C4QJ35_SCHMA Loading...

ATP-binding cassette sub-family F member 1

AlphaFold DB , UniProt , Accession C4QJ35, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 998 aa.

						>C4QJ35_SCHMA|C4QJ35
MPPKRNVRNKDSEDESVRANANNNEGKNAKSGNKKNRDDEDESVRADTNNNEKKNTKSGNKKNKGKAVSHVPSDSEEDKVITDDSNAKRKEKKKKGKELSVNDLVEKQNDTKITKESHKSSNESLKSDEVDDEFYKKKRKAGRNTVKRADSEDERDANKASNKKQGKKKGKLNAIDAEQRGQKADIQQKTEVCDSKMDSNRETQQKNYELDEESTKPEEIDDDFYTKKRKAGRGKQKQGPEHGELPNQNATGKKKKQKPGKKKHDDGFDSEQEDLDGLAKAMTVVSLDSEIDDLDLQSTKFDGFSAICLDHHTTVNNQDTADDVQIISDDPLESKPQIDVAKSKPPIDNDINSLTDKCSTTDIKLEDDTCSKPTLVEENVTESDANAVKPKVSKKELKKLKKKEEFEKLVENAKAKIIASSGTLENFALSQASGNAKSEQQDNQLDIRVENFSIAAKGKDLFVNASLQITHGRRYGLVGPNGYGKTTLLRHIATRAINIPANIDVLLCEQEVVADSTPAFEMVLRSDKRRLELLEECEKLKSLLETDHSPSVVDKFNEVYEELVAIKADAAEGKARRILSGLGFTKNMMDRPTKDLSGGWRMRVSLARALFLEPTLLLLDEPTNHLDLNAVIWLDNYLQRWKKTLLIVSHDQSFLDNVCTDIIHLDQRQLFYYRGNYNNFKSMFIQRRKEQLKEYEKQEKRLKELKQSGMSNKQAQAKNQRDVLTRKQAKNKQTSNEANDNGKPQLLSKPKEYVVKFTFPNPTPISPPILGLYSVTFAYPNQKPLFKELNFGIDMTSRISIVGPNGVGKSTFLKLLTGEVQPTDGERRLNHRVKIGKYDQHSADQLNLSETPTEYLQRLFNLTYQDARATLGKFGLEAHAHTIPNADLSGGQRARVAFAELSRRAPDILILDEPTNNLDIESIDALADAINEFEGGVIVVSHDERLIRDTNCILWVIEDLGINEIDGDFDDYRREILDSLGEEISNPSKVAAVAGCLS
					

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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	30.8	Very low	37.7	Very low	233 Å²	233	161.9 Å²	161.9	100%	1.148	80%	0.799	S	S	*	*				0	141.7	0	-68.6	175	171.9	0	0	107.4
2	P	42.2	Very low	37.8	Very low	111 Å²	111	157.8 Å²	157.8	72%	0.721	80%	0.797	S	S	*	*			trans	-66.8	156.6	163.6	31.6	-34.3	0	0	0	109.9
3	P	45.4	Very low	37.6	Very low	124 Å²	124	160.3 Å²	160.3	81%	0.805	81%	0.805	S	S	*	*			trans	-68.1	132.8	173.5	29.3	-33.7	0	0	0	110	R5	P3-R5 PolarHBondContact O-N 3.39Å; P3-R5 VanDerWaalsContact O-N 3.17Å
4	K	40.5	Very low	37.5	Very low	199 Å²	199	161.2 Å²	161.2	87%	0.865	81%	0.813	S	S	*	*			trans	-67.1	113.6	174.4	-66.8	-174.3	176.2	-172.8	0	109.4	N6	K4-N6 PolarHBondContact O-N 2.82Å
5	R	45.3	Very low	37.3	Very low	146 Å²	146	162.9 Å²	162.9	55%	0.551	82%	0.817	S	S	*	*			trans	-58.8	126	166.6	-88.2	-171.8	171.3	89.5	0.8	108.3	P3 V7 E975	P3-R5 PolarHBondContact O-N 3.39Å; P3-R5 VanDerWaalsContact O-N 3.17Å; R5-V7 PolarHBondContact O-N 3.03Å; R5-E975 IonicContact CZ-OE1 3.69Å; R5-E975 IonicContact CZ-OE2 2.77Å; R5-E975 IonicContact NH1-OE1 2.67Å; R5-E975 PolarHBondContact NH1-OE1 2.97Å; R5-E975 IonicContact NH1-OE2 3.31Å; R5-E975 PolarHBondContact NH1-OE2 3.36Å; R5-E975 IonicContact NH2-OE1 2.7Å; R5-E975 IonicContact NH2-OE2 3.36Å; R5-E975 PolarHBondContact NH2-OE2 3.24Å
6	N	33	Very low	37.1	Very low	156 Å²	156	159.7 Å²	159.7	83%	0.834	82%	0.815	S	S	*	*			trans	-72.7	108.1	176	-90.3	-27.5	0	0	0	109.8	K4 R8	K4-N6 PolarHBondContact O-N 2.82Å; N6-R8 PolarHBondContact O-N 3.14Å
7	V	37.9	Very low	37.2	Very low	124 Å²	124	158.6 Å²	158.6	75%	0.752	82%	0.817	S	S	*	*			trans	-65	105.6	172	-179.3	0	0	0	0	109	R5 N9	R5-V7 PolarHBondContact O-N 3.03Å; V7-N9 WeakPolarHBondContact CG1-OD1 3.19Å; V7-N9 PolarHBondContact O-N 3.09Å
8	R	33.7	Very low	37	Very low	235 Å²	235	163.2 Å²	163.2	89%	0.887	82%	0.822	S	S	*	*			trans	-86.8	83.8	169.3	-93.8	-174.6	166	170.5	-2.6	109.7	N6 K10	N6-R8 PolarHBondContact O-N 3.14Å; R8-K10 PolarHBondContact O-N 2.91Å
9	N	35.1	Very low	37	Very low	114 Å²	114	159.1 Å²	159.1	61%	0.61	82%	0.816	S	S	*	*			trans	-56.6	129.3	157.7	-77.3	10	0	0	0	108.5	V7	V7-N9 WeakPolarHBondContact CG1-OD1 3.19Å; V7-N9 PolarHBondContact O-N 3.09Å
10	K	37.4	Very low	37	Very low	201 Å²	201	158.7 Å²	158.7	87%	0.874	82%	0.815	S	S	*	*			trans	-101.1	82.8	161.7	-83.1	-172.9	175.6	178.6	0	107.7	R8 S12	R8-K10 PolarHBondContact O-N 2.91Å; K10-S12 PolarHBondContact O-N 3.04Å
11	D	34	Very low	37	Very low	138 Å²	138	155.3 Å²	155.3	74%	0.738	81%	0.811	S	S	*	*			trans	-65.3	129.8	161.7	-54.6	-59.4	0	0	0	107.8
12	S	38.6	Very low	37.3	Very low	112 Å²	112	151 Å²	151	78%	0.783	79%	0.793	S	S	*	*			trans	-134.9	118.1	172.3	61	0	0	0	0	108.6	K10	K10-S12 PolarHBondContact O-N 3.04Å
13	E	35.1	Very low	37	Very low	191 Å²	191	152.1 Å²	152.1	89%	0.893	79%	0.793	S	S	*	*			trans	-78.7	120.5	-164.6	-60.8	159.6	127.9	0	0	111.9	E15	E13-E15 PolarHBondContact O-N 3.26Å
14	D	35.5	Very low	36.7	Very low	173 Å²	173	151.8 Å²	151.8	93%	0.925	78%	0.784	S	S	*	*			trans	-82	82.4	168.6	-100	-33.2	0	0	0	109.9	S16	D14-S16 PolarHBondContact O-N 3.06Å
15	E	35.8	Very low	36.5	Very low	187 Å²	187	150.7 Å²	150.7	87%	0.874	78%	0.782	S	S	*	*			trans	-79	118.9	174.6	-161.7	179.1	-139.8	0	0	111.5	E13	E13-E15 PolarHBondContact O-N 3.26Å
16	S	33.7	Very low	36.1	Very low	111 Å²	111	146.9 Å²	146.9	78%	0.776	79%	0.789	S	S	*	*			trans	-88	125.4	-165.8	66.8	0	0	0	0	114.7	D14	D14-S16 PolarHBondContact O-N 3.06Å
17	V	39.1	Very low	36.4	Very low	141 Å²	141	148.5 Å²	148.5	86%	0.855	79%	0.788	S	S	*	*			trans	-134.6	122.8	161.3	-176	0	0	0	0	111.3
18	R	32.2	Very low	36.3	Very low	242 Å²	242	149.8 Å²	149.8	91%	0.913	79%	0.791	S	S	*	*			trans	-87.9	146.3	169.6	-64	169.7	171	160.6	-4.1	110.2
19	A	37	Very low	36.5	Very low	84 Å²	84	143.5 Å²	143.5	69%	0.694	79%	0.789	S	S	*	*				168.5	150.6	120.2	0	0	0	0	0	115.7
20	N	36.9	Very low	36.7	Very low	152 Å²	152	147.3 Å²	147.3	81%	0.813	80%	0.8	S	S	*	*			trans	60.2	83.5	143.7	-59.7	-7.7	0	0	0	121.5
21	A	37	Very low	36.7	Very low	87 Å²	87	143.4 Å²	143.4	72%	0.719	80%	0.798	S	S	*	*				35.2	135.9	106.6	0	0	0	0	0	122.4
22	N	37.6	Very low	37	Very low	144 Å²	144	141 Å²	141	77%	0.77	81%	0.805	S	S	*	*			trans	92.2	128	140.9	-69.7	-3	0	0	0	122.8
23	N	37.2	Very low	36.8	Very low	134 Å²	134	142.6 Å²	142.6	72%	0.717	81%	0.805	S	S	*	*			trans	90.4	113.7	140.6	-66.2	1.6	0	0	0	122.7
24	N	38.3	Very low	37	Very low	117 Å²	117	143.2 Å²	143.2	63%	0.626	81%	0.805	S	S	*	*				92.2	122.1	128.5	-72.9	32.2	0	0	0	122.8
25	E	36.6	Very low	37.1	Very low	175 Å²	175	142.9 Å²	142.9	82%	0.818	80%	0.795	S	S	*	*			trans	70.6	115.4	133.2	-66.8	174.1	-128.9	0	0	121.7
26	G	37.3	Very low	37.3	Very low	67 Å²	67	142.1 Å²	142.1	69%	0.691	80%	0.797	S	S	*	*				156.7	99.6	123.6	0	0	0	0	0	120.9
27	K	37.5	Very low	37.3	Very low	189 Å²	189	146.3 Å²	146.3	82%	0.822	80%	0.796	S	S	*	*			trans	73	107.6	134.3	-62.6	161.3	-176.6	163.2	0	121.6
28	N	36.1	Very low	37.2	Very low	152 Å²	152	145.1 Å²	145.1	81%	0.813	79%	0.785	S	S	*	*				73.4	103.5	120.7	-60.3	-16.3	0	0	0	123.2
29	A	39.6	Very low	37.6	Very low	102 Å²	102	140.6 Å²	140.6	84%	0.843	78%	0.779	S	S	*	*			trans	-155	94.9	132.9	0	0	0	0	0	109.6
30	K	38.4	Very low	37.7	Very low	194 Å²	194	145.4 Å²	145.4	84%	0.843	79%	0.787	S	S	*	*				71.9	100.8	85.4	-86.7	-166.3	172.8	-178.8	0	117.5
31	S	37.2	Very low	37.8	Very low	120 Å²	120	145.6 Å²	145.6	84%	0.839	79%	0.788	S	S	*	*			trans	63.8	113.9	137	59.8	0	0	0	0	121.5
32	G	39.7	Very low	37.8	Very low	86 Å²	86	149.8 Å²	149.8	89%	0.887	79%	0.793	S	S	*	*			trans	-154.6	85.8	156.5	0	0	0	0	0	110.4
33	N	35	Very low	37.7	Very low	147 Å²	147	147.6 Å²	147.6	79%	0.786	79%	0.789	S	S	*	*			trans	-118.9	130.9	-174.8	-176.6	2	0	0	0	110.3
34	K	39.9	Very low	37.9	Very low	204 Å²	204	147.8 Å²	147.8	89%	0.887	80%	0.795	S	S	*	*			trans	-144.6	118	170.3	-146.8	174.1	-173.2	-178	0	110.9
35	K	36.9	Very low	37.6	Very low	165 Å²	165	153.5 Å²	153.5	72%	0.717	81%	0.807	S	S	*	*			trans	-72.7	159.3	171.1	-56.9	174.5	-179.9	177.2	0	110.2
36	N	39.9	Very low	37.7	Very low	171 Å²	171	149.2 Å²	149.2	91%	0.914	80%	0.802	S	S	*	*			trans	-141.1	161.9	130	-101.5	5	0	0	0	108.1
37	R	34.1	Very low	37.7	Very low	200 Å²	200	152.9 Å²	152.9	76%	0.755	81%	0.806	S	S	*	*			trans	-165.9	165.5	-162.9	-143	-169	-170.7	-150.8	4.7	110
38	D	37.8	Very low	37.7	Very low	115 Å²	115	149.1 Å²	149.1	62%	0.615	80%	0.799	S	S	*	*			trans	74	168.4	160.4	-47.1	-37.6	0	0	0	117.3
39	D	39.9	Very low	37.8	Very low	148 Å²	148	148.6 Å²	148.6	79%	0.791	80%	0.796	S	S	*	*			trans	74.4	134	174.9	-46.2	-16.1	0	0	0	118.4
40	E	39.2	Very low	37.6	Very low	184 Å²	184	150.4 Å²	150.4	86%	0.86	79%	0.791	S	S	*	*			cis	-158.5	-163.7	-17.2	-135.4	175	-156	0	0	111.8
41	D	37.8	Very low	37.6	Very low	156 Å²	156	146.8 Å²	146.8	83%	0.834	78%	0.781	S	S	*	*			trans	-104.7	-168.8	-151.6	-97.8	-60.3	0	0	0	119.4
42	E	38.2	Very low	37.5	Very low	175 Å²	175	147.8 Å²	147.8	82%	0.818	77%	0.773	S	S	*	*			trans	87.1	119.3	171.7	-53.5	-160.8	145.2	0	0	117.6
43	S	36	Very low	37.3	Very low	99 Å²	99	152.2 Å²	152.2	69%	0.692	77%	0.767	S	S	*	*				77.7	134.4	54	100	0	0	0	0	113.5
44	V	39.7	Very low	37.3	Very low	138 Å²	138	154.3 Å²	154.3	84%	0.836	77%	0.77	S	S	*	*				-153.1	173.8	64.1	167.1	0	0	0	0	111.7
45	R	33.2	Very low	37	Very low	237 Å²	237	151.1 Å²	151.1	89%	0.894	76%	0.762	S	S	*	*			trans	-105.6	-172.7	-175.5	-61.7	174.9	172.4	157	-3.3	114.5
46	A	38.2	Very low	36.8	Very low	85 Å²	85	148.6 Å²	148.6	70%	0.702	76%	0.761	S	S	*	*			trans	88.3	145.2	158.3	0	0	0	0	0	118.2
47	D	37.4	Very low	36.5	Very low	144 Å²	144	150.3 Å²	150.3	77%	0.77	76%	0.76	S	S	*	*			cis	-161.9	158.8	-15.2	-110.9	-30.2	0	0	0	115
48	T	38.8	Very low	36.3	Very low	110 Å²	110	146.7 Å²	146.7	68%	0.675	77%	0.766	S	S	*	*			trans	48.3	111	151.3	59.6	0	0	0	0	124.7
49	N	36.5	Very low	36.1	Very low	140 Å²	140	144.6 Å²	144.6	75%	0.749	77%	0.771	S	S	*	*				54.3	134.6	114.5	-65	-9.8	0	0	0	125.5
50	N	36.7	Very low	36	Very low	141 Å²	141	144.3 Å²	144.3	75%	0.754	77%	0.77	S	S	*	*			trans	72.6	153.1	144.9	-60.6	-8.7	0	0	0	118.7
51	N	37.2	Very low	36	Very low	118 Å²	118	143.4 Å²	143.4	63%	0.631	76%	0.763	S	S	*	*			cis	-150.4	159.4	4.9	-139.8	19.6	0	0	0	114.9
52	E	36	Very low	36.2	Very low	140 Å²	140	144.3 Å²	144.3	65%	0.654	76%	0.759	S	S	*	*			trans	45.7	112.9	149.2	-72.4	-175.8	114.8	0	0	125
53	K	34.7	Very low	36.3	Very low	179 Å²	179	142 Å²	142	78%	0.778	75%	0.752	S	S	*	*				32.7	116.1	117	-58.9	170.5	-178.5	166.6	0	119.4
54	K	36.1	Very low	36.5	Very low	192 Å²	192	146.6 Å²	146.6	84%	0.835	76%	0.76	S	S	*	*				178.5	122.3	107.7	-99.1	159.8	-174.1	166.5	0	116.1
55	N	32.5	Very low	36.5	Very low	136 Å²	136	143.3 Å²	143.3	73%	0.727	75%	0.754	S	S	*	*				51.1	117.8	126.5	-82.3	9.3	0	0	0	124
56	T	34	Very low	36.8	Very low	113 Å²	113	142.3 Å²	142.3	69%	0.693	76%	0.756	S	S	*	*				90.6	143.8	120	65.4	0	0	0	0	123.4
57	K	33	Very low	36.9	Very low	206 Å²	206	142.6 Å²	142.6	90%	0.896	76%	0.759	S	S	*	*			trans	93.8	135.2	149.9	-81.8	167.1	-177.9	175.5	0	118.6
58	S	30	Very low	37.1	Very low	125 Å²	125	142.5 Å²	142.5	87%	0.874	76%	0.763	S	S	*	*			trans	-114.1	160.6	-165	48.8	0	0	0	0	112.1
59	G	34.1	Very low	37	Very low	71 Å²	71	142.1 Å²	142.1	73%	0.732	77%	0.765	S	S	*	*			trans	-149.1	114.3	161.1	0	0	0	0	0	109.3
60	N	35.9	Very low	37.1	Very low	142 Å²	142	143.4 Å²	143.4	76%	0.759	77%	0.766	S	S	*	*				77.4	103.5	56.7	-176.3	5	0	0	0	113.3
61	K	41	Very low	37.2	Very low	165 Å²	165	143.8 Å²	143.8	72%	0.717	77%	0.773	S	S	*	*				173.8	126.3	127.3	-94.4	154.2	-170.1	167.4	0	114.9
62	K	40	Very low	37.2	Very low	175 Å²	175	143 Å²	143	76%	0.761	78%	0.775	S	S	*	*				67.8	145.8	128.2	-69	-177.7	-179.2	-174.3	0	119.8
63	N	41.9	Very low	37.2	Very low	125 Å²	125	141.3 Å²	141.3	67%	0.668	78%	0.778	S	S	*	*			cis	-167.6	161.7	-9.5	-129.8	-8.1	0	0	0	113.8
64	K	40.4	Very low	37.4	Very low	196 Å²	196	139.8 Å²	139.8	85%	0.852	78%	0.778	S	S	*	*			trans	66.3	136	157.8	-64.3	172.3	177.7	-176.7	0	118.2
65	G	39	Very low	37.4	Very low	69 Å²	69	135.5 Å²	135.5	71%	0.711	77%	0.773	S	S	*	*			cis	161.7	157.3	-11.1	0	0	0	0	0	115.5
66	K	40.2	Very low	37.7	Very low	216 Å²	216	138.1 Å²	138.1	94%	0.939	78%	0.781	S	S	*	*			trans	71.1	141.2	-173	-52.9	-179.5	177.5	-174.8	0	113.9
67	A	39.9	Very low	37.8	Very low	91 Å²	91	141.7 Å²	141.7	75%	0.752	79%	0.789	S	S	*	*			cis	-175.5	171.7	-18	0	0	0	0	0	107.8
68	V	41.6	Very low	38	Very low	142 Å²	142	139.1 Å²	139.1	86%	0.861	79%	0.785	S	S	*	*			cis	-175	143.4	-29.6	150	0	0	0	0	103.4
69	S	37	Very low	38.2	Very low	103 Å²	103	143 Å²	143	72%	0.72	79%	0.787	S	S	*	*			cis	-117.5	176.3	-1.8	47.1	0	0	0	0	110.4
70	H	36.8	Very low	38.3	Very low	167 Å²	167	145.3 Å²	145.3	77%	0.773	79%	0.786	S	S	*	*			cis	102.4	85.7	9.7	-134.2	55.3	0	0	0	117.4
71	V	40.1	Very low	38.4	Very low	149 Å²	149	145.7 Å²	145.7	90%	0.903	79%	0.787	S	S	*	*			trans	-144.9	124.4	142.4	-178.4	0	0	0	0	107.3
72	P	35.8	Very low	38.2	Very low	102 Å²	102	143.7 Å²	143.7	66%	0.662	79%	0.788	S	S	*	*			trans	-139.6	136.6	179	38.2	-21.7	0	0	0	116.8
73	S	37.2	Very low	37.8	Very low	104 Å²	104	142.7 Å²	142.7	73%	0.727	79%	0.791	S	S	*	*			trans	-176.7	157.8	150.1	88.8	0	0	0	0	107.7
74	D	38.2	Very low	37.6	Very low	146 Å²	146	144.5 Å²	144.5	78%	0.781	80%	0.801	S	S	*	*			cis	-137.3	-179.4	0.9	-86.4	-62.2	0	0	0	111.3
75	S	37.4	Very low	37.4	Very low	102 Å²	102	139.1 Å²	139.1	71%	0.713	79%	0.788	S	S	*	*			trans	-80.5	173.9	179.6	57	0	0	0	0	112.9
76	E	39.1	Very low	37	Very low	192 Å²	192	142.4 Å²	142.4	90%	0.897	79%	0.789	S	S	*	*				-145.2	176.4	57.3	-72.5	-175.4	142.5	0	0	114.7
77	E	35	Very low	36.9	Very low	188 Å²	188	137.3 Å²	137.3	88%	0.879	79%	0.787	S	S	*	*			trans	-112	152.6	-168	-53.4	-179.4	126.6	0	0	112.5
78	D	38.2	Very low	36.6	Very low	151 Å²	151	141.9 Å²	141.9	81%	0.807	79%	0.79	S	S	*	*			trans	-157.6	103	149.1	-144.7	-13.5	0	0	0	113.1
79	K	33.3	Very low	36.3	Very low	208 Å²	208	147.4 Å²	147.4	90%	0.904	80%	0.796	S	S	*	*			trans	-157.7	134.5	165.3	-82.4	-154.2	176.5	-177.1	0	111.8
80	V	37.3	Very low	36.1	Very low	119 Å²	119	152.1 Å²	152.1	72%	0.721	80%	0.803	S	S	*	*			trans	-125.4	118.5	-174.7	167.7	0	0	0	0	111.2
81	I	36.6	Very low	36	Very low	150 Å²	150	153.5 Å²	153.5	77%	0.769	81%	0.81	S	S	*	*			trans	47.4	140.8	135.7	-59.1	178.6	0	0	0	119
82	T	36.9	Very low	35.7	Very low	122 Å²	122	155.1 Å²	155.1	75%	0.748	81%	0.805	S	S	*	*			cis	-177.4	168.1	-47.8	26.5	0	0	0	0	107
83	D	31.6	Very low	35.6	Very low	155 Å²	155	159 Å²	159	83%	0.829	81%	0.812	S	S	*	*			trans	-64.5	161.3	-179.4	-47.9	-95.1	0	0	0	115.4
84	D	38.6	Very low	35.4	Very low	162 Å²	162	163 Å²	163	87%	0.866	82%	0.816	S	S	*	*			trans	-139.9	164.7	149.6	-151.5	-12.9	0	0	0	111.3
85	S	36.4	Very low	35	Very low	84 Å²	84	166.2 Å²	166.2	59%	0.587	82%	0.823	S	S	*	*			trans	-147.3	162.6	-142.9	79.8	0	0	0	0	118.7
86	N	30.7	Very low	34.8	Very low	138 Å²	138	165 Å²	165	74%	0.738	83%	0.826	S	S	*	*			trans	62.5	110.5	156.2	-75.3	-76.6	0	0	0	120.6
87	A	37.6	Very low	34.3	Very low	108 Å²	108	165.4 Å²	165.4	89%	0.893	83%	0.825	S	S	*	*			trans	-138.4	145.1	144.8	0	0	0	0	0	111.2
88	K	34	Very low	34.2	Very low	188 Å²	188	165.1 Å²	165.1	82%	0.817	82%	0.824	S	S	*	*			trans	-117.3	139.8	-174	-65.4	165.2	-177.6	157.6	0	111.7
89	R	35.3	Very low	34	Very low	258 Å²	258	165 Å²	165	97%	0.974	82%	0.822	S	S	*	*			trans	-152.1	158.5	144.9	-114.1	166	-176.6	170.9	0.7	111.4
90	K	32.5	Very low	33.9	Very low	201 Å²	201	159.9 Å²	159.9	87%	0.874	81%	0.812	S	S	*	*			trans	-127.2	140.9	-175.9	-66.2	172.5	177.4	171	0	108.9
91	E	35.3	Very low	33.9	Very low	196 Å²	196	161 Å²	161	92%	0.916	82%	0.819	S	S	*	*			trans	-150.2	-173.9	146.6	-136.4	157.3	-149.8	0	0	113.1
92	K	32.1	Very low	33.7	Very low	183 Å²	183	160 Å²	160	80%	0.796	82%	0.816	S	S	*	*			trans	-145.2	152.4	-153.7	-91.7	-179.3	176.3	174.4	0	114.6
93	K	33.4	Very low	33.3	Very low	185 Å²	185	161 Å²	161	80%	0.804	82%	0.816	S	S	*	*			trans	86.6	134.3	149.3	-78.6	169	177.2	175.9	0	120.8
94	K	33.8	Very low	33.4	Very low	187 Å²	187	161.7 Å²	161.7	81%	0.813	82%	0.819	S	S	*	*			trans	92.8	105.7	139.7	-79.5	173.3	173.2	-173.1	0	121.9
95	K	30.5	Very low	33.1	Very low	213 Å²	213	161.1 Å²	161.1	93%	0.926	82%	0.821	S	S	*	*				56.6	115.5	124.1	-70.8	-168.1	171.1	-169.1	0	121.9
96	G	32.2	Very low	32.8	Very low	76 Å²	76	164.9 Å²	164.9	78%	0.784	83%	0.829	S	S	*	*			trans	162.8	128.2	157.3	0	0	0	0	0	106.8
97	K	29	Very low	33	Very low	202 Å²	202	166.6 Å²	166.6	88%	0.878	83%	0.83	S	S	*	*			cis	92.2	59	14.4	-151.6	-141.3	174.6	-166.4	0	117.1
98	E	33.2	Very low	32.8	Very low	182 Å²	182	169.6 Å²	169.6	85%	0.85	83%	0.826	S	S	*	*			trans	-160.9	170.4	164.9	-102.1	146.3	-141.4	0	0	107.9
99	L	33.6	Very low	32.8	Very low	148 Å²	148	167.4 Å²	167.4	78%	0.775	82%	0.823	S	S	*	*				-157.1	178.2	-56.8	-121.3	170.2	0	0	0	108.1
100	S	32.5	Very low	32.6	Very low	100 Å²	100	161.3 Å²	161.3	70%	0.699	81%	0.81	S	S	*	*			trans	-71.2	140.1	172.8	48.7	0	0	0	0	111.8
101	V	37.2	Very low	32.8	Very low	142 Å²	142	158.8 Å²	158.8	86%	0.861	81%	0.811	S	S	*	*			trans	-106.3	102.2	170.6	-178.3	0	0	0	0	109.6
102	N	31.5	Very low	32.6	Very low	131 Å²	131	157 Å²	157	70%	0.701	80%	0.801	S	S	*	*			trans	-122.8	150.4	159.5	-101.2	48.4	0	0	0	106.8
103	D	29	Very low	32.7	Very low	141 Å²	141	156.2 Å²	156.2	75%	0.754	80%	0.803	S	S	*	*			trans	49.9	99.1	156	-46.7	-37.7	0	0	0	118.8
104	L	33.4	Very low	32.6	Very low	170 Å²	170	153.6 Å²	153.6	89%	0.89	80%	0.803	S	S	*	*			trans	-167.2	70.8	153.7	-115.5	173.1	0	0	0	115.6
105	V	32.9	Very low	32.5	Very low	151 Å²	151	153.8 Å²	153.8	92%	0.915	80%	0.804	S	S	*	*			trans	-144.6	91.4	150.5	-174.5	0	0	0	0	110.4
106	E	30.1	Very low	32.5	Very low	163 Å²	163	152.1 Å²	152.1	76%	0.762	80%	0.799	S	S	*	*			trans	-149.4	100.6	163.4	-171.3	-162.9	-114.9	0	0	110.1
107	K	33.4	Very low	32.4	Very low	174 Å²	174	153.3 Å²	153.3	76%	0.757	80%	0.796	S	S	*	*			trans	161.2	153.8	150.5	-92.2	149.9	-164.9	159.3	0	112.2
108	Q	34.1	Very low	32.7	Very low	170 Å²	170	152.6 Å²	152.6	79%	0.794	80%	0.795	S	S	*	*			trans	67.4	127.1	161.9	-72.6	167.7	7.2	0	0	115.4
109	N	33.4	Very low	32.5	Very low	143 Å²	143	153.2 Å²	153.2	77%	0.765	80%	0.795	S	S	*	*			cis	-144.6	169.1	20.3	-79.8	-54.5	0	0	0	113.6
110	D	32.1	Very low	32.4	Very low	129 Å²	129	151.8 Å²	151.8	69%	0.69	80%	0.798	S	S	*	*			trans	-64.1	143.9	173.5	-63.4	-107	0	0	0	114.8
