; N598-I602 WeakPolarHBondContact O-CD1 3.32Å; N598-I602 WeakPolarHBondContact O-CG1 3.47Å; N598-I602 PolarHBondContact O-N 3.15Å; N598-I602 VanDerWaalsContact O-N 3.09Å
599	K	84.8	Confident	81	Confident	161 Å²	161	64.7 Å²	64.7	70%	0.7	32%	0.319	S	S	*	.	H	α-helix	trans	-58.1	-32.1	175.9	-169.8	175.6	-179.3	177	0	113.5	N595 Y596 R597	N595-K599 WeakPolarHBondContact O-CB 3.19Å; N595-K599 PolarHBondContact O-N 2.76Å; Y596-K599 WeakPolarHBondContact O-CB 3.25Å; Y596-K599 PolarHBondContact O-N 2.65Å; R597-K599 VanDerWaalsContact C-N 3.28Å; R597-K599 PolarHBondContact O-N 3.04Å
600	I	84.4	Confident	82.1	Confident	15 Å²	15	66 Å²	66	8%	0.077	32%	0.321	C	S	.	.	H	α-helix	trans	-83.3	-38.5	178.7	-63	161.2	0	0	0	112.2	F486 V563 A567 Y596 R597 N598 P603 A606 L609	F486-I600 HydrophobicContact CE1-CG2 4.06Å; F486-I600 HydrophobicContact CZ-CD1 4.36Å; V563-I600 HydrophobicContact CG1-CD1 3.37Å; V563-I600 HydrophobicContact CG1-CG1 3.66Å; V563-I600 HydrophobicContact CG1-CG2 4.19Å; A567-I600 HydrophobicContact CB-CD1 4.49Å; Y596-I600 HydrophobicContact CD1-CD1 3.55Å; Y596-I600 HydrophobicContact CE1-CD1 3.26Å; Y596-I600 HydrophobicContact CE1-CG1 4.41Å; Y596-I600 HydrophobicContact CG-CD1 4.33Å; Y596-I600 WeakPolarHBondContact O-CG1 3.46Å; Y596-I600 PolarHBondContact O-N 3.47Å; R597-I600 PolarHBondContact O-N 3.05Å; N598-I600 PolarHBondContact O-N 3.24Å; I600-P603 WeakPolarHBondContact O-CD 3.12Å; I600-A606 WeakPolarHBondContact O-CB 2.92Å; I600-L609 HydrophobicContact CG2-CD2 3.92Å
601	L	83.2	Confident	82.5	Confident	12 Å²	12	61.3 Å²	61.3	6%	0.063	30%	0.304	C	S	.	.	H	α-helix	trans	-83.8	-18.3	-173.5	-92.8	70.1	0	0	0	114.6	F486 R597 N598 R610 W615	F486-L601 HydrophobicContact CD1-CD1 3.79Å; F486-L601 HydrophobicContact CE1-CD1 3.15Å; F486-L601 HydrophobicContact CZ-CD1 3.71Å; R597-L601 HydrophobicContact CG-CD1 3.98Å; R597-L601 HydrophobicContact CG-CD2 4.41Å; R597-L601 WeakPolarHBondContact O-CD1 3.47Å; R597-L601 PolarHBondContact O-N 3.26Å; N598-L601 PolarHBondContact O-N 2.66Å; L601-R610 HydrophobicContact CD2-CG 4.1Å; L601-R610 HydrophobicContact CG-CG 4.1Å; L601-R610 PolarHBondContact O-NE 3.35Å; L601-R610 PolarHBondContact O-NH2 2.96Å; L601-W615 HydrophobicContact CD2-CE3 3.62Å; L601-W615 HydrophobicContact CD2-CH2 4.38Å; L601-W615 HydrophobicContact CD2-CZ3 3.38Å
602	I	82.1	Confident	82.9	Confident	124 Å²	124	56.3 Å²	56.3	64%	0.636	28%	0.281	S	S	*	.	S	Bend	trans	-65.4	-49.4	-179.1	-72.4	159.3	0	0	0	112.8	N598	N598-I602 HydrophobicContact CB-CD1 4.33Å; N598-I602 WeakPolarHBondContact O-CB 3.23Å; N598-I602 WeakPolarHBondContact O-CD1 3.32Å; N598-I602 WeakPolarHBondContact O-CG1 3.47Å; N598-I602 PolarHBondContact O-N 3.15Å; N598-I602 VanDerWaalsContact O-N 3.09Å
603	P	82.6	Confident	83.1	Confident	54 Å²	54	56.8 Å²	56.8	35%	0.351	28%	0.276	S	S	.	.	S	Bend	trans	-58.3	139.3	-179.3	-23.8	33.9	0	0	0	112.8	I600 S605 A606	I600-P603 WeakPolarHBondContact O-CD 3.12Å; P603-S605 PolarHBondContact O-N 3.43Å; P603-S605 VanDerWaalsContact O-N 3.16Å; P603-A606 PolarHBondContact O-N 3.09Å
604	E	80	Confident	83.2	Confident	181 Å²	181	63.4 Å²	63.4	85%	0.846	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-59.3	-28.3	176.9	-67.8	-174.8	171.2	0	0	112.7	A606 Y607	E604-A606 PolarHBondContact O-N 3.46Å; E604-Y607 VanDerWaalsContact O-CB 3.26Å; E604-Y607 WeakPolarHBondContact O-CB 3.22Å; E604-Y607 PolarHBondContact O-N 3.3Å; E604-Y607 VanDerWaalsContact O-N 3.14Å
605	S	80.8	Confident	83.2	Confident	65 Å²	65	65.2 Å²	65.2	46%	0.455	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-64.1	-22.7	176.9	59.7	0	0	0	0	113.7	Y560 P603	Y560-S605 WeakPolarHBondContact OH-CB 3.34Å; Y560-S605 PolarHBondContact OH-OG 3.37Å; P603-S605 PolarHBondContact O-N 3.43Å; P603-S605 VanDerWaalsContact O-N 3.16Å
606	A	81.8	Confident	83.3	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-95.5	8.2	178.2	0	0	0	0	0	113.3	I600 P603 E604 W608 L609	I600-A606 WeakPolarHBondContact O-CB 2.92Å; P603-A606 PolarHBondContact O-N 3.09Å; E604-A606 PolarHBondContact O-N 3.46Å; A606-W608 VanDerWaalsContact C-N 3.31Å; A606-W608 PolarHBondContact O-N 3.48Å; A606-L609 VanDerWaalsContact O-CB 3.25Å; A606-L609 WeakPolarHBondContact O-CB 3.46Å; A606-L609 PolarHBondContact O-N 3.4Å
607	Y	85.8	Confident	83.5	Confident	40 Å²	40	60.3 Å²	60.3	16%	0.157	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-50.5	-48.3	-179.8	178.6	-93.3	0	0	0	112.8	E604 L609 R610 W616 A617 D620	E604-Y607 VanDerWaalsContact O-CB 3.26Å; E604-Y607 WeakPolarHBondContact O-CB 3.22Å; E604-Y607 PolarHBondContact O-N 3.3Å; E604-Y607 VanDerWaalsContact O-N 3.14Å; Y607-L609 PolarHBondContact O-N 2.86Å; Y607-L609 VanDerWaalsContact O-N 3.11Å; Y607-R610 WeakPolarHBondContact O-CB 3.47Å; Y607-R610 WeakPolarHBondContact O-CG 3.41Å; Y607-R610 PolarHBondContact O-N 3.4Å; Y607-W616 WeakPolarHBondContact OH-CA 3.34Å; Y607-W616 WeakPolarHBondContact OH-CB 3.43Å; Y607-A617 HydrophobicContact CE2-CB 4.4Å; Y607-A617 PolarHBondContact OH-N 3.36Å; Y607-D620 WeakPolarHBondContact CE1-OD2 3.29Å; Y607-D620 WeakPolarHBondContact OH-CB 3.39Å; Y607-D620 PolarHBondContact OH-OD2 2.89Å
608	W	84.6	Confident	83.4	Confident	52 Å²	52	64 Å²	64	20%	0.197	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-68.7	-8	-178.7	-58.3	102.5	0	0	0	114.6	V549 K552 V553 A606 P621	V549-W608 HydrophobicContact CG1-CZ3 4.31Å; V549-W608 HydrophobicContact CG2-CZ3 4.09Å; K552-W608 HydrophobicContact CB-CD2 4.01Å; K552-W608 HydrophobicContact CB-CE3 4.37Å; K552-W608 HydrophobicContact CB-CG 4.33Å; K552-W608 HydrophobicContact CD-CD2 4.32Å; K552-W608 HydrophobicContact CD-CH2 3.97Å; K552-W608 HydrophobicContact CD-CZ2 3.42Å; K552-W608 VanDerWaalsContact CD-CZ2 3.42Å; V553-W608 HydrophobicContact CG2-CE3 4.39Å; A606-W608 VanDerWaalsContact C-N 3.31Å; A606-W608 PolarHBondContact O-N 3.48Å; W608-P621 HydrophobicContact CH2-CG 3.65Å; W608-P621 HydrophobicContact CZ3-CG 4.14Å
609	L	83.6	Confident	83.5	Confident	2 Å²	2	66.5 Å²	66.5	1%	0.01	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-89	-19.7	177.6	-161.7	73.5	0	0	0	112.3	F486 R487 M557 I600 A606 Y607 G611	F486-L609 WeakPolarHBondContact CA-O 3.19Å; F486-L609 HydrophobicContact CD1-CD2 3.56Å; F486-L609 HydrophobicContact CD1-CG 3.76Å; F486-L609 HydrophobicContact CE1-CD2 3.68Å; F486-L609 HydrophobicContact CE1-CG 4.38Å; R487-L609 PolarHBondContact N-O 3.47Å; M557-L609 HydrophobicContact SD-CD1 3.48Å; M557-L609 WeakPolarHBondContact SD-CD1 3.48Å; I600-L609 HydrophobicContact CG2-CD2 3.92Å; A606-L609 VanDerWaalsContact O-CB 3.25Å; A606-L609 WeakPolarHBondContact O-CB 3.46Å; A606-L609 PolarHBondContact O-N 3.4Å; Y607-L609 PolarHBondContact O-N 2.86Å; Y607-L609 VanDerWaalsContact O-N 3.11Å; L609-G611 PolarHBondContact O-N 3.24Å
610	R	86.2	Confident	83.7	Confident	52 Å²	52	59 Å²	59	20%	0.196	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-61.8	117.1	-177.6	-64.2	175.7	-177.3	176.3	4.8	110.5	L601 Y607 W615 W616	L601-R610 HydrophobicContact CD2-CG 4.1Å; L601-R610 HydrophobicContact CG-CG 4.1Å; L601-R610 PolarHBondContact O-NE 3.35Å; L601-R610 PolarHBondContact O-NH2 2.96Å; Y607-R610 WeakPolarHBondContact O-CB 3.47Å; Y607-R610 WeakPolarHBondContact O-CG 3.41Å; Y607-R610 PolarHBondContact O-N 3.4Å; R610-W615 HydrophobicContact CB-CE3 4.49Å; R610-W615 PolarHBondContact NH1-O 2.86Å; R610-W615 VanDerWaalsContact NH1-O 3.09Å; R610-W616 PolarHBondContact O-NE1 3.14Å
611	G	79.1	Confident	84	Confident	15 Å²	15	59.7 Å²	59.7	16%	0.155	31%	0.311	C	S	.	.			trans	-72.2	-56.3	-178.2	0	0	0	0	0	112.6	Y484 D485 L609 R613	Y484-G611 CarbonylContact O-C 3.59Å; D485-G611 PolarHBondContact O-N 3.15Å; L609-G611 PolarHBondContact O-N 3.24Å; G611-R613 PolarHBondContact O-N 3.25Å
612	C	82.9	Confident	84.1	Confident	11 Å²	11	60.1 Å²	60.1	7%	0.074	31%	0.313	C	S	.	.	S	Bend	trans	-66.6	126.2	-176.3	-174.5	0	0	0	0	111.9	Y484 L614 W615 W616	Y484-C612 HydrophobicContact CD2-CB 4.27Å; Y484-C612 HydrophobicContact CE1-CB 4.23Å; Y484-C612 HydrophobicContact CE2-CB 3.98Å; Y484-C612 VanDerWaalsContact CE2-SG 3.51Å; Y484-C612 VanDerWaalsContact CZ-SG 3.58Å; Y484-C612 WeakPolarHBondContact O-CA 3.24Å; Y484-C612 VanDerWaalsContact O-CB 3.32Å; Y484-C612 WeakPolarHBondContact O-CB 3.44Å; Y484-C612 PolarHBondContact O-N 3.26Å; C612-L614 PolarHBondContact O-N 3.37Å; C612-W615 HydrophobicContact CB-CD2 4.2Å; C612-W615 HydrophobicContact CB-CE3 4.17Å; C612-W615 HydrophobicContact CB-CZ3 4.4Å; C612-W615 PolarHBondContact O-N 3.47Å; C612-W616 PolarHBondContact O-NE1 2.9Å
613	R	83.7	Confident	84.5	Confident	101 Å²	101	57.5 Å²	57.5	38%	0.381	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-58.2	-32.4	179.7	-63.9	-170.7	160.9	-160.8	-17	112.1	G611 W615 W616 E622 Y623 D626	G611-R613 PolarHBondContact O-N 3.25Å; R613-W615 PolarHBondContact O-N 2.96Å; R613-W615 VanDerWaalsContact O-N 3.1Å; R613-W616 HydrophobicContact CB-CD2 4.44Å; R613-W616 HydrophobicContact CB-CE3 4.25Å; R613-W616 HydrophobicContact CB-CH2 4.46Å; R613-W616 HydrophobicContact CB-CZ3 4.28Å; R613-W616 HydrophobicContact CG-CE3 4.19Å; R613-W616 HydrophobicContact CG-CH2 3.6Å; R613-W616 HydrophobicContact CG-CZ2 3.97Å; R613-W616 HydrophobicContact CG-CZ3 3.72Å; R613-W616 WeakPolarHBondContact O-CB 3.5Å; R613-W616 PolarHBondContact O-N 3.15Å; R613-W616 VanDerWaalsContact O-N 3.07Å; R613-E622 IonicContact CZ-OE1 2.68Å; R613-E622 IonicContact NE-OE1 3.66Å; R613-E622 IonicContact NH2-OE1 2.8Å; R613-E622 PolarHBondContact NH2-OE1 2.95Å; R613-Y623 HydrophobicContact CB-CE1 4.24Å; R613-Y623 WeakPolarHBondContact CB-OH 3.43Å; R613-Y623 PolarHBondContact O-OH 3.26Å; R613-D626 IonicContact CZ-OD2 3.46Å; R613-D626 IonicContact NH1-OD2 2.67Å; R613-D626 PolarHBondContact NH1-OD2 3.47Å; R613-D626 IonicContact NH2-OD2 2.9Å; R613-D626 PolarHBondContact NH2-OD2 3.25Å
614	L	82.7	Confident	84.9	Confident	143 Å²	143	58.4 Å²	58.4	75%	0.749	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-64.7	-16.1	-178.2	-75.3	79.5	0	0	0	113.9	C612	C612-L614 PolarHBondContact O-N 3.37Å
615	W	82.2	Confident	85.4	Confident	76 Å²	76	49.8 Å²	49.8	29%	0.288	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-95.1	4.7	177.2	-59.4	-22	0	0	0	114	Y484 D485 R597 L601 R610 C612 R613	Y484-W615 HydrophobicContact CE1-CH2 4.17Å; Y484-W615 HydrophobicContact CE1-CZ2 4.11Å; D485-W615 WeakPolarHBondContact OD1-CH2 3.36Å; R597-W615 VanDerWaalsContact CZ-CH2 3.43Å; R597-W615 VanDerWaalsContact NH2-CZ2 3.32Å; L601-W615 HydrophobicContact CD2-CE3 3.62Å; L601-W615 HydrophobicContact CD2-CH2 4.38Å; L601-W615 HydrophobicContact CD2-CZ3 3.38Å; R610-W615 HydrophobicContact CB-CE3 4.49Å; R610-W615 PolarHBondContact NH1-O 2.86Å; R610-W615 VanDerWaalsContact NH1-O 3.09Å; C612-W615 HydrophobicContact CB-CD2 4.2Å; C612-W615 HydrophobicContact CB-CE3 4.17Å; C612-W615 HydrophobicContact CB-CZ3 4.4Å; C612-W615 PolarHBondContact O-N 3.47Å; R613-W615 PolarHBondContact O-N 2.96Å; R613-W615 VanDerWaalsContact O-N 3.1Å
616	W	86.4	Confident	85.9	Confident	22 Å²	22	48.7 Å²	48.7	8%	0.083	25%	0.245	C	C	.	.	S	Bend	trans	-85.7	152.5	176.6	-59.3	-7.4	0	0	0	110.4	Y607 R610 C612 R613 D620 E622 Y623	Y607-W616 WeakPolarHBondContact OH-CA 3.34Å; Y607-W616 WeakPolarHBondContact OH-CB 3.43Å; R610-W616 PolarHBondContact O-NE1 3.14Å; C612-W616 PolarHBondContact O-NE1 2.9Å; R613-W616 HydrophobicContact CB-CD2 4.44Å; R613-W616 HydrophobicContact CB-CE3 4.25Å; R613-W616 HydrophobicContact CB-CH2 4.46Å; R613-W616 HydrophobicContact CB-CZ3 4.28Å; R613-W616 HydrophobicContact CG-CE3 4.19Å; R613-W616 HydrophobicContact CG-CH2 3.6Å; R613-W616 HydrophobicContact CG-CZ2 3.97Å; R613-W616 HydrophobicContact CG-CZ3 3.72Å; R613-W616 WeakPolarHBondContact O-CB 3.5Å; R613-W616 PolarHBondContact O-N 3.15Å; R613-W616 VanDerWaalsContact O-N 3.07Å; W616-D620 HydrophobicContact CB-CB 4.16Å; W616-E622 HydrophobicContact CE3-CB 4.49Å; W616-E622 VanDerWaalsContact CH2-CD 3.43Å; W616-E622 HydrophobicContact CH2-CG 4.37Å; W616-E622 WeakPolarHBondContact CH2-OE1 3.13Å; W616-E622 WeakPolarHBondContact CH2-OE2 3.42Å; W616-E622 HydrophobicContact CZ3-CB 3.91Å; W616-E622 VanDerWaalsContact CZ3-CD 3.49Å; W616-E622 HydrophobicContact CZ3-CG 3.93Å; W616-Y623 HydrophobicContact CB-CD2 4.39Å; W616-Y623 HydrophobicContact CB-CE2 3.73Å; W616-Y623 HydrophobicContact CE3-CD2 4.29Å; W616-Y623 HydrophobicContact CE3-CE1 4.36Å; W616-Y623 HydrophobicContact CE3-CE2 4Å
617	A	86.6	Confident	86.4	Confident	33 Å²	33	52.4 Å²	52.4	27%	0.273	27%	0.27	S	S	.	.			trans	-67.3	152.4	173.3	0	0	0	0	0	110.1	Y607 D619 D620	Y607-A617 HydrophobicContact CE2-CB 4.4Å; Y607-A617 PolarHBondContact OH-N 3.36Å; A617-D619 WeakPolarHBondContact CB-OD1 3.37Å; A617-D619 PolarHBondContact O-N 2.95Å; A617-D620 WeakPolarHBondContact O-CB 3.37Å; A617-D620 PolarHBondContact O-N 3.22Å; A617-D620 VanDerWaalsContact O-N 3.07Å
618	P	84.2	Confident	86.8	Confident	124 Å²	124	52.3 Å²	52.3	81%	0.805	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-22.2	179.7	26.7	-35.1	0	0	0	113.2
619	D	85.3	Confident	87.2	Confident	113 Å²	113	50.6 Å²	50.6	60%	0.604	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	15.7	176.3	63.6	-39.5	0	0	0	113.3	A617	A617-D619 WeakPolarHBondContact CB-OD1 3.37Å; A617-D619 PolarHBondContact O-N 2.95Å
620	D	89.8	Confident	87.6	Confident	4 Å²	4	53 Å²	53	2%	0.021	29%	0.286	C	S	.	.			trans	-56.2	127.9	176	-166	-47.7	0	0	0	110.5	Y607 W616 A617 E622 Y623 I624	Y607-D620 WeakPolarHBondContact CE1-OD2 3.29Å; Y607-D620 WeakPolarHBondContact OH-CB 3.39Å; Y607-D620 PolarHBondContact OH-OD2 2.89Å; W616-D620 HydrophobicContact CB-CB 4.16Å; A617-D620 WeakPolarHBondContact O-CB 3.37Å; A617-D620 PolarHBondContact O-N 3.22Å; A617-D620 VanDerWaalsContact O-N 3.07Å; D620-E622 PolarHBondContact O-N 3.4Å; D620-E622 VanDerWaalsContact O-N 3.11Å; D620-E622 PolarHBondContact OD1-N 3.4Å; D620-Y623 HydrophobicContact CB-CD2 3.8Å; D620-Y623 HydrophobicContact CB-CG 4.48Å; D620-Y623 PolarHBondContact O-N 3.05Å; D620-I624 PolarHBondContact O-N 2.93Å; D620-I624 VanDerWaalsContact O-N 3.12Å
621	P	89.5	Confident	88	Confident	30 Å²	30	55.3 Å²	55.3	20%	0.195	30%	0.302	C	S	.	.	H	α-helix	trans	-56.3	-26.8	177.3	22.9	-35.5	0	0	0	114	L545 V549 W608 S625	L545-P621 HydrophobicContact CD2-CB 3.9Å; V549-P621 HydrophobicContact CG2-CB 4Å; V549-P621 HydrophobicContact CG2-CG 3.72Å; W608-P621 HydrophobicContact CH2-CG 3.65Å; W608-P621 HydrophobicContact CZ3-CG 4.14Å; P621-S625 VanDerWaalsContact O-CB 3.25Å; P621-S625 WeakPolarHBondContact O-CB 3.41Å; P621-S625 PolarHBondContact O-N 2.93Å
622	E	87.3	Confident	88.7	Confident	20 Å²	20	54.6 Å²	54.6	9%	0.093	30%	0.295	C	S	.	.	H	α-helix	trans	-69	-43.7	175.3	-169.1	172.3	146.4	0	0	111.6	R487 R613 W616 D620 I624 S625 D626	R487-E622 IonicContact CZ-OE2 2.74Å; R487-E622 IonicContact NH1-OE2 3.93Å; R487-E622 PolarHBondContact NH1-OE2 2.91Å; R487-E622 VanDerWaalsContact NH1-OE2 3.08Å; R487-E622 IonicContact NH2-OE1 2.87Å; R487-E622 IonicContact NH2-OE2 3.75Å; R487-E622 PolarHBondContact NH2-OE2 3.33Å; R613-E622 IonicContact CZ-OE1 2.68Å; R613-E622 IonicContact NE-OE1 3.66Å; R613-E622 IonicContact NH2-OE1 2.8Å; R613-E622 PolarHBondContact NH2-OE1 2.95Å; W616-E622 HydrophobicContact CE3-CB 4.49Å; W616-E622 VanDerWaalsContact CH2-CD 3.43Å; W616-E622 HydrophobicContact CH2-CG 4.37Å; W616-E622 WeakPolarHBondContact CH2-OE1 3.13Å; W616-E622 WeakPolarHBondContact CH2-OE2 3.42Å; W616-E622 HydrophobicContact CZ3-CB 3.91Å; W616-E622 VanDerWaalsContact CZ3-CD 3.49Å; W616-E622 HydrophobicContact CZ3-CG 3.93Å; D620-E622 PolarHBondContact O-N 3.4Å; D620-E622 VanDerWaalsContact O-N 3.11Å; D620-E622 PolarHBondContact OD1-N 3.4Å; E622-I624 PolarHBondContact O-N 3.28Å; E622-S625 WeakPolarHBondContact O-CB 3.38Å; E622-S625 PolarHBondContact O-N 3.36Å; E622-S625 VanDerWaalsContact O-N 3.15Å; E622-S625 PolarHBondContact O-OG 3.43Å; E622-D626 PolarHBondContact O-N 3.47Å
623	Y	89	Confident	89.1	Confident	70 Å²	70	54.8 Å²	54.8	28%	0.275	30%	0.295	S	S	.	.	H	α-helix	trans	-61.2	-45.7	174.9	-79.2	-46.9	0	0	0	111.9	R613 W616 D620 S625 D626 C627	R613-Y623 HydrophobicContact CB-CE1 4.24Å; R613-Y623 WeakPolarHBondContact CB-OH 3.43Å; R613-Y623 PolarHBondContact O-OH 3.26Å; W616-Y623 HydrophobicContact CB-CD2 4.39Å; W616-Y623 HydrophobicContact CB-CE2 3.73Å; W616-Y623 HydrophobicContact CE3-CD2 4.29Å; W616-Y623 HydrophobicContact CE3-CE1 4.36Å; W616-Y623 HydrophobicContact CE3-CE2 4Å; D620-Y623 HydrophobicContact CB-CD2 3.8Å; D620-Y623 HydrophobicContact CB-CG 4.48Å; D620-Y623 PolarHBondContact O-N 3.05Å; Y623-S625 VanDerWaalsContact C-N 3.26Å; Y623-S625 PolarHBondContact O-N 2.64Å; Y623-D626 PolarHBondContact O-N 3.44Å; Y623-C627 PolarHBondContact O-N 2.89Å; Y623-C627 PolarHBondContact O-SG 2.96Å
624	I	91.7	Very high	89.6	Confident	73 Å²	73	54.8 Å²	54.8	37%	0.374	31%	0.306	S	S	.	.	H	α-helix	trans	-60.6	-42.6	176	-61.7	172.4	0	0	0	109.3	L545 D620 E622 D626 C627 L628	L545-I624 HydrophobicContact CD1-CB 4.25Å; L545-I624 HydrophobicContact CD1-CG2 3.88Å; D620-I624 PolarHBondContact O-N 2.93Å; D620-I624 VanDerWaalsContact O-N 3.12Å; E622-I624 PolarHBondContact O-N 3.28Å; I624-D626 PolarHBondContact O-N 2.88Å; I624-C627 PolarHBondContact O-N 3.49Å; I624-L628 HydrophobicContact CG2-CD1 3.9Å; I624-L628 HydrophobicContact CG2-CG 4.27Å; I624-L628 WeakPolarHBondContact O-CB 3.21Å; I624-L628 VanDerWaalsContact O-CG 3.22Å; I624-L628 WeakPolarHBondContact O-CG 3.24Å; I624-L628 PolarHBondContact O-N 2.83Å
625	S	91.3	Very high	90.1	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-62.6	-38.8	177.7	83.7	0	0	0	0	113.3	S542 P621 E622 Y623 F629	S542-S625 WeakPolarHBondContact CB-O 3.36Å; S542-S625 PolarHBondContact OG-O 3.5Å; P621-S625 VanDerWaalsContact O-CB 3.25Å; P621-S625 WeakPolarHBondContact O-CB 3.41Å; P621-S625 PolarHBondContact O-N 2.93Å; E622-S625 WeakPolarHBondContact O-CB 3.38Å; E622-S625 PolarHBondContact O-N 3.36Å; E622-S625 VanDerWaalsContact O-N 3.15Å; E622-S625 PolarHBondContact O-OG 3.43Å; Y623-S625 VanDerWaalsContact C-N 3.26Å; Y623-S625 PolarHBondContact O-N 2.64Å; S625-F629 VanDerWaalsContact O-CB 3.25Å; S625-F629 WeakPolarHBondContact O-CB 3.28Å; S625-F629 PolarHBondContact O-N 3.36Å
626	D	89.5	Confident	90.5	Very high	41 Å²	41	46.8 Å²	46.8	22%	0.219	27%	0.27	C	S	.	.	H	α-helix	trans	-70.5	-39.7	178.3	-81	-7.4	0	0	0	110.5	R546 R613 E622 Y623 I624 F629 A630	R546-D626 IonicContact CZ-OD1 3.4Å; R546-D626 IonicContact NE-OD1 2.81Å; R546-D626 IonicContact NH2-OD1 2.82Å; R546-D626 PolarHBondContact NH2-OD1 3.17Å; R613-D626 IonicContact CZ-OD2 3.46Å; R613-D626 IonicContact NH1-OD2 2.67Å; R613-D626 PolarHBondContact NH1-OD2 3.47Å; R613-D626 IonicContact NH2-OD2 2.9Å; R613-D626 PolarHBondContact NH2-OD2 3.25Å; E622-D626 PolarHBondContact O-N 3.47Å; Y623-D626 PolarHBondContact O-N 3.44Å; I624-D626 PolarHBondContact O-N 2.88Å; D626-F629 PolarHBondContact O-N 3.21Å; D626-A630 WeakPolarHBondContact O-CB 3.37Å; D626-A630 PolarHBondContact O-N 3.35Å
627	C	92.9	Very high	90.8	Very high	78 Å²	78	49.8 Å²	49.8	53%	0.527	28%	0.283	S	S	.	.	H	α-helix	trans	-62	-48	173.3	-65.6	0	0	0	0	111.8	Y623 I624 F629 A630 L631	Y623-C627 PolarHBondContact O-N 2.89Å; Y623-C627 PolarHBondContact O-SG 2.96Å; I624-C627 PolarHBondContact O-N 3.49Å; C627-F629 VanDerWaalsContact C-N 3.32Å; C627-F629 PolarHBondContact O-N 3.28Å; C627-A630 PolarHBondContact O-N 2.74Å; C627-L631 WeakPolarHBondContact O-CG 3.47Å; C627-L631 PolarHBondContact O-N 3Å
628	L	94.6	Very high	90.9	Very high	39 Å²	39	51 Å²	51	20%	0.204	29%	0.29	C	S	.	.	H	α-helix	trans	-63.6	-39.1	177.5	-66.8	172.9	0	0	0	111.5	L538 A541 L545 I624 G632	L538-L628 HydrophobicContact CD2-CD2 3.53Å; A541-L628 HydrophobicContact CB-CD1 3.94Å; L545-L628 HydrophobicContact CD1-CD1 4.17Å; I624-L628 HydrophobicContact CG2-CD1 3.9Å; I624-L628 HydrophobicContact CG2-CG 4.27Å; I624-L628 WeakPolarHBondContact O-CB 3.21Å; I624-L628 VanDerWaalsContact O-CG 3.22Å; I624-L628 WeakPolarHBondContact O-CG 3.24Å; I624-L628 PolarHBondContact O-N 2.83Å; L628-G632 PolarHBondContact O-N 2.96Å
629	F	92.2	Very high	91.2	Very high	16 Å²	16	46.6 Å²	46.6	7%	0.07	26%	0.258	C	S	.	.	H	α-helix	trans	-63.6	-43	175.5	-171.1	-106.6	0	0	0	111.7	Y539 Y543 S625 D626 C627 G632 N633	Y539-F629 AromaticContact CD1-CD2 3.83Å; Y539-F629 HydrophobicContact CD1-CD2 3.83Å; Y539-F629 HydrophobicContact CD1-CE2 4.01Å; Y539-F629 AromaticContact CE1-CD2 3.77Å; Y539-F629 HydrophobicContact CE1-CD2 3.77Å; Y539-F629 AromaticContact CE1-CE2 3.74Å; Y539-F629 HydrophobicContact CE1-CE2 3.74Å; Y543-F629 HydrophobicContact CE2-CD2 4.41Å; Y543-F629 HydrophobicContact CE2-CE2 4.12Å; S625-F629 VanDerWaalsContact O-CB 3.25Å; S625-F629 WeakPolarHBondContact O-CB 3.28Å; S625-F629 PolarHBondContact O-N 3.36Å; D626-F629 PolarHBondContact O-N 3.21Å; C627-F629 VanDerWaalsContact C-N 3.32Å; C627-F629 PolarHBondContact O-N 3.28Å; F629-G632 PolarHBondContact O-N 2.8Å; F629-N633 WeakPolarHBondContact CD1-ND2 3.5Å; F629-N633 WeakPolarHBondContact CE1-ND2 3.42Å; F629-N633 PolarHBondContact O-N 3.17Å; F629-N633 PolarHBondContact O-ND2 3.16Å; F629-N633 PolarHBondContact O-OD1 3.39Å
630	A	92.4	Very high	91.3	Very high	51 Å²	51	44.1 Å²	44.1	42%	0.421	24%	0.243	S	C	.	.	H	α-helix	trans	-63.5	-46	177.9	0	0	0	0	0	111.8	D626 C627 G632 N633 V634	D626-A630 WeakPolarHBondContact O-CB 3.37Å; D626-A630 PolarHBondContact O-N 3.35Å; C627-A630 PolarHBondContact O-N 2.74Å; A630-G632 VanDerWaalsContact C-N 3.33Å; A630-G632 PolarHBondContact O-N 3.23Å; A630-N633 WeakPolarHBondContact O-CB 3.41Å; A630-N633 PolarHBondContact O-N 3.48Å; A630-V634 PolarHBondContact O-N 2.8Å; A630-V634 VanDerWaalsContact O-N 3.11Å
631	L	94.5	Very high	91.1	Very high	101 Å²	101	45.3 Å²	45.3	53%	0.529	25%	0.252	S	S	.	.	H	α-helix	trans	-61	-42.8	174.2	-69.3	175	0	0	0	111.8	L538 C627 N633 V634 L635	L538-L631 HydrophobicContact CD1-CB 4Å; C627-L631 WeakPolarHBondContact O-CG 3.47Å; C627-L631 PolarHBondContact O-N 3Å; L631-N633 VanDerWaalsContact C-N 3.31Å; L631-N633 PolarHBondContact O-N 3.16Å; L631-V634 PolarHBondContact O-N 3.34Å; L631-L635 PolarHBondContact O-N 3.07Å
632	G	93.4	Very high	90.9	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-57.7	-42.7	174	0	0	0	0	0	112.2	Y539 L628 F629 A630 L635 S636	Y539-G632 VanDerWaalsContact OH-C 3.29Å; Y539-G632 PolarHBondContact OH-O 3.49Å; L628-G632 PolarHBondContact O-N 2.96Å; F629-G632 PolarHBondContact O-N 2.8Å; A630-G632 VanDerWaalsContact C-N 3.33Å; A630-G632 PolarHBondContact O-N 3.23Å; G632-L635 PolarHBondContact O-N 3.48Å; G632-S636 WeakPolarHBondContact O-CB 3.39Å; G632-S636 PolarHBondContact O-N 3.46Å; G632-S636 PolarHBondContact O-OG 3.47Å
633	N	92.2	Very high	90.7	Very high	16 Å²	16	45.6 Å²	45.6	9%	0.086	25%	0.25	C	C	.	.	H	α-helix	trans	-63.6	-42.9	178.1	-67.6	-19.5	0	0	0	112.6	I455 Y539 F629 A630 L631 L635 S636 F637	I455-N633 HydrophobicContact CG2-CB 4.32Å; Y539-N633 WeakPolarHBondContact CE1-OD1 3.32Å; Y539-N633 WeakPolarHBondContact OH-CA 3.22Å; Y539-N633 PolarHBondContact OH-N 3.09Å; Y539-N633 PolarHBondContact OH-OD1 3.29Å; F629-N633 WeakPolarHBondContact CD1-ND2 3.5Å; F629-N633 WeakPolarHBondContact CE1-ND2 3.42Å; F629-N633 PolarHBondContact O-N 3.17Å; F629-N633 PolarHBondContact O-ND2 3.16Å; F629-N633 PolarHBondContact O-OD1 3.39Å; A630-N633 WeakPolarHBondContact O-CB 3.41Å; A630-N633 PolarHBondContact O-N 3.48Å; L631-N633 VanDerWaalsContact C-N 3.31Å; L631-N633 PolarHBondContact O-N 3.16Å; N633-L635 PolarHBondContact O-N 2.88Å; N633-S636 WeakPolarHBondContact O-CB 3.49Å; N633-S636 PolarHBondContact O-N 2.81Å; N633-F637 VanDerWaalsContact O-CD2 3.28Å; N633-F637 WeakPolarHBondContact O-CD2 3.47Å; N633-F637 PolarHBondContact O-N 2.98Å
634	V	93.6	Very high	90.5	Very high	100 Å²	100	45.4 Å²	45.4	61%	0.606	25%	0.252	S	S	*	.	H	α-helix	trans	-59.3	-47.1	176.8	174.2	0	0	0	0	110.9	A630 L631 S636 F637 S638	A630-V634 PolarHBondContact O-N 2.8Å; A630-V634 VanDerWaalsContact O-N 3.11Å; L631-V634 PolarHBondContact O-N 3.34Å; V634-S636 VanDerWaalsContact C-N 3.32Å; V634-S636 PolarHBondContact O-N 2.97Å; V634-F637 PolarHBondContact O-N 3.49Å; V634-S638 WeakPolarHBondContact O-CB 3.35Å; V634-S638 PolarHBondContact O-N 2.99Å
635	L	93.2	Very high	90.1	Very high	47 Å²	47	42.5 Å²	42.5	25%	0.246	24%	0.239	C	C	.	.	H	α-helix	trans	-63.7	-39.3	176.1	-66.1	179.9	0	0	0	111.8	M531 V534 L538 L631 G632 N633 F637 S638 R639	M531-L635 HydrophobicContact CG-CB 4.47Å; M531-L635 HydrophobicContact CG-CD2 4.25Å; V534-L635 HydrophobicContact CB-CD1 4.34Å; V534-L635 HydrophobicContact CG1-CD1 3.66Å; L538-L635 HydrophobicContact CD1-CD1 3.85Å; L631-L635 PolarHBondContact O-N 3.07Å; G632-L635 PolarHBondContact O-N 3.48Å; N633-L635 PolarHBondContact O-N 2.88Å; L635-F637 VanDerWaalsContact C-N 3.33Å; L635-F637 PolarHBondContact O-N 3.44Å; L635-S638 WeakPolarHBondContact O-CB 3.34Å; L635-S638 PolarHBondContact O-N 3.2Å; L635-R639 WeakPolarHBondContact O-CB 3.38Å; L635-R639 PolarHBondContact O-N 3.36Å
636	S	91.2	Very high	89.6	Confident	5 Å²	5	43.9 Å²	43.9	4%	0.035	25%	0.25	C	C	.	.	H	α-helix	trans	-61.3	-37.5	175.4	-69.6	0	0	0	0	112.7	Y448 Y539 G632 N633 V634	Y448-S636 PolarHBondContact OH-O 3.19Å; Y539-S636 WeakPolarHBondContact CE2-OG 3.1Å; Y539-S636 WeakPolarHBondContact OH-CB 3.44Å; Y539-S636 PolarHBondContact OH-OG 3.34Å; G632-S636 WeakPolarHBondContact O-CB 3.39Å; G632-S636 PolarHBondContact O-N 3.46Å; G632-S636 PolarHBondContact O-OG 3.47Å; N633-S636 WeakPolarHBondContact O-CB 3.49Å; N633-S636 PolarHBondContact O-N 2.81Å; V634-S636 VanDerWaalsContact C-N 3.32Å; V634-S636 PolarHBondContact O-N 2.97Å
637	F	91.9	Very high	89.2	Confident	84 Å²	84	49.6 Å²	49.6	37%	0.368	27%	0.269	S	S	.	.	H	α-helix	trans	-74.4	-39.5	173.6	-81.6	-78.8	0	0	0	112.4	L452 I455 T456 N633 V634 L635 R639 I640	L452-F637 HydrophobicContact CB-CE1 4.05Å; L452-F637 HydrophobicContact CB-CZ 4.32Å; L452-F637 HydrophobicContact CD1-CD1 4.28Å; L452-F637 HydrophobicContact CD1-CE1 4.32Å; L452-F637 HydrophobicContact CD2-CD1 3.9Å; L452-F637 HydrophobicContact CD2-CD2 4.36Å; L452-F637 HydrophobicContact CD2-CE1 3.88Å; L452-F637 HydrophobicContact CD2-CE2 4.34Å; L452-F637 HydrophobicContact CD2-CG 4.13Å; L452-F637 HydrophobicContact CD2-CZ 4.08Å; L452-F637 HydrophobicContact CG-CE1 4.31Å; I455-F637 HydrophobicContact CG2-CE2 4.13Å; T456-F637 HydrophobicContact CG2-CE1 4.36Å; T456-F637 HydrophobicContact CG2-CZ 3.64Å; N633-F637 VanDerWaalsContact O-CD2 3.28Å; N633-F637 WeakPolarHBondContact O-CD2 3.47Å; N633-F637 PolarHBondContact O-N 2.98Å; V634-F637 PolarHBondContact O-N 3.49Å; L635-F637 VanDerWaalsContact C-N 3.33Å; L635-F637 PolarHBondContact O-N 3.44Å; F637-R639 PolarHBondContact O-N 2.73Å; F637-I640 HydrophobicContact CD1-CD1 4.25Å; F637-I640 WeakPolarHBondContact O-CB 2.96Å; F637-I640 WeakPolarHBondContact O-CG1 3.48Å; F637-I640 PolarHBondContact O-N 2.91Å; F637-I640 VanDerWaalsContact O-N 3.15Å
638	S	89.9	Confident	88.7	Confident	59 Å²	59	51.6 Å²	51.6	41%	0.413	27%	0.27	S	S	.	.	H	α-helix	trans	-58.1	-31.4	176.2	-178.8	0	0	0	0	112.4	V634 L635 I640 S641	V634-S638 WeakPolarHBondContact O-CB 3.35Å; V634-S638 PolarHBondContact O-N 2.99Å; L635-S638 WeakPolarHBondContact O-CB 3.34Å; L635-S638 PolarHBondContact O-N 3.2Å; S638-I640 PolarHBondContact O-N 3.37Å; S638-S641 WeakPolarHBondContact O-CB 3.12Å; S638-S641 PolarHBondContact O-N 2.99Å; S638-S641 PolarHBondContact O-OG 3.06Å
639	R	90.1	Very high	88.1	Confident	32 Å²	32	56.9 Å²	56.9	12%	0.121	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-64.4	-17	179.7	172.9	66.5	169.3	136.8	-3.9	114.1	Y448 M531 D532 L635 F637 S641 Y642	Y448-R639 HydrophobicContact CE2-CG 4.02Å; Y448-R639 WeakPolarHBondContact OH-CA 3.43Å; Y448-R639 WeakPolarHBondContact OH-CB 3.31Å; Y448-R639 VanDerWaalsContact OH-CG 3.25Å; Y448-R639 WeakPolarHBondContact OH-CG 3.39Å; M531-R639 HydrophobicContact SD-CB 3.96Å; D532-R639 WeakPolarHBondContact OD1-CD 3.24Å; D532-R639 WeakPolarHBondContact OD1-CG 3.39Å; D532-R639 IonicContact OD1-CZ 3.49Å; D532-R639 IonicContact OD1-NE 2.8Å; D532-R639 PolarHBondContact OD1-NE 3.26Å; D532-R639 IonicContact OD1-NH2 3.08Å; D532-R639 IonicContact OD2-CZ 3.85Å; D532-R639 IonicContact OD2-NE 2.81Å; D532-R639 PolarHBondContact OD2-NE 3.16Å; D532-R639 IonicContact OD2-NH2 3.99Å; D532-R639 PolarHBondContact OD2-NH2 2.89Å; L635-R639 WeakPolarHBondContact O-CB 3.38Å; L635-R639 PolarHBondContact O-N 3.36Å; F637-R639 PolarHBondContact O-N 2.73Å; R639-S641 PolarHBondContact O-N 3.32Å; R639-S641 VanDerWaalsContact O-N 3.17Å; R639-Y642 VanDerWaalsContact NH1-CD2 3.25Å; R639-Y642 WeakPolarHBondContact O-CB 3.41Å; R639-Y642 PolarHBondContact O-N 2.96Å; R639-Y642 VanDerWaalsContact O-N 3.14Å
640	I	87.2	Confident	87.7	Confident	60 Å²	60	59.1 Å²	59.1	31%	0.308	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-57.1	-30.6	169.4	-61.8	169.3	0	0	0	111.2	Y448 L452 F637 S638 Y642 L643	Y448-I640 HydrophobicContact CE1-CB 4.44Å; Y448-I640 HydrophobicContact CE1-CG1 3.71Å; Y448-I640 PolarHBondContact OH-N 3.14Å; L452-I640 HydrophobicContact CD1-CD1 3.34Å; L452-I640 HydrophobicContact CD1-CG1 3.46Å; L452-I640 VanDerWaalsContact CD1-CG1 3.46Å; F637-I640 HydrophobicContact CD1-CD1 4.25Å; F637-I640 WeakPolarHBondContact O-CB 2.96Å; F637-I640 WeakPolarHBondContact O-CG1 3.48Å; F637-I640 PolarHBondContact O-N 2.91Å; F637-I640 VanDerWaalsContact O-N 3.15Å; S638-I640 PolarHBondContact O-N 3.37Å; I640-Y642 PolarHBondContact O-N 3.43Å; I640-L643 WeakPolarHBondContact O-CB 3.42Å; I640-L643 PolarHBondContact O-N 3.4Å
641	S	85.6	Confident	87.3	Confident	30 Å²	30	56.7 Å²	56.7	21%	0.21	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-53.2	-30.7	178.2	64.5	0	0	0	0	112.6	S638 R639 L643 M644 P645 Q654	S638-S641 WeakPolarHBondContact O-CB 3.12Å; S638-S641 PolarHBondContact O-N 2.99Å; S638-S641 PolarHBondContact O-OG 3.06Å; R639-S641 PolarHBondContact O-N 3.32Å; R639-S641 VanDerWaalsContact O-N 3.17Å; S641-L643 PolarHBondContact O-N 3.27Å; S641-L643 VanDerWaalsContact O-N 3.14Å; S641-M644 WeakPolarHBondContact O-CB 3.07Å; S641-M644 PolarHBondContact O-N 3.11Å; S641-M644 VanDerWaalsContact O-N 3.16Å; S641-P645 WeakPolarHBondContact O-CD 3.28Å; S641-Q654 VanDerWaalsContact C-NE2 3.32Å; S641-Q654 PolarHBondContact O-NE2 3.03Å; S641-Q654 PolarHBondContact O-OE1 3.46Å
642	Y	84.5	Confident	86.9	Confident	39 Å²	39	52.3 Å²	52.3	15%	0.153	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-64.9	-19.5	177.1	177.1	-108.1	0	0	0	115	Y528 R639 I640 P645 L809	Y528-Y642 HydrophobicContact CD1-CD2 4.1Å; Y528-Y642 HydrophobicContact CD1-CG 4.48Å; Y528-Y642 AromaticContact CD2-CD2 3.67Å; Y528-Y642 HydrophobicContact CD2-CD2 3.67Å; Y528-Y642 HydrophobicContact CD2-CE2 4.24Å; Y528-Y642 HydrophobicContact CE2-CD2 4.13Å; Y528-Y642 AromaticContact CG-CD2 3.66Å; Y528-Y642 HydrophobicContact CG-CD2 3.66Å; Y528-Y642 HydrophobicContact CG-CE2 4.43Å; Y528-Y642 HydrophobicContact CG-CG 4.41Å; R639-Y642 VanDerWaalsContact NH1-CD2 3.25Å; R639-Y642 WeakPolarHBondContact O-CB 3.41Å; R639-Y642 PolarHBondContact O-N 2.96Å; R639-Y642 VanDerWaalsContact O-N 3.14Å; I640-Y642 PolarHBondContact O-N 3.43Å; Y642-P645 VanDerWaalsContact O-CD 3.24Å; Y642-P645 WeakPolarHBondContact O-CD 3.46Å; Y642-L809 HydrophobicContact CD1-CD1 4.31Å; Y642-L809 HydrophobicContact CE1-CD1 3.51Å; Y642-L809 HydrophobicContact CE2-CD1 4.34Å; Y642-L809 WeakPolarHBondContact OH-CD1 3.21Å
643	L	83.6	Confident	86.5	Confident	16 Å²	16	55.7 Å²	55.7	8%	0.084	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-91.8	-16	-179.2	-53.7	170.8	0	0	0	111.6	F441 M445 Y448 I640 S641 A646	F441-L643 HydrophobicContact CE2-CD2 4.2Å; M445-L643 HydrophobicContact CE-CB 3.92Å; M445-L643 HydrophobicContact CE-CD1 3.71Å; M445-L643 HydrophobicContact CE-CG 4.21Å; M445-L643 HydrophobicContact SD-CB 3.64Å; M445-L643 HydrophobicContact SD-CD1 3.17Å; M445-L643 WeakPolarHBondContact SD-CD1 3.32Å; M445-L643 HydrophobicContact SD-CD2 3.23Å; M445-L643 WeakPolarHBondContact SD-CD2 3.21Å; M445-L643 HydrophobicContact SD-CG 3.43Å; M445-L643 WeakPolarHBondContact SD-CG 3.49Å; Y448-L643 HydrophobicContact CD1-CD1 3.81Å; Y448-L643 HydrophobicContact CE1-CD1 4.08Å; I640-L643 WeakPolarHBondContact O-CB 3.42Å; I640-L643 PolarHBondContact O-N 3.4Å; S641-L643 PolarHBondContact O-N 3.27Å; S641-L643 VanDerWaalsContact O-N 3.14Å; L643-A646 VanDerWaalsContact O-CB 3.29Å; L643-A646 WeakPolarHBondContact O-CB 3.46Å; L643-A646 PolarHBondContact O-N 2.92Å; L643-A646 VanDerWaalsContact O-N 3.14Å
644	M	84.6	Confident	86.2	Confident	66 Å²	66	56.1 Å²	56.1	33%	0.325	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-64.1	-29.2	179	-71.7	-161.8	176.3	0	0	114.8	S641 A646 W647 L650 G651	S641-M644 WeakPolarHBondContact O-CB 3.07Å; S641-M644 PolarHBondContact O-N 3.11Å; S641-M644 VanDerWaalsContact O-N 3.16Å; M644-A646 PolarHBondContact O-N 3.32Å; M644-A646 VanDerWaalsContact O-N 3.15Å; M644-W647 WeakPolarHBondContact O-CB 3.43Å; M644-W647 PolarHBondContact O-N 3.44Å; M644-L650 HydrophobicContact CB-CB 4.35Å; M644-L650 HydrophobicContact CE-CD1 4.28Å; M644-L650 HydrophobicContact SD-CB 4.3Å; M644-L650 HydrophobicContact SD-CD1 4.23Å; M644-G651 VanDerWaalsContact O-CA 3.31Å; M644-G651 WeakPolarHBondContact O-CA 3.33Å; M644-G651 PolarHBondContact O-N 3.28Å