111	T	35.9	Very low	32.4	Very low	148 Å²	148	151.6 Å²	151.6	91%	0.908	80%	0.796	S	S	*	*			trans	-136.4	128.8	140.5	8.5	0	0	0	0	109.8
112	K	32.6	Very low	32.2	Very low	160 Å²	160	151.3 Å²	151.3	70%	0.696	79%	0.79	S	S	*	*			trans	-105.2	168.3	178.8	-65.5	171.6	179	167.2	0	109.9
113	I	33.2	Very low	32.2	Very low	166 Å²	166	154 Å²	154	85%	0.851	80%	0.798	S	S	*	*			trans	75.1	130.3	168.6	-52.9	137.2	0	0	0	110.8
114	T	31.8	Very low	32.3	Very low	130 Å²	130	152.2 Å²	152.2	80%	0.798	80%	0.797	S	S	*	*			cis	-115.7	160	23	46.6	0	0	0	0	115.7
115	K	30.4	Very low	32.5	Very low	191 Å²	191	151.5 Å²	151.5	83%	0.83	79%	0.793	S	S	*	*			trans	-112.6	151.8	147.7	-69.7	177	175.3	178.4	0	107.1
116	E	30.5	Very low	32.4	Very low	178 Å²	178	153.8 Å²	153.8	83%	0.832	79%	0.791	S	S	*	*				155.9	145.7	129.2	-87.8	169.9	-166.9	0	0	112.7
117	S	31	Very low	32.6	Very low	101 Å²	101	151 Å²	151	71%	0.706	79%	0.789	S	S	*	*			trans	58.2	144.7	173.5	54.2	0	0	0	0	117.2
118	H	35.8	Very low	32.7	Very low	187 Å²	187	149.7 Å²	149.7	87%	0.866	79%	0.79	S	S	*	*			cis	-119.9	168.6	14.7	-77.9	-101.4	0	0	0	114.1
119	K	28.7	Very low	32.5	Very low	194 Å²	194	150.7 Å²	150.7	84%	0.843	80%	0.795	S	S	*	*			trans	-149.9	159.5	176	-167.2	-177.2	-178.6	-172.6	0	108.2
120	S	31.1	Very low	32.7	Very low	119 Å²	119	149.8 Å²	149.8	83%	0.832	79%	0.794	S	S	*	*			trans	74.5	149.2	-173.5	82.2	0	0	0	0	113.8
121	S	32.4	Very low	32.8	Very low	95 Å²	95	150.8 Å²	150.8	66%	0.664	80%	0.799	S	S	*	*			cis	-145	-175.3	3.4	60.7	0	0	0	0	112.2
122	N	33.4	Very low	32.8	Very low	137 Å²	137	151 Å²	151	73%	0.733	80%	0.795	S	S	*	*			trans	80.4	118.7	173.1	-49.9	10.7	0	0	0	112.8
123	E	31.1	Very low	32.8	Very low	188 Å²	188	151.9 Å²	151.9	88%	0.879	80%	0.802	S	S	*	*			cis	65.1	129.9	23.4	-58	-172.9	133.3	0	0	113.6
124	S	31.6	Very low	32.8	Very low	103 Å²	103	152.6 Å²	152.6	72%	0.72	80%	0.799	S	S	*	*			cis	-159.1	-158.8	3.5	57.4	0	0	0	0	111.3
125	L	36.7	Very low	33	Very low	154 Å²	154	155.2 Å²	155.2	81%	0.806	80%	0.795	S	S	*	*			trans	77	125.7	-176.2	-48.7	176.8	0	0	0	112.8
126	K	31.2	Very low	32.9	Very low	200 Å²	200	156.8 Å²	156.8	87%	0.87	80%	0.802	S	S	*	*			cis	64.7	128.7	28.2	-56.5	-171.7	176.4	-173.7	0	113.8
127	S	33.2	Very low	33	Very low	103 Å²	103	157 Å²	157	72%	0.72	80%	0.8	S	S	*	*			cis	-137.2	-173.7	0	47.6	0	0	0	0	108.3
128	D	36.2	Very low	33	Very low	147 Å²	147	162.5 Å²	162.5	79%	0.786	81%	0.812	S	S	*	*			cis	-141.7	166.4	34.3	-64.5	-51.9	0	0	0	113.4
129	E	31	Very low	32.9	Very low	191 Å²	191	164.9 Å²	164.9	89%	0.893	81%	0.813	S	S	*	*			trans	-104	152.6	170.6	-61.4	173.1	122.5	0	0	109.8
130	V	36.1	Very low	32.9	Very low	125 Å²	125	165.4 Å²	165.4	76%	0.758	82%	0.815	S	S	*	*			trans	173.3	127.1	141.5	146.3	0	0	0	0	109.5
131	D	34.6	Very low	33.1	Very low	149 Å²	149	165 Å²	165	80%	0.797	82%	0.819	S	S	*	*			trans	55.6	147.1	163.9	-53.8	-15	0	0	0	120.2
132	D	36.9	Very low	33.1	Very low	152 Å²	152	164.6 Å²	164.6	81%	0.813	83%	0.83	S	S	*	*			cis	-143.2	153.2	4	-158.4	-6.5	0	0	0	112.8
133	E	31.2	Very low	33	Very low	180 Å²	180	169.2 Å²	169.2	84%	0.841	84%	0.837	S	S	*	*			trans	-96.4	105.7	178.9	-89.7	-147.8	123.3	0	0	112.9
134	F	34.1	Very low	33.1	Very low	181 Å²	181	167.2 Å²	167.2	79%	0.794	83%	0.832	S	S	*	*			trans	-132.9	105	163.5	-129	-106.5	0	0	0	116.8
135	Y	35.8	Very low	33.2	Very low	184 Å²	184	168.7 Å²	168.7	72%	0.722	84%	0.838	S	S	*	*			trans	74.7	51.4	145.5	-87.1	-103.5	0	0	0	122.3	K137	Y135-K137 PolarHBondContact O-N 3.21Å
136	K	29	Very low	33.2	Very low	225 Å²	225	168.2 Å²	168.2	98%	0.978	84%	0.841	S	S	*	*			trans	-85.7	65.9	152.7	-113.5	172.9	-173	161.6	0	112.8
137	K	32	Very low	33.3	Very low	181 Å²	181	167.1 Å²	167.1	79%	0.787	84%	0.836	S	S	*	*			trans	-145.6	70.9	-173	-141.3	166.4	-166.2	164.9	0	118.4	Y135	Y135-K137 PolarHBondContact O-N 3.21Å
138	K	31.7	Very low	33.2	Very low	217 Å²	217	173.2 Å²	173.2	94%	0.943	84%	0.843	S	S	*	*			trans	-154.8	91.8	149.7	-118.9	169.8	-172.3	173.4	0	113.7
139	R	32.9	Very low	33.1	Very low	238 Å²	238	170.1 Å²	170.1	90%	0.898	84%	0.838	S	S	*	*			trans	-103.2	139	166.6	-91.5	179.2	162.2	-178.3	-3.9	110.2
140	K	29.6	Very low	33.3	Very low	204 Å²	204	167.7 Å²	167.7	89%	0.887	83%	0.831	S	S	*	*			trans	40	95.5	151.3	-61.2	-177.5	177	-178.5	0	118.4
141	A	34.4	Very low	33.2	Very low	110 Å²	110	166.6 Å²	166.6	91%	0.909	83%	0.829	S	S	*	*			trans	-150.1	141.1	148.9	0	0	0	0	0	109.4
142	G	31.9	Very low	33.1	Very low	87 Å²	87	167.9 Å²	167.9	90%	0.897	83%	0.83	S	S	*	*			trans	124.4	62.2	178.5	0	0	0	0	0	115.7
143	R	32.6	Very low	33.1	Very low	234 Å²	234	168.8 Å²	168.8	88%	0.883	84%	0.835	S	S	*	*			trans	-140.9	101.8	171.8	-175.6	-175	-167.2	178.8	6.1	110.2
144	N	33.2	Very low	33.2	Very low	146 Å²	146	166.7 Å²	166.7	78%	0.781	83%	0.825	S	S	*	*			trans	174.1	146.7	148	-93.5	-18.4	0	0	0	112.7
145	T	34	Very low	33.2	Very low	135 Å²	135	167.2 Å²	167.2	83%	0.828	82%	0.822	S	S	*	*			trans	62.7	145.5	174.6	60.2	0	0	0	0	115.7
146	V	35.1	Very low	33.2	Very low	143 Å²	143	165.3 Å²	165.3	87%	0.867	82%	0.824	S	S	*	*			cis	-112.9	174.2	19.6	175.7	0	0	0	0	112.6
147	K	33	Very low	33.5	Very low	177 Å²	177	158.5 Å²	158.5	77%	0.77	81%	0.81	S	S	*	*			trans	-122.5	160.2	-174.9	-69.8	177.2	171	178.4	0	112.5
148	R	32.1	Very low	33.7	Very low	232 Å²	232	156.1 Å²	156.1	88%	0.875	81%	0.806	S	S	*	*			trans	71.6	153	169.5	-61.9	161.2	175.7	159	-5.3	114.3
149	A	34.4	Very low	33.9	Very low	81 Å²	81	154.6 Å²	154.6	67%	0.669	80%	0.799	S	S	*	*			cis	-125.5	147.2	5.6	0	0	0	0	0	109.7
150	D	34.4	Very low	34.1	Very low	140 Å²	140	147.5 Å²	147.5	75%	0.749	79%	0.791	S	S	*	*				60.8	131.8	81.2	-34.7	-44.1	0	0	0	112.5
151	S	35	Very low	34.4	Very low	102 Å²	102	142.6 Å²	142.6	71%	0.713	78%	0.783	S	S	*	*			cis	-159.2	165.4	-0.7	52	0	0	0	0	112.1
152	E	32.2	Very low	34.5	Very low	177 Å²	177	143 Å²	143	83%	0.827	77%	0.77	S	S	*	*			trans	21.5	135.8	144.6	-64.5	164.7	178.9	0	0	121.5
153	D	36.3	Very low	34.7	Very low	171 Å²	171	147.2 Å²	147.2	91%	0.914	76%	0.763	S	S	*	*				-163.9	154	111.3	-119.2	-26.7	0	0	0	113.9
154	E	33.3	Very low	34.8	Very low	136 Å²	136	143.8 Å²	143.8	64%	0.636	76%	0.755	S	S	*	*			trans	-136.2	140.6	-179.3	-145.2	-153.2	142.4	0	0	112.2
155	R	34.4	Very low	34.8	Very low	191 Å²	191	145.1 Å²	145.1	72%	0.721	76%	0.756	S	S	*	*			trans	78.9	157.3	161.6	-49.2	-177.4	-171.1	146	20.4	120.8
156	D	36.5	Very low	34.8	Very low	144 Å²	144	142.6 Å²	142.6	77%	0.77	76%	0.757	S	S	*	*			trans	62.6	84.4	148.5	-61.1	-18.7	0	0	0	123.5
157	A	35.4	Very low	34.6	Very low	83 Å²	83	145.4 Å²	145.4	69%	0.686	76%	0.758	S	S	*	*				82.7	143.9	108.3	0	0	0	0	0	123
158	N	36	Very low	34.6	Very low	130 Å²	130	147.3 Å²	147.3	70%	0.695	77%	0.766	S	S	*	*			trans	77.8	112.6	155.8	-77.7	-59.1	0	0	0	121.8
159	K	35.7	Very low	34.5	Very low	186 Å²	186	146.6 Å²	146.6	81%	0.809	77%	0.769	S	S	*	*			trans	74.3	105.9	130.8	-67.5	175.6	-177.8	174.6	0	120.9
160	A	36.5	Very low	34.5	Very low	88 Å²	88	146 Å²	146	73%	0.727	77%	0.771	S	S	*	*				83.3	91.7	114.8	0	0	0	0	0	121.1
161	S	36	Very low	34.4	Very low	102 Å²	102	149 Å²	149	71%	0.713	78%	0.777	S	S	*	*				96.3	151.9	115.6	85.9	0	0	0	0	121.2
162	N	37	Very low	34.5	Very low	118 Å²	118	151.4 Å²	151.4	63%	0.631	78%	0.782	S	S	*	*			trans	72	97.1	155.4	-74.3	-63.1	0	0	0	121.1
163	K	35.3	Very low	34.6	Very low	175 Å²	175	150 Å²	150	76%	0.761	78%	0.78	S	S	*	*				76.9	132.3	114.9	-80.1	176	-177.3	152	0	121.6
164	K	35	Very low	34.5	Very low	163 Å²	163	145.3 Å²	145.3	71%	0.709	77%	0.765	S	S	*	*			trans	91.3	121.5	133.9	-85.2	-177.5	166.2	-168.6	0	120.3
165	Q	33.5	Very low	34.6	Very low	173 Å²	173	146.2 Å²	146.2	81%	0.808	77%	0.772	S	S	*	*			trans	72	120.2	133.3	-66.3	172.9	-38	0	0	119.3
166	G	33.3	Very low	34.6	Very low	82 Å²	82	143.8 Å²	143.8	85%	0.845	77%	0.774	S	S	*	*			trans	-177.9	94	165.4	0	0	0	0	0	113.2
167	K	31.1	Very low	34.5	Very low	203 Å²	203	141.2 Å²	141.2	88%	0.883	77%	0.772	S	S	*	*			trans	-87.5	139.1	167.2	-67.1	178.8	177.6	178.7	0	109.7
168	K	34	Very low	34.3	Very low	217 Å²	217	144.8 Å²	144.8	94%	0.943	78%	0.775	S	S	*	*			trans	-170.1	176	138	-108.8	163.8	-175.2	-177.6	0	113.3
169	K	30.2	Very low	34.2	Very low	216 Å²	216	144.4 Å²	144.4	94%	0.939	77%	0.769	S	S	*	*			trans	-116	154.7	-169.5	-62.4	176.8	173.9	-176.7	0	112.4
170	G	34.4	Very low	34	Very low	69 Å²	69	145.9 Å²	145.9	71%	0.711	77%	0.769	S	S	*	*			trans	168.2	122.1	163.4	0	0	0	0	0	106.8
171	K	31.6	Very low	33.8	Very low	203 Å²	203	145 Å²	145	88%	0.883	77%	0.769	S	S	*	*			cis	79.6	141.9	27.7	-139.5	-168.4	-173.2	-162.6	0	113.3
172	L	36.5	Very low	33.6	Very low	153 Å²	153	149.9 Å²	149.9	80%	0.801	78%	0.781	S	S	*	*			trans	76.7	142.4	-157.7	-49.3	160	0	0	0	111.1
173	N	34.2	Very low	33.2	Very low	147 Å²	147	154 Å²	154	79%	0.786	79%	0.793	S	S	*	*			cis	-167	169	-13.8	-105.7	6.4	0	0	0	106.3
174	A	35.5	Very low	33.1	Very low	73 Å²	73	150.3 Å²	150.3	60%	0.603	80%	0.795	S	S	*	*			cis	-173.1	-174.9	-20.9	0	0	0	0	0	107.2
175	I	35.5	Very low	32.8	Very low	154 Å²	154	149.6 Å²	149.6	79%	0.79	80%	0.799	S	S	*	*			trans	70.3	121.9	169.4	-52.8	169.3	0	0	0	114
176	D	33.1	Very low	32.9	Very low	141 Å²	141	149.8 Å²	149.8	75%	0.754	80%	0.804	S	S	*	*			cis	-143.6	143.6	-9.4	-80.3	-29.6	0	0	0	105.7
177	A	34.1	Very low	32.9	Very low	89 Å²	89	153.7 Å²	153.7	74%	0.736	80%	0.8	S	S	*	*				64.2	137.6	65.2	0	0	0	0	0	115.9
178	E	31.8	Very low	32.9	Very low	158 Å²	158	152.6 Å²	152.6	74%	0.738	80%	0.798	S	S	*	*			cis	-172.1	153.1	-11.2	-99.7	-85.5	102	0	0	106
179	Q	33.5	Very low	32.8	Very low	123 Å²	123	151.6 Å²	151.6	58%	0.575	79%	0.794	S	S	*	*			cis	-155.6	-103.7	-10	-162.3	-159.2	119.1	0	0	113.1
180	R	31.9	Very low	32.7	Very low	216 Å²	216	147.4 Å²	147.4	82%	0.815	79%	0.786	S	S	*	*			trans	-119	174	-178.6	-64.2	164.1	-174.7	133.4	-12.5	108.9
181	G	31.7	Very low	32.6	Very low	71 Å²	71	152.7 Å²	152.7	73%	0.732	79%	0.793	S	S	*	*			cis	114	114.6	6.6	0	0	0	0	0	112.2
182	Q	31.9	Very low	32.5	Very low	204 Å²	204	149 Å²	149	95%	0.953	79%	0.787	S	S	*	*			trans	-157.5	154.9	177.7	-112.5	171.9	21.8	0	0	113.4
183	K	30	Very low	32	Very low	203 Å²	203	146.9 Å²	146.9	88%	0.883	78%	0.784	S	S	*	*			trans	-113.4	154.3	165.8	-69.5	-176.4	174.5	-171.2	0	109.1
184	A	33.1	Very low	32	Very low	98 Å²	98	146.7 Å²	146.7	81%	0.81	78%	0.783	S	S	*	*			trans	-157.2	145.9	151.7	0	0	0	0	0	110.1
185	D	28.6	Very low	31.7	Very low	149 Å²	149	147.7 Å²	147.7	80%	0.797	79%	0.785	S	S	*	*			trans	-84.7	155	-172.8	-44.3	-80.8	0	0	0	113.1
186	I	35.9	Very low	31.6	Very low	177 Å²	177	150.3 Å²	150.3	91%	0.908	79%	0.791	S	S	*	*			trans	-130.7	137.3	151	-64.4	-175	0	0	0	107.4
187	Q	33.5	Very low	31.5	Very low	163 Å²	163	152.1 Å²	152.1	76%	0.762	80%	0.797	S	S	*	*			trans	-93.9	150.4	-167.1	-66.9	165	-33.6	0	0	113.1
188	Q	30.2	Very low	31.6	Very low	181 Å²	181	155.9 Å²	155.9	85%	0.846	81%	0.805	S	S	*	*			trans	37.7	120.3	142.9	-63.7	176.1	-13	0	0	119.5
189	K	31.6	Very low	31.6	Very low	195 Å²	195	152.7 Å²	152.7	85%	0.848	80%	0.8	S	S	*	*				-153.8	127	122.9	-114.6	-179.6	-178.7	-165.2	0	111.7
190	T	27.6	Very low	31.6	Very low	128 Å²	128	152.5 Å²	152.5	79%	0.785	80%	0.803	S	S	*	*			trans	-95.8	137.8	169.3	46.4	0	0	0	0	109.5
191	E	33.5	Very low	31.7	Very low	180 Å²	180	151.3 Å²	151.3	84%	0.841	80%	0.798	S	S	*	*			trans	-127.2	155.1	161.5	-69.3	-173.6	169.7	0	0	108.9
192	V	29.7	Very low	31.7	Very low	126 Å²	126	155.3 Å²	155.3	76%	0.764	80%	0.798	S	S	*	*			trans	-143	156.6	-155.6	170.1	0	0	0	0	109.4
193	C	26.4	Very low	31.5	Very low	109 Å²	109	151.7 Å²	151.7	74%	0.736	79%	0.79	S	S	*	*			trans	70.5	160.5	175.8	-87.9	0	0	0	0	115.2
194	D	32.6	Very low	31.6	Very low	143 Å²	143	151.2 Å²	151.2	77%	0.765	79%	0.791	S	S	*	*			cis	-143.6	170	11.5	-137.8	-30	0	0	0	114.7
195	S	29.5	Very low	31.3	Very low	94 Å²	94	155 Å²	155	66%	0.657	79%	0.792	S	S	*	*			trans	-81.3	158.6	-176.9	64.3	0	0	0	0	115.1
196	K	34.7	Very low	31.5	Very low	209 Å²	209	157.5 Å²	157.5	91%	0.909	80%	0.796	S	S	*	*			trans	-166.6	149.9	136.1	-108.8	153.7	-169.9	168.6	0	114
197	M	30.6	Very low	31.1	Very low	178 Å²	178	155.5 Å²	155.5	88%	0.877	79%	0.787	S	S	*	*			trans	-81.9	161.3	171.9	-57.3	170.9	176.1	0	0	110.5
198	D	35.6	Very low	31.1	Very low	168 Å²	168	157.2 Å²	157.2	90%	0.898	79%	0.788	S	S	*	*				-154.9	164.7	115.6	-119.4	-36.4	0	0	0	111.6
199	S	30.8	Very low	31.1	Very low	92 Å²	92	156.7 Å²	156.7	64%	0.643	79%	0.785	S	S	*	*			trans	-124.9	155.9	-166.6	64.7	0	0	0	0	113.5
200	N	35.2	Very low	31	Very low	119 Å²	119	154.9 Å²	154.9	64%	0.636	78%	0.784	S	S	*	*			trans	174.4	136.6	131.7	-98.8	-73.8	0	0	0	112.3
201	R	34.1	Very low	31.2	Very low	190 Å²	190	156.8 Å²	156.8	72%	0.717	79%	0.79	S	S	*	*				44.1	147.8	128.2	-64.2	-175	153.5	107.2	-3.4	122.1
202	E	31.8	Very low	30.9	Very low	156 Å²	156	157.2 Å²	157.2	73%	0.729	79%	0.792	S	S	*	*			cis	-158.7	162.9	-7.7	-120.7	153.8	-164.6	0	0	109.8
203	T	26.1	Very low	31.1	Very low	127 Å²	127	160.5 Å²	160.5	78%	0.779	80%	0.799	S	S	*	*			trans	-76.2	146.6	179.5	46.5	0	0	0	0	114.2
204	Q	32.8	Very low	31.2	Very low	194 Å²	194	160.4 Å²	160.4	91%	0.907	80%	0.799	S	S	*	*			trans	-154.4	135.2	139.1	-121.9	160	100.9	0	0	112.9
205	Q	27.1	Very low	31.3	Very low	177 Å²	177	160.4 Å²	160.4	83%	0.827	80%	0.804	S	S	*	*			trans	-94.5	154.6	175.9	-60.7	159.6	-51.3	0	0	110.4
206	K	32.5	Very low	31.5	Very low	202 Å²	202	165.3 Å²	165.3	88%	0.878	81%	0.814	S	S	*	*			trans	-162.6	157.6	140.6	-110.7	157.1	-172.4	175.5	0	112
207	N	26.4	Very low	31.4	Very low	135 Å²	135	161.3 Å²	161.3	72%	0.722	81%	0.809	S	S	*	*			trans	-96	-165.2	-170.6	-56.8	-14.3	0	0	0	111.6
208	Y	34.2	Very low	31.7	Very low	199 Å²	199	161.9 Å²	161.9	78%	0.78	81%	0.81	S	S	*	*			trans	80.4	137.1	173.4	-53.9	-75.7	0	0	0	115.2
209	E	31.3	Very low	31.5	Very low	170 Å²	170	163.3 Å²	163.3	79%	0.794	81%	0.811	S	S	*	*			cis	-153.6	-167.4	-24.1	-159.4	143	-138	0	0	108.5
210	L	28.9	Very low	31.8	Very low	156 Å²	156	166.5 Å²	166.5	82%	0.817	82%	0.819	S	S	*	*			trans	-69.4	145.4	175.8	-68.1	160	0	0	0	111.8
211	D	31.1	Very low	31.6	Very low	169 Å²	169	168.2 Å²	168.2	90%	0.904	83%	0.828	S	S	*	*			trans	-161.6	150.9	137.3	-102.4	-28.7	0	0	0	110.5
212	E	28.3	Very low	31.7	Very low	189 Å²	189	166.5 Å²	166.5	88%	0.883	83%	0.833	S	S	*	*			trans	-101.5	130.8	177.3	-58.2	-176.9	135.1	0	0	110.2
213	E	32.8	Very low	31.8	Very low	195 Å²	195	166.6 Å²	166.6	91%	0.911	84%	0.839	S	S	*	*			trans	-167.3	168.1	136.7	-116.4	-178.6	-174	0	0	114.4
214	S	28.4	Very low	32.1	Very low	106 Å²	106	168.1 Å²	168.1	74%	0.741	84%	0.835	S	S	*	*			trans	-83.8	149.5	-165.9	64.3	0	0	0	0	115.8
215	T	34.5	Very low	32.3	Very low	143 Å²	143	168.7 Å²	168.7	88%	0.877	83%	0.83	S	S	*	*			trans	-146.5	165	150.5	2.9	0	0	0	0	111.3
216	K	33.3	Very low	32.6	Very low	197 Å²	197	165.6 Å²	165.6	86%	0.857	82%	0.824	S	S	*	*			trans	-95.8	159.7	-169.4	-78.5	178.2	-179.9	175.5	0	112.5
217	P	33.3	Very low	32.4	Very low	125 Å²	125	165 Å²	165	81%	0.812	82%	0.821	S	S	*	*			trans	-79.8	157.6	-172.4	33.5	-37.1	0	0	0	113.3
218	E	36.2	Very low	32.7	Very low	191 Å²	191	167.8 Å²	167.8	89%	0.893	83%	0.827	S	S	*	*			trans	-105.7	147.6	163	-66.5	-171.8	138.9	0	0	110.3
219	E	32.9	Very low	32.7	Very low	197 Å²	197	169.1 Å²	169.1	92%	0.921	83%	0.831	S	S	*	*			trans	-92.6	137.9	178.9	-62.8	169.8	137	0	0	110
220	I	36.7	Very low	32.6	Very low	160 Å²	160	170.8 Å²	170.8	82%	0.821	84%	0.835	S	S	*	*			trans	-135.2	110.6	167.8	-60.3	-178.1	0	0	0	108.2
221	D	31.8	Very low	32.7	Very low	154 Å²	154	168.7 Å²	168.7	82%	0.824	84%	0.84	S	S	*	*			trans	-65.3	147.1	165.4	-79.3	-47.8	0	0	0	111
222	D	35.9	Very low	32.8	Very low	154 Å²	154	164.3 Å²	164.3	82%	0.824	84%	0.835	S	S	*	*			trans	-153.8	94.4	148.3	-127.6	-24.9	0	0	0	112	F224	D222-F224 PolarHBondContact O-N 3.25Å
223	D	33.1	Very low	32.9	Very low	158 Å²	158	167.6 Å²	167.6	85%	0.845	84%	0.839	S	S	*	*			trans	-81.5	88.6	-177.2	-176.4	22.6	0	0	0	111.3
224	F	33.2	Very low	32.9	Very low	160 Å²	160	161.7 Å²	161.7	70%	0.702	83%	0.83	S	S	*	*			trans	-133.5	140.3	-178.2	-137.4	-121.8	0	0	0	115.3	D222	D222-F224 PolarHBondContact O-N 3.25Å
225	Y	36.8	Very low	33.2	Very low	205 Å²	205	166.4 Å²	166.4	80%	0.804	84%	0.837	S	S	*	*			trans	71.8	65.6	178.7	-73.2	-69.3	0	0	0	120
226	T	33	Very low	33.1	Very low	113 Å²	113	167.4 Å²	167.4	69%	0.693	83%	0.832	S	S	*	*			trans	-130.7	158.5	136.2	69.8	0	0	0	0	113.2
227	K	28.9	Very low	33.1	Very low	189 Å²	189	166.1 Å²	166.1	82%	0.822	83%	0.827	S	S	*	*			trans	69.9	95.3	166.1	-55.5	157.9	-171.8	149.4	0	119.4
228	K	33.1	Very low	33.1	Very low	194 Å²	194	168.2 Å²	168.2	84%	0.843	83%	0.825	S	S	*	*			trans	-168	144.6	135.6	-94.8	142.9	-173.9	169.4	0	106.2
229	R	33.1	Very low	32.9	Very low	227 Å²	227	162.6 Å²	162.6	86%	0.857	82%	0.819	S	S	*	*			cis	-154.3	162.2	10.9	-126.2	159.6	178.7	169.1	-3.5	110.4
230	K	28.8	Very low	33	Very low	205 Å²	205	158.3 Å²	158.3	89%	0.891	81%	0.808	S	S	*	*			trans	-137.1	161	162.4	-92.6	-171.8	176.6	179.3	0	109.8
231	A	31.9	Very low	33	Very low	111 Å²	111	158.6 Å²	158.6	92%	0.917	81%	0.806	S	S	*	*			trans	83.9	148.1	168.8	0	0	0	0	0	119.5
232	G	32.9	Very low	33.3	Very low	77 Å²	77	160 Å²	160	79%	0.794	81%	0.807	S	S	*	*			trans	94.8	104.8	179.6	0	0	0	0	0	113.8
233	R	30	Very low	33.1	Very low	259 Å²	259	156.1 Å²	156.1	98%	0.977	80%	0.803	S	S	*	*			cis	101.1	86.2	13.7	-161.1	-168.4	-170.8	-170.4	4.3	116.1
234	G	32.5	Very low	33	Very low	70 Å²	70	157.3 Å²	157.3	72%	0.722	80%	0.804	S	S	*	*			trans	141.1	123.5	138	0	0	0	0	0	121.2
235	K	35.1	Very low	33.2	Very low	205 Å²	205	157.8 Å²	157.8	89%	0.891	81%	0.813	S	S	*	*			trans	68.9	161	149.6	-58.6	179.3	-179.8	179.5	0	120
236	Q	32.5	Very low	33.1	Very low	165 Å²	165	152.7 Å²	152.7	77%	0.771	81%	0.805	S	S	*	*			cis	-173.8	155.5	-43	-153.6	175.2	12	0	0	110.6
237	K	33.4	Very low	33.2	Very low	169 Å²	169	155 Å²	155	74%	0.735	81%	0.813	S	S	*	*			trans	79.4	151.7	169.1	-56.7	177.9	167.9	-166.6	0	116.9
238	Q	34.6	Very low	33.5	Very low	169 Å²	169	154.2 Å²	154.2	79%	0.79	81%	0.813	S	S	*	*			cis	-158.2	163.5	-18.7	-110	163.4	-36	0	0	109.2
239	G	31	Very low	33.6	Very low	73 Å²	73	152.9 Å²	152.9	75%	0.753	82%	0.815	S	S	*	*			trans	-92.2	-149.9	-176	0	0	0	0	0	115.7
240	P	36.2	Very low	33.7	Very low	108 Å²	108	146.2 Å²	146.2	70%	0.701	81%	0.808	S	S	*	*			cis	-146.2	-173.4	14.6	45	-25.2	0	0	0	118.7
241	E	35.5	Very low	33.9	Very low	165 Å²	165	143 Å²	143	77%	0.771	81%	0.806	S	S	*	*			trans	62.7	135.5	149.9	-75.9	154.5	-164.5	0	0	121.7
242	H	37.6	Very low	34.1	Very low	184 Å²	184	141.7 Å²	141.7	85%	0.852	80%	0.803	S	S	*	*				-171.8	148.5	53	-119.9	-63.6	0	0	0	114.2
243	G	33.2	Very low	34.1	Very low	72 Å²	72	147.7 Å²	147.7	74%	0.742	81%	0.807	S	S	*	*			trans	78.9	150.8	165	0	0	0	0	0	116.8
244	E	30.9	Very low	34.4	Very low	183 Å²	183	145.5 Å²	145.5	86%	0.855	81%	0.805	S	S	*	*			cis	86.8	120.1	-5.2	-163.8	161.4	-139.3	0	0	122.5
245	L	35.8	Very low	34.5	Very low	170 Å²	170	151.2 Å²	151.2	89%	0.89	81%	0.81	S	S	*	*			trans	-163.4	118.9	155.1	-126.3	-177.2	0	0	0	111.6
246	P	35.1	Very low	34.3	Very low	99 Å²	99	150.5 Å²	150.5	64%	0.643	81%	0.807	S	S	*	*			trans	-129.1	155.6	165.9	38	-26.1	0	0	0	113.3
247	N	36.3	Very low	34.3	Very low	160 Å²	160	152.1 Å²	152.1	86%	0.856	81%	0.814	S	S	*	*			trans	-133.6	143.3	177.9	-153.3	-8.9	0	0	0	113.1
248	Q	34.7	Very low	34.3	Very low	174 Å²	174	153.3 Å²	153.3	81%	0.813	82%	0.819	S	S	*	*			trans	-122.5	138.8	-177.6	-60	179.3	15.7	0	0	110.3
249	N	34.9	Very low	34.3	Very low	166 Å²	166	151.6 Å²	151.6	89%	0.888	82%	0.823	S	S	*	*			trans	179.5	153.9	154.1	-98.3	-43.9	0	0	0	109.3
250	A	34.8	Very low	34.4	Very low	87 Å²	87	152 Å²	152	72%	0.719	83%	0.827	S	S	*	*			cis	-145.5	160.8	-1.7	0	0	0	0	0	111.4
251	T	33.8	Very low	34.2	Very low	138 Å²	138	156.8 Å²	156.8	85%	0.847	84%	0.837	S	S	*	*			trans	-86.3	111.1	179.8	54.5	0	0	0	0	113.6
252	G	35.3	Very low	34.2	Very low	83 Å²	83	158.1 Å²	158.1	86%	0.856	84%	0.84	S	S	*	*			trans	-94.4	96.9	177	0	0	0	0	0	115
253	K	32.9	Very low	34	Very low	203 Å²	203	158.5 Å²	158.5	88%	0.883	84%	0.839	S	S	*	*			trans	-84.7	115.6	169.5	-72.3	175.7	-178.3	166.3	0	111.3
254	K	35.9	Very low	33.9	Very low	212 Å²	212	162.1 Å²	162.1	92%	0.922	84%	0.837	S	S	*	*			trans	-120.8	150.2	157.9	-81.8	-173.8	175.8	177.2	0	111.6
255	K	34.8	Very low	34	Very low	190 Å²	190	161.4 Å²	161.4	83%	0.826	84%	0.838	S	S	*	*			trans	-110.5	150.8	-167.7	-73.8	171.5	176.9	167.3	0	111
256	K	31.3	Very low	33.9	Very low	190 Å²	190	159.9 Å²	159.9	83%	0.826	83%	0.831	S	S	*	*			trans	47.1	125.7	148.1	-65.4	176.9	176.4	-175.3	0	118.3
257	Q	32.9	Very low	33.8	Very low	199 Å²	199	158.3 Å²	158.3	93%	0.93	83%	0.833	S	S	*	*				-158.1	174.5	101.9	-104.9	174.2	52.1	0	0	111.3
258	K	33	Very low	33.7	Very low	195 Å²	195	160 Å²	160	85%	0.848	83%	0.833	S	S	*	*			trans	-105.4	154.1	-173.7	-71.6	-179.7	175	-178.8	0	110.9
259	P	34.1	Very low	33.6	Very low	133 Å²	133	158 Å²	158	86%	0.864	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-68	141.8	166	30.4	-34.7	0	0	0	111.1
260	G	33.4	Very low	33.4	Very low	81 Å²	81	154.6 Å²	154.6	84%	0.835	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-103.9	135.9	178	0	0	0	0	0	112.5
261	K	31.9	Very low	33.3	Very low	208 Å²	208	159.9 Å²	159.9	90%	0.904	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-85.2	142.1	172.2	-69.9	-177.7	171.9	-171.9	0	111.5
262	K	35	Very low	33.2	Very low	194 Å²	194	161.7 Å²	161.7	84%	0.843	83%	0.826	S	S	*	*			trans	-133.9	124.9	144.4	-74.8	-172.8	178.2	178.1	0	106.8
263	K	33.6	Very low	32.9	Very low	192 Å²	192	165.9 Å²	165.9	84%	0.835	82%	0.823	S	S	*	*				60.7	107.9	109.1	-63	-162.5	169.4	-158.5	0	112
264	H	32.3	Very low	33	Very low	148 Å²	148	163.8 Å²	163.8	69%	0.685	82%	0.822	S	S	*	*			cis	69.1	102	41	-145.1	-38.3	0	0	0	111.6	D266	H264-D266 IonicContact CE1-OD1 3.39Å; H264-D266 PolarHBondContact CE1-OD1 3.44Å; H264-D266 IonicContact CE1-OD2 3.03Å; H264-D266 PolarHBondContact CE1-OD2 3.3Å; H264-D266 IonicContact ND1-OD1 3.68Å; H264-D266 IonicContact ND1-OD2 2.82Å; H264-D266 PolarHBondContact ND1-OD2 3.41Å
265	D	33	Very low	32.9	Very low	167 Å²	167	160.2 Å²	160.2	89%	0.893	81%	0.812	S	S	*	*			trans	-150	154.4	149.9	-84.1	-44.6	0	0	0	105.8
266	D	33.2	Very low	32.6	Very low	138 Å²	138	158.9 Å²	158.9	74%	0.738	81%	0.814	S	S	*	*			trans	-126.8	152	-159.4	-61.9	-93.8	0	0	0	113.5	H264	H264-D266 IonicContact CE1-OD1 3.39Å; H264-D266 PolarHBondContact CE1-OD1 3.44Å; H264-D266 IonicContact CE1-OD2 3.03Å; H264-D266 PolarHBondContact CE1-OD2 3.3Å; H264-D266 IonicContact ND1-OD1 3.68Å; H264-D266 IonicContact ND1-OD2 2.82Å; H264-D266 PolarHBondContact ND1-OD2 3.41Å
267	G	33.1	Very low	32.7	Very low	67 Å²	67	153.4 Å²	153.4	69%	0.691	81%	0.812	S	S	*	*			trans	158.8	124.9	-178	0	0	0	0	0	108.6
268	F	33	Very low	32.7	Very low	195 Å²	195	152.5 Å²	152.5	86%	0.855	81%	0.812	S	S	*	*			cis	60	117.8	25.5	-110.3	-92.5	0	0	0	111.4
269	D	33.4	Very low	32.5	Very low	132 Å²	132	147.8 Å²	147.8	71%	0.706	81%	0.81	S	S	*	*			cis	-134.2	-169.3	16.5	-142.3	-28.1	0	0	0	113.7
270	S	30.6	Very low	32.2	Very low	94 Å²	94	151.7 Å²	151.7	66%	0.657	81%	0.813	S	S	*	*			trans	-65.2	149.8	178.2	60.8	0	0	0	0	115.1
271	E	33.9	Very low	32.1	Very low	199 Å²	199	152.3 Å²	152.3	93%	0.93	81%	0.811	S	S	*	*			trans	-153.9	170.6	138.1	-124.7	154.2	-142.3	0	0	112.8
272	Q	30.3	Very low	32.1	Very low	175 Å²	175	151.2 Å²	151.2	82%	0.818	81%	0.811	S	S	*	*			trans	-153	148.1	-167.9	178.6	-179.2	-38.6	0	0	108.7
273	E	30.2	Very low	31.8	Very low	172 Å²	172	148.3 Å²	148.3	80%	0.804	81%	0.809	S	S	*	*			trans	95.3	167.5	-167.7	-56	179.4	-176.7	0	0	113.1
274	D	34.3	Very low	31.6	Very low	158 Å²	158	145.1 Å²	145.1	85%	0.845	81%	0.806	S	S	*	*			trans	90.2	88.3	-153.3	-68.5	-12	0	0	0	113.4
275	L	34.1	Very low	31.5	Very low	138 Å²	138	144 Å²	144	72%	0.723	81%	0.81	S	S	*	*			cis	71.5	111.7	41.7	-88.1	167.4	0	0	0	116.1	G277	L275-G277 PolarHBondContact O-N 3.13Å
276	D	28.6	Very low	31.2	Very low	161 Å²	161	141.1 Å²	141.1	86%	0.861	80%	0.802	S	S	*	*			trans	38.1	66.6	146.2	-60.5	-3.6	0	0	0	119.3
277	G	32	Very low	31.4	Very low	76 Å²	76	142 Å²	142	78%	0.784	81%	0.806	S	S	*	*			trans	-122.4	14.8	-176.9	0	0	0	0	0	118.2	L275	L275-G277 PolarHBondContact O-N 3.13Å
278	L	33.1	Very low	31.3	Very low	179 Å²	179	146 Å²	146	94%	0.937	81%	0.812	S	S	*	*			trans	-127.5	29.3	-166.8	-105.6	169.2	0	0	0	116.7
279	A	29.1	Very low	31.4	Very low	97 Å²	97	142.1 Å²	142.1	80%	0.802	81%	0.808	S	S	*	*	S	Bend	trans	-127.1	47.2	-179.3	0	0	0	0	0	113.7
280	K	27.9	Very low	31.3	Very low	214 Å²	214	144.7 Å²	144.7	93%	0.93	82%	0.816	S	S	*	*			trans	-159.8	45	175.8	-119.4	163	-171.2	175.5	0	116.7
281	A	31.9	Very low	31.6	Very low	95 Å²	95	147.5 Å²	147.5	79%	0.785	82%	0.823	S	S	*	*			trans	-150.3	141.6	161.9	0	0	0	0	0	108.6
282	M	31.3	Very low	31.6	Very low	185 Å²	185	145 Å²	145	91%	0.911	82%	0.816	S	S	*	*			cis	-121.6	157.5	-0.8	-63.6	168.1	124.6	0	0	110.2
283	T	28.9	Very low	31.8	Very low	132 Å²	132	144.2 Å²	144.2	81%	0.81	82%	0.817	S	S	*	*			trans	-146.5	119.8	177.2	-49.6	0	0	0	0	110.4
284	V	28.7	Very low	32.1	Very low	125 Å²	125	144.4 Å²	144.4	76%	0.758	82%	0.823	S	S	*	*			trans	50.6	114.9	162.4	179.7	0	0	0	0	118
285	V	30.9	Very low	31.8	Very low	126 Å²	126	143.9 Å²	143.9	76%	0.764	82%	0.82	S	S	*	*				-138.6	124.9	125.5	-177.9	0	0	0	0	108	L287	V285-L287 HydrophobicContact CG1-CD1 4.12Å; V285-L287 HydrophobicContact CG1-CG 4.2Å
286	S	27.4	Very low	31.8	Very low	105 Å²	105	144.2 Å²	144.2	73%	0.734	82%	0.821	S	S	*	*			trans	-117.4	133.3	160.2	-58.9	0	0	0	0	107
287	L	37.4	Very low	31.7	Very low	156 Å²	156	144.6 Å²	144.6	82%	0.817	82%	0.818	S	S	*	*			trans	-149.5	112.9	175.5	-90.5	173.2	0	0	0	109.6	V285	V285-L287 HydrophobicContact CG1-CD1 4.12Å; V285-L287 HydrophobicContact CG1-CG 4.2Å
288	D	29.9	Very low	31.5	Very low	152 Å²	152	146.2 Å²	146.2	81%	0.813	82%	0.817	S	S	*	*			trans	-98.8	134.2	170.4	-53.1	-69	0	0	0	109.5
289	S	34.7	Very low	31.4	Very low	113 Å²	113	144.3 Å²	144.3	79%	0.79	81%	0.813	S	S	*	*			trans	-161	114.1	155.3	-45.4	0	0	0	0	111.1
290	E	31.5	Very low	31.2	Very low	186 Å²	186	148.7 Å²	148.7	87%	0.869	81%	0.814	S	S	*	*			trans	4.3	138.2	145.8	-61	163.6	172.6	0	0	119.8
291	I	37.5	Very low	31.3	Very low	154 Å²	154	148.7 Å²	148.7	79%	0.79	82%	0.815	S	S	*	*				-168.5	136.7	121.6	-102.8	161.7	0	0	0	112.4
292	D	35	Very low	31.1	Very low	147 Å²	147	151.6 Å²	151.6	79%	0.786	82%	0.817	S	S	*	*			trans	58	130.3	163.8	-60.4	-4.2	0	0	0	122.8
293	D	33.2	Very low	31.1	Very low	157 Å²	157	146.4 Å²	146.4	84%	0.84	81%	0.811	S	S	*	*			trans	-75.2	157.1	176.4	-51.9	-82	0	0	0	114.4
294	L	36.9	Very low	31	Very low	177 Å²	177	149.7 Å²	149.7	93%	0.927	81%	0.814	S	S	*	*			trans	-168.7	126.2	132.3	-107.3	166.7	0	0	0	111.8
295	D	28	Very low	30.8	Very low	146 Å²	146	148.9 Å²	148.9	78%	0.781	81%	0.814	S	S	*	*			trans	-67.3	143.3	176.2	-88.4	-56.9	0	0	0	113.5
296	L	34.1	Very low	30.6	Very low	145 Å²	145	147.1 Å²	147.1	76%	0.759	81%	0.813	S	S	*	*				176.9	110.2	112.6	-96.3	151.3	0	0	0	113.7
297	Q	26	Very low	30.7	Very low	169 Å²	169	150.7 Å²	150.7	79%	0.79	82%	0.822	S	S	*	*			trans	31.9	106.9	139.7	-59.1	175.3	8.5	0	0	119.8
298	S	28.8	Very low	30.2	Very low	110 Å²	110	148.1 Å²	148.1	77%	0.769	82%	0.816	S	S	*	*				173.8	138.8	105.9	43.9	0	0	0	0	114.5
299	T	29.8	Very low	30.1	Very low	139 Å²	139	147.5 Å²	147.5	85%	0.853	81%	0.812	S	S	*	*			trans	28.4	99.7	157.4	53.6	0	0	0	0	119.8
300	K	26.3	Very low	29.7	Very low	190 Å²	190	148.4 Å²	148.4	83%	0.826	81%	0.807	S	S	*	*			trans	-99.4	151.5	147.6	-70.5	-175.5	178.6	-179.6	0	109.8
301	F	30.3	Very low	29.8	Very low	213 Å²	213	148 Å²	148	93%	0.934	81%	0.806	S	S	*	*			trans	-138.3	63.8	169.1	-137.1	-75.8	0	0	0	111.4
302	D	26.9	Very low	29.3	Very low	157 Å²	157	150 Å²	150	84%	0.84	81%	0.811	S	S	*	*			trans	-94.4	133.4	163	-81.3	-55.6	0	0	0	108.7
303	G	30.6	Very low	29.1	Very low	75 Å²	75	148.7 Å²	148.7	77%	0.773	81%	0.808	S	S	*	*			trans	-161.6	75.6	-173.5	0	0	0	0	0	113.1
304	F	26.5	Very low	28.8	Very low	202 Å²	202	147.7 Å²	147.7	89%	0.886	81%	0.808	S	S	*	*			trans	-116.7	126.4	178.6	-136.7	-81.6	0	0	0	111.4
305	S	25.8	Very low	28.8	Very low	107 Å²	107	145.2 Å²	145.2	75%	0.748	80%	0.8	S	S	*	*			trans	68.6	149	162.9	68.1	0	0	0	0	121.3
306	A	27	Very low	28.7	Very low	90 Å²	90	145.4 Å²	145.4	74%	0.744	80%	0.801	S	S	*	*			trans	73.2	96	157.3	0	0	0	0	0	120.9
307	I	29.6	Very low	28.7	Very low	179 Å²	179	145.9 Å²	145.9	92%	0.918	80%	0.804	S	S	*	*			trans	-126.9	153.2	139.4	-78.3	179.4	0	0	0	107.4
308	C	26.2	Very low	28.9	Very low	103 Å²	103	145.5 Å²	145.5	70%	0.696	80%	0.803	S	S	*	*			trans	-120.8	160.9	-164	-60.8	0	0	0	0	114.5
309	L	27.4	Very low	29	Very low	139 Å²	139	147.3 Å²	147.3	73%	0.728	80%	0.804	S	S	*	*			trans	34.4	123.9	142.4	-69.3	160.8	0	0	0	120.7
310	D	27.4	Very low	29.3	Very low	131 Å²	131	147.5 Å²	147.5	70%	0.701	81%	0.805	S	S	*	*			trans	45.8	123.7	131.4	-51.3	-5.6	0	0	0	120.7
311	H	32.5	Very low	29.5	Very low	179 Å²	179	142.5 Å²	142.5	83%	0.829	80%	0.799	S	S	*	*				-169.8	135.4	109.4	-110	-76.3	0	0	0	113.6
312	H	27.8	Very low	29.8	Very low	195 Å²	195	140.7 Å²	140.7	90%	0.903	80%	0.799	S	S	*	*			trans	-75.9	117.1	159.1	-96.9	-81	0	0	0	109.7
313	T	30.4	Very low	30.1	Very low	119 Å²	119	139.7 Å²	139.7	73%	0.73	79%	0.794	S	S	*	*			trans	-147.8	125.4	160.5	-22.8	0	0	0	0	110.9
314	T	26.6	Very low	30.4	Very low	137 Å²	137	143.1 Å²	143.1	84%	0.84	80%	0.799	S	S	*	*			trans	-83	125.8	172.9	44.7	0	0	0	0	111
315	V	35.8	Very low	30.7	Very low	125 Å²	125	140.7 Å²	140.7	76%	0.758	79%	0.791	S	S	*	*			trans	-137.5	119.5	164.2	179.1	0	0	0	0	108.1
316	N	26.7	Very low	31.1	Very low	150 Å²	150	142.8 Å²	142.8	80%	0.802	79%	0.792	S	S	*	*			trans	-75.6	139.7	164.4	-71.1	-13.9	0	0	0	108.8
317	N	34.9	Very low	31.6	Very low	154 Å²	154	145.8 Å²	145.8	82%	0.824	79%	0.794	S	S	*	*			trans	-161.8	164.6	136.3	-99.8	-19.1	0	0	0	110.3
318	Q	28.8	Very low	31.8	Very low	162 Å²	162	141.9 Å²	141.9	76%	0.757	78%	0.783	S	S	*	*			trans	-101.4	174.4	-164.2	-63.2	158.7	-97.5	0	0	112.2
319	D	31.8	Very low	32.6	Very low	147 Å²	147	144.1 Å²	144.1	79%	0.786	79%	0.788	S	S	*	*			trans	66.1	127.9	166	-45.1	-36.3	0	0	0	115.2
320	T	35.6	Very low	33.2	Very low	143 Å²	143	144.6 Å²	144.6	88%	0.877	79%	0.791	S	S	*	*			cis	-141.6	165.2	37.1	37.8	0	0	0	0	113.5
321	A	30.7	Very low	34	Very low	86 Å²	86	143.3 Å²	143.3	71%	0.711	79%	0.79	S	S	*	*			trans	-99.4	160.9	175.5	0	0	0	0	0	112.4
322	D	37.8	Very low	34.3	Very low	174 Å²	174	142.6 Å²	142.6	93%	0.93	79%	0.791	S	S	*	*			trans	-151.9	136.1	145.8	-104.6	-34.4	0	0	0	109.1
323	D	31.7	Very low	34.7	Very low	136 Å²	136	141.4 Å²	141.4	73%	0.727	79%	0.786	S	S	*	*			trans	-95.6	143	-170.1	-82	-63.6	0	0	0	113.7
324	V	37.4	Very low	35	Very low	147 Å²	147	141.5 Å²	141.5	89%	0.891	79%	0.792	S	S	*	*			trans	-139.2	106	151.9	-177.5	0	0	0	0	109.7
325	Q	32.2	Very low	35.4	Very low	152 Å²	152	144.2 Å²	144.2	71%	0.71	79%	0.792	S	S	*	*			trans	-78.8	176.3	166.7	-56.3	175.1	-6.9	0	0	109.4
326	I	34.5	Very low	35.6	Very low	151 Å²	151	144.6 Å²	144.6	77%	0.774	80%	0.797	S	S	*	*			cis	-151.3	-176.9	19	4.5	171.7	0	0	0	106.2
327	I	38.8	Very low	35.8	Very low	152 Å²	152	145.5 Å²	145.5	78%	0.779	80%	0.796	S	S	*	*			cis	-136.5	166.3	17.6	-50.9	157.2	0	0	0	108.7
328	S	33.6	Very low	36	Very low	98 Å²	98	146.3 Å²	146.3	69%	0.685	80%	0.799	S	S	*	*			trans	-135.4	155.8	170.4	56.6	0	0	0	0	111
329	D	41.6	Very low	36.3	Very low	149 Å²	149	145.6 Å²	145.6	80%	0.797	80%	0.8	S	S	*	*			trans	-179.5	146.4	161.3	-85.7	-26.5	0	0	0	107.7
330	D	39.7	Very low	36.2	Very low	150 Å²	150	145.2 Å²	145.2	80%	0.802	80%	0.802	S	S	*	*			cis	-159.6	172.9	-25.5	-138.5	27.1	0	0	0	109.1
331	P	44.3	Very low	36.2	Very low	103 Å²	103	143.1 Å²	143.1	67%	0.669	80%	0.8	S	S	*	*			trans	-113.3	-174.3	-158.4	43.8	-39.8	0	0	0	116.7
332	L	39.7	Very low	36.1	Very low	164 Å²	164	148.9 Å²	148.9	86%	0.859	81%	0.809	S	S	*	*			trans	-168.9	177.2	139	-105	165.7	0	0	0	114
333	E	35.7	Very low	36.1	Very low	171 Å²	171	146.4 Å²	146.4	80%	0.799	81%	0.806	S	S	*	*			trans	-105.6	156.8	-154.3	-56.1	169.9	113.7	0	0	117.4
334	S	37.5	Very low	36.2	Very low	121 Å²	121	149.3 Å²	149.3	85%	0.846	81%	0.811	S	S	*	*				168	162.9	112.1	51.2	0	0	0	0	114.1
335	K	35.6	Very low	36.1	Very low	194 Å²	194	147.5 Å²	147.5	84%	0.843	80%	0.803	S	S	*	*			trans	-131	164.4	174.8	-73.5	-176.3	178.8	176.2	0	110.6
336	P	38.9	Very low	36.7	Very low	132 Å²	132	145.7 Å²	145.7	86%	0.857	80%	0.804	S	S	*	*				-131.1	178.4	117	37.1	-29.6	0	0	0	114.1
337	Q	31.3	Very low	36.6	Very low	170 Å²	170	145 Å²	145	79%	0.794	80%	0.801	S	S	*	*			trans	-104	156	-173.6	-59.3	156.2	-71.7	0	0	112
338	I	39.8	Very low	36.7	Very low	171 Å²	171	145.2 Å²	145.2	88%	0.877	80%	0.804	S	S	*	*			trans	-136.6	144.7	153.4	-62.5	-174.7	0	0	0	107.8
339	D	33.7	Very low	36.6	Very low	147 Å²	147	147 Å²	147	79%	0.786	81%	0.806	S	S	*	*			trans	-87	157.4	-156	-62.5	-77.6	0	0	0	117.8
340	V	29.6	Very low	36.5	Very low	138 Å²	138	147 Å²	147	84%	0.836	81%	0.806	S	S	*	*			trans	-100	104.6	168.6	177.3	0	0	0	0	109.9
341	A	35.8	Very low	36.1	Very low	100 Å²	100	146.1 Å²	146.1	83%	0.826	80%	0.799	S	S	*	*			trans	-86.4	129.3	175.5	0	0	0	0	0	112.1
342	K	30	Very low	35.4	Very low	206 Å²	206	148.5 Å²	148.5	90%	0.896	81%	0.806	S	S	*	*			trans	-94.9	137.7	172.9	-63.6	172.8	-178.7	172.5	0	110.2
343	S	35.9	Very low	35	Very low	123 Å²	123	145.1 Å²	145.1	86%	0.86	80%	0.797	S	S	*	*			trans	-132	152.5	163	56.5	0	0	0	0	110.7
344	K	33.7	Very low	34.8	Very low	196 Å²	196	143.7 Å²	143.7	85%	0.852	79%	0.794	S	S	*	*			trans	-105.4	157.8	-171.6	-75.6	176.9	174.6	179.5	0	111
345	P	35.7	Very low	34.6	Very low	110 Å²	110	143.3 Å²	143.3	71%	0.714	79%	0.786	S	S	*	*			trans	-70.9	153.3	171	32.1	-36.4	0	0	0	111.6
346	P	46.3	Very low	34.4	Very low	113 Å²	113	139.2 Å²	139.2	73%	0.734	77%	0.774	S	S	*	*			trans	-75.6	144.4	162.5	32.6	-32.3	0	0	0	110.7
347	I	32.2	Very low	34.1	Very low	138 Å²	138	141 Å²	141	71%	0.708	77%	0.768	S	S	*	*			trans	-122.7	116.6	163.7	-60.2	171.6	0	0	0	105
348	D	41	Very low	34	Very low	156 Å²	156	138.3 Å²	138.3	83%	0.834	77%	0.766	S	S	*	*			trans	-125.2	130.8	169.2	-75.1	-58.5	0	0	0	108.8
349	N	30.2	Very low	33.8	Very low	136 Å²	136	134.4 Å²	134.4	73%	0.727	76%	0.755	S	S	*	*			trans	-118.3	115.7	178	-64.9	-83.8	0	0	0	108.9
350	D	39	Very low	33.7	Very low	149 Å²	149	132.5 Å²	132.5	80%	0.797	75%	0.748	S	S	*	*			trans	-149.2	106.8	155.6	-92.5	-44.9	0	0	0	106.4
351	I	32.3	Very low	34	Very low	131 Å²	131	133 Å²	133	67%	0.672	75%	0.752	S	S	*	*				72.9	111.5	77.7	-67.5	176.3	0	0	0	112.2
352	N	29.4	Very low	33.8	Very low	152 Å²	152	133.9 Å²	133.9	81%	0.813	74%	0.742	S	S	*	*			trans	64.9	130.4	162.9	-64.4	-22.5	0	0	0	117.4
353	S	31.5	Very low	34.1	Very low	94 Å²	94	132.3 Å²	132.3	66%	0.657	74%	0.742	S	S	*	*			cis	-176.9	167.5	11.9	48.2	0	0	0	0	113.8
354	L	31.9	Very low	33.7	Very low	141 Å²	141	134.6 Å²	134.6	74%	0.738	74%	0.737	S	S	*	*			trans	67.8	122.8	147.4	-72.9	159.3	0	0	0	121.6
355	T	32.1	Very low	33.8	Very low	113 Å²	113	132.1 Å²	132.1	69%	0.693	73%	0.732	S	S	*	*			trans	72.6	139.9	138.3	56.7	0	0	0	0	119.8
356	D	31.5	Very low	33.6	Very low	107 Å²	107	134.8 Å²	134.8	57%	0.572	74%	0.735	S	S	*	*			cis	-165.6	153.2	-7.1	-126.9	-21.1	0	0	0	113
357	K	32.7	Very low	32.7	Very low	171 Å²	171	137 Å²	137	74%	0.743	74%	0.74	S	S	*	*			trans	62.5	154.6	151.4	-66.1	156.9	-174.6	139.3	0	117.2
358	C	29.5	Very low	32.7	Very low	112 Å²	112	138.1 Å²	138.1	76%	0.757	75%	0.748	S	S	*	*			cis	-166.5	162.8	-9.3	-112.5	0	0	0	0	106.2