645	P	83.8	Confident	85.8	Confident	13 Å²	13	52.5 Å²	52.5	8%	0.084	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-62.1	-20	171.8	-23.5	36.3	0	0	0	113.9	S641 Y642 W647 W802 A805	S641-P645 WeakPolarHBondContact O-CD 3.28Å; Y642-P645 VanDerWaalsContact O-CD 3.24Å; Y642-P645 WeakPolarHBondContact O-CD 3.46Å; P645-W647 PolarHBondContact O-N 2.8Å; P645-W802 PolarHBondContact O-NE1 3.19Å; P645-A805 HydrophobicContact CB-CB 4.42Å
646	A	81.3	Confident	85.3	Confident	29 Å²	29	50.3 Å²	50.3	24%	0.24	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-72.3	-20.1	173.8	0	0	0	0	0	112.7	F441 L643 M644 L809	F441-A646 HydrophobicContact CE1-CB 4.21Å; F441-A646 HydrophobicContact CZ-CB 3.72Å; L643-A646 VanDerWaalsContact O-CB 3.29Å; L643-A646 WeakPolarHBondContact O-CB 3.46Å; L643-A646 PolarHBondContact O-N 2.92Å; L643-A646 VanDerWaalsContact O-N 3.14Å; M644-A646 PolarHBondContact O-N 3.32Å; M644-A646 VanDerWaalsContact O-N 3.15Å; A646-L809 HydrophobicContact CB-CD2 3.99Å
647	W	81.3	Confident	85	Confident	161 Å²	161	54.1 Å²	54.1	61%	0.61	27%	0.272	S	S	*	.	S	Bend	trans	-92.1	128.7	178.6	-73.2	61.3	0	0	0	110.2	M644 P645 L649 L650 G651	M644-W647 WeakPolarHBondContact O-CB 3.43Å; M644-W647 PolarHBondContact O-N 3.44Å; P645-W647 PolarHBondContact O-N 2.8Å; W647-L649 VanDerWaalsContact C-N 3.29Å; W647-L649 PolarHBondContact O-N 3.46Å; W647-L650 HydrophobicContact CB-CB 4.21Å; W647-G651 WeakPolarHBondContact O-CA 3.18Å; W647-G651 PolarHBondContact O-N 2.92Å
648	E	81.1	Confident	84.7	Confident	120 Å²	120	52.8 Å²	52.8	56%	0.561	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-29.1	-173.7	-54.2	-172.8	159.8	0	0	113.1	P652 W802	E648-P652 VanDerWaalsContact O-CD 3.24Å; E648-P652 WeakPolarHBondContact O-CD 3.45Å; E648-P652 WeakPolarHBondContact O-CG 3.19Å; E648-W802 HydrophobicContact CB-CH2 3.96Å; E648-W802 HydrophobicContact CB-CZ2 3.95Å; E648-W802 HydrophobicContact CG-CH2 3.77Å; E648-W802 HydrophobicContact CG-CZ2 3.75Å
649	L	81.6	Confident	84.4	Confident	150 Å²	150	54.9 Å²	54.9	79%	0.785	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-47.5	177.8	-177.7	63.1	0	0	0	112.9	W647	W647-L649 VanDerWaalsContact C-N 3.29Å; W647-L649 PolarHBondContact O-N 3.46Å
650	L	84.3	Confident	84.2	Confident	62 Å²	62	54.1 Å²	54.1	33%	0.325	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-29.3	-173.5	-69	172	0	0	0	113.1	M644 W647 L653 Q654	M644-L650 HydrophobicContact CB-CB 4.35Å; M644-L650 HydrophobicContact CE-CD1 4.28Å; M644-L650 HydrophobicContact SD-CB 4.3Å; M644-L650 HydrophobicContact SD-CD1 4.23Å; W647-L650 HydrophobicContact CB-CB 4.21Å; L650-L653 PolarHBondContact O-N 3.15Å; L650-L653 VanDerWaalsContact O-N 3.17Å; L650-Q654 PolarHBondContact O-N 3.33Å
651	G	85	Confident	84.2	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-57	-54.6	-177.6	0	0	0	0	0	113.2	M644 W647 L653 Q654 I655	M644-G651 VanDerWaalsContact O-CA 3.31Å; M644-G651 WeakPolarHBondContact O-CA 3.33Å; M644-G651 PolarHBondContact O-N 3.28Å; W647-G651 WeakPolarHBondContact O-CA 3.18Å; W647-G651 PolarHBondContact O-N 2.92Å; G651-L653 PolarHBondContact O-N 2.89Å; G651-Q654 PolarHBondContact O-N 2.76Å; G651-I655 WeakPolarHBondContact O-CG1 3.41Å; G651-I655 PolarHBondContact O-N 3.38Å; G651-I655 VanDerWaalsContact O-N 3.15Å
652	P	85.5	Confident	84.1	Confident	9 Å²	9	56 Å²	56	6%	0.058	29%	0.289	C	S	.	.	H	α-helix	trans	-61.4	-28.5	177.1	-23.2	33.2	0	0	0	113.8	E648 S656 R798 W802	E648-P652 VanDerWaalsContact O-CD 3.24Å; E648-P652 WeakPolarHBondContact O-CD 3.45Å; E648-P652 WeakPolarHBondContact O-CG 3.19Å; P652-S656 PolarHBondContact O-N 3Å; P652-S656 PolarHBondContact O-OG 3.47Å; P652-S656 VanDerWaalsContact O-OG 3.06Å; P652-R798 HydrophobicContact CB-CB 4.49Å; P652-R798 HydrophobicContact CB-CG 4.17Å; P652-R798 VanDerWaalsContact CB-NE 3.29Å; P652-R798 PolarHBondContact O-NE 3.18Å; P652-R798 PolarHBondContact O-NH2 2.86Å; P652-W802 HydrophobicContact CB-CB 4.41Å; P652-W802 HydrophobicContact CG-CB 3.95Å; P652-W802 HydrophobicContact CG-CD2 3.93Å; P652-W802 HydrophobicContact CG-CE3 4.33Å; P652-W802 HydrophobicContact CG-CG 3.71Å
653	L	85.1	Confident	84.2	Confident	72 Å²	72	57 Å²	57	38%	0.377	30%	0.296	S	S	.	.	H	α-helix	trans	-74.5	-44.2	179.2	179.5	65	0	0	0	111.4	L650 G651 I655 S656 L657 R798	L650-L653 PolarHBondContact O-N 3.15Å; L650-L653 VanDerWaalsContact O-N 3.17Å; G651-L653 PolarHBondContact O-N 2.89Å; L653-I655 VanDerWaalsContact C-N 3.33Å; L653-I655 PolarHBondContact O-N 3.46Å; L653-S656 WeakPolarHBondContact CA-OG 3.26Å; L653-S656 PolarHBondContact O-N 3.18Å; L653-S656 PolarHBondContact O-OG 3.22Å; L653-L657 HydrophobicContact CG-CD1 4.16Å; L653-L657 WeakPolarHBondContact O-CG 3.4Å; L653-L657 PolarHBondContact O-N 3.26Å; L653-R798 VanDerWaalsContact N-NH2 3.14Å
654	Q	86.6	Confident	84.4	Confident	24 Å²	24	58.3 Å²	58.3	11%	0.112	30%	0.303	C	S	.	.	H	α-helix	trans	-63.3	-40.6	177.7	-174.1	-161.3	-1.4	0	0	111.9	Y528 S641 L650 G651 L657 A658	Y528-Q654 PolarHBondContact OH-NE2 3.24Å; S641-Q654 VanDerWaalsContact C-NE2 3.32Å; S641-Q654 PolarHBondContact O-NE2 3.03Å; S641-Q654 PolarHBondContact O-OE1 3.46Å; L650-Q654 PolarHBondContact O-N 3.33Å; G651-Q654 PolarHBondContact O-N 2.76Å; Q654-L657 PolarHBondContact O-N 2.82Å; Q654-A658 WeakPolarHBondContact O-CB 3.27Å; Q654-A658 PolarHBondContact O-N 3.44Å
655	I	83.7	Confident	84.5	Confident	24 Å²	24	60.3 Å²	60.3	12%	0.123	31%	0.314	C	S	.	.	H	α-helix	trans	-65.6	-42.7	-179.4	-66.7	166	0	0	0	110.7	G651 L653 L657 A658 R659 E801 W802 A805	G651-I655 WeakPolarHBondContact O-CG1 3.41Å; G651-I655 PolarHBondContact O-N 3.38Å; G651-I655 VanDerWaalsContact O-N 3.15Å; L653-I655 VanDerWaalsContact C-N 3.33Å; L653-I655 PolarHBondContact O-N 3.46Å; I655-L657 VanDerWaalsContact C-N 3.34Å; I655-L657 PolarHBondContact O-N 2.68Å; I655-A658 PolarHBondContact O-N 3.41Å; I655-R659 PolarHBondContact O-N 3.14Å; I655-R659 VanDerWaalsContact O-N 3.09Å; I655-E801 HydrophobicContact CG2-CB 3.97Å; I655-E801 WeakPolarHBondContact CG2-OE2 3.49Å; I655-W802 VanDerWaalsContact CD1-CA 3.42Å; I655-W802 HydrophobicContact CD1-CB 3.9Å; I655-A805 HydrophobicContact CD1-CB 3.65Å
656	S	83.4	Confident	84.5	Confident	1 Å²	1	67.9 Å²	67.9	1%	0.007	34%	0.341	C	S	.	.	H	α-helix	trans	-60.1	-43.7	173.1	45.4	0	0	0	0	112	P652 L653 A658 R659 M660	P652-S656 PolarHBondContact O-N 3Å; P652-S656 PolarHBondContact O-OG 3.47Å; P652-S656 VanDerWaalsContact O-OG 3.06Å; L653-S656 WeakPolarHBondContact CA-OG 3.26Å; L653-S656 PolarHBondContact O-N 3.18Å; L653-S656 PolarHBondContact O-OG 3.22Å; S656-A658 PolarHBondContact O-N 3.07Å; S656-R659 PolarHBondContact O-N 3.44Å; S656-M660 WeakPolarHBondContact O-CG 3.41Å; S656-M660 PolarHBondContact O-N 3.3Å
657	L	85.6	Confident	84.7	Confident	86 Å²	86	67.4 Å²	67.4	45%	0.45	33%	0.334	S	S	.	.	H	α-helix	trans	-60.7	-45.7	176	-73.5	164.1	0	0	0	111.7	L653 Q654 I655 R659 M660 V661	L653-L657 HydrophobicContact CG-CD1 4.16Å; L653-L657 WeakPolarHBondContact O-CG 3.4Å; L653-L657 PolarHBondContact O-N 3.26Å; Q654-L657 PolarHBondContact O-N 2.82Å; I655-L657 VanDerWaalsContact C-N 3.34Å; I655-L657 PolarHBondContact O-N 2.68Å; L657-R659 VanDerWaalsContact C-N 3.31Å; L657-R659 PolarHBondContact O-N 3.41Å; L657-M660 HydrophobicContact CD2-CE 3.6Å; L657-M660 HydrophobicContact CG-CE 4.22Å; L657-M660 PolarHBondContact O-N 3.17Å; L657-V661 WeakPolarHBondContact O-CG2 3.38Å; L657-V661 PolarHBondContact O-N 3.4Å
658	A	84.4	Confident	85	Confident	55 Å²	55	63 Å²	63	46%	0.455	32%	0.321	S	S	.	.	H	α-helix	trans	-62.5	-36.4	-179.4	0	0	0	0	0	112.8	Q654 I655 S656	Q654-A658 WeakPolarHBondContact O-CB 3.27Å; Q654-A658 PolarHBondContact O-N 3.44Å; I655-A658 PolarHBondContact O-N 3.41Å; S656-A658 PolarHBondContact O-N 3.07Å
659	R	83.2	Confident	85.2	Confident	103 Å²	103	60 Å²	60	39%	0.389	32%	0.316	S	S	.	.	H	α-helix	trans	-71.5	-41.9	175	-73.4	-166	65.9	168.9	-8.3	112	I655 S656 L657 V661 S662 I794 E801	I655-R659 PolarHBondContact O-N 3.14Å; I655-R659 VanDerWaalsContact O-N 3.09Å; S656-R659 PolarHBondContact O-N 3.44Å; L657-R659 VanDerWaalsContact C-N 3.31Å; L657-R659 PolarHBondContact O-N 3.41Å; R659-V661 PolarHBondContact O-N 3.32Å; R659-S662 WeakPolarHBondContact O-CB 3.19Å; R659-S662 PolarHBondContact O-N 2.99Å; R659-S662 VanDerWaalsContact O-N 3.08Å; R659-I794 HydrophobicContact CB-CD1 3.71Å; R659-I794 HydrophobicContact CB-CG1 4.44Å; R659-I794 HydrophobicContact CB-CG2 4.39Å; R659-E801 VanDerWaalsContact CD-OE2 3.3Å; R659-E801 WeakPolarHBondContact CD-OE2 3.49Å; R659-E801 IonicContact CZ-OE1 3.07Å; R659-E801 IonicContact NH1-OE1 3.94Å; R659-E801 PolarHBondContact NH1-OE1 3.46Å; R659-E801 IonicContact NH1-OE2 3.8Å
660	M	87.3	Confident	85.4	Confident	16 Å²	16	58 Å²	58	8%	0.079	31%	0.306	C	S	.	.	H	α-helix	trans	-58.9	-37.1	174.1	-72.7	-168.9	-62.9	0	0	112.1	S656 L657 S662 D663 I664 F791 I794	S656-M660 WeakPolarHBondContact O-CG 3.41Å; S656-M660 PolarHBondContact O-N 3.3Å; L657-M660 HydrophobicContact CD2-CE 3.6Å; L657-M660 HydrophobicContact CG-CE 4.22Å; L657-M660 PolarHBondContact O-N 3.17Å; M660-S662 PolarHBondContact O-N 3.47Å; M660-D663 PolarHBondContact O-N 2.99Å; M660-I664 HydrophobicContact CB-CD1 4.37Å; M660-I664 VanDerWaalsContact O-CG1 3.25Å; M660-I664 WeakPolarHBondContact O-CG1 3.25Å; M660-I664 PolarHBondContact O-N 3.42Å; M660-F791 HydrophobicContact CE-CD2 3.67Å; M660-F791 HydrophobicContact CE-CE2 4.43Å; M660-F791 HydrophobicContact SD-CB 3.58Å; M660-F791 VanDerWaalsContact SD-CB 3.58Å; M660-F791 HydrophobicContact SD-CD2 3.8Å; M660-F791 HydrophobicContact SD-CG 4.17Å; M660-I794 HydrophobicContact CG-CD1 3.96Å
661	V	86.5	Confident	85.5	Confident	74 Å²	74	55.9 Å²	55.9	45%	0.448	29%	0.294	S	S	.	.	H	α-helix	trans	-55.4	-37.3	176.1	169.9	0	0	0	0	111.8	L657 R659 D663 I664 I665	L657-V661 WeakPolarHBondContact O-CG2 3.38Å; L657-V661 PolarHBondContact O-N 3.4Å; R659-V661 PolarHBondContact O-N 3.32Å; V661-D663 VanDerWaalsContact C-N 3.35Å; V661-D663 PolarHBondContact O-N 3.09Å; V661-I664 PolarHBondContact O-N 3.26Å; V661-I665 HydrophobicContact CG1-CD1 3.82Å; V661-I665 HydrophobicContact CG1-CG1 4.34Å; V661-I665 WeakPolarHBondContact O-CB 3.46Å; V661-I665 WeakPolarHBondContact O-CD1 3.47Å; V661-I665 WeakPolarHBondContact O-CG1 3.3Å; V661-I665 PolarHBondContact O-N 2.85Å
662	S	83.6	Confident	85.7	Confident	57 Å²	57	59 Å²	59	40%	0.399	31%	0.313	S	S	.	.	H	α-helix	trans	-64.8	-37.6	176.2	-177.7	0	0	0	0	112.7	R659 M660 R666	R659-S662 WeakPolarHBondContact O-CB 3.19Å; R659-S662 PolarHBondContact O-N 2.99Å; R659-S662 VanDerWaalsContact O-N 3.08Å; M660-S662 PolarHBondContact O-N 3.47Å; S662-R666 WeakPolarHBondContact O-CG 3.5Å; S662-R666 PolarHBondContact O-N 3.32Å
663	D	86	Confident	86	Confident	59 Å²	59	63.3 Å²	63.3	32%	0.316	34%	0.339	S	S	.	.	H	α-helix	trans	-77.3	-36.7	178.3	-67.6	-32.7	0	0	0	111.6	M660 V661 I665 R666 F667	M660-D663 PolarHBondContact O-N 2.99Å; V661-D663 VanDerWaalsContact C-N 3.35Å; V661-D663 PolarHBondContact O-N 3.09Å; D663-I665 VanDerWaalsContact C-N 3.32Å; D663-I665 PolarHBondContact O-N 3.41Å; D663-R666 WeakPolarHBondContact O-CB 3.23Å; D663-R666 PolarHBondContact O-N 3.2Å; D663-R666 IonicContact OD1-CZ 3Å; D663-R666 IonicContact OD1-NH1 3.78Å; D663-R666 PolarHBondContact OD1-NH1 3.14Å; D663-F667 PolarHBondContact O-N 2.9Å; D663-F667 VanDerWaalsContact O-N 3.09Å
664	I	88.2	Confident	86.1	Confident	43 Å²	43	62.7 Å²	62.7	22%	0.221	34%	0.335	C	S	.	.	H	α-helix	trans	-57.4	-45.8	169.7	-66	165.5	0	0	0	109.8	M660 V661 R666 F667 M668 L783 M787	M660-I664 HydrophobicContact CB-CD1 4.37Å; M660-I664 VanDerWaalsContact O-CG1 3.25Å; M660-I664 WeakPolarHBondContact O-CG1 3.25Å; M660-I664 PolarHBondContact O-N 3.42Å; V661-I664 PolarHBondContact O-N 3.26Å; I664-R666 VanDerWaalsContact C-N 3.31Å; I664-R666 PolarHBondContact O-N 3.49Å; I664-F667 PolarHBondContact O-N 2.81Å; I664-M668 HydrophobicContact CG2-CG 3.94Å; I664-M668 WeakPolarHBondContact O-CB 3.48Å; I664-M668 VanDerWaalsContact O-CG 3.25Å; I664-M668 WeakPolarHBondContact O-CG 3.43Å; I664-M668 PolarHBondContact O-N 3.1Å; I664-L783 HydrophobicContact CG1-CD1 4.28Å; I664-L783 HydrophobicContact CG2-CD1 4.2Å; I664-M787 HydrophobicContact CD1-CG 3.95Å; I664-M787 HydrophobicContact CD1-SD 3.57Å; I664-M787 VanDerWaalsContact CD1-SD 3.57Å; I664-M787 HydrophobicContact CG1-CG 3.84Å; I664-M787 HydrophobicContact CG1-SD 3.96Å
665	I	87.1	Confident	86.3	Confident	109 Å²	109	61.9 Å²	61.9	56%	0.559	33%	0.331	S	S	*	.	H	α-helix	trans	-59.5	-40.9	178.1	-72.5	164.1	0	0	0	111.5	V661 D663 F667 M668 A669	V661-I665 HydrophobicContact CG1-CD1 3.82Å; V661-I665 HydrophobicContact CG1-CG1 4.34Å; V661-I665 WeakPolarHBondContact O-CB 3.46Å; V661-I665 WeakPolarHBondContact O-CD1 3.47Å; V661-I665 WeakPolarHBondContact O-CG1 3.3Å; V661-I665 PolarHBondContact O-N 2.85Å; D663-I665 VanDerWaalsContact C-N 3.32Å; D663-I665 PolarHBondContact O-N 3.41Å; I665-F667 VanDerWaalsContact C-N 3.35Å; I665-F667 PolarHBondContact O-N 2.98Å; I665-M668 PolarHBondContact O-N 3.21Å; I665-A669 PolarHBondContact O-N 3.39Å
666	R	84.3	Confident	86.7	Confident	171 Å²	171	65.2 Å²	65.2	65%	0.645	35%	0.349	S	S	*	.	H	α-helix	trans	-62.8	-41.6	177.1	-68.6	169.2	-175.9	165.9	-5.9	111.6	S662 D663 I664 A669	S662-R666 WeakPolarHBondContact O-CG 3.5Å; S662-R666 PolarHBondContact O-N 3.32Å; D663-R666 WeakPolarHBondContact O-CB 3.23Å; D663-R666 PolarHBondContact O-N 3.2Å; D663-R666 IonicContact OD1-CZ 3Å; D663-R666 IonicContact OD1-NH1 3.78Å; D663-R666 PolarHBondContact OD1-NH1 3.14Å; I664-R666 VanDerWaalsContact C-N 3.31Å; I664-R666 PolarHBondContact O-N 3.49Å; R666-A669 WeakPolarHBondContact O-CB 3.48Å; R666-A669 PolarHBondContact O-N 3.36Å
667	F	85.4	Confident	87.2	Confident	20 Å²	20	68.2 Å²	68.2	9%	0.088	37%	0.373	C	S	.	.	H	α-helix	trans	-73.3	-35.6	176.2	-172.2	-105.4	0	0	0	113.1	D663 I664 I665 A669 L670 F671 L779 M782 L783 M786	D663-F667 PolarHBondContact O-N 2.9Å; D663-F667 VanDerWaalsContact O-N 3.09Å; I664-F667 PolarHBondContact O-N 2.81Å; I665-F667 VanDerWaalsContact C-N 3.35Å; I665-F667 PolarHBondContact O-N 2.98Å; F667-A669 PolarHBondContact O-N 3.45Å; F667-A669 VanDerWaalsContact O-N 3.11Å; F667-L670 HydrophobicContact CD2-CD1 4.01Å; F667-L670 HydrophobicContact CE2-CD1 4.31Å; F667-L670 WeakPolarHBondContact O-CB 3.39Å; F667-L670 PolarHBondContact O-N 3.36Å; F667-F671 PolarHBondContact O-N 3.11Å; F667-F671 VanDerWaalsContact O-N 3.1Å; F667-L779 HydrophobicContact CE1-CB 4.44Å; F667-L779 HydrophobicContact CE1-CD2 4.47Å; F667-L779 WeakPolarHBondContact CE1-O 3.22Å; F667-L779 HydrophobicContact CE2-CD2 4.48Å; F667-L779 HydrophobicContact CZ-CB 4.38Å; F667-L779 HydrophobicContact CZ-CD2 3.79Å; F667-M782 HydrophobicContact CE2-CB 4.46Å; F667-M782 HydrophobicContact CZ-CB 3.99Å; F667-L783 HydrophobicContact CD1-CB 4.04Å; F667-L783 HydrophobicContact CD1-CD1 3.69Å; F667-L783 HydrophobicContact CD1-CG 4.38Å; F667-L783 HydrophobicContact CE1-CB 3.74Å; F667-L783 HydrophobicContact CE1-CD1 4.3Å; F667-L783 HydrophobicContact CG-CD1 4.45Å; F667-M786 HydrophobicContact CB-CE 3.56Å; F667-M786 HydrophobicContact CD1-CE 3.99Å; F667-M786 HydrophobicContact CD2-CE 3.04Å; F667-M786 HydrophobicContact CD2-SD 4.25Å; F667-M786 HydrophobicContact CE1-CE 4.41Å; F667-M786 HydrophobicContact CE2-CE 3.55Å; F667-M786 HydrophobicContact CG-CE 3.24Å; F667-M786 HydrophobicContact CZ-CE 4.19Å
668	M	86.4	Confident	87.5	Confident	69 Å²	69	65.8 Å²	65.8	34%	0.34	36%	0.359	S	S	.	.	H	α-helix	trans	-60	-22.4	175.9	-77.6	-57.3	-64.8	0	0	112.1	I664 I665 F671 T672	I664-M668 HydrophobicContact CG2-CG 3.94Å; I664-M668 WeakPolarHBondContact O-CB 3.48Å; I664-M668 VanDerWaalsContact O-CG 3.25Å; I664-M668 WeakPolarHBondContact O-CG 3.43Å; I664-M668 PolarHBondContact O-N 3.1Å; I665-M668 PolarHBondContact O-N 3.21Å; M668-F671 HydrophobicContact CE-CB 4.38Å; M668-F671 HydrophobicContact CE-CD1 3.83Å; M668-F671 HydrophobicContact CE-CE1 4.4Å; M668-F671 HydrophobicContact CE-CG 4.19Å; M668-F671 PolarHBondContact O-N 3.29Å; M668-F671 HydrophobicContact SD-CB 4.09Å; M668-F671 HydrophobicContact SD-CD1 4.36Å; M668-F671 HydrophobicContact SD-CG 4.12Å; M668-T672 VanDerWaalsContact O-CB 3.28Å; M668-T672 WeakPolarHBondContact O-CB 3.41Å; M668-T672 PolarHBondContact O-N 3.45Å; M668-T672 PolarHBondContact O-OG1 3.45Å
669	A	86.2	Confident	87.9	Confident	57 Å²	57	63.8 Å²	63.8	47%	0.471	34%	0.341	S	S	.	.	H	α-helix	trans	-63.6	-44.4	169.9	0	0	0	0	0	112.2	I665 R666 F667 F671 T672 V673	I665-A669 PolarHBondContact O-N 3.39Å; R666-A669 WeakPolarHBondContact O-CB 3.48Å; R666-A669 PolarHBondContact O-N 3.36Å; F667-A669 PolarHBondContact O-N 3.45Å; F667-A669 VanDerWaalsContact O-N 3.11Å; A669-F671 VanDerWaalsContact C-N 3.35Å; A669-T672 PolarHBondContact O-N 2.92Å; A669-V673 WeakPolarHBondContact O-CG2 3.37Å; A669-V673 PolarHBondContact O-N 3.07Å; A669-V673 VanDerWaalsContact O-N 3.07Å
670	L	85.4	Confident	88.3	Confident	107 Å²	107	62.1 Å²	62.1	56%	0.56	34%	0.343	S	S	*	.	H	α-helix	trans	-63.7	-43.3	174.6	-64.3	172.3	0	0	0	110.9	F667 T672 V673 M674	F667-L670 HydrophobicContact CD2-CD1 4.01Å; F667-L670 HydrophobicContact CE2-CD1 4.31Å; F667-L670 WeakPolarHBondContact O-CB 3.39Å; F667-L670 PolarHBondContact O-N 3.36Å; L670-T672 VanDerWaalsContact C-N 3.35Å; L670-T672 PolarHBondContact O-N 2.68Å; L670-V673 PolarHBondContact O-N 2.76Å; L670-M674 PolarHBondContact O-N 3.35Å
671	F	87.2	Confident	88.5	Confident	18 Å²	18	63 Å²	63	8%	0.079	36%	0.356	C	S	.	.	H	α-helix	trans	-58	-46.5	175.4	-168.3	-81.5	0	0	0	111.8	F667 M668 A669 V673 M674 V675 L726 M775 L779	F667-F671 PolarHBondContact O-N 3.11Å; F667-F671 VanDerWaalsContact O-N 3.1Å; M668-F671 HydrophobicContact CE-CB 4.38Å; M668-F671 HydrophobicContact CE-CD1 3.83Å; M668-F671 HydrophobicContact CE-CE1 4.4Å; M668-F671 HydrophobicContact CE-CG 4.19Å; M668-F671 PolarHBondContact O-N 3.29Å; M668-F671 HydrophobicContact SD-CB 4.09Å; M668-F671 HydrophobicContact SD-CD1 4.36Å; M668-F671 HydrophobicContact SD-CG 4.12Å; A669-F671 VanDerWaalsContact C-N 3.35Å; F671-V673 PolarHBondContact O-N 2.9Å; F671-M674 PolarHBondContact O-N 3.28Å; F671-V675 HydrophobicContact CD1-CG2 3.81Å; F671-V675 HydrophobicContact CE1-CG2 3.57Å; F671-V675 HydrophobicContact CZ-CG2 4.43Å; F671-V675 WeakPolarHBondContact O-CG2 3.01Å; F671-V675 PolarHBondContact O-N 3.04Å; F671-L726 HydrophobicContact CE1-CD2 4.16Å; F671-L726 HydrophobicContact CE2-CD1 4Å; F671-L726 HydrophobicContact CE2-CD2 4.25Å; F671-L726 HydrophobicContact CZ-CD1 3.64Å; F671-L726 HydrophobicContact CZ-CD2 3.42Å; F671-L726 VanDerWaalsContact CZ-CD2 3.42Å; F671-L726 HydrophobicContact CZ-CG 4.11Å; F671-M775 HydrophobicContact CD1-CE 3.69Å; F671-M775 HydrophobicContact CD2-CE 3.45Å; F671-M775 VanDerWaalsContact CD2-CE 3.45Å; F671-M775 HydrophobicContact CE1-CE 3.36Å; F671-M775 HydrophobicContact CE2-CE 3.13Å; F671-M775 HydrophobicContact CG-CE 3.71Å; F671-M775 HydrophobicContact CZ-CE 3.05Å; F671-L779 HydrophobicContact CD2-CB 4.13Å; F671-L779 HydrophobicContact CD2-CD1 3.81Å; F671-L779 HydrophobicContact CE2-CB 4.43Å; F671-L779 HydrophobicContact CE2-CD1 4.41Å; F671-L779 HydrophobicContact CG-CD1 4.4Å
672	T	88.8	Confident	88.7	Confident	64 Å²	64	59.5 Å²	59.5	39%	0.393	33%	0.334	S	S	.	.	H	α-helix	trans	-65.8	-39.5	-178.3	-57.8	0	0	0	0	111.8	M668 A669 L670 M674 V675 I676	M668-T672 VanDerWaalsContact O-CB 3.28Å; M668-T672 WeakPolarHBondContact O-CB 3.41Å; M668-T672 PolarHBondContact O-N 3.45Å; M668-T672 PolarHBondContact O-OG1 3.45Å; A669-T672 PolarHBondContact O-N 2.92Å; L670-T672 VanDerWaalsContact C-N 3.35Å; L670-T672 PolarHBondContact O-N 2.68Å; T672-M674 VanDerWaalsContact C-N 3.32Å; T672-M674 PolarHBondContact O-N 2.99Å; T672-V675 PolarHBondContact O-N 3.19Å; T672-I676 HydrophobicContact CG2-CD1 3.79Å; T672-I676 HydrophobicContact CG2-CG1 4.31Å; T672-I676 WeakPolarHBondContact O-CB 3.34Å; T672-I676 VanDerWaalsContact O-CG1 3.25Å; T672-I676 WeakPolarHBondContact O-CG1 3.25Å; T672-I676 PolarHBondContact O-N 2.93Å
673	V	90.7	Very high	88.9	Confident	100 Å²	100	57.1 Å²	57.1	61%	0.606	32%	0.317	S	S	*	.	H	α-helix	trans	-60.3	-43.3	175.3	170.5	0	0	0	0	111	A669 L670 F671 I676 A677	A669-V673 WeakPolarHBondContact O-CG2 3.37Å; A669-V673 PolarHBondContact O-N 3.07Å; A669-V673 VanDerWaalsContact O-N 3.07Å; L670-V673 PolarHBondContact O-N 2.76Å; F671-V673 PolarHBondContact O-N 2.9Å; V673-I676 PolarHBondContact O-N 3.25Å; V673-A677 PolarHBondContact O-N 3.43Å
674	M	88.8	Confident	89.1	Confident	59 Å²	59	60.2 Å²	60.2	29%	0.291	33%	0.334	S	S	.	.	H	α-helix	trans	-66.1	-45.7	176.9	-72.9	-173.6	55.7	0	0	111.9	L670 F671 T672 I676 A677 F678 C774 M775 L779	L670-M674 PolarHBondContact O-N 3.35Å; F671-M674 PolarHBondContact O-N 3.28Å; T672-M674 VanDerWaalsContact C-N 3.32Å; T672-M674 PolarHBondContact O-N 2.99Å; M674-I676 VanDerWaalsContact C-N 3.33Å; M674-I676 PolarHBondContact O-N 3.33Å; M674-A677 WeakPolarHBondContact O-CB 3.48Å; M674-A677 PolarHBondContact O-N 3.5Å; M674-F678 VanDerWaalsContact O-CD2 3.3Å; M674-F678 WeakPolarHBondContact O-CD2 3.3Å; M674-F678 PolarHBondContact O-N 3.03Å; M674-F678 VanDerWaalsContact O-N 3.14Å; M674-C774 HydrophobicContact CE-CB 3.81Å; M674-M775 HydrophobicContact CB-SD 4.01Å; M674-M775 HydrophobicContact CE-SD 4.18Å; M674-L779 HydrophobicContact CB-CD1 4.45Å; M674-L779 HydrophobicContact CE-CD1 4.03Å; M674-L779 HydrophobicContact CE-CG 4.49Å; M674-L779 HydrophobicContact SD-CD1 3.66Å; M674-L779 HydrophobicContact SD-CD2 4.19Å; M674-L779 HydrophobicContact SD-CG 4.21Å
675	V	91	Very high	89	Confident	7 Å²	7	60.2 Å²	60.2	4%	0.042	33%	0.334	C	S	.	.	H	α-helix	trans	-58.1	-45.2	175.7	174.3	0	0	0	0	111.2	F671 T672 A677 F678 V679 F719 Y771 M775	F671-V675 HydrophobicContact CD1-CG2 3.81Å; F671-V675 HydrophobicContact CE1-CG2 3.57Å; F671-V675 HydrophobicContact CZ-CG2 4.43Å; F671-V675 WeakPolarHBondContact O-CG2 3.01Å; F671-V675 PolarHBondContact O-N 3.04Å; T672-V675 PolarHBondContact O-N 3.19Å; V675-A677 VanDerWaalsContact C-N 3.31Å; V675-A677 PolarHBondContact O-N 2.67Å; V675-F678 PolarHBondContact O-N 3.3Å; V675-V679 HydrophobicContact CG1-CG2 3.99Å; V675-V679 WeakPolarHBondContact O-CB 3.47Å; V675-V679 VanDerWaalsContact O-CG2 3.24Å; V675-V679 WeakPolarHBondContact O-CG2 3.35Å; V675-V679 PolarHBondContact O-N 3.34Å; V675-F719 HydrophobicContact CG1-CD2 3.84Å; V675-F719 HydrophobicContact CG1-CE2 3.9Å; V675-Y771 HydrophobicContact CG2-CE2 4.42Å; V675-M775 HydrophobicContact CG2-CE 3.54Å; V675-M775 HydrophobicContact CG2-SD 4.46Å
676	I	92	Very high	89	Confident	95 Å²	95	55.1 Å²	55.1	49%	0.487	31%	0.308	S	S	.	.	H	α-helix	trans	-60.5	-41.4	178.3	-69.9	168.8	0	0	0	111.1	T672 V673 M674 F678 V679 V680	T672-I676 HydrophobicContact CG2-CD1 3.79Å; T672-I676 HydrophobicContact CG2-CG1 4.31Å; T672-I676 WeakPolarHBondContact O-CB 3.34Å; T672-I676 VanDerWaalsContact O-CG1 3.25Å; T672-I676 WeakPolarHBondContact O-CG1 3.25Å; T672-I676 PolarHBondContact O-N 2.93Å; V673-I676 PolarHBondContact O-N 3.25Å; M674-I676 VanDerWaalsContact C-N 3.33Å; M674-I676 PolarHBondContact O-N 3.33Å; I676-F678 PolarHBondContact O-N 2.98Å; I676-V679 PolarHBondContact O-N 3.18Å; I676-V680 HydrophobicContact CG2-CG2 4.4Å; I676-V680 WeakPolarHBondContact O-CG2 3.47Å; I676-V680 PolarHBondContact O-N 3.28Å
677	A	92.6	Very high	89	Confident	63 Å²	63	54.2 Å²	54.2	52%	0.521	31%	0.305	S	S	.	.	H	α-helix	trans	-60.1	-44.9	177.8	0	0	0	0	0	112.2	V673 M674 V675 G681	V673-A677 PolarHBondContact O-N 3.43Å; M674-A677 WeakPolarHBondContact O-CB 3.48Å; M674-A677 PolarHBondContact O-N 3.5Å; V675-A677 VanDerWaalsContact C-N 3.31Å; V675-A677 PolarHBondContact O-N 2.67Å; A677-G681 PolarHBondContact O-N 3.48Å
678	F	92.3	Very high	88.8	Confident	35 Å²	35	60.9 Å²	60.9	15%	0.154	33%	0.33	C	S	.	.	H	α-helix	trans	-73.1	-35.5	177.2	-77.4	-81.2	0	0	0	113.2	M674 V675 I676 G681 L682 L722 I770 Y771	M674-F678 VanDerWaalsContact O-CD2 3.3Å; M674-F678 WeakPolarHBondContact O-CD2 3.3Å; M674-F678 PolarHBondContact O-N 3.03Å; M674-F678 VanDerWaalsContact O-N 3.14Å; V675-F678 PolarHBondContact O-N 3.3Å; I676-F678 PolarHBondContact O-N 2.98Å; F678-G681 PolarHBondContact O-N 3.41Å; F678-L682 WeakPolarHBondContact O-CB 3.46Å; F678-L682 PolarHBondContact O-N 3.25Å; F678-L722 HydrophobicContact CB-CD1 4.16Å; F678-I770 HydrophobicContact CE1-CG2 4.44Å; F678-I770 HydrophobicContact CZ-CG2 4.12Å; F678-Y771 HydrophobicContact CB-CD2 3.73Å; F678-Y771 HydrophobicContact CB-CE2 4.25Å; F678-Y771 HydrophobicContact CD1-CD2 4.13Å; F678-Y771 HydrophobicContact CD1-CG 4.41Å; F678-Y771 AromaticContact CD2-CD2 3.58Å; F678-Y771 HydrophobicContact CD2-CD2 3.58Å; F678-Y771 HydrophobicContact CD2-CE2 4.36Å; F678-Y771 HydrophobicContact CE2-CD2 4.17Å; F678-Y771 AromaticContact CG-CD2 3.55Å; F678-Y771 HydrophobicContact CG-CD2 3.55Å; F678-Y771 HydrophobicContact CG-CE2 4.44Å; F678-Y771 HydrophobicContact CG-CG 4.26Å
679	V	93	Very high	88.4	Confident	13 Å²	13	60.4 Å²	60.4	8%	0.079	33%	0.326	C	S	.	.	H	α-helix	trans	-56.4	-51.1	172	162.8	0	0	0	0	109.8	V675 I676 T683 F719 L722	V675-V679 HydrophobicContact CG1-CG2 3.99Å; V675-V679 WeakPolarHBondContact O-CB 3.47Å; V675-V679 VanDerWaalsContact O-CG2 3.24Å; V675-V679 WeakPolarHBondContact O-CG2 3.35Å; V675-V679 PolarHBondContact O-N 3.34Å; I676-V679 PolarHBondContact O-N 3.18Å; V679-T683 VanDerWaalsContact O-CB 3.26Å; V679-T683 WeakPolarHBondContact O-CB 3.34Å; V679-T683 PolarHBondContact O-N 3.06Å; V679-T683 PolarHBondContact O-OG1 3.15Å; V679-F719 HydrophobicContact CG2-CB 3.94Å; V679-F719 HydrophobicContact CG2-CD2 4.14Å; V679-L722 HydrophobicContact CB-CD1 4.46Å; V679-L722 HydrophobicContact CG2-CD1 3.71Å
680	V	92.3	Very high	88	Confident	69 Å²	69	58.1 Å²	58.1	42%	0.418	31%	0.308	S	S	.	.	H	α-helix	trans	-65.3	-43.7	179.1	174.9	0	0	0	0	111	I676 N684	I676-V680 HydrophobicContact CG2-CG2 4.4Å; I676-V680 WeakPolarHBondContact O-CG2 3.47Å; I676-V680 PolarHBondContact O-N 3.28Å; V680-N684 WeakPolarHBondContact O-CB 3.46Å; V680-N684 PolarHBondContact O-N 3.14Å; V680-N684 PolarHBondContact O-ND2 2.86Å
681	G	91.2	Very high	87.6	Confident	34 Å²	34	55.8 Å²	55.8	35%	0.351	30%	0.296	S	S	.	.	H	α-helix	trans	-60.6	-49.7	179.3	0	0	0	0	0	113.5	A677 F678 N684 L685	A677-G681 PolarHBondContact O-N 3.48Å; F678-G681 PolarHBondContact O-N 3.41Å; G681-N684 PolarHBondContact O-N 2.7Å; G681-L685 PolarHBondContact O-N 3.24Å; G681-L685 VanDerWaalsContact O-N 3.16Å
682	L	89.7	Confident	86.9	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.005	30%	0.304	C	S	.	.	H	α-helix	trans	-73.9	-34.9	180	-71.2	169.9	0	0	0	112.4	F678 N684 L685 Y686 F712 L722 L767	F678-L682 WeakPolarHBondContact O-CB 3.46Å; F678-L682 PolarHBondContact O-N 3.25Å; L682-N684 VanDerWaalsContact C-N 3.33Å; L682-N684 PolarHBondContact O-N 3.24Å; L682-L685 PolarHBondContact O-N 3.44Å; L682-Y686 HydrophobicContact CD2-CD2 4.39Å; L682-Y686 HydrophobicContact CD2-CE2 4.06Å; L682-Y686 WeakPolarHBondContact O-CD2 3.18Å; L682-Y686 PolarHBondContact O-N 3.17Å; L682-Y686 VanDerWaalsContact O-N 3.07Å; L682-F712 HydrophobicContact CD1-CE1 4.45Å; L682-F712 HydrophobicContact CD1-CZ 4.46Å; L682-L722 HydrophobicContact CD1-CD1 4.08Å; L682-L722 HydrophobicContact CD1-CD2 3.72Å; L682-L722 HydrophobicContact CD1-CG 4.34Å; L682-L767 HydrophobicContact CD2-CB 4.16Å
683	T	88.4	Confident	85.9	Confident	7 Å²	7	59.8 Å²	59.8	4%	0.043	31%	0.314	C	S	.	.	H	α-helix	trans	-57.5	-51	171.5	-54.1	0	0	0	0	109.3	V679 L685 Y686 W687 T715 T718	V679-T683 VanDerWaalsContact O-CB 3.26Å; V679-T683 WeakPolarHBondContact O-CB 3.34Å; V679-T683 PolarHBondContact O-N 3.06Å; V679-T683 PolarHBondContact O-OG1 3.15Å; T683-L685 VanDerWaalsContact C-N 3.25Å; T683-L685 PolarHBondContact O-N 3.18Å; T683-Y686 PolarHBondContact O-N 3.47Å; T683-W687 HydrophobicContact CG2-CB 4.48Å; T683-W687 WeakPolarHBondContact O-CA 3.39Å; T683-W687 WeakPolarHBondContact O-CB 3.49Å; T683-W687 PolarHBondContact O-N 3.42Å; T683-T715 HydrophobicContact CG2-CG2 3.98Å; T683-T718 VanDerWaalsContact OG1-CG2 3.32Å; T683-T718 WeakPolarHBondContact OG1-CG2 3.27Å; T683-T718 PolarHBondContact OG1-OG1 3.04Å; T683-T718 VanDerWaalsContact OG1-OG1 3.1Å
684	N	90.5	Very high	84.6	Confident	123 Å²	123	55.3 Å²	55.3	66%	0.658	29%	0.287	S	S	*	.	H	α-helix	trans	-63.1	-32.7	-177	-70.3	-11.7	0	0	0	112.8	V680 G681 L682	V680-N684 WeakPolarHBondContact O-CB 3.46Å; V680-N684 PolarHBondContact O-N 3.14Å; V680-N684 PolarHBondContact O-ND2 2.86Å; G681-N684 PolarHBondContact O-N 2.7Å; L682-N684 VanDerWaalsContact C-N 3.33Å; L682-N684 PolarHBondContact O-N 3.24Å
685	L	86.6	Confident	83.5	Confident	43 Å²	43	55.8 Å²	55.8	23%	0.225	30%	0.296	C	S	.	.	H	α-helix	trans	-70.7	-42.5	178.2	-175.1	62.6	0	0	0	112.6	G681 L682 T683 V760 L767	G681-L685 PolarHBondContact O-N 3.24Å; G681-L685 VanDerWaalsContact O-N 3.16Å; L682-L685 PolarHBondContact O-N 3.44Å; T683-L685 VanDerWaalsContact C-N 3.25Å; T683-L685 PolarHBondContact O-N 3.18Å; L685-V760 HydrophobicContact CD1-CG1 3.87Å; L685-V760 HydrophobicContact CD2-CG1 4.49Å; L685-V760 HydrophobicContact CG-CG1 3.92Å; L685-L767 HydrophobicContact CD2-CD1 4.26Å
686	Y	85.2	Confident	82	Confident	3 Å²	3	56.6 Å²	56.6	1%	0.012	30%	0.301	C	S	.	.	H	α-helix	trans	-102.9	-11.4	-171.1	-74.8	-80.9	0	0	0	114.8	L682 T683 Y688 F689 A690 F712 T735 I737 V760 G764	L682-Y686 HydrophobicContact CD2-CD2 4.39Å; L682-Y686 HydrophobicContact CD2-CE2 4.06Å; L682-Y686 WeakPolarHBondContact O-CD2 3.18Å; L682-Y686 PolarHBondContact O-N 3.17Å; L682-Y686 VanDerWaalsContact O-N 3.07Å; T683-Y686 PolarHBondContact O-N 3.47Å; Y686-Y688 VanDerWaalsContact C-N 3.26Å; Y686-Y688 PolarHBondContact O-N 3Å; Y686-Y688 VanDerWaalsContact O-N 3.15Å; Y686-F689 PolarHBondContact O-N 2.9Å; Y686-F689 VanDerWaalsContact O-N 3.12Å; Y686-A690 WeakPolarHBondContact O-CB 3.37Å; Y686-A690 PolarHBondContact O-N 3.33Å; Y686-F712 VanDerWaalsContact CB-CB 3.43Å; Y686-F712 HydrophobicContact CD1-CD2 4.04Å; Y686-F712 HydrophobicContact CD2-CB 4.18Å; Y686-F712 AromaticContact CD2-CD2 3.32Å; Y686-F712 HydrophobicContact CD2-CD2 3.32Å; Y686-F712 AromaticContact CD2-CE2 3.85Å; Y686-F712 HydrophobicContact CD2-CE2 3.85Å; Y686-F712 AromaticContact CD2-CG 4Å; Y686-F712 HydrophobicContact CD2-CG 4Å; Y686-F712 HydrophobicContact CE1-CD2 4.32Å; Y686-F712 AromaticContact CE2-CD2 3.66Å; Y686-F712 HydrophobicContact CE2-CD2 3.66Å; Y686-F712 AromaticContact CE2-CE2 3.7Å; Y686-F712 HydrophobicContact CE2-CE2 3.7Å; Y686-F712 HydrophobicContact CG-CB 3.95Å; Y686-F712 AromaticContact CG-CD2 3.54Å; Y686-F712 HydrophobicContact CG-CD2 3.54Å; Y686-F712 HydrophobicContact CG-CE2 4.41Å; Y686-F712 HydrophobicContact CG-CG 4.16Å; Y686-T735 WeakPolarHBondContact CE1-O 3.36Å; Y686-T735 VanDerWaalsContact OH-CA 3.28Å; Y686-T735 WeakPolarHBondContact OH-CA 3.35Å; Y686-T735 WeakPolarHBondContact OH-CB 3.4Å; Y686-T735 PolarHBondContact OH-O 3.39Å; Y686-I737 HydrophobicContact CD1-CD1 4.15Å; Y686-I737 HydrophobicContact CD1-CG1 4.27Å; Y686-I737 HydrophobicContact CE1-CD1 3.91Å; Y686-I737 HydrophobicContact CE1-CG1 3.89Å; Y686-V760 HydrophobicContact CE1-CG1 4.43Å; Y686-G764 WeakPolarHBondContact OH-CA 3.48Å
687	W	84.7	Confident	80.6	Confident	152 Å²	152	57.5 Å²	57.5	58%	0.576	31%	0.306	S	S	*	.	H	α-helix	trans	-54.6	-39	-173.3	179.2	83.9	0	0	0	113.4	T683 N691	T683-W687 HydrophobicContact CG2-CB 4.48Å; T683-W687 WeakPolarHBondContact O-CA 3.39Å; T683-W687 WeakPolarHBondContact O-CB 3.49Å; T683-W687 PolarHBondContact O-N 3.42Å; W687-N691 VanDerWaalsContact CD1-ND2 3.28Å; W687-N691 PolarHBondContact NE1-ND2 3.14Å; W687-N691 WeakPolarHBondContact O-CB 3.09Å; W687-N691 PolarHBondContact O-N 3.01Å; W687-N691 PolarHBondContact O-ND2 2.88Å
688	Y	82.2	Confident	79	Confident	160 Å²	160	56.3 Å²	56.3	63%	0.627	30%	0.297	S	S	*	.	H	α-helix	trans	-66.4	-51	177.7	178.9	-100.7	0	0	0	111.9	Y686 A690 N691 I692	Y686-Y688 VanDerWaalsContact C-N 3.26Å; Y686-Y688 PolarHBondContact O-N 3Å; Y686-Y688 VanDerWaalsContact O-N 3.15Å; Y688-A690 PolarHBondContact O-N 3.43Å; Y688-N691 PolarHBondContact O-N 3.32Å; Y688-I692 PolarHBondContact O-N 3.27Å
689	F	78.6	Confident	77.4	Confident	58 Å²	58	64.5 Å²	64.5	25%	0.254	34%	0.335	S	S	.	.	H	α-helix	trans	-69	-34.1	-177.5	-62.6	-75.2	0	0	0	112.8	Y686 N691 I692 S707 I737 V760	Y686-F689 PolarHBondContact O-N 2.9Å; Y686-F689 VanDerWaalsContact O-N 3.12Å; F689-N691 VanDerWaalsContact C-N 3.35Å; F689-I692 VanDerWaalsContact O-CG2 3.23Å; F689-I692 WeakPolarHBondContact O-CG2 3.05Å; F689-S707 WeakPolarHBondContact O-CB 3.46Å; F689-S707 PolarHBondContact O-OG 3.01Å; F689-I737 HydrophobicContact CB-CD1 4.1Å; F689-I737 HydrophobicContact CD1-CD1 4.21Å; F689-I737 HydrophobicContact CD2-CD1 3.78Å; F689-I737 HydrophobicContact CE2-CD1 4.26Å; F689-I737 HydrophobicContact CG-CD1 3.76Å; F689-V760 HydrophobicContact CD2-CG1 4.18Å; F689-V760 HydrophobicContact CE2-CB 4.29Å; F689-V760 HydrophobicContact CE2-CG1 3.89Å; F689-V760 HydrophobicContact CE2-CG2 3.86Å; F689-V760 HydrophobicContact CZ-CG2 4.19Å