359	S	36.3	Very low	32.1	Very low	90 Å²	90	136.9 Å²	136.9	63%	0.629	75%	0.746	S	S	*	*			cis	-173.6	117.3	-21.2	43.7	0	0	0	0	106.1
360	T	31.8	Very low	32	Very low	106 Å²	106	136.9 Å²	136.9	65%	0.65	76%	0.755	S	S	*	*				72.2	111.8	91.3	-53.7	0	0	0	0	115.3	D362	T360-D362 WeakPolarHBondContact CG2-OD2 3.15Å
361	T	36	Very low	31.6	Very low	148 Å²	148	134.9 Å²	134.9	91%	0.908	75%	0.753	S	S	*	*			trans	-139.2	88.5	138.1	51.4	0	0	0	0	108.4
362	D	30.4	Very low	31.4	Very low	119 Å²	119	137.2 Å²	137.2	64%	0.636	76%	0.758	S	S	*	*			trans	-81.9	144.9	177.7	-56.2	-53.1	0	0	0	111.7	T360	T360-D362 WeakPolarHBondContact CG2-OD2 3.15Å
363	I	37.3	Very low	31.6	Very low	173 Å²	173	136.3 Å²	136.3	89%	0.887	76%	0.761	S	S	*	*			trans	-129	131.1	140.7	-63	-175.1	0	0	0	107
364	K	27.3	Very low	31.5	Very low	171 Å²	171	137.4 Å²	137.4	74%	0.743	76%	0.763	S	S	*	*			trans	-90.1	-171.6	-174.1	-61.8	-177.9	176.6	-176.8	0	112.3
365	L	35.3	Very low	31.4	Very low	145 Å²	145	139 Å²	139	76%	0.759	77%	0.772	S	S	*	*			trans	99.5	130.9	172.1	-56.9	172.6	0	0	0	112.4
366	E	31.1	Very low	31.4	Very low	166 Å²	166	139.9 Å²	139.9	78%	0.776	78%	0.777	S	S	*	*			cis	-175.2	163.7	-25.3	-118.1	162.5	-150.1	0	0	103.4
367	D	27.7	Very low	31.3	Very low	158 Å²	158	143.4 Å²	143.4	85%	0.845	79%	0.79	S	S	*	*			trans	-50.7	141.6	-166.4	-51.4	-54.2	0	0	0	115.8
368	D	32.7	Very low	31.3	Very low	162 Å²	162	144.3 Å²	144.3	87%	0.866	80%	0.797	S	S	*	*				-155.8	142	128.2	-133.6	-22.6	0	0	0	112.8
369	T	28.2	Very low	31.2	Very low	131 Å²	131	146.4 Å²	146.4	80%	0.804	80%	0.801	S	S	*	*			trans	-109.3	139	178.4	55.7	0	0	0	0	111.1
370	C	27.5	Very low	31	Very low	135 Å²	135	149.2 Å²	149.2	91%	0.912	81%	0.813	S	S	*	*			trans	-137.4	132	161.6	-159.9	0	0	0	0	111.1
371	S	30.9	Very low	31	Very low	107 Å²	107	149.8 Å²	149.8	75%	0.748	82%	0.817	S	S	*	*			trans	-131.6	-179.9	-169.7	59.9	0	0	0	0	111.4
372	K	28.8	Very low	30.8	Very low	180 Å²	180	151.3 Å²	151.3	78%	0.783	81%	0.814	S	S	*	*			trans	-56.8	140.4	-175.2	-56.2	172.3	-177.5	176.7	0	112	T374	K372-T374 PolarHBondContact O-N 3.41Å
373	P	34.1	Very low	30.9	Very low	134 Å²	134	151.1 Å²	151.1	87%	0.87	82%	0.822	S	S	*	*			trans	-75.1	103.7	161.2	31.1	-31	0	0	0	109.6
374	T	29	Very low	30.9	Very low	116 Å²	116	150.9 Å²	150.9	71%	0.712	82%	0.822	S	S	*	*			trans	-95.5	133.8	164.9	-54.9	0	0	0	0	108.4	K372 V376	K372-T374 PolarHBondContact O-N 3.41Å; T374-V376 PolarHBondContact O-N 2.87Å
375	L	29.5	Very low	31.2	Very low	174 Å²	174	146.1 Å²	146.1	91%	0.911	82%	0.815	S	S	*	*			trans	-73.1	113.6	177.3	-69.4	165.6	0	0	0	111
376	V	32.4	Very low	31	Very low	133 Å²	133	147 Å²	147	81%	0.806	82%	0.821	S	S	*	*			trans	-145.5	141	158.6	-168.2	0	0	0	0	107.9	T374	T374-V376 PolarHBondContact O-N 2.87Å
377	E	28.7	Very low	31.2	Very low	181 Å²	181	144 Å²	144	85%	0.846	82%	0.824	S	S	*	*			trans	-85.3	147.1	174.8	-53.7	179.5	136.9	0	0	111
378	E	32.6	Very low	31.6	Very low	190 Å²	190	143.4 Å²	143.4	89%	0.888	83%	0.826	S	S	*	*			trans	-170.6	162.5	133.1	-110	173	-169.3	0	0	111.7
379	N	27.7	Very low	32	Very low	156 Å²	156	144.5 Å²	144.5	83%	0.834	82%	0.823	S	S	*	*			trans	-100.8	152.7	-175.4	-64.8	-88.4	0	0	0	111.6
380	V	32.8	Very low	32.6	Very low	148 Å²	148	143.9 Å²	143.9	90%	0.897	82%	0.821	S	S	*	*			trans	-173.5	164.9	136.4	138.4	0	0	0	0	110.6
381	T	31	Very low	33.3	Very low	119 Å²	119	147.3 Å²	147.3	73%	0.73	82%	0.82	S	S	*	*			trans	-96.4	150.8	-152.6	49.5	0	0	0	0	117.6
382	E	31.4	Very low	34.7	Very low	179 Å²	179	147 Å²	147	84%	0.836	81%	0.813	S	S	*	*			trans	15.6	119.8	142.8	-54	-173.9	145.7	0	0	119.7
383	S	32.9	Very low	36.6	Very low	115 Å²	115	140.7 Å²	140.7	80%	0.804	79%	0.792	S	S	*	*				158.3	121.9	103.3	49.5	0	0	0	0	112.9
384	D	37	Very low	38.4	Very low	168 Å²	168	143.7 Å²	143.7	90%	0.898	79%	0.792	S	S	*	*				-176.8	170.1	111.9	-130.2	-31.8	0	0	0	111.3
385	A	33.6	Very low	40.4	Very low	72 Å²	72	146.7 Å²	146.7	60%	0.595	80%	0.795	S	S	*	*			trans	-122.9	159.1	-159.1	0	0	0	0	0	118.4
386	N	31.3	Very low	42.4	Very low	164 Å²	164	143.2 Å²	143.2	88%	0.877	77%	0.774	S	S	*	*			trans	76.2	90.3	158.4	-59.5	-51.8	0	0	0	120.3
387	A	36	Very low	44.3	Very low	101 Å²	101	141.7 Å²	141.7	84%	0.835	76%	0.761	S	S	*	*			trans	-137.5	148	146.9	0	0	0	0	0	110.7
388	V	35.7	Very low	46.5	Very low	146 Å²	146	140.3 Å²	140.3	89%	0.885	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-93.1	124.3	-162.2	-179.8	0	0	0	0	113.3
389	K	40.4	Very low	48.6	Very low	186 Å²	186	139 Å²	139	81%	0.809	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-82.7	135.2	172.8	-66.4	-176.2	178.7	-179.7	0	112.2
390	P	41.7	Very low	50.8	Low	118 Å²	118	136.5 Å²	136.5	77%	0.766	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-71.7	139	175.7	29.5	-34.3	0	0	0	111.8	V392	P390-V392 PolarHBondContact O-N 3.43Å
391	K	42.6	Very low	53	Low	207 Å²	207	135.1 Å²	135.1	90%	0.9	71%	0.711	S	S	*	*			trans	-84.9	95	-179.7	-68.4	177.9	-179.2	173.1	0	111.1	S393	K391-S393 PolarHBondContact O-N 2.83Å
392	V	59.4	Low	55.2	Low	99 Å²	99	136 Å²	136	60%	0.6	71%	0.705	S	S	*	*			trans	-52.1	134.1	168.8	178.5	0	0	0	0	109.8	P390 E396	P390-V392 PolarHBondContact O-N 3.43Å; V392-E396 HydrophobicContact CG1-CB 3.9Å
393	S	68.5	Low	57.4	Low	49 Å²	49	132.8 Å²	132.8	34%	0.343	69%	0.688	S	S	.	*			trans	-75.6	152.4	-171	78.8	0	0	0	0	112.6	K391 K395 E396 L397	K391-S393 PolarHBondContact O-N 2.83Å; S393-K395 PolarHBondContact O-N 3.3Å; S393-K395 PolarHBondContact OG-N 3.21Å; S393-E396 WeakPolarHBondContact CA-OE2 3.43Å; S393-E396 WeakPolarHBondContact CB-OE2 3.41Å; S393-E396 PolarHBondContact N-OE2 2.8Å; S393-E396 PolarHBondContact O-N 3.4Å; S393-E396 PolarHBondContact OG-N 2.79Å; S393-E396 PolarHBondContact OG-OE2 3.11Å; S393-L397 PolarHBondContact O-N 3.27Å; S393-L397 VanDerWaalsContact O-N 3.15Å
394	K	71.4	Confident	59.4	Low	196 Å²	196	132.8 Å²	132.8	85%	0.852	68%	0.675	S	S	*	*	H	α-helix	trans	-58.9	-15.4	172	-68.9	-172.9	177.2	-177.1	0	113.5	K398	K394-K398 WeakPolarHBondContact O-CB 3.48Å
395	K	71.7	Confident	61.2	Low	180 Å²	180	130.2 Å²	130.2	78%	0.783	66%	0.658	S	S	*	*	H	α-helix	trans	-81.1	-39	173.2	-82	-177.4	174.5	177	0	112.4	S393 K398 K399	S393-K395 PolarHBondContact O-N 3.3Å; S393-K395 PolarHBondContact OG-N 3.21Å; K395-K398 PolarHBondContact O-N 2.91Å; K395-K399 PolarHBondContact O-N 3.28Å; K395-K399 VanDerWaalsContact O-N 3.08Å
396	E	71.2	Confident	63.3	Low	100 Å²	100	133.6 Å²	133.6	47%	0.467	66%	0.66	S	S	.	*	H	α-helix	trans	-72.9	-44	179.6	-71.4	149	141.6	0	0	111.2	V392 S393 K398 K399 L400	V392-E396 HydrophobicContact CG1-CB 3.9Å; S393-E396 WeakPolarHBondContact CA-OE2 3.43Å; S393-E396 WeakPolarHBondContact CB-OE2 3.41Å; S393-E396 PolarHBondContact N-OE2 2.8Å; S393-E396 PolarHBondContact O-N 3.4Å; S393-E396 PolarHBondContact OG-N 2.79Å; S393-E396 PolarHBondContact OG-OE2 3.11Å; E396-K398 PolarHBondContact O-N 3.03Å; E396-K399 WeakPolarHBondContact O-CA 3.34Å; E396-K399 WeakPolarHBondContact O-CB 3.42Å; E396-K399 PolarHBondContact O-N 2.93Å; E396-L400 PolarHBondContact O-N 3.18Å
397	L	72.7	Confident	65.3	Low	102 Å²	102	130.6 Å²	130.6	53%	0.534	64%	0.641	S	S	.	*	H	α-helix	trans	-57.4	-35.8	174	-159.7	76.2	0	0	0	111.9	S393 K401	S393-L397 PolarHBondContact O-N 3.27Å; S393-L397 VanDerWaalsContact O-N 3.15Å; L397-K401 PolarHBondContact O-N 3.42Å; L397-K401 VanDerWaalsContact O-N 3.12Å
398	K	75.4	Confident	67.2	Low	151 Å²	151	132.4 Å²	132.4	66%	0.657	63%	0.629	S	S	*	*	H	α-helix	trans	-78.8	-18.9	176.1	-164.5	168	-173.6	172.8	0	113.8	K394 K395 E396 K402	K394-K398 WeakPolarHBondContact O-CB 3.48Å; K395-K398 PolarHBondContact O-N 2.91Å; E396-K398 PolarHBondContact O-N 3.03Å; K398-K402 WeakPolarHBondContact O-CB 3.5Å; K398-K402 WeakPolarHBondContact O-CG 3.43Å
399	K	77.3	Confident	69	Low	164 Å²	164	131 Å²	131	71%	0.713	62%	0.617	S	S	*	*	H	α-helix	trans	-77.9	-43.8	167.8	-84.3	-174.6	171.7	-172.6	0	111.4	K395 E396 K402 K403	K395-K399 PolarHBondContact O-N 3.28Å; K395-K399 VanDerWaalsContact O-N 3.08Å; E396-K399 WeakPolarHBondContact O-CA 3.34Å; E396-K399 WeakPolarHBondContact O-CB 3.42Å; E396-K399 PolarHBondContact O-N 2.93Å; K399-K402 PolarHBondContact O-N 3.44Å; K399-K403 PolarHBondContact O-N 2.96Å
400	L	73.4	Confident	70.5	Confident	102 Å²	102	125 Å²	125	53%	0.534	60%	0.595	S	S	.	*	H	α-helix	trans	-61.3	-51.7	178.5	-75.8	166.6	0	0	0	111.2	E396 K402 K403 E404	E396-L400 PolarHBondContact O-N 3.18Å; L400-K402 VanDerWaalsContact C-N 3.29Å; L400-K402 PolarHBondContact O-N 2.85Å; L400-K403 WeakPolarHBondContact O-CA 3.42Å; L400-K403 WeakPolarHBondContact O-CB 3.49Å; L400-K403 PolarHBondContact O-N 3.4Å; L400-E404 PolarHBondContact O-N 2.93Å
401	K	78.5	Confident	71.7	Confident	119 Å²	119	125.5 Å²	125.5	52%	0.517	59%	0.587	S	S	.	*	H	α-helix	trans	-56	-41.1	175	-73	-163.5	170	-156.8	0	113.2	L397 K403 E404 E405	L397-K401 PolarHBondContact O-N 3.42Å; L397-K401 VanDerWaalsContact O-N 3.12Å; K401-K403 VanDerWaalsContact C-N 3.28Å; K401-K403 PolarHBondContact O-N 3.49Å; K401-E404 WeakPolarHBondContact CA-OE2 3.26Å; K401-E404 PolarHBondContact O-N 3.41Å; K401-E405 WeakPolarHBondContact O-CB 3.31Å; K401-E405 WeakPolarHBondContact O-CG 3.28Å; K401-E405 PolarHBondContact O-N 2.92Å
402	K	77.4	Confident	72.8	Confident	137 Å²	137	120.5 Å²	120.5	60%	0.596	57%	0.57	S	S	*	*	H	α-helix	trans	-65.8	-26.4	174	-85.5	-161.7	165	-145.3	0	114.2	K398 K399 L400 F406	K398-K402 WeakPolarHBondContact O-CB 3.5Å; K398-K402 WeakPolarHBondContact O-CG 3.43Å; K399-K402 PolarHBondContact O-N 3.44Å; L400-K402 VanDerWaalsContact C-N 3.29Å; L400-K402 PolarHBondContact O-N 2.85Å; K402-F406 WeakPolarHBondContact O-CB 3.49Å; K402-F406 PolarHBondContact O-N 3.47Å
403	K	76.4	Confident	72.9	Confident	112 Å²	112	118.1 Å²	118.1	49%	0.487	56%	0.561	S	S	.	*	H	α-helix	trans	-73.1	-50	171.9	-167.6	-177.8	177.5	-83.8	0	109.6	K399 L400 K401 E405 F406 E407	K399-K403 PolarHBondContact O-N 2.96Å; L400-K403 WeakPolarHBondContact O-CA 3.42Å; L400-K403 WeakPolarHBondContact O-CB 3.49Å; L400-K403 PolarHBondContact O-N 3.4Å; K401-K403 VanDerWaalsContact C-N 3.28Å; K401-K403 PolarHBondContact O-N 3.49Å; K403-E405 PolarHBondContact O-N 3.19Å; K403-F406 PolarHBondContact O-N 2.96Å; K403-F406 VanDerWaalsContact O-N 3.11Å; K403-E407 IonicContact NZ-OE1 2.89Å; K403-E407 PolarHBondContact NZ-OE1 3.42Å; K403-E407 IonicContact NZ-OE2 2.69Å; K403-E407 PolarHBondContact NZ-OE2 3.07Å; K403-E407 VanDerWaalsContact O-CB 3.31Å; K403-E407 WeakPolarHBondContact O-CB 3.36Å; K403-E407 PolarHBondContact O-N 3.36Å
404	E	76.6	Confident	72.2	Confident	115 Å²	115	122.1 Å²	122.1	54%	0.537	57%	0.572	S	S	.	*	H	α-helix	trans	-57.8	-43.7	177	-63.1	171	138.2	0	0	112.4	L400 K401 F406 E407 K408	L400-E404 PolarHBondContact O-N 2.93Å; K401-E404 WeakPolarHBondContact CA-OE2 3.26Å; K401-E404 PolarHBondContact O-N 3.41Å; E404-F406 VanDerWaalsContact C-N 3.34Å; E404-F406 PolarHBondContact O-N 2.92Å; E404-E407 PolarHBondContact O-N 3.38Å; E404-K408 WeakPolarHBondContact O-CB 3.29Å; E404-K408 WeakPolarHBondContact O-CG 3.42Å; E404-K408 PolarHBondContact O-N 3.06Å
405	E	74.1	Confident	71.3	Confident	115 Å²	115	115 Å²	115	54%	0.537	55%	0.55	S	S	.	.	H	α-helix	trans	-59.6	-41.5	174.5	-75.3	163.1	-174.2	0	0	111.9	K401 K403 L409	K401-E405 WeakPolarHBondContact O-CB 3.31Å; K401-E405 WeakPolarHBondContact O-CG 3.28Å; K401-E405 PolarHBondContact O-N 2.92Å; K403-E405 PolarHBondContact O-N 3.19Å; E405-L409 WeakPolarHBondContact O-CB 3.48Å; E405-L409 PolarHBondContact O-N 3.45Å; E405-L409 VanDerWaalsContact O-N 3.1Å
406	F	76.7	Confident	70.2	Confident	142 Å²	142	114.1 Å²	114.1	62%	0.623	55%	0.546	S	S	*	.	H	α-helix	trans	-72.6	-40.7	177.5	-179.2	-97	0	0	0	112.3	K402 K403 E404 L409 V410	K402-F406 WeakPolarHBondContact O-CB 3.49Å; K402-F406 PolarHBondContact O-N 3.47Å; K403-F406 PolarHBondContact O-N 2.96Å; K403-F406 VanDerWaalsContact O-N 3.11Å; E404-F406 VanDerWaalsContact C-N 3.34Å; E404-F406 PolarHBondContact O-N 2.92Å; F406-L409 WeakPolarHBondContact O-CB 3.33Å; F406-L409 PolarHBondContact O-N 2.89Å; F406-L409 VanDerWaalsContact O-N 3.16Å; F406-V410 HydrophobicContact CD1-CG2 4.23Å; F406-V410 HydrophobicContact CE1-CG2 3.81Å; F406-V410 HydrophobicContact CE2-CG2 4.48Å; F406-V410 HydrophobicContact CZ-CG2 3.95Å; F406-V410 WeakPolarHBondContact O-CG2 3.44Å; F406-V410 PolarHBondContact O-N 3.16Å
407	E	74.8	Confident	68.9	Low	102 Å²	102	114 Å²	114	48%	0.477	55%	0.547	S	S	.	.	H	α-helix	trans	-64.8	-45.6	-179.7	-148.4	141.1	-134.4	0	0	109.8	K403 E404 L409 V410 E411	K403-E407 IonicContact NZ-OE1 2.89Å; K403-E407 PolarHBondContact NZ-OE1 3.42Å; K403-E407 IonicContact NZ-OE2 2.69Å; K403-E407 PolarHBondContact NZ-OE2 3.07Å; K403-E407 VanDerWaalsContact O-CB 3.31Å; K403-E407 WeakPolarHBondContact O-CB 3.36Å; K403-E407 PolarHBondContact O-N 3.36Å; E404-E407 PolarHBondContact O-N 3.38Å; E407-L409 VanDerWaalsContact C-N 3.34Å; E407-L409 PolarHBondContact O-N 3.27Å; E407-V410 PolarHBondContact O-N 3.24Å; E407-E411 WeakPolarHBondContact O-CB 3.44Å; E407-E411 PolarHBondContact O-N 3.05Å
408	K	74.9	Confident	67.5	Low	138 Å²	138	115.2 Å²	115.2	60%	0.6	55%	0.553	S	S	*	*	H	α-helix	trans	-63.8	-32.2	170.4	-72.3	-174.3	176	-170.4	0	113.8	E404 N412	E404-K408 WeakPolarHBondContact O-CB 3.29Å; E404-K408 WeakPolarHBondContact O-CG 3.42Å; E404-K408 PolarHBondContact O-N 3.06Å; K408-N412 VanDerWaalsContact O-CB 3.28Å; K408-N412 WeakPolarHBondContact O-CB 3.34Å; K408-N412 VanDerWaalsContact O-CG 3.31Å; K408-N412 PolarHBondContact O-N 2.91Å; K408-N412 PolarHBondContact O-ND2 3.25Å
409	L	74.4	Confident	65.9	Low	118 Å²	118	111.9 Å²	111.9	62%	0.618	55%	0.554	S	S	*	*	H	α-helix	trans	-68.3	-41.4	173.6	-102.4	167.2	0	0	0	112	E405 F406 E407 A413	E405-L409 WeakPolarHBondContact O-CB 3.48Å; E405-L409 PolarHBondContact O-N 3.45Å; E405-L409 VanDerWaalsContact O-N 3.1Å; F406-L409 WeakPolarHBondContact O-CB 3.33Å; F406-L409 PolarHBondContact O-N 2.89Å; F406-L409 VanDerWaalsContact O-N 3.16Å; E407-L409 VanDerWaalsContact C-N 3.34Å; E407-L409 PolarHBondContact O-N 3.27Å; L409-A413 VanDerWaalsContact O-CB 3.28Å; L409-A413 WeakPolarHBondContact O-CB 3.33Å; L409-A413 PolarHBondContact O-N 3.45Å
410	V	71.7	Confident	64	Low	58 Å²	58	105 Å²	105	35%	0.352	53%	0.527	S	S	.	.	H	α-helix	trans	-66.7	-39.1	174.8	170.5	0	0	0	0	111.1	F406 E407 A413 K414	F406-V410 HydrophobicContact CD1-CG2 4.23Å; F406-V410 HydrophobicContact CE1-CG2 3.81Å; F406-V410 HydrophobicContact CE2-CG2 4.48Å; F406-V410 HydrophobicContact CZ-CG2 3.95Å; F406-V410 WeakPolarHBondContact O-CG2 3.44Å; F406-V410 PolarHBondContact O-N 3.16Å; E407-V410 PolarHBondContact O-N 3.24Å; V410-A413 PolarHBondContact O-N 3.49Å; V410-K414 HydrophobicContact CG1-CD 4.49Å; V410-K414 WeakPolarHBondContact O-CG 3.41Å; V410-K414 PolarHBondContact O-N 2.9Å
411	E	66.6	Low	62.6	Low	129 Å²	129	103.8 Å²	103.8	60%	0.603	53%	0.526	S	S	*	.	H	α-helix	trans	-67	-46.7	177.1	-167	159.9	-116.6	0	0	111.9	E407 A413 K414 A415	E407-E411 WeakPolarHBondContact O-CB 3.44Å; E407-E411 PolarHBondContact O-N 3.05Å; E411-A413 VanDerWaalsContact C-N 3.3Å; E411-A413 PolarHBondContact O-N 3.04Å; E411-K414 WeakPolarHBondContact O-CB 3.43Å; E411-K414 PolarHBondContact O-N 3.4Å; E411-A415 WeakPolarHBondContact O-CB 3.27Å; E411-A415 PolarHBondContact O-N 2.86Å
412	N	64.9	Low	60.9	Low	103 Å²	103	100.7 Å²	100.7	55%	0.551	53%	0.528	S	S	*	.	H	α-helix	trans	-61.5	-35.6	171.5	-78.4	-41	0	0	0	112.7	K408 K416	K408-N412 VanDerWaalsContact O-CB 3.28Å; K408-N412 WeakPolarHBondContact O-CB 3.34Å; K408-N412 VanDerWaalsContact O-CG 3.31Å; K408-N412 PolarHBondContact O-N 2.91Å; K408-N412 PolarHBondContact O-ND2 3.25Å; N412-K416 WeakPolarHBondContact O-CB 3.5Å; N412-K416 WeakPolarHBondContact O-CG 3.29Å; N412-K416 PolarHBondContact O-N 3.08Å
413	A	61.3	Low	59.4	Low	48 Å²	48	97.3 Å²	97.3	40%	0.397	52%	0.519	S	S	.	.	H	α-helix	trans	-66.8	-42.8	173.9	0	0	0	0	0	111.6	L409 V410 E411 K416 I417	L409-A413 VanDerWaalsContact O-CB 3.28Å; L409-A413 WeakPolarHBondContact O-CB 3.33Å; L409-A413 PolarHBondContact O-N 3.45Å; V410-A413 PolarHBondContact O-N 3.49Å; E411-A413 VanDerWaalsContact C-N 3.3Å; E411-A413 PolarHBondContact O-N 3.04Å; A413-K416 PolarHBondContact O-N 2.96Å; A413-I417 WeakPolarHBondContact O-CB 3.34Å; A413-I417 WeakPolarHBondContact O-CD1 3Å; A413-I417 VanDerWaalsContact O-CG1 3.23Å; A413-I417 WeakPolarHBondContact O-CG1 3.32Å; A413-I417 PolarHBondContact O-N 3.29Å
414	K	54.4	Low	58.3	Low	133 Å²	133	94.9 Å²	94.9	58%	0.578	51%	0.512	S	S	*	.	H	α-helix	trans	-60.7	-47.4	172.5	-74.8	174.8	178.2	-177.6	0	111.6	V410 E411 K416 I417 I418	V410-K414 HydrophobicContact CG1-CD 4.49Å; V410-K414 WeakPolarHBondContact O-CG 3.41Å; V410-K414 PolarHBondContact O-N 2.9Å; E411-K414 WeakPolarHBondContact O-CB 3.43Å; E411-K414 PolarHBondContact O-N 3.4Å; K414-K416 VanDerWaalsContact C-N 3.33Å; K414-K416 PolarHBondContact O-N 3.35Å; K414-I417 PolarHBondContact O-N 2.88Å; K414-I417 VanDerWaalsContact O-N 3.09Å; K414-I418 VanDerWaalsContact O-CG1 3.3Å; K414-I418 WeakPolarHBondContact O-CG1 3.38Å; K414-I418 PolarHBondContact O-N 3.13Å
415	A	53.2	Low	57	Low	47 Å²	47	97.7 Å²	97.7	39%	0.388	52%	0.524	S	S	.	.	H	α-helix	trans	-58	-44.5	177	0	0	0	0	0	111.7	E411 I418 A419	E411-A415 WeakPolarHBondContact O-CB 3.27Å; E411-A415 PolarHBondContact O-N 2.86Å; A415-I418 PolarHBondContact O-N 2.85Å; A415-A419 WeakPolarHBondContact O-CB 3.26Å; A415-A419 PolarHBondContact O-N 3.19Å