690	A	77.5	Confident	75.8	Confident	10 Å²	10	67.1 Å²	67.1	8%	0.083	37%	0.365	C	S	.	.	H	α-helix	trans	-77.9	-18.1	-178.5	0	0	0	0	0	113.9	Y686 Y688 S707 K713	Y686-A690 WeakPolarHBondContact O-CB 3.37Å; Y686-A690 PolarHBondContact O-N 3.33Å; Y688-A690 PolarHBondContact O-N 3.43Å; A690-S707 WeakPolarHBondContact CA-OG 3.45Å; A690-S707 PolarHBondContact O-OG 3.19Å; A690-K713 HydrophobicContact CB-CB 3.96Å; A690-K713 HydrophobicContact CB-CG 4.41Å
691	N	76.2	Confident	74	Confident	58 Å²	58	70.6 Å²	70.6	31%	0.31	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-0.2	177.3	-74.4	-60.2	0	0	0	113.5	W687 Y688 F689 I693 K713	W687-N691 VanDerWaalsContact CD1-ND2 3.28Å; W687-N691 PolarHBondContact NE1-ND2 3.14Å; W687-N691 WeakPolarHBondContact O-CB 3.09Å; W687-N691 PolarHBondContact O-N 3.01Å; W687-N691 PolarHBondContact O-ND2 2.88Å; Y688-N691 PolarHBondContact O-N 3.32Å; F689-N691 VanDerWaalsContact C-N 3.35Å; N691-I693 PolarHBondContact O-N 3.37Å; N691-K713 PolarHBondContact ND2-O 2.84Å; N691-K713 WeakPolarHBondContact OD1-CE 3.35Å; N691-K713 WeakPolarHBondContact OD1-CG 3.3Å
692	I	73.3	Confident	72.1	Confident	50 Å²	50	73.8 Å²	73.8	26%	0.256	39%	0.385	S	S	.	.			trans	-71.6	120.8	176.5	-154.8	169.8	0	0	0	109.5	Y688 F689 V694 S707 L741	Y688-I692 PolarHBondContact O-N 3.27Å; F689-I692 VanDerWaalsContact O-CG2 3.23Å; F689-I692 WeakPolarHBondContact O-CG2 3.05Å; I692-V694 HydrophobicContact CG1-CG2 4.48Å; I692-S707 PolarHBondContact O-N 2.86Å; I692-L741 HydrophobicContact CG2-CD2 3.55Å
693	I	67	Low	70.6	Confident	116 Å²	116	76.8 Å²	76.8	60%	0.595	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.9	116.3	171.9	41.2	164.1	0	0	0	106.9	N691 A706	N691-I693 PolarHBondContact O-N 3.37Å; I693-A706 HydrophobicContact CG2-CB 4.36Å
694	V	64.2	Low	69.1	Low	5 Å²	5	84.9 Å²	84.9	3%	0.03	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	119.4	175.3	-173	0	0	0	0	106.9	I692 V696 R704 Y705 Y745	I692-V694 HydrophobicContact CG1-CG2 4.48Å; V694-V696 HydrophobicContact CG1-CG2 4.05Å; V694-R704 CarbonylContact O-C 3.46Å; V694-R704 VanDerWaalsContact O-CA 3.3Å; V694-R704 WeakPolarHBondContact O-CA 3.43Å; V694-Y705 HydrophobicContact CB-CD2 4.49Å; V694-Y705 HydrophobicContact CG1-CD2 4.47Å; V694-Y705 PolarHBondContact N-O 3.16Å; V694-Y705 PolarHBondContact O-N 3.36Å; V694-Y745 HydrophobicContact CB-CD2 4.34Å; V694-Y745 HydrophobicContact CB-CE2 4.12Å; V694-Y745 HydrophobicContact CG1-CD2 3.64Å; V694-Y745 HydrophobicContact CG1-CE2 3.55Å; V694-Y745 HydrophobicContact CG1-CG 4.29Å; V694-Y745 HydrophobicContact CG2-CD2 3.73Å; V694-Y745 HydrophobicContact CG2-CE2 3.55Å
695	S	65.1	Low	67.5	Low	70 Å²	70	82.1 Å²	82.1	49%	0.49	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	116	171.8	59.9	0	0	0	0	109	I703	S695-I703 WeakPolarHBondContact CA-O 3.5Å
696	V	60.4	Low	66.2	Low	23 Å²	23	83.1 Å²	83.1	14%	0.139	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	128.9	176	-179.5	0	0	0	0	108.3	V694 A698 L702 I703 Y705 P746	V694-V696 HydrophobicContact CG1-CG2 4.05Å; V696-A698 PolarHBondContact O-N 3.22Å; V696-L702 CarbonylContact O-C 3.48Å; V696-L702 WeakPolarHBondContact O-CA 3.23Å; V696-I703 PolarHBondContact N-O 2.98Å; V696-I703 PolarHBondContact O-N 3.48Å; V696-Y705 HydrophobicContact CB-CE2 4.17Å; V696-Y705 HydrophobicContact CG2-CD2 3.99Å; V696-Y705 HydrophobicContact CG2-CE2 3.73Å; V696-P746 HydrophobicContact CB-CG 4.49Å; V696-P746 HydrophobicContact CG1-CG 4.01Å; V696-P746 HydrophobicContact CG2-CG 3.78Å
697	D	61.1	Low	65	Low	114 Å²	114	83.9 Å²	83.9	61%	0.61	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.1	92.8	168.5	-171.1	6.4	0	0	0	108.8	G700	D697-G700 VanDerWaalsContact OD1-CA 3.22Å; D697-G700 WeakPolarHBondContact OD1-CA 3.05Å; D697-G700 PolarHBondContact OD1-N 2.93Å
698	A	59.3	Low	63.7	Low	38 Å²	38	79.9 Å²	79.9	31%	0.314	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	111.6	173.6	0	0	0	0	0	108.2	V696 G700 Q701 I703	V696-A698 PolarHBondContact O-N 3.22Å; A698-G700 VanDerWaalsContact C-N 3.27Å; A698-G700 PolarHBondContact O-N 3.11Å; A698-Q701 PolarHBondContact N-O 3.23Å; A698-Q701 WeakPolarHBondContact O-CA 3.47Å; A698-Q701 PolarHBondContact O-N 3.31Å; A698-I703 HydrophobicContact CB-CD1 4.16Å
699	Q	59.1	Low	62.8	Low	207 Å²	207	73.2 Å²	73.2	97%	0.967	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	36.3	172.9	-56.5	177	-3.5	0	0	114.3	Q701	Q699-Q701 VanDerWaalsContact C-N 3.26Å; Q699-Q701 PolarHBondContact O-N 3.12Å
700	G	58.8	Low	62.3	Low	68 Å²	68	75 Å²	75	70%	0.701	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.3	1.4	-177	0	0	0	0	0	114.4	D697 A698	D697-G700 VanDerWaalsContact OD1-CA 3.22Å; D697-G700 WeakPolarHBondContact OD1-CA 3.05Å; D697-G700 PolarHBondContact OD1-N 2.93Å; A698-G700 VanDerWaalsContact C-N 3.27Å; A698-G700 PolarHBondContact O-N 3.11Å
701	Q	54.5	Low	62.2	Low	143 Å²	143	75.5 Å²	75.5	67%	0.668	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.2	117.2	166	-75.4	-165.3	-16.2	0	0	110.5	A698 Q699 I703	A698-Q701 PolarHBondContact N-O 3.23Å; A698-Q701 WeakPolarHBondContact O-CA 3.47Å; A698-Q701 PolarHBondContact O-N 3.31Å; Q699-Q701 VanDerWaalsContact C-N 3.26Å; Q699-Q701 PolarHBondContact O-N 3.12Å; Q701-I703 PolarHBondContact O-N 2.99Å
702	L	52.1	Low	62.6	Low	100 Å²	100	72.8 Å²	72.8	52%	0.524	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	91	170.8	-166.6	83.4	0	0	0	109.7	V696 R704	V696-L702 CarbonylContact O-C 3.48Å; V696-L702 WeakPolarHBondContact O-CA 3.23Å; L702-R704 HydrophobicContact CD2-CG 4.41Å; L702-R704 PolarHBondContact O-N 3.41Å
703	I	58.4	Low	63	Low	64 Å²	64	75.2 Å²	75.2	33%	0.328	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	117.8	173.6	-56.2	176.2	0	0	0	107.8	S695 V696 A698 Q701 Y705	S695-I703 WeakPolarHBondContact CA-O 3.5Å; V696-I703 PolarHBondContact N-O 2.98Å; V696-I703 PolarHBondContact O-N 3.48Å; A698-I703 HydrophobicContact CB-CD1 4.16Å; Q701-I703 PolarHBondContact O-N 2.99Å; I703-Y705 HydrophobicContact CG2-CD1 4.4Å; I703-Y705 HydrophobicContact CG2-CE1 3.82Å; I703-Y705 HydrophobicContact CG2-CE2 4.11Å
704	R	56.7	Low	63.9	Low	178 Å²	178	72.4 Å²	72.4	67%	0.672	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.3	109.1	175.8	-71.2	-176.8	166.3	-163.9	-3.8	109.8	V694 L702	V694-R704 CarbonylContact O-C 3.46Å; V694-R704 VanDerWaalsContact O-CA 3.3Å; V694-R704 WeakPolarHBondContact O-CA 3.43Å; L702-R704 HydrophobicContact CD2-CG 4.41Å; L702-R704 PolarHBondContact O-N 3.41Å
705	Y	56.9	Low	65.1	Low	64 Å²	64	76.3 Å²	76.3	25%	0.251	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	112.6	163.5	-51.4	-73.6	0	0	0	108.5	V694 V696 I703 M744	V694-Y705 HydrophobicContact CB-CD2 4.49Å; V694-Y705 HydrophobicContact CG1-CD2 4.47Å; V694-Y705 PolarHBondContact N-O 3.16Å; V694-Y705 PolarHBondContact O-N 3.36Å; V696-Y705 HydrophobicContact CB-CE2 4.17Å; V696-Y705 HydrophobicContact CG2-CD2 3.99Å; V696-Y705 HydrophobicContact CG2-CE2 3.73Å; I703-Y705 HydrophobicContact CG2-CD1 4.4Å; I703-Y705 HydrophobicContact CG2-CE1 3.82Å; I703-Y705 HydrophobicContact CG2-CE2 4.11Å; Y705-M744 HydrophobicContact CD1-CE 3.67Å; Y705-M744 HydrophobicContact CD1-CG 4.01Å; Y705-M744 HydrophobicContact CD1-SD 3.23Å; Y705-M744 WeakPolarHBondContact CD1-SD 3.29Å; Y705-M744 HydrophobicContact CD2-CG 3.9Å; Y705-M744 HydrophobicContact CD2-SD 4.21Å; Y705-M744 HydrophobicContact CE1-CE 3.06Å; Y705-M744 HydrophobicContact CE1-CG 3.9Å; Y705-M744 HydrophobicContact CE1-SD 3.3Å; Y705-M744 WeakPolarHBondContact CE1-SD 3.11Å; Y705-M744 HydrophobicContact CE2-CE 4.45Å; Y705-M744 HydrophobicContact CE2-CG 3.76Å; Y705-M744 HydrophobicContact CE2-SD 4.25Å; Y705-M744 HydrophobicContact CG-CG 4Å; Y705-M744 HydrophobicContact CG-SD 3.71Å
706	A	58.6	Low	66.3	Low	64 Å²	64	75 Å²	75	53%	0.529	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	149.1	165.6	0	0	0	0	0	108.3	I693 G708	I693-A706 HydrophobicContact CG2-CB 4.36Å; A706-G708 PolarHBondContact O-N 3.38Å
707	S	60.5	Low	67.5	Low	20 Å²	20	75.2 Å²	75.2	14%	0.14	44%	0.444	C	S	.	.			trans	-53.7	131.1	166	64	0	0	0	0	109.5	F689 A690 I692 I709	F689-S707 WeakPolarHBondContact O-CB 3.46Å; F689-S707 PolarHBondContact O-OG 3.01Å; A690-S707 WeakPolarHBondContact CA-OG 3.45Å; A690-S707 PolarHBondContact O-OG 3.19Å; I692-S707 PolarHBondContact O-N 2.86Å; S707-I709 PolarHBondContact O-N 3.17Å
708	G	58.1	Low	68.9	Low	68 Å²	68	69.8 Å²	69.8	70%	0.701	42%	0.415	S	S	*	.	S	Bend	trans	-64.3	1.1	-177.3	0	0	0	0	0	116	A706 P710	A706-G708 PolarHBondContact O-N 3.38Å; G708-P710 VanDerWaalsContact O-CD 3.26Å; G708-P710 WeakPolarHBondContact O-CD 3.41Å
709	I	63.3	Low	70.4	Confident	20 Å²	20	73 Å²	73	10%	0.103	42%	0.422	C	S	.	.			trans	-117	89.2	-171.9	-47.5	164.4	0	0	0	110.2	S707 S711 V734 T736 I737	S707-I709 PolarHBondContact O-N 3.17Å; I709-S711 PolarHBondContact O-N 3.45Å; I709-V734 WeakPolarHBondContact CG2-O 3.12Å; I709-T736 WeakPolarHBondContact CD1-O 3.4Å; I709-I737 HydrophobicContact CD1-CG1 4.2Å
710	P	67.5	Low	71.8	Confident	94 Å²	94	68.3 Å²	68.3	61%	0.61	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-70.4	-16.2	171.1	29.6	-34.3	0	0	0	112.3	G708 F712 K713	G708-P710 VanDerWaalsContact O-CD 3.26Å; G708-P710 WeakPolarHBondContact O-CD 3.41Å; P710-F712 VanDerWaalsContact C-N 3.26Å; P710-F712 PolarHBondContact O-N 3.29Å; P710-F712 VanDerWaalsContact O-N 3.13Å; P710-K713 WeakPolarHBondContact O-CB 3.35Å; P710-K713 PolarHBondContact O-N 3.49Å
711	S	75.8	Confident	73.2	Confident	22 Å²	22	65.9 Å²	65.9	15%	0.154	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-57.3	-33.9	-166.6	-50.1	0	0	0	0	114.2	I709 A717 T718 T721 V734	I709-S711 PolarHBondContact O-N 3.45Å; S711-A717 CarbonylContact O-C 3.58Å; S711-A717 WeakPolarHBondContact O-CB 3.25Å; S711-A717 VanDerWaalsContact O-O 3.11Å; S711-T718 WeakPolarHBondContact O-CA 3.46Å; S711-T718 PolarHBondContact O-N 3.43Å; S711-T718 VanDerWaalsContact O-N 3.11Å; S711-T721 PolarHBondContact O-OG1 3.06Å; S711-V734 VanDerWaalsContact CB-CG1 3.49Å
712	F	83	Confident	74.9	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-119.5	21.4	-175.4	-53.4	-43.9	0	0	0	114.5	L682 Y686 P710 T718 T721 V734 T735	L682-F712 HydrophobicContact CD1-CE1 4.45Å; L682-F712 HydrophobicContact CD1-CZ 4.46Å; Y686-F712 VanDerWaalsContact CB-CB 3.43Å; Y686-F712 HydrophobicContact CD1-CD2 4.04Å; Y686-F712 HydrophobicContact CD2-CB 4.18Å; Y686-F712 AromaticContact CD2-CD2 3.32Å; Y686-F712 HydrophobicContact CD2-CD2 3.32Å; Y686-F712 AromaticContact CD2-CE2 3.85Å; Y686-F712 HydrophobicContact CD2-CE2 3.85Å; Y686-F712 AromaticContact CD2-CG 4Å; Y686-F712 HydrophobicContact CD2-CG 4Å; Y686-F712 HydrophobicContact CE1-CD2 4.32Å; Y686-F712 AromaticContact CE2-CD2 3.66Å; Y686-F712 HydrophobicContact CE2-CD2 3.66Å; Y686-F712 AromaticContact CE2-CE2 3.7Å; Y686-F712 HydrophobicContact CE2-CE2 3.7Å; Y686-F712 HydrophobicContact CG-CB 3.95Å; Y686-F712 AromaticContact CG-CD2 3.54Å; Y686-F712 HydrophobicContact CG-CD2 3.54Å; Y686-F712 HydrophobicContact CG-CE2 4.41Å; Y686-F712 HydrophobicContact CG-CG 4.16Å; P710-F712 VanDerWaalsContact C-N 3.26Å; P710-F712 PolarHBondContact O-N 3.29Å; P710-F712 VanDerWaalsContact O-N 3.13Å; F712-T718 HydrophobicContact CB-CG2 3.76Å; F712-T718 HydrophobicContact CD1-CG2 3.58Å; F712-T718 HydrophobicContact CG-CG2 4.08Å; F712-T721 HydrophobicContact CE1-CG2 4.05Å; F712-V734 HydrophobicContact CD2-CG1 4.24Å; F712-V734 HydrophobicContact CE1-CG1 3.97Å; F712-V734 HydrophobicContact CE2-CG1 3.47Å; F712-V734 VanDerWaalsContact CE2-CG1 3.47Å; F712-V734 HydrophobicContact CZ-CB 4.48Å; F712-V734 HydrophobicContact CZ-CG1 3.33Å; F712-T735 HydrophobicContact CE2-CG2 4.25Å
713	K	83	Confident	76.6	Confident	101 Å²	101	59.1 Å²	59.1	44%	0.439	33%	0.333	S	S	.	.	S	Bend	trans	-66.5	-36.8	-178.2	-173.1	179.6	179.4	177.8	0	113.8	A690 N691 P710	A690-K713 HydrophobicContact CB-CB 3.96Å; A690-K713 HydrophobicContact CB-CG 4.41Å; N691-K713 PolarHBondContact ND2-O 2.84Å; N691-K713 WeakPolarHBondContact OD1-CE 3.35Å; N691-K713 WeakPolarHBondContact OD1-CG 3.3Å; P710-K713 WeakPolarHBondContact O-CB 3.35Å; P710-K713 PolarHBondContact O-N 3.49Å
714	S	86.4	Confident	78	Confident	57 Å²	57	60.5 Å²	60.5	40%	0.399	33%	0.334	S	S	.	.	S	Bend	trans	-140.7	162.5	-178.2	74.5	0	0	0	0	110.5	G716 A717 T718	S714-G716 PolarHBondContact O-N 3.34Å; S714-A717 PolarHBondContact O-N 3.46Å; S714-A717 VanDerWaalsContact O-N 3.11Å; S714-A717 PolarHBondContact OG-N 2.86Å; S714-T718 PolarHBondContact O-N 2.9Å; S714-T718 PolarHBondContact O-OG1 3.25Å; S714-T718 VanDerWaalsContact O-OG1 3.08Å
715	T	89.1	Confident	79.4	Confident	88 Å²	88	52.1 Å²	52.1	54%	0.54	30%	0.303	S	S	.	.	H	α-helix	trans	-56.1	-35.6	176	52.8	0	0	0	0	112.8	T683 T718 F719	T683-T715 HydrophobicContact CG2-CG2 3.98Å; T715-T718 WeakPolarHBondContact CA-OG1 3.4Å; T715-T718 PolarHBondContact O-OG1 2.87Å; T715-F719 WeakPolarHBondContact O-CB 3.31Å; T715-F719 PolarHBondContact O-N 3.4Å
716	G	89.2	Confident	80.7	Confident	43 Å²	43	50.2 Å²	50.2	44%	0.443	30%	0.297	S	S	.	.	H	α-helix	trans	-69	-43.3	176.5	0	0	0	0	0	112.7	S714 F719 H720	S714-G716 PolarHBondContact O-N 3.34Å; G716-F719 PolarHBondContact O-N 3.45Å; G716-H720 PolarHBondContact O-N 2.97Å
717	A	86.4	Confident	81.9	Confident	27 Å²	27	52.8 Å²	52.8	22%	0.223	30%	0.297	C	S	.	.	H	α-helix	trans	-67	-42	177.3	0	0	0	0	0	111.7	S711 S714 F719 H720 T721	S711-A717 CarbonylContact O-C 3.58Å; S711-A717 WeakPolarHBondContact O-CB 3.25Å; S711-A717 VanDerWaalsContact O-O 3.11Å; S714-A717 PolarHBondContact O-N 3.46Å; S714-A717 VanDerWaalsContact O-N 3.11Å; S714-A717 PolarHBondContact OG-N 2.86Å; A717-F719 VanDerWaalsContact C-N 3.32Å; A717-F719 PolarHBondContact O-N 3.44Å; A717-H720 PolarHBondContact O-N 3.36Å; A717-T721 PolarHBondContact O-N 3.14Å; A717-T721 PolarHBondContact O-OG1 3.46Å
718	T	89.7	Confident	82.8	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-61.1	-42.6	175.1	46	0	0	0	0	111.2	T683 S711 F712 S714 T715 T721 L722	T683-T718 VanDerWaalsContact OG1-CG2 3.32Å; T683-T718 WeakPolarHBondContact OG1-CG2 3.27Å; T683-T718 PolarHBondContact OG1-OG1 3.04Å; T683-T718 VanDerWaalsContact OG1-OG1 3.1Å; S711-T718 WeakPolarHBondContact O-CA 3.46Å; S711-T718 PolarHBondContact O-N 3.43Å; S711-T718 VanDerWaalsContact O-N 3.11Å; F712-T718 HydrophobicContact CB-CG2 3.76Å; F712-T718 HydrophobicContact CD1-CG2 3.58Å; F712-T718 HydrophobicContact CG-CG2 4.08Å; S714-T718 PolarHBondContact O-N 2.9Å; S714-T718 PolarHBondContact O-OG1 3.25Å; S714-T718 VanDerWaalsContact O-OG1 3.08Å; T715-T718 WeakPolarHBondContact CA-OG1 3.4Å; T715-T718 PolarHBondContact O-OG1 2.87Å; T718-T721 PolarHBondContact O-N 3.17Å; T718-L722 WeakPolarHBondContact O-CB 3.32Å; T718-L722 VanDerWaalsContact O-CG 3.3Å; T718-L722 WeakPolarHBondContact O-CG 3.29Å; T718-L722 PolarHBondContact O-N 3.02Å
719	F	91.8	Very high	83.8	Confident	105 Å²	105	58.1 Å²	58.1	46%	0.461	32%	0.317	S	S	.	.	H	α-helix	trans	-63.1	-47.4	177.7	173.6	-97	0	0	0	111.2	V675 V679 T715 G716 A717 T721 L722 Y723	V675-F719 HydrophobicContact CG1-CD2 3.84Å; V675-F719 HydrophobicContact CG1-CE2 3.9Å; V679-F719 HydrophobicContact CG2-CB 3.94Å; V679-F719 HydrophobicContact CG2-CD2 4.14Å; T715-F719 WeakPolarHBondContact O-CB 3.31Å; T715-F719 PolarHBondContact O-N 3.4Å; G716-F719 PolarHBondContact O-N 3.45Å; A717-F719 VanDerWaalsContact C-N 3.32Å; A717-F719 PolarHBondContact O-N 3.44Å; F719-T721 VanDerWaalsContact C-N 3.31Å; F719-T721 PolarHBondContact O-N 3.39Å; F719-L722 PolarHBondContact O-N 3.25Å; F719-Y723 HydrophobicContact CZ-CD2 4.5Å; F719-Y723 WeakPolarHBondContact O-CB 3.23Å; F719-Y723 PolarHBondContact O-N 3.24Å
720	H	89	Confident	84.6	Confident	109 Å²	109	58.4 Å²	58.4	51%	0.505	32%	0.321	S	S	.	.	H	α-helix	trans	-57.1	-45.6	177.2	-177.6	-90.3	0	0	0	111.6	G716 A717 Y723 W724	G716-H720 PolarHBondContact O-N 2.97Å; A717-H720 PolarHBondContact O-N 3.36Å; H720-Y723 PolarHBondContact O-N 3.25Å; H720-W724 AromaticContact CD2-CD1 3.86Å; H720-W724 AromaticContact CD2-NE1 3.53Å; H720-W724 AromaticContact CE1-CD1 3.28Å; H720-W724 AromaticContact CE1-NE1 3.27Å; H720-W724 PolarHBondContact CE1-NE1 3.35Å; H720-W724 VanDerWaalsContact CE1-NE1 3.27Å; H720-W724 AromaticContact CG-CD1 3.94Å; H720-W724 AromaticContact ND1-CD1 3.58Å; H720-W724 AromaticContact ND1-NE1 3.93Å; H720-W724 AromaticContact NE2-CD1 3.46Å; H720-W724 AromaticContact NE2-NE1 2.96Å; H720-W724 PolarHBondContact NE2-NE1 2.96Å; H720-W724 PolarHBondContact O-N 3.38Å; H720-W724 VanDerWaalsContact O-N 3.12Å
721	T	87.3	Confident	85	Confident	17 Å²	17	56.9 Å²	56.9	10%	0.104	31%	0.313	C	S	.	.	H	α-helix	trans	-64	-46.3	179.6	-53.7	0	0	0	0	112.1	S711 F712 A717 T718 F719 A725 V734	S711-T721 PolarHBondContact O-OG1 3.06Å; F712-T721 HydrophobicContact CE1-CG2 4.05Å; A717-T721 PolarHBondContact O-N 3.14Å; A717-T721 PolarHBondContact O-OG1 3.46Å; T718-T721 PolarHBondContact O-N 3.17Å; F719-T721 VanDerWaalsContact C-N 3.31Å; F719-T721 PolarHBondContact O-N 3.39Å; T721-A725 WeakPolarHBondContact O-CB 3.37Å; T721-A725 PolarHBondContact O-N 3.45Å; T721-V734 HydrophobicContact CG2-CG1 3.86Å; T721-V734 HydrophobicContact CG2-CG2 4.33Å
722	L	89.3	Confident	84.7	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-68.3	-36.4	178.4	-69.7	173.8	0	0	0	112.2	F678 V679 L682 T718 F719 A725 L726 Y768 Y771	F678-L722 HydrophobicContact CB-CD1 4.16Å; V679-L722 HydrophobicContact CB-CD1 4.46Å; V679-L722 HydrophobicContact CG2-CD1 3.71Å; L682-L722 HydrophobicContact CD1-CD1 4.08Å; L682-L722 HydrophobicContact CD1-CD2 3.72Å; L682-L722 HydrophobicContact CD1-CG 4.34Å; T718-L722 WeakPolarHBondContact O-CB 3.32Å; T718-L722 VanDerWaalsContact O-CG 3.3Å; T718-L722 WeakPolarHBondContact O-CG 3.29Å; T718-L722 PolarHBondContact O-N 3.02Å; F719-L722 PolarHBondContact O-N 3.25Å; L722-A725 WeakPolarHBondContact O-CB 3.49Å; L722-A725 PolarHBondContact O-N 3.27Å; L722-L726 PolarHBondContact O-N 3.46Å; L722-Y768 HydrophobicContact CD2-CD2 4.03Å; L722-Y768 HydrophobicContact CD2-CE2 4.06Å; L722-Y771 HydrophobicContact CB-CE1 4.15Å; L722-Y771 HydrophobicContact CB-CE2 4.44Å; L722-Y771 HydrophobicContact CD2-CD1 3.7Å; L722-Y771 HydrophobicContact CD2-CD2 4.36Å; L722-Y771 HydrophobicContact CD2-CE1 3.67Å; L722-Y771 HydrophobicContact CD2-CE2 4.3Å; L722-Y771 HydrophobicContact CD2-CG 4.06Å; L722-Y771 HydrophobicContact CG-CE1 4.48Å; L722-Y771 PolarHBondContact O-OH 3.34Å
723	Y	89.1	Confident	84.3	Confident	101 Å²	101	67.3 Å²	67.3	40%	0.396	37%	0.372	S	S	.	.	H	α-helix	trans	-61	-48.9	176.1	176	-94.4	0	0	0	111.7	F719 H720 A725 L726 F727	F719-Y723 HydrophobicContact CZ-CD2 4.5Å; F719-Y723 WeakPolarHBondContact O-CB 3.23Å; F719-Y723 PolarHBondContact O-N 3.24Å; H720-Y723 PolarHBondContact O-N 3.25Å; Y723-A725 VanDerWaalsContact C-N 3.29Å; Y723-A725 PolarHBondContact O-N 2.9Å; Y723-L726 VanDerWaalsContact O-CB 3.23Å; Y723-L726 WeakPolarHBondContact O-CB 3.15Å; Y723-L726 PolarHBondContact O-N 2.97Å; Y723-F727 HydrophobicContact CE1-CD2 4.49Å; Y723-F727 HydrophobicContact CE1-CE2 4.11Å; Y723-F727 HydrophobicContact CE2-CE2 4.18Å; Y723-F727 AromaticContact CZ-CE2 3.77Å
724	W	86.8	Confident	84	Confident	93 Å²	93	62.7 Å²	62.7	35%	0.352	35%	0.352	S	S	.	.	H	α-helix	trans	-71.1	-25.1	177	-69.6	115.4	0	0	0	113.1	H720 L726 F727 G728 Q729	H720-W724 AromaticContact CD2-CD1 3.86Å; H720-W724 AromaticContact CD2-NE1 3.53Å; H720-W724 AromaticContact CE1-CD1 3.28Å; H720-W724 AromaticContact CE1-NE1 3.27Å; H720-W724 PolarHBondContact CE1-NE1 3.35Å; H720-W724 VanDerWaalsContact CE1-NE1 3.27Å; H720-W724 AromaticContact CG-CD1 3.94Å; H720-W724 AromaticContact ND1-CD1 3.58Å; H720-W724 AromaticContact ND1-NE1 3.93Å; H720-W724 AromaticContact NE2-CD1 3.46Å; H720-W724 AromaticContact NE2-NE1 2.96Å; H720-W724 PolarHBondContact NE2-NE1 2.96Å; H720-W724 PolarHBondContact O-N 3.38Å; H720-W724 VanDerWaalsContact O-N 3.12Å; W724-L726 VanDerWaalsContact C-N 3.25Å; W724-L726 PolarHBondContact O-N 3.31Å; W724-F727 PolarHBondContact O-N 3.01Å; W724-G728 PolarHBondContact O-N 3.19Å; W724-Q729 HydrophobicContact CB-CB 4.25Å; W724-Q729 HydrophobicContact CE3-CB 4.48Å; W724-Q729 PolarHBondContact O-N 3.07Å
725	A	85.8	Confident	83.7	Confident	2 Å²	2	60.4 Å²	60.4	2%	0.017	34%	0.336	C	S	.	.	H	α-helix	trans	-61.5	-32.5	171.5	0	0	0	0	0	112.7	T721 L722 Y723 F727 G728 S730 Y768 Y771	T721-A725 WeakPolarHBondContact O-CB 3.37Å; T721-A725 PolarHBondContact O-N 3.45Å; L722-A725 WeakPolarHBondContact O-CB 3.49Å; L722-A725 PolarHBondContact O-N 3.27Å; Y723-A725 VanDerWaalsContact C-N 3.29Å; Y723-A725 PolarHBondContact O-N 2.9Å; A725-F727 PolarHBondContact O-N 2.83Å; A725-G728 PolarHBondContact O-N 3.49Å; A725-S730 WeakPolarHBondContact CA-OG 3.32Å; A725-S730 WeakPolarHBondContact CB-OG 3.49Å; A725-Y768 HydrophobicContact CB-CE2 4Å; A725-Y768 VanDerWaalsContact CB-OH 3.31Å; A725-Y768 WeakPolarHBondContact CB-OH 3.43Å; A725-Y771 HydrophobicContact CB-CE1 4.29Å
726	L	85	Confident	83.1	Confident	23 Å²	23	59.2 Å²	59.2	12%	0.12	33%	0.329	C	S	.	.	H	α-helix	trans	-56.3	-37	175	-177.1	66.9	0	0	0	112.5	F671 L722 Y723 W724 M775 I776	F671-L726 HydrophobicContact CE1-CD2 4.16Å; F671-L726 HydrophobicContact CE2-CD1 4Å; F671-L726 HydrophobicContact CE2-CD2 4.25Å; F671-L726 HydrophobicContact CZ-CD1 3.64Å; F671-L726 HydrophobicContact CZ-CD2 3.42Å; F671-L726 VanDerWaalsContact CZ-CD2 3.42Å; F671-L726 HydrophobicContact CZ-CG 4.11Å; L722-L726 PolarHBondContact O-N 3.46Å; Y723-L726 VanDerWaalsContact O-CB 3.23Å; Y723-L726 WeakPolarHBondContact O-CB 3.15Å; Y723-L726 PolarHBondContact O-N 2.97Å; W724-L726 VanDerWaalsContact C-N 3.25Å; W724-L726 PolarHBondContact O-N 3.31Å; L726-M775 HydrophobicContact CD1-CB 4.04Å; L726-I776 HydrophobicContact CD1-CG1 4.4Å
727	F	84.3	Confident	82.4	Confident	119 Å²	119	57.9 Å²	57.9	52%	0.522	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	8.7	-179.8	-59.9	-74.1	0	0	0	112.8	Y723 W724 A725 Q729	Y723-F727 HydrophobicContact CE1-CD2 4.49Å; Y723-F727 HydrophobicContact CE1-CE2 4.11Å; Y723-F727 HydrophobicContact CE2-CE2 4.18Å; Y723-F727 AromaticContact CZ-CE2 3.77Å; W724-F727 PolarHBondContact O-N 3.01Å; A725-F727 PolarHBondContact O-N 2.83Å; F727-Q729 VanDerWaalsContact C-N 3.33Å; F727-Q729 PolarHBondContact O-N 3.36Å
728	G	78.9	Confident	81.7	Confident	61 Å²	61	60.8 Å²	60.8	63%	0.629	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.2	11.4	179.4	0	0	0	0	0	115.5	W724 A725	W724-G728 PolarHBondContact O-N 3.19Å; A725-G728 PolarHBondContact O-N 3.49Å
729	Q	80.1	Confident	80.7	Confident	138 Å²	138	66 Å²	66	65%	0.645	35%	0.347	S	S	*	.			trans	-93.7	11.4	-177.6	-67.7	-171.9	2.8	0	0	114.5	W724 F727	W724-Q729 HydrophobicContact CB-CB 4.25Å; W724-Q729 HydrophobicContact CE3-CB 4.48Å; W724-Q729 PolarHBondContact O-N 3.07Å; F727-Q729 VanDerWaalsContact C-N 3.33Å; F727-Q729 PolarHBondContact O-N 3.36Å
730	S	78.4	Confident	79.4	Confident	27 Å²	27	65.9 Å²	65.9	19%	0.189	35%	0.352	C	S	.	.	S	Bend	trans	-84.4	140.9	175.7	50.6	0	0	0	0	111.5	A725 Y768	A725-S730 WeakPolarHBondContact CA-OG 3.32Å; A725-S730 WeakPolarHBondContact CB-OG 3.49Å; S730-Y768 WeakPolarHBondContact CB-OH 3.47Å; S730-Y768 PolarHBondContact OG-OH 3Å
731	S	77	Confident	78.2	Confident	61 Å²	61	61.8 Å²	61.8	43%	0.427	33%	0.333	S	S	.	.			trans	-61.3	150.1	174.5	59.9	0	0	0	0	111.4	N733 V734	S731-N733 VanDerWaalsContact C-N 3.31Å; S731-N733 WeakPolarHBondContact CB-OD1 3.31Å; S731-N733 PolarHBondContact OG-OD1 3.36Å; S731-V734 WeakPolarHBondContact O-CG2 3.4Å; S731-V734 WeakPolarHBondContact OG-CG2 3.37Å
732	T	69.5	Low	77.1	Confident	143 Å²	143	62.8 Å²	62.8	88%	0.877	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-25.2	-177.4	48.8	0	0	0	0	112.3
733	N	75.2	Confident	76	Confident	98 Å²	98	65.5 Å²	65.5	52%	0.524	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	28	-176.9	65.3	-13.3	0	0	0	113.8	S731 T736	S731-N733 VanDerWaalsContact C-N 3.31Å; S731-N733 WeakPolarHBondContact CB-OD1 3.31Å; S731-N733 PolarHBondContact OG-OD1 3.36Å; N733-T736 PolarHBondContact O-OG1 2.99Å
734	V	75.4	Confident	74.8	Confident	4 Å²	4	64.8 Å²	64.8	2%	0.024	36%	0.364	C	S	.	.	S	Bend	trans	-70	-33.9	-178.7	179	0	0	0	0	112.1	I709 S711 F712 T721 S731	I709-V734 WeakPolarHBondContact CG2-O 3.12Å; S711-V734 VanDerWaalsContact CB-CG1 3.49Å; F712-V734 HydrophobicContact CD2-CG1 4.24Å; F712-V734 HydrophobicContact CE1-CG1 3.97Å; F712-V734 HydrophobicContact CE2-CG1 3.47Å; F712-V734 VanDerWaalsContact CE2-CG1 3.47Å; F712-V734 HydrophobicContact CZ-CB 4.48Å; F712-V734 HydrophobicContact CZ-CG1 3.33Å; T721-V734 HydrophobicContact CG2-CG1 3.86Å; T721-V734 HydrophobicContact CG2-CG2 4.33Å; S731-V734 WeakPolarHBondContact O-CG2 3.4Å; S731-V734 WeakPolarHBondContact OG-CG2 3.37Å
735	T	79.6	Confident	73.7	Confident	9 Å²	9	65.5 Å²	65.5	6%	0.055	37%	0.367	C	S	.	.	S	Bend	trans	-86.2	-15.1	-173.9	51.3	0	0	0	0	113.7	Y686 F712 I737 N761 S765 Y768	Y686-T735 WeakPolarHBondContact CE1-O 3.36Å; Y686-T735 VanDerWaalsContact OH-CA 3.28Å; Y686-T735 WeakPolarHBondContact OH-CA 3.35Å; Y686-T735 WeakPolarHBondContact OH-CB 3.4Å; Y686-T735 PolarHBondContact OH-O 3.39Å; F712-T735 HydrophobicContact CE2-CG2 4.25Å; T735-I737 PolarHBondContact O-N 3.26Å; T735-N761 PolarHBondContact O-OD1 3.28Å; T735-S765 WeakPolarHBondContact CB-OG 3.35Å; T735-S765 PolarHBondContact OG1-OG 3.4Å; T735-Y768 HydrophobicContact CG2-CD1 4.35Å; T735-Y768 HydrophobicContact CG2-CG 4.17Å
736	T	77.9	Confident	72.7	Confident	64 Å²	64	68.9 Å²	68.9	39%	0.393	39%	0.389	S	S	.	.			trans	-82.8	108.2	-173.3	54.7	0	0	0	0	111.8	I709 N733 N761	I709-T736 WeakPolarHBondContact CD1-O 3.4Å; N733-T736 PolarHBondContact O-OG1 2.99Å; T736-N761 WeakPolarHBondContact CA-OD1 3.28Å
737	I	74.5	Confident	71.8	Confident	14 Å²	14	70.9 Å²	70.9	7%	0.072	42%	0.415	C	S	.	.			trans	-73.6	130.9	172.1	-59	168.7	0	0	0	109.1	Y686 F689 I709 T735 E739 P757 V760	Y686-I737 HydrophobicContact CD1-CD1 4.15Å; Y686-I737 HydrophobicContact CD1-CG1 4.27Å; Y686-I737 HydrophobicContact CE1-CD1 3.91Å; Y686-I737 HydrophobicContact CE1-CG1 3.89Å; F689-I737 HydrophobicContact CB-CD1 4.1Å; F689-I737 HydrophobicContact CD1-CD1 4.21Å; F689-I737 HydrophobicContact CD2-CD1 3.78Å; F689-I737 HydrophobicContact CE2-CD1 4.26Å; F689-I737 HydrophobicContact CG-CD1 3.76Å; I709-I737 HydrophobicContact CD1-CG1 4.2Å; T735-I737 PolarHBondContact O-N 3.26Å; I737-E739 PolarHBondContact O-N 2.95Å; I737-E739 VanDerWaalsContact O-N 3.14Å; I737-P757 HydrophobicContact CB-CB 3.87Å; I737-P757 HydrophobicContact CB-CG 4.27Å; I737-P757 HydrophobicContact CD1-CB 3.96Å; I737-P757 HydrophobicContact CG1-CB 4.5Å; I737-P757 HydrophobicContact CG2-CB 3.92Å; I737-P757 HydrophobicContact CG2-CG 4.24Å; I737-V760 HydrophobicContact CD1-CB 4.25Å; I737-V760 HydrophobicContact CD1-CG1 3.72Å
738	D	72	Confident	70.9	Confident	88 Å²	88	69.5 Å²	69.5	47%	0.471	41%	0.41	S	S	.	.			trans	-62.7	113.5	176.4	-168.3	-3	0	0	0	110.1	N740 L741	D738-N740 PolarHBondContact O-N 3.43Å; D738-N740 PolarHBondContact OD1-N 3.46Å; D738-L741 WeakPolarHBondContact O-CB 3.43Å; D738-L741 PolarHBondContact O-N 3.2Å
739	E	67.2	Low	70.3	Confident	110 Å²	110	73.5 Å²	73.5	51%	0.514	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-65.7	-28.5	-178.2	-62.1	-173.6	167.6	0	0	111.5	I737 L741 P757	I737-E739 PolarHBondContact O-N 2.95Å; I737-E739 VanDerWaalsContact O-N 3.14Å; E739-L741 PolarHBondContact O-N 2.99Å; E739-P757 HydrophobicContact CG-CG 4.21Å
740	N	64.9	Low	69.8	Low	103 Å²	103	75.7 Å²	75.7	55%	0.551	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-74.6	-5.3	-178.1	-60.3	-42.3	0	0	0	113.2	D738 A742 S743 M744	D738-N740 PolarHBondContact O-N 3.43Å; D738-N740 PolarHBondContact OD1-N 3.46Å; N740-A742 VanDerWaalsContact C-N 3.27Å; N740-A742 PolarHBondContact O-N 3.28Å; N740-S743 WeakPolarHBondContact CA-OG 3.3Å; N740-S743 PolarHBondContact O-N 3.43Å; N740-S743 PolarHBondContact O-OG 3.2Å; N740-M744 WeakPolarHBondContact O-CB 3.39Å; N740-M744 PolarHBondContact O-N 2.95Å
741	L	65.1	Low	69.4	Low	23 Å²	23	79.2 Å²	79.2	12%	0.12	43%	0.432	C	S	.	.	G	3₁₀ helix	trans	-65.6	-32.5	-177.5	-167.9	63.4	0	0	0	112.3	I692 D738 E739	I692-L741 HydrophobicContact CG2-CD2 3.55Å; D738-L741 WeakPolarHBondContact O-CB 3.43Å; D738-L741 PolarHBondContact O-N 3.2Å; E739-L741 PolarHBondContact O-N 2.99Å
742	A	64.2	Low	69	Low	38 Å²	38	77.9 Å²	77.9	31%	0.314	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-41.7	177	0	0	0	0	0	112.1	N740 M744 Y745 A752	N740-A742 VanDerWaalsContact C-N 3.27Å; N740-A742 PolarHBondContact O-N 3.28Å; A742-M744 PolarHBondContact O-N 2.5Å; A742-Y745 WeakPolarHBondContact O-CB 3.24Å; A742-Y745 PolarHBondContact O-N 3.25Å; A742-A752 HydrophobicContact CB-CB 3.95Å
743	S	64.2	Low	69	Low	56 Å²	56	76 Å²	76	39%	0.392	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-22.9	176.8	54.1	0	0	0	0	112.6	N740 Y745	N740-S743 WeakPolarHBondContact CA-OG 3.3Å; N740-S743 PolarHBondContact O-N 3.43Å; N740-S743 PolarHBondContact O-OG 3.2Å; S743-Y745 PolarHBondContact O-N 3.43Å
744	M	64	Low	68.6	Low	87 Å²	87	78.5 Å²	78.5	43%	0.429	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-7.8	176.6	-149.6	154.6	-143.5	0	0	113.4	Y705 N740 A742 P746	Y705-M744 HydrophobicContact CD1-CE 3.67Å; Y705-M744 HydrophobicContact CD1-CG 4.01Å; Y705-M744 HydrophobicContact CD1-SD 3.23Å; Y705-M744 WeakPolarHBondContact CD1-SD 3.29Å; Y705-M744 HydrophobicContact CD2-CG 3.9Å; Y705-M744 HydrophobicContact CD2-SD 4.21Å; Y705-M744 HydrophobicContact CE1-CE 3.06Å; Y705-M744 HydrophobicContact CE1-CG 3.9Å; Y705-M744 HydrophobicContact CE1-SD 3.3Å; Y705-M744 WeakPolarHBondContact CE1-SD 3.11Å; Y705-M744 HydrophobicContact CE2-CE 4.45Å; Y705-M744 HydrophobicContact CE2-CG 3.76Å; Y705-M744 HydrophobicContact CE2-SD 4.25Å; Y705-M744 HydrophobicContact CG-CG 4Å; Y705-M744 HydrophobicContact CG-SD 3.71Å; N740-M744 WeakPolarHBondContact O-CB 3.39Å; N740-M744 PolarHBondContact O-N 2.95Å; A742-M744 PolarHBondContact O-N 2.5Å; M744-P746 WeakPolarHBondContact O-CD 3.22Å
745	Y	64.5	Low	68.3	Low	107 Å²	107	81.7 Å²	81.7	42%	0.42	45%	0.449	S	S	.	.	S	Bend	trans	-81.2	116	-179.7	-137	-78.2	0	0	0	111.1	V694 A742 S743 G747 H748	V694-Y745 HydrophobicContact CB-CD2 4.34Å; V694-Y745 HydrophobicContact CB-CE2 4.12Å; V694-Y745 HydrophobicContact CG1-CD2 3.64Å; V694-Y745 HydrophobicContact CG1-CE2 3.55Å; V694-Y745 HydrophobicContact CG1-CG 4.29Å; V694-Y745 HydrophobicContact CG2-CD2 3.73Å; V694-Y745 HydrophobicContact CG2-CE2 3.55Å; A742-Y745 WeakPolarHBondContact O-CB 3.24Å; A742-Y745 PolarHBondContact O-N 3.25Å; S743-Y745 PolarHBondContact O-N 3.43Å; Y745-G747 PolarHBondContact O-N 2.64Å; Y745-H748 AromaticContact CD1-CD2 3.86Å; Y745-H748 PolarHBondContact O-N 3.47Å
746	P	64.6	Low	67.9	Low	74 Å²	74	84.8 Å²	84.8	48%	0.481	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	135.4	-174.5	27.1	-35.3	0	0	0	111.3	V696 M744 H748	V696-P746 HydrophobicContact CB-CG 4.49Å; V696-P746 HydrophobicContact CG1-CG 4.01Å; V696-P746 HydrophobicContact CG2-CG 3.78Å; M744-P746 WeakPolarHBondContact O-CD 3.22Å; P746-H748 PolarHBondContact O-N 2.99Å
747	G	65.6	Low	67.8	Low	65 Å²	65	82 Å²	82	67%	0.67	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	-4	176.3	0	0	0	0	0	115.8	Y745 Y750	Y745-G747 PolarHBondContact O-N 2.64Å; G747-Y750 VanDerWaalsContact O-CE1 3.31Å; G747-Y750 WeakPolarHBondContact O-CE1 3.28Å
748	H	66.2	Low	68.1	Low	89 Å²	89	88.2 Å²	88.2	41%	0.412	48%	0.477	S	S	.	.			trans	-122.2	13.5	-178.4	-66.3	-63.1	0	0	0	113.5	Y745 P746 Y750 L751 A752	Y745-H748 AromaticContact CD1-CD2 3.86Å; Y745-H748 PolarHBondContact O-N 3.47Å; P746-H748 PolarHBondContact O-N 2.99Å; H748-Y750 PolarHBondContact O-N 3.49Å; H748-L751 HydrophobicContact CB-CD1 4.18Å; H748-L751 WeakPolarHBondContact ND1-CD1 3.41Å; H748-L751 WeakPolarHBondContact O-CA 3.16Å; H748-L751 WeakPolarHBondContact O-CB 3.41Å; H748-L751 PolarHBondContact O-N 3.44Å; H748-A752 PolarHBondContact O-N 2.92Å
749	E	66.6	Low	68.7	Low	146 Å²	146	89.6 Å²	89.6	68%	0.682	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-52.7	-40.7	178.4	-172.8	-179.3	-176.5	0	0	112.3	L751 A752	E749-L751 PolarHBondContact O-N 3.06Å; E749-A752 VanDerWaalsContact O-CB 3.25Å; E749-A752 WeakPolarHBondContact O-CB 3.43Å; E749-A752 PolarHBondContact O-N 3.31Å
750	Y	70.5	Confident	69.5	Low	184 Å²	184	85.7 Å²	85.7	72%	0.722	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-69.1	-12.9	177.9	71.4	-90.1	0	0	0	114.6	G747 H748	G747-Y750 VanDerWaalsContact O-CE1 3.31Å; G747-Y750 WeakPolarHBondContact O-CE1 3.28Å; H748-Y750 PolarHBondContact O-N 3.49Å
751	L	70.1	Confident	70.4	Confident	101 Å²	101	82.3 Å²	82.3	53%	0.529	45%	0.449	S	S	.	.	G	3₁₀ helix	trans	-92.5	-12.7	173.7	-62.7	175.9	0	0	0	112.1	H748 E749 V753	H748-L751 HydrophobicContact CB-CD1 4.18Å; H748-L751 WeakPolarHBondContact ND1-CD1 3.41Å; H748-L751 WeakPolarHBondContact O-CA 3.16Å; H748-L751 WeakPolarHBondContact O-CB 3.41Å; H748-L751 PolarHBondContact O-N 3.44Å; E749-L751 PolarHBondContact O-N 3.06Å; L751-V753 PolarHBondContact O-N 3.19Å
752	A	68.1	Low	71.5	Confident	33 Å²	33	83.4 Å²	83.4	27%	0.273	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-64.3	119.1	177.1	0	0	0	0	0	108.7	A742 H748 E749	A742-A752 HydrophobicContact CB-CB 3.95Å; H748-A752 PolarHBondContact O-N 2.92Å; E749-A752 VanDerWaalsContact O-CB 3.25Å; E749-A752 WeakPolarHBondContact O-CB 3.43Å; E749-A752 PolarHBondContact O-N 3.31Å