416	K	47.5	Very low	56.3	Low	161 Å²	161	94.8 Å²	94.8	70%	0.7	51%	0.513	S	S	*	.	H	α-helix	trans	-64.3	-36.7	173	-76.5	-169.6	174.1	-165.7	0	113.4	N412 A413 K414 S420	N412-K416 WeakPolarHBondContact O-CB 3.5Å; N412-K416 WeakPolarHBondContact O-CG 3.29Å; N412-K416 PolarHBondContact O-N 3.08Å; A413-K416 PolarHBondContact O-N 2.96Å; K414-K416 VanDerWaalsContact C-N 3.33Å; K414-K416 PolarHBondContact O-N 3.35Å; K416-S420 VanDerWaalsContact O-CB 3.22Å; K416-S420 WeakPolarHBondContact O-CB 3.38Å; K416-S420 PolarHBondContact O-N 2.93Å; K416-S420 PolarHBondContact O-OG 3.17Å
417	I	44.2	Very low	55.5	Low	97 Å²	97	90.5 Å²	90.5	50%	0.497	49%	0.494	S	S	.	.	H	α-helix	trans	-69.3	-36.4	176.3	-71.6	163.6	0	0	0	111.4	A413 K414 S421	A413-I417 WeakPolarHBondContact O-CB 3.34Å; A413-I417 WeakPolarHBondContact O-CD1 3Å; A413-I417 VanDerWaalsContact O-CG1 3.23Å; A413-I417 WeakPolarHBondContact O-CG1 3.32Å; A413-I417 PolarHBondContact O-N 3.29Å; K414-I417 PolarHBondContact O-N 2.88Å; K414-I417 VanDerWaalsContact O-N 3.09Å; I417-S421 PolarHBondContact O-N 3.26Å
418	I	44.3	Very low	55.1	Low	128 Å²	128	88.8 Å²	88.8	66%	0.656	50%	0.497	S	S	*	.	H	α-helix	trans	-67.8	-50.7	175.2	-67.9	162.5	0	0	0	109.7	K414 A415 S420 S421	K414-I418 VanDerWaalsContact O-CG1 3.3Å; K414-I418 WeakPolarHBondContact O-CG1 3.38Å; K414-I418 PolarHBondContact O-N 3.13Å; A415-I418 PolarHBondContact O-N 2.85Å; I418-S420 VanDerWaalsContact C-N 3.35Å; I418-S420 PolarHBondContact O-N 3.4Å; I418-S421 VanDerWaalsContact O-CB 3.28Å; I418-S421 WeakPolarHBondContact O-CB 3.14Å; I418-S421 PolarHBondContact O-N 2.96Å; I418-S421 VanDerWaalsContact O-N 3.16Å
419	A	41.5	Very low	55	Low	82 Å²	82	85 Å²	85	68%	0.678	48%	0.483	S	S	*	.	H	α-helix	trans	-62	-37.6	177.3	0	0	0	0	0	113.2	A415 S421	A415-A419 WeakPolarHBondContact O-CB 3.26Å; A415-A419 PolarHBondContact O-N 3.19Å; A419-S421 VanDerWaalsContact C-N 3.34Å
420	S	37.6	Very low	54.9	Low	20 Å²	20	82.8 Å²	82.8	14%	0.14	48%	0.477	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	5	177	65.8	0	0	0	0	114.6	K416 I418 G422 T423 N426	K416-S420 VanDerWaalsContact O-CB 3.22Å; K416-S420 WeakPolarHBondContact O-CB 3.38Å; K416-S420 PolarHBondContact O-N 2.93Å; K416-S420 PolarHBondContact O-OG 3.17Å; I418-S420 VanDerWaalsContact C-N 3.35Å; I418-S420 PolarHBondContact O-N 3.4Å; S420-G422 PolarHBondContact O-N 3.46Å; S420-G422 VanDerWaalsContact O-N 3.14Å; S420-T423 VanDerWaalsContact CA-OG1 3.31Å; S420-T423 WeakPolarHBondContact CA-OG1 3.49Å; S420-T423 WeakPolarHBondContact CB-OG1 3.42Å; S420-T423 PolarHBondContact O-N 3.08Å; S420-T423 VanDerWaalsContact O-N 3.11Å; S420-T423 PolarHBondContact O-OG1 2.8Å; S420-N426 WeakPolarHBondContact CB-ND2 3.21Å; S420-N426 PolarHBondContact O-ND2 3.35Å; S420-N426 PolarHBondContact OG-ND2 3.18Å
421	S	43	Very low	54.6	Low	75 Å²	75	83 Å²	83	52%	0.524	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-18.3	178.2	-150	0	0	0	0	112.5	I417 I418 A419	I417-S421 PolarHBondContact O-N 3.26Å; I418-S421 VanDerWaalsContact O-CB 3.28Å; I418-S421 WeakPolarHBondContact O-CB 3.14Å; I418-S421 PolarHBondContact O-N 2.96Å; I418-S421 VanDerWaalsContact O-N 3.16Å; A419-S421 VanDerWaalsContact C-N 3.34Å
422	G	44.3	Very low	54.2	Low	54 Å²	54	80.1 Å²	80.1	56%	0.557	47%	0.473	S	S	*	.	S	Bend	trans	-94.2	-23.7	170.3	0	0	0	0	0	116	S420	S420-G422 PolarHBondContact O-N 3.46Å; S420-G422 VanDerWaalsContact O-N 3.14Å
423	T	44.1	Very low	53.4	Low	66 Å²	66	80.9 Å²	80.9	41%	0.405	49%	0.486	S	S	.	.	S	Bend	trans	-90.4	152.4	-168.7	52.5	0	0	0	0	114.5	S420 E425	S420-T423 VanDerWaalsContact CA-OG1 3.31Å; S420-T423 WeakPolarHBondContact CA-OG1 3.49Å; S420-T423 WeakPolarHBondContact CB-OG1 3.42Å; S420-T423 PolarHBondContact O-N 3.08Å; S420-T423 VanDerWaalsContact O-N 3.11Å; S420-T423 PolarHBondContact O-OG1 2.8Å; T423-E425 VanDerWaalsContact C-N 3.26Å; T423-E425 PolarHBondContact O-N 2.77Å
424	L	54.3	Low	52.7	Low	62 Å²	62	82.1 Å²	82.1	33%	0.325	50%	0.503	S	S	.	.	G	3₁₀ helix	trans	-71.3	-11.1	-172.1	-107.2	142.9	0	0	0	115.1	N426 F427 T494	L424-N426 PolarHBondContact O-N 2.61Å; L424-N426 VanDerWaalsContact O-N 3.12Å; L424-F427 WeakPolarHBondContact O-CD2 3.42Å; L424-F427 PolarHBondContact O-N 3.26Å; L424-T494 HydrophobicContact CD1-CG2 3.53Å; L424-T494 WeakPolarHBondContact CD1-OG1 3.23Å
425	E	49.3	Very low	51.8	Low	173 Å²	173	83 Å²	83	81%	0.808	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	-61.4	-22.3	-178.1	-58	-178.8	157.7	0	0	113.4	T423 F427	T423-E425 VanDerWaalsContact C-N 3.26Å; T423-E425 PolarHBondContact O-N 2.77Å; E425-F427 PolarHBondContact O-N 2.84Å
426	N	59	Low	51.2	Low	55 Å²	55	85.4 Å²	85.4	29%	0.294	53%	0.534	S	S	.	.	G	3₁₀ helix	trans	-81.2	8.1	179.3	-76	-62	0	0	0	114.5	S420 L424	S420-N426 WeakPolarHBondContact CB-ND2 3.21Å; S420-N426 PolarHBondContact O-ND2 3.35Å; S420-N426 PolarHBondContact OG-ND2 3.18Å; L424-N426 PolarHBondContact O-N 2.61Å; L424-N426 VanDerWaalsContact O-N 3.12Å
427	F	61.1	Low	51.1	Low	52 Å²	52	84.4 Å²	84.4	23%	0.228	53%	0.53	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	131.2	-174.6	-62.4	-95.4	0	0	0	112.2	L424 E425 I454 A455 A456 T487 H491	L424-F427 WeakPolarHBondContact O-CD2 3.42Å; L424-F427 PolarHBondContact O-N 3.26Å; E425-F427 PolarHBondContact O-N 2.84Å; F427-I454 HydrophobicContact CD1-CG2 4.36Å; F427-A455 WeakPolarHBondContact CA-O 3.24Å; F427-A456 HydrophobicContact CD1-CB 3.43Å; F427-A456 VanDerWaalsContact CD1-CB 3.43Å; F427-A456 HydrophobicContact CE1-CB 3.33Å; F427-A456 HydrophobicContact CG-CB 4.48Å; F427-A456 HydrophobicContact CZ-CB 4.35Å; F427-T487 HydrophobicContact CD1-CG2 3.65Å; F427-T487 HydrophobicContact CE1-CG2 3.32Å; F427-T487 HydrophobicContact CZ-CG2 4.17Å; F427-H491 AromaticContact CD1-CE1 3.78Å; F427-H491 AromaticContact CG-CE1 3.77Å
428	A	65	Low	51.4	Low	65 Å²	65	83.5 Å²	83.5	54%	0.537	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	116.4	173.3	0	0	0	0	0	109.9	A455	A428-A455 PolarHBondContact N-O 3.26Å; A428-A455 PolarHBondContact O-N 2.8Å
429	L	73.8	Confident	51.6	Low	59 Å²	59	85.8 Å²	85.8	31%	0.309	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	133.8	178.4	176.4	64.9	0	0	0	110	Q431 I454 A496	L429-Q431 HydrophobicContact CD1-CG 4.31Å; L429-I454 HydrophobicContact CD1-CD1 4.3Å; L429-I454 HydrophobicContact CD1-CG1 3.57Å; L429-A496 HydrophobicContact CD2-CB 3.92Å; L429-A496 VanDerWaalsContact CD2-O 3.22Å; L429-A496 WeakPolarHBondContact CD2-O 3.22Å
430	S	71.4	Confident	52.1	Low	71 Å²	71	88.4 Å²	88.4	50%	0.497	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	134.9	167.8	52.1	0	0	0	0	110.2	S453	S430-S453 PolarHBondContact N-O 2.99Å; S430-S453 PolarHBondContact O-N 3.34Å
431	Q	66.2	Low	53	Low	64 Å²	64	91 Å²	91	30%	0.299	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	138.5	176.5	-75.8	170.8	89.1	0	0	107.2	L429 S433 F452 A496	L429-Q431 HydrophobicContact CD1-CG 4.31Å; Q431-S433 PolarHBondContact O-N 2.9Å; Q431-F452 HydrophobicContact CG-CB 3.81Å; Q431-A496 PolarHBondContact NE2-O 3.36Å
432	A	57.3	Low	53.6	Low	68 Å²	68	91.2 Å²	91.2	56%	0.562	54%	0.544	S	S	*	.			trans	-69.4	121.5	170.9	0	0	0	0	0	109.2	G434 N451	A432-G434 PolarHBondContact O-N 3.48Å; A432-N451 HydrophobicContact CB-CB 4.4Å
433	S	48.6	Very low	54.6	Low	118 Å²	118	96 Å²	96	83%	0.825	56%	0.557	S	S	*	*			trans	-57.8	108.9	-178.5	-53.5	0	0	0	0	111.4	Q431 N435	Q431-S433 PolarHBondContact O-N 2.9Å; S433-N435 PolarHBondContact O-N 2.83Å
434	G	46.2	Very low	56	Low	74 Å²	74	96.7 Å²	96.7	76%	0.763	56%	0.555	S	S	*	*			trans	-64.1	118.9	179.1	0	0	0	0	0	111.2	A432 A436	A432-G434 PolarHBondContact O-N 3.48Å; G434-A436 PolarHBondContact O-N 3.37Å
435	N	36.9	Very low	57.2	Low	153 Å²	153	98 Å²	98	82%	0.818	56%	0.562	S	S	*	*			trans	-63.4	102.8	-178	-90	-24.9	0	0	0	112.4	S433 K437	S433-N435 PolarHBondContact O-N 2.83Å; N435-K437 PolarHBondContact O-N 2.89Å
436	A	38.8	Very low	59.1	Low	97 Å²	97	91.1 Å²	91.1	80%	0.802	53%	0.531	S	S	*	.	S	Bend	trans	43.3	57.2	150.1	0	0	0	0	0	115.9	G434	G434-A436 PolarHBondContact O-N 3.37Å
437	K	46.5	Very low	60.5	Low	140 Å²	140	88.7 Å²	88.7	61%	0.609	52%	0.518	S	S	*	.			trans	-136.9	12.1	175.1	-82.3	-160.6	173.1	-164.5	0	115.1	N435 E439 Q440	N435-K437 PolarHBondContact O-N 2.89Å; K437-E439 VanDerWaalsContact C-N 3.32Å; K437-E439 PolarHBondContact O-N 3.43Å; K437-Q440 PolarHBondContact O-N 3.21Å
438	S	50.2	Low	61.8	Low	78 Å²	78	92.5 Å²	92.5	55%	0.545	53%	0.53	S	S	.	.	G	3₁₀ helix	trans	-47.8	-50.7	-172.8	-35.9	0	0	0	0	112.9	Q440 Q441 D442	S438-Q440 PolarHBondContact O-N 2.89Å; S438-Q441 PolarHBondContact O-N 2.66Å; S438-D442 PolarHBondContact O-N 2.83Å
439	E	49.4	Very low	62.9	Low	175 Å²	175	90 Å²	90	82%	0.818	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-58.4	-14.5	-177.6	-57	174.5	165.2	0	0	115.1	K437	K437-E439 VanDerWaalsContact C-N 3.32Å; K437-E439 PolarHBondContact O-N 3.43Å
440	Q	51.7	Low	63.5	Low	138 Å²	138	93 Å²	93	65%	0.645	52%	0.521	S	S	*	.	G	3₁₀ helix	trans	-101.1	-4.1	174.8	-67.8	-166.2	-24.7	0	0	113.8	K437 S438 Q444	K437-Q440 PolarHBondContact O-N 3.21Å; S438-Q440 PolarHBondContact O-N 2.89Å; Q440-Q444 PolarHBondContact O-NE2 3.49Å
441	Q	55.1	Low	64.2	Low	75 Å²	75	93 Å²	93	35%	0.35	52%	0.516	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-28.1	176.5	-61	-169.9	-92.9	0	0	112.4	S438 N443 Q444	S438-Q441 PolarHBondContact O-N 2.66Å; Q441-N443 PolarHBondContact O-N 2.7Å; Q441-N443 VanDerWaalsContact O-N 3.11Å; Q441-Q444 WeakPolarHBondContact O-CB 3.25Å; Q441-Q444 PolarHBondContact O-N 2.8Å
442	D	57	Low	65.3	Low	79 Å²	79	90 Å²	90	42%	0.422	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-21.3	-176.1	-55.8	-47.4	0	0	0	114.4	S438 N502	S438-D442 PolarHBondContact O-N 2.83Å; D442-N502 PolarHBondContact O-ND2 3.01Å; D442-N502 VanDerWaalsContact O-ND2 3.16Å
443	N	64.2	Low	66.8	Low	155 Å²	155	87.6 Å²	87.6	83%	0.829	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	5.7	173.8	-76.5	-42.4	0	0	0	113.9	Q441	Q441-N443 PolarHBondContact O-N 2.7Å; Q441-N443 VanDerWaalsContact O-N 3.11Å
444	Q	73.5	Confident	68.7	Low	79 Å²	79	82 Å²	82	37%	0.369	44%	0.442	S	S	.	.			trans	-98.9	135.6	177.9	-59.3	-175.1	37.5	0	0	110.2	Q440 Q441 D446 N502	Q440-Q444 PolarHBondContact O-NE2 3.49Å; Q441-Q444 WeakPolarHBondContact O-CB 3.25Å; Q441-Q444 PolarHBondContact O-N 2.8Å; Q444-D446 VanDerWaalsContact C-N 3.33Å; Q444-N502 PolarHBondContact O-ND2 2.82Å
445	L	79.6	Confident	70.6	Confident	89 Å²	89	79.8 Å²	79.8	47%	0.466	42%	0.415	S	S	.	.	S	Bend	trans	-89.7	-2.4	173.4	-58.3	175.3	0	0	0	112.4	H471	L445-H471 HydrophobicContact CB-CB 3.75Å
446	D	88.8	Confident	72.6	Confident	30 Å²	30	73.1 Å²	73.1	16%	0.16	38%	0.382	C	S	.	.	S	Bend	trans	-92.1	125.7	176.3	-89.2	22.5	0	0	0	110.3	Q444 R448 I469 T470 H471	Q444-D446 VanDerWaalsContact C-N 3.33Å; D446-R448 IonicContact OD2-CZ 3.67Å; D446-R448 IonicContact OD2-NE 2.84Å; D446-R448 PolarHBondContact OD2-NE 3.22Å; D446-R448 IonicContact OD2-NH2 2.73Å; D446-R448 PolarHBondContact OD2-NH2 2.96Å; D446-I469 CarbonylContact C-O 3.6Å; D446-I469 WeakPolarHBondContact CA-O 3.14Å; D446-T470 VanDerWaalsContact OD1-CA 3.26Å; D446-T470 WeakPolarHBondContact OD1-CA 3.43Å; D446-T470 WeakPolarHBondContact OD1-CG2 3.33Å; D446-T470 PolarHBondContact OD2-OG1 3.04Å; D446-H471 PolarHBondContact OD1-N 2.93Å
447	I	88.7	Confident	74.1	Confident	3 Å²	3	75.9 Å²	75.9	2%	0.015	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	124.6	170.5	-56.1	174.3	0	0	0	108.7	V449 L467 Q468 I469 I499 I503 L616	I447-V449 HydrophobicContact CG2-CG2 4.23Å; I447-L467 HydrophobicContact CG2-CD2 4.28Å; I447-Q468 WeakPolarHBondContact O-CA 3.47Å; I447-I469 HydrophobicContact CB-CB 4.2Å; I447-I469 HydrophobicContact CD1-CD1 4.42Å; I447-I469 PolarHBondContact N-O 2.93Å; I447-I469 PolarHBondContact O-N 3.25Å; I447-I499 HydrophobicContact CD1-CG1 4.41Å; I447-I499 HydrophobicContact CD1-CG2 3.9Å; I447-I499 HydrophobicContact CG1-CG2 4.34Å; I447-I499 HydrophobicContact CG2-CG1 4.22Å; I447-I503 HydrophobicContact CD1-CD1 4.16Å; I447-I503 HydrophobicContact CD1-CG2 4.5Å; I447-I503 HydrophobicContact CG1-CD1 3.53Å; I447-L616 HydrophobicContact CD1-CD2 3.54Å
448	R	89.7	Confident	75.3	Confident	132 Å²	132	73.1 Å²	73.1	50%	0.498	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	104.7	176.1	-59.1	-175.8	-170	-179.4	6.1	110.1	D446 L467	D446-R448 IonicContact OD2-CZ 3.67Å; D446-R448 IonicContact OD2-NE 2.84Å; D446-R448 PolarHBondContact OD2-NE 3.22Å; D446-R448 IonicContact OD2-NH2 2.73Å; D446-R448 PolarHBondContact OD2-NH2 2.96Å; R448-L467 WeakPolarHBondContact CA-O 3.48Å
449	V	87.4	Confident	76.5	Confident	13 Å²	13	74.2 Å²	74.2	8%	0.079	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	127	176.1	-174.7	0	0	0	0	108.9	I447 F452 S466 L467 I497 N498	I447-V449 HydrophobicContact CG2-CG2 4.23Å; V449-F452 HydrophobicContact CG1-CB 4.44Å; V449-S466 CarbonylContact O-C 3.55Å; V449-S466 VanDerWaalsContact O-CA 3.27Å; V449-S466 WeakPolarHBondContact O-CA 3.22Å; V449-L467 HydrophobicContact CB-CB 4.37Å; V449-L467 PolarHBondContact N-O 3.17Å; V449-L467 PolarHBondContact O-N 2.91Å; V449-I497 HydrophobicContact CB-CG2 4.25Å; V449-I497 HydrophobicContact CG1-CG2 4.2Å; V449-I497 HydrophobicContact CG2-CG2 3.8Å; V449-N498 WeakPolarHBondContact CG2-O 3.04Å
450	E	86.7	Confident	78.3	Confident	122 Å²	122	69.1 Å²	69.1	57%	0.57	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.7	141.6	-176.6	-62	-172.3	172.9	0	0	111.4	F452	E450-F452 PolarHBondContact O-N 3.47Å
451	N	86.4	Confident	79.9	Confident	72 Å²	72	63.2 Å²	63.2	39%	0.385	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	56.7	46.6	174.2	-50	-68.3	0	0	0	114.5	A432 A465	A432-N451 HydrophobicContact CB-CB 4.4Å; N451-A465 CarbonylContact C-O 3.6Å; N451-A465 VanDerWaalsContact CA-O 3.3Å; N451-A465 WeakPolarHBondContact CA-O 3.36Å; N451-A465 PolarHBondContact N-O 3.46Å
452	F	89.5	Confident	81.6	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	146.2	167.6	79.3	-89.3	0	0	0	110.9	Q431 V449 E450 I454 F462 N464 A465 L467 L488 I497 L670	Q431-F452 HydrophobicContact CG-CB 3.81Å; V449-F452 HydrophobicContact CG1-CB 4.44Å; E450-F452 PolarHBondContact O-N 3.47Å; F452-I454 HydrophobicContact CD2-CD1 4.06Å; F452-I454 HydrophobicContact CD2-CG1 4.22Å; F452-I454 HydrophobicContact CE2-CD1 3.97Å; F452-F462 HydrophobicContact CD2-CB 4.35Å; F452-F462 HydrophobicContact CE2-CB 3.89Å; F452-F462 AromaticContact CE2-CD1 3.75Å; F452-F462 HydrophobicContact CE2-CD1 3.75Å; F452-F462 HydrophobicContact CE2-CD2 4.48Å; F452-F462 HydrophobicContact CE2-CE1 4.43Å; F452-F462 AromaticContact CE2-CG 3.78Å; F452-F462 HydrophobicContact CE2-CG 3.78Å; F452-F462 AromaticContact CZ-CD1 3.86Å; F452-F462 HydrophobicContact CZ-CD1 3.86Å; F452-F462 HydrophobicContact CZ-CE1 4.34Å; F452-F462 HydrophobicContact CZ-CG 4.37Å; F452-N464 PolarHBondContact O-N 3.5Å; F452-A465 HydrophobicContact CD1-CB 4.02Å; F452-A465 VanDerWaalsContact CD1-O 3.23Å; F452-A465 WeakPolarHBondContact CD1-O 3.36Å; F452-A465 HydrophobicContact CD2-CB 4.48Å; F452-A465 HydrophobicContact CE1-CB 3.53Å; F452-A465 HydrophobicContact CE2-CB 4.05Å; F452-A465 HydrophobicContact CG-CB 4.47Å; F452-A465 HydrophobicContact CZ-CB 3.55Å; F452-A465 PolarHBondContact N-O 2.85Å; F452-A465 PolarHBondContact O-N 3.35Å; F452-L467 HydrophobicContact CD1-CB 4.49Å; F452-L467 HydrophobicContact CE1-CB 3.88Å; F452-L488 HydrophobicContact CE2-CD1 3.83Å; F452-L488 HydrophobicContact CZ-CD1 3.75Å; F452-I497 HydrophobicContact CD2-CD1 4.27Å; F452-I497 HydrophobicContact CE2-CD1 4.2Å; F452-L670 HydrophobicContact CE1-CD1 4.27Å; F452-L670 HydrophobicContact CZ-CD1 4.03Å
453	S	89	Confident	83.2	Confident	17 Å²	17	58.5 Å²	58.5	12%	0.119	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	133.4	175.3	-55.3	0	0	0	0	110.4	S430 F462 N464	S430-S453 PolarHBondContact N-O 2.99Å; S430-S453 PolarHBondContact O-N 3.34Å; S453-F462 CarbonylContact C-O 3.6Å; S453-F462 WeakPolarHBondContact CA-O 3.3Å; S453-F462 WeakPolarHBondContact CB-O 3.33Å; S453-N464 PolarHBondContact OG-N 3.11Å; S453-N464 PolarHBondContact OG-OD1 2.99Å
454	I	88.5	Confident	84.3	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.01	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	127.4	-178.6	-64.4	166.3	0	0	0	108.4	F427 L429 F452 L461 F462 T487 H491 I497	F427-I454 HydrophobicContact CD1-CG2 4.36Å; L429-I454 HydrophobicContact CD1-CD1 4.3Å; L429-I454 HydrophobicContact CD1-CG1 3.57Å; F452-I454 HydrophobicContact CD2-CD1 4.06Å; F452-I454 HydrophobicContact CD2-CG1 4.22Å; F452-I454 HydrophobicContact CE2-CD1 3.97Å; I454-L461 HydrophobicContact CG2-CD1 4.48Å; I454-L461 PolarHBondContact O-N 2.73Å; I454-F462 HydrophobicContact CB-CB 4.26Å; I454-F462 HydrophobicContact CB-CD2 4.07Å; I454-F462 HydrophobicContact CD1-CD2 4.18Å; I454-F462 PolarHBondContact N-O 3.19Å; I454-F462 PolarHBondContact O-N 3.48Å; I454-F462 VanDerWaalsContact O-N 3.07Å; I454-T487 HydrophobicContact CG2-CG2 4.19Å; I454-H491 HydrophobicContact CD1-CB 4.2Å; I454-I497 HydrophobicContact CD1-CD1 4.32Å
455	A	85.9	Confident	85.1	Confident	26 Å²	26	51.6 Å²	51.6	22%	0.215	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	142.9	170.1	0	0	0	0	0	110.9	F427 A428 K459	F427-A455 WeakPolarHBondContact CA-O 3.24Å; A428-A455 PolarHBondContact N-O 3.26Å; A428-A455 PolarHBondContact O-N 2.8Å; A455-K459 WeakPolarHBondContact CA-O 3.32Å
456	A	78.4	Confident	85.6	Confident	14 Å²	14	49.3 Å²	49.3	12%	0.116	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	127	-175.1	0	0	0	0	0	110	F427 G458 K459 L461	F427-A456 HydrophobicContact CD1-CB 3.43Å; F427-A456 VanDerWaalsContact CD1-CB 3.43Å; F427-A456 HydrophobicContact CE1-CB 3.33Å; F427-A456 HydrophobicContact CG-CB 4.48Å; F427-A456 HydrophobicContact CZ-CB 4.35Å; A456-G458 PolarHBondContact O-N 2.86Å; A456-K459 PolarHBondContact N-O 3.34Å; A456-K459 PolarHBondContact O-N 3.49Å; A456-L461 HydrophobicContact CB-CD1 3.62Å; A456-L461 HydrophobicContact CB-CG 4.11Å