753	V	69.8	Low	72.6	Confident	103 Å²	103	85.8 Å²	85.8	62%	0.624	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-92.4	118.5	173.4	178.7	0	0	0	0	107.3	L751 S755 S756	L751-V753 PolarHBondContact O-N 3.19Å; V753-S755 PolarHBondContact O-N 3.24Å; V753-S756 WeakPolarHBondContact O-CB 3.43Å; V753-S756 PolarHBondContact O-N 3.48Å; V753-S756 VanDerWaalsContact O-N 3.1Å
754	D	66.9	Low	73.8	Confident	150 Å²	150	83.1 Å²	83.1	80%	0.802	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	136.5	172.1	-66.2	-24.2	0	0	0	109.5	S756	D754-S756 VanDerWaalsContact C-N 3.29Å; D754-S756 PolarHBondContact O-N 3.06Å
755	S	67.7	Low	74.8	Confident	71 Å²	71	81 Å²	81	50%	0.497	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	19.1	-177.8	-47.2	0	0	0	0	115.8	V753 P757 Y758	V753-S755 PolarHBondContact O-N 3.24Å; S755-P757 VanDerWaalsContact C-CD 3.48Å; S755-Y758 WeakPolarHBondContact O-CB 3.33Å; S755-Y758 PolarHBondContact O-N 3.21Å
756	S	71.5	Confident	76.1	Confident	74 Å²	74	80 Å²	80	52%	0.517	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-40.6	179.6	67.5	0	0	0	0	115.6	V753 D754 Y758	V753-S756 WeakPolarHBondContact O-CB 3.43Å; V753-S756 PolarHBondContact O-N 3.48Å; V753-S756 VanDerWaalsContact O-N 3.1Å; D754-S756 VanDerWaalsContact C-N 3.29Å; D754-S756 PolarHBondContact O-N 3.06Å; S756-Y758 VanDerWaalsContact C-N 3.27Å; S756-Y758 PolarHBondContact O-N 3.33Å
757	P	75.3	Confident	77.3	Confident	6 Å²	6	79.5 Å²	79.5	4%	0.039	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	5.5	177.6	36.1	-35.1	0	0	0	113.4	I737 E739 S755 I759 V760 N761	I737-P757 HydrophobicContact CB-CB 3.87Å; I737-P757 HydrophobicContact CB-CG 4.27Å; I737-P757 HydrophobicContact CD1-CB 3.96Å; I737-P757 HydrophobicContact CG1-CB 4.5Å; I737-P757 HydrophobicContact CG2-CB 3.92Å; I737-P757 HydrophobicContact CG2-CG 4.24Å; E739-P757 HydrophobicContact CG-CG 4.21Å; S755-P757 VanDerWaalsContact C-CD 3.48Å; P757-I759 PolarHBondContact O-N 3.45Å; P757-V760 PolarHBondContact O-N 2.68Å; P757-V760 VanDerWaalsContact O-N 3.13Å; P757-N761 WeakPolarHBondContact O-CB 3.35Å; P757-N761 PolarHBondContact O-N 2.99Å
758	Y	81.3	Confident	78.4	Confident	144 Å²	144	77.8 Å²	77.8	57%	0.565	41%	0.408	S	S	*	.	H	α-helix	trans	-55.6	-48.2	-172.3	174.9	-97.6	0	0	0	113	S755 S756 V760 N761 S762	S755-Y758 WeakPolarHBondContact O-CB 3.33Å; S755-Y758 PolarHBondContact O-N 3.21Å; S756-Y758 VanDerWaalsContact C-N 3.27Å; S756-Y758 PolarHBondContact O-N 3.33Å; Y758-V760 VanDerWaalsContact C-N 3.31Å; Y758-V760 PolarHBondContact O-N 3.09Å; Y758-N761 PolarHBondContact O-N 2.86Å; Y758-S762 VanDerWaalsContact O-CB 3.32Å; Y758-S762 WeakPolarHBondContact O-CB 3.35Å; Y758-S762 PolarHBondContact O-N 3.35Å
759	I	84.8	Confident	79.5	Confident	117 Å²	117	76.3 Å²	76.3	60%	0.6	41%	0.412	S	S	*	.	H	α-helix	trans	-63.5	-40.9	-179	-61.3	174.8	0	0	0	110.5	P757 S762 L763	P757-I759 PolarHBondContact O-N 3.45Å; I759-S762 PolarHBondContact O-N 3.4Å; I759-L763 HydrophobicContact CG2-CD1 3.9Å; I759-L763 HydrophobicContact CG2-CG 4.36Å; I759-L763 WeakPolarHBondContact O-CB 3.33Å; I759-L763 VanDerWaalsContact O-CG 3.29Å; I759-L763 WeakPolarHBondContact O-CG 3.33Å; I759-L763 PolarHBondContact O-N 2.88Å
760	V	84.1	Confident	80.7	Confident	28 Å²	28	73.1 Å²	73.1	17%	0.17	40%	0.398	C	S	.	.	H	α-helix	trans	-68.2	-45	179.8	178.1	0	0	0	0	110.6	L685 Y686 F689 I737 P757 Y758 L763 G764	L685-V760 HydrophobicContact CD1-CG1 3.87Å; L685-V760 HydrophobicContact CD2-CG1 4.49Å; L685-V760 HydrophobicContact CG-CG1 3.92Å; Y686-V760 HydrophobicContact CE1-CG1 4.43Å; F689-V760 HydrophobicContact CD2-CG1 4.18Å; F689-V760 HydrophobicContact CE2-CB 4.29Å; F689-V760 HydrophobicContact CE2-CG1 3.89Å; F689-V760 HydrophobicContact CE2-CG2 3.86Å; F689-V760 HydrophobicContact CZ-CG2 4.19Å; I737-V760 HydrophobicContact CD1-CB 4.25Å; I737-V760 HydrophobicContact CD1-CG1 3.72Å; P757-V760 PolarHBondContact O-N 2.68Å; P757-V760 VanDerWaalsContact O-N 3.13Å; Y758-V760 VanDerWaalsContact C-N 3.31Å; Y758-V760 PolarHBondContact O-N 3.09Å; V760-L763 PolarHBondContact O-N 2.54Å; V760-G764 PolarHBondContact O-N 2.99Å
761	N	84.1	Confident	81.7	Confident	33 Å²	33	64.4 Å²	64.4	18%	0.176	36%	0.364	C	S	.	.	H	α-helix	trans	-62	-43.5	176.3	-175.1	21.9	0	0	0	111.4	T735 T736 P757 Y758 S765	T735-N761 PolarHBondContact O-OD1 3.28Å; T736-N761 WeakPolarHBondContact CA-OD1 3.28Å; P757-N761 WeakPolarHBondContact O-CB 3.35Å; P757-N761 PolarHBondContact O-N 2.99Å; Y758-N761 PolarHBondContact O-N 2.86Å; N761-S765 VanDerWaalsContact O-CB 3.23Å; N761-S765 WeakPolarHBondContact O-CB 3.5Å; N761-S765 PolarHBondContact O-N 3.28Å; N761-S765 PolarHBondContact O-OG 2.84Å; N761-S765 PolarHBondContact OD1-OG 3.34Å
762	S	86.9	Confident	82.5	Confident	45 Å²	45	61.3 Å²	61.3	32%	0.315	35%	0.348	S	S	.	.	H	α-helix	trans	-63.6	-50.1	176.7	-173.4	0	0	0	0	111.4	Y758 I759 S765 I766	Y758-S762 VanDerWaalsContact O-CB 3.32Å; Y758-S762 WeakPolarHBondContact O-CB 3.35Å; Y758-S762 PolarHBondContact O-N 3.35Å; I759-S762 PolarHBondContact O-N 3.4Å; S762-S765 PolarHBondContact O-N 3.32Å; S762-I766 WeakPolarHBondContact O-CB 3.49Å; S762-I766 WeakPolarHBondContact O-CD1 3.18Å; S762-I766 WeakPolarHBondContact O-CG1 3.22Å; S762-I766 PolarHBondContact O-N 2.94Å
763	L	88.7	Confident	83.5	Confident	88 Å²	88	61.7 Å²	61.7	46%	0.461	35%	0.352	S	S	.	.	H	α-helix	trans	-64.7	-40.9	179.3	-73.4	175.4	0	0	0	112	I759 V760 I766 L767	I759-L763 HydrophobicContact CG2-CD1 3.9Å; I759-L763 HydrophobicContact CG2-CG 4.36Å; I759-L763 WeakPolarHBondContact O-CB 3.33Å; I759-L763 VanDerWaalsContact O-CG 3.29Å; I759-L763 WeakPolarHBondContact O-CG 3.33Å; I759-L763 PolarHBondContact O-N 2.88Å; V760-L763 PolarHBondContact O-N 2.54Å; L763-I766 PolarHBondContact O-N 3.24Å; L763-L767 WeakPolarHBondContact O-CB 3.14Å; L763-L767 WeakPolarHBondContact O-CG 3.44Å; L763-L767 PolarHBondContact O-N 3.08Å
764	G	87.9	Confident	84.4	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-64.9	-43.1	177.6	0	0	0	0	0	112.2	Y686 V760 L767 Y768	Y686-G764 WeakPolarHBondContact OH-CA 3.48Å; V760-G764 PolarHBondContact O-N 2.99Å; G764-L767 PolarHBondContact O-N 3.09Å; G764-Y768 WeakPolarHBondContact O-CB 3.3Å; G764-Y768 PolarHBondContact O-N 3.26Å
765	S	86.5	Confident	85.4	Confident	43 Å²	43	51.1 Å²	51.1	30%	0.301	29%	0.293	S	S	.	.	H	α-helix	trans	-64.2	-40.1	174.5	-60.1	0	0	0	0	112.1	T735 N761 S762 A769	T735-S765 WeakPolarHBondContact CB-OG 3.35Å; T735-S765 PolarHBondContact OG1-OG 3.4Å; N761-S765 VanDerWaalsContact O-CB 3.23Å; N761-S765 WeakPolarHBondContact O-CB 3.5Å; N761-S765 PolarHBondContact O-N 3.28Å; N761-S765 PolarHBondContact O-OG 2.84Å; N761-S765 PolarHBondContact OD1-OG 3.34Å; S762-S765 PolarHBondContact O-N 3.32Å; S765-A769 VanDerWaalsContact O-CB 3.27Å; S765-A769 WeakPolarHBondContact O-CB 3.4Å; S765-A769 PolarHBondContact O-N 3.05Å
766	I	90.7	Very high	86.1	Confident	86 Å²	86	50.6 Å²	50.6	44%	0.441	28%	0.284	S	S	.	.	H	α-helix	trans	-64.9	-49.2	174.8	-69.9	163.8	0	0	0	110.9	S762 L763 Y768 A769 I770	S762-I766 WeakPolarHBondContact O-CB 3.49Å; S762-I766 WeakPolarHBondContact O-CD1 3.18Å; S762-I766 WeakPolarHBondContact O-CG1 3.22Å; S762-I766 PolarHBondContact O-N 2.94Å; L763-I766 PolarHBondContact O-N 3.24Å; I766-Y768 VanDerWaalsContact C-N 3.3Å; I766-Y768 PolarHBondContact O-N 3.15Å; I766-A769 PolarHBondContact O-N 3.04Å; I766-I770 HydrophobicContact CG2-CD1 3.73Å; I766-I770 HydrophobicContact CG2-CG1 4.4Å; I766-I770 VanDerWaalsContact O-CG1 3.26Å; I766-I770 WeakPolarHBondContact O-CG1 3.37Å; I766-I770 PolarHBondContact O-N 3.12Å
767	L	90.2	Very high	86.7	Confident	63 Å²	63	52.2 Å²	52.2	33%	0.33	29%	0.286	S	S	.	.	H	α-helix	trans	-61.5	-39.8	178.8	-76.9	171.6	0	0	0	111.8	L682 L685 L763 G764 I770 Y771	L682-L767 HydrophobicContact CD2-CB 4.16Å; L685-L767 HydrophobicContact CD2-CD1 4.26Å; L763-L767 WeakPolarHBondContact O-CB 3.14Å; L763-L767 WeakPolarHBondContact O-CG 3.44Å; L763-L767 PolarHBondContact O-N 3.08Å; G764-L767 PolarHBondContact O-N 3.09Å; L767-I770 PolarHBondContact O-N 3.24Å; L767-Y771 WeakPolarHBondContact O-CB 3.42Å; L767-Y771 PolarHBondContact O-N 3.35Å
768	Y	89.2	Confident	87.1	Confident	29 Å²	29	56.5 Å²	56.5	11%	0.114	31%	0.308	C	S	.	.	H	α-helix	trans	-69.4	-38.3	176.9	-177.2	-107.5	0	0	0	112.3	L722 A725 S730 T735 G764 I766 Y771 N772	L722-Y768 HydrophobicContact CD2-CD2 4.03Å; L722-Y768 HydrophobicContact CD2-CE2 4.06Å; A725-Y768 HydrophobicContact CB-CE2 4Å; A725-Y768 VanDerWaalsContact CB-OH 3.31Å; A725-Y768 WeakPolarHBondContact CB-OH 3.43Å; S730-Y768 WeakPolarHBondContact CB-OH 3.47Å; S730-Y768 PolarHBondContact OG-OH 3Å; T735-Y768 HydrophobicContact CG2-CD1 4.35Å; T735-Y768 HydrophobicContact CG2-CG 4.17Å; G764-Y768 WeakPolarHBondContact O-CB 3.3Å; G764-Y768 PolarHBondContact O-N 3.26Å; I766-Y768 VanDerWaalsContact C-N 3.3Å; I766-Y768 PolarHBondContact O-N 3.15Å; Y768-Y771 WeakPolarHBondContact O-CB 3.4Å; Y768-Y771 PolarHBondContact O-N 3.15Å; Y768-N772 WeakPolarHBondContact CE1-ND2 3.24Å; Y768-N772 VanDerWaalsContact CZ-ND2 3.26Å; Y768-N772 PolarHBondContact O-N 3.37Å; Y768-N772 PolarHBondContact O-ND2 2.81Å; Y768-N772 PolarHBondContact OH-ND2 2.84Å
769	A	89.1	Confident	87.3	Confident	59 Å²	59	50.5 Å²	50.5	49%	0.488	29%	0.285	S	S	.	.	H	α-helix	trans	-64.2	-43.7	172	0	0	0	0	0	111.8	S765 I766 Y771 N772 A773	S765-A769 VanDerWaalsContact O-CB 3.27Å; S765-A769 WeakPolarHBondContact O-CB 3.4Å; S765-A769 PolarHBondContact O-N 3.05Å; I766-A769 PolarHBondContact O-N 3.04Å; A769-Y771 VanDerWaalsContact C-N 3.33Å; A769-Y771 PolarHBondContact O-N 3.31Å; A769-N772 PolarHBondContact O-N 2.91Å; A769-A773 WeakPolarHBondContact O-CB 3.06Å; A769-A773 PolarHBondContact O-N 3.3Å
770	I	91.6	Very high	87.3	Confident	79 Å²	79	47.4 Å²	47.4	41%	0.405	27%	0.27	S	S	.	.	H	α-helix	trans	-62.2	-41.8	174.5	-67.7	167.4	0	0	0	110.4	F678 I766 L767 A773 C774	F678-I770 HydrophobicContact CE1-CG2 4.44Å; F678-I770 HydrophobicContact CZ-CG2 4.12Å; I766-I770 HydrophobicContact CG2-CD1 3.73Å; I766-I770 HydrophobicContact CG2-CG1 4.4Å; I766-I770 VanDerWaalsContact O-CG1 3.26Å; I766-I770 WeakPolarHBondContact O-CG1 3.37Å; I766-I770 PolarHBondContact O-N 3.12Å; L767-I770 PolarHBondContact O-N 3.24Å; I770-A773 PolarHBondContact O-N 3.04Å; I770-C774 VanDerWaalsContact O-CB 3.29Å; I770-C774 WeakPolarHBondContact O-CB 3.23Å; I770-C774 PolarHBondContact O-N 3.39Å; I770-C774 PolarHBondContact O-SG 3.44Å
771	Y	91.4	Very high	87.4	Confident	1 Å²	1	50 Å²	50	0%	0.004	28%	0.282	C	S	.	.	H	α-helix	trans	-56.2	-55.8	174.2	170.5	-98.3	0	0	0	110.9	V675 F678 L722 A725 L767 Y768 A769 A773 C774 M775	V675-Y771 HydrophobicContact CG2-CE2 4.42Å; F678-Y771 HydrophobicContact CB-CD2 3.73Å; F678-Y771 HydrophobicContact CB-CE2 4.25Å; F678-Y771 HydrophobicContact CD1-CD2 4.13Å; F678-Y771 HydrophobicContact CD1-CG 4.41Å; F678-Y771 AromaticContact CD2-CD2 3.58Å; F678-Y771 HydrophobicContact CD2-CD2 3.58Å; F678-Y771 HydrophobicContact CD2-CE2 4.36Å; F678-Y771 HydrophobicContact CE2-CD2 4.17Å; F678-Y771 AromaticContact CG-CD2 3.55Å; F678-Y771 HydrophobicContact CG-CD2 3.55Å; F678-Y771 HydrophobicContact CG-CE2 4.44Å; F678-Y771 HydrophobicContact CG-CG 4.26Å; L722-Y771 HydrophobicContact CB-CE1 4.15Å; L722-Y771 HydrophobicContact CB-CE2 4.44Å; L722-Y771 HydrophobicContact CD2-CD1 3.7Å; L722-Y771 HydrophobicContact CD2-CD2 4.36Å; L722-Y771 HydrophobicContact CD2-CE1 3.67Å; L722-Y771 HydrophobicContact CD2-CE2 4.3Å; L722-Y771 HydrophobicContact CD2-CG 4.06Å; L722-Y771 HydrophobicContact CG-CE1 4.48Å; L722-Y771 PolarHBondContact O-OH 3.34Å; A725-Y771 HydrophobicContact CB-CE1 4.29Å; L767-Y771 WeakPolarHBondContact O-CB 3.42Å; L767-Y771 PolarHBondContact O-N 3.35Å; Y768-Y771 WeakPolarHBondContact O-CB 3.4Å; Y768-Y771 PolarHBondContact O-N 3.15Å; A769-Y771 VanDerWaalsContact C-N 3.33Å; A769-Y771 PolarHBondContact O-N 3.31Å; Y771-A773 VanDerWaalsContact C-N 3.32Å; Y771-A773 PolarHBondContact O-N 3.44Å; Y771-C774 PolarHBondContact O-N 3.44Å; Y771-M775 HydrophobicContact CD1-CG 4.36Å; Y771-M775 HydrophobicContact CD2-CG 3.54Å; Y771-M775 HydrophobicContact CD2-SD 4.3Å; Y771-M775 HydrophobicContact CE1-CG 4.09Å; Y771-M775 HydrophobicContact CE2-CB 4.48Å; Y771-M775 HydrophobicContact CE2-CG 3.24Å; Y771-M775 HydrophobicContact CE2-SD 3.92Å; Y771-M775 HydrophobicContact CG-CG 4.11Å; Y771-M775 WeakPolarHBondContact O-CB 3.23Å; Y771-M775 VanDerWaalsContact O-CG 3.24Å; Y771-M775 WeakPolarHBondContact O-CG 3.5Å; Y771-M775 PolarHBondContact O-N 2.72Å
772	N	87.8	Confident	87.5	Confident	35 Å²	35	53.1 Å²	53.1	19%	0.187	30%	0.297	C	S	.	.	H	α-helix	trans	-60.7	-41.3	-179.4	-74.3	-31.9	0	0	0	111.8	Y768 A769 I776	Y768-N772 WeakPolarHBondContact CE1-ND2 3.24Å; Y768-N772 VanDerWaalsContact CZ-ND2 3.26Å; Y768-N772 PolarHBondContact O-N 3.37Å; Y768-N772 PolarHBondContact O-ND2 2.81Å; Y768-N772 PolarHBondContact OH-ND2 2.84Å; A769-N772 PolarHBondContact O-N 2.91Å; N772-I776 HydrophobicContact CB-CD1 4.23Å; N772-I776 WeakPolarHBondContact O-CB 3.34Å; N772-I776 WeakPolarHBondContact O-CG1 3.38Å; N772-I776 PolarHBondContact O-N 2.94Å
773	A	88.1	Confident	87.5	Confident	42 Å²	42	52.4 Å²	52.4	35%	0.347	29%	0.29	S	S	.	.	I	π-helix	trans	-60.5	-48.7	175	0	0	0	0	0	111.9	A769 I770 Y771 I777 I778	A769-A773 WeakPolarHBondContact O-CB 3.06Å; A769-A773 PolarHBondContact O-N 3.3Å; I770-A773 PolarHBondContact O-N 3.04Å; Y771-A773 VanDerWaalsContact C-N 3.32Å; Y771-A773 PolarHBondContact O-N 3.44Å; A773-I777 HydrophobicContact CB-CD1 4.2Å; A773-I777 WeakPolarHBondContact O-CA 3.35Å; A773-I777 WeakPolarHBondContact O-CB 3.43Å; A773-I777 PolarHBondContact O-N 2.87Å; A773-I778 PolarHBondContact O-N 2.96Å
774	C	88.3	Confident	87.4	Confident	30 Å²	30	52.4 Å²	52.4	20%	0.203	29%	0.289	C	S	.	.	I	π-helix	trans	-65	-46.7	178.9	-74.9	0	0	0	0	112.6	M674 I770 Y771 I778 L779	M674-C774 HydrophobicContact CE-CB 3.81Å; I770-C774 VanDerWaalsContact O-CB 3.29Å; I770-C774 WeakPolarHBondContact O-CB 3.23Å; I770-C774 PolarHBondContact O-N 3.39Å; I770-C774 PolarHBondContact O-SG 3.44Å; Y771-C774 PolarHBondContact O-N 3.44Å; C774-I778 WeakPolarHBondContact O-CB 3.46Å; C774-I778 PolarHBondContact O-N 3.35Å; C774-L779 PolarHBondContact O-N 2.9Å
775	M	87.5	Confident	87.3	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	31%	0.307	C	S	.	.	I	π-helix	trans	-75.6	-43.6	-174	-60.6	-51.9	-63.8	0	0	112.4	F671 M674 V675 L726 Y771 L779 L780	F671-M775 HydrophobicContact CD1-CE 3.69Å; F671-M775 HydrophobicContact CD2-CE 3.45Å; F671-M775 VanDerWaalsContact CD2-CE 3.45Å; F671-M775 HydrophobicContact CE1-CE 3.36Å; F671-M775 HydrophobicContact CE2-CE 3.13Å; F671-M775 HydrophobicContact CG-CE 3.71Å; F671-M775 HydrophobicContact CZ-CE 3.05Å; M674-M775 HydrophobicContact CB-SD 4.01Å; M674-M775 HydrophobicContact CE-SD 4.18Å; V675-M775 HydrophobicContact CG2-CE 3.54Å; V675-M775 HydrophobicContact CG2-SD 4.46Å; L726-M775 HydrophobicContact CD1-CB 4.04Å; Y771-M775 HydrophobicContact CD1-CG 4.36Å; Y771-M775 HydrophobicContact CD2-CG 3.54Å; Y771-M775 HydrophobicContact CD2-SD 4.3Å; Y771-M775 HydrophobicContact CE1-CG 4.09Å; Y771-M775 HydrophobicContact CE2-CB 4.48Å; Y771-M775 HydrophobicContact CE2-CG 3.24Å; Y771-M775 HydrophobicContact CE2-SD 3.92Å; Y771-M775 HydrophobicContact CG-CG 4.11Å; Y771-M775 WeakPolarHBondContact O-CB 3.23Å; Y771-M775 VanDerWaalsContact O-CG 3.24Å; Y771-M775 WeakPolarHBondContact O-CG 3.5Å; Y771-M775 PolarHBondContact O-N 2.72Å; M775-L779 HydrophobicContact CE-CD1 3.67Å; M775-L779 HydrophobicContact SD-CD1 3.64Å; M775-L780 WeakPolarHBondContact O-CB 3.47Å; M775-L780 PolarHBondContact O-N 2.7Å
776	I	84.4	Confident	87.3	Confident	61 Å²	61	56.5 Å²	56.5	31%	0.313	31%	0.312	S	S	.	.	I	π-helix	trans	-86.4	-47.7	-175.3	-56.2	173.6	0	0	0	110.8	L726 N772 L780	L726-I776 HydrophobicContact CD1-CG1 4.4Å; N772-I776 HydrophobicContact CB-CD1 4.23Å; N772-I776 WeakPolarHBondContact O-CB 3.34Å; N772-I776 WeakPolarHBondContact O-CG1 3.38Å; N772-I776 PolarHBondContact O-N 2.94Å; I776-L780 WeakPolarHBondContact O-CB 3.39Å
777	I	83.8	Confident	87.1	Confident	108 Å²	108	55.2 Å²	55.2	55%	0.554	31%	0.305	S	S	*	.	I	π-helix	trans	-80.3	-41.2	-174.3	-51.8	174.6	0	0	0	111.3	A773 N781	A773-I777 HydrophobicContact CB-CD1 4.2Å; A773-I777 WeakPolarHBondContact O-CA 3.35Å; A773-I777 WeakPolarHBondContact O-CB 3.43Å; A773-I777 PolarHBondContact O-N 2.87Å; I777-N781 VanDerWaalsContact O-CB 3.28Å; I777-N781 WeakPolarHBondContact O-CB 3.41Å; I777-N781 VanDerWaalsContact O-CG 3.3Å; I777-N781 PolarHBondContact O-ND2 3.42Å
778	I	83.8	Confident	86.9	Confident	96 Å²	96	55.1 Å²	55.1	49%	0.492	31%	0.31	S	S	.	.	I	π-helix	trans	-91.3	-62.6	-175.5	-53.8	176.3	0	0	0	109.9	A773 C774 M782	A773-I778 PolarHBondContact O-N 2.96Å; C774-I778 WeakPolarHBondContact O-CB 3.46Å; C774-I778 PolarHBondContact O-N 3.35Å; I778-M782 WeakPolarHBondContact O-CB 2.99Å; I778-M782 WeakPolarHBondContact O-CG 3.26Å; I778-M782 PolarHBondContact O-N 3.37Å
779	L	84	Confident	86.8	Confident	17 Å²	17	60 Å²	60	9%	0.089	33%	0.332	C	S	.	.	I	π-helix	trans	-73.1	-41.9	-168.8	-67.4	-176.9	0	0	0	114.1	F667 F671 M674 C774 M775 M782 L783	F667-L779 HydrophobicContact CE1-CB 4.44Å; F667-L779 HydrophobicContact CE1-CD2 4.47Å; F667-L779 WeakPolarHBondContact CE1-O 3.22Å; F667-L779 HydrophobicContact CE2-CD2 4.48Å; F667-L779 HydrophobicContact CZ-CB 4.38Å; F667-L779 HydrophobicContact CZ-CD2 3.79Å; F671-L779 HydrophobicContact CD2-CB 4.13Å; F671-L779 HydrophobicContact CD2-CD1 3.81Å; F671-L779 HydrophobicContact CE2-CB 4.43Å; F671-L779 HydrophobicContact CE2-CD1 4.41Å; F671-L779 HydrophobicContact CG-CD1 4.4Å; M674-L779 HydrophobicContact CB-CD1 4.45Å; M674-L779 HydrophobicContact CE-CD1 4.03Å; M674-L779 HydrophobicContact CE-CG 4.49Å; M674-L779 HydrophobicContact SD-CD1 3.66Å; M674-L779 HydrophobicContact SD-CD2 4.19Å; M674-L779 HydrophobicContact SD-CG 4.21Å; C774-L779 PolarHBondContact O-N 2.9Å; M775-L779 HydrophobicContact CE-CD1 3.67Å; M775-L779 HydrophobicContact SD-CD1 3.64Å; L779-M782 PolarHBondContact O-N 2.82Å; L779-L783 WeakPolarHBondContact O-CB 3.28Å; L779-L783 PolarHBondContact O-N 3.23Å
780	L	85.7	Confident	86.7	Confident	52 Å²	52	57.8 Å²	57.8	27%	0.272	31%	0.313	S	S	.	.	I	π-helix	trans	-65.9	-41.6	178.3	-175.3	157.9	0	0	0	110.7	M775 I776 L783 I784	M775-L780 WeakPolarHBondContact O-CB 3.47Å; M775-L780 PolarHBondContact O-N 2.7Å; I776-L780 WeakPolarHBondContact O-CB 3.39Å; L780-L783 WeakPolarHBondContact O-CB 3.49Å; L780-L783 PolarHBondContact O-N 2.96Å; L780-I784 HydrophobicContact CD2-CD1 3.44Å; L780-I784 VanDerWaalsContact CD2-CD1 3.44Å; L780-I784 HydrophobicContact CD2-CG1 4.21Å; L780-I784 HydrophobicContact CG-CD1 4.5Å; L780-I784 WeakPolarHBondContact O-CG1 3.33Å; L780-I784 PolarHBondContact O-N 3.27Å
781	N	85.5	Confident	86.4	Confident	82 Å²	82	56.7 Å²	56.7	44%	0.439	31%	0.305	S	S	.	.	H	α-helix	trans	-64.7	-40.1	174.6	-72.4	-22.9	0	0	0	112.5	I777 I784 A785	I777-N781 VanDerWaalsContact O-CB 3.28Å; I777-N781 WeakPolarHBondContact O-CB 3.41Å; I777-N781 VanDerWaalsContact O-CG 3.3Å; I777-N781 PolarHBondContact O-ND2 3.42Å; N781-I784 PolarHBondContact O-N 3.39Å; N781-A785 WeakPolarHBondContact O-CB 3.18Å; N781-A785 PolarHBondContact O-N 3.01Å
782	M	86.1	Confident	86.1	Confident	99 Å²	99	61.7 Å²	61.7	49%	0.488	33%	0.332	S	S	.	.	H	α-helix	trans	-66.1	-37.3	172.8	-71.3	-64	97.1	0	0	112.3	F667 I778 L779 A785 M786	F667-M782 HydrophobicContact CE2-CB 4.46Å; F667-M782 HydrophobicContact CZ-CB 3.99Å; I778-M782 WeakPolarHBondContact O-CB 2.99Å; I778-M782 WeakPolarHBondContact O-CG 3.26Å; I778-M782 PolarHBondContact O-N 3.37Å; L779-M782 PolarHBondContact O-N 2.82Å; M782-A785 PolarHBondContact O-N 3.44Å; M782-M786 WeakPolarHBondContact O-CB 3.33Å; M782-M786 VanDerWaalsContact O-CG 3.3Å; M782-M786 WeakPolarHBondContact O-CG 3.32Å; M782-M786 PolarHBondContact O-N 2.96Å
783	L	87.3	Confident	85.9	Confident	31 Å²	31	66.1 Å²	66.1	16%	0.162	35%	0.351	C	S	.	.	H	α-helix	trans	-61.7	-48.7	174.7	178.8	65.5	0	0	0	110.6	I664 F667 L779 L780 A785 M786 M787	I664-L783 HydrophobicContact CG1-CD1 4.28Å; I664-L783 HydrophobicContact CG2-CD1 4.2Å; F667-L783 HydrophobicContact CD1-CB 4.04Å; F667-L783 HydrophobicContact CD1-CD1 3.69Å; F667-L783 HydrophobicContact CD1-CG 4.38Å; F667-L783 HydrophobicContact CE1-CB 3.74Å; F667-L783 HydrophobicContact CE1-CD1 4.3Å; F667-L783 HydrophobicContact CG-CD1 4.45Å; L779-L783 WeakPolarHBondContact O-CB 3.28Å; L779-L783 PolarHBondContact O-N 3.23Å; L780-L783 WeakPolarHBondContact O-CB 3.49Å; L780-L783 PolarHBondContact O-N 2.96Å; L783-A785 PolarHBondContact O-N 3.44Å; L783-M786 PolarHBondContact O-N 3.34Å; L783-M787 HydrophobicContact CD1-CG 4.37Å; L783-M787 HydrophobicContact CD1-SD 4.48Å; L783-M787 HydrophobicContact CG-CE 4.1Å; L783-M787 HydrophobicContact CG-SD 4.35Å; L783-M787 WeakPolarHBondContact O-CB 3.5Å; L783-M787 VanDerWaalsContact O-CG 3.26Å; L783-M787 WeakPolarHBondContact O-CG 3.38Å; L783-M787 PolarHBondContact O-N 3.46Å
784	I	86	Confident	85.5	Confident	87 Å²	87	64.6 Å²	64.6	45%	0.446	34%	0.337	S	S	.	.	H	α-helix	trans	-61.5	-44.8	177.6	-65.6	174.4	0	0	0	110.9	L780 N781 M786 M787 S788	L780-I784 HydrophobicContact CD2-CD1 3.44Å; L780-I784 VanDerWaalsContact CD2-CD1 3.44Å; L780-I784 HydrophobicContact CD2-CG1 4.21Å; L780-I784 HydrophobicContact CG-CD1 4.5Å; L780-I784 WeakPolarHBondContact O-CG1 3.33Å; L780-I784 PolarHBondContact O-N 3.27Å; N781-I784 PolarHBondContact O-N 3.39Å; I784-M786 PolarHBondContact O-N 2.96Å; I784-M787 HydrophobicContact CB-CE 4.42Å; I784-M787 HydrophobicContact CG1-CE 3.98Å; I784-M787 PolarHBondContact O-N 3.47Å; I784-S788 PolarHBondContact O-N 3.27Å; I784-S788 PolarHBondContact O-OG 3.46Å
785	A	87.2	Confident	85	Confident	45 Å²	45	67.5 Å²	67.5	37%	0.372	35%	0.348	S	S	.	.	H	α-helix	trans	-64.8	-37.3	179.1	0	0	0	0	0	113.3	N781 M782 L783 S788 K789	N781-A785 WeakPolarHBondContact O-CB 3.18Å; N781-A785 PolarHBondContact O-N 3.01Å; M782-A785 PolarHBondContact O-N 3.44Å; L783-A785 PolarHBondContact O-N 3.44Å; A785-S788 PolarHBondContact O-OG 3.38Å; A785-K789 WeakPolarHBondContact O-CB 3.41Å; A785-K789 PolarHBondContact O-N 2.82Å
786	M	85.7	Confident	84.4	Confident	84 Å²	84	70.7 Å²	70.7	41%	0.414	38%	0.381	S	S	.	.	H	α-helix	trans	-74.1	-34.9	174	-71.1	-165	-47.4	0	0	112.1	F667 M782 L783 I784 S788 S790	F667-M786 HydrophobicContact CB-CE 3.56Å; F667-M786 HydrophobicContact CD1-CE 3.99Å; F667-M786 HydrophobicContact CD2-CE 3.04Å; F667-M786 HydrophobicContact CD2-SD 4.25Å; F667-M786 HydrophobicContact CE1-CE 4.41Å; F667-M786 HydrophobicContact CE2-CE 3.55Å; F667-M786 HydrophobicContact CG-CE 3.24Å; F667-M786 HydrophobicContact CZ-CE 4.19Å; M782-M786 WeakPolarHBondContact O-CB 3.33Å; M782-M786 VanDerWaalsContact O-CG 3.3Å; M782-M786 WeakPolarHBondContact O-CG 3.32Å; M782-M786 PolarHBondContact O-N 2.96Å; L783-M786 PolarHBondContact O-N 3.34Å; I784-M786 PolarHBondContact O-N 2.96Å; M786-S788 VanDerWaalsContact C-N 3.34Å; M786-S790 VanDerWaalsContact O-CB 3.23Å; M786-S790 WeakPolarHBondContact O-CB 3.37Å; M786-S790 PolarHBondContact O-N 3.42Å; M786-S790 PolarHBondContact O-OG 3.19Å
787	M	85.7	Confident	84.2	Confident	59 Å²	59	71.9 Å²	71.9	29%	0.291	39%	0.388	S	S	.	.	H	α-helix	trans	-62	-43.4	172.3	-76	-171.2	-54.5	0	0	110.6	I664 L783 I784 S790 F791	I664-M787 HydrophobicContact CD1-CG 3.95Å; I664-M787 HydrophobicContact CD1-SD 3.57Å; I664-M787 VanDerWaalsContact CD1-SD 3.57Å; I664-M787 HydrophobicContact CG1-CG 3.84Å; I664-M787 HydrophobicContact CG1-SD 3.96Å; L783-M787 HydrophobicContact CD1-CG 4.37Å; L783-M787 HydrophobicContact CD1-SD 4.48Å; L783-M787 HydrophobicContact CG-CE 4.1Å; L783-M787 HydrophobicContact CG-SD 4.35Å; L783-M787 WeakPolarHBondContact O-CB 3.5Å; L783-M787 VanDerWaalsContact O-CG 3.26Å; L783-M787 WeakPolarHBondContact O-CG 3.38Å; L783-M787 PolarHBondContact O-N 3.46Å; I784-M787 HydrophobicContact CB-CE 4.42Å; I784-M787 HydrophobicContact CG1-CE 3.98Å; I784-M787 PolarHBondContact O-N 3.47Å; M787-S790 WeakPolarHBondContact CA-OG 3.42Å; M787-S790 PolarHBondContact O-OG 3.27Å; M787-S790 VanDerWaalsContact O-OG 3.11Å; M787-F791 VanDerWaalsContact O-CB 3.22Å; M787-F791 WeakPolarHBondContact O-CB 3.39Å; M787-F791 PolarHBondContact O-N 3.12Å
788	S	86.2	Confident	84.1	Confident	62 Å²	62	69.4 Å²	69.4	43%	0.434	37%	0.372	S	S	.	.	H	α-helix	trans	-65.9	-47.2	177.8	65.8	0	0	0	0	111.8	I784 A785 M786 S790 F791 D792	I784-S788 PolarHBondContact O-N 3.27Å; I784-S788 PolarHBondContact O-OG 3.46Å; A785-S788 PolarHBondContact O-OG 3.38Å; M786-S788 VanDerWaalsContact C-N 3.34Å; S788-S790 PolarHBondContact O-N 3.12Å; S788-F791 WeakPolarHBondContact O-CB 3.5Å; S788-F791 PolarHBondContact O-N 3.19Å; S788-D792 VanDerWaalsContact O-CG 3.32Å; S788-D792 PolarHBondContact O-N 3.18Å
789	K	87.2	Confident	84.1	Confident	132 Å²	132	69.9 Å²	69.9	57%	0.574	38%	0.375	S	S	*	.	H	α-helix	trans	-62.9	-43.6	177.7	-178.2	177.9	171.7	-179.8	0	112.6	A785 F791 D792 E793	A785-K789 WeakPolarHBondContact O-CB 3.41Å; A785-K789 PolarHBondContact O-N 2.82Å; K789-F791 VanDerWaalsContact C-N 3.34Å; K789-D792 PolarHBondContact O-N 3.32Å; K789-E793 WeakPolarHBondContact CE-OE1 3.26Å; K789-E793 IonicContact NZ-OE1 3.36Å; K789-E793 WeakPolarHBondContact O-CG 3.16Å; K789-E793 PolarHBondContact O-N 3.11Å
790	S	86.6	Confident	84.2	Confident	12 Å²	12	72.9 Å²	72.9	8%	0.084	39%	0.388	C	S	.	.	H	α-helix	trans	-67.1	-36.8	177.2	58.4	0	0	0	0	111.4	M786 M787 S788 E793 I794	M786-S790 VanDerWaalsContact O-CB 3.23Å; M786-S790 WeakPolarHBondContact O-CB 3.37Å; M786-S790 PolarHBondContact O-N 3.42Å; M786-S790 PolarHBondContact O-OG 3.19Å; M787-S790 WeakPolarHBondContact CA-OG 3.42Å; M787-S790 PolarHBondContact O-OG 3.27Å; M787-S790 VanDerWaalsContact O-OG 3.11Å; S788-S790 PolarHBondContact O-N 3.12Å; S790-E793 PolarHBondContact O-N 2.91Å; S790-I794 WeakPolarHBondContact O-CB 3.35Å; S790-I794 WeakPolarHBondContact O-CD1 3.39Å; S790-I794 WeakPolarHBondContact O-CG1 3.39Å; S790-I794 PolarHBondContact O-N 3.27Å
791	F	85.4	Confident	84.1	Confident	55 Å²	55	71 Å²	71	24%	0.241	38%	0.378	C	S	.	.	H	α-helix	trans	-58.4	-48.8	172.8	-173.5	-103.3	0	0	0	111.5	M660 M787 S788 K789 I794 Q795	M660-F791 HydrophobicContact CE-CD2 3.67Å; M660-F791 HydrophobicContact CE-CE2 4.43Å; M660-F791 HydrophobicContact SD-CB 3.58Å; M660-F791 VanDerWaalsContact SD-CB 3.58Å; M660-F791 HydrophobicContact SD-CD2 3.8Å; M660-F791 HydrophobicContact SD-CG 4.17Å; M787-F791 VanDerWaalsContact O-CB 3.22Å; M787-F791 WeakPolarHBondContact O-CB 3.39Å; M787-F791 PolarHBondContact O-N 3.12Å; S788-F791 WeakPolarHBondContact O-CB 3.5Å; S788-F791 PolarHBondContact O-N 3.19Å; K789-F791 VanDerWaalsContact C-N 3.34Å; F791-I794 PolarHBondContact O-N 2.9Å; F791-Q795 WeakPolarHBondContact O-CB 3.09Å; F791-Q795 PolarHBondContact O-N 3.5Å
792	D	85.7	Confident	84.3	Confident	107 Å²	107	68.1 Å²	68.1	57%	0.572	36%	0.361	S	S	*	.	H	α-helix	trans	-64.2	-43.2	-179.2	-66.2	-26.1	0	0	0	112.1	S788 K789 I794 Q795	S788-D792 VanDerWaalsContact O-CG 3.32Å; S788-D792 PolarHBondContact O-N 3.18Å; K789-D792 PolarHBondContact O-N 3.32Å; D792-I794 VanDerWaalsContact C-N 3.35Å; D792-I794 PolarHBondContact O-N 3.31Å; D792-Q795 PolarHBondContact O-N 3.3Å
793	E	84	Confident	84.5	Confident	127 Å²	127	66.3 Å²	66.3	59%	0.593	35%	0.35	S	S	*	.	H	α-helix	trans	-62.6	-39.9	175.8	-73.5	176.9	-176.2	0	0	111.9	K789 S790	K789-E793 WeakPolarHBondContact CE-OE1 3.26Å; K789-E793 IonicContact NZ-OE1 3.36Å; K789-E793 WeakPolarHBondContact O-CG 3.16Å; K789-E793 PolarHBondContact O-N 3.11Å; S790-E793 PolarHBondContact O-N 2.91Å
794	I	80.4	Confident	84.6	Confident	10 Å²	10	65.9 Å²	65.9	5%	0.051	35%	0.347	C	S	.	.	H	α-helix	trans	-76.2	-26.8	179.4	-64.4	160.3	0	0	0	111.7	R659 M660 S790 F791 D792 G796 D797 R798	R659-I794 HydrophobicContact CB-CD1 3.71Å; R659-I794 HydrophobicContact CB-CG1 4.44Å; R659-I794 HydrophobicContact CB-CG2 4.39Å; M660-I794 HydrophobicContact CG-CD1 3.96Å; S790-I794 WeakPolarHBondContact O-CB 3.35Å; S790-I794 WeakPolarHBondContact O-CD1 3.39Å; S790-I794 WeakPolarHBondContact O-CG1 3.39Å; S790-I794 PolarHBondContact O-N 3.27Å; F791-I794 PolarHBondContact O-N 2.9Å; D792-I794 VanDerWaalsContact C-N 3.35Å; D792-I794 PolarHBondContact O-N 3.31Å; I794-G796 PolarHBondContact O-N 3.46Å; I794-D797 PolarHBondContact O-N 2.87Å; I794-R798 PolarHBondContact O-N 2.76Å
795	Q	77.7	Confident	84.7	Confident	91 Å²	91	63 Å²	63	43%	0.425	34%	0.337	S	S	.	.	H	α-helix	trans	-60.3	-30.5	-178.9	-174.4	171.8	-29.5	0	0	112.4	F791 D792 D797	F791-Q795 WeakPolarHBondContact O-CB 3.09Å; F791-Q795 PolarHBondContact O-N 3.5Å; D792-Q795 PolarHBondContact O-N 3.3Å; Q795-D797 PolarHBondContact O-N 3.4Å
796	G	74.4	Confident	84.8	Confident	67 Å²	67	61.9 Å²	61.9	69%	0.691	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-39.8	177.8	0	0	0	0	0	114.2	I794	I794-G796 PolarHBondContact O-N 3.46Å
797	D	79.2	Confident	84.9	Confident	87 Å²	87	57.9 Å²	57.9	47%	0.465	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-3.1	-173.6	-67.2	-18.2	0	0	0	113.4	I794 Q795 L799 E800 E801	I794-D797 PolarHBondContact O-N 2.87Å; Q795-D797 PolarHBondContact O-N 3.4Å; D797-L799 VanDerWaalsContact C-N 3.3Å; D797-L799 PolarHBondContact O-N 3.26Å; D797-L799 VanDerWaalsContact O-N 3.12Å; D797-E800 PolarHBondContact O-N 2.96Å; D797-E801 HydrophobicContact CB-CG 4.48Å; D797-E801 WeakPolarHBondContact O-CG 3.3Å; D797-E801 PolarHBondContact O-N 3.01Å
798	R	81.5	Confident	84.9	Confident	56 Å²	56	56.4 Å²	56.4	21%	0.211	30%	0.299	C	S	.	.	H	α-helix	trans	-58.1	-35.5	-165.3	81.2	-171.9	-54	-165.9	6.5	114.8	P652 L653 I794 W802	P652-R798 HydrophobicContact CB-CB 4.49Å; P652-R798 HydrophobicContact CB-CG 4.17Å; P652-R798 VanDerWaalsContact CB-NE 3.29Å; P652-R798 PolarHBondContact O-NE 3.18Å; P652-R798 PolarHBondContact O-NH2 2.86Å; L653-R798 VanDerWaalsContact N-NH2 3.14Å; I794-R798 PolarHBondContact O-N 2.76Å; R798-W802 VanDerWaalsContact O-CB 3.25Å; R798-W802 WeakPolarHBondContact O-CB 3.38Å; R798-W802 PolarHBondContact O-N 2.67Å
799	L	83.9	Confident	84.9	Confident	106 Å²	106	53.8 Å²	53.8	56%	0.555	28%	0.28	S	S	*	.	H	α-helix	trans	-71.1	-40.1	-175	-69.4	177	0	0	0	111.2	D797 K803	D797-L799 VanDerWaalsContact C-N 3.3Å; D797-L799 PolarHBondContact O-N 3.26Å; D797-L799 VanDerWaalsContact O-N 3.12Å; L799-K803 WeakPolarHBondContact O-CB 3.26Å; L799-K803 VanDerWaalsContact O-CG 3.27Å; L799-K803 WeakPolarHBondContact O-CG 3.49Å; L799-K803 PolarHBondContact O-N 2.72Å
800	E	85.8	Confident	84.9	Confident	79 Å²	79	48.1 Å²	48.1	37%	0.369	26%	0.255	S	S	.	.	H	α-helix	trans	-66.9	-43.6	176.1	-61	-174.5	172.1	0	0	110.5	K356 A359 D797 K803 F804	K356-E800 WeakPolarHBondContact CG-OE2 3.24Å; A359-E800 HydrophobicContact CB-CB 3.91Å; A359-E800 HydrophobicContact CB-CG 4.25Å; D797-E800 PolarHBondContact O-N 2.96Å; E800-K803 PolarHBondContact O-N 2.92Å; E800-F804 WeakPolarHBondContact O-CB 3.48Å; E800-F804 PolarHBondContact O-N 3.37Å
801	E	85.6	Confident	84.8	Confident	13 Å²	13	48.4 Å²	48.4	6%	0.061	26%	0.255	C	S	.	.	H	α-helix	trans	-64.7	-41.5	178	-61.6	-159	137.4	0	0	112.8	K355 I655 R659 D797 F804 A805	K355-E801 HydrophobicContact CD-CG 4.24Å; K355-E801 IonicContact NZ-OE1 3.44Å; K355-E801 PolarHBondContact NZ-OE1 3.38Å; I655-E801 HydrophobicContact CG2-CB 3.97Å; I655-E801 WeakPolarHBondContact CG2-OE2 3.49Å; R659-E801 VanDerWaalsContact CD-OE2 3.3Å; R659-E801 WeakPolarHBondContact CD-OE2 3.49Å; R659-E801 IonicContact CZ-OE1 3.07Å; R659-E801 IonicContact NH1-OE1 3.94Å; R659-E801 PolarHBondContact NH1-OE1 3.46Å; R659-E801 IonicContact NH1-OE2 3.8Å; D797-E801 HydrophobicContact CB-CG 4.48Å; D797-E801 WeakPolarHBondContact O-CG 3.3Å; D797-E801 PolarHBondContact O-N 3.01Å; E801-F804 WeakPolarHBondContact O-CB 3.47Å; E801-F804 PolarHBondContact O-N 2.92Å; E801-A805 WeakPolarHBondContact O-CB 3.39Å; E801-A805 PolarHBondContact O-N 2.87Å
802	W	89.1	Confident	84.6	Confident	21 Å²	21	47.6 Å²	47.6	8%	0.08	26%	0.255	C	S	.	.	H	α-helix	trans	-63.2	-45.7	175.9	169.7	61	0	0	0	112	P645 E648 P652 I655 R798 F804 A805 R806	P645-W802 PolarHBondContact O-NE1 3.19Å; E648-W802 HydrophobicContact CB-CH2 3.96Å; E648-W802 HydrophobicContact CB-CZ2 3.95Å; E648-W802 HydrophobicContact CG-CH2 3.77Å; E648-W802 HydrophobicContact CG-CZ2 3.75Å; P652-W802 HydrophobicContact CB-CB 4.41Å; P652-W802 HydrophobicContact CG-CB 3.95Å; P652-W802 HydrophobicContact CG-CD2 3.93Å; P652-W802 HydrophobicContact CG-CE3 4.33Å; P652-W802 HydrophobicContact CG-CG 3.71Å; I655-W802 VanDerWaalsContact CD1-CA 3.42Å; I655-W802 HydrophobicContact CD1-CB 3.9Å; R798-W802 VanDerWaalsContact O-CB 3.25Å; R798-W802 WeakPolarHBondContact O-CB 3.38Å; R798-W802 PolarHBondContact O-N 2.67Å; W802-F804 VanDerWaalsContact C-N 3.27Å; W802-F804 PolarHBondContact O-N 3.15Å; W802-A805 PolarHBondContact O-N 2.89Å; W802-R806 VanDerWaalsContact O-CB 3.22Å; W802-R806 WeakPolarHBondContact O-CB 3.45Å; W802-R806 PolarHBondContact O-N 3.42Å
803	K	89.5	Confident	84.4	Confident	61 Å²	61	43.2 Å²	43.2	27%	0.265	23%	0.23	S	C	.	.	H	α-helix	trans	-59.8	-38.6	175	-75	173.2	178.2	-178.4	0	112	A359 Q364 L799 E800 A807	A359-K803 HydrophobicContact CB-CB 3.93Å; A359-K803 HydrophobicContact CB-CD 4.11Å; A359-K803 WeakPolarHBondContact O-CD 3.41Å; Q364-K803 HydrophobicContact CG-CB 4.4Å; Q364-K803 HydrophobicContact CG-CD 4.28Å; Q364-K803 HydrophobicContact CG-CG 4.48Å; Q364-K803 PolarHBondContact NE2-O 2.91Å; L799-K803 WeakPolarHBondContact O-CB 3.26Å; L799-K803 VanDerWaalsContact O-CG 3.27Å; L799-K803 WeakPolarHBondContact O-CG 3.49Å; L799-K803 PolarHBondContact O-N 2.72Å; E800-K803 PolarHBondContact O-N 2.92Å; K803-A807 VanDerWaalsContact O-CB 3.29Å; K803-A807 WeakPolarHBondContact O-CB 3.49Å; K803-A807 PolarHBondContact O-N 3.43Å
804	F	90.1	Very high	84.2	Confident	23 Å²	23	39 Å²	39	10%	0.101	21%	0.211	C	C	.	.	H	α-helix	trans	-65.6	-47.2	173.6	176.1	-91.5	0	0	0	112.3	I350 H353 K355 V358 E800 E801 W802 R806 A807 S808	I350-F804 HydrophobicContact CG1-CE2 4.33Å; I350-F804 HydrophobicContact CG2-CE2 4.47Å; I350-F804 HydrophobicContact CG2-CZ 4.31Å; H353-F804 HydrophobicContact CB-CZ 4.49Å; H353-F804 AromaticContact ND1-CZ 3.93Å; K355-F804 HydrophobicContact CB-CB 4.43Å; K355-F804 HydrophobicContact CB-CG 4.48Å; K355-F804 HydrophobicContact CG-CB 4.39Å; K355-F804 HydrophobicContact CG-CD1 4.35Å; K355-F804 HydrophobicContact CG-CD2 4.27Å; K355-F804 HydrophobicContact CG-CG 4.07Å; V358-F804 HydrophobicContact CB-CD2 3.99Å; V358-F804 HydrophobicContact CG1-CD2 4.23Å; V358-F804 HydrophobicContact CG2-CD2 4.16Å; V358-F804 HydrophobicContact CG2-CE2 4.41Å; E800-F804 WeakPolarHBondContact O-CB 3.48Å; E800-F804 PolarHBondContact O-N 3.37Å; E801-F804 WeakPolarHBondContact O-CB 3.47Å; E801-F804 PolarHBondContact O-N 2.92Å; W802-F804 VanDerWaalsContact C-N 3.27Å; W802-F804 PolarHBondContact O-N 3.15Å; F804-R806 VanDerWaalsContact C-N 3.35Å; F804-R806 PolarHBondContact O-N 3.25Å; F804-A807 PolarHBondContact O-N 3.22Å; F804-S808 WeakPolarHBondContact O-CB 3.4Å; F804-S808 PolarHBondContact O-N 2.89Å; F804-S808 PolarHBondContact O-OG 2.92Å
805	A	86.9	Confident	83.9	Confident	27 Å²	27	40.8 Å²	40.8	22%	0.223	22%	0.221	C	C	.	.	H	α-helix	trans	-63.4	-41.3	179	0	0	0	0	0	111.7	P645 I655 E801 W802 S808 L809	P645-A805 HydrophobicContact CB-CB 4.42Å; I655-A805 HydrophobicContact CD1-CB 3.65Å; E801-A805 WeakPolarHBondContact O-CB 3.39Å; E801-A805 PolarHBondContact O-N 2.87Å; W802-A805 PolarHBondContact O-N 2.89Å; A805-S808 WeakPolarHBondContact O-CB 3.21Å; A805-S808 PolarHBondContact O-N 3.44Å; A805-L809 PolarHBondContact O-N 3.18Å
806	R	89.8	Confident	83.4	Confident	20 Å²	20	38 Å²	38	8%	0.075	21%	0.208	C	C	.	.	H	α-helix	trans	-62.2	-47.9	174.1	-175.4	176.9	72.4	155.9	12	111.8	E368 W802 F804 S808 L809 W810	E368-R806 IonicContact OE1-CZ 3.44Å; E368-R806 IonicContact OE1-NH1 3.96Å; E368-R806 IonicContact OE1-NH2 2.69Å; E368-R806 PolarHBondContact OE1-NH2 2.86Å; W802-R806 VanDerWaalsContact O-CB 3.22Å; W802-R806 WeakPolarHBondContact O-CB 3.45Å; W802-R806 PolarHBondContact O-N 3.42Å; F804-R806 VanDerWaalsContact C-N 3.35Å; F804-R806 PolarHBondContact O-N 3.25Å; R806-S808 VanDerWaalsContact C-N 3.31Å; R806-S808 PolarHBondContact O-N 3.06Å; R806-L809 WeakPolarHBondContact O-CB 3.17Å; R806-L809 PolarHBondContact O-N 3.43Å; R806-W810 HydrophobicContact CG-CD2 4.21Å; R806-W810 HydrophobicContact CG-CH2 3.99Å; R806-W810 HydrophobicContact CG-CZ2 3.58Å; R806-W810 HydrophobicContact CG-CZ3 4.46Å; R806-W810 VanDerWaalsContact CZ-CH2 3.48Å; R806-W810 PolarHBondContact O-N 2.88Å
807	A	88.1	Confident	82.6	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.3	-37.5	176.4	0	0	0	0	0	112.3	V358 M367 K803 F804 W810 L811	V358-A807 HydrophobicContact CG1-CB 3.45Å; V358-A807 VanDerWaalsContact CG1-CB 3.45Å; M367-A807 HydrophobicContact CE-CB 4.33Å; K803-A807 VanDerWaalsContact O-CB 3.29Å; K803-A807 WeakPolarHBondContact O-CB 3.49Å; K803-A807 PolarHBondContact O-N 3.43Å; F804-A807 PolarHBondContact O-N 3.22Å; A807-W810 PolarHBondContact O-N 3.32Å; A807-L811 WeakPolarHBondContact O-CB 3.21Å; A807-L811 PolarHBondContact O-N 3.08Å
808	S	86.3	Confident	82	Confident	29 Å²	29	39.9 Å²	39.9	20%	0.203	20%	0.202	C	C	.	.	H	α-helix	trans	-63.1	-42	174.4	-59	0	0	0	0	111.6	F804 A805 R806 L811 V812	F804-S808 WeakPolarHBondContact O-CB 3.4Å; F804-S808 PolarHBondContact O-N 2.89Å; F804-S808 PolarHBondContact O-OG 2.92Å; A805-S808 WeakPolarHBondContact O-CB 3.21Å; A805-S808 PolarHBondContact O-N 3.44Å; R806-S808 VanDerWaalsContact C-N 3.31Å; R806-S808 PolarHBondContact O-N 3.06Å; S808-L811 PolarHBondContact O-N 3.42Å; S808-V812 PolarHBondContact O-N 3.38Å
809	L	85.8	Confident	81.4	Confident	7 Å²	7	37.7 Å²	37.7	4%	0.037	20%	0.195	C	C	.	.	H	α-helix	trans	-62.1	-46.7	174.2	179.6	65.8	0	0	0	111.3	F441 Y642 A646 A805 R806 L811 V812 Y813	F441-L809 HydrophobicContact CE2-CD2 4.09Å; F441-L809 HydrophobicContact CZ-CD2 4.45Å; Y642-L809 HydrophobicContact CD1-CD1 4.31Å; Y642-L809 HydrophobicContact CE1-CD1 3.51Å; Y642-L809 HydrophobicContact CE2-CD1 4.34Å; Y642-L809 WeakPolarHBondContact OH-CD1 3.21Å; A646-L809 HydrophobicContact CB-CD2 3.99Å; A805-L809 PolarHBondContact O-N 3.18Å; R806-L809 WeakPolarHBondContact O-CB 3.17Å; R806-L809 PolarHBondContact O-N 3.43Å; L809-L811 VanDerWaalsContact C-N 3.32Å; L809-L811 PolarHBondContact O-N 2.96Å; L809-V812 PolarHBondContact O-N 3.33Å; L809-Y813 HydrophobicContact CD1-CE2 3.88Å; L809-Y813 HydrophobicContact CG-CE2 4.37Å; L809-Y813 VanDerWaalsContact O-CD2 3.32Å; L809-Y813 WeakPolarHBondContact O-CD2 3.39Å
810	W	86.4	Confident	81.1	Confident	13 Å²	13	33.7 Å²	33.7	5%	0.049	17%	0.174	C	C	.	.	H	α-helix	trans	-60.9	-40.9	177	-67	-20.1	0	0	0	112.6	M367 E368 F371 R806 A807 V812 Y813 I814	M367-W810 HydrophobicContact CB-CE3 4.14Å; M367-W810 HydrophobicContact CB-CZ3 4.29Å; E368-W810 HydrophobicContact CG-CH2 3.32Å; E368-W810 HydrophobicContact CG-CZ2 4.39Å; E368-W810 HydrophobicContact CG-CZ3 3.51Å; F371-W810 HydrophobicContact CB-CD2 4.42Å; F371-W810 AromaticContact CD1-CD1 3.99Å; F371-W810 HydrophobicContact CD1-CD2 4.37Å; F371-W810 HydrophobicContact CD1-CG 4.35Å; F371-W810 AromaticContact CD1-NE1 3.77Å; F371-W810 HydrophobicContact CD2-CB 3.87Å; F371-W810 AromaticContact CD2-CD1 3.68Å; F371-W810 HydrophobicContact CD2-CD2 4.43Å; F371-W810 AromaticContact CD2-CG 3.74Å; F371-W810 HydrophobicContact CD2-CG 3.74Å; F371-W810 AromaticContact CE1-CD1 3.79Å; F371-W810 AromaticContact CE1-NE1 3.56Å; F371-W810 HydrophobicContact CE2-CB 4.27Å; F371-W810 AromaticContact CE2-CD1 3.49Å; F371-W810 VanDerWaalsContact CE2-CD1 3.49Å; F371-W810 HydrophobicContact CE2-CG 4.01Å; F371-W810 HydrophobicContact CG-CB 4.42Å; F371-W810 AromaticContact CG-CD1 3.95Å; F371-W810 HydrophobicContact CG-CD2 4.17Å; F371-W810 AromaticContact CG-CG 3.95Å; F371-W810 HydrophobicContact CG-CG 3.95Å; F371-W810 AromaticContact CZ-CD1 3.55Å; F371-W810 HydrophobicContact CZ-CG 4.41Å; F371-W810 AromaticContact CZ-NE1 3.78Å; R806-W810 HydrophobicContact CG-CD2 4.21Å; R806-W810 HydrophobicContact CG-CH2 3.99Å; R806-W810 HydrophobicContact CG-CZ2 3.58Å; R806-W810 HydrophobicContact CG-CZ3 4.46Å; R806-W810 VanDerWaalsContact CZ-CH2 3.48Å; R806-W810 PolarHBondContact O-N 2.88Å; A807-W810 PolarHBondContact O-N 3.32Å; W810-V812 PolarHBondContact O-N 3.05Å; W810-Y813 PolarHBondContact O-N 3.07Å; W810-I814 HydrophobicContact CB-CD1 4.34Å; W810-I814 WeakPolarHBondContact O-CG1 3.31Å; W810-I814 PolarHBondContact O-N 3.05Å
811	L	84.4	Confident	81.1	Confident	17 Å²	17	30.2 Å²	30.2	9%	0.089	16%	0.158	C	C	.	.	H	α-helix	trans	-57.3	-38.6	-179.9	-178.5	64.1	0	0	0	111.9	L343 K347 I350 M367 A807 S808 L809 Y813 I814 D815	L343-L811 HydrophobicContact CD1-CD1 4.01Å; K347-L811 HydrophobicContact CD-CD1 4.3Å; K347-L811 HydrophobicContact CG-CD1 3.56Å; K347-L811 HydrophobicContact CG-CD2 3.97Å; K347-L811 HydrophobicContact CG-CG 4.38Å; I350-L811 HydrophobicContact CB-CD2 4.26Å; I350-L811 HydrophobicContact CD1-CB 4.24Å; I350-L811 HydrophobicContact CD1-CD2 3.74Å; I350-L811 HydrophobicContact CG2-CD2 4.15Å; M367-L811 HydrophobicContact CE-CB 4.49Å; A807-L811 WeakPolarHBondContact O-CB 3.21Å; A807-L811 PolarHBondContact O-N 3.08Å; S808-L811 PolarHBondContact O-N 3.42Å; L809-L811 VanDerWaalsContact C-N 3.32Å; L809-L811 PolarHBondContact O-N 2.96Å; L811-Y813 VanDerWaalsContact C-N 3.3Å; L811-Y813 PolarHBondContact O-N 3.1Å; L811-I814 PolarHBondContact O-N 2.85Å; L811-D815 WeakPolarHBondContact O-CB 3.1Å; L811-D815 PolarHBondContact O-N 3.46Å
812	V	81.9	Confident	81.1	Confident	38 Å²	38	29.8 Å²	29.8	23%	0.23	16%	0.157	C	C	.	.	H	α-helix	trans	-58.6	-41.7	176.8	176	0	0	0	0	111.5	S808 L809 W810 Q816	S808-V812 PolarHBondContact O-N 3.38Å; L809-V812 PolarHBondContact O-N 3.33Å; W810-V812 PolarHBondContact O-N 3.05Å; V812-Q816 HydrophobicContact CG1-CG 4.5Å; V812-Q816 VanDerWaalsContact CG1-NE2 3.32Å; V812-Q816 WeakPolarHBondContact O-CB 3.45Å; V812-Q816 WeakPolarHBondContact O-CG 3.32Å; V812-Q816 PolarHBondContact O-N 2.99Å; V812-Q816 VanDerWaalsContact O-N 3.11Å
813	Y	81.8	Confident	80.7	Confident	16 Å²	16	30.7 Å²	30.7	6%	0.063	17%	0.165	C	C	.	.	H	α-helix	trans	-82.6	-24	-179.9	-67.1	-77.8	0	0	0	113.9	K440 F441 H444 L809 W810 L811	K440-Y813 HydrophobicContact CB-CD1 4.18Å; F441-Y813 HydrophobicContact CB-CD1 4.25Å; F441-Y813 HydrophobicContact CB-CD2 4.15Å; F441-Y813 HydrophobicContact CB-CE1 4.4Å; F441-Y813 HydrophobicContact CB-CE2 4.32Å; F441-Y813 HydrophobicContact CB-CG 4.12Å; F441-Y813 AromaticContact CD2-CD2 3.94Å; F441-Y813 HydrophobicContact CD2-CD2 3.94Å; F441-Y813 HydrophobicContact CD2-CE1 4.41Å; F441-Y813 AromaticContact CD2-CE2 3.4Å; F441-Y813 HydrophobicContact CD2-CE2 3.4Å; F441-Y813 VanDerWaalsContact CD2-CE2 3.4Å; F441-Y813 AromaticContact CD2-CZ 3.66Å; F441-Y813 HydrophobicContact CE2-CE2 4.16Å; F441-Y813 HydrophobicContact CG-CD2 4.46Å; F441-Y813 HydrophobicContact CG-CE2 4.3Å; H444-Y813 HydrophobicContact CB-CE1 4.1Å; H444-Y813 AromaticContact CD2-CE1 3.61Å; L809-Y813 HydrophobicContact CD1-CE2 3.88Å; L809-Y813 HydrophobicContact CG-CE2 4.37Å; L809-Y813 VanDerWaalsContact O-CD2 3.32Å; L809-Y813 WeakPolarHBondContact O-CD2 3.39Å; W810-Y813 PolarHBondContact O-N 3.07Å; L811-Y813 VanDerWaalsContact C-N 3.3Å; L811-Y813 PolarHBondContact O-N 3.1Å
814	I	80.5	Confident	80.3	Confident	37 Å²	37	30.1 Å²	30.1	19%	0.19	17%	0.165	C	C	.	.	H	α-helix	trans	-69.6	-42.7	171.7	-68.6	167.3	0	0	0	109.8	L343 L370 P437 W810 L811	L343-I814 HydrophobicContact CD1-CG2 4.31Å; L343-I814 HydrophobicContact CD2-CG2 3.78Å; L370-I814 HydrophobicContact CB-CD1 4.5Å; P437-I814 HydrophobicContact CB-CG1 4Å; P437-I814 HydrophobicContact CG-CG1 3.87Å; W810-I814 HydrophobicContact CB-CD1 4.34Å; W810-I814 WeakPolarHBondContact O-CG1 3.31Å; W810-I814 PolarHBondContact O-N 3.05Å; L811-I814 PolarHBondContact O-N 2.85Å
815	D	73	Confident	79.8	Confident	49 Å²	49	31.5 Å²	31.5	26%	0.262	17%	0.173	S	C	.	.	H	α-helix	trans	-80.2	-27.8	-177.9	-77.9	-10.3	0	0	0	114.1	K347 Y518 L811 E817	K347-D815 WeakPolarHBondContact CE-OD1 3.26Å; K347-D815 WeakPolarHBondContact CE-OD2 3.43Å; K347-D815 IonicContact NZ-OD1 3.36Å; K347-D815 PolarHBondContact NZ-OD1 2.97Å; K347-D815 IonicContact NZ-OD2 3.67Å; K347-D815 PolarHBondContact NZ-OD2 3Å; Y518-D815 WeakPolarHBondContact OH-CB 3.1Å; L811-D815 WeakPolarHBondContact O-CB 3.1Å; L811-D815 PolarHBondContact O-N 3.46Å; D815-E817 PolarHBondContact O-N 3.4Å
816	Q	67.5	Low	79.4	Confident	32 Å²	32	32.8 Å²	32.8	15%	0.15	18%	0.176	C	C	.	.			trans	-69	118.2	-179.8	-82	176.1	7.7	0	0	112.1	K440 V812 G818	K440-Q816 PolarHBondContact NZ-O 3.2Å; V812-Q816 HydrophobicContact CG1-CG 4.5Å; V812-Q816 VanDerWaalsContact CG1-NE2 3.32Å; V812-Q816 WeakPolarHBondContact O-CB 3.45Å; V812-Q816 WeakPolarHBondContact O-CG 3.32Å; V812-Q816 PolarHBondContact O-N 2.99Å; V812-Q816 VanDerWaalsContact O-N 3.11Å; Q816-G818 VanDerWaalsContact C-N 3.27Å; Q816-G818 PolarHBondContact O-N 3.16Å
817	E	58.7	Low	78.7	Confident	171 Å²	171	36.5 Å²	36.5	80%	0.799	20%	0.197	S	C	*	.			trans	-75.2	-13.9	173	-63.7	-177.4	170.5	0	0	113.2	D815	D815-E817 PolarHBondContact O-N 3.4Å
818	G	65	Low	77.8	Confident	22 Å²	22	40.3 Å²	40.3	23%	0.227	22%	0.221	C	C	.	.			trans	-72.5	131.1	177.5	0	0	0	0	0	112.3	Q816	Q816-G818 VanDerWaalsContact C-N 3.27Å; Q816-G818 PolarHBondContact O-N 3.16Å
819	V	69	Low	76.7	Confident	10 Å²	10	41 Å²	41	6%	0.061	23%	0.226	C	C	.	.			trans	-103.8	-26.5	179.4	175.4	0	0	0	0	112.3	Y404 L434 R435	Y404-V819 HydrophobicContact CE2-CG1 4.46Å; L434-V819 HydrophobicContact CB-CG1 3.59Å; L434-V819 HydrophobicContact CD2-CG1 4.48Å; L434-V819 WeakPolarHBondContact O-CG1 3.44Å; R435-V819 HydrophobicContact CG-CG2 4.03Å
820	L	78.8	Confident	75.7	Confident	22 Å²	22	49.3 Å²	49.3	12%	0.115	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-91.4	126.3	-171	-90.2	67.9	0	0	0	112	Y404 L405 L824	Y404-L820 HydrophobicContact CD1-CD1 3.55Å; Y404-L820 HydrophobicContact CE1-CD1 3.29Å; L405-L820 HydrophobicContact CD1-CD2 4.48Å; L405-L820 HydrophobicContact CD2-CD2 3.64Å; L405-L820 HydrophobicContact CG-CD2 4.15Å; L820-L824 HydrophobicContact CD2-CB 4.17Å
821	P	85.6	Confident	74.6	Confident	6 Å²	6	53.7 Å²	53.7	4%	0.039	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-76.6	167.6	172.9	33.3	-35.7	0	0	0	111.8	Y401 G443 L824 N825	Y401-P821 HydrophobicContact CD2-CG 4.25Å; Y401-P821 HydrophobicContact CE1-CG 4.22Å; Y401-P821 HydrophobicContact CE2-CG 3.78Å; G443-P821 WeakPolarHBondContact O-CB 3.26Å; P821-L824 PolarHBondContact O-N 2.83Å; P821-N825 PolarHBondContact O-N 3.48Å
822	V	85.5	Confident	73.6	Confident	5 Å²	5	55.1 Å²	55.1	3%	0.03	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	143.7	173.6	-177.3	0	0	0	0	109.5	S447 W503 M510	S447-V822 VanDerWaalsContact CB-O 3.23Å; S447-V822 WeakPolarHBondContact CB-O 3.49Å; S447-V822 PolarHBondContact OG-O 2.97Å; W503-V822 HydrophobicContact CG-CG1 3.98Å; W503-V822 WeakPolarHBondContact O-CG1 3.47Å; M510-V822 HydrophobicContact CB-CG2 4.45Å; M510-V822 HydrophobicContact SD-CG2 4.15Å
823	P	81	Confident	72.8	Confident	39 Å²	39	56.6 Å²	56.6	25%	0.253	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	cis	-85.6	-4.1	-4.5	35.1	-35.5	0	0	0	114	W503 N825 L826	W503-P823 HydrophobicContact CD2-CG 4.43Å; W503-P823 HydrophobicContact CE3-CG 4.27Å; W503-P823 HydrophobicContact CZ3-CG 4.41Å; P823-N825 PolarHBondContact O-N 2.75Å; P823-N825 VanDerWaalsContact O-N 3.07Å; P823-L826 PolarHBondContact O-N 3.12Å
824	L	79.7	Confident	72.2	Confident	50 Å²	50	59 Å²	59	26%	0.262	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-60.4	-22.3	-175.5	-61.2	177.5	0	0	0	113.2	Y401 L405 L820 P821 L826 L827	Y401-L824 HydrophobicContact CG-CD1 4.3Å; L405-L824 HydrophobicContact CD1-CD2 4.45Å; L820-L824 HydrophobicContact CD2-CB 4.17Å; P821-L824 PolarHBondContact O-N 2.83Å; L824-L826 PolarHBondContact O-N 2.96Å; L824-L826 VanDerWaalsContact O-N 3.1Å; L824-L827 HydrophobicContact CD2-CD1 4.38Å; L824-L827 PolarHBondContact O-N 3.34Å
825	N	81	Confident	71.6	Confident	51 Å²	51	59.7 Å²	59.7	27%	0.273	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-54.2	-22.9	171.8	-172.6	36.4	0	0	0	114.3	P821 P823 L827	P821-N825 PolarHBondContact O-N 3.48Å; P823-N825 PolarHBondContact O-N 2.75Å; P823-N825 VanDerWaalsContact O-N 3.07Å; N825-L827 VanDerWaalsContact C-N 3.27Å; N825-L827 PolarHBondContact O-N 2.85Å
826	L	78.1	Confident	71.4	Confident	55 Å²	55	62.1 Å²	62.1	29%	0.288	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-71.9	-20.6	175.8	-67.5	174.5	0	0	0	113.3	F502 L505 C509 P823 L824 P828	F502-L826 HydrophobicContact CD1-CD1 4.23Å; F502-L826 WeakPolarHBondContact O-CD1 3.24Å; L505-L826 HydrophobicContact CB-CD1 4.41Å; L505-L826 HydrophobicContact CD2-CD1 4.39Å; L505-L826 HydrophobicContact CG-CD1 4.42Å; L505-L826 HydrophobicContact CG-CD2 4.21Å; C509-L826 HydrophobicContact CB-CD2 4.22Å; C509-L826 VanDerWaalsContact SG-CD2 3.6Å; P823-L826 PolarHBondContact O-N 3.12Å; L824-L826 PolarHBondContact O-N 2.96Å; L824-L826 VanDerWaalsContact O-N 3.1Å; L826-P828 WeakPolarHBondContact O-CD 3.41Å
827	L	75.2	Confident	71.7	Confident	98 Å²	98	65.7 Å²	65.7	51%	0.513	36%	0.357	S	S	.	.	S	Bend	trans	-89	116.3	-178.4	-62	175	0	0	0	110.1	L405 L824 N825	L405-L827 HydrophobicContact CD1-CD1 4.27Å; L405-L827 HydrophobicContact CD2-CB 4.44Å; L824-L827 HydrophobicContact CD2-CD1 4.38Å; L824-L827 PolarHBondContact O-N 3.34Å; N825-L827 VanDerWaalsContact C-N 3.27Å; N825-L827 PolarHBondContact O-N 2.85Å
828	P	68.1	Low	72.2	Confident	80 Å²	80	60.3 Å²	60.3	52%	0.519	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-67.1	143.5	174.4	25	-29.5	0	0	0	110.8	L826 A832 I833	L826-P828 WeakPolarHBondContact O-CD 3.41Å; P828-A832 HydrophobicContact CB-CB 4.47Å; P828-I833 HydrophobicContact CB-CD1 4.45Å; P828-I833 HydrophobicContact CB-CG1 3.92Å; P828-I833 HydrophobicContact CG-CD1 3.96Å; P828-I833 HydrophobicContact CG-CG1 3.7Å; P828-I833 WeakPolarHBondContact O-CD1 3.25Å
829	S	64.7	Low	72.5	Confident	43 Å²	43	67.5 Å²	67.5	30%	0.301	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-63.2	151.2	175.7	65.3	0	0	0	0	111.1	E831 A832 I833	S829-E831 PolarHBondContact O-N 3.05Å; S829-E831 VanDerWaalsContact O-N 3.16Å; S829-A832 CarbonylContact O-C 3.01Å; S829-A832 WeakPolarHBondContact O-CA 3.27Å; S829-A832 WeakPolarHBondContact O-CB 3.49Å; S829-A832 PolarHBondContact O-N 2.93Å; S829-A832 WeakPolarHBondContact OG-CB 3.47Å; S829-A832 PolarHBondContact OG-N 3.31Å; S829-I833 WeakPolarHBondContact O-CG1 3.22Å; S829-I833 PolarHBondContact O-N 3.37Å
830	R	64.4	Low	72.9	Confident	181 Å²	181	72.6 Å²	72.6	68%	0.683	38%	0.38	S	S	*	.	H	α-helix	trans	-56	-34.1	179.2	-171.8	-177.9	178.2	179.9	0.4	112.7	I833 S834	R830-I833 CarbonylContact O-C 3.57Å; R830-I833 PolarHBondContact O-N 3.41Å; R830-S834 WeakPolarHBondContact O-CB 3.44Å; R830-S834 PolarHBondContact O-N 2.89Å
831	E	62.5	Low	72.6	Confident	106 Å²	106	78.2 Å²	78.2	50%	0.495	40%	0.401	S	S	.	.	H	α-helix	trans	-67.3	-41.1	174.9	-66.4	175.5	-169.7	0	0	112.2	H409 S829 I833 S834 S835	H409-E831 IonicContact NE2-OE1 3.7Å; S829-E831 PolarHBondContact O-N 3.05Å; S829-E831 VanDerWaalsContact O-N 3.16Å; E831-I833 VanDerWaalsContact C-N 3.34Å; E831-S834 PolarHBondContact O-N 3.49Å; E831-S834 PolarHBondContact O-OG 3.04Å; E831-S834 VanDerWaalsContact O-OG 3.12Å; E831-S835 VanDerWaalsContact O-CB 3.23Å; E831-S835 WeakPolarHBondContact O-CB 3.35Å; E831-S835 PolarHBondContact O-N 3.49Å
832	A	64.2	Low	71.7	Confident	46 Å²	46	82.7 Å²	82.7	38%	0.38	43%	0.425	S	S	.	.	H	α-helix	trans	-65.4	-41.2	173.4	0	0	0	0	0	110.6	P828 S829 S835 L836	P828-A832 HydrophobicContact CB-CB 4.47Å; S829-A832 CarbonylContact O-C 3.01Å; S829-A832 WeakPolarHBondContact O-CA 3.27Å; S829-A832 WeakPolarHBondContact O-CB 3.49Å; S829-A832 PolarHBondContact O-N 2.93Å; S829-A832 WeakPolarHBondContact OG-CB 3.47Å; S829-A832 PolarHBondContact OG-N 3.31Å; A832-S835 PolarHBondContact O-N 2.85Å; A832-L836 VanDerWaalsContact O-CB 3.23Å; A832-L836 WeakPolarHBondContact O-CB 3.2Å; A832-L836 PolarHBondContact O-N 2.84Å
833	I	63.9	Low	71.1	Confident	69 Å²	69	87.7 Å²	87.7	35%	0.354	45%	0.45	S	S	.	.	H	α-helix	trans	-63.9	-42.5	174	-62.8	169.2	0	0	0	110.6	P828 S829 R830 E831 L836 L837	P828-I833 HydrophobicContact CB-CD1 4.45Å; P828-I833 HydrophobicContact CB-CG1 3.92Å; P828-I833 HydrophobicContact CG-CD1 3.96Å; P828-I833 HydrophobicContact CG-CG1 3.7Å; P828-I833 WeakPolarHBondContact O-CD1 3.25Å; S829-I833 WeakPolarHBondContact O-CG1 3.22Å; S829-I833 PolarHBondContact O-N 3.37Å; R830-I833 CarbonylContact O-C 3.57Å; R830-I833 PolarHBondContact O-N 3.41Å; E831-I833 VanDerWaalsContact C-N 3.34Å; I833-L836 PolarHBondContact O-N 2.9Å; I833-L837 HydrophobicContact CG2-CD1 3.61Å; I833-L837 HydrophobicContact CG2-CG 4.06Å; I833-L837 WeakPolarHBondContact O-CB 3.27Å; I833-L837 WeakPolarHBondContact O-CG 3.46Å; I833-L837 PolarHBondContact O-N 3.13Å
834	S	69.5	Low	70.5	Confident	66 Å²	66	90.6 Å²	90.6	46%	0.462	46%	0.462	S	S	.	.	H	α-helix	trans	-71.3	-34.6	-179.6	77.7	0	0	0	0	112	R830 E831 S838	R830-S834 WeakPolarHBondContact O-CB 3.44Å; R830-S834 PolarHBondContact O-N 2.89Å; E831-S834 PolarHBondContact O-N 3.49Å; E831-S834 PolarHBondContact O-OG 3.04Å; E831-S834 VanDerWaalsContact O-OG 3.12Å; S834-S838 VanDerWaalsContact O-CB 3.24Å; S834-S838 WeakPolarHBondContact O-CB 3.25Å; S834-S838 PolarHBondContact O-N 3.32Å; S834-S838 PolarHBondContact O-OG 3.07Å; S834-S838 VanDerWaalsContact O-OG 3.05Å
835	S	67.5	Low	69.5	Low	52 Å²	52	93.8 Å²	93.8	36%	0.364	48%	0.476	S	S	.	.	H	α-helix	trans	-64.4	-43.9	169.5	175	0	0	0	0	111.6	E831 A832 S838 R839	E831-S835 VanDerWaalsContact O-CB 3.23Å; E831-S835 WeakPolarHBondContact O-CB 3.35Å; E831-S835 PolarHBondContact O-N 3.49Å; A832-S835 PolarHBondContact O-N 2.85Å; S835-S838 WeakPolarHBondContact CA-OG 3.42Å; S835-S838 PolarHBondContact O-N 3.47Å; S835-S838 PolarHBondContact O-OG 3.48Å; S835-R839 WeakPolarHBondContact O-CB 3.44Å; S835-R839 WeakPolarHBondContact O-CG 3.48Å; S835-R839 PolarHBondContact O-N 2.79Å
836	L	69.9	Low	68.1	Low	101 Å²	101	102.6 Å²	102.6	53%	0.529	51%	0.506	S	S	.	.	H	α-helix	trans	-67.9	-44	178	-157.2	101	0	0	0	111	A832 I833 R839 F840	A832-L836 VanDerWaalsContact O-CB 3.23Å; A832-L836 WeakPolarHBondContact O-CB 3.2Å; A832-L836 PolarHBondContact O-N 2.84Å; I833-L836 PolarHBondContact O-N 2.9Å; L836-R839 PolarHBondContact O-N 2.84Å; L836-F840 HydrophobicContact CD2-CD2 4.12Å; L836-F840 HydrophobicContact CD2-CE2 4.07Å; L836-F840 HydrophobicContact CG-CD2 4.13Å; L836-F840 HydrophobicContact CG-CE2 4.31Å; L836-F840 WeakPolarHBondContact O-CB 3.28Å; L836-F840 WeakPolarHBondContact O-CD2 3.5Å; L836-F840 PolarHBondContact O-N 3.02Å
837	L	74.4	Confident	66.8	Low	107 Å²	107	108.7 Å²	108.7	56%	0.56	53%	0.53	S	S	*	.	H	α-helix	trans	-64.9	-39.9	176.1	-77.3	170.5	0	0	0	111.4	I833 F840 Y841	I833-L837 HydrophobicContact CG2-CD1 3.61Å; I833-L837 HydrophobicContact CG2-CG 4.06Å; I833-L837 WeakPolarHBondContact O-CB 3.27Å; I833-L837 WeakPolarHBondContact O-CG 3.46Å; I833-L837 PolarHBondContact O-N 3.13Å; L837-F840 PolarHBondContact O-N 3.38Å; L837-Y841 WeakPolarHBondContact O-CB 3.44Å; L837-Y841 PolarHBondContact O-N 2.77Å
838	S	68.7	Low	65.2	Low	58 Å²	58	112.6 Å²	112.6	41%	0.406	54%	0.543	S	S	.	.	H	α-helix	trans	-68.2	-39.2	175.5	66.3	0	0	0	0	111.5	S834 S835 Y841 N842	S834-S838 VanDerWaalsContact O-CB 3.24Å; S834-S838 WeakPolarHBondContact O-CB 3.25Å; S834-S838 PolarHBondContact O-N 3.32Å; S834-S838 PolarHBondContact O-OG 3.07Å; S834-S838 VanDerWaalsContact O-OG 3.05Å; S835-S838 WeakPolarHBondContact CA-OG 3.42Å; S835-S838 PolarHBondContact O-N 3.47Å; S835-S838 PolarHBondContact O-OG 3.48Å; S838-Y841 PolarHBondContact O-N 3.32Å; S838-N842 VanDerWaalsContact O-CB 3.31Å; S838-N842 WeakPolarHBondContact O-CB 3.3Å; S838-N842 PolarHBondContact O-N 3.27Å; S838-N842 PolarHBondContact O-ND2 3.16Å
839	R	71.5	Confident	63.9	Low	173 Å²	173	113.9 Å²	113.9	65%	0.653	55%	0.551	S	S	*	*	H	α-helix	trans	-61.2	-46.3	170.3	-78.2	175.7	169.5	179.6	-1.5	111.9	S835 L836 N842 I843	S835-R839 WeakPolarHBondContact O-CB 3.44Å; S835-R839 WeakPolarHBondContact O-CG 3.48Å; S835-R839 PolarHBondContact O-N 2.79Å; L836-R839 PolarHBondContact O-N 2.84Å; R839-N842 PolarHBondContact O-N 2.85Å; R839-I843 WeakPolarHBondContact O-CD1 3.35Å; R839-I843 WeakPolarHBondContact O-CG1 3.43Å; R839-I843 PolarHBondContact O-N 3.38Å
840	F	76.5	Confident	62.7	Low	116 Å²	116	119.9 Å²	119.9	51%	0.509	57%	0.574	S	S	.	*	H	α-helix	trans	-63.9	-42.4	176.4	-100.7	-84.4	0	0	0	112.1	L836 L837 I843 I844	L836-F840 HydrophobicContact CD2-CD2 4.12Å; L836-F840 HydrophobicContact CD2-CE2 4.07Å; L836-F840 HydrophobicContact CG-CD2 4.13Å; L836-F840 HydrophobicContact CG-CE2 4.31Å; L836-F840 WeakPolarHBondContact O-CB 3.28Å; L836-F840 WeakPolarHBondContact O-CD2 3.5Å; L836-F840 PolarHBondContact O-N 3.02Å; L837-F840 PolarHBondContact O-N 3.38Å; F840-I843 WeakPolarHBondContact O-CB 3.25Å; F840-I843 PolarHBondContact O-N 3.46Å; F840-I844 VanDerWaalsContact O-CG1 3.25Å; F840-I844 WeakPolarHBondContact O-CG1 3.42Å; F840-I844 PolarHBondContact O-N 3.38Å
841	Y	72.1	Confident	61.4	Low	140 Å²	140	118.4 Å²	118.4	55%	0.549	58%	0.578	S	S	.	*	H	α-helix	trans	-65.9	-40.1	178.3	-167	-96.2	0	0	0	111.4	L837 S838 I843 I844 Q845	L837-Y841 WeakPolarHBondContact O-CB 3.44Å; L837-Y841 PolarHBondContact O-N 2.77Å; S838-Y841 PolarHBondContact O-N 3.32Å; Y841-I843 VanDerWaalsContact C-N 3.33Å; Y841-I843 PolarHBondContact O-N 2.99Å; Y841-I844 PolarHBondContact O-N 2.91Å; Y841-Q845 HydrophobicContact CD1-CG 4.15Å; Y841-Q845 HydrophobicContact CE1-CG 3.74Å; Y841-Q845 PolarHBondContact O-N 2.62Å; Y841-Q845 PolarHBondContact OH-NE2 3.1Å
842	N	67.4	Low	59.9	Low	100 Å²	100	122.8 Å²	122.8	54%	0.535	59%	0.592	S	S	.	*	H	α-helix	trans	-63	-38.5	172.5	-71.5	-15.2	0	0	0	111.6	S838 R839 W846	S838-N842 VanDerWaalsContact O-CB 3.31Å; S838-N842 WeakPolarHBondContact O-CB 3.3Å; S838-N842 PolarHBondContact O-N 3.27Å; S838-N842 PolarHBondContact O-ND2 3.16Å; R839-N842 PolarHBondContact O-N 2.85Å; N842-W846 PolarHBondContact O-N 3.25Å
843	I	72.6	Confident	58.3	Low	110 Å²	110	126.9 Å²	126.9	56%	0.564	61%	0.612	S	S	*	*	H	α-helix	trans	-66.1	-38.9	174.2	-68	162.4	0	0	0	111.5	R839 F840 Y841	R839-I843 WeakPolarHBondContact O-CD1 3.35Å; R839-I843 WeakPolarHBondContact O-CG1 3.43Å; R839-I843 PolarHBondContact O-N 3.38Å; F840-I843 WeakPolarHBondContact O-CB 3.25Å; F840-I843 PolarHBondContact O-N 3.46Å; Y841-I843 VanDerWaalsContact C-N 3.33Å; Y841-I843 PolarHBondContact O-N 2.99Å
844	I	69.2	Low	56.5	Low	100 Å²	100	132.6 Å²	132.6	51%	0.513	63%	0.634	S	S	.	*	H	α-helix	trans	-74.1	-39.4	-178.4	-68.7	163.7	0	0	0	111.7	F840 Y841 W846 K847	F840-I844 VanDerWaalsContact O-CG1 3.25Å; F840-I844 WeakPolarHBondContact O-CG1 3.42Å; F840-I844 PolarHBondContact O-N 3.38Å; Y841-I844 PolarHBondContact O-N 2.91Å; I844-W846 VanDerWaalsContact C-N 3.29Å; I844-W846 PolarHBondContact O-N 2.86Å; I844-K847 PolarHBondContact O-N 3.38Å
845	Q	57.1	Low	54.6	Low	117 Å²	117	138.3 Å²	138.3	55%	0.547	65%	0.653	S	S	.	*	H	α-helix	trans	-64.9	-32.1	178.3	-83.8	-139.2	-7.4	0	0	113.1	Y841 K847 K848	Y841-Q845 HydrophobicContact CD1-CG 4.15Å; Y841-Q845 HydrophobicContact CE1-CG 3.74Å; Y841-Q845 PolarHBondContact O-N 2.62Å; Y841-Q845 PolarHBondContact OH-NE2 3.1Å; Q845-K847 PolarHBondContact O-N 3.4Å; Q845-K847 VanDerWaalsContact O-N 3.1Å; Q845-K848 PolarHBondContact O-N 2.97Å
846	W	53.3	Low	52.5	Low	237 Å²	237	143.3 Å²	143.3	90%	0.898	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	-9.3	173.7	-84.6	60.9	0	0	0	113.9	N842 I844	N842-W846 PolarHBondContact O-N 3.25Å; I844-W846 VanDerWaalsContact C-N 3.29Å; I844-W846 PolarHBondContact O-N 2.86Å
847	K	51.1	Low	50.5	Low	183 Å²	183	144.8 Å²	144.8	80%	0.796	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.5	0.9	179.6	-90	-169.9	174.5	-174.6	0	115.9	I844 Q845 P849	I844-K847 PolarHBondContact O-N 3.38Å; Q845-K847 PolarHBondContact O-N 3.4Å; Q845-K847 VanDerWaalsContact O-N 3.1Å; K847-P849 WeakPolarHBondContact O-CD 3.4Å
848	K	40.9	Very low	48.1	Very low	179 Å²	179	145.8 Å²	145.8	78%	0.778	69%	0.694	S	S	*	*			trans	-89.2	118.4	174.8	-81.9	-170.8	176.3	-178.5	0	111.7	Q845	Q845-K848 PolarHBondContact O-N 2.97Å
849	P	41.1	Very low	46	Very low	107 Å²	107	150.8 Å²	150.8	70%	0.695	72%	0.715	S	S	*	*			trans	-74.3	130.7	-179.3	29.3	-31.3	0	0	0	110.6	K847 I851	K847-P849 WeakPolarHBondContact O-CD 3.4Å; P849-I851 PolarHBondContact O-N 3.11Å
850	Q	39.8	Very low	43.9	Very low	169 Å²	169	151 Å²	151	79%	0.79	72%	0.724	S	S	*	*			trans	-69.9	106.8	174.4	-67.6	-161.7	-10.5	0	0	109.9	Y852	Q850-Y852 PolarHBondContact O-N 3.45Å
851	I	36.3	Very low	41.6	Very low	150 Å²	150	155.3 Å²	155.3	77%	0.769	74%	0.742	S	S	*	*			trans	-85.2	108	172.2	-64.7	170.6	0	0	0	107.6	P849 T853	P849-I851 PolarHBondContact O-N 3.11Å; I851-T853 PolarHBondContact O-N 3.39Å
852	Y	30.9	Very low	39.4	Very low	199 Å²	199	155.2 Å²	155.2	78%	0.78	75%	0.751	S	S	*	*			trans	-67.6	113.2	173.6	-85.4	-100	0	0	0	110.8	Q850	Q850-Y852 PolarHBondContact O-N 3.45Å
853	T	29.8	Very low	37.4	Very low	131 Å²	131	156.2 Å²	156.2	80%	0.804	76%	0.756	S	S	*	*			trans	-90.3	100.4	159.8	44.6	0	0	0	0	109	I851	I851-T853 PolarHBondContact O-N 3.39Å
854	K	26.4	Very low	35.1	Very low	189 Å²	189	158.8 Å²	158.8	82%	0.822	77%	0.771	S	S	*	*			trans	-93.9	95.2	-179.6	-168.5	176.9	-172.5	177.2	0	108.1
855	H	29.7	Very low	33	Very low	186 Å²	186	158.8 Å²	158.8	86%	0.861	79%	0.787	S	S	*	*			trans	-119.2	125.9	169.1	-92.7	-83.1	0	0	0	110.8
856	H	24.7	Very low	31.4	Very low	157 Å²	157	161.2 Å²	161.2	73%	0.727	80%	0.803	S	S	*	*			trans	-50.7	138.1	177.4	-81.1	-109.2	0	0	0	113.8
857	C	26.5	Very low	30	Very low	132 Å²	132	157.8 Å²	157.8	89%	0.892	80%	0.8	S	S	*	*				-156.8	127.5	127.8	-110.3	0	0	0	0	109.1
858	D	24.5	Very low	28.8	Very low	129 Å²	129	158.3 Å²	158.3	69%	0.69	80%	0.802	S	S	*	*			trans	-73.3	171.9	-172.7	-61.3	-67.7	0	0	0	114.1
859	L	24.7	Very low	28	Very low	163 Å²	163	153.6 Å²	153.6	85%	0.853	79%	0.792	S	S	*	*			trans	87	125.5	157.4	-92.8	108.3	0	0	0	119.1
860	Q	26.3	Very low	27.1	Very low	177 Å²	177	157.4 Å²	157.4	83%	0.827	80%	0.801	S	S	*	*			trans	102.4	82.6	141.2	-144.8	168.6	35.7	0	0	116.8
861	K	30	Very low	26.3	Very low	206 Å²	206	156 Å²	156	90%	0.896	80%	0.804	S	S	*	*				-171.4	130.4	111.8	-106.6	169.7	178	174.9	0	112.6
862	N	24.4	Very low	25.8	Very low	138 Å²	138	155.2 Å²	155.2	74%	0.738	81%	0.806	S	S	*	*			trans	-49.4	146.1	176.1	-88.2	9.9	0	0	0	115.2
863	D	25.1	Very low	25.8	Very low	121 Å²	121	150.7 Å²	150.7	65%	0.647	80%	0.801	S	S	*	*				48.4	110.6	128.8	-47.1	-28.7	0	0	0	118.1
864	N	25.1	Very low	25.6	Very low	164 Å²	164	150.8 Å²	150.8	88%	0.877	80%	0.802	S	S	*	*				164.9	79.5	126	-78.3	-20.1	0	0	0	110.3
865	A	26	Very low	25.3	Very low	101 Å²	101	151 Å²	151	84%	0.835	80%	0.803	S	S	*	*			trans	172.1	78.4	152.1	0	0	0	0	0	110.6
866	L	22.8	Very low	25	Very low	168 Å²	168	152.9 Å²	152.9	88%	0.88	80%	0.804	S	S	*	*			trans	-148.9	105.4	165.9	-123.5	144.7	0	0	0	107.1
867	I	25	Very low	25	Very low	164 Å²	164	153.9 Å²	153.9	84%	0.841	81%	0.809	S	S	*	*			trans	179.2	100.8	149.2	-79.8	140.3	0	0	0	105
868	F	25.7	Very low	24.9	Very low	194 Å²	194	153.3 Å²	153.3	85%	0.851	80%	0.801	S	S	*	*				-175	137.4	107.6	-157.3	-103.8	0	0	0	110.4
869	S	23.6	Very low	25	Very low	81 Å²	81	153.7 Å²	153.7	57%	0.566	81%	0.808	S	S	*	*			trans	-65.7	145	-167.4	37.9	0	0	0	0	116.6
870	Q	21.2	Very low	25	Very low	187 Å²	187	152.7 Å²	152.7	87%	0.874	80%	0.803	S	S	*	*			trans	-61.9	138.6	147.9	-62.8	166.4	-25.8	0	0	111.1
871	T	23.9	Very low	25.1	Very low	139 Å²	139	149.3 Å²	149.3	85%	0.853	80%	0.799	S	S	*	*			trans	-151.2	132.7	143.4	41.8	0	0	0	0	110
872	T	26.3	Very low	24.9	Very low	133 Å²	133	148.5 Å²	148.5	82%	0.816	80%	0.799	S	S	*	*			trans	-79.2	-165.9	176.2	55.5	0	0	0	0	109.9
873	P	30.1	Very low	24.9	Very low	104 Å²	104	149.4 Å²	149.4	68%	0.675	80%	0.803	S	S	*	*			cis	-135.7	179.6	-11.7	36.9	-17.1	0	0	0	113.2
874	T	25.2	Very low	24.9	Very low	133 Å²	133	151 Å²	151	82%	0.816	81%	0.811	S	S	*	*				174.9	135.1	128.5	32.2	0	0	0	0	112.8
875	K	19.8	Very low	25.1	Very low	195 Å²	195	150.3 Å²	150.3	85%	0.848	80%	0.803	S	S	*	*			trans	-84.4	137	-179.9	-69.5	165.6	170.4	174.8	0	110.5
876	Y	24.1	Very low	25	Very low	224 Å²	224	153.3 Å²	153.3	88%	0.878	81%	0.805	S	S	*	*			trans	-136.5	146.9	149.9	-79.3	-76.4	0	0	0	110.8
877	H	25.5	Very low	25.2	Very low	179 Å²	179	150.8 Å²	150.8	83%	0.829	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-70.8	132.4	-155	-95.3	-110.6	0	0	0	115.8
878	T	23.5	Very low	25	Very low	119 Å²	119	154.7 Å²	154.7	73%	0.73	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-83.6	121.2	153.7	39.1	0	0	0	0	110
879	V	26.7	Very low	25	Very low	137 Å²	137	153.2 Å²	153.2	83%	0.83	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-80.4	116.7	164	173.3	0	0	0	0	108
880	N	23.6	Very low	25	Very low	142 Å²	142	155.9 Å²	155.9	76%	0.759	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-82.2	138.4	169.9	-76.3	-33.2	0	0	0	110.1
881	S	28.7	Very low	25.3	Very low	107 Å²	107	154.2 Å²	154.2	75%	0.748	79%	0.793	S	S	*	*				-173.1	107.5	129.5	41.5	0	0	0	0	112.1
882	Q	25.8	Very low	25.3	Very low	188 Å²	188	154.6 Å²	154.6	88%	0.879	80%	0.795	S	S	*	*			trans	32.2	111.9	136.4	-59.4	-176.5	-9	0	0	119.4
883	L	24.8	Very low	25.3	Very low	158 Å²	158	152.7 Å²	152.7	83%	0.827	78%	0.784	S	S	*	*				-159	98.1	116.8	-146.6	78.2	0	0	0	110.8
884	N	25.5	Very low	25.1	Very low	154 Å²	154	154.5 Å²	154.5	82%	0.824	79%	0.793	S	S	*	*			trans	-75.4	120	153.9	-114	-24.3	0	0	0	106.5
885	Q	29.4	Very low	25.3	Very low	149 Å²	149	153.7 Å²	153.7	70%	0.696	79%	0.788	S	S	*	*			trans	-163.1	100.1	149.2	-109.5	168.4	30.3	0	0	111.2	I887	Q885-I887 PolarHBondContact O-N 3.02Å; Q885-I887 VanDerWaalsContact O-N 3.16Å
886	N	24	Very low	25.5	Very low	165 Å²	165	151.2 Å²	151.2	88%	0.882	79%	0.789	S	S	*	*			trans	-56.1	105.7	154	-71.7	-41	0	0	0	109.3
887	I	26.7	Very low	25.7	Very low	115 Å²	115	145.1 Å²	145.1	59%	0.59	78%	0.779	S	S	*	*			trans	-127.1	102.1	160.9	-62.7	179	0	0	0	108.8	Q885 K889	Q885-I887 PolarHBondContact O-N 3.02Å; Q885-I887 VanDerWaalsContact O-N 3.16Å; I887-K889 HydrophobicContact CG2-CD 4.35Å; I887-K889 HydrophobicContact CG2-CG 4.01Å; I887-K889 PolarHBondContact O-N 3.08Å
888	R	21.3	Very low	25.7	Very low	246 Å²	246	142.8 Å²	142.8	93%	0.928	78%	0.778	S	S	*	*			trans	-67	106.2	166.8	-158.3	175.3	-151.4	171.2	3.5	107.8