457	K	70.8	Confident	85.7	Confident	154 Å²	154	47.9 Å²	47.9	67%	0.67	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.7	38.6	179.3	-59.5	-174.7	178.3	-178.1	0	113.7
458	G	70.5	Confident	85.9	Confident	82 Å²	82	51.8 Å²	51.8	85%	0.845	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.7	1.6	-178.6	0	0	0	0	0	116.6	A456	A456-G458 PolarHBondContact O-N 2.86Å
459	K	76.9	Confident	86.1	Confident	101 Å²	101	45.7 Å²	45.7	44%	0.439	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	119	174.8	-175.9	-175.1	-177.4	-176.2	0	110.4	A455 A456 L461 G482	A455-K459 WeakPolarHBondContact CA-O 3.32Å; A456-K459 PolarHBondContact N-O 3.34Å; A456-K459 PolarHBondContact O-N 3.49Å; K459-L461 HydrophobicContact CD-CD2 4.03Å; K459-L461 HydrophobicContact CG-CD2 4.24Å; K459-L461 PolarHBondContact O-N 3.26Å; K459-G482 PolarHBondContact NZ-O 2.93Å
460	D	85.6	Confident	86.3	Confident	69 Å²	69	47.2 Å²	47.2	37%	0.369	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	121.6	168.7	-20.3	-75.4	0	0	0	109.3	V463 R668	D460-V463 HydrophobicContact CB-CG2 3.79Å; D460-R668 VanDerWaalsContact O-CZ 3.32Å; D460-R668 PolarHBondContact O-NE 2.84Å; D460-R668 PolarHBondContact O-NH2 3.13Å; D460-R668 IonicContact OD2-CZ 3.84Å; D460-R668 IonicContact OD2-NH1 3.48Å; D460-R668 PolarHBondContact OD2-NH1 3.38Å; D460-R668 IonicContact OD2-NH2 3.83Å; D460-R668 PolarHBondContact OD2-NH2 3.34Å
461	L	86.4	Confident	86.5	Confident	13 Å²	13	44.9 Å²	44.9	7%	0.068	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	-44	177.7	-59.4	179.3	0	0	0	110.5	I454 A456 K459 T487 R668	I454-L461 HydrophobicContact CG2-CD1 4.48Å; I454-L461 PolarHBondContact O-N 2.73Å; A456-L461 HydrophobicContact CB-CD1 3.62Å; A456-L461 HydrophobicContact CB-CG 4.11Å; K459-L461 HydrophobicContact CD-CD2 4.03Å; K459-L461 HydrophobicContact CG-CD2 4.24Å; K459-L461 PolarHBondContact O-N 3.26Å; L461-T487 HydrophobicContact CD1-CG2 3.85Å; L461-R668 WeakPolarHBondContact O-CA 3.35Å; L461-R668 VanDerWaalsContact O-CB 3.28Å; L461-R668 WeakPolarHBondContact O-CB 2.48Å; L461-R668 WeakPolarHBondContact O-CG 2.56Å
462	F	91	Very high	86.7	Confident	1 Å²	1	43 Å²	43	0%	0.004	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	133.6	179.8	-65.4	-94.3	0	0	0	110	F452 S453 I454 A465 L488 L665 R668 L670	F452-F462 HydrophobicContact CD2-CB 4.35Å; F452-F462 HydrophobicContact CE2-CB 3.89Å; F452-F462 AromaticContact CE2-CD1 3.75Å; F452-F462 HydrophobicContact CE2-CD1 3.75Å; F452-F462 HydrophobicContact CE2-CD2 4.48Å; F452-F462 HydrophobicContact CE2-CE1 4.43Å; F452-F462 AromaticContact CE2-CG 3.78Å; F452-F462 HydrophobicContact CE2-CG 3.78Å; F452-F462 AromaticContact CZ-CD1 3.86Å; F452-F462 HydrophobicContact CZ-CD1 3.86Å; F452-F462 HydrophobicContact CZ-CE1 4.34Å; F452-F462 HydrophobicContact CZ-CG 4.37Å; S453-F462 CarbonylContact C-O 3.6Å; S453-F462 WeakPolarHBondContact CA-O 3.3Å; S453-F462 WeakPolarHBondContact CB-O 3.33Å; I454-F462 HydrophobicContact CB-CB 4.26Å; I454-F462 HydrophobicContact CB-CD2 4.07Å; I454-F462 HydrophobicContact CD1-CD2 4.18Å; I454-F462 PolarHBondContact N-O 3.19Å; I454-F462 PolarHBondContact O-N 3.48Å; I454-F462 VanDerWaalsContact O-N 3.07Å; F462-A465 HydrophobicContact CB-CB 4.28Å; F462-A465 HydrophobicContact CD1-CB 3.96Å; F462-L488 HydrophobicContact CE1-CD1 4.48Å; F462-L488 HydrophobicContact CE1-CD2 3.95Å; F462-L488 HydrophobicContact CE2-CB 4.06Å; F462-L488 HydrophobicContact CZ-CB 3.71Å; F462-L488 HydrophobicContact CZ-CD1 4.38Å; F462-L488 HydrophobicContact CZ-CD2 3.9Å; F462-L488 HydrophobicContact CZ-CG 4.21Å; F462-L665 HydrophobicContact CD1-CD1 4.16Å; F462-L665 HydrophobicContact CE1-CD1 3.44Å; F462-L665 VanDerWaalsContact CE1-CD1 3.44Å; F462-L665 HydrophobicContact CZ-CD1 3.79Å; F462-L665 HydrophobicContact CZ-CD2 4.11Å; F462-R668 WeakPolarHBondContact CA-O 3.47Å; F462-L670 HydrophobicContact CE1-CD2 3.92Å; F462-L670 HydrophobicContact CE1-CG 4.17Å
463	V	89.5	Confident	86.9	Confident	54 Å²	54	46.8 Å²	46.8	33%	0.327	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	109.1	179.5	179.3	0	0	0	0	110.2	D460 A465 R668 Q669	D460-V463 HydrophobicContact CB-CG2 3.79Å; V463-A465 PolarHBondContact O-N 2.9Å; V463-R668 HydrophobicContact CB-CB 4.35Å; V463-R668 HydrophobicContact CG2-CB 4.26Å; V463-R668 PolarHBondContact N-O 2.96Å; V463-Q669 PolarHBondContact O-NE2 3.37Å; V463-Q669 VanDerWaalsContact O-NE2 3.15Å
464	N	87.5	Confident	87.2	Confident	89 Å²	89	48 Å²	48	48%	0.476	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	48.6	45.4	-173.6	-59.8	-25.7	0	0	0	112.1	F452 S453	F452-N464 PolarHBondContact O-N 3.5Å; S453-N464 PolarHBondContact OG-N 3.11Å; S453-N464 PolarHBondContact OG-OD1 2.99Å
465	A	89.7	Confident	87.5	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.008	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	157.7	174.1	0	0	0	0	0	110.4	N451 F452 F462 V463	N451-A465 CarbonylContact C-O 3.6Å; N451-A465 VanDerWaalsContact CA-O 3.3Å; N451-A465 WeakPolarHBondContact CA-O 3.36Å; N451-A465 PolarHBondContact N-O 3.46Å; F452-A465 HydrophobicContact CD1-CB 4.02Å; F452-A465 VanDerWaalsContact CD1-O 3.23Å; F452-A465 WeakPolarHBondContact CD1-O 3.36Å; F452-A465 HydrophobicContact CD2-CB 4.48Å; F452-A465 HydrophobicContact CE1-CB 3.53Å; F452-A465 HydrophobicContact CE2-CB 4.05Å; F452-A465 HydrophobicContact CG-CB 4.47Å; F452-A465 HydrophobicContact CZ-CB 3.55Å; F452-A465 PolarHBondContact N-O 2.85Å; F452-A465 PolarHBondContact O-N 3.35Å; F462-A465 HydrophobicContact CB-CB 4.28Å; F462-A465 HydrophobicContact CD1-CB 3.96Å; V463-A465 PolarHBondContact O-N 2.9Å
466	S	90.6	Very high	88	Confident	40 Å²	40	47.1 Å²	47.1	28%	0.28	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	134.8	170.5	54.3	0	0	0	0	109.2	V449	V449-S466 CarbonylContact O-C 3.55Å; V449-S466 VanDerWaalsContact O-CA 3.27Å; V449-S466 WeakPolarHBondContact O-CA 3.22Å
467	L	92	Very high	88.7	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	116.4	177.1	-173.5	69.6	0	0	0	107.8	I447 R448 V449 F452 I469 I492 I497 L670 Y672	I447-L467 HydrophobicContact CG2-CD2 4.28Å; R448-L467 WeakPolarHBondContact CA-O 3.48Å; V449-L467 HydrophobicContact CB-CB 4.37Å; V449-L467 PolarHBondContact N-O 3.17Å; V449-L467 PolarHBondContact O-N 2.91Å; F452-L467 HydrophobicContact CD1-CB 4.49Å; F452-L467 HydrophobicContact CE1-CB 3.88Å; L467-I469 HydrophobicContact CD1-CD1 4.12Å; L467-I469 HydrophobicContact CD1-CG1 4.26Å; L467-I469 HydrophobicContact CD2-CD1 4.36Å; L467-I469 HydrophobicContact CG-CD1 4.24Å; L467-I469 HydrophobicContact CG-CG1 4.3Å; L467-I492 HydrophobicContact CD1-CD1 4.33Å; L467-I492 HydrophobicContact CD2-CD1 3.78Å; L467-I492 HydrophobicContact CD2-CG1 4.01Å; L467-I497 HydrophobicContact CD2-CG2 4.23Å; L467-L670 HydrophobicContact CD1-CD1 3.94Å; L467-Y672 WeakPolarHBondContact CA-OH 2.85Å
468	Q	92.1	Very high	89.7	Confident	85 Å²	85	39.3 Å²	39.3	40%	0.397	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	114.8	175.5	-64.4	-174.6	-5.8	0	0	108.9	I447 Y672	I447-Q468 WeakPolarHBondContact O-CA 3.47Å; Q468-Y672 HydrophobicContact CB-CE1 4.47Å; Q468-Y672 HydrophobicContact CB-CE2 4.4Å; Q468-Y672 PolarHBondContact N-OH 2.87Å; Q468-Y672 WeakPolarHBondContact O-CE1 3.49Å; Q468-Y672 PolarHBondContact O-OH 3.11Å
469	I	92.9	Very high	90.5	Very high	3 Å²	3	35.9 Å²	35.9	2%	0.015	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	116.6	177.6	-57.1	176.9	0	0	0	107.1	D446 I447 L467 Y475 L616 T644 L646	D446-I469 CarbonylContact C-O 3.6Å; D446-I469 WeakPolarHBondContact CA-O 3.14Å; I447-I469 HydrophobicContact CB-CB 4.2Å; I447-I469 HydrophobicContact CD1-CD1 4.42Å; I447-I469 PolarHBondContact N-O 2.93Å; I447-I469 PolarHBondContact O-N 3.25Å; L467-I469 HydrophobicContact CD1-CD1 4.12Å; L467-I469 HydrophobicContact CD1-CG1 4.26Å; L467-I469 HydrophobicContact CD2-CD1 4.36Å; L467-I469 HydrophobicContact CG-CD1 4.24Å; L467-I469 HydrophobicContact CG-CG1 4.3Å; I469-Y475 HydrophobicContact CB-CE2 4.23Å; I469-Y475 HydrophobicContact CG2-CD2 3.93Å; I469-Y475 HydrophobicContact CG2-CE2 3.6Å; I469-L616 HydrophobicContact CD1-CD2 4.38Å; I469-L616 HydrophobicContact CG2-CD1 4.49Å; I469-T644 HydrophobicContact CG2-CG2 3.6Å; I469-L646 HydrophobicContact CD1-CD2 4.1Å
470	T	92.4	Very high	90.8	Very high	46 Å²	46	32.9 Å²	32.9	28%	0.282	18%	0.18	S	C	.	.			trans	-92.6	138.9	175.2	-69.8	0	0	0	0	110.2	D446 R473 Y475	D446-T470 VanDerWaalsContact OD1-CA 3.26Å; D446-T470 WeakPolarHBondContact OD1-CA 3.43Å; D446-T470 WeakPolarHBondContact OD1-CG2 3.33Å; D446-T470 PolarHBondContact OD2-OG1 3.04Å; T470-R473 HydrophobicContact CG2-CG 4.42Å; T470-R473 PolarHBondContact O-N 2.82Å; T470-Y475 PolarHBondContact N-OH 3.34Å
471	H	91.2	Very high	90.6	Very high	73 Å²	73	31.6 Å²	31.6	34%	0.338	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	141.1	-178	-172.9	80.1	0	0	0	113	L445 D446 R473	L445-H471 HydrophobicContact CB-CB 3.75Å; D446-H471 PolarHBondContact OD1-N 2.93Å; H471-R473 PolarHBondContact O-N 2.91Å
472	G	89.4	Confident	90.1	Very high	31 Å²	31	33.1 Å²	33.1	32%	0.32	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.5	8.4	174.6	0	0	0	0	0	115.4	T644	G472-T644 PolarHBondContact N-OG1 3.16Å; G472-T644 VanDerWaalsContact N-OG1 3.1Å
473	R	94	Very high	89.7	Confident	81 Å²	81	36.9 Å²	36.9	31%	0.306	21%	0.206	S	C	.	.			trans	-96.6	161.4	172.5	-67.8	-172.2	179.8	-141.4	17.8	112.3	T470 H471 Y475 T644 L645 D661	T470-R473 HydrophobicContact CG2-CG 4.42Å; T470-R473 PolarHBondContact O-N 2.82Å; H471-R473 PolarHBondContact O-N 2.91Å; R473-Y475 HydrophobicContact CB-CD2 4.15Å; R473-Y475 HydrophobicContact CB-CE2 3.57Å; R473-Y475 WeakPolarHBondContact CD-OH 3.4Å; R473-T644 WeakPolarHBondContact O-CA 3.49Å; R473-T644 WeakPolarHBondContact O-CG2 3.39Å; R473-L645 PolarHBondContact O-N 3.15Å; R473-D661 WeakPolarHBondContact CD-OD2 3.48Å; R473-D661 IonicContact CZ-OD2 3.52Å; R473-D661 IonicContact NH1-OD1 2.68Å; R473-D661 PolarHBondContact NH1-OD1 3.35Å; R473-D661 IonicContact NH1-OD2 2.69Å; R473-D661 PolarHBondContact NH1-OD2 2.92Å
474	R	95.2	Very high	89.4	Confident	41 Å²	41	34.7 Å²	34.7	16%	0.155	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	104.4	-177.8	-54.5	-171.9	-62.7	-105.5	1	109.3	Q639 W641 L645 V658 C659 T660 D661	R474-Q639 PolarHBondContact NH1-O 2.88Å; R474-W641 PolarHBondContact NH1-O 2.97Å; R474-W641 VanDerWaalsContact NH1-O 3.12Å; R474-L645 HydrophobicContact CB-CB 4.13Å; R474-L645 HydrophobicContact CB-CD1 4.46Å; R474-L645 HydrophobicContact CG-CB 4.1Å; R474-L645 HydrophobicContact CG-CD1 3.89Å; R474-V658 PolarHBondContact NE-O 3.32Å; R474-V658 PolarHBondContact NH2-O 2.69Å; R474-C659 CarbonylContact O-C 3.55Å; R474-C659 WeakPolarHBondContact O-CA 3.26Å; R474-T660 HydrophobicContact CB-CG2 4.35Å; R474-T660 PolarHBondContact N-OG1 3.07Å; R474-T660 VanDerWaalsContact N-OG1 3.13Å; R474-T660 PolarHBondContact O-N 3.16Å; R474-T660 PolarHBondContact O-OG1 3.4Å; R474-D661 PolarHBondContact O-N 2.87Å
475	Y	95.9	Very high	89.4	Confident	10 Å²	10	31 Å²	31	4%	0.039	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	125.3	-172.2	-70.2	-85.1	0	0	0	111.6	I469 T470 R473 L645 L646 I647 D661 I663 Y672	I469-Y475 HydrophobicContact CB-CE2 4.23Å; I469-Y475 HydrophobicContact CG2-CD2 3.93Å; I469-Y475 HydrophobicContact CG2-CE2 3.6Å; T470-Y475 PolarHBondContact N-OH 3.34Å; R473-Y475 HydrophobicContact CB-CD2 4.15Å; R473-Y475 HydrophobicContact CB-CE2 3.57Å; R473-Y475 WeakPolarHBondContact CD-OH 3.4Å; Y475-L645 PolarHBondContact N-O 2.91Å; Y475-L646 WeakPolarHBondContact O-CA 3.42Å; Y475-I647 PolarHBondContact O-N 2.33Å; Y475-D661 WeakPolarHBondContact CA-O 3.45Å; Y475-D661 HydrophobicContact CD1-CB 3.74Å; Y475-D661 HydrophobicContact CE1-CB 3.78Å; Y475-I663 HydrophobicContact CD1-CD1 3.79Å; Y475-I663 HydrophobicContact CD1-CG1 3.75Å; Y475-I663 HydrophobicContact CG-CD1 4.07Å; Y475-I663 HydrophobicContact CG-CG1 4.37Å; Y475-Y672 HydrophobicContact CE1-CD1 4.29Å; Y475-Y672 HydrophobicContact CE1-CE1 4.26Å
476	G	95.3	Very high	89.3	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	114.4	169.4	0	0	0	0	0	111.4	I647 C659 D661 I662 I663	G476-I647 CarbonylContact C-O 2.94Å; G476-I647 WeakPolarHBondContact CA-O 3.23Å; G476-C659 VanDerWaalsContact CA-SG 3.59Å; G476-D661 PolarHBondContact N-O 2.91Å; G476-I662 CarbonylContact O-C 3.5Å; G476-I662 WeakPolarHBondContact O-CA 3.39Å; G476-I663 PolarHBondContact O-N 2.85Å
477	L	94.1	Very high	89.2	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.005	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	106.3	176.7	174.9	56.6	0	0	0	110.4	L488 L646 I647 V648 I663 L665 L670	L477-L488 HydrophobicContact CD2-CD2 3.97Å; L477-L646 HydrophobicContact CB-CD1 4.02Å; L477-I647 PolarHBondContact N-O 3.02Å; L477-V648 HydrophobicContact CB-CG2 3.85Å; L477-V648 HydrophobicContact CD2-CG2 3.72Å; L477-V648 HydrophobicContact CG-CG2 3.91Å; L477-I663 WeakPolarHBondContact CA-O 3.38Å; L477-I663 HydrophobicContact CD1-CB 4.14Å; L477-I663 HydrophobicContact CD1-CG2 4.19Å; L477-L665 HydrophobicContact CD1-CB 4.31Å; L477-L670 HydrophobicContact CD1-CD2 4.08Å
478	V	92	Very high	89.1	Confident	3 Å²	3	31.9 Å²	31.9	2%	0.018	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	140.7	-174.7	-61.3	0	0	0	0	111.9	L655 I662 I663 H664 L665 Y677 F680	V478-L655 HydrophobicContact CG1-CD1 3.51Å; V478-L655 HydrophobicContact CG1-CD2 4.49Å; V478-I662 HydrophobicContact CG2-CG2 3.48Å; V478-I662 VanDerWaalsContact CG2-CG2 3.48Å; V478-I663 PolarHBondContact N-O 3.09Å; V478-H664 HydrophobicContact CG2-CB 4.41Å; V478-H664 WeakPolarHBondContact O-CA 3.42Å; V478-L665 PolarHBondContact O-N 2.89Å; V478-Y677 HydrophobicContact CG1-CD2 4.2Å; V478-Y677 HydrophobicContact CG1-CE2 4.16Å; V478-Y677 HydrophobicContact CG2-CE2 4.39Å; V478-F680 HydrophobicContact CG2-CD1 4.46Å; V478-F680 HydrophobicContact CG2-CE1 3.94Å; V478-F680 HydrophobicContact CG2-CZ 4.23Å
479	G	86.8	Confident	89.1	Confident	10 Å²	10	27.8 Å²	27.8	10%	0.103	16%	0.159	C	C	.	.			trans	172	169.7	175.4	0	0	0	0	0	112.1	H650	G479-H650 PolarHBondContact O-CE1 2.9Å
480	P	83	Confident	89	Confident	39 Å²	39	31.1 Å²	31.1	25%	0.253	17%	0.171	S	C	.	.			trans	-69.2	160.6	-174.7	-17.7	31.5	0	0	0	113.7	Y483	P480-Y483 HydrophobicContact CB-CD2 3.8Å; P480-Y483 HydrophobicContact CB-CE2 3.8Å; P480-Y483 HydrophobicContact CG-CD2 4.3Å; P480-Y483 HydrophobicContact CG-CE2 4.16Å; P480-Y483 WeakPolarHBondContact O-CB 3.29Å; P480-Y483 PolarHBondContact O-N 2.83Å
481	N	81.7	Confident	88.9	Confident	42 Å²	42	29 Å²	29	23%	0.225	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	142.5	-177.2	-73.6	-20.1	0	0	0	112.8	K485 H650 N917	N481-K485 PolarHBondContact OD1-NZ 3.36Å; N481-H650 PolarHBondContact OD1-NE2 3.13Å; N481-N917 PolarHBondContact ND2-O 2.86Å
482	G	76.1	Confident	88.8	Confident	45 Å²	45	25.6 Å²	25.6	46%	0.464	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.6	12.2	-172.8	0	0	0	0	0	116	K459	K459-G482 PolarHBondContact NZ-O 2.93Å
483	Y	81.3	Confident	88.9	Confident	80 Å²	80	25.7 Å²	25.7	31%	0.314	14%	0.14	S	C	.	.	S	Bend	trans	-89.9	-10.9	174.5	-81.5	-118.5	0	0	0	114.3	P480	P480-Y483 HydrophobicContact CB-CD2 3.8Å; P480-Y483 HydrophobicContact CB-CE2 3.8Å; P480-Y483 HydrophobicContact CG-CD2 4.3Å; P480-Y483 HydrophobicContact CG-CE2 4.16Å; P480-Y483 WeakPolarHBondContact O-CB 3.29Å; P480-Y483 PolarHBondContact O-N 2.83Å
484	G	83.2	Confident	88.6	Confident	8 Å²	8	25.5 Å²	25.5	8%	0.082	15%	0.148	C	C	.	.	S	Bend	trans	106.8	27.5	172.8	0	0	0	0	0	116.6	T487 L488	G484-T487 WeakPolarHBondContact O-CB 3.43Å; G484-T487 PolarHBondContact O-N 2.77Å; G484-L488 PolarHBondContact O-N 3.37Å
485	K	88.4	Confident	88.2	Confident	10 Å²	10	28.9 Å²	28.9	4%	0.043	16%	0.161	C	C	.	.	H	α-helix	trans	-54.8	-63.3	177.8	-44	-167.5	-47.5	-94.6	0	111.6	N481 T487 L488 L489 E621 V648 H650 L665	N481-K485 PolarHBondContact OD1-NZ 3.36Å; K485-T487 VanDerWaalsContact C-N 3.28Å; K485-T487 PolarHBondContact O-N 3.25Å; K485-L488 WeakPolarHBondContact O-CB 3.28Å; K485-L488 PolarHBondContact O-N 3.19Å; K485-L488 VanDerWaalsContact O-N 3.11Å; K485-L489 PolarHBondContact O-N 2.82Å; K485-E621 WeakPolarHBondContact CE-OE1 3.42Å; K485-E621 IonicContact NZ-OE1 2.97Å; K485-E621 PolarHBondContact NZ-OE1 3.46Å; K485-V648 HydrophobicContact CB-CG1 4.01Å; K485-V648 HydrophobicContact CB-CG2 4.08Å; K485-V648 HydrophobicContact CD-CG1 3.86Å; K485-H650 PolarHBondContact NZ-NE2 3.32Å; K485-L665 HydrophobicContact CG-CD2 4.18Å
486	T	87.3	Confident	87.7	Confident	39 Å²	39	30.2 Å²	30.2	24%	0.239	17%	0.174	C	C	.	.	H	α-helix	trans	-51.5	-43.1	171.4	-45.5	0	0	0	0	112.7	L488 L489 R490 E509 D620	T486-L488 VanDerWaalsContact C-N 3.32Å; T486-L488 PolarHBondContact O-N 3.2Å; T486-L489 PolarHBondContact O-N 2.77Å; T486-L489 VanDerWaalsContact O-N 3.17Å; T486-R490 WeakPolarHBondContact O-CG 3.41Å; T486-R490 PolarHBondContact O-N 2.98Å; T486-E509 WeakPolarHBondContact CG2-OE1 3.44Å; T486-D620 WeakPolarHBondContact CA-OD2 3.39Å; T486-D620 WeakPolarHBondContact CB-OD2 3.49Å; T486-D620 WeakPolarHBondContact CG2-OD2 3.39Å; T486-D620 PolarHBondContact OG1-OD2 3.03Å
487	T	88	Confident	87.2	Confident	21 Å²	21	30.2 Å²	30.2	13%	0.129	17%	0.174	C	C	.	.	H	α-helix	trans	-59	-42.9	179	-51.7	0	0	0	0	112	F427 I454 L461 G484 K485 R490 H491	F427-T487 HydrophobicContact CD1-CG2 3.65Å; F427-T487 HydrophobicContact CE1-CG2 3.32Å; F427-T487 HydrophobicContact CZ-CG2 4.17Å; I454-T487 HydrophobicContact CG2-CG2 4.19Å; L461-T487 HydrophobicContact CD1-CG2 3.85Å; G484-T487 WeakPolarHBondContact O-CB 3.43Å; G484-T487 PolarHBondContact O-N 2.77Å; K485-T487 VanDerWaalsContact C-N 3.28Å; K485-T487 PolarHBondContact O-N 3.25Å; T487-R490 PolarHBondContact O-N 3.39Å; T487-H491 PolarHBondContact O-N 3.41Å; T487-H491 PolarHBondContact O-ND1 3.46Å