889	K	26	Very low	25.9	Very low	163 Å²	163	144.5 Å²	144.5	71%	0.709	78%	0.782	S	S	*	*			trans	-138.4	103.1	162.8	-76.8	-168.8	-179.6	-178.6	0	110.4	I887 H891	I887-K889 HydrophobicContact CG2-CD 4.35Å; I887-K889 HydrophobicContact CG2-CG 4.01Å; I887-K889 PolarHBondContact O-N 3.08Å; K889-H891 PolarHBondContact O-N 2.74Å
890	T	23.3	Very low	25.8	Very low	136 Å²	136	144.7 Å²	144.7	83%	0.834	78%	0.777	S	S	*	*			trans	-51.7	109.4	155.6	44.7	0	0	0	0	109.7
891	H	26.6	Very low	26	Very low	153 Å²	153	145.2 Å²	145.2	71%	0.708	78%	0.78	S	S	*	*			trans	-129	101.9	157.4	-92.9	-82	0	0	0	108.3	K889 T893	K889-H891 PolarHBondContact O-N 2.74Å; H891-T893 PolarHBondContact O-N 2.91Å
892	T	23.8	Very low	25.8	Very low	146 Å²	146	146.5 Å²	146.5	90%	0.896	78%	0.783	S	S	*	*			trans	-66.3	97.6	157	44.7	0	0	0	0	107.7
893	T	27.5	Very low	25.9	Very low	94 Å²	94	144.4 Å²	144.4	58%	0.577	78%	0.779	S	S	*	*			trans	-133.4	110.3	164.4	-48.2	0	0	0	0	108.5	H891 T895	H891-T893 PolarHBondContact O-N 2.91Å; T893-T895 PolarHBondContact O-N 3.33Å; T893-T895 VanDerWaalsContact O-N 3.12Å
894	T	25.3	Very low	25.8	Very low	141 Å²	141	141.4 Å²	141.4	87%	0.865	77%	0.771	S	S	*	*			trans	-50.8	104	160.4	37.9	0	0	0	0	110.2
895	T	28.7	Very low	25.6	Very low	116 Å²	116	142.3 Å²	142.3	71%	0.712	77%	0.774	S	S	*	*			trans	-114.3	100.4	160.6	50.3	0	0	0	0	107.9	T893 S897	T893-T895 PolarHBondContact O-N 3.33Å; T893-T895 VanDerWaalsContact O-N 3.12Å; T895-S897 PolarHBondContact O-N 3Å
896	V	24.2	Very low	25.3	Very low	143 Å²	143	142.2 Å²	142.2	87%	0.867	77%	0.773	S	S	*	*			trans	-70.4	109.5	159.4	173.8	0	0	0	0	106.5
897	S	29.4	Very low	25.3	Very low	96 Å²	96	139.4 Å²	139.4	67%	0.671	77%	0.766	S	S	*	*			trans	-161.7	102.2	157.5	47.9	0	0	0	0	108.6	T895	T895-S897 PolarHBondContact O-N 3Å
898	T	25.7	Very low	25.2	Very low	130 Å²	130	139.3 Å²	139.3	80%	0.798	77%	0.767	S	S	*	*			trans	-34.7	123.4	161.1	49.2	0	0	0	0	113.7
899	L	27.3	Very low	25.3	Very low	156 Å²	156	136.3 Å²	136.3	82%	0.817	76%	0.763	S	S	*	*			trans	-152.1	113.1	151.4	-133.9	107.1	0	0	0	109
900	L	24.8	Very low	25.2	Very low	141 Å²	141	138.8 Å²	138.8	74%	0.738	77%	0.768	S	S	*	*			trans	44.3	103.4	140.9	-63.6	161.1	0	0	0	117.3
901	D	27.3	Very low	25.3	Very low	152 Å²	152	138.1 Å²	138.1	81%	0.813	76%	0.764	S	S	*	*				-170.8	88.2	117.8	-87.9	-18.3	0	0	0	109.3	N903	D901-N903 PolarHBondContact O-N 3.47Å
902	T	25.4	Very low	25.3	Very low	134 Å²	134	135.6 Å²	135.6	82%	0.822	76%	0.764	S	S	*	*			trans	-74.5	95.8	163.7	49.4	0	0	0	0	108.3
903	N	26.2	Very low	25.4	Very low	145 Å²	145	136 Å²	136	78%	0.775	76%	0.76	S	S	*	*			trans	-102.4	112.8	159.9	-86.6	-30.2	0	0	0	108.7	D901 I905	D901-N903 PolarHBondContact O-N 3.47Å; N903-I905 PolarHBondContact O-N 2.91Å
904	S	23.5	Very low	25.4	Very low	95 Å²	95	135.2 Å²	135.2	66%	0.664	77%	0.771	S	S	*	*			trans	-49.1	124.6	177.1	54.8	0	0	0	0	111.7	H906	S904-H906 VanDerWaalsContact C-N 3.3Å; S904-H906 PolarHBondContact O-N 3.33Å
905	I	22.3	Very low	25.5	Very low	172 Å²	172	133.1 Å²	133.1	88%	0.882	76%	0.762	S	S	*	*			trans	-67	92.2	164.1	-64.2	166.6	0	0	0	106.4	N903	N903-I905 PolarHBondContact O-N 2.91Å
906	H	23.1	Very low	25.4	Very low	148 Å²	148	135 Å²	135	69%	0.685	77%	0.768	S	S	*	*			trans	-78.4	117	166	-120.5	-78.9	0	0	0	107.8	S904 N908	S904-H906 VanDerWaalsContact C-N 3.3Å; S904-H906 PolarHBondContact O-N 3.33Å; H906-N908 PolarHBondContact O-N 3.01Å; H906-N908 VanDerWaalsContact O-N 3.08Å
907	S	23.2	Very low	25.7	Very low	106 Å²	106	135.5 Å²	135.5	74%	0.741	76%	0.764	S	S	*	*			trans	-59.2	100.8	162.8	51.7	0	0	0	0	109.3
908	N	25.3	Very low	25.5	Very low	113 Å²	113	138.8 Å²	138.8	60%	0.604	77%	0.774	S	S	*	*			trans	-110.7	97.4	165.1	-72.1	-18.4	0	0	0	107.9	H906 W910	H906-N908 PolarHBondContact O-N 3.01Å; H906-N908 VanDerWaalsContact O-N 3.08Å; N908-W910 PolarHBondContact O-N 2.9Å
909	E	22.5	Very low	25.8	Very low	182 Å²	182	135.2 Å²	135.2	85%	0.85	76%	0.763	S	S	*	*			trans	-62.5	100.4	159.1	-166.1	168.7	-152.8	0	0	107.1	T911	E909-T911 PolarHBondContact O-N 3.29Å
910	W	23.4	Very low	25.8	Very low	216 Å²	216	137.1 Å²	137.1	82%	0.818	77%	0.768	S	S	*	*			trans	-86.3	90.3	173.2	-79.4	50.9	0	0	0	108.2	N908 S912	N908-W910 PolarHBondContact O-N 2.9Å; W910-S912 PolarHBondContact O-N 3.4Å
911	T	25.6	Very low	25.9	Very low	121 Å²	121	137.1 Å²	137.1	74%	0.742	77%	0.769	S	S	*	*			trans	-66.7	88.4	150.9	51.4	0	0	0	0	107	E909 D913	E909-T911 PolarHBondContact O-N 3.29Å; T911-D913 PolarHBondContact O-N 3.36Å; T911-D913 VanDerWaalsContact O-N 3.17Å
912	S	26.7	Very low	26	Very low	100 Å²	100	136 Å²	136	70%	0.699	77%	0.773	S	S	*	*			trans	-72.7	105.7	170.4	59.8	0	0	0	0	108.2	W910 G914	W910-S912 PolarHBondContact O-N 3.4Å; S912-G914 PolarHBondContact O-N 3.46Å
913	D	27	Very low	26.2	Very low	154 Å²	154	134 Å²	134	82%	0.824	76%	0.764	S	S	*	*			trans	-49.3	120.4	162.1	-79.5	-39.5	0	0	0	109	T911 S915	T911-D913 PolarHBondContact O-N 3.36Å; T911-D913 VanDerWaalsContact O-N 3.17Å; D913-S915 PolarHBondContact O-N 3.25Å
914	G	26.5	Very low	26.3	Very low	78 Å²	78	130.3 Å²	130.3	80%	0.804	75%	0.749	S	S	*	*			trans	-69.4	95.7	175.2	0	0	0	0	0	109.6	S912	S912-G914 PolarHBondContact O-N 3.46Å
915	S	27.6	Very low	26.6	Very low	97 Å²	97	135.6 Å²	135.6	68%	0.678	75%	0.754	S	S	*	*			trans	-89.8	122.8	161	60.7	0	0	0	0	109.3	D913 I917	D913-S915 PolarHBondContact O-N 3.25Å; S915-I917 PolarHBondContact O-N 2.8Å
916	D	26.1	Very low	27.3	Very low	156 Å²	156	131.3 Å²	131.3	83%	0.834	74%	0.739	S	S	*	*			trans	-45.8	116.7	177.3	-60.4	-54.4	0	0	0	113
917	I	30	Very low	28.3	Very low	154 Å²	154	129 Å²	129	79%	0.79	73%	0.731	S	S	*	*			trans	-120.4	92.2	159.8	-59.9	178.6	0	0	0	107.1	S915 G919	S915-I917 PolarHBondContact O-N 2.8Å; I917-G919 PolarHBondContact O-N 2.93Å
918	D	26.7	Very low	29.3	Very low	165 Å²	165	130.2 Å²	130.2	88%	0.882	72%	0.724	S	S	*	*			trans	-61.3	106.7	163.1	-78.2	-40.7	0	0	0	109.3
919	G	30.4	Very low	30.5	Very low	55 Å²	55	129.3 Å²	129.3	57%	0.567	72%	0.719	S	S	*	*			trans	-160.9	77.6	-176.9	0	0	0	0	0	113.1	I917 N921	I917-G919 PolarHBondContact O-N 2.93Å; G919-N921 PolarHBondContact O-N 3.19Å
920	Q	28.3	Very low	32.2	Very low	195 Å²	195	125.9 Å²	125.9	91%	0.911	71%	0.707	S	S	*	*			trans	30.7	81.5	147.5	-60.5	-179.4	-0.1	0	0	117.2
921	N	27.4	Very low	33.8	Very low	141 Å²	141	118 Å²	118	75%	0.754	68%	0.68	S	S	*	*			trans	-148.8	77	158	-100.1	-22.9	0	0	0	109.9	G919 S923	G919-N921 PolarHBondContact O-N 3.19Å; N921-S923 VanDerWaalsContact C-N 3.27Å; N921-S923 PolarHBondContact O-N 3.18Å
922	S	29.3	Very low	35.7	Very low	128 Å²	128	118 Å²	118	90%	0.895	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	13.1	-177	49.3	0	0	0	0	114.9
923	S	29.4	Very low	37.6	Very low	92 Å²	92	118.1 Å²	118.1	64%	0.643	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.8	0.6	-179.8	63.6	0	0	0	0	116.2	N921	N921-S923 VanDerWaalsContact C-N 3.27Å; N921-S923 PolarHBondContact O-N 3.18Å
924	C	27.1	Very low	39.4	Very low	68 Å²	68	116.5 Å²	116.5	46%	0.459	65%	0.654	S	S	.	*	S	Bend	trans	-121.2	4.9	-177.3	-78.8	0	0	0	0	115.5	F928	C924-F928 WeakPolarHBondContact O-CD2 3.37Å
925	R	30.7	Very low	41.3	Very low	206 Å²	206	116 Å²	116	78%	0.777	63%	0.629	S	S	*	*	H	α-helix	trans	-77.7	-24.2	-173.7	-147.2	172.5	-173.3	171.8	2.7	113.9
926	C	36	Very low	43.5	Very low	83 Å²	83	117.2 Å²	117.2	56%	0.561	63%	0.627	S	S	*	*	H	α-helix	trans	-71.8	-38.1	175.6	36.9	0	0	0	0	112.7	N930	C926-N930 PolarHBondContact O-N 2.83Å
927	D	44.5	Very low	45.9	Very low	98 Å²	98	115 Å²	115	52%	0.524	61%	0.612	S	S	.	*	H	α-helix	trans	-70.3	-37.4	179.6	-74.5	-15.9	0	0	0	112.2	N930 I931	D927-N930 PolarHBondContact O-N 3.42Å; D927-I931 WeakPolarHBondContact O-CB 3.21Å; D927-I931 WeakPolarHBondContact O-CD1 3.44Å; D927-I931 WeakPolarHBondContact O-CG1 3.23Å; D927-I931 PolarHBondContact O-N 2.94Å
928	F	45.2	Very low	47.9	Very low	132 Å²	132	108.2 Å²	108.2	58%	0.579	58%	0.578	S	S	*	*	H	α-helix	trans	-64.4	-41.5	178	-89.7	-80.3	0	0	0	113.2	C924 I931 Q932	C924-F928 WeakPolarHBondContact O-CD2 3.37Å; F928-I931 PolarHBondContact O-N 3.35Å; F928-Q932 PolarHBondContact O-N 2.9Å
929	N	50.9	Low	50.3	Low	95 Å²	95	104 Å²	104	51%	0.508	56%	0.555	S	S	.	*	H	α-helix	trans	-66.9	-43.4	177.5	-78	0.6	0	0	0	111.4	I931 Q932 V933	N929-I931 VanDerWaalsContact C-N 3.28Å; N929-I931 PolarHBondContact O-N 3.35Å; N929-Q932 PolarHBondContact O-N 2.97Å; N929-V933 VanDerWaalsContact O-CG2 3.31Å; N929-V933 WeakPolarHBondContact O-CG2 2.96Å; N929-V933 PolarHBondContact O-N 3.29Å
930	N	56.4	Low	52.8	Low	110 Å²	110	104.4 Å²	104.4	59%	0.588	55%	0.547	S	S	*	.	H	α-helix	trans	-61.5	-38.6	175.7	-79.2	-16	0	0	0	111.8	C926 D927 F934	C926-N930 PolarHBondContact O-N 2.83Å; D927-N930 PolarHBondContact O-N 3.42Å; N930-F934 VanDerWaalsContact O-CB 3.26Å; N930-F934 WeakPolarHBondContact O-CB 3.17Å; N930-F934 PolarHBondContact O-N 3.44Å
931	I	58.3	Low	55.3	Low	49 Å²	49	96.3 Å²	96.3	25%	0.251	51%	0.509	S	S	.	.	H	α-helix	trans	-64	-46.3	175.7	-73.2	164.6	0	0	0	111.1	D927 F928 N929 F934 K935	D927-I931 WeakPolarHBondContact O-CB 3.21Å; D927-I931 WeakPolarHBondContact O-CD1 3.44Å; D927-I931 WeakPolarHBondContact O-CG1 3.23Å; D927-I931 PolarHBondContact O-N 2.94Å; F928-I931 PolarHBondContact O-N 3.35Å; N929-I931 VanDerWaalsContact C-N 3.28Å; N929-I931 PolarHBondContact O-N 3.35Å; I931-F934 PolarHBondContact O-N 3.49Å; I931-K935 HydrophobicContact CG2-CD 4.31Å; I931-K935 WeakPolarHBondContact O-CG 3.47Å; I931-K935 PolarHBondContact O-N 3.1Å
932	Q	65.1	Low	58	Low	122 Å²	122	90.5 Å²	90.5	57%	0.57	48%	0.477	S	S	*	.	H	α-helix	trans	-65.3	-41	178.6	-75.9	-176.7	-1	0	0	112.6	F928 N929 K935 L936	F928-Q932 PolarHBondContact O-N 2.9Å; N929-Q932 PolarHBondContact O-N 2.97Å; Q932-K935 WeakPolarHBondContact O-CB 3.42Å; Q932-K935 PolarHBondContact O-N 3.27Å; Q932-L936 PolarHBondContact O-N 2.88Å
933	V	67.3	Low	60.5	Low	102 Å²	102	86.2 Å²	86.2	62%	0.618	45%	0.449	S	S	*	.	H	α-helix	trans	-64.2	-43.5	176.5	173.5	0	0	0	0	110.8	N929 K935 L936 H937	N929-V933 VanDerWaalsContact O-CG2 3.31Å; N929-V933 WeakPolarHBondContact O-CG2 2.96Å; N929-V933 PolarHBondContact O-N 3.29Å; V933-K935 PolarHBondContact O-N 2.83Å; V933-L936 PolarHBondContact O-N 3.14Å; V933-H937 WeakPolarHBondContact O-CB 3.25Å; V933-H937 PolarHBondContact O-N 3.39Å
934	F	64.4	Low	63.1	Low	121 Å²	121	84.6 Å²	84.6	53%	0.531	43%	0.433	S	S	.	.	H	α-helix	trans	-62.8	-41.2	176.5	-170.6	-95.9	0	0	0	111.9	N930 I931 H937 T938	N930-F934 VanDerWaalsContact O-CB 3.26Å; N930-F934 WeakPolarHBondContact O-CB 3.17Å; N930-F934 PolarHBondContact O-N 3.44Å; I931-F934 PolarHBondContact O-N 3.49Å; F934-H937 WeakPolarHBondContact O-CB 3.41Å; F934-H937 PolarHBondContact O-N 2.93Å; F934-T938 HydrophobicContact CD1-CG2 4.06Å; F934-T938 HydrophobicContact CE1-CG2 3.69Å; F934-T938 HydrophobicContact CZ-CG2 4.08Å; F934-T938 WeakPolarHBondContact O-CG2 3.31Å; F934-T938 PolarHBondContact O-N 2.9Å; F934-T938 PolarHBondContact O-OG1 3.44Å
935	K	66.5	Low	65.9	Low	66 Å²	66	81.4 Å²	81.4	29%	0.287	41%	0.412	S	S	.	.	H	α-helix	trans	-59.5	-51.4	174.1	-72.2	173.6	-169.7	-170.6	0	112.4	I332 I931 Q932 V933 H937 T938 D939	I332-K935 HydrophobicContact CD1-CD 3.5Å; I332-K935 VanDerWaalsContact CD1-CD 3.5Å; I332-K935 HydrophobicContact CD1-CG 3.78Å; I332-K935 HydrophobicContact CG1-CD 4.21Å; I332-K935 HydrophobicContact CG1-CG 4.2Å; I931-K935 HydrophobicContact CG2-CD 4.31Å; I931-K935 WeakPolarHBondContact O-CG 3.47Å; I931-K935 PolarHBondContact O-N 3.1Å; Q932-K935 WeakPolarHBondContact O-CB 3.42Å; Q932-K935 PolarHBondContact O-N 3.27Å; V933-K935 PolarHBondContact O-N 2.83Å; K935-H937 PolarHBondContact O-N 3.4Å; K935-T938 WeakPolarHBondContact CA-OG1 3.38Å; K935-T938 PolarHBondContact O-N 3.03Å; K935-T938 VanDerWaalsContact O-N 3.13Å; K935-T938 PolarHBondContact O-OG1 3.39Å; K935-D939 WeakPolarHBondContact O-CB 3.49Å; K935-D939 VanDerWaalsContact O-CG 3.32Å; K935-D939 PolarHBondContact O-N 3.17Å
936	L	73.6	Confident	68.6	Low	123 Å²	123	72.4 Å²	72.4	64%	0.644	38%	0.379	S	S	*	.	H	α-helix	trans	-58.6	-39.5	-179.5	-175.2	66.9	0	0	0	110.3	Q932 V933 T940	Q932-L936 PolarHBondContact O-N 2.88Å; V933-L936 PolarHBondContact O-N 3.14Å; L936-T940 VanDerWaalsContact O-CB 3.29Å; L936-T940 WeakPolarHBondContact O-CB 3.27Å; L936-T940 PolarHBondContact O-N 2.93Å; L936-T940 PolarHBondContact O-OG1 3.34Å
937	H	76.2	Confident	71	Confident	109 Å²	109	74.4 Å²	74.4	51%	0.505	37%	0.374	S	S	.	.	H	α-helix	trans	-64.1	-48.5	175	-174.6	64.2	0	0	0	112.6	V933 F934 K935 D939 T940 I941	V933-H937 WeakPolarHBondContact O-CB 3.25Å; V933-H937 PolarHBondContact O-N 3.39Å; F934-H937 WeakPolarHBondContact O-CB 3.41Å; F934-H937 PolarHBondContact O-N 2.93Å; K935-H937 PolarHBondContact O-N 3.4Å; H937-D939 PolarHBondContact O-N 3.25Å; H937-T940 PolarHBondContact O-N 2.93Å; H937-I941 WeakPolarHBondContact NE2-CD1 3.44Å; H937-I941 WeakPolarHBondContact O-CG1 3.21Å; H937-I941 PolarHBondContact O-N 3.42Å; H937-I941 VanDerWaalsContact O-N 3.1Å
938	T	72.4	Confident	73.1	Confident	12 Å²	12	72.4 Å²	72.4	7%	0.074	36%	0.36	C	S	.	.	H	α-helix	trans	-63.3	-42.5	178.8	52	0	0	0	0	112.4	C326 F934 K935 I941 R942	C326-T938 HydrophobicContact CB-CG2 4.39Å; F934-T938 HydrophobicContact CD1-CG2 4.06Å; F934-T938 HydrophobicContact CE1-CG2 3.69Å; F934-T938 HydrophobicContact CZ-CG2 4.08Å; F934-T938 WeakPolarHBondContact O-CG2 3.31Å; F934-T938 PolarHBondContact O-N 2.9Å; F934-T938 PolarHBondContact O-OG1 3.44Å; K935-T938 WeakPolarHBondContact CA-OG1 3.38Å; K935-T938 PolarHBondContact O-N 3.03Å; K935-T938 VanDerWaalsContact O-N 3.13Å; K935-T938 PolarHBondContact O-OG1 3.39Å; T938-I941 PolarHBondContact O-N 2.96Å; T938-R942 WeakPolarHBondContact O-CG 2.98Å; T938-R942 PolarHBondContact O-N 3.4Å
939	D	76.9	Confident	75.2	Confident	76 Å²	76	66.8 Å²	66.8	41%	0.406	33%	0.334	S	S	.	.	H	α-helix	trans	-70	-35.4	-178.8	-66.3	-21.7	0	0	0	111.4	K935 H937 R942 A943	K935-D939 WeakPolarHBondContact O-CB 3.49Å; K935-D939 VanDerWaalsContact O-CG 3.32Å; K935-D939 PolarHBondContact O-N 3.17Å; H937-D939 PolarHBondContact O-N 3.25Å; D939-R942 PolarHBondContact O-N 2.74Å; D939-R942 IonicContact OD1-CZ 3.51Å; D939-R942 IonicContact OD1-NH1 2.65Å; D939-R942 PolarHBondContact OD1-NH1 3.21Å; D939-A943 WeakPolarHBondContact O-CB 3.25Å; D939-A943 PolarHBondContact O-N 3.39Å
940	T	82.6	Confident	76.9	Confident	64 Å²	64	63.4 Å²	63.4	39%	0.393	32%	0.316	S	S	.	.	H	α-helix	trans	-62.4	-44.7	173.3	-57.6	0	0	0	0	111.1	L936 H937 A943 D944	L936-T940 VanDerWaalsContact O-CB 3.29Å; L936-T940 WeakPolarHBondContact O-CB 3.27Å; L936-T940 PolarHBondContact O-N 2.93Å; L936-T940 PolarHBondContact O-OG1 3.34Å; H937-T940 PolarHBondContact O-N 2.93Å; T940-A943 PolarHBondContact O-N 2.79Å; T940-D944 PolarHBondContact O-N 3.34Å
941	I	81.3	Confident	78.4	Confident	25 Å²	25	64.7 Å²	64.7	13%	0.128	32%	0.317	C	S	.	.	H	α-helix	trans	-63.9	-43.6	177.7	-70.7	170.5	0	0	0	111.2	E323 C326 H937 T938 A943 D944 V945	E323-I941 HydrophobicContact CB-CG2 4.26Å; E323-I941 HydrophobicContact CG-CG2 4.04Å; C326-I941 HydrophobicContact CB-CB 4.23Å; C326-I941 HydrophobicContact CB-CD1 4.33Å; C326-I941 HydrophobicContact CB-CG2 3.84Å; H937-I941 WeakPolarHBondContact NE2-CD1 3.44Å; H937-I941 WeakPolarHBondContact O-CG1 3.21Å; H937-I941 PolarHBondContact O-N 3.42Å; H937-I941 VanDerWaalsContact O-N 3.1Å; T938-I941 PolarHBondContact O-N 2.96Å; I941-A943 VanDerWaalsContact C-N 3.34Å; I941-A943 PolarHBondContact O-N 3.23Å; I941-D944 WeakPolarHBondContact O-CB 3.49Å; I941-D944 PolarHBondContact O-N 2.98Å; I941-V945 WeakPolarHBondContact O-CG2 3.49Å; I941-V945 PolarHBondContact O-N 3.33Å
942	R	82.9	Confident	79.9	Confident	20 Å²	20	65.7 Å²	65.7	8%	0.075	32%	0.319	C	S	.	.	H	α-helix	trans	-61.1	-43.6	175.9	-70.2	170.9	-168.9	157.4	-14	111.5	D274 C326 G329 T938 D939 D944 V945 M946	D274-R942 IonicContact OD1-CZ 2.64Å; D274-R942 IonicContact OD1-NE 3.87Å; D274-R942 IonicContact OD1-NH1 3.42Å; D274-R942 PolarHBondContact OD1-NH1 3.26Å; D274-R942 IonicContact OD1-NH2 3.5Å; C326-R942 PolarHBondContact O-NE 2.75Å; C326-R942 PolarHBondContact O-NH2 3.1Å; G329-R942 PolarHBondContact O-NH2 3.47Å; T938-R942 WeakPolarHBondContact O-CG 2.98Å; T938-R942 PolarHBondContact O-N 3.4Å; D939-R942 PolarHBondContact O-N 2.74Å; D939-R942 IonicContact OD1-CZ 3.51Å; D939-R942 IonicContact OD1-NH1 2.65Å; D939-R942 PolarHBondContact OD1-NH1 3.21Å; R942-D944 VanDerWaalsContact C-N 3.31Å; R942-D944 PolarHBondContact O-N 3.43Å; R942-V945 PolarHBondContact O-N 2.88Å; R942-M946 PolarHBondContact O-N 3.35Å
943	A	82.1	Confident	80.9	Confident	37 Å²	37	60.8 Å²	60.8	31%	0.306	30%	0.297	S	S	.	.	H	α-helix	trans	-62.6	-37.1	175.9	0	0	0	0	0	112.1	D939 T940 I941 M946 R947	D939-A943 WeakPolarHBondContact O-CB 3.25Å; D939-A943 PolarHBondContact O-N 3.39Å; T940-A943 PolarHBondContact O-N 2.79Å; I941-A943 VanDerWaalsContact C-N 3.34Å; I941-A943 PolarHBondContact O-N 3.23Å; A943-M946 PolarHBondContact O-N 3.43Å; A943-R947 WeakPolarHBondContact O-CB 3.43Å; A943-R947 WeakPolarHBondContact O-CG 3.35Å; A943-R947 PolarHBondContact O-N 2.97Å
944	D	85.2	Confident	81.8	Confident	59 Å²	59	59.2 Å²	59.2	32%	0.316	28%	0.283	S	S	.	.	H	α-helix	trans	-63.8	-42.1	173.9	-79.2	-25.3	0	0	0	112.5	T940 I941 R942 R947 R948	T940-D944 PolarHBondContact O-N 3.34Å; I941-D944 WeakPolarHBondContact O-CB 3.49Å; I941-D944 PolarHBondContact O-N 2.98Å; R942-D944 VanDerWaalsContact C-N 3.31Å; R942-D944 PolarHBondContact O-N 3.43Å; D944-R947 PolarHBondContact O-N 3.4Å; D944-R947 IonicContact OD1-CZ 3.71Å; D944-R947 IonicContact OD1-NE 2.72Å; D944-R947 PolarHBondContact OD1-NE 3.14Å; D944-R947 IonicContact OD1-NH2 2.76Å; D944-R947 PolarHBondContact OD1-NH2 3.42Å; D944-R948 VanDerWaalsContact O-CG 3.3Å; D944-R948 WeakPolarHBondContact O-CG 3.23Å; D944-R948 PolarHBondContact O-N 2.81Å
945	V	86.1	Confident	82.9	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.006	28%	0.284	C	S	.	.	H	α-helix	trans	-62.9	-43.2	174.6	175.6	0	0	0	0	110.7	L317 I941 R942 R948 Y949	L317-V945 HydrophobicContact CB-CG1 4.23Å; I941-V945 WeakPolarHBondContact O-CG2 3.49Å; I941-V945 PolarHBondContact O-N 3.33Å; R942-V945 PolarHBondContact O-N 2.88Å; V945-R948 WeakPolarHBondContact O-CB 3.3Å; V945-R948 PolarHBondContact O-N 3.12Å; V945-Y949 PolarHBondContact O-N 3.37Å
946	M	86.7	Confident	83.8	Confident	17 Å²	17	60.2 Å²	60.2	8%	0.084	29%	0.288	C	S	.	.	H	α-helix	trans	-63.9	-41.4	176.6	-73.3	-58.1	145.7	0	0	113.3	A269 P275 F310 R942 A943 R948 Y949 L950	A269-M946 HydrophobicContact CB-SD 3.94Å; P275-M946 HydrophobicContact CB-CE 3.18Å; P275-M946 HydrophobicContact CG-CE 3.18Å; F310-M946 HydrophobicContact CZ-CE 4.16Å; F310-M946 HydrophobicContact CZ-SD 4.21Å; R942-M946 PolarHBondContact O-N 3.35Å; A943-M946 PolarHBondContact O-N 3.43Å; M946-R948 VanDerWaalsContact C-N 3.32Å; M946-R948 PolarHBondContact O-N 3.15Å; M946-Y949 WeakPolarHBondContact O-CB 3.35Å; M946-Y949 PolarHBondContact O-N 3.27Å; M946-Y949 VanDerWaalsContact O-N 3.1Å; M946-L950 WeakPolarHBondContact O-CG 3.43Å; M946-L950 PolarHBondContact O-N 3.11Å
947	R	86.8	Confident	84.3	Confident	124 Å²	124	56.3 Å²	56.3	47%	0.468	27%	0.266	S	S	.	.	H	α-helix	trans	-57.7	-47.1	173.2	-79.6	-171.9	-80.5	-105	5.6	110.9	A943 D944 Y949 L950 F951	A943-R947 WeakPolarHBondContact O-CB 3.43Å; A943-R947 WeakPolarHBondContact O-CG 3.35Å; A943-R947 PolarHBondContact O-N 2.97Å; D944-R947 PolarHBondContact O-N 3.4Å; D944-R947 IonicContact OD1-CZ 3.71Å; D944-R947 IonicContact OD1-NE 2.72Å; D944-R947 PolarHBondContact OD1-NE 3.14Å; D944-R947 IonicContact OD1-NH2 2.76Å; D944-R947 PolarHBondContact OD1-NH2 3.42Å; R947-Y949 PolarHBondContact O-N 3.1Å; R947-L950 PolarHBondContact O-N 3.23Å; R947-F951 HydrophobicContact CB-CE2 4.39Å; R947-F951 WeakPolarHBondContact O-CD2 3.35Å; R947-F951 PolarHBondContact O-N 3.14Å
948	R	88.4	Confident	84.7	Confident	57 Å²	57	55.3 Å²	55.3	22%	0.215	26%	0.262	C	S	.	.	H	α-helix	trans	-59.5	-36.4	176.3	-65.7	170.4	-165.9	175.5	9.2	111.9	L317 E323 D944 V945 M946 K952	L317-R948 HydrophobicContact CD1-CB 4.44Å; L317-R948 HydrophobicContact CD2-CB 4.16Å; L317-R948 PolarHBondContact O-NH1 2.87Å; E323-R948 IonicContact OE1-CZ 2.65Å; E323-R948 IonicContact OE1-NH1 2.8Å; E323-R948 PolarHBondContact OE1-NH1 3.28Å; E323-R948 IonicContact OE1-NH2 3.74Å; E323-R948 PolarHBondContact OE1-NH2 3.35Å; E323-R948 IonicContact OE2-CZ 3.28Å; E323-R948 IonicContact OE2-NH1 2.76Å; E323-R948 PolarHBondContact OE2-NH1 3.13Å; E323-R948 IonicContact OE2-NH2 3.88Å; D944-R948 VanDerWaalsContact O-CG 3.3Å; D944-R948 WeakPolarHBondContact O-CG 3.23Å; D944-R948 PolarHBondContact O-N 2.81Å; V945-R948 WeakPolarHBondContact O-CB 3.3Å; V945-R948 PolarHBondContact O-N 3.12Å; M946-R948 VanDerWaalsContact C-N 3.32Å; M946-R948 PolarHBondContact O-N 3.15Å; R948-K952 PolarHBondContact O-N 3.16Å
949	Y	88.4	Confident	85.3	Confident	13 Å²	13	59.6 Å²	59.6	5%	0.051	28%	0.281	C	S	.	.	H	α-helix	trans	-67	-47	176.7	-176.2	-101.8	0	0	0	112.4	S265 A269 F310 L317 V945 M946 R947 F951 K952 L953	S265-Y949 WeakPolarHBondContact CB-OH 3.32Å; S265-Y949 PolarHBondContact OG-OH 3.24Å; A269-Y949 HydrophobicContact CB-CD1 3.84Å; A269-Y949 HydrophobicContact CB-CE1 4.21Å; F310-Y949 HydrophobicContact CD2-CD1 4.32Å; F310-Y949 AromaticContact CD2-CE1 3.64Å; F310-Y949 HydrophobicContact CD2-CE1 3.64Å; F310-Y949 HydrophobicContact CD2-CE2 4.18Å; F310-Y949 AromaticContact CD2-CZ 3.59Å; F310-Y949 AromaticContact CE2-CD1 3.86Å; F310-Y949 HydrophobicContact CE2-CD1 3.86Å; F310-Y949 AromaticContact CE2-CE1 3.57Å; F310-Y949 HydrophobicContact CE2-CE1 3.57Å; F310-Y949 HydrophobicContact CE2-CG 4.45Å; F310-Y949 AromaticContact CE2-CZ 3.99Å; L317-Y949 VanDerWaalsContact CD1-CA 3.42Å; L317-Y949 VanDerWaalsContact CD1-CB 3.49Å; L317-Y949 HydrophobicContact CD1-CD2 3.74Å; L317-Y949 HydrophobicContact CD1-CG 4.12Å; V945-Y949 PolarHBondContact O-N 3.37Å; M946-Y949 WeakPolarHBondContact O-CB 3.35Å; M946-Y949 PolarHBondContact O-N 3.27Å; M946-Y949 VanDerWaalsContact O-N 3.1Å; R947-Y949 PolarHBondContact O-N 3.1Å; Y949-F951 VanDerWaalsContact C-N 3.32Å; Y949-F951 PolarHBondContact O-N 2.97Å; Y949-K952 WeakPolarHBondContact O-CA 3.5Å; Y949-K952 WeakPolarHBondContact O-CB 3.19Å; Y949-K952 PolarHBondContact O-N 3.17Å; Y949-L953 HydrophobicContact CD1-CD1 4.06Å; Y949-L953 HydrophobicContact CD1-CG 4.37Å; Y949-L953 HydrophobicContact CE1-CD1 3.44Å; Y949-L953 VanDerWaalsContact CE1-CD1 3.44Å; Y949-L953 HydrophobicContact CE1-CD2 4.41Å; Y949-L953 HydrophobicContact CE1-CG 3.85Å; Y949-L953 PolarHBondContact O-N 2.92Å
950	L	87.4	Confident	85.5	Confident	24 Å²	24	62 Å²	62	13%	0.126	29%	0.29	C	S	.	.	H	α-helix	trans	-61.1	-40.9	176.3	-68.2	169.2	0	0	0	111.7	H214 A269 L270 M946 R947 K952 L953 Q954	H214-L950 HydrophobicContact CB-CD2 4.07Å; A269-L950 HydrophobicContact CB-CD2 4.01Å; A269-L950 HydrophobicContact CB-CG 4.37Å; L270-L950 HydrophobicContact CD2-CD1 3.63Å; L270-L950 HydrophobicContact CD2-CD2 4.07Å; L270-L950 HydrophobicContact CG-CD2 4.29Å; M946-L950 WeakPolarHBondContact O-CG 3.43Å; M946-L950 PolarHBondContact O-N 3.11Å; R947-L950 PolarHBondContact O-N 3.23Å; L950-K952 VanDerWaalsContact C-N 3.3Å; L950-K952 PolarHBondContact O-N 3.37Å; L950-L953 PolarHBondContact O-N 3.33Å; L950-Q954 PolarHBondContact O-N 3.43Å
951	F	88.6	Confident	85.5	Confident	138 Å²	138	63.8 Å²	63.8	61%	0.605	30%	0.296	S	S	*	.	H	α-helix	trans	-61.5	-36.2	172.6	-76.6	-60.8	0	0	0	112.8	R947 Y949 K955	R947-F951 HydrophobicContact CB-CE2 4.39Å; R947-F951 WeakPolarHBondContact O-CD2 3.35Å; R947-F951 PolarHBondContact O-N 3.14Å; Y949-F951 VanDerWaalsContact C-N 3.32Å; Y949-F951 PolarHBondContact O-N 2.97Å; F951-K955 WeakPolarHBondContact O-CB 3.48Å; F951-K955 PolarHBondContact O-N 3.24Å
952	K	88.6	Confident	85.6	Confident	69 Å²	69	67.6 Å²	67.6	30%	0.3	31%	0.312	S	S	.	.	H	α-helix	trans	-65	-45.2	174.3	-177	-175.3	176.8	-175.1	0	111.2	R948 Y949 L950 Q954 K955 Q956	R948-K952 PolarHBondContact O-N 3.16Å; Y949-K952 WeakPolarHBondContact O-CA 3.5Å; Y949-K952 WeakPolarHBondContact O-CB 3.19Å; Y949-K952 PolarHBondContact O-N 3.17Å; L950-K952 VanDerWaalsContact C-N 3.3Å; L950-K952 PolarHBondContact O-N 3.37Å; K952-Q954 VanDerWaalsContact C-N 3.35Å; K952-Q954 PolarHBondContact O-N 2.9Å; K952-K955 PolarHBondContact O-N 2.89Å; K952-Q956 WeakPolarHBondContact O-CG 3.35Å; K952-Q956 PolarHBondContact O-N 2.75Å
953	L	85.8	Confident	85.5	Confident	19 Å²	19	70 Å²	70	10%	0.099	33%	0.332	C	S	.	.	H	α-helix	trans	-61.3	-42.6	176.2	-74.4	-179.7	0	0	0	112	A266 Y949 L950 K955 Q956 K957	A266-L953 HydrophobicContact CB-CD1 4.08Å; Y949-L953 HydrophobicContact CD1-CD1 4.06Å; Y949-L953 HydrophobicContact CD1-CG 4.37Å; Y949-L953 HydrophobicContact CE1-CD1 3.44Å; Y949-L953 VanDerWaalsContact CE1-CD1 3.44Å; Y949-L953 HydrophobicContact CE1-CD2 4.41Å; Y949-L953 HydrophobicContact CE1-CG 3.85Å; Y949-L953 PolarHBondContact O-N 2.92Å; L950-L953 PolarHBondContact O-N 3.33Å; L953-K955 VanDerWaalsContact C-N 3.32Å; L953-K955 PolarHBondContact O-N 2.93Å; L953-Q956 PolarHBondContact O-N 3.5Å; L953-K957 PolarHBondContact O-N 2.99Å
954	Q	87.2	Confident	85.4	Confident	69 Å²	69	70.5 Å²	70.5	32%	0.322	34%	0.336	S	S	.	.	H	α-helix	trans	-60.7	-43.7	176	-172.4	177.5	-5.9	0	0	111.4	L950 K952 Q956 K957 E958	L950-Q954 PolarHBondContact O-N 3.43Å; K952-Q954 VanDerWaalsContact C-N 3.35Å; K952-Q954 PolarHBondContact O-N 2.9Å; Q954-Q956 PolarHBondContact O-N 2.82Å; Q954-K957 WeakPolarHBondContact O-CB 3.5Å; Q954-K957 PolarHBondContact O-N 3.32Å; Q954-E958 WeakPolarHBondContact O-CG 3.27Å; Q954-E958 PolarHBondContact O-N 3.31Å
955	K	88	Confident	85.4	Confident	127 Å²	127	73 Å²	73	55%	0.552	35%	0.346	S	S	*	.	H	α-helix	trans	-63.4	-40.2	177	-169.6	-177	178.7	-161.5	0	112.4	F951 K952 L953 E958 E959	F951-K955 WeakPolarHBondContact O-CB 3.48Å; F951-K955 PolarHBondContact O-N 3.24Å; K952-K955 PolarHBondContact O-N 2.89Å; L953-K955 VanDerWaalsContact C-N 3.32Å; L953-K955 PolarHBondContact O-N 2.93Å; K955-E958 PolarHBondContact O-N 2.74Å; K955-E959 WeakPolarHBondContact CE-OE1 3.44Å; K955-E959 IonicContact NZ-OE1 3.7Å; K955-E959 WeakPolarHBondContact O-CG 3.47Å; K955-E959 PolarHBondContact O-N 2.69Å
956	Q	85.5	Confident	85.1	Confident	82 Å²	82	79.6 Å²	79.6	38%	0.383	38%	0.375	S	S	.	.	H	α-helix	trans	-61.9	-44.4	175.4	-74.2	176.5	-31.7	0	0	111.3	K952 L953 Q954 E958 E959 E960	K952-Q956 WeakPolarHBondContact O-CG 3.35Å; K952-Q956 PolarHBondContact O-N 2.75Å; L953-Q956 PolarHBondContact O-N 3.5Å; Q954-Q956 PolarHBondContact O-N 2.82Å; Q956-E958 VanDerWaalsContact C-N 3.33Å; Q956-E958 PolarHBondContact O-N 3.19Å; Q956-E959 PolarHBondContact O-N 2.93Å; Q956-E959 VanDerWaalsContact O-N 3.17Å; Q956-E960 WeakPolarHBondContact O-CG 3.34Å; Q956-E960 PolarHBondContact O-N 2.95Å
957	K	83.8	Confident	84.9	Confident	40 Å²	40	81.4 Å²	81.4	17%	0.174	39%	0.389	C	S	.	.	H	α-helix	trans	-59.9	-41.7	174.8	-175.4	-178.5	174.7	-170.9	0	112.2	N159 N213 E215 L953 Q954 E960 L961	N159-K957 PolarHBondContact ND2-NZ 3.38Å; N213-K957 PolarHBondContact ND2-NZ 3.29Å; N213-K957 PolarHBondContact OD1-NZ 2.64Å; E215-K957 IonicContact OE1-NZ 3.83Å; E215-K957 PolarHBondContact OE1-NZ 2.85Å; E215-K957 IonicContact OE2-NZ 2.67Å; L953-K957 PolarHBondContact O-N 2.99Å; Q954-K957 WeakPolarHBondContact O-CB 3.5Å; Q954-K957 PolarHBondContact O-N 3.32Å; K957-E960 PolarHBondContact O-N 2.6Å; K957-L961 WeakPolarHBondContact O-CB 3.39Å; K957-L961 PolarHBondContact O-N 3.22Å
958	E	84.3	Confident	84.8	Confident	89 Å²	89	80 Å²	80	42%	0.416	39%	0.394	S	S	.	.	H	α-helix	trans	-66.2	-36.2	175.6	-72.7	178.6	-164.4	0	0	112.9	Q954 K955 Q956 K962	Q954-E958 WeakPolarHBondContact O-CG 3.27Å; Q954-E958 PolarHBondContact O-N 3.31Å; K955-E958 PolarHBondContact O-N 2.74Å; Q956-E958 VanDerWaalsContact C-N 3.33Å; Q956-E958 PolarHBondContact O-N 3.19Å; E958-K962 WeakPolarHBondContact O-CB 3.38Å; E958-K962 WeakPolarHBondContact O-CD 3.33Å; E958-K962 VanDerWaalsContact O-CG 3.22Å; E958-K962 WeakPolarHBondContact O-CG 3.35Å; E958-K962 PolarHBondContact O-N 3.16Å
959	E	84.8	Confident	84.5	Confident	101 Å²	101	82.5 Å²	82.5	47%	0.472	41%	0.409	S	S	.	.	H	α-helix	trans	-69.3	-41.5	175.6	-74.2	173.3	-175.3	0	0	111.5	K955 Q956 K962 S963	K955-E959 WeakPolarHBondContact CE-OE1 3.44Å; K955-E959 IonicContact NZ-OE1 3.7Å; K955-E959 WeakPolarHBondContact O-CG 3.47Å; K955-E959 PolarHBondContact O-N 2.69Å; Q956-E959 PolarHBondContact O-N 2.93Å; Q956-E959 VanDerWaalsContact O-N 3.17Å; E959-K962 PolarHBondContact O-N 3.06Å; E959-S963 VanDerWaalsContact O-CB 3.3Å; E959-S963 WeakPolarHBondContact O-CB 3.17Å; E959-S963 PolarHBondContact O-N 3.21Å
960	E	81.8	Confident	84.4	Confident	128 Å²	128	85.8 Å²	85.8	60%	0.598	43%	0.428	S	S	*	.	H	α-helix	trans	-61	-46.6	173.6	-74.7	175.7	-177.6	0	0	111.1	Q956 K957 K962 S963 A964	Q956-E960 WeakPolarHBondContact O-CG 3.34Å; Q956-E960 PolarHBondContact O-N 2.95Å; K957-E960 PolarHBondContact O-N 2.6Å; E960-K962 PolarHBondContact O-N 3.35Å; E960-S963 PolarHBondContact O-N 3.2Å; E960-S963 PolarHBondContact O-OG 3.07Å; E960-A964 PolarHBondContact O-N 2.89Å
961	L	81.7	Confident	84.4	Confident	101 Å²	101	88.9 Å²	88.9	53%	0.529	44%	0.444	S	S	.	.	H	α-helix	trans	-62.3	-45	177.7	-169.6	138.8	0	0	0	111.8	K957 S963 A964 E965	K957-L961 WeakPolarHBondContact O-CB 3.39Å; K957-L961 PolarHBondContact O-N 3.22Å; L961-S963 VanDerWaalsContact C-N 3.35Å; L961-S963 PolarHBondContact O-N 3.37Å; L961-A964 WeakPolarHBondContact O-CB 3.48Å; L961-A964 PolarHBondContact O-N 3.23Å; L961-E965 WeakPolarHBondContact CD2-OE1 3.37Å; L961-E965 WeakPolarHBondContact O-CG 3.37Å; L961-E965 PolarHBondContact O-N 2.88Å
962	K	84.7	Confident	84.5	Confident	104 Å²	104	87 Å²	87	45%	0.452	44%	0.437	S	S	.	.	H	α-helix	trans	-62.2	-41.3	173.7	-74.3	167.4	-174.1	161.1	0	111.9	E958 E959 E960 A964 E965 F966	E958-K962 WeakPolarHBondContact O-CB 3.38Å; E958-K962 WeakPolarHBondContact O-CD 3.33Å; E958-K962 VanDerWaalsContact O-CG 3.22Å; E958-K962 WeakPolarHBondContact O-CG 3.35Å; E958-K962 PolarHBondContact O-N 3.16Å; E959-K962 PolarHBondContact O-N 3.06Å; E960-K962 PolarHBondContact O-N 3.35Å; K962-A964 VanDerWaalsContact C-N 3.3Å; K962-A964 PolarHBondContact O-N 3.21Å; K962-E965 PolarHBondContact O-N 3.43Å; K962-F966 HydrophobicContact CB-CD2 4.49Å; K962-F966 HydrophobicContact CB-CE2 4.36Å; K962-F966 WeakPolarHBondContact O-CD2 3.47Å; K962-F966 PolarHBondContact O-N 3.39Å
963	S	80.7	Confident	84.4	Confident	70 Å²	70	91.7 Å²	91.7	49%	0.49	45%	0.452	S	S	.	.	H	α-helix	trans	-64.3	-37.2	178.5	79.6	0	0	0	0	111.9	E959 E960 L961 F966 S967	E959-S963 VanDerWaalsContact O-CB 3.3Å; E959-S963 WeakPolarHBondContact O-CB 3.17Å; E959-S963 PolarHBondContact O-N 3.21Å; E960-S963 PolarHBondContact O-N 3.2Å; E960-S963 PolarHBondContact O-OG 3.07Å; L961-S963 VanDerWaalsContact C-N 3.35Å; L961-S963 PolarHBondContact O-N 3.37Å; S963-F966 PolarHBondContact O-N 3.24Å; S963-S967 WeakPolarHBondContact O-CB 3.3Å; S963-S967 PolarHBondContact O-N 3.19Å
964	A	79.4	Confident	84.3	Confident	48 Å²	48	96.5 Å²	96.5	40%	0.397	47%	0.474	S	S	.	.	H	α-helix	trans	-63.9	-47.1	173.3	0	0	0	0	0	110.6	E960 L961 K962 F966 S967 V968	E960-A964 PolarHBondContact O-N 2.89Å; L961-A964 WeakPolarHBondContact O-CB 3.48Å; L961-A964 PolarHBondContact O-N 3.23Å; K962-A964 VanDerWaalsContact C-N 3.3Å; K962-A964 PolarHBondContact O-N 3.21Å; A964-F966 PolarHBondContact O-N 3.48Å; A964-S967 WeakPolarHBondContact O-CB 3.45Å; A964-S967 PolarHBondContact O-N 3.2Å; A964-S967 VanDerWaalsContact O-N 3.13Å; A964-S967 PolarHBondContact O-OG 3.22Å; A964-V968 WeakPolarHBondContact O-CG2 3.32Å; A964-V968 PolarHBondContact O-N 3.36Å
965	E	85.7	Confident	84.5	Confident	112 Å²	112	98.5 Å²	98.5	52%	0.523	48%	0.484	S	S	.	.	H	α-helix	trans	-58.9	-44.5	175.1	-70.7	177	174.4	0	0	112.5	L961 K962 S967 V968 M969	L961-E965 WeakPolarHBondContact CD2-OE1 3.37Å; L961-E965 WeakPolarHBondContact O-CG 3.37Å; L961-E965 PolarHBondContact O-N 2.88Å; K962-E965 PolarHBondContact O-N 3.43Å; E965-S967 VanDerWaalsContact C-N 3.31Å; E965-S967 PolarHBondContact O-N 3.32Å; E965-V968 PolarHBondContact O-N 3.48Å; E965-M969 WeakPolarHBondContact O-CG 3.49Å; E965-M969 PolarHBondContact O-N 3.23Å
966	F	79.8	Confident	84.6	Confident	140 Å²	140	95.9 Å²	95.9	61%	0.614	48%	0.475	S	S	*	.	H	α-helix	trans	-63.2	-37	175.5	-77.5	-61.6	0	0	0	112.4	K962 S963 A964 M969 N970	K962-F966 HydrophobicContact CB-CD2 4.49Å; K962-F966 HydrophobicContact CB-CE2 4.36Å; K962-F966 WeakPolarHBondContact O-CD2 3.47Å; K962-F966 PolarHBondContact O-N 3.39Å; S963-F966 PolarHBondContact O-N 3.24Å; A964-F966 PolarHBondContact O-N 3.48Å; F966-M969 PolarHBondContact O-N 3.45Å; F966-N970 WeakPolarHBondContact O-CB 3.45Å; F966-N970 PolarHBondContact O-N 3.47Å; F966-N970 PolarHBondContact O-ND2 2.92Å
967	S	81.8	Confident	84.6	Confident	55 Å²	55	96.5 Å²	96.5	39%	0.385	48%	0.478	S	S	.	.	H	α-helix	trans	-64.8	-41.9	176	80	0	0	0	0	111.5	S963 A964 E965 N970 I971	S963-S967 WeakPolarHBondContact O-CB 3.3Å; S963-S967 PolarHBondContact O-N 3.19Å; A964-S967 WeakPolarHBondContact O-CB 3.45Å; A964-S967 PolarHBondContact O-N 3.2Å; A964-S967 VanDerWaalsContact O-N 3.13Å; A964-S967 PolarHBondContact O-OG 3.22Å; E965-S967 VanDerWaalsContact C-N 3.31Å; E965-S967 PolarHBondContact O-N 3.32Å; S967-N970 PolarHBondContact O-N 2.82Å; S967-I971 VanDerWaalsContact O-CG1 3.29Å; S967-I971 WeakPolarHBondContact O-CG1 3.42Å; S967-I971 PolarHBondContact O-N 3.28Å
968	V	84.1	Confident	84.8	Confident	93 Å²	93	101.7 Å²	101.7	56%	0.564	50%	0.5	S	S	*	.	H	α-helix	trans	-64.6	-44.2	176.1	174.2	0	0	0	0	110.7	A964 E965 N970 I971 H972	A964-V968 WeakPolarHBondContact O-CG2 3.32Å; A964-V968 PolarHBondContact O-N 3.36Å; E965-V968 PolarHBondContact O-N 3.48Å; V968-N970 VanDerWaalsContact C-N 3.32Å; V968-N970 PolarHBondContact O-N 3.35Å; V968-I971 PolarHBondContact O-N 3.36Å; V968-H972 WeakPolarHBondContact O-CB 3.22Å; V968-H972 PolarHBondContact O-N 3.21Å
969	M	81.8	Confident	85	Confident	111 Å²	111	103.9 Å²	103.9	55%	0.547	51%	0.512	S	S	.	.	H	α-helix	trans	-62.4	-37.5	175.6	-74.6	-63	-66.9	0	0	112.5	E965 F966 R973	E965-M969 WeakPolarHBondContact O-CG 3.49Å; E965-M969 PolarHBondContact O-N 3.23Å; F966-M969 PolarHBondContact O-N 3.45Å; M969-R973 WeakPolarHBondContact O-CB 3.43Å; M969-R973 PolarHBondContact O-N 3.16Å
970	N	86.4	Confident	85	Confident	82 Å²	82	103.6 Å²	103.6	44%	0.439	51%	0.512	S	S	.	.	H	α-helix	trans	-69.4	-40.8	175.5	-78.8	-25.1	0	0	0	112.2	F966 S967 V968 H972 R973 Q974	F966-N970 WeakPolarHBondContact O-CB 3.45Å; F966-N970 PolarHBondContact O-N 3.47Å; F966-N970 PolarHBondContact O-ND2 2.92Å; S967-N970 PolarHBondContact O-N 2.82Å; V968-N970 VanDerWaalsContact C-N 3.32Å; V968-N970 PolarHBondContact O-N 3.35Å; N970-H972 VanDerWaalsContact C-N 3.34Å; N970-R973 PolarHBondContact O-N 3.07Å; N970-Q974 WeakPolarHBondContact O-CB 3.15Å; N970-Q974 WeakPolarHBondContact O-CG 3.31Å; N970-Q974 PolarHBondContact O-N 2.89Å
971	I	88.3	Confident	85.1	Confident	89 Å²	89	101.4 Å²	101.4	46%	0.456	50%	0.504	S	S	.	.	H	α-helix	trans	-62.3	-45	174.1	-68.6	163.9	0	0	0	109.9	S967 V968 R973 Q974 Q975	S967-I971 VanDerWaalsContact O-CG1 3.29Å; S967-I971 WeakPolarHBondContact O-CG1 3.42Å; S967-I971 PolarHBondContact O-N 3.28Å; V968-I971 PolarHBondContact O-N 3.36Å; I971-R973 VanDerWaalsContact C-N 3.34Å; I971-R973 PolarHBondContact O-N 3Å; I971-Q974 PolarHBondContact O-N 3.41Å; I971-Q975 WeakPolarHBondContact O-CG 3.3Å; I971-Q975 PolarHBondContact O-N 3.15Å
972	H	90.3	Very high	85.1	Confident	99 Å²	99	102.4 Å²	102.4	46%	0.458	51%	0.506	S	S	.	.	H	α-helix	trans	-61.9	-42.7	177.1	-169.2	60.4	0	0	0	111.5	V968 N970 Q974 Q975 I976	V968-H972 WeakPolarHBondContact O-CB 3.22Å; V968-H972 PolarHBondContact O-N 3.21Å; N970-H972 VanDerWaalsContact C-N 3.34Å; H972-Q974 PolarHBondContact O-N 3.09Å; H972-Q975 PolarHBondContact O-N 2.87Å; H972-I976 WeakPolarHBondContact O-CG1 3.47Å; H972-I976 PolarHBondContact O-N 3.49Å
973	R	86.2	Confident	85.2	Confident	166 Å²	166	102.5 Å²	102.5	63%	0.626	51%	0.508	S	S	*	.	H	α-helix	trans	-61.6	-42	173.6	-170.7	-176.5	-64	-179.3	0.8	112.1	M969 N970 I971 Q975 I976 Q977	M969-R973 WeakPolarHBondContact O-CB 3.43Å; M969-R973 PolarHBondContact O-N 3.16Å; N970-R973 PolarHBondContact O-N 3.07Å; I971-R973 VanDerWaalsContact C-N 3.34Å; I971-R973 PolarHBondContact O-N 3Å; R973-Q975 VanDerWaalsContact C-N 3.34Å; R973-I976 PolarHBondContact O-N 3.12Å; R973-Q977 WeakPolarHBondContact O-CB 3.43Å; R973-Q977 PolarHBondContact O-N 2.68Å
974	Q	84.6	Confident	85.4	Confident	120 Å²	120	102.9 Å²	102.9	56%	0.561	51%	0.507	S	S	*	.	H	α-helix	trans	-65.2	-36.7	175.7	-75.4	178.9	4.1	0	0	112.3	N970 I971 H972 Q977 K978	N970-Q974 WeakPolarHBondContact O-CB 3.15Å; N970-Q974 WeakPolarHBondContact O-CG 3.31Å; N970-Q974 PolarHBondContact O-N 2.89Å; I971-Q974 PolarHBondContact O-N 3.41Å; H972-Q974 PolarHBondContact O-N 3.09Å; Q974-Q977 PolarHBondContact O-N 2.92Å; Q974-K978 WeakPolarHBondContact O-CB 3.33Å; Q974-K978 WeakPolarHBondContact O-CG 3.45Å; Q974-K978 PolarHBondContact O-N 3.05Å
975	Q	90.7	Very high	85.4	Confident	112 Å²	112	106.8 Å²	106.8	52%	0.523	52%	0.515	S	S	.	.	H	α-helix	trans	-65.5	-45.6	174.1	-75.3	177.1	-14.3	0	0	111.2	I971 H972 R973 Q977 K978 M979	I971-Q975 WeakPolarHBondContact O-CG 3.3Å; I971-Q975 PolarHBondContact O-N 3.15Å; H972-Q975 PolarHBondContact O-N 2.87Å; R973-Q975 VanDerWaalsContact C-N 3.34Å; Q975-Q977 VanDerWaalsContact C-N 3.33Å; Q975-Q977 PolarHBondContact O-N 3.36Å; Q975-K978 PolarHBondContact O-N 3.4Å; Q975-M979 VanDerWaalsContact O-CG 3.3Å; Q975-M979 WeakPolarHBondContact O-CG 3.21Å; Q975-M979 PolarHBondContact O-N 2.67Å
976	I	90.5	Very high	85.1	Confident	72 Å²	72	109.2 Å²	109.2	37%	0.369	52%	0.52	S	S	.	.	H	α-helix	trans	-60.8	-44.5	175	-67.2	167.1	0	0	0	110.5	H972 R973 K978 M979 M980	H972-I976 WeakPolarHBondContact O-CG1 3.47Å; H972-I976 PolarHBondContact O-N 3.49Å; R973-I976 PolarHBondContact O-N 3.12Å; I976-K978 PolarHBondContact O-N 3.49Å; I976-M979 PolarHBondContact O-N 3.07Å; I976-M979 VanDerWaalsContact O-N 3.16Å; I976-M980 HydrophobicContact CG2-CG 4.49Å; I976-M980 WeakPolarHBondContact O-CG 3.25Å; I976-M980 PolarHBondContact O-N 2.97Å
977	Q	86	Confident	85.2	Confident	95 Å²	95	108.9 Å²	108.9	44%	0.444	52%	0.518	S	S	.	.	H	α-helix	trans	-59.7	-46.6	177.2	-167.6	71.1	23.4	0	0	111.1	R973 Q974 Q975 M979 M980 D981	R973-Q977 WeakPolarHBondContact O-CB 3.43Å; R973-Q977 PolarHBondContact O-N 2.68Å; Q974-Q977 PolarHBondContact O-N 2.92Å; Q975-Q977 VanDerWaalsContact C-N 3.33Å; Q975-Q977 PolarHBondContact O-N 3.36Å; Q977-M979 VanDerWaalsContact C-N 3.31Å; Q977-M979 PolarHBondContact O-N 3.37Å; Q977-M980 PolarHBondContact O-N 2.76Å; Q977-D981 VanDerWaalsContact O-CG 3.29Å; Q977-D981 PolarHBondContact O-N 3.16Å
978	K	87.3	Confident	84.9	Confident	148 Å²	148	112 Å²	112	64%	0.643	53%	0.527	S	S	*	.	H	α-helix	trans	-60.1	-39.9	175.1	-77.9	178.4	179.7	179.4	0	112.1	Q974 Q975 I976 H982	Q974-K978 WeakPolarHBondContact O-CB 3.33Å; Q974-K978 WeakPolarHBondContact O-CG 3.45Å; Q974-K978 PolarHBondContact O-N 3.05Å; Q975-K978 PolarHBondContact O-N 3.4Å; I976-K978 PolarHBondContact O-N 3.49Å; K978-H982 VanDerWaalsContact O-CB 3.29Å; K978-H982 WeakPolarHBondContact O-CB 3.38Å; K978-H982 PolarHBondContact O-N 3.4Å
979	M	88	Confident	84.4	Confident	136 Å²	136	113.2 Å²	113.2	67%	0.67	53%	0.526	S	S	*	.	H	α-helix	trans	-64.9	-43.3	176.2	-67.8	-138.9	-59.9	0	0	111.5	Q975 I976 Q977 H982 E983	Q975-M979 VanDerWaalsContact O-CG 3.3Å; Q975-M979 WeakPolarHBondContact O-CG 3.21Å; Q975-M979 PolarHBondContact O-N 2.67Å; I976-M979 PolarHBondContact O-N 3.07Å; I976-M979 VanDerWaalsContact O-N 3.16Å; Q977-M979 VanDerWaalsContact C-N 3.31Å; Q977-M979 PolarHBondContact O-N 3.37Å; M979-H982 PolarHBondContact O-N 3.13Å; M979-E983 WeakPolarHBondContact O-CB 3.44Å; M979-E983 PolarHBondContact O-N 3.1Å
980	M	84.5	Confident	84	Confident	95 Å²	95	112.8 Å²	112.8	47%	0.468	53%	0.525	S	S	.	.	H	α-helix	trans	-63.5	-44.2	175.8	-69.3	-158.1	-58.7	0	0	112	I976 Q977 H982 E983 V984	I976-M980 HydrophobicContact CG2-CG 4.49Å; I976-M980 WeakPolarHBondContact O-CG 3.25Å; I976-M980 PolarHBondContact O-N 2.97Å; Q977-M980 PolarHBondContact O-N 2.76Å; M980-H982 VanDerWaalsContact C-N 3.3Å; M980-H982 PolarHBondContact O-N 2.88Å; M980-E983 CarbonylContact O-C 3.58Å; M980-E983 WeakPolarHBondContact O-CB 3.31Å; M980-E983 PolarHBondContact O-N 3.06Å; M980-E983 VanDerWaalsContact O-N 3.11Å; M980-V984 WeakPolarHBondContact O-CG2 3.48Å; M980-V984 PolarHBondContact O-N 3.06Å
981	D	84.6	Confident	83.2	Confident	81 Å²	81	113.4 Å²	113.4	43%	0.433	53%	0.529	S	S	.	.	H	α-helix	trans	-62.2	-39.8	176.8	-67.9	-21.7	0	0	0	111.3	Q977 E983 V984 K985	Q977-D981 VanDerWaalsContact O-CG 3.29Å; Q977-D981 PolarHBondContact O-N 3.16Å; D981-E983 VanDerWaalsContact C-N 3.26Å; D981-E983 PolarHBondContact O-N 3.21Å; D981-V984 PolarHBondContact O-N 3.43Å; D981-K985 WeakPolarHBondContact O-CG 3.37Å; D981-K985 PolarHBondContact O-N 3.35Å
982	H	82.3	Confident	82.1	Confident	122 Å²	122	115.9 Å²	115.9	57%	0.565	54%	0.539	S	S	*	.	H	α-helix	trans	-67.6	-29.3	176.3	-148.9	-55.1	0	0	0	112.3	K978 M979 M980 R986	K978-H982 VanDerWaalsContact O-CB 3.29Å; K978-H982 WeakPolarHBondContact O-CB 3.38Å; K978-H982 PolarHBondContact O-N 3.4Å; M979-H982 PolarHBondContact O-N 3.13Å; M980-H982 VanDerWaalsContact C-N 3.3Å; M980-H982 PolarHBondContact O-N 2.88Å; H982-R986 PolarHBondContact O-N 2.85Å
983	E	86.2	Confident	80.7	Confident	107 Å²	107	116.2 Å²	116.2	50%	0.5	54%	0.543	S	S	.	.	H	α-helix	trans	-79.1	-37.4	175.7	-163.6	164.9	-177.4	0	0	112.2	M979 M980 D981 R986 K987	M979-E983 WeakPolarHBondContact O-CB 3.44Å; M979-E983 PolarHBondContact O-N 3.1Å; M980-E983 CarbonylContact O-C 3.58Å; M980-E983 WeakPolarHBondContact O-CB 3.31Å; M980-E983 PolarHBondContact O-N 3.06Å; M980-E983 VanDerWaalsContact O-N 3.11Å; D981-E983 VanDerWaalsContact C-N 3.26Å; D981-E983 PolarHBondContact O-N 3.21Å; E983-R986 PolarHBondContact O-N 3.36Å; E983-K987 WeakPolarHBondContact O-CG 3.38Å; E983-K987 PolarHBondContact O-N 3.36Å
984	V	84.2	Confident	79.5	Confident	77 Å²	77	114.4 Å²	114.4	47%	0.467	54%	0.54	S	S	.	.	H	α-helix	trans	-63.2	-45.8	171.6	171.3	0	0	0	0	110.8	M980 D981 R986 K987 Q988	M980-V984 WeakPolarHBondContact O-CG2 3.48Å; M980-V984 PolarHBondContact O-N 3.06Å; D981-V984 PolarHBondContact O-N 3.43Å; V984-R986 VanDerWaalsContact C-N 3.33Å; V984-R986 PolarHBondContact O-N 3.05Å; V984-K987 PolarHBondContact O-N 3.2Å; V984-K987 VanDerWaalsContact O-N 3.12Å; V984-Q988 PolarHBondContact O-N 3.42Å
985	K	79.2	Confident	78.2	Confident	130 Å²	130	113.9 Å²	113.9	57%	0.565	54%	0.541	S	S	*	.	H	α-helix	trans	-57.8	-45.3	174.2	-78	-177.2	177.8	-175.7	0	111.8	D981 K987 Q988 E989	D981-K985 WeakPolarHBondContact O-CG 3.37Å; D981-K985 PolarHBondContact O-N 3.35Å; K985-K987 VanDerWaalsContact C-N 3.28Å; K985-K987 PolarHBondContact O-N 3.28Å; K985-Q988 PolarHBondContact O-N 3.41Å; K985-Q988 VanDerWaalsContact O-N 3.14Å; K985-E989 WeakPolarHBondContact O-CG 3.31Å; K985-E989 PolarHBondContact O-N 3.17Å
986	R	80	Confident	76.5	Confident	164 Å²	164	111.4 Å²	111.4	62%	0.619	54%	0.536	S	S	*	.	H	α-helix	trans	-58.3	-39.2	175.3	-119.3	-172.4	-70.3	-165.2	-2.7	112.5	H982 E983 V984 L990	H982-R986 PolarHBondContact O-N 2.85Å; E983-R986 PolarHBondContact O-N 3.36Å; V984-R986 VanDerWaalsContact C-N 3.33Å; V984-R986 PolarHBondContact O-N 3.05Å; R986-L990 WeakPolarHBondContact O-CB 2.92Å; R986-L990 PolarHBondContact O-N 3.21Å; R986-L990 VanDerWaalsContact O-N 3.11Å
987	K	81.2	Confident	74.7	Confident	132 Å²	132	117.9 Å²	117.9	57%	0.574	56%	0.555	S	S	*	*	H	α-helix	trans	-71.2	-34.8	177	-73.9	179.2	-178.3	174.2	0	112.7	E983 V984 K985 N991	E983-K987 WeakPolarHBondContact O-CG 3.38Å; E983-K987 PolarHBondContact O-N 3.36Å; V984-K987 PolarHBondContact O-N 3.2Å; V984-K987 VanDerWaalsContact O-N 3.12Å; K985-K987 VanDerWaalsContact C-N 3.28Å; K985-K987 PolarHBondContact O-N 3.28Å; K987-N991 PolarHBondContact O-N 3.07Å; K987-N991 VanDerWaalsContact O-N 3.11Å
988	Q	76.9	Confident	73.1	Confident	122 Å²	122	121.3 Å²	121.3	57%	0.57	57%	0.569	S	S	*	*	H	α-helix	trans	-68.2	-46.5	175.3	-76.2	179.4	-21.7	0	0	111.7	V984 K985 L990 N991 Q992	V984-Q988 PolarHBondContact O-N 3.42Å; K985-Q988 PolarHBondContact O-N 3.41Å; K985-Q988 VanDerWaalsContact O-N 3.14Å; Q988-L990 VanDerWaalsContact C-N 3.3Å; Q988-L990 PolarHBondContact O-N 2.6Å; Q988-N991 PolarHBondContact O-N 3.1Å; Q988-Q992 PolarHBondContact O-N 3.21Å
989	E	73.4	Confident	71	Confident	117 Å²	117	121.1 Å²	121.1	55%	0.547	57%	0.57	S	S	.	*	H	α-helix	trans	-57.1	-44.6	174.2	-72.1	172.1	177.5	0	0	110.9	K985 N991 Q992 D993	K985-E989 WeakPolarHBondContact O-CG 3.31Å; K985-E989 PolarHBondContact O-N 3.17Å; E989-N991 VanDerWaalsContact C-N 3.29Å; E989-N991 PolarHBondContact O-N 3.07Å; E989-Q992 PolarHBondContact O-N 3.39Å; E989-D993 PolarHBondContact O-N 2.83Å
990	L	73.4	Confident	69	Low	102 Å²	102	119.1 Å²	119.1	53%	0.534	57%	0.57	S	S	.	*	H	α-helix	trans	-62.6	-32.9	176.5	-164.1	80.4	0	0	0	113.1	R986 Q988 K994	R986-L990 WeakPolarHBondContact O-CB 2.92Å; R986-L990 PolarHBondContact O-N 3.21Å; R986-L990 VanDerWaalsContact O-N 3.11Å; Q988-L990 VanDerWaalsContact C-N 3.3Å; Q988-L990 PolarHBondContact O-N 2.6Å; L990-K994 WeakPolarHBondContact O-CG 3.39Å; L990-K994 PolarHBondContact O-N 2.7Å
991	N	69.8	Low	66.8	Low	96 Å²	96	123 Å²	123	51%	0.513	58%	0.584	S	S	.	*	H	α-helix	trans	-78	-36.6	176.9	-84.9	-12.6	0	0	0	112.4	K987 Q988 E989 K994 L995	K987-N991 PolarHBondContact O-N 3.07Å; K987-N991 VanDerWaalsContact O-N 3.11Å; Q988-N991 PolarHBondContact O-N 3.1Å; E989-N991 VanDerWaalsContact C-N 3.29Å; E989-N991 PolarHBondContact O-N 3.07Å; N991-K994 WeakPolarHBondContact O-CB 3.35Å; N991-K994 PolarHBondContact O-N 3.08Å; N991-L995 PolarHBondContact O-N 3.44Å
992	Q	64.2	Low	64.5	Low	141 Å²	141	125.4 Å²	125.4	66%	0.659	60%	0.601	S	S	*	*	H	α-helix	trans	-63.5	-41.9	172.4	-108.9	173.6	-24.6	0	0	111.2	Q988 E989 K994 L995 S996	Q988-Q992 PolarHBondContact O-N 3.21Å; E989-Q992 PolarHBondContact O-N 3.39Å; Q992-K994 VanDerWaalsContact C-N 3.27Å; Q992-K994 PolarHBondContact O-N 2.84Å; Q992-L995 PolarHBondContact O-N 2.97Å; Q992-L995 VanDerWaalsContact O-N 3.11Å; Q992-S996 PolarHBondContact O-N 3.37Å; Q992-S996 PolarHBondContact O-OG 3.45Å
993	D	61	Low	62	Low	105 Å²	105	129.2 Å²	129.2	56%	0.561	62%	0.62	S	S	*	*	H	α-helix	trans	-63.4	-32.2	173.2	-85.7	-11	0	0	0	112.8	E989 S996 R997	E989-D993 PolarHBondContact O-N 2.83Å; D993-S996 WeakPolarHBondContact CA-OG 3.25Å; D993-S996 PolarHBondContact O-OG 3.11Å; D993-S996 VanDerWaalsContact O-OG 3.13Å; D993-R997 VanDerWaalsContact O-CB 3.28Å; D993-R997 WeakPolarHBondContact O-CB 3.26Å; D993-R997 WeakPolarHBondContact O-CG 3.33Å; D993-R997 PolarHBondContact O-N 2.64Å
994	K	61.9	Low	59.4	Low	128 Å²	128	127 Å²	127	56%	0.557	63%	0.626	S	S	*	*	H	α-helix	trans	-71.2	-35.5	172.5	-79.6	178.2	-178.9	178.5	0	112.4	L990 N991 Q992 K998	L990-K994 WeakPolarHBondContact O-CG 3.39Å; L990-K994 PolarHBondContact O-N 2.7Å; N991-K994 WeakPolarHBondContact O-CB 3.35Å; N991-K994 PolarHBondContact O-N 3.08Å; Q992-K994 VanDerWaalsContact C-N 3.27Å; Q992-K994 PolarHBondContact O-N 2.84Å; K994-K998 PolarHBondContact O-N 3.06Å; K994-K998 VanDerWaalsContact O-N 3.16Å
995	L	56.8	Low	56.9	Low	109 Å²	109	131.5 Å²	131.5	57%	0.571	65%	0.647	S	S	*	*	H	α-helix	trans	-71.3	-45.4	176.8	-120.6	100.4	0	0	0	111.1	N991 Q992 R997 K998 E999	N991-L995 PolarHBondContact O-N 3.44Å; Q992-L995 PolarHBondContact O-N 2.97Å; Q992-L995 VanDerWaalsContact O-N 3.11Å; L995-R997 VanDerWaalsContact C-N 3.29Å; L995-R997 PolarHBondContact O-N 3.16Å; L995-K998 CarbonylContact O-C 3.57Å; L995-K998 WeakPolarHBondContact O-CA 3.48Å; L995-K998 WeakPolarHBondContact O-CB 3.38Å; L995-K998 PolarHBondContact O-N 3.43Å; L995-E999 PolarHBondContact O-N 2.87Å
996	S	54.7	Low	54.4	Low	60 Å²	60	134.4 Å²	134.4	42%	0.42	66%	0.663	S	S	.	*	H	α-helix	trans	-64.1	-33.4	176.3	64.7	0	0	0	0	112.2	Q992 D993 K998 E999 S1000	Q992-S996 PolarHBondContact O-N 3.37Å; Q992-S996 PolarHBondContact O-OG 3.45Å; D993-S996 WeakPolarHBondContact CA-OG 3.25Å; D993-S996 PolarHBondContact O-OG 3.11Å; D993-S996 VanDerWaalsContact O-OG 3.13Å; S996-K998 VanDerWaalsContact C-N 3.3Å; S996-K998 PolarHBondContact O-N 3.22Å; S996-E999 PolarHBondContact O-N 3.32Å; S996-S1000 PolarHBondContact O-N 2.99Å; S996-S1000 PolarHBondContact O-OG 3.44Å
997	R	53.1	Low	52	Low	208 Å²	208	136.3 Å²	136.3	79%	0.785	68%	0.678	S	S	*	*	H	α-helix	trans	-69.9	-20.7	168.9	-86.7	-176.2	169	179.3	-0.6	114.6	D993 L995 S1000	D993-R997 VanDerWaalsContact O-CB 3.28Å; D993-R997 WeakPolarHBondContact O-CB 3.26Å; D993-R997 WeakPolarHBondContact O-CG 3.33Å; D993-R997 PolarHBondContact O-N 2.64Å; L995-R997 VanDerWaalsContact C-N 3.29Å; L995-R997 PolarHBondContact O-N 3.16Å; R997-S1000 PolarHBondContact O-OG 3.17Å
998	K	52.6	Low	49.4	Very low	168 Å²	168	137.4 Å²	137.4	73%	0.73	69%	0.689	S	S	*	*	H	α-helix	trans	-84.4	-36.2	171.6	-86.4	-172.8	171.9	-174	0	112	K994 L995 S996 S1000 K1001	K994-K998 PolarHBondContact O-N 3.06Å; K994-K998 VanDerWaalsContact O-N 3.16Å; L995-K998 CarbonylContact O-C 3.57Å; L995-K998 WeakPolarHBondContact O-CA 3.48Å; L995-K998 WeakPolarHBondContact O-CB 3.38Å; L995-K998 PolarHBondContact O-N 3.43Å; S996-K998 VanDerWaalsContact C-N 3.3Å; S996-K998 PolarHBondContact O-N 3.22Å; K998-S1000 VanDerWaalsContact C-N 3.29Å; K998-S1000 PolarHBondContact O-N 2.81Å; K998-K1001 PolarHBondContact O-N 3.38Å
999	E	43.9	Very low	47.1	Very low	144 Å²	144	139.1 Å²	139.1	67%	0.673	70%	0.702	S	S	*	*	H	α-helix	trans	-73	-20	-179.9	-71.8	178.8	174	0	0	113.5	L995 S996 K1001	L995-E999 PolarHBondContact O-N 2.87Å; S996-E999 PolarHBondContact O-N 3.32Å; E999-K1001 PolarHBondContact O-N 3.2Å
1000	S	44	Very low	44.7	Very low	93 Å²	93	141.8 Å²	141.8	65%	0.65	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	5.3	171.5	40.4	0	0	0	0	114.5	S996 R997 K998	S996-S1000 PolarHBondContact O-N 2.99Å; S996-S1000 PolarHBondContact O-OG 3.44Å; R997-S1000 PolarHBondContact O-OG 3.17Å; K998-S1000 VanDerWaalsContact C-N 3.29Å; K998-S1000 PolarHBondContact O-N 2.81Å
1001	K	39.9	Very low	42.6	Very low	178 Å²	178	143.3 Å²	143.3	77%	0.774	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.1	63.1	171.4	-74.5	-171.8	176	-176.4	0	111.4	K998 E999	K998-K1001 PolarHBondContact O-N 3.38Å; E999-K1001 PolarHBondContact O-N 3.2Å
1002	T	35.7	Very low	40.7	Very low	130 Å²	130	144.5 Å²	144.5	80%	0.798	74%	0.742	S	S	*	*			trans	-171.9	92	152	11.3	0	0	0	0	109.1
1003	Q	30.5	Very low	39.1	Very low	203 Å²	203	143.6 Å²	143.6	95%	0.949	75%	0.748	S	S	*	*			trans	-116.5	119.9	166.1	-124.7	177.7	-5.3	0	0	105.6
1004	G	30.5	Very low	37.3	Very low	61 Å²	61	148.3 Å²	148.3	63%	0.629	76%	0.763	S	S	*	*			trans	119.5	83.7	-179.9	0	0	0	0	0	112.4
1005	D	33.1	Very low	35.5	Very low	171 Å²	171	148.1 Å²	148.1	91%	0.914	78%	0.778	S	S	*	*				176.6	136.6	102.2	-79.3	-20.9	0	0	0	109.7
1006	E	26.5	Very low	34.2	Very low	191 Å²	191	146.4 Å²	146.4	89%	0.893	78%	0.78	S	S	*	*			trans	-73	139.7	-175.9	-60.7	170.4	148.6	0	0	111
1007	E	28.9	Very low	33	Very low	203 Å²	203	149.8 Å²	149.8	95%	0.949	80%	0.798	S	S	*	*			trans	-167.3	143	136.2	-112.4	170.8	-173.5	0	0	112.1
1008	I	26.6	Very low	31.7	Very low	155 Å²	155	148.7 Å²	148.7	80%	0.795	80%	0.802	S	S	*	*			trans	-84.5	128.3	-173.5	-65	155.1	0	0	0	108.1
1009	D	28.2	Very low	30.7	Very low	159 Å²	159	147.2 Å²	147.2	85%	0.85	80%	0.8	S	S	*	*			trans	-147.9	120.8	148.5	-144	-1.1	0	0	0	111.2
1010	E	23.9	Very low	30.2	Very low	173 Å²	173	143 Å²	143	81%	0.808	80%	0.795	S	S	*	*			trans	-81.5	119.1	178.8	-67	-178.4	147.9	0	0	109.2
1011	T	29.2	Very low	29.8	Very low	133 Å²	133	144.8 Å²	144.8	82%	0.816	80%	0.798	S	S	*	*			trans	-150.1	133.5	148.2	36.8	0	0	0	0	111.5
1012	P	30.1	Very low	29.5	Very low	122 Å²	122	143.5 Å²	143.5	79%	0.792	79%	0.794	S	S	*	*			trans	-85.2	176	-171.5	38.5	-38.3	0	0	0	112.9
1013	P	29.3	Very low	29.8	Very low	121 Å²	121	142.7 Å²	142.7	79%	0.786	79%	0.785	S	S	*	*			trans	-88.7	153	-135.5	34.3	-35.7	0	0	0	115.7	S1015	P1013-S1015 PolarHBondContact O-N 3.27Å; P1013-S1015 VanDerWaalsContact O-N 3.17Å
1014	K	25.1	Very low	30.3	Very low	204 Å²	204	143.4 Å²	143.4	89%	0.887	78%	0.779	S	S	*	*			trans	-67.4	104.6	164.6	-74.7	176.8	177.6	172.8	0	110.2	A1016	K1014-A1016 PolarHBondContact O-N 2.89Å
1015	S	24.3	Very low	30.6	Very low	125 Å²	125	144.8 Å²	144.8	87%	0.874	77%	0.771	S	S	*	*			trans	-67.3	100.7	150.5	55.4	0	0	0	0	108.3	P1013	P1013-S1015 PolarHBondContact O-N 3.27Å; P1013-S1015 VanDerWaalsContact O-N 3.17Å
1016	A	27.9	Very low	31	Very low	73 Å²	73	145.7 Å²	145.7	60%	0.603	76%	0.762	S	S	*	*			trans	-133.3	106.9	169.3	0	0	0	0	0	109.4	K1014	K1014-A1016 PolarHBondContact O-N 2.89Å
1017	T	30.2	Very low	31.8	Very low	130 Å²	130	138.9 Å²	138.9	80%	0.798	74%	0.743	S	S	*	*			trans	67.8	65.4	141.9	43.3	0	0	0	0	117.9	I1019	T1017-I1019 VanDerWaalsContact C-N 3.28Å
1018	E	26.6	Very low	32.3	Very low	185 Å²	185	131.1 Å²	131.1	86%	0.864	71%	0.708	S	S	*	*	S	Bend	trans	-84.8	3.2	148.1	-79.8	-173.2	160.3	0	0	112.9	G1020	E1018-G1020 VanDerWaalsContact C-N 3.28Å; E1018-G1020 PolarHBondContact O-N 3.41Å
1019	I	30	Very low	33	Very low	138 Å²	138	132.8 Å²	132.8	71%	0.708	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	4.5	-174.6	-55.9	173.5	0	0	0	112.7	T1017	T1017-I1019 VanDerWaalsContact C-N 3.28Å
1020	G	34.4	Very low	33.7	Very low	54 Å²	54	130 Å²	130	56%	0.557	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-37.2	178.7	0	0	0	0	0	114.8	E1018	E1018-G1020 VanDerWaalsContact C-N 3.28Å; E1018-G1020 PolarHBondContact O-N 3.41Å
1021	D	35.8	Very low	34.5	Very low	132 Å²	132	125.5 Å²	125.5	71%	0.706	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.4	-18.4	-166.2	-76.8	-22.1	0	0	0	114.4	N1023	D1021-N1023 PolarHBondContact O-N 2.8Å
1022	E	33.3	Very low	35	Very low	151 Å²	151	128 Å²	128	71%	0.706	69%	0.685	S	S	*	*	H	α-helix	trans	-73.2	-26.4	176	-75.7	-134.4	136.1	0	0	113.6	R1024 L1025 R1026	E1022-R1024 PolarHBondContact O-N 2.72Å; E1022-L1025 PolarHBondContact O-N 3.49Å; E1022-R1026 PolarHBondContact O-N 3.31Å
1023	N	42.3	Very low	35.8	Very low	112 Å²	112	126 Å²	126	60%	0.599	67%	0.667	S	S	*	*	H	α-helix	trans	-75.8	-22.4	-178.3	-78.7	-23.2	0	0	0	113.7	D1021	D1021-N1023 PolarHBondContact O-N 2.8Å
1024	R	40.4	Very low	36.8	Very low	218 Å²	218	124 Å²	124	82%	0.823	65%	0.653	S	S	*	*	H	α-helix	trans	-77.6	-24	174.6	-90.8	-177.6	169	179.5	-3	113.4	E1022	E1022-R1024 PolarHBondContact O-N 2.72Å
1025	L	36.7	Very low	37.8	Very low	90 Å²	90	119.1 Å²	119.1	47%	0.471	64%	0.643	S	S	.	*	H	α-helix	trans	-95	-18.1	-179.3	-79.9	154.9	0	0	0	113.7	E1022 G1027 L1028 R1029	E1022-L1025 PolarHBondContact O-N 3.49Å; L1025-G1027 VanDerWaalsContact C-N 3.3Å; L1025-G1027 PolarHBondContact O-N 3.18Å; L1025-L1028 PolarHBondContact O-N 3.09Å; L1025-R1029 PolarHBondContact O-N 2.96Å
1026	R	41.2	Very low	39.1	Very low	191 Å²	191	117 Å²	117	72%	0.721	63%	0.628	S	S	*	*	H	α-helix	trans	-64.9	-32.4	-177.5	-148.6	173.6	-165.7	173.1	4.7	113.4	E1022	E1022-R1026 PolarHBondContact O-N 3.31Å
1027	G	43	Very low	40.2	Very low	48 Å²	48	116.4 Å²	116.4	50%	0.495	62%	0.616	S	S	.	*	H	α-helix	trans	-70.6	-27.2	176	0	0	0	0	0	114.5	L1025 S1030	L1025-G1027 VanDerWaalsContact C-N 3.3Å; L1025-G1027 PolarHBondContact O-N 3.18Å; G1027-S1030 PolarHBondContact O-OG 2.57Å
1028	L	39.6	Very low	41.2	Very low	39 Å²	39	114 Å²	114	20%	0.204	59%	0.593	C	S	.	*	H	α-helix	trans	-86	-23.5	179	-81.1	161	0	0	0	112.7	L1025 L1031	L1025-L1028 PolarHBondContact O-N 3.09Å; L1028-L1031 HydrophobicContact CD2-CD1 4.41Å
1029	R	42.2	Very low	42.3	Very low	191 Å²	191	112.5 Å²	112.5	72%	0.721	58%	0.583	S	S	*	*	H	α-helix	trans	-74.7	-26.2	173.8	-79.2	-173.1	174.1	-178.1	0.4	113.5	L1025 L1031 R1038	L1025-R1029 PolarHBondContact O-N 2.96Å; R1029-L1031 VanDerWaalsContact C-N 3.27Å; R1029-L1031 PolarHBondContact O-N 3.4Å; R1029-R1038 PolarHBondContact O-NH2 3.03Å
1030	S	41.8	Very low	43	Very low	100 Å²	100	113.5 Å²	113.5	70%	0.699	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	-4.4	177	73.7	0	0	0	0	114.1	G1027	G1027-S1030 PolarHBondContact O-OG 2.57Å
1031	L	40.2	Very low	43.7	Very low	78 Å²	78	114.3 Å²	114.3	41%	0.408	57%	0.574	S	S	.	*	S	Bend	trans	-89.8	113	177	-77.1	162.3	0	0	0	109.8	L1028 R1029 M1033 R1038	L1028-L1031 HydrophobicContact CD2-CD1 4.41Å; R1029-L1031 VanDerWaalsContact C-N 3.27Å; R1029-L1031 PolarHBondContact O-N 3.4Å; L1031-M1033 VanDerWaalsContact C-N 3.29Å; L1031-M1033 HydrophobicContact CB-CG 4.23Å; L1031-M1033 HydrophobicContact CB-SD 4.36Å; L1031-M1033 PolarHBondContact O-N 2.78Å; L1031-R1038 PolarHBondContact O-NH2 2.82Å; L1031-R1038 VanDerWaalsContact O-NH2 3.13Å
1032	L	41.5	Very low	44.4	Very low	186 Å²	186	111.7 Å²	111.7	97%	0.974	56%	0.557	S	S	*	*			trans	-65.6	87.5	169.5	-135.4	89.4	0	0	0	107.8
1033	M	46.3	Very low	45.2	Very low	80 Å²	80	107.3 Å²	107.3	39%	0.394	55%	0.547	S	S	.	.			trans	-132.6	145.1	-179.9	-73	-173.7	163	0	0	110.7	L1031 V1037 L1041	L1031-M1033 VanDerWaalsContact C-N 3.29Å; L1031-M1033 HydrophobicContact CB-CG 4.23Å; L1031-M1033 HydrophobicContact CB-SD 4.36Å; L1031-M1033 PolarHBondContact O-N 2.78Å; M1033-V1037 HydrophobicContact SD-CG1 4.2Å; M1033-L1041 HydrophobicContact SD-CD1 4.16Å
1034	P	49.3	Very low	45.1	Very low	78 Å²	78	106.3 Å²	106.3	51%	0.506	55%	0.545	S	S	.	.			trans	-54.9	144.9	176.3	-24.3	32.2	0	0	0	112.5	S1036 V1037 R1038	P1034-S1036 PolarHBondContact O-N 3.46Å; P1034-V1037 HydrophobicContact CB-CG2 4.45Å; P1034-V1037 PolarHBondContact O-N 3Å; P1034-R1038 PolarHBondContact O-N 3.22Å
1035	P	46.4	Very low	45.3	Very low	103 Å²	103	99.2 Å²	99.2	67%	0.669	53%	0.533	S	S	*	.	H	α-helix	trans	-55.9	-30.3	-174.9	-25	31.9	0	0	0	114.6	K1039	P1035-K1039 WeakPolarHBondContact O-CG 3.48Å; P1035-K1039 PolarHBondContact O-N 3.29Å
1036	S	52	Low	45.4	Very low	79 Å²	79	99.4 Å²	99.4	55%	0.552	54%	0.541	S	S	*	.	H	α-helix	trans	-68.7	-34.6	178	51.1	0	0	0	0	113	P1034 K1040	P1034-S1036 PolarHBondContact O-N 3.46Å; S1036-K1040 WeakPolarHBondContact O-CG 3.28Å; S1036-K1040 PolarHBondContact O-N 3.48Å
1037	V	50.7	Low	45.2	Very low	61 Å²	61	95.3 Å²	95.3	37%	0.37	54%	0.538	S	S	.	.	H	α-helix	trans	-80.2	-41.2	-180	-179.3	0	0	0	0	110.3	M1033 P1034 K1039 K1040 L1041	M1033-V1037 HydrophobicContact SD-CG1 4.2Å; P1034-V1037 HydrophobicContact CB-CG2 4.45Å; P1034-V1037 PolarHBondContact O-N 3Å; V1037-K1039 PolarHBondContact O-N 3.05Å; V1037-K1040 PolarHBondContact O-N 3.38Å; V1037-L1041 HydrophobicContact CG1-CD1 4.11Å; V1037-L1041 PolarHBondContact O-N 3.48Å
1038	R	50.7	Low	44.9	Very low	80 Å²	80	99.5 Å²	99.5	30%	0.302	55%	0.549	S	S	.	.	H	α-helix	trans	-58	-48.7	175.6	-177.1	178.9	-79.9	176.5	-4	111.7	R1029 L1031 P1034 K1040 L1041 E1042	R1029-R1038 PolarHBondContact O-NH2 3.03Å; L1031-R1038 PolarHBondContact O-NH2 2.82Å; L1031-R1038 VanDerWaalsContact O-NH2 3.13Å; P1034-R1038 PolarHBondContact O-N 3.22Å; R1038-K1040 VanDerWaalsContact C-N 3.29Å; R1038-K1040 PolarHBondContact O-N 3.01Å; R1038-L1041 PolarHBondContact O-N 3.35Å; R1038-L1041 VanDerWaalsContact O-N 3.16Å; R1038-E1042 HydrophobicContact CG-CG 4.42Å; R1038-E1042 WeakPolarHBondContact CG-OE1 3.4Å; R1038-E1042 WeakPolarHBondContact O-CG 3.14Å; R1038-E1042 PolarHBondContact O-N 2.84Å
1039	K	51.2	Low	44.5	Very low	153 Å²	153	106.3 Å²	106.3	67%	0.665	58%	0.579	S	S	*	*	H	α-helix	trans	-59.7	-38.2	177.3	-77.8	-176.2	177.6	-177.4	0	112.9	P1035 V1037 A1043	P1035-K1039 WeakPolarHBondContact O-CG 3.48Å; P1035-K1039 PolarHBondContact O-N 3.29Å; V1037-K1039 PolarHBondContact O-N 3.05Å; K1039-A1043 VanDerWaalsContact O-CB 3.3Å; K1039-A1043 WeakPolarHBondContact O-CB 3.48Å; K1039-A1043 PolarHBondContact O-N 2.89Å; K1039-A1043 VanDerWaalsContact O-N 3.07Å
1040	K	44.8	Very low	44.1	Very low	159 Å²	159	103.2 Å²	103.2	69%	0.691	58%	0.584	S	S	*	*	H	α-helix	trans	-67.6	-40.1	176.8	-78.1	-178.3	177.1	-177.3	0	111.7	S1036 V1037 R1038 A1043 V1044	S1036-K1040 WeakPolarHBondContact O-CG 3.28Å; S1036-K1040 PolarHBondContact O-N 3.48Å; V1037-K1040 PolarHBondContact O-N 3.38Å; R1038-K1040 VanDerWaalsContact C-N 3.29Å; R1038-K1040 PolarHBondContact O-N 3.01Å; K1040-A1043 PolarHBondContact O-N 3.33Å; K1040-V1044 WeakPolarHBondContact O-CG2 3.19Å; K1040-V1044 PolarHBondContact O-N 3.48Å
1041	L	49	Very low	43.8	Very low	72 Å²	72	101.2 Å²	101.2	38%	0.377	58%	0.579	S	S	.	*	H	α-helix	trans	-71.1	-39.5	177.9	-92.2	154.9	0	0	0	112.9	M1033 V1037 R1038 A1043 V1044 A1045	M1033-L1041 HydrophobicContact SD-CD1 4.16Å; V1037-L1041 HydrophobicContact CG1-CD1 4.11Å; V1037-L1041 PolarHBondContact O-N 3.48Å; R1038-L1041 PolarHBondContact O-N 3.35Å; R1038-L1041 VanDerWaalsContact O-N 3.16Å; L1041-A1043 VanDerWaalsContact C-N 3.3Å; L1041-A1043 PolarHBondContact O-N 2.92Å; L1041-V1044 PolarHBondContact O-N 3Å; L1041-A1045 VanDerWaalsContact O-CB 3.32Å; L1041-A1045 WeakPolarHBondContact O-CB 3.31Å; L1041-A1045 PolarHBondContact O-N 2.93Å
1042	E	50.6	Low	43.8	Very low	77 Å²	77	103.7 Å²	103.7	36%	0.36	59%	0.592	S	S	.	*	H	α-helix	trans	-61.9	-39.9	172.9	-72.4	171.5	178.3	0	0	111.5	R1038 V1044 A1045 S1046	R1038-E1042 HydrophobicContact CG-CG 4.42Å; R1038-E1042 WeakPolarHBondContact CG-OE1 3.4Å; R1038-E1042 WeakPolarHBondContact O-CG 3.14Å; R1038-E1042 PolarHBondContact O-N 2.84Å; E1042-V1044 VanDerWaalsContact C-N 3.34Å; E1042-A1045 PolarHBondContact O-N 3.18Å; E1042-S1046 PolarHBondContact O-N 2.89Å; E1042-S1046 PolarHBondContact O-OG 3.16Å
1043	A	49.4	Very low	43.7	Very low	58 Å²	58	102 Å²	102	48%	0.479	58%	0.58	S	S	.	*	H	α-helix	trans	-67.7	-32.5	175	0	0	0	0	0	113	K1039 K1040 L1041 S1046	K1039-A1043 VanDerWaalsContact O-CB 3.3Å; K1039-A1043 WeakPolarHBondContact O-CB 3.48Å; K1039-A1043 PolarHBondContact O-N 2.89Å; K1039-A1043 VanDerWaalsContact O-N 3.07Å; K1040-A1043 PolarHBondContact O-N 3.33Å; L1041-A1043 VanDerWaalsContact C-N 3.3Å; L1041-A1043 PolarHBondContact O-N 2.92Å; A1043-S1046 PolarHBondContact O-OG 3.2Å
1044	V	40.7	Very low	43.5	Very low	92 Å²	92	102 Å²	102	56%	0.558	59%	0.587	S	S	*	*	H	α-helix	trans	-77.4	-37.8	175.9	171.2	0	0	0	0	111.3	K1040 L1041 E1042 S1046 V1047	K1040-V1044 WeakPolarHBondContact O-CG2 3.19Å; K1040-V1044 PolarHBondContact O-N 3.48Å; L1041-V1044 PolarHBondContact O-N 3Å; E1042-V1044 VanDerWaalsContact C-N 3.34Å; V1044-S1046 VanDerWaalsContact C-N 3.3Å; V1044-S1046 PolarHBondContact O-N 2.82Å; V1044-V1047 PolarHBondContact O-N 3.42Å
1045	A	44.3	Very low	43.3	Very low	69 Å²	69	104.8 Å²	104.8	57%	0.57	59%	0.593	S	S	*	*	H	α-helix	trans	-68.8	-28	-179	0	0	0	0	0	113.1	L1041 E1042 V1047	L1041-A1045 VanDerWaalsContact O-CB 3.32Å; L1041-A1045 WeakPolarHBondContact O-CB 3.31Å; L1041-A1045 PolarHBondContact O-N 2.93Å; E1042-A1045 PolarHBondContact O-N 3.18Å; A1045-V1047 VanDerWaalsContact C-N 3.3Å; A1045-V1047 PolarHBondContact O-N 2.86Å
1046	S	38.3	Very low	43.1	Very low	93 Å²	93	107.6 Å²	107.6	65%	0.65	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-6	-178.5	45.4	0	0	0	0	114.9	E1042 A1043 V1044	E1042-S1046 PolarHBondContact O-N 2.89Å; E1042-S1046 PolarHBondContact O-OG 3.16Å; A1043-S1046 PolarHBondContact O-OG 3.2Å; V1044-S1046 VanDerWaalsContact C-N 3.3Å; V1044-S1046 PolarHBondContact O-N 2.82Å
1047	V	37.4	Very low	42.7	Very low	106 Å²	106	112.2 Å²	112.2	64%	0.642	60%	0.601	S	S	*	*	S	Bend	trans	-113.7	-5	-168.8	179.8	0	0	0	0	114.5	V1044 A1045 H1049	V1044-V1047 PolarHBondContact O-N 3.42Å; A1045-V1047 VanDerWaalsContact C-N 3.3Å; A1045-V1047 PolarHBondContact O-N 2.86Å; V1047-H1049 PolarHBondContact O-N 2.8Å; V1047-H1049 VanDerWaalsContact O-N 3.14Å
1048	N	35.7	Very low	42.5	Very low	136 Å²	136	115.3 Å²	115.3	73%	0.727	61%	0.611	S	S	*	*			trans	-88.2	97.3	-173.9	-76.4	-11	0	0	0	113.9
1049	H	32.2	Very low	42.1	Very low	181 Å²	181	114.5 Å²	114.5	84%	0.838	62%	0.621	S	S	*	*			trans	-65.3	145.3	160	-103.1	-73.4	0	0	0	111.6	V1047 G1051	V1047-H1049 PolarHBondContact O-N 2.8Å; V1047-H1049 VanDerWaalsContact O-N 3.14Å; H1049-G1051 PolarHBondContact O-N 3.01Å
1050	P	33.5	Very low	41.6	Very low	127 Å²	127	110.2 Å²	110.2	83%	0.825	61%	0.614	S	S	*	*			trans	-78.5	118.9	-175.5	31.5	-31	0	0	0	110.8
1051	G	35.3	Very low	41.6	Very low	58 Å²	58	107.1 Å²	107.1	60%	0.598	60%	0.602	S	S	*	*			trans	-160.8	108.5	172.5	0	0	0	0	0	111.6	H1049 E1053	H1049-G1051 PolarHBondContact O-N 3.01Å; G1051-E1053 PolarHBondContact O-N 2.84Å
1052	N	39.6	Very low	41.4	Very low	129 Å²	129	106.5 Å²	106.5	69%	0.69	61%	0.608	S	S	*	*			trans	23.1	85.2	169.6	-80.1	-3.3	0	0	0	117.1	S1054	N1052-S1054 PolarHBondContact O-N 3.13Å
1053	E	39.6	Very low	41.1	Very low	151 Å²	151	105 Å²	105	71%	0.706	61%	0.608	S	S	*	*	H	α-helix	trans	-63.2	-22.1	174.1	-76.9	-128	152.8	0	0	114.4	G1051 R1057	G1051-E1053 PolarHBondContact O-N 2.84Å; E1053-R1057 WeakPolarHBondContact O-CB 3.45Å; E1053-R1057 PolarHBondContact O-N 2.98Å
1054	S	43.6	Very low	40.6	Very low	79 Å²	79	104.8 Å²	104.8	55%	0.552	61%	0.607	S	S	*	*	H	α-helix	trans	-67.5	-48.1	-171.4	-161.7	0	0	0	0	113	N1052 R1057 E1058	N1052-S1054 PolarHBondContact O-N 3.13Å; S1054-R1057 PolarHBondContact O-N 3.41Å; S1054-E1058 PolarHBondContact O-N 3.47Å
1055	E	43.5	Very low	40.5	Very low	137 Å²	137	108 Å²	108	64%	0.64	61%	0.609	S	S	*	*	H	α-helix	trans	-73.1	-35.1	-174	-72	-179.5	161.6	0	0	112.8	A1059	E1055-A1059 VanDerWaalsContact O-CB 3.3Å; E1055-A1059 WeakPolarHBondContact O-CB 3.38Å; E1055-A1059 PolarHBondContact O-N 3.48Å
1056	K	43.6	Very low	40.8	Very low	162 Å²	162	110.5 Å²	110.5	70%	0.704	61%	0.607	S	S	*	*	H	α-helix	trans	-70.5	-36	177.9	-71.7	-177.5	-179.6	174	0	111.8	A1060	K1056-A1060 VanDerWaalsContact O-CB 3.3Å; K1056-A1060 WeakPolarHBondContact O-CB 3.33Å; K1056-A1060 PolarHBondContact O-N 2.86Å
1057	R	43.4	Very low	40.9	Very low	177 Å²	177	114 Å²	114	67%	0.668	61%	0.607	S	S	*	*	H	α-helix	trans	-70	-42.6	176.5	-157.9	173	-174.6	159.6	-0.4	110.7	E1053 S1054 A1060 E1061	E1053-R1057 WeakPolarHBondContact O-CB 3.45Å; E1053-R1057 PolarHBondContact O-N 2.98Å; S1054-R1057 PolarHBondContact O-N 3.41Å; R1057-A1060 PolarHBondContact O-N 3.23Å; R1057-E1061 VanDerWaalsContact O-CB 3.31Å; R1057-E1061 WeakPolarHBondContact O-CB 3.32Å; R1057-E1061 PolarHBondContact O-N 2.89Å
1058	E	45.4	Very low	40.7	Very low	126 Å²	126	114.7 Å²	114.7	59%	0.589	61%	0.607	S	S	*	*	H	α-helix	trans	-64.3	-41	174.3	-78.2	-177.4	165.9	0	0	112.7	S1054 E1061 A1062	S1054-E1058 PolarHBondContact O-N 3.47Å; E1058-E1061 PolarHBondContact O-N 3.46Å; E1058-A1062 WeakPolarHBondContact O-CB 3.49Å; E1058-A1062 PolarHBondContact O-N 2.98Å