488	L	90.9	Very high	86.6	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-63.4	-46.4	175.6	179.6	62.2	0	0	0	110.9	F452 F462 L477 G484 K485 T486 R490 H491 I492 I497 L670	F452-L488 HydrophobicContact CE2-CD1 3.83Å; F452-L488 HydrophobicContact CZ-CD1 3.75Å; F462-L488 HydrophobicContact CE1-CD1 4.48Å; F462-L488 HydrophobicContact CE1-CD2 3.95Å; F462-L488 HydrophobicContact CE2-CB 4.06Å; F462-L488 HydrophobicContact CZ-CB 3.71Å; F462-L488 HydrophobicContact CZ-CD1 4.38Å; F462-L488 HydrophobicContact CZ-CD2 3.9Å; F462-L488 HydrophobicContact CZ-CG 4.21Å; L477-L488 HydrophobicContact CD2-CD2 3.97Å; G484-L488 PolarHBondContact O-N 3.37Å; K485-L488 WeakPolarHBondContact O-CB 3.28Å; K485-L488 PolarHBondContact O-N 3.19Å; K485-L488 VanDerWaalsContact O-N 3.11Å; T486-L488 VanDerWaalsContact C-N 3.32Å; T486-L488 PolarHBondContact O-N 3.2Å; L488-R490 PolarHBondContact O-N 2.89Å; L488-H491 PolarHBondContact O-N 2.97Å; L488-I492 HydrophobicContact CD1-CD1 4.12Å; L488-I492 HydrophobicContact CD1-CG1 4.35Å; L488-I492 HydrophobicContact CG-CD1 3.9Å; L488-I492 VanDerWaalsContact O-CG1 3.28Å; L488-I492 WeakPolarHBondContact O-CG1 3.39Å; L488-I492 PolarHBondContact O-N 3.3Å; L488-I497 HydrophobicContact CD1-CD1 3.57Å; L488-L670 HydrophobicContact CD2-CD1 3.97Å; L488-L670 HydrophobicContact CD2-CD2 4.22Å
489	L	92.2	Very high	86.4	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-58.9	-44.4	177.2	-64.2	-170.3	0	0	0	112.2	K485 T486 H491 I492 A493 L507 L618 D620 L646 V648	K485-L489 PolarHBondContact O-N 2.82Å; T486-L489 PolarHBondContact O-N 2.77Å; T486-L489 VanDerWaalsContact O-N 3.17Å; L489-H491 PolarHBondContact O-N 2.82Å; L489-I492 PolarHBondContact O-N 2.84Å; L489-A493 WeakPolarHBondContact O-CB 3.27Å; L489-A493 PolarHBondContact O-N 3.38Å; L489-L507 HydrophobicContact CB-CD1 3.96Å; L489-L507 HydrophobicContact CB-CD2 4.32Å; L489-L507 HydrophobicContact CD1-CD1 4.03Å; L489-L618 HydrophobicContact CD2-CB 4.4Å; L489-L618 HydrophobicContact CD2-CD1 4.49Å; L489-L618 HydrophobicContact CD2-CD2 4.39Å; L489-D620 HydrophobicContact CD1-CB 3.69Å; L489-D620 WeakPolarHBondContact CD1-OD1 3.4Å; L489-L646 HydrophobicContact CD2-CD2 3.64Å; L489-L646 HydrophobicContact CD2-CG 3.96Å; L489-V648 HydrophobicContact CD1-CB 4.43Å; L489-V648 HydrophobicContact CD1-CG2 3.72Å; L489-V648 HydrophobicContact CG-CG2 4.16Å
490	R	90.3	Very high	86.3	Confident	72 Å²	72	36 Å²	36	27%	0.272	20%	0.203	S	C	.	.	H	α-helix	trans	-59.2	-44.5	174.4	-69.5	-175	-163.5	167.6	9.3	112.5	T486 T487 L488 I492 A493 T494 L507 E509	T486-R490 WeakPolarHBondContact O-CG 3.41Å; T486-R490 PolarHBondContact O-N 2.98Å; T487-R490 PolarHBondContact O-N 3.39Å; L488-R490 PolarHBondContact O-N 2.89Å; R490-I492 VanDerWaalsContact C-N 3.29Å; R490-I492 PolarHBondContact O-N 3.34Å; R490-A493 PolarHBondContact O-N 3.31Å; R490-T494 PolarHBondContact O-N 2.87Å; R490-T494 PolarHBondContact O-OG1 2.81Å; R490-L507 HydrophobicContact CG-CD2 4.2Å; R490-E509 WeakPolarHBondContact CG-OE2 3.37Å; R490-E509 IonicContact CZ-OE1 3.94Å; R490-E509 IonicContact CZ-OE2 2.74Å; R490-E509 VanDerWaalsContact NE-CD 3.3Å; R490-E509 IonicContact NE-OE1 3.27Å; R490-E509 PolarHBondContact NE-OE1 2.87Å; R490-E509 IonicContact NE-OE2 3.67Å; R490-E509 PolarHBondContact NE-OE2 2.93Å; R490-E509 IonicContact NH2-OE1 3.59Å; R490-E509 PolarHBondContact NH2-OE1 3.07Å
491	H	89.9	Confident	86.4	Confident	3 Å²	3	37.4 Å²	37.4	1%	0.014	22%	0.218	C	C	.	.	H	α-helix	trans	-69.6	-24	179.2	-75.5	69.2	0	0	0	113.5	F427 I454 T487 L488 L489 A496 I497	F427-H491 AromaticContact CD1-CE1 3.78Å; F427-H491 AromaticContact CG-CE1 3.77Å; I454-H491 HydrophobicContact CD1-CB 4.2Å; T487-H491 PolarHBondContact O-N 3.41Å; T487-H491 PolarHBondContact O-ND1 3.46Å; L488-H491 PolarHBondContact O-N 2.97Å; L489-H491 PolarHBondContact O-N 2.82Å; H491-A496 HydrophobicContact CB-CB 4.49Å; H491-A496 PolarHBondContact O-N 3.13Å; H491-A496 VanDerWaalsContact O-N 3.14Å; H491-I497 HydrophobicContact CB-CD1 3.93Å; H491-I497 HydrophobicContact CB-CG1 4.15Å; H491-I497 PolarHBondContact O-N 3.05Å
492	I	90.8	Very high	86.5	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-75.5	-48.4	170	-67.1	169.7	0	0	0	109.4	L467 L488 L489 R490 T494 R495 I497 I499 V505 L618 L646	L467-I492 HydrophobicContact CD1-CD1 4.33Å; L467-I492 HydrophobicContact CD2-CD1 3.78Å; L467-I492 HydrophobicContact CD2-CG1 4.01Å; L488-I492 HydrophobicContact CD1-CD1 4.12Å; L488-I492 HydrophobicContact CD1-CG1 4.35Å; L488-I492 HydrophobicContact CG-CD1 3.9Å; L488-I492 VanDerWaalsContact O-CG1 3.28Å; L488-I492 WeakPolarHBondContact O-CG1 3.39Å; L488-I492 PolarHBondContact O-N 3.3Å; L489-I492 PolarHBondContact O-N 2.84Å; R490-I492 VanDerWaalsContact C-N 3.29Å; R490-I492 PolarHBondContact O-N 3.34Å; I492-T494 PolarHBondContact O-N 2.87Å; I492-R495 PolarHBondContact O-N 3.16Å; I492-R495 VanDerWaalsContact O-N 3.11Å; I492-I497 HydrophobicContact CG1-CD1 4.04Å; I492-I499 HydrophobicContact CB-CD1 3.97Å; I492-I499 HydrophobicContact CG1-CD1 4.33Å; I492-I499 HydrophobicContact CG2-CD1 3.51Å; I492-I499 VanDerWaalsContact O-CD1 3.23Å; I492-I499 WeakPolarHBondContact O-CD1 3.33Å; I492-V505 HydrophobicContact CG2-CG1 4.15Å; I492-L618 HydrophobicContact CB-CD1 4.15Å; I492-L618 HydrophobicContact CG2-CD1 3.71Å; I492-L618 HydrophobicContact CG2-CD2 4.29Å; I492-L646 HydrophobicContact CD1-CD2 4.06Å
493	A	89.8	Confident	87	Confident	33 Å²	33	36.9 Å²	36.9	27%	0.273	20%	0.204	S	C	.	.	H	α-helix	trans	-62.4	-41.3	-178.2	0	0	0	0	0	113.5	L489 R490 R495 L507 L618	L489-A493 WeakPolarHBondContact O-CB 3.27Å; L489-A493 PolarHBondContact O-N 3.38Å; R490-A493 PolarHBondContact O-N 3.31Å; A493-R495 PolarHBondContact O-N 3.45Å; A493-L507 HydrophobicContact CB-CB 3.7Å; A493-L507 HydrophobicContact CB-CD2 3.8Å; A493-L507 HydrophobicContact CB-CG 4.41Å; A493-L618 HydrophobicContact CB-CD1 4.28Å
494	T	87.7	Confident	87.4	Confident	77 Å²	77	36.5 Å²	36.5	47%	0.472	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	6.8	176.9	61.1	0	0	0	0	113.9	L424 R490 I492 A496	L424-T494 HydrophobicContact CD1-CG2 3.53Å; L424-T494 WeakPolarHBondContact CD1-OG1 3.23Å; R490-T494 PolarHBondContact O-N 2.87Å; R490-T494 PolarHBondContact O-OG1 2.81Å; I492-T494 PolarHBondContact O-N 2.87Å; T494-A496 PolarHBondContact O-N 2.89Å; T494-A496 VanDerWaalsContact O-N 3.08Å
495	R	86.6	Confident	87.7	Confident	113 Å²	113	37.6 Å²	37.6	43%	0.426	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	25.4	-178	-63.1	179.4	166.2	-171.8	-8.4	114.1	I492 A493 I497 A501 I503	I492-R495 PolarHBondContact O-N 3.16Å; I492-R495 VanDerWaalsContact O-N 3.11Å; A493-R495 PolarHBondContact O-N 3.45Å; R495-I497 VanDerWaalsContact C-N 3.34Å; R495-I497 CarbonylContact C-O 3.59Å; R495-I497 VanDerWaalsContact C-O 3.3Å; R495-A501 PolarHBondContact NH2-O 2.88Å; R495-I503 PolarHBondContact NH2-O 2.98Å
496	A	85.5	Confident	87.9	Confident	37 Å²	37	39 Å²	39	31%	0.306	22%	0.22	S	C	.	.			trans	-67.8	-38.1	172.6	0	0	0	0	0	110.9	L429 Q431 H491 T494	L429-A496 HydrophobicContact CD2-CB 3.92Å; L429-A496 VanDerWaalsContact CD2-O 3.22Å; L429-A496 WeakPolarHBondContact CD2-O 3.22Å; Q431-A496 PolarHBondContact NE2-O 3.36Å; H491-A496 HydrophobicContact CB-CB 4.49Å; H491-A496 PolarHBondContact O-N 3.13Å; H491-A496 VanDerWaalsContact O-N 3.14Å; T494-A496 PolarHBondContact O-N 2.89Å; T494-A496 VanDerWaalsContact O-N 3.08Å
497	I	84.8	Confident	88.1	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.218	C	C	.	.	S	Bend	trans	-73.9	130.6	159.4	-71.3	168.7	0	0	0	107.8	V449 F452 I454 L467 L488 H491 I492 R495 I499	V449-I497 HydrophobicContact CB-CG2 4.25Å; V449-I497 HydrophobicContact CG1-CG2 4.2Å; V449-I497 HydrophobicContact CG2-CG2 3.8Å; F452-I497 HydrophobicContact CD2-CD1 4.27Å; F452-I497 HydrophobicContact CE2-CD1 4.2Å; I454-I497 HydrophobicContact CD1-CD1 4.32Å; L467-I497 HydrophobicContact CD2-CG2 4.23Å; L488-I497 HydrophobicContact CD1-CD1 3.57Å; H491-I497 HydrophobicContact CB-CD1 3.93Å; H491-I497 HydrophobicContact CB-CG1 4.15Å; H491-I497 PolarHBondContact O-N 3.05Å; I492-I497 HydrophobicContact CG1-CD1 4.04Å; R495-I497 VanDerWaalsContact C-N 3.34Å; R495-I497 CarbonylContact C-O 3.59Å; R495-I497 VanDerWaalsContact C-O 3.3Å; I497-I499 HydrophobicContact CB-CD1 4.49Å; I497-I499 HydrophobicContact CG2-CD1 4.41Å; I497-I499 HydrophobicContact CG2-CG1 4.28Å; I497-I499 WeakPolarHBondContact O-CG1 3.14Å; I497-I499 PolarHBondContact O-N 3.39Å
498	N	83.5	Confident	87.9	Confident	112 Å²	112	38.4 Å²	38.4	60%	0.599	22%	0.215	S	C	*	.			trans	-66	104.3	-175.8	-176.7	26.1	0	0	0	111.6	V449	V449-N498 WeakPolarHBondContact CG2-O 3.04Å
499	I	85.9	Confident	87	Confident	9 Å²	9	40.9 Å²	40.9	5%	0.046	23%	0.227	C	C	.	.			trans	-117.6	131.9	-176.7	-70.3	155.5	0	0	0	108.8	I447 I492 I497 A501 I503 V505	I447-I499 HydrophobicContact CD1-CG1 4.41Å; I447-I499 HydrophobicContact CD1-CG2 3.9Å; I447-I499 HydrophobicContact CG1-CG2 4.34Å; I447-I499 HydrophobicContact CG2-CG1 4.22Å; I492-I499 HydrophobicContact CB-CD1 3.97Å; I492-I499 HydrophobicContact CG1-CD1 4.33Å; I492-I499 HydrophobicContact CG2-CD1 3.51Å; I492-I499 VanDerWaalsContact O-CD1 3.23Å; I492-I499 WeakPolarHBondContact O-CD1 3.33Å; I497-I499 HydrophobicContact CB-CD1 4.49Å; I497-I499 HydrophobicContact CG2-CD1 4.41Å; I497-I499 HydrophobicContact CG2-CG1 4.28Å; I497-I499 WeakPolarHBondContact O-CG1 3.14Å; I497-I499 PolarHBondContact O-N 3.39Å; I499-A501 PolarHBondContact O-N 3.22Å; I499-I503 HydrophobicContact CG2-CB 4.48Å; I499-V505 HydrophobicContact CG2-CG2 4.25Å
500	P	86	Confident	85.8	Confident	15 Å²	15	47.8 Å²	47.8	10%	0.097	26%	0.26	C	S	.	.			trans	-50	130	178.1	-30	36.9	0	0	0	113	N502 I503	P500-N502 VanDerWaalsContact C-OD1 3.26Å; P500-N502 WeakPolarHBondContact CB-OD1 3.2Å; P500-N502 PolarHBondContact O-N 3.47Å; P500-N502 PolarHBondContact O-OD1 3Å; P500-I503 HydrophobicContact CB-CD1 4.13Å; P500-I503 HydrophobicContact CB-CG1 4.37Å; P500-I503 HydrophobicContact CG-CD1 4.29Å; P500-I503 PolarHBondContact O-N 3.36Å
501	A	83.6	Confident	85	Confident	68 Å²	68	48 Å²	48	56%	0.562	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-23.6	-168.1	0	0	0	0	0	113.9	R495 I499 I503	R495-A501 PolarHBondContact NH2-O 2.88Å; I499-A501 PolarHBondContact O-N 3.22Å; A501-I503 PolarHBondContact O-N 2.88Å
502	N	85.3	Confident	84.3	Confident	70 Å²	70	48.2 Å²	48.2	37%	0.374	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-13.6	172.6	63.3	-44.2	0	0	0	114.2	D442 Q444 P500	D442-N502 PolarHBondContact O-ND2 3.01Å; D442-N502 VanDerWaalsContact O-ND2 3.16Å; Q444-N502 PolarHBondContact O-ND2 2.82Å; P500-N502 VanDerWaalsContact C-OD1 3.26Å; P500-N502 WeakPolarHBondContact CB-OD1 3.2Å; P500-N502 PolarHBondContact O-N 3.47Å; P500-N502 PolarHBondContact O-OD1 3Å
503	I	86.6	Confident	83.9	Confident	6 Å²	6	52.8 Å²	52.8	3%	0.031	29%	0.293	C	S	.	.	S	Bend	trans	-94.9	112.5	177.5	-58.4	175.3	0	0	0	108.7	I447 R495 I499 P500 A501 V505 L616	I447-I503 HydrophobicContact CD1-CD1 4.16Å; I447-I503 HydrophobicContact CD1-CG2 4.5Å; I447-I503 HydrophobicContact CG1-CD1 3.53Å; R495-I503 PolarHBondContact NH2-O 2.98Å; I499-I503 HydrophobicContact CG2-CB 4.48Å; P500-I503 HydrophobicContact CB-CD1 4.13Å; P500-I503 HydrophobicContact CB-CG1 4.37Å; P500-I503 HydrophobicContact CG-CD1 4.29Å; P500-I503 PolarHBondContact O-N 3.36Å; A501-I503 PolarHBondContact O-N 2.88Å; I503-V505 HydrophobicContact CG2-CG2 4.02Å; I503-L616 HydrophobicContact CG2-CB 4.04Å
504	D	88.7	Confident	83.5	Confident	72 Å²	72	53.6 Å²	53.6	39%	0.385	30%	0.3	S	S	.	.			trans	-74.4	124.7	168.4	64.3	-49.9	0	0	0	110.2	P614 T615 L616	D504-P614 WeakPolarHBondContact OD2-CA 3.17Å; D504-P614 WeakPolarHBondContact OD2-CB 3.33Å; D504-T615 PolarHBondContact O-OG1 3.09Å; D504-T615 WeakPolarHBondContact OD1-CB 3.29Å; D504-T615 WeakPolarHBondContact OD1-CG2 3.5Å; D504-T615 PolarHBondContact OD1-N 3.29Å; D504-T615 PolarHBondContact OD1-OG1 3.46Å; D504-T615 PolarHBondContact OD2-N 3.23Å; D504-T615 VanDerWaalsContact OD2-N 3.08Å; D504-L616 PolarHBondContact O-N 2.93Å; D504-L616 VanDerWaalsContact O-N 3.17Å
505	V	90.8	Very high	83.4	Confident	32 Å²	32	53 Å²	53	19%	0.194	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	126.3	-174.8	-177.1	0	0	0	0	108	I492 I499 I503 L616 L618	I492-V505 HydrophobicContact CG2-CG1 4.15Å; I499-V505 HydrophobicContact CG2-CG2 4.25Å; I503-V505 HydrophobicContact CG2-CG2 4.02Å; V505-L616 HydrophobicContact CG1-CD2 4.45Å; V505-L616 HydrophobicContact CG2-CB 4.43Å; V505-L616 HydrophobicContact CG2-CD2 4.22Å; V505-L618 HydrophobicContact CG1-CD1 3.57Å; V505-L618 HydrophobicContact CG1-CD2 4.49Å; V505-L618 HydrophobicContact CG1-CG 3.88Å
506	L	91.6	Very high	83.5	Confident	38 Å²	38	52.2 Å²	52.2	20%	0.199	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	133.3	174.4	-171.8	62.9	0	0	0	110	A609 L612 P614 L616 L618	L506-A609 HydrophobicContact CD2-CB 3.79Å; L506-L612 HydrophobicContact CD2-CD1 3.96Å; L506-P614 HydrophobicContact CB-CB 4.21Å; L506-P614 HydrophobicContact CB-CG 3.83Å; L506-P614 HydrophobicContact CD2-CG 4.4Å; L506-L616 PolarHBondContact N-O 2.92Å; L506-L618 WeakPolarHBondContact O-CB 3.39Å; L506-L618 PolarHBondContact O-N 2.85Å
507	L	91.3	Very high	83.7	Confident	36 Å²	36	51.3 Å²	51.3	19%	0.188	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	119.8	172.9	177.4	58.1	0	0	0	110.5	L489 R490 A493 E509 L618	L489-L507 HydrophobicContact CB-CD1 3.96Å; L489-L507 HydrophobicContact CB-CD2 4.32Å; L489-L507 HydrophobicContact CD1-CD1 4.03Å; R490-L507 HydrophobicContact CG-CD2 4.2Å; A493-L507 HydrophobicContact CB-CB 3.7Å; A493-L507 HydrophobicContact CB-CD2 3.8Å; A493-L507 HydrophobicContact CB-CG 4.41Å; L507-E509 HydrophobicContact CD1-CB 4.31Å; L507-E509 HydrophobicContact CD2-CB 4.1Å; L507-E509 HydrophobicContact CG-CB 3.85Å; L507-E509 PolarHBondContact O-N 3.18Å; L507-L618 HydrophobicContact CB-CB 4.34Å; L507-L618 HydrophobicContact CB-CD1 4.32Å; L507-L618 HydrophobicContact CD1-CB 3.76Å; L507-L618 HydrophobicContact CD1-CD1 4.49Å
508	C	84.7	Confident	84	Confident	12 Å²	12	53.1 Å²	53.1	8%	0.081	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	91	166.8	-168.9	0	0	0	0	109	A609 L618 L619	C508-A609 HydrophobicContact CB-CB 4.26Å; C508-L618 PolarHBondContact N-O 3.12Å; C508-L619 HydrophobicContact CB-CD2 3.7Å
509	E	72	Confident	84.3	Confident	54 Å²	54	47.8 Å²	47.8	25%	0.252	28%	0.279	S	S	.	.			trans	-127.3	-30.3	173.9	178	173.7	-163.3	0	0	112.9	T486 R490 L507 M602	T486-E509 WeakPolarHBondContact CG2-OE1 3.44Å; R490-E509 WeakPolarHBondContact CG-OE2 3.37Å; R490-E509 IonicContact CZ-OE1 3.94Å; R490-E509 IonicContact CZ-OE2 2.74Å; R490-E509 VanDerWaalsContact NE-CD 3.3Å; R490-E509 IonicContact NE-OE1 3.27Å; R490-E509 PolarHBondContact NE-OE1 2.87Å; R490-E509 IonicContact NE-OE2 3.67Å; R490-E509 PolarHBondContact NE-OE2 2.93Å; R490-E509 IonicContact NH2-OE1 3.59Å; R490-E509 PolarHBondContact NH2-OE1 3.07Å; L507-E509 HydrophobicContact CD1-CB 4.31Å; L507-E509 HydrophobicContact CD2-CB 4.1Å; L507-E509 HydrophobicContact CG-CB 3.85Å; L507-E509 PolarHBondContact O-N 3.18Å; E509-M602 WeakPolarHBondContact O-CE 3.22Å
510	Q	66.5	Low	84.6	Confident	145 Å²	145	48.4 Å²	48.4	68%	0.678	28%	0.282	S	S	*	.	S	Bend	trans	-101.2	141.4	-172.4	-166	62.3	45.3	0	0	111.9	S605	Q510-S605 WeakPolarHBondContact O-CB 3.43Å; Q510-S605 PolarHBondContact O-OG 2.84Å
511	E	74.1	Confident	84.9	Confident	75 Å²	75	50.9 Å²	50.9	35%	0.35	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-56.7	149.2	164.9	-67.3	-173.5	-170.6	0	0	111.5	G598 R601 M602	E511-G598 WeakPolarHBondContact OE1-CA 3.23Å; E511-G598 WeakPolarHBondContact OE2-CA 3.46Å; E511-R601 HydrophobicContact CB-CB 4.11Å; E511-R601 HydrophobicContact CG-CB 4.46Å; E511-R601 IonicContact OE2-NH1 2.79Å; E511-M602 HydrophobicContact CG-CE 4.02Å
512	V	75.5	Confident	85.1	Confident	8 Å²	8	49.5 Å²	49.5	5%	0.048	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-64.3	142.7	167.1	178.8	0	0	0	0	109.7	M522 T593 R601 V604	V512-M522 HydrophobicContact CG1-CE 4.06Å; V512-M522 HydrophobicContact CG1-CG 3.89Å; V512-T593 HydrophobicContact CG1-CG2 4.33Å; V512-R601 HydrophobicContact CB-CB 4.49Å; V512-R601 WeakPolarHBondContact O-CD 3.48Å; V512-V604 HydrophobicContact CG2-CB 3.94Å; V512-V604 HydrophobicContact CG2-CG1 3.98Å
513	V	81.1	Confident	85.4	Confident	97 Å²	97	46.1 Å²	46.1	59%	0.588	26%	0.256	S	S	*	.	P	Polyproline II helix	trans	-57.7	146.5	177.3	-173.2	0	0	0	0	109.9	D515 T593	V513-D515 WeakPolarHBondContact CG1-OD1 3.23Å; V513-D515 PolarHBondContact O-N 2.89Å; V513-T593 PolarHBondContact O-OG1 3.29Å
514	A	82.4	Confident	85.6	Confident	50 Å²	50	46.5 Å²	46.5	41%	0.413	26%	0.258	S	S	.	.			trans	-78	64.7	-174.8	0	0	0	0	0	111.9	K594	A514-K594 HydrophobicContact CB-CB 4.48Å; A514-K594 WeakPolarHBondContact O-CB 3.47Å
515	D	85.3	Confident	85.5	Confident	64 Å²	64	48.4 Å²	48.4	34%	0.342	26%	0.26	S	S	.	.			trans	-93.6	161.4	-171.6	-65.6	-31.8	0	0	0	113.1	V513 T517 T593 K594	V513-D515 WeakPolarHBondContact CG1-OD1 3.23Å; V513-D515 PolarHBondContact O-N 2.89Å; D515-T517 PolarHBondContact O-N 3.05Å; D515-T593 PolarHBondContact N-OG1 2.69Å; D515-T593 VanDerWaalsContact N-OG1 3.09Å; D515-T593 PolarHBondContact O-N 3.3Å; D515-T593 PolarHBondContact O-OG1 2.7Å; D515-K594 WeakPolarHBondContact O-CG 3.46Å; D515-K594 PolarHBondContact O-N 3.08Å
516	S	89.5	Confident	85.2	Confident	97 Å²	97	47.8 Å²	47.8	68%	0.678	26%	0.257	S	S	*	.	S	Bend	trans	-68.1	-15.6	173.6	53.9	0	0	0	0	114	P592	S516-P592 WeakPolarHBondContact O-CB 3.45Å