1059	A	43.1	Very low	40.9	Very low	63 Å²	63	113.8 Å²	113.8	52%	0.521	60%	0.601	S	S	.	*	H	α-helix	trans	-65.3	-40.5	175.9	0	0	0	0	0	112.1	E1055 A1063	E1055-A1059 VanDerWaalsContact O-CB 3.3Å; E1055-A1059 WeakPolarHBondContact O-CB 3.38Å; E1055-A1059 PolarHBondContact O-N 3.48Å; A1059-A1063 VanDerWaalsContact O-CB 3.3Å; A1059-A1063 WeakPolarHBondContact O-CB 3.22Å; A1059-A1063 PolarHBondContact O-N 3.45Å
1060	A	41.8	Very low	41.2	Very low	62 Å²	62	110.3 Å²	110.3	51%	0.512	59%	0.585	S	S	.	*	H	α-helix	trans	-67.8	-39.2	175.5	0	0	0	0	0	112	K1056 R1057 A1063 A1064	K1056-A1060 VanDerWaalsContact O-CB 3.3Å; K1056-A1060 WeakPolarHBondContact O-CB 3.33Å; K1056-A1060 PolarHBondContact O-N 2.86Å; R1057-A1060 PolarHBondContact O-N 3.23Å; A1060-A1063 PolarHBondContact O-N 2.85Å; A1060-A1064 WeakPolarHBondContact O-CB 3.38Å; A1060-A1064 PolarHBondContact O-N 2.81Å
1061	E	42.9	Very low	41.3	Very low	95 Å²	95	109.7 Å²	109.7	44%	0.444	58%	0.579	S	S	.	*	H	α-helix	trans	-70.7	-38.1	177.2	-148	-171.4	150.6	0	0	111.5	R1057 E1058 A1064 R1065	R1057-E1061 VanDerWaalsContact O-CB 3.31Å; R1057-E1061 WeakPolarHBondContact O-CB 3.32Å; R1057-E1061 PolarHBondContact O-N 2.89Å; E1058-E1061 PolarHBondContact O-N 3.46Å; E1061-A1064 PolarHBondContact O-N 2.9Å; E1061-R1065 WeakPolarHBondContact O-CB 3.03Å; E1061-R1065 VanDerWaalsContact O-CG 3.29Å; E1061-R1065 WeakPolarHBondContact O-CG 3.45Å; E1061-R1065 PolarHBondContact O-N 3.38Å; E1061-R1065 IonicContact OE1-CZ 3.59Å; E1061-R1065 IonicContact OE1-NE 2.66Å; E1061-R1065 IonicContact OE1-NH2 2.82Å; E1061-R1065 PolarHBondContact OE1-NH2 2.99Å
1062	A	46.7	Very low	41.3	Very low	59 Å²	59	111.6 Å²	111.6	49%	0.488	58%	0.579	S	S	.	*	H	α-helix	trans	-65.2	-42.2	173.4	0	0	0	0	0	111.6	E1058 R1065 F1066	E1058-A1062 WeakPolarHBondContact O-CB 3.49Å; E1058-A1062 PolarHBondContact O-N 2.98Å; A1062-R1065 PolarHBondContact O-N 3.08Å; A1062-F1066 WeakPolarHBondContact O-CB 3.38Å; A1062-F1066 PolarHBondContact O-N 3.27Å
1063	A	42.6	Very low	41	Very low	44 Å²	44	115 Å²	115	36%	0.364	58%	0.582	S	S	.	*	H	α-helix	trans	-62.6	-45.9	173.5	0	0	0	0	0	111.1	A1059 A1060 R1065 F1066 Y1067	A1059-A1063 VanDerWaalsContact O-CB 3.3Å; A1059-A1063 WeakPolarHBondContact O-CB 3.22Å; A1059-A1063 PolarHBondContact O-N 3.45Å; A1060-A1063 PolarHBondContact O-N 2.85Å; A1063-R1065 PolarHBondContact O-N 3.18Å; A1063-F1066 PolarHBondContact O-N 3.14Å; A1063-Y1067 WeakPolarHBondContact O-CD2 3.48Å; A1063-Y1067 PolarHBondContact O-N 3.06Å
1064	A	38.7	Very low	40.7	Very low	55 Å²	55	117 Å²	117	46%	0.455	59%	0.589	S	S	.	*	H	α-helix	trans	-61.1	-42.9	176.7	0	0	0	0	0	112	A1060 E1061 F1066 Y1067 L1068	A1060-A1064 WeakPolarHBondContact O-CB 3.38Å; A1060-A1064 PolarHBondContact O-N 2.81Å; E1061-A1064 PolarHBondContact O-N 2.9Å; A1064-F1066 PolarHBondContact O-N 3.23Å; A1064-Y1067 PolarHBondContact O-N 2.74Å; A1064-L1068 WeakPolarHBondContact O-CB 3.11Å; A1064-L1068 PolarHBondContact O-N 3.03Å
1065	R	39.9	Very low	40.1	Very low	159 Å²	159	117.2 Å²	117.2	60%	0.6	60%	0.596	S	S	*	*	H	α-helix	trans	-63.4	-39.9	175	-75.4	178.6	-172.8	-170.1	6.5	112.1	E1061 A1062 A1063 L1068 L1069	E1061-R1065 WeakPolarHBondContact O-CB 3.03Å; E1061-R1065 VanDerWaalsContact O-CG 3.29Å; E1061-R1065 WeakPolarHBondContact O-CG 3.45Å; E1061-R1065 PolarHBondContact O-N 3.38Å; E1061-R1065 IonicContact OE1-CZ 3.59Å; E1061-R1065 IonicContact OE1-NE 2.66Å; E1061-R1065 IonicContact OE1-NH2 2.82Å; E1061-R1065 PolarHBondContact OE1-NH2 2.99Å; A1062-R1065 PolarHBondContact O-N 3.08Å; A1063-R1065 PolarHBondContact O-N 3.18Å; R1065-L1068 PolarHBondContact O-N 2.79Å; R1065-L1069 WeakPolarHBondContact O-CB 3.35Å; R1065-L1069 PolarHBondContact O-N 3.11Å
1066	F	50.6	Low	39.5	Very low	122 Å²	122	120.4 Å²	120.4	54%	0.535	60%	0.603	S	S	.	*	H	α-helix	trans	-64.3	-45.1	177	-176.7	-97.1	0	0	0	112	A1062 A1063 A1064 L1069 Q1070	A1062-F1066 WeakPolarHBondContact O-CB 3.38Å; A1062-F1066 PolarHBondContact O-N 3.27Å; A1063-F1066 PolarHBondContact O-N 3.14Å; A1064-F1066 PolarHBondContact O-N 3.23Å; F1066-L1069 PolarHBondContact O-N 3.03Å; F1066-Q1070 HydrophobicContact CE1-CG 4.25Å; F1066-Q1070 HydrophobicContact CZ-CG 4.47Å; F1066-Q1070 PolarHBondContact O-N 2.82Å
1067	Y	38.9	Very low	38.8	Very low	165 Å²	165	119.6 Å²	119.6	65%	0.647	61%	0.607	S	S	*	*	H	α-helix	trans	-66.1	-38.2	176.4	-76.1	-64.6	0	0	0	112.3	A1063 A1064 L1069 Q1070 T1071	A1063-Y1067 WeakPolarHBondContact O-CD2 3.48Å; A1063-Y1067 PolarHBondContact O-N 3.06Å; A1064-Y1067 PolarHBondContact O-N 2.74Å; Y1067-L1069 PolarHBondContact O-N 3.41Å; Y1067-Q1070 PolarHBondContact O-N 2.95Å; Y1067-T1071 PolarHBondContact O-N 2.94Å
1068	L	34.8	Very low	38.2	Very low	122 Å²	122	117.3 Å²	117.3	64%	0.639	61%	0.613	S	S	*	*	H	α-helix	trans	-66.6	-38	177.7	-149.9	122.6	0	0	0	111.8	A1064 R1065 T1071 T1072	A1064-L1068 WeakPolarHBondContact O-CB 3.11Å; A1064-L1068 PolarHBondContact O-N 3.03Å; R1065-L1068 PolarHBondContact O-N 2.79Å; L1068-T1071 PolarHBondContact O-N 3.39Å; L1068-T1071 PolarHBondContact O-OG1 3.47Å; L1068-T1072 PolarHBondContact O-N 3.09Å; L1068-T1072 PolarHBondContact O-OG1 2.85Å
1069	L	38.9	Very low	37.3	Very low	116 Å²	116	119.3 Å²	119.3	61%	0.607	63%	0.627	S	S	*	*	H	α-helix	trans	-67.2	-35.2	173.6	-85	159.5	0	0	0	113	R1065 F1066 Y1067 T1072 R1073	R1065-L1069 WeakPolarHBondContact O-CB 3.35Å; R1065-L1069 PolarHBondContact O-N 3.11Å; F1066-L1069 PolarHBondContact O-N 3.03Å; Y1067-L1069 PolarHBondContact O-N 3.41Å; L1069-T1072 PolarHBondContact O-N 3.33Å; L1069-T1072 PolarHBondContact O-OG1 3.17Å; L1069-R1073 PolarHBondContact O-N 3.17Å
1070	Q	38.4	Very low	36.5	Very low	108 Å²	108	125.3 Å²	125.3	51%	0.505	64%	0.642	S	S	.	*	H	α-helix	trans	-67.5	-36.1	175.8	-78.1	-138	5.2	0	0	113	F1066 Y1067 T1072	F1066-Q1070 HydrophobicContact CE1-CG 4.25Å; F1066-Q1070 HydrophobicContact CZ-CG 4.47Å; F1066-Q1070 PolarHBondContact O-N 2.82Å; Y1067-Q1070 PolarHBondContact O-N 2.95Å; Q1070-T1072 VanDerWaalsContact C-N 3.28Å; Q1070-T1072 PolarHBondContact O-N 3.17Å
1071	T	36.2	Very low	35.9	Very low	114 Å²	114	131.1 Å²	131.1	70%	0.699	66%	0.663	S	S	*	*	H	α-helix	trans	-70.7	-23.7	179.2	59.9	0	0	0	0	113.4	Y1067 L1068	Y1067-T1071 PolarHBondContact O-N 2.94Å; L1068-T1071 PolarHBondContact O-N 3.39Å; L1068-T1071 PolarHBondContact O-OG1 3.47Å
1072	T	34.8	Very low	35.3	Very low	98 Å²	98	132.3 Å²	132.3	60%	0.601	68%	0.682	S	S	*	*	H	α-helix	trans	-95	-18	-177.5	49.2	0	0	0	0	114.1	L1068 L1069 Q1070	L1068-T1072 PolarHBondContact O-N 3.09Å; L1068-T1072 PolarHBondContact O-OG1 2.85Å; L1069-T1072 PolarHBondContact O-N 3.33Å; L1069-T1072 PolarHBondContact O-OG1 3.17Å; Q1070-T1072 VanDerWaalsContact C-N 3.28Å; Q1070-T1072 PolarHBondContact O-N 3.17Å
1073	R	32.6	Very low	34.3	Very low	200 Å²	200	133.4 Å²	133.4	76%	0.755	70%	0.699	S	S	*	*	H	α-helix	trans	-90.5	-13.3	-174.4	-160.7	168.7	178.9	174.4	0.1	115.3	L1069 A1075	L1069-R1073 PolarHBondContact O-N 3.17Å; R1073-A1075 VanDerWaalsContact C-N 3.29Å; R1073-A1075 PolarHBondContact O-N 3.14Å
1074	K	33.9	Very low	33.7	Very low	194 Å²	194	140.2 Å²	140.2	84%	0.843	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	18.6	-174	-99.3	-174.1	178.1	-179.4	0	116.7
1075	A	32.3	Very low	32.9	Very low	84 Å²	84	143 Å²	143	69%	0.694	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.1	-1.4	173.7	0	0	0	0	0	114.9	R1073	R1073-A1075 VanDerWaalsContact C-N 3.29Å; R1073-A1075 PolarHBondContact O-N 3.14Å
1076	Y	30	Very low	32.2	Very low	204 Å²	204	145.4 Å²	145.4	80%	0.8	76%	0.755	S	S	*	*	S	Bend	trans	-133.4	82.8	177.4	-83.2	-86.6	0	0	0	109.5
1077	D	29.7	Very low	31	Very low	145 Å²	145	148.7 Å²	148.7	78%	0.775	77%	0.768	S	S	*	*			trans	-174.5	53.9	155.2	-90	-27.2	0	0	0	111.3
1078	T	29.9	Very low	30.1	Very low	129 Å²	129	146 Å²	146	79%	0.791	77%	0.774	S	S	*	*			trans	-142.1	71.5	163.7	52.3	0	0	0	0	109.2
1079	N	26.8	Very low	29.6	Very low	167 Å²	167	150.7 Å²	150.7	89%	0.893	78%	0.783	S	S	*	*			trans	-167.6	59.4	159	-92.8	-17.4	0	0	0	109.7
1080	K	26	Very low	29	Very low	190 Å²	190	153 Å²	153	83%	0.826	79%	0.79	S	S	*	*			trans	-145.9	89.6	165.3	-86.1	-175	178.3	173.2	0	107.5
1081	L	29.3	Very low	28.2	Very low	183 Å²	183	152.6 Å²	152.6	96%	0.958	80%	0.8	S	S	*	*			trans	165.6	76.4	152	-94.4	143.3	0	0	0	110.4
1082	S	29.4	Very low	27.7	Very low	120 Å²	120	158.2 Å²	158.2	84%	0.839	81%	0.81	S	S	*	*			trans	-164.9	85.2	150	58.4	0	0	0	0	108
1083	G	26.4	Very low	27.3	Very low	82 Å²	82	158.9 Å²	158.9	85%	0.845	82%	0.818	S	S	*	*			trans	-83.6	104.5	167.2	0	0	0	0	0	108.9
1084	E	29.5	Very low	27.1	Very low	187 Å²	187	156.7 Å²	156.7	87%	0.874	82%	0.822	S	S	*	*			trans	-128.7	116.3	155	-79.2	-165.5	160.9	0	0	108.8	F1086	E1084-F1086 PolarHBondContact O-N 3.31Å
1085	S	23.7	Very low	26.8	Very low	114 Å²	114	156.5 Å²	156.5	80%	0.797	82%	0.824	S	S	*	*			trans	-80	109.3	-179	58.5	0	0	0	0	110.1
1086	F	24	Very low	26.7	Very low	210 Å²	210	157.8 Å²	157.8	92%	0.921	83%	0.825	S	S	*	*			trans	-117.6	120.5	157	-110	-89.5	0	0	0	110	E1084	E1084-F1086 PolarHBondContact O-N 3.31Å
1087	K	24.9	Very low	26.7	Very low	190 Å²	190	157.2 Å²	157.2	83%	0.826	83%	0.827	S	S	*	*			trans	-76.8	139.5	-175.4	-72.7	176.6	174.6	175.8	0	111.5
1088	S	21.6	Very low	26.8	Very low	108 Å²	108	157.2 Å²	157.2	76%	0.755	83%	0.827	S	S	*	*			trans	58.9	108.1	144.7	65.1	0	0	0	0	120
1089	R	23.6	Very low	26.8	Very low	222 Å²	222	159.8 Å²	159.8	84%	0.838	83%	0.83	S	S	*	*				-176.9	131.2	117.5	-106.7	174.6	175.6	167	-2.3	113
1090	Q	26.5	Very low	27	Very low	163 Å²	163	157.3 Å²	157.3	76%	0.762	82%	0.821	S	S	*	*			trans	67.8	103.7	142.2	-71.1	168.5	-29	0	0	120.7
1091	S	21.3	Very low	27	Very low	100 Å²	100	157.6 Å²	157.6	70%	0.699	82%	0.822	S	S	*	*			trans	-8.3	122.1	143.8	57.6	0	0	0	0	118.5
1092	Y	26.7	Very low	27	Very low	233 Å²	233	154.5 Å²	154.5	91%	0.914	81%	0.811	S	S	*	*			trans	-146.8	127.2	130.6	-92.1	-77.8	0	0	0	109.2	N1094	Y1092-N1094 PolarHBondContact O-N 3.34Å
1093	S	24.6	Very low	26.8	Very low	111 Å²	111	152.3 Å²	152.3	78%	0.776	80%	0.8	S	S	*	*			trans	-72.5	112.3	176.6	52.5	0	0	0	0	110.7
1094	N	28.6	Very low	27	Very low	155 Å²	155	159.1 Å²	159.1	83%	0.829	80%	0.801	S	S	*	*			trans	-129.6	106.8	157.5	-89.5	-22.2	0	0	0	106.8	Y1092 P1096	Y1092-N1094 PolarHBondContact O-N 3.34Å; N1094-P1096 VanDerWaalsContact O-CD 3.3Å; N1094-P1096 WeakPolarHBondContact O-CD 3.46Å
1095	Q	27.7	Very low	27	Very low	190 Å²	190	156.2 Å²	156.2	89%	0.888	80%	0.795	S	S	*	*			trans	-74.4	116.4	168.1	-77.8	179.7	-32	0	0	108.3
1096	P	30.4	Very low	27.3	Very low	110 Å²	110	159.1 Å²	159.1	71%	0.714	80%	0.796	S	S	*	*			trans	-81.1	124.3	161.8	29.8	-20.9	0	0	0	107.8	N1094 D1098	N1094-P1096 VanDerWaalsContact O-CD 3.3Å; N1094-P1096 WeakPolarHBondContact O-CD 3.46Å; P1096-D1098 PolarHBondContact O-N 2.91Å
1097	K	30.1	Very low	28	Very low	193 Å²	193	160 Å²	160	84%	0.839	79%	0.794	S	S	*	*			trans	-73.5	111.7	168	-74	177.7	175.6	178.4	0	107.4	E1099	K1097-E1099 PolarHBondContact O-N 3.36Å
1098	D	30.9	Very low	28.7	Very low	145 Å²	145	156.8 Å²	156.8	78%	0.775	79%	0.792	S	S	*	*			trans	-67.7	96.3	168.9	-74.4	-32.9	0	0	0	109.1	P1096 T1100	P1096-D1098 PolarHBondContact O-N 2.91Å; D1098-T1100 PolarHBondContact O-N 3.44Å; D1098-T1100 VanDerWaalsContact O-N 3.14Å
1099	E	30.6	Very low	29.6	Very low	182 Å²	182	156.4 Å²	156.4	85%	0.85	78%	0.78	S	S	*	*			trans	-76.1	92.8	163.7	-73.1	-174.1	175.3	0	0	108.3	K1097 F1101	K1097-E1099 PolarHBondContact O-N 3.36Å; E1099-F1101 PolarHBondContact O-N 2.87Å
1100	T	31	Very low	30.4	Very low	116 Å²	116	154 Å²	154	71%	0.712	78%	0.776	S	S	*	*			trans	-62.2	100.7	168.6	47.2	0	0	0	0	109.6	D1098 T1102	D1098-T1100 PolarHBondContact O-N 3.44Å; D1098-T1100 VanDerWaalsContact O-N 3.14Å; T1100-T1102 PolarHBondContact O-N 3.17Å
1101	F	26.3	Very low	31.4	Very low	196 Å²	196	149.1 Å²	149.1	86%	0.86	77%	0.77	S	S	*	*			trans	-66.5	100.3	169.9	-170.6	-98.7	0	0	0	109.1	E1099	E1099-F1101 PolarHBondContact O-N 2.87Å
1102	T	28.3	Very low	33.1	Very low	117 Å²	117	149.3 Å²	149.3	72%	0.718	77%	0.767	S	S	*	*			trans	-89.9	102.5	172.4	46.9	0	0	0	0	107.9	T1100 R1104	T1100-T1102 PolarHBondContact O-N 3.17Å; T1102-R1104 PolarHBondContact O-N 3.18Å
1103	A	25.6	Very low	34.1	Very low	74 Å²	74	143.4 Å²	143.4	61%	0.612	75%	0.747	S	S	*	*			trans	-60	107.5	158.5	0	0	0	0	0	106.3	T1105	A1103-T1105 VanDerWaalsContact C-N 3.29Å; A1103-T1105 PolarHBondContact O-N 3.37Å
1104	R	30.7	Very low	35.1	Very low	226 Å²	226	141.7 Å²	141.7	85%	0.853	73%	0.729	S	S	*	*			trans	-61.5	93.9	178.8	178.7	-177.5	-94.5	171.3	-7.1	107.6	T1102 E1106	T1102-R1104 PolarHBondContact O-N 3.18Å; R1104-E1106 PolarHBondContact O-N 3.46Å
1105	T	30.7	Very low	36.5	Very low	125 Å²	125	144.1 Å²	144.1	77%	0.767	73%	0.726	S	S	*	*			trans	-68.5	112.2	158.9	42.9	0	0	0	0	105.7	A1103 R1107	A1103-T1105 VanDerWaalsContact C-N 3.29Å; A1103-T1105 PolarHBondContact O-N 3.37Å; T1105-R1107 PolarHBondContact O-N 2.91Å
1106	E	29.1	Very low	38.2	Very low	175 Å²	175	140.4 Å²	140.4	82%	0.818	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-55.9	124.9	173.2	-68.6	-175.9	164.7	0	0	108.1	R1104	R1104-E1106 PolarHBondContact O-N 3.46Å
1107	R	37.9	Very low	39.4	Very low	230 Å²	230	140 Å²	140	87%	0.868	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-61.9	136.4	179.5	-72.7	178.6	175	177.3	-2.1	107.9	T1105 I1109	T1105-R1107 PolarHBondContact O-N 2.91Å; R1107-I1109 PolarHBondContact O-N 3.19Å; R1107-I1109 VanDerWaalsContact O-N 3.11Å
1108	P	40.3	Very low	41	Very low	121 Å²	121	137.8 Å²	137.8	79%	0.786	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-54.3	123.2	177.6	21.7	-31.8	0	0	0	109.2	K1110	P1108-K1110 PolarHBondContact O-N 3.26Å; P1108-K1110 VanDerWaalsContact O-N 3.07Å
1109	I	40.9	Very low	43.1	Very low	100 Å²	100	132.6 Å²	132.6	51%	0.513	67%	0.668	S	S	.	*			trans	-53.9	114.5	-176.6	-61.5	173.7	0	0	0	107.7	R1107 H1113	R1107-I1109 PolarHBondContact O-N 3.19Å; R1107-I1109 VanDerWaalsContact O-N 3.11Å; I1109-H1113 HydrophobicContact CG2-CB 3.3Å
1110	K	40.9	Very low	45.1	Very low	172 Å²	172	127.8 Å²	127.8	75%	0.748	65%	0.651	S	S	*	*			trans	-59.5	143.8	177.6	-72.1	-176.7	176.7	-178.4	0	108.9	P1108 V1112 H1113	P1108-K1110 PolarHBondContact O-N 3.26Å; P1108-K1110 VanDerWaalsContact O-N 3.07Å; K1110-V1112 PolarHBondContact O-N 3.21Å; K1110-H1113 PolarHBondContact O-N 3.09Å
1111	G	45.9	Very low	46.8	Very low	61 Å²	61	127.8 Å²	127.8	63%	0.629	64%	0.643	S	S	*	*	H	α-helix	trans	-53.8	-15.5	-171	0	0	0	0	0	117	R1115	G1111-R1115 PolarHBondContact O-N 2.96Å
1112	V	58.6	Low	49	Very low	104 Å²	104	124.1 Å²	124.1	63%	0.63	63%	0.628	S	S	*	*	H	α-helix	trans	-68.1	-45.4	172	-177.6	0	0	0	0	111.3	K1110 R1115 E1116	K1110-V1112 PolarHBondContact O-N 3.21Å; V1112-R1115 WeakPolarHBondContact O-CB 3.01Å; V1112-R1115 PolarHBondContact O-N 2.95Å; V1112-E1116 PolarHBondContact O-N 3.02Å; V1112-E1116 VanDerWaalsContact O-N 3.15Å
1113	H	47	Very low	51.4	Low	108 Å²	108	124.5 Å²	124.5	50%	0.5	62%	0.622	S	S	.	*	H	α-helix	trans	-72.9	-28.4	179.7	-81.8	-54.9	0	0	0	112.9	I1109 K1110 R1115 E1116 L1117	I1109-H1113 HydrophobicContact CG2-CB 3.3Å; K1110-H1113 PolarHBondContact O-N 3.09Å; H1113-R1115 VanDerWaalsContact C-N 3.29Å; H1113-E1116 IonicContact CE1-OE2 3.41Å; H1113-E1116 IonicContact CG-OE2 2.84Å; H1113-E1116 IonicContact ND1-OE2 4Å; H1113-E1116 PolarHBondContact ND1-OE2 3.47Å; H1113-E1116 PolarHBondContact O-N 3.02Å; H1113-L1117 PolarHBondContact O-N 3.16Å
1114	L	45.8	Very low	53.5	Low	75 Å²	75	126.7 Å²	126.7	39%	0.393	62%	0.621	S	S	.	*	H	α-helix	trans	-64.4	-37.5	171.1	-112.2	140.3	0	0	0	110.9	L1117 Y1118	L1114-L1117 PolarHBondContact O-N 2.78Å; L1114-Y1118 HydrophobicContact CD2-CD2 4.23Å; L1114-Y1118 HydrophobicContact CD2-CE2 3.55Å; L1114-Y1118 WeakPolarHBondContact O-CD2 3.48Å; L1114-Y1118 PolarHBondContact O-N 3.17Å
1115	R	58.1	Low	55.4	Low	207 Å²	207	121.3 Å²	121.3	78%	0.781	61%	0.605	S	S	*	*	H	α-helix	trans	-67.8	-37.7	175.4	-159.9	-179.6	-149.6	166.2	6.1	112.4	G1111 V1112 H1113 G1119	G1111-R1115 PolarHBondContact O-N 2.96Å; V1112-R1115 WeakPolarHBondContact O-CB 3.01Å; V1112-R1115 PolarHBondContact O-N 2.95Å; H1113-R1115 VanDerWaalsContact C-N 3.29Å; R1115-G1119 PolarHBondContact O-N 2.69Å
1116	E	63.1	Low	57.6	Low	111 Å²	111	119.1 Å²	119.1	52%	0.519	59%	0.589	S	S	.	*	H	α-helix	trans	-65.7	-42.8	172.8	-71.3	175.5	168.1	0	0	111.4	V1112 H1113 Y1118 G1119 V1120	V1112-E1116 PolarHBondContact O-N 3.02Å; V1112-E1116 VanDerWaalsContact O-N 3.15Å; H1113-E1116 IonicContact CE1-OE2 3.41Å; H1113-E1116 IonicContact CG-OE2 2.84Å; H1113-E1116 IonicContact ND1-OE2 4Å; H1113-E1116 PolarHBondContact ND1-OE2 3.47Å; H1113-E1116 PolarHBondContact O-N 3.02Å; E1116-Y1118 VanDerWaalsContact C-N 3.33Å; E1116-Y1118 PolarHBondContact O-N 2.73Å; E1116-G1119 WeakPolarHBondContact O-CA 3.37Å; E1116-G1119 PolarHBondContact O-N 3.25Å; E1116-G1119 VanDerWaalsContact O-N 3.1Å; E1116-V1120 WeakPolarHBondContact O-CG2 3.4Å; E1116-V1120 PolarHBondContact O-N 2.87Å
1117	L	55	Low	59.4	Low	102 Å²	102	116 Å²	116	53%	0.534	58%	0.576	S	S	.	*	H	α-helix	trans	-61	-42.9	175.7	-125.9	99	0	0	0	111.6	H1113 L1114 G1119 V1120 E1121	H1113-L1117 PolarHBondContact O-N 3.16Å; L1114-L1117 PolarHBondContact O-N 2.78Å; L1117-G1119 VanDerWaalsContact C-N 3.31Å; L1117-G1119 PolarHBondContact O-N 3.37Å; L1117-V1120 PolarHBondContact O-N 2.99Å; L1117-E1121 PolarHBondContact O-N 3.14Å
1118	Y	64.9	Low	60.7	Low	147 Å²	147	108.4 Å²	108.4	58%	0.576	56%	0.558	S	S	*	*	H	α-helix	trans	-64.2	-35.3	173.9	-79.9	-58.3	0	0	0	112.5	L1114 E1116 Q1122	L1114-Y1118 HydrophobicContact CD2-CD2 4.23Å; L1114-Y1118 HydrophobicContact CD2-CE2 3.55Å; L1114-Y1118 WeakPolarHBondContact O-CD2 3.48Å; L1114-Y1118 PolarHBondContact O-N 3.17Å; E1116-Y1118 VanDerWaalsContact C-N 3.33Å; E1116-Y1118 PolarHBondContact O-N 2.73Å; Y1118-Q1122 WeakPolarHBondContact O-CB 3.26Å; Y1118-Q1122 PolarHBondContact O-N 3.45Å
1119	G	74	Confident	61.9	Low	36 Å²	36	108 Å²	108	37%	0.371	55%	0.546	S	S	.	.	H	α-helix	trans	-62.9	-43.9	173	0	0	0	0	0	112.2	R1115 E1116 L1117 Q1122 E1123	R1115-G1119 PolarHBondContact O-N 2.69Å; E1116-G1119 WeakPolarHBondContact O-CA 3.37Å; E1116-G1119 PolarHBondContact O-N 3.25Å; E1116-G1119 VanDerWaalsContact O-N 3.1Å; L1117-G1119 VanDerWaalsContact C-N 3.31Å; L1117-G1119 PolarHBondContact O-N 3.37Å; G1119-Q1122 PolarHBondContact O-N 3.41Å; G1119-E1123 WeakPolarHBondContact O-CG 3.44Å; G1119-E1123 PolarHBondContact O-N 3.05Å
1120	V	73.8	Confident	63	Low	80 Å²	80	105.4 Å²	105.4	49%	0.485	54%	0.539	S	S	.	.	H	α-helix	trans	-69.2	-40.7	178.6	176.2	0	0	0	0	111.7	E1116 L1117 Q1122 E1123 M1124	E1116-V1120 WeakPolarHBondContact O-CG2 3.4Å; E1116-V1120 PolarHBondContact O-N 2.87Å; L1117-V1120 PolarHBondContact O-N 2.99Å; V1120-Q1122 VanDerWaalsContact C-N 3.32Å; V1120-Q1122 PolarHBondContact O-N 3.19Å; V1120-E1123 PolarHBondContact O-N 3Å; V1120-M1124 HydrophobicContact CG1-CG 4.45Å; V1120-M1124 WeakPolarHBondContact O-CB 3.42Å; V1120-M1124 VanDerWaalsContact O-CG 3.32Å; V1120-M1124 WeakPolarHBondContact O-CG 3.07Å; V1120-M1124 PolarHBondContact O-N 3.44Å
1121	E	66.1	Low	63.4	Low	117 Å²	117	103.6 Å²	103.6	55%	0.547	54%	0.537	S	S	.	.	H	α-helix	trans	-62.8	-39.6	174.4	-82.1	-174.3	157.1	0	0	111.9	L1117 M1124 H1125	L1117-E1121 PolarHBondContact O-N 3.14Å; E1121-M1124 PolarHBondContact O-N 3.41Å; E1121-H1125 WeakPolarHBondContact O-CB 3.21Å; E1121-H1125 PolarHBondContact O-N 2.88Å
1122	Q	72.7	Confident	63.7	Low	118 Å²	118	104.9 Å²	104.9	55%	0.551	54%	0.536	S	S	*	.	H	α-helix	trans	-65.1	-46.5	175.4	-163.8	83.4	28.9	0	0	111	Y1118 G1119 V1120 M1124 H1125 D1126	Y1118-Q1122 WeakPolarHBondContact O-CB 3.26Å; Y1118-Q1122 PolarHBondContact O-N 3.45Å; G1119-Q1122 PolarHBondContact O-N 3.41Å; V1120-Q1122 VanDerWaalsContact C-N 3.32Å; V1120-Q1122 PolarHBondContact O-N 3.19Å; Q1122-M1124 VanDerWaalsContact C-N 3.32Å; Q1122-M1124 PolarHBondContact O-N 3.41Å; Q1122-H1125 PolarHBondContact O-N 3.39Å; Q1122-H1125 VanDerWaalsContact O-N 3.13Å; Q1122-D1126 WeakPolarHBondContact O-CB 3.4Å; Q1122-D1126 VanDerWaalsContact O-CG 3.25Å; Q1122-D1126 PolarHBondContact O-N 3.16Å
1123	E	79.4	Confident	63.2	Low	126 Å²	126	103.9 Å²	103.9	59%	0.589	53%	0.534	S	S	*	.	H	α-helix	trans	-61.9	-38.3	175.7	-77.6	-176.6	174.9	0	0	112.1	G1119 V1120 H1125 D1126 M1127	G1119-E1123 WeakPolarHBondContact O-CG 3.44Å; G1119-E1123 PolarHBondContact O-N 3.05Å; V1120-E1123 PolarHBondContact O-N 3Å; E1123-H1125 VanDerWaalsContact C-N 3.34Å; E1123-D1126 PolarHBondContact O-N 3.02Å; E1123-M1127 VanDerWaalsContact O-CB 3.31Å; E1123-M1127 WeakPolarHBondContact O-CB 3.42Å; E1123-M1127 VanDerWaalsContact O-CG 3.26Å; E1123-M1127 WeakPolarHBondContact O-CG 3.17Å; E1123-M1127 PolarHBondContact O-N 2.89Å
1124	M	69.1	Low	63.3	Low	120 Å²	120	108 Å²	108	59%	0.591	55%	0.546	S	S	*	.	H	α-helix	trans	-66.8	-36.2	174.8	-74.4	-164.1	76.7	0	0	112.1	V1120 E1121 Q1122 M1127 S1128	V1120-M1124 HydrophobicContact CG1-CG 4.45Å; V1120-M1124 WeakPolarHBondContact O-CB 3.42Å; V1120-M1124 VanDerWaalsContact O-CG 3.32Å; V1120-M1124 WeakPolarHBondContact O-CG 3.07Å; V1120-M1124 PolarHBondContact O-N 3.44Å; E1121-M1124 PolarHBondContact O-N 3.41Å; Q1122-M1124 VanDerWaalsContact C-N 3.32Å; Q1122-M1124 PolarHBondContact O-N 3.41Å; M1124-M1127 HydrophobicContact CG-CE 4.15Å; M1124-S1128 WeakPolarHBondContact O-CB 3.22Å; M1124-S1128 PolarHBondContact O-N 3.05Å
1125	H	70.5	Confident	63.4	Low	112 Å²	112	108.9 Å²	108.9	52%	0.519	56%	0.559	S	S	.	*	H	α-helix	trans	-68.6	-45.7	175	-160.7	62.9	0	0	0	111.4	E1121 Q1122 E1123 M1127 S1128 E1129	E1121-H1125 WeakPolarHBondContact O-CB 3.21Å; E1121-H1125 PolarHBondContact O-N 2.88Å; Q1122-H1125 PolarHBondContact O-N 3.39Å; Q1122-H1125 VanDerWaalsContact O-N 3.13Å; E1123-H1125 VanDerWaalsContact C-N 3.34Å; H1125-M1127 VanDerWaalsContact C-N 3.34Å; H1125-M1127 PolarHBondContact O-N 3.22Å; H1125-S1128 CarbonylContact O-C 3.6Å; H1125-S1128 WeakPolarHBondContact O-CB 3.44Å; H1125-S1128 PolarHBondContact O-N 3.48Å; H1125-S1128 VanDerWaalsContact O-N 3.1Å; H1125-E1129 PolarHBondContact O-N 2.9Å
1126	D	76.7	Confident	62.8	Low	79 Å²	79	105.2 Å²	105.2	42%	0.422	55%	0.554	S	S	.	*	H	α-helix	trans	-64.1	-37.4	177.3	-66.7	-9	0	0	0	111.3	Q1122 E1123 E1129 A1130	Q1122-D1126 WeakPolarHBondContact O-CB 3.4Å; Q1122-D1126 VanDerWaalsContact O-CG 3.25Å; Q1122-D1126 PolarHBondContact O-N 3.16Å; E1123-D1126 PolarHBondContact O-N 3.02Å; D1126-E1129 PolarHBondContact O-N 3.37Å; D1126-A1130 VanDerWaalsContact O-CB 3.28Å; D1126-A1130 WeakPolarHBondContact O-CB 3.39Å; D1126-A1130 PolarHBondContact O-N 2.89Å
1127	M	66.2	Low	62.1	Low	109 Å²	109	103.5 Å²	103.5	54%	0.537	55%	0.554	S	S	.	*	H	α-helix	trans	-67.2	-37.4	172	-77.7	-169.7	-66.1	0	0	112.2	E1123 M1124 H1125 A1130 L1131	E1123-M1127 VanDerWaalsContact O-CB 3.31Å; E1123-M1127 WeakPolarHBondContact O-CB 3.42Å; E1123-M1127 VanDerWaalsContact O-CG 3.26Å; E1123-M1127 WeakPolarHBondContact O-CG 3.17Å; E1123-M1127 PolarHBondContact O-N 2.89Å; M1124-M1127 HydrophobicContact CG-CE 4.15Å; H1125-M1127 VanDerWaalsContact C-N 3.34Å; H1125-M1127 PolarHBondContact O-N 3.22Å; M1127-A1130 PolarHBondContact O-N 3.26Å; M1127-L1131 WeakPolarHBondContact O-CB 3.23Å; M1127-L1131 VanDerWaalsContact O-CG 3.31Å; M1127-L1131 WeakPolarHBondContact O-CG 3.47Å; M1127-L1131 PolarHBondContact O-N 3.15Å
1128	S	65.8	Low	62	Low	71 Å²	71	106.6 Å²	106.6	50%	0.497	57%	0.566	S	S	.	*	H	α-helix	trans	-69.4	-36.5	176.2	-169.6	0	0	0	0	111.9	M1124 H1125 S1132	M1124-S1128 WeakPolarHBondContact O-CB 3.22Å; M1124-S1128 PolarHBondContact O-N 3.05Å; H1125-S1128 CarbonylContact O-C 3.6Å; H1125-S1128 WeakPolarHBondContact O-CB 3.44Å; H1125-S1128 PolarHBondContact O-N 3.48Å; H1125-S1128 VanDerWaalsContact O-N 3.1Å; S1128-S1132 WeakPolarHBondContact O-CB 3.4Å; S1128-S1132 PolarHBondContact O-N 2.87Å; S1128-S1132 PolarHBondContact O-OG 3.36Å
1129	E	65.8	Low	61.5	Low	114 Å²	114	102.5 Å²	102.5	53%	0.533	56%	0.562	S	S	.	*	H	α-helix	trans	-69.7	-39.4	170.9	-89.4	-167.8	156.6	0	0	111.8	H1125 D1126 L1131 S1132 S1133	H1125-E1129 PolarHBondContact O-N 2.9Å; D1126-E1129 PolarHBondContact O-N 3.37Å; E1129-L1131 VanDerWaalsContact C-N 3.35Å; E1129-L1131 PolarHBondContact O-N 3.24Å; E1129-S1132 WeakPolarHBondContact CA-OG 3.44Å; E1129-S1132 PolarHBondContact O-N 3.37Å; E1129-S1132 PolarHBondContact O-OG 3.16Å; E1129-S1133 WeakPolarHBondContact O-CB 3.32Å; E1129-S1133 PolarHBondContact O-N 3.34Å; E1129-S1133 PolarHBondContact O-OG 3.46Å
1130	A	63.3	Low	60.4	Low	44 Å²	44	103.1 Å²	103.1	36%	0.364	56%	0.559	S	S	.	*	H	α-helix	trans	-60.3	-46.8	174.3	0	0	0	0	0	110.6	D1126 M1127 S1132 S1133 Y1134	D1126-A1130 VanDerWaalsContact O-CB 3.28Å; D1126-A1130 WeakPolarHBondContact O-CB 3.39Å; D1126-A1130 PolarHBondContact O-N 2.89Å; M1127-A1130 PolarHBondContact O-N 3.26Å; A1130-S1132 VanDerWaalsContact C-N 3.34Å; A1130-S1132 PolarHBondContact O-N 3.2Å; A1130-S1133 WeakPolarHBondContact CA-OG 3.27Å; A1130-S1133 PolarHBondContact O-N 3.33Å; A1130-S1133 PolarHBondContact O-OG 3.44Å; A1130-Y1134 WeakPolarHBondContact O-CD2 3.47Å; A1130-Y1134 PolarHBondContact O-N 2.87Å; A1130-Y1134 VanDerWaalsContact O-N 3.11Å
1131	L	48.9	Very low	59.5	Low	135 Å²	135	103.2 Å²	103.2	71%	0.707	56%	0.556	S	S	*	*	H	α-helix	trans	-64.7	-34.5	176.8	-76	166.5	0	0	0	113.1	M1127 E1129	M1127-L1131 WeakPolarHBondContact O-CB 3.23Å; M1127-L1131 VanDerWaalsContact O-CG 3.31Å; M1127-L1131 WeakPolarHBondContact O-CG 3.47Å; M1127-L1131 PolarHBondContact O-N 3.15Å; E1129-L1131 VanDerWaalsContact C-N 3.35Å; E1129-L1131 PolarHBondContact O-N 3.24Å
1132	S	52.5	Low	59.1	Low	88 Å²	88	100.8 Å²	100.8	62%	0.615	55%	0.552	S	S	*	*	H	α-helix	trans	-77.5	-27.2	175.2	71.1	0	0	0	0	112.7	S1128 E1129 A1130 Y1134	S1128-S1132 WeakPolarHBondContact O-CB 3.4Å; S1128-S1132 PolarHBondContact O-N 2.87Å; S1128-S1132 PolarHBondContact O-OG 3.36Å; E1129-S1132 WeakPolarHBondContact CA-OG 3.44Å; E1129-S1132 PolarHBondContact O-N 3.37Å; E1129-S1132 PolarHBondContact O-OG 3.16Å; A1130-S1132 VanDerWaalsContact C-N 3.34Å; A1130-S1132 PolarHBondContact O-N 3.2Å; S1132-Y1134 VanDerWaalsContact C-N 3.33Å
1133	S	49.2	Very low	58.3	Low	83 Å²	83	101.2 Å²	101.2	58%	0.58	55%	0.554	S	S	*	*	H	α-helix	trans	-78.5	-13.9	175.8	76	0	0	0	0	113.8	E1129 A1130 S1135	E1129-S1133 WeakPolarHBondContact O-CB 3.32Å; E1129-S1133 PolarHBondContact O-N 3.34Å; E1129-S1133 PolarHBondContact O-OG 3.46Å; A1130-S1133 WeakPolarHBondContact CA-OG 3.27Å; A1130-S1133 PolarHBondContact O-N 3.33Å; A1130-S1133 PolarHBondContact O-OG 3.44Å; S1133-S1135 PolarHBondContact O-N 3.18Å
1134	Y	47.8	Very low	56.8	Low	193 Å²	193	100.7 Å²	100.7	76%	0.757	56%	0.555	S	S	*	*			trans	-72.2	58.5	157.8	-78.3	-79.9	0	0	0	109.8	A1130 S1132 L1136	A1130-Y1134 WeakPolarHBondContact O-CD2 3.47Å; A1130-Y1134 PolarHBondContact O-N 2.87Å; A1130-Y1134 VanDerWaalsContact O-N 3.11Å; S1132-Y1134 VanDerWaalsContact C-N 3.33Å; Y1134-L1136 VanDerWaalsContact C-N 3.34Å; Y1134-L1136 PolarHBondContact O-N 3.44Å
1135	S	47.8	Very low	56.2	Low	94 Å²	94	99.3 Å²	99.3	66%	0.657	55%	0.55	S	S	*	.			trans	-63.9	105.2	153.4	61.2	0	0	0	0	105.6	S1133 S1137	S1133-S1135 PolarHBondContact O-N 3.18Å; S1135-S1137 VanDerWaalsContact C-N 3.35Å; S1135-S1137 PolarHBondContact O-N 3.04Å
1136	L	46.2	Very low	55.7	Low	131 Å²	131	100.4 Å²	100.4	69%	0.686	56%	0.555	S	S	*	*			trans	-28.9	92.8	175.2	-149.7	81.6	0	0	0	110.7	Y1134 I1141	Y1134-L1136 VanDerWaalsContact C-N 3.34Å; Y1134-L1136 PolarHBondContact O-N 3.44Å; L1136-I1141 HydrophobicContact CD2-CG1 4.36Å
1137	S	49.1	Very low	54.3	Low	75 Å²	75	102.8 Å²	102.8	52%	0.524	57%	0.567	S	S	.	*			trans	-67.1	139.3	-175.2	55.1	0	0	0	0	108.2	S1135 A1139 T1140	S1135-S1137 VanDerWaalsContact C-N 3.35Å; S1135-S1137 PolarHBondContact O-N 3.04Å; S1137-A1139 PolarHBondContact O-N 3.19Å; S1137-T1140 PolarHBondContact O-N 3.21Å; S1137-T1140 PolarHBondContact O-OG1 3.38Å; S1137-T1140 VanDerWaalsContact O-OG1 3.08Å
1138	E	52.1	Low	53.3	Low	167 Å²	167	105.4 Å²	105.4	78%	0.78	58%	0.578	S	S	*	*	H	α-helix	trans	-48	-20.9	-175.9	-71.7	177.7	146.6	0	0	114.8	T1140 I1141 S1142	E1138-T1140 PolarHBondContact O-N 3.38Å; E1138-I1141 PolarHBondContact O-N 3.29Å; E1138-I1141 VanDerWaalsContact O-N 3.15Å; E1138-S1142 PolarHBondContact O-N 3.34Å; E1138-S1142 VanDerWaalsContact O-N 3.13Å
1139	A	54.3	Low	52.5	Low	60 Å²	60	107.7 Å²	107.7	50%	0.496	59%	0.589	S	S	.	*	H	α-helix	trans	-58.9	-36.8	171.8	0	0	0	0	0	114.5	S1137 I1141 S1142 E1143	S1137-A1139 PolarHBondContact O-N 3.19Å; A1139-I1141 VanDerWaalsContact C-N 3.29Å; A1139-I1141 PolarHBondContact O-N 2.78Å; A1139-S1142 PolarHBondContact O-N 2.97Å; A1139-S1142 PolarHBondContact O-OG 3.38Å; A1139-E1143 PolarHBondContact O-N 2.92Å; A1139-E1143 VanDerWaalsContact O-N 3.16Å
1140	T	52.1	Low	51.5	Low	50 Å²	50	114.5 Å²	114.5	31%	0.307	61%	0.612	S	S	.	*	H	α-helix	trans	-75.8	-22.3	176.9	53.2	0	0	0	0	111.9	S1137 E1138 L1144	S1137-T1140 PolarHBondContact O-N 3.21Å; S1137-T1140 PolarHBondContact O-OG1 3.38Å; S1137-T1140 VanDerWaalsContact O-OG1 3.08Å; E1138-T1140 PolarHBondContact O-N 3.38Å; T1140-L1144 WeakPolarHBondContact O-CB 3.32Å; T1140-L1144 PolarHBondContact O-N 3.35Å
1141	I	53.1	Low	50.9	Low	81 Å²	81	118.1 Å²	118.1	42%	0.415	62%	0.624	S	S	.	*	H	α-helix	trans	-74.1	-33.7	172.9	-61.3	171.7	0	0	0	110	L1136 E1138 A1139 L1144 N1145	L1136-I1141 HydrophobicContact CD2-CG1 4.36Å; E1138-I1141 PolarHBondContact O-N 3.29Å; E1138-I1141 VanDerWaalsContact O-N 3.15Å; A1139-I1141 VanDerWaalsContact C-N 3.29Å; A1139-I1141 PolarHBondContact O-N 2.78Å; I1141-L1144 PolarHBondContact O-N 3.08Å; I1141-N1145 WeakPolarHBondContact O-CB 3.35Å; I1141-N1145 PolarHBondContact O-N 2.9Å
1142	S	58.1	Low	51	Low	67 Å²	67	117.2 Å²	117.2	47%	0.469	62%	0.62	S	S	.	*	H	α-helix	trans	-68.8	-38.3	171.6	58.3	0	0	0	0	113	E1138 A1139 L1144 N1145 E1146	E1138-S1142 PolarHBondContact O-N 3.34Å; E1138-S1142 VanDerWaalsContact O-N 3.13Å; A1139-S1142 PolarHBondContact O-N 2.97Å; A1139-S1142 PolarHBondContact O-OG 3.38Å; S1142-L1144 VanDerWaalsContact C-N 3.34Å; S1142-L1144 PolarHBondContact O-N 3.19Å; S1142-N1145 PolarHBondContact O-N 2.71Å; S1142-E1146 PolarHBondContact O-N 3.36Å
1143	E	55.6	Low	50.9	Low	127 Å²	127	118.8 Å²	118.8	59%	0.593	62%	0.62	S	S	*	*	H	α-helix	trans	-66.9	-35.1	175.1	-75.3	-174.6	166.7	0	0	112.2	A1139 E1146 L1147	A1139-E1143 PolarHBondContact O-N 2.92Å; A1139-E1143 VanDerWaalsContact O-N 3.16Å; E1143-E1146 PolarHBondContact O-N 3.03Å; E1143-L1147 PolarHBondContact O-N 2.93Å
1144	L	49.2	Very low	51	Low	114 Å²	114	120.9 Å²	120.9	60%	0.597	62%	0.622	S	S	*	*	H	α-helix	trans	-68.3	-37	172.6	-99.5	140.8	0	0	0	112.5	T1140 I1141 S1142 L1147 E1148	T1140-L1144 WeakPolarHBondContact O-CB 3.32Å; T1140-L1144 PolarHBondContact O-N 3.35Å; I1141-L1144 PolarHBondContact O-N 3.08Å; S1142-L1144 VanDerWaalsContact C-N 3.34Å; S1142-L1144 PolarHBondContact O-N 3.19Å; L1144-L1147 PolarHBondContact O-N 3.19Å; L1144-E1148 PolarHBondContact O-N 3.35Å
1145	N	56.3	Low	51.2	Low	92 Å²	92	116.4 Å²	116.4	49%	0.492	61%	0.614	S	S	.	*	H	α-helix	trans	-70.8	-31.9	174.3	-76.5	-9.8	0	0	0	112.7	I1141 S1142 E1148 T1149	I1141-N1145 WeakPolarHBondContact O-CB 3.35Å; I1141-N1145 PolarHBondContact O-N 2.9Å; S1142-N1145 PolarHBondContact O-N 2.71Å; N1145-E1148 PolarHBondContact O-N 2.83Å; N1145-T1149 PolarHBondContact O-N 2.79Å; N1145-T1149 PolarHBondContact O-OG1 2.97Å
1146	E	59.7	Low	51.4	Low	134 Å²	134	117.9 Å²	117.9	63%	0.626	61%	0.611	S	S	*	*	H	α-helix	trans	-69	-34.7	171.2	-83.5	-171.5	162.8	0	0	111.7	S1142 E1143 T1149 Y1150	S1142-E1146 PolarHBondContact O-N 3.36Å; E1143-E1146 PolarHBondContact O-N 3.03Å; E1146-T1149 WeakPolarHBondContact CA-OG1 3.45Å; E1146-T1149 PolarHBondContact O-N 2.99Å; E1146-T1149 PolarHBondContact O-OG1 3.24Å; E1146-T1149 VanDerWaalsContact O-OG1 3.07Å; E1146-Y1150 WeakPolarHBondContact O-CD2 3.46Å; E1146-Y1150 PolarHBondContact O-N 3.19Å
1147	L	47.9	Very low	51.8	Low	129 Å²	129	116.9 Å²	116.9	68%	0.675	61%	0.606	S	S	*	*	H	α-helix	trans	-73.6	-24.2	173.4	-87.7	157.9	0	0	0	113.9	E1143 L1144 T1149	E1143-L1147 PolarHBondContact O-N 2.93Å; L1144-L1147 PolarHBondContact O-N 3.19Å; L1147-T1149 VanDerWaalsContact C-N 3.33Å
1148	E	44.6	Very low	52	Low	165 Å²	165	120.2 Å²	120.2	77%	0.771	61%	0.612	S	S	*	*	H	α-helix	trans	-80	-15.9	172.3	-115.7	-178.7	-175.2	0	0	113.1	L1144 N1145	L1144-E1148 PolarHBondContact O-N 3.35Å; N1145-E1148 PolarHBondContact O-N 2.83Å
1149	T	49.6	Very low	52	Low	118 Å²	118	116.3 Å²	116.3	72%	0.724	60%	0.598	S	S	*	*	H	α-helix	trans	-93.3	-11.2	175.1	38.7	0	0	0	0	113.9	N1145 E1146 L1147	N1145-T1149 PolarHBondContact O-N 2.79Å; N1145-T1149 PolarHBondContact O-OG1 2.97Å; E1146-T1149 WeakPolarHBondContact CA-OG1 3.45Å; E1146-T1149 PolarHBondContact O-N 2.99Å; E1146-T1149 PolarHBondContact O-OG1 3.24Å; E1146-T1149 VanDerWaalsContact O-OG1 3.07Å; L1147-T1149 VanDerWaalsContact C-N 3.33Å
1150	Y	43.3	Very low	51.8	Low	258 Å²	258	121.4 Å²	121.4	100%	1.012	61%	0.607	S	S	*	*			trans	-91.2	0	165.1	-89.3	-78.2	0	0	0	111.2	E1146	E1146-Y1150 WeakPolarHBondContact O-CD2 3.46Å; E1146-Y1150 PolarHBondContact O-N 3.19Å

Retrieved 1,150 of 1,150 residues in 1926.8 ms (Link to these results)

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