517	T	88.7	Confident	85.1	Confident	18 Å²	18	47.7 Å²	47.7	11%	0.11	26%	0.257	C	S	.	.	S	Bend	trans	-63.5	134.9	179.4	-50.9	0	0	0	0	111.7	D515 E521 M522 P592 T593	D515-T517 PolarHBondContact O-N 3.05Å; T517-E521 HydrophobicContact CG2-CB 4.01Å; T517-E521 HydrophobicContact CG2-CG 4.12Å; T517-M522 HydrophobicContact CG2-CB 4.11Å; T517-P592 WeakPolarHBondContact O-CA 3.36Å; T517-T593 PolarHBondContact O-N 2.9Å
518	P	91.7	Very high	84.8	Confident	38 Å²	38	53.1 Å²	53.1	25%	0.247	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-58.2	148.1	171.9	-26.8	35.9	0	0	0	113.5	F520 E521 M522 R591	P518-F520 VanDerWaalsContact C-N 3.34Å; P518-F520 PolarHBondContact O-N 3.14Å; P518-E521 HydrophobicContact CB-CB 4.21Å; P518-E521 WeakPolarHBondContact CD-OE2 3.41Å; P518-E521 HydrophobicContact CG-CB 4.48Å; P518-E521 PolarHBondContact O-N 2.92Å; P518-M522 WeakPolarHBondContact O-CB 3.48Å; P518-M522 PolarHBondContact O-N 2.91Å; P518-R591 WeakPolarHBondContact CA-O 3.33Å
519	A	89.4	Confident	84.9	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-58.4	-40.7	-179.3	0	0	0	0	0	113.7	V523 F584 M589 R591 T593 L596 V604	A519-V523 PolarHBondContact O-N 3.48Å; A519-F584 HydrophobicContact CB-CE1 4.11Å; A519-M589 PolarHBondContact N-O 3.5Å; A519-R591 PolarHBondContact N-O 3.08Å; A519-T593 HydrophobicContact CB-CG2 4.46Å; A519-L596 HydrophobicContact CB-CD1 4.02Å; A519-V604 HydrophobicContact CB-CG2 3.88Å
520	F	92.8	Very high	85.6	Confident	22 Å²	22	55.8 Å²	55.8	10%	0.096	29%	0.285	C	S	.	.	H	α-helix	trans	-65	-46.3	175	163.2	-109.9	0	0	0	112.6	P518 M522 V523 L524 E572 A575 R576 L579 M589	P518-F520 VanDerWaalsContact C-N 3.34Å; P518-F520 PolarHBondContact O-N 3.14Å; F520-M522 VanDerWaalsContact C-N 3.31Å; F520-M522 PolarHBondContact O-N 2.87Å; F520-V523 PolarHBondContact O-N 3.03Å; F520-L524 HydrophobicContact CD1-CD1 4.48Å; F520-L524 HydrophobicContact CD2-CD1 4.4Å; F520-L524 HydrophobicContact CE1-CD1 3.76Å; F520-L524 HydrophobicContact CE2-CD1 3.67Å; F520-L524 HydrophobicContact CE2-CG 4.1Å; F520-L524 HydrophobicContact CZ-CD1 3.31Å; F520-L524 HydrophobicContact CZ-CG 4.24Å; F520-L524 PolarHBondContact O-N 3.21Å; F520-L524 VanDerWaalsContact O-N 3.16Å; F520-E572 HydrophobicContact CE2-CB 4.44Å; F520-E572 HydrophobicContact CZ-CB 4.13Å; F520-E572 HydrophobicContact CZ-CG 4.13Å; F520-A575 HydrophobicContact CD2-CB 4.14Å; F520-A575 HydrophobicContact CE2-CB 3.98Å; F520-R576 HydrophobicContact CD2-CG 3.77Å; F520-R576 HydrophobicContact CE2-CG 3.49Å; F520-R576 VanDerWaalsContact CE2-CG 3.49Å; F520-R576 HydrophobicContact CZ-CG 4.22Å; F520-R576 VanDerWaalsContact CZ-CZ 3.49Å; F520-L579 HydrophobicContact CB-CD1 4.03Å; F520-L579 HydrophobicContact CD2-CD1 4.41Å; F520-M589 HydrophobicContact CB-CB 4Å; F520-M589 PolarHBondContact N-O 2.91Å
521	E	90.8	Very high	86.7	Confident	67 Å²	67	51.5 Å²	51.5	31%	0.313	27%	0.267	S	S	.	.	H	α-helix	trans	-64.9	-37.7	178.9	-171	-178.9	-162.6	0	0	111.2	T517 P518 V523 L524 R525	T517-E521 HydrophobicContact CG2-CB 4.01Å; T517-E521 HydrophobicContact CG2-CG 4.12Å; P518-E521 HydrophobicContact CB-CB 4.21Å; P518-E521 WeakPolarHBondContact CD-OE2 3.41Å; P518-E521 HydrophobicContact CG-CB 4.48Å; P518-E521 PolarHBondContact O-N 2.92Å; E521-V523 VanDerWaalsContact C-N 3.29Å; E521-V523 PolarHBondContact O-N 3.42Å; E521-L524 CarbonylContact O-C 3.55Å; E521-L524 PolarHBondContact O-N 3.13Å; E521-L524 VanDerWaalsContact O-N 3.12Å; E521-R525 VanDerWaalsContact CD-CZ 3.45Å; E521-R525 HydrophobicContact CG-CG 3.97Å; E521-R525 WeakPolarHBondContact O-CB 3.38Å; E521-R525 WeakPolarHBondContact O-CG 3.49Å; E521-R525 PolarHBondContact O-N 3.05Å; E521-R525 IonicContact OE1-CZ 3.42Å; E521-R525 IonicContact OE1-NE 3.11Å; E521-R525 PolarHBondContact OE1-NE 2.75Å; E521-R525 IonicContact OE1-NH2 2.81Å; E521-R525 PolarHBondContact OE1-NH2 3.26Å; E521-R525 IonicContact OE2-CZ 2.71Å; E521-R525 IonicContact OE2-NE 2.64Å; E521-R525 IonicContact OE2-NH2 3.64Å; E521-R525 PolarHBondContact OE2-NH2 3.16Å
522	M	88.6	Confident	87.6	Confident	38 Å²	38	52.5 Å²	52.5	19%	0.187	27%	0.271	C	S	.	.	H	α-helix	trans	-65.2	-30.7	178.1	-171.4	53.6	-173.8	0	0	113.1	V512 T517 P518 F520 S526 T593	V512-M522 HydrophobicContact CG1-CE 4.06Å; V512-M522 HydrophobicContact CG1-CG 3.89Å; T517-M522 HydrophobicContact CG2-CB 4.11Å; P518-M522 WeakPolarHBondContact O-CB 3.48Å; P518-M522 PolarHBondContact O-N 2.91Å; F520-M522 VanDerWaalsContact C-N 3.31Å; F520-M522 PolarHBondContact O-N 2.87Å; M522-S526 PolarHBondContact O-N 3.14Å; M522-T593 HydrophobicContact CB-CG2 4.39Å
523	V	90.6	Very high	88.3	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-68.5	-46.9	169.6	174.6	0	0	0	0	110.4	A519 F520 E521 R525 S526 A575 L579 V604 A607 F611	A519-V523 PolarHBondContact O-N 3.48Å; F520-V523 PolarHBondContact O-N 3.03Å; E521-V523 VanDerWaalsContact C-N 3.29Å; E521-V523 PolarHBondContact O-N 3.42Å; V523-R525 PolarHBondContact O-N 3.03Å; V523-S526 WeakPolarHBondContact O-CB 3.43Å; V523-S526 PolarHBondContact O-N 3.49Å; V523-S526 PolarHBondContact O-OG 3.39Å; V523-A575 HydrophobicContact CG1-CB 3.95Å; V523-L579 HydrophobicContact CG2-CD1 4.18Å; V523-L579 HydrophobicContact CG2-CD2 4.21Å; V523-L579 HydrophobicContact CG2-CG 4.39Å; V523-V604 HydrophobicContact CG2-CG1 4.09Å; V523-A607 HydrophobicContact CG2-CB 3.82Å; V523-F611 HydrophobicContact CG1-CB 3.67Å; V523-F611 HydrophobicContact CG1-CD1 3.98Å; V523-F611 HydrophobicContact CG1-CD2 4.1Å; V523-F611 HydrophobicContact CG1-CG 3.65Å; V523-F611 WeakPolarHBondContact O-CD1 3.43Å
524	L	90.7	Very high	88.7	Confident	13 Å²	13	50.3 Å²	50.3	7%	0.068	26%	0.255	C	S	.	.	H	α-helix	trans	-65.6	-36.9	179.2	-75.5	-179.4	0	0	0	114	F520 E521 S526 R530 A571 E572 A575 F611	F520-L524 HydrophobicContact CD1-CD1 4.48Å; F520-L524 HydrophobicContact CD2-CD1 4.4Å; F520-L524 HydrophobicContact CE1-CD1 3.76Å; F520-L524 HydrophobicContact CE2-CD1 3.67Å; F520-L524 HydrophobicContact CE2-CG 4.1Å; F520-L524 HydrophobicContact CZ-CD1 3.31Å; F520-L524 HydrophobicContact CZ-CG 4.24Å; F520-L524 PolarHBondContact O-N 3.21Å; F520-L524 VanDerWaalsContact O-N 3.16Å; E521-L524 CarbonylContact O-C 3.55Å; E521-L524 PolarHBondContact O-N 3.13Å; E521-L524 VanDerWaalsContact O-N 3.12Å; L524-S526 PolarHBondContact O-N 3.39Å; L524-R530 PolarHBondContact O-NH2 3.32Å; L524-A571 HydrophobicContact CD2-CB 4.05Å; L524-E572 HydrophobicContact CD1-CG 4.12Å; L524-A575 HydrophobicContact CD2-CB 3.89Å; L524-A575 HydrophobicContact CG-CB 4.19Å; L524-F611 HydrophobicContact CD2-CE2 4.19Å; L524-F611 HydrophobicContact CD2-CZ 3.88Å
525	R	88.2	Confident	89.1	Confident	112 Å²	112	52.8 Å²	52.8	42%	0.423	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-12.6	176.7	-72.7	-179.7	-179.7	-166.7	3.9	113.3	E521 V523 D527 L531	E521-R525 VanDerWaalsContact CD-CZ 3.45Å; E521-R525 HydrophobicContact CG-CG 3.97Å; E521-R525 WeakPolarHBondContact O-CB 3.38Å; E521-R525 WeakPolarHBondContact O-CG 3.49Å; E521-R525 PolarHBondContact O-N 3.05Å; E521-R525 IonicContact OE1-CZ 3.42Å; E521-R525 IonicContact OE1-NE 3.11Å; E521-R525 PolarHBondContact OE1-NE 2.75Å; E521-R525 IonicContact OE1-NH2 2.81Å; E521-R525 PolarHBondContact OE1-NH2 3.26Å; E521-R525 IonicContact OE2-CZ 2.71Å; E521-R525 IonicContact OE2-NE 2.64Å; E521-R525 IonicContact OE2-NH2 3.64Å; E521-R525 PolarHBondContact OE2-NH2 3.16Å; V523-R525 PolarHBondContact O-N 3.03Å; R525-D527 VanDerWaalsContact C-N 3.29Å; R525-D527 PolarHBondContact O-N 3.03Å; R525-L531 HydrophobicContact CB-CD1 4.17Å; R525-L531 HydrophobicContact CG-CD1 4.24Å
526	S	84.9	Confident	89.4	Confident	20 Å²	20	53.3 Å²	53.3	14%	0.14	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-27.8	179.1	74.9	0	0	0	0	113.2	M522 V523 L524 K528	M522-S526 PolarHBondContact O-N 3.14Å; V523-S526 WeakPolarHBondContact O-CB 3.43Å; V523-S526 PolarHBondContact O-N 3.49Å; V523-S526 PolarHBondContact O-OG 3.39Å; L524-S526 PolarHBondContact O-N 3.39Å; S526-K528 PolarHBondContact O-N 3.14Å
527	D	87.5	Confident	89.4	Confident	35 Å²	35	49.7 Å²	49.7	19%	0.187	23%	0.234	C	C	.	.			trans	-83.6	89.6	170.6	-177.7	-7.3	0	0	0	109.8	R525 R529 R530 L531 F611 L612	R525-D527 VanDerWaalsContact C-N 3.29Å; R525-D527 PolarHBondContact O-N 3.03Å; D527-R529 VanDerWaalsContact C-N 3.35Å; D527-R529 PolarHBondContact OD1-N 2.76Å; D527-R530 HydrophobicContact CB-CB 4.18Å; D527-R530 PolarHBondContact OD1-N 2.94Å; D527-R530 VanDerWaalsContact OD2-CB 3.25Å; D527-R530 WeakPolarHBondContact OD2-CB 2.93Å; D527-L531 PolarHBondContact O-N 3.3Å; D527-F611 HydrophobicContact CB-CE1 3.89Å; D527-L612 HydrophobicContact CB-CD2 4.1Å
528	K	86.6	Confident	89.5	Confident	151 Å²	151	55.5 Å²	55.5	66%	0.657	26%	0.259	S	S	*	.	H	α-helix	trans	-62.4	-38.9	177.6	-66.8	-169.2	174.7	-167.2	0	112.6	S526 R530 L531 E532	S526-K528 PolarHBondContact O-N 3.14Å; K528-R530 VanDerWaalsContact C-N 3.34Å; K528-R530 PolarHBondContact O-N 3.3Å; K528-L531 WeakPolarHBondContact O-CB 3.06Å; K528-L531 PolarHBondContact O-N 2.88Å; K528-L531 VanDerWaalsContact O-N 3.11Å; K528-E532 WeakPolarHBondContact O-CB 3.5Å; K528-E532 VanDerWaalsContact O-CG 3.26Å; K528-E532 WeakPolarHBondContact O-CG 3.5Å; K528-E532 PolarHBondContact O-N 3.37Å
529	R	86.1	Confident	89.5	Confident	98 Å²	98	58.9 Å²	58.9	37%	0.37	27%	0.27	S	S	.	.	H	α-helix	trans	-65.1	-41	-176.2	-177.9	56.6	-178.2	160.3	3.2	111	D527 E532 L533 E562 I566	D527-R529 VanDerWaalsContact C-N 3.35Å; D527-R529 PolarHBondContact OD1-N 2.76Å; R529-E532 IonicContact NH1-OE2 3.29Å; R529-E532 PolarHBondContact O-N 3.13Å; R529-L533 HydrophobicContact CG-CD1 4.02Å; R529-L533 WeakPolarHBondContact O-CB 3.37Å; R529-L533 WeakPolarHBondContact O-CD1 3.43Å; R529-L533 VanDerWaalsContact O-CG 3.27Å; R529-L533 WeakPolarHBondContact O-CG 3.23Å; R529-L533 PolarHBondContact O-N 2.84Å; R529-E562 IonicContact CZ-OE1 3.24Å; R529-E562 IonicContact CZ-OE2 3.1Å; R529-E562 IonicContact NE-OE1 2.79Å; R529-E562 PolarHBondContact NE-OE1 3.49Å; R529-E562 IonicContact NE-OE2 2.71Å; R529-E562 VanDerWaalsContact NH2-CD 3.3Å; R529-E562 IonicContact NH2-OE1 2.77Å; R529-E562 PolarHBondContact NH2-OE1 3.12Å; R529-E562 VanDerWaalsContact NH2-OE1 3.15Å; R529-E562 IonicContact NH2-OE2 2.68Å; R529-E562 PolarHBondContact NH2-OE2 2.76Å; R529-I566 HydrophobicContact CG-CD1 4.33Å
530	R	87.7	Confident	89.5	Confident	23 Å²	23	59.5 Å²	59.5	9%	0.087	27%	0.273	C	S	.	.	H	α-helix	trans	-63.8	-37.7	172.7	-173.9	-164.7	68.6	79.9	10.8	112.6	L524 D527 K528 L534 A568	L524-R530 PolarHBondContact O-NH2 3.32Å; D527-R530 HydrophobicContact CB-CB 4.18Å; D527-R530 PolarHBondContact OD1-N 2.94Å; D527-R530 VanDerWaalsContact OD2-CB 3.25Å; D527-R530 WeakPolarHBondContact OD2-CB 2.93Å; K528-R530 VanDerWaalsContact C-N 3.34Å; K528-R530 PolarHBondContact O-N 3.3Å; R530-L534 HydrophobicContact CG-CD1 4.21Å; R530-L534 VanDerWaalsContact NH1-CD1 3.25Å; R530-L534 WeakPolarHBondContact O-CB 3.49Å; R530-L534 VanDerWaalsContact O-CG 3.25Å; R530-L534 WeakPolarHBondContact O-CG 3.22Å; R530-L534 PolarHBondContact O-N 2.99Å; R530-L534 VanDerWaalsContact O-N 3.08Å; R530-A568 HydrophobicContact CG-CB 4.25Å
531	L	89.2	Confident	89.3	Confident	56 Å²	56	64.1 Å²	64.1	29%	0.293	29%	0.293	S	S	.	.	H	α-helix	trans	-65.6	-49.5	173.8	-71.5	-178.4	0	0	0	111.8	R525 D527 K528 L533 L534 E535	R525-L531 HydrophobicContact CB-CD1 4.17Å; R525-L531 HydrophobicContact CG-CD1 4.24Å; D527-L531 PolarHBondContact O-N 3.3Å; K528-L531 WeakPolarHBondContact O-CB 3.06Å; K528-L531 PolarHBondContact O-N 2.88Å; K528-L531 VanDerWaalsContact O-N 3.11Å; L531-L533 VanDerWaalsContact C-N 3.31Å; L531-L533 PolarHBondContact O-N 2.99Å; L531-L534 PolarHBondContact O-N 3.1Å; L531-L534 VanDerWaalsContact O-N 3.17Å; L531-E535 PolarHBondContact O-N 3.13Å
532	E	91.6	Very high	89.2	Confident	95 Å²	95	63.9 Å²	63.9	44%	0.444	30%	0.299	S	S	.	.	H	α-helix	trans	-53.8	-47.4	177.7	-71.5	158.5	-161.6	0	0	111.4	K528 R529 E536	K528-E532 WeakPolarHBondContact O-CB 3.5Å; K528-E532 VanDerWaalsContact O-CG 3.26Å; K528-E532 WeakPolarHBondContact O-CG 3.5Å; K528-E532 PolarHBondContact O-N 3.37Å; R529-E532 IonicContact NH1-OE2 3.29Å; R529-E532 PolarHBondContact O-N 3.13Å; E532-E536 VanDerWaalsContact O-CB 3.29Å; E532-E536 WeakPolarHBondContact O-CB 3.39Å; E532-E536 PolarHBondContact O-N 2.81Å
533	L	90.2	Very high	89.2	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-67.4	-36.4	178.3	-74	166.4	0	0	0	113.5	R529 L531 C537 V559 E562 L563 I566	R529-L533 HydrophobicContact CG-CD1 4.02Å; R529-L533 WeakPolarHBondContact O-CB 3.37Å; R529-L533 WeakPolarHBondContact O-CD1 3.43Å; R529-L533 VanDerWaalsContact O-CG 3.27Å; R529-L533 WeakPolarHBondContact O-CG 3.23Å; R529-L533 PolarHBondContact O-N 2.84Å; L531-L533 VanDerWaalsContact C-N 3.31Å; L531-L533 PolarHBondContact O-N 2.99Å; L533-C537 WeakPolarHBondContact O-CB 3.36Å; L533-C537 PolarHBondContact O-N 2.8Å; L533-V559 HydrophobicContact CD2-CG1 3.97Å; L533-V559 HydrophobicContact CD2-CG2 4.44Å; L533-V559 WeakPolarHBondContact O-CG1 3.42Å; L533-E562 HydrophobicContact CD1-CB 4.21Å; L533-E562 HydrophobicContact CD1-CG 3.8Å; L533-E562 HydrophobicContact CD2-CB 4.18Å; L533-E562 HydrophobicContact CD2-CG 4.35Å; L533-L563 HydrophobicContact CB-CD1 4.5Å; L533-L563 HydrophobicContact CB-CD2 3.56Å; L533-L563 HydrophobicContact CB-CG 3.9Å; L533-L563 HydrophobicContact CD1-CD2 4.34Å; L533-I566 HydrophobicContact CD1-CD1 3.5Å; L533-I566 VanDerWaalsContact CD1-CD1 3.5Å
534	L	90	Very high	89	Confident	59 Å²	59	68.6 Å²	68.6	31%	0.309	33%	0.325	S	S	.	.	H	α-helix	trans	-69.3	-45.3	176	-76	170.8	0	0	0	111	R530 L531 E536 C537 E538 L563	R530-L534 HydrophobicContact CG-CD1 4.21Å; R530-L534 VanDerWaalsContact NH1-CD1 3.25Å; R530-L534 WeakPolarHBondContact O-CB 3.49Å; R530-L534 VanDerWaalsContact O-CG 3.25Å; R530-L534 WeakPolarHBondContact O-CG 3.22Å; R530-L534 PolarHBondContact O-N 2.99Å; R530-L534 VanDerWaalsContact O-N 3.08Å; L531-L534 PolarHBondContact O-N 3.1Å; L531-L534 VanDerWaalsContact O-N 3.17Å; L534-E536 VanDerWaalsContact C-N 3.32Å; L534-E536 PolarHBondContact O-N 2.92Å; L534-C537 WeakPolarHBondContact O-CB 3.43Å; L534-C537 PolarHBondContact O-N 2.82Å; L534-E538 WeakPolarHBondContact O-CG 3.28Å; L534-E538 PolarHBondContact O-N 3.17Å; L534-L563 HydrophobicContact CD2-CD1 4.11Å; L534-L563 HydrophobicContact CD2-CD2 3.91Å; L534-L563 HydrophobicContact CG-CD2 3.9Å
535	E	91.7	Very high	88.7	Confident	102 Å²	102	74.8 Å²	74.8	48%	0.477	35%	0.353	S	S	.	.	H	α-helix	trans	-59.1	-42.5	172.3	-81.1	-168	-138.3	0	0	112.1	L531 E538 K539	L531-E535 PolarHBondContact O-N 3.13Å; E535-E538 PolarHBondContact O-N 2.55Å; E535-K539 WeakPolarHBondContact O-CB 3.43Å; E535-K539 WeakPolarHBondContact O-CD 3.39Å; E535-K539 WeakPolarHBondContact O-CE 3.36Å; E535-K539 WeakPolarHBondContact O-CG 3.45Å; E535-K539 PolarHBondContact O-N 3.29Å; E535-K539 IonicContact OE2-NZ 3.08Å; E535-K539 PolarHBondContact OE2-NZ 3.29Å
536	E	90.8	Very high	88.5	Confident	76 Å²	76	75.4 Å²	75.4	36%	0.355	37%	0.369	S	S	.	.	H	α-helix	trans	-66.2	-40.3	176.6	-171.7	166	-157.3	0	0	111.2	E532 L534 E538 K539 L540 V559	E532-E536 VanDerWaalsContact O-CB 3.29Å; E532-E536 WeakPolarHBondContact O-CB 3.39Å; E532-E536 PolarHBondContact O-N 2.81Å; L534-E536 VanDerWaalsContact C-N 3.32Å; L534-E536 PolarHBondContact O-N 2.92Å; E536-E538 PolarHBondContact O-N 3.48Å; E536-K539 PolarHBondContact O-N 3.4Å; E536-L540 HydrophobicContact CG-CD1 3.87Å; E536-L540 HydrophobicContact CG-CG 4.3Å; E536-L540 VanDerWaalsContact O-CB 3.29Å; E536-L540 WeakPolarHBondContact O-CB 3.37Å; E536-L540 VanDerWaalsContact O-CG 3.24Å; E536-L540 WeakPolarHBondContact O-CG 3.45Å; E536-L540 PolarHBondContact O-N 2.95Å; E536-V559 HydrophobicContact CB-CG1 4.45Å; E536-V559 HydrophobicContact CG-CG2 4.03Å
537	C	89.5	Confident	88.1	Confident	21 Å²	21	78.3 Å²	78.3	14%	0.142	38%	0.383	C	S	.	.	H	α-helix	trans	-62.6	-40.3	174.2	-173.2	0	0	0	0	112.6	L533 L534 K541 V559 L563	L533-C537 WeakPolarHBondContact O-CB 3.36Å; L533-C537 PolarHBondContact O-N 2.8Å; L534-C537 WeakPolarHBondContact O-CB 3.43Å; L534-C537 PolarHBondContact O-N 2.82Å; C537-K541 WeakPolarHBondContact O-CB 3.22Å; C537-K541 PolarHBondContact O-N 3.39Å; C537-V559 HydrophobicContact CB-CG1 3.97Å; C537-L563 HydrophobicContact CB-CD1 3.8Å
538	E	90.5	Very high	87.6	Confident	139 Å²	139	83.8 Å²	83.8	65%	0.65	41%	0.408	S	S	*	.	H	α-helix	trans	-69.1	-40.6	176	-73.2	-178.3	170.4	0	0	112.2	L534 E535 E536 K541 S542	L534-E538 WeakPolarHBondContact O-CG 3.28Å; L534-E538 PolarHBondContact O-N 3.17Å; E535-E538 PolarHBondContact O-N 2.55Å; E536-E538 PolarHBondContact O-N 3.48Å; E538-K541 PolarHBondContact O-N 3.17Å; E538-S542 PolarHBondContact O-N 3.16Å; E538-S542 PolarHBondContact O-OG 3.43Å
539	K	91.7	Very high	87.4	Confident	110 Å²	110	78 Å²	78	48%	0.478	39%	0.386	S	S	.	.	H	α-helix	trans	-64.8	-44.1	174.4	-68.8	159.7	-161.4	169.8	0	111.3	E535 E536 S542 L543	E535-K539 WeakPolarHBondContact O-CB 3.43Å; E535-K539 WeakPolarHBondContact O-CD 3.39Å; E535-K539 WeakPolarHBondContact O-CE 3.36Å; E535-K539 WeakPolarHBondContact O-CG 3.45Å; E535-K539 PolarHBondContact O-N 3.29Å; E535-K539 IonicContact OE2-NZ 3.08Å; E535-K539 PolarHBondContact OE2-NZ 3.29Å; E536-K539 PolarHBondContact O-N 3.4Å; K539-S542 PolarHBondContact O-OG 2.85Å; K539-S542 VanDerWaalsContact O-OG 3.12Å; K539-L543 WeakPolarHBondContact O-CB 3.43Å; K539-L543 VanDerWaalsContact O-CG 3.24Å; K539-L543 WeakPolarHBondContact O-CG 3.26Å; K539-L543 PolarHBondContact O-N 2.77Å
540	L	89.2	Confident	87.2	Confident	13 Å²	13	77.8 Å²	77.8	7%	0.068	40%	0.397	C	S	.	.	H	α-helix	trans	-68	-36.4	176.2	-71.7	171.8	0	0	0	112.3	E536 L543 L544 V552 K555 F556 V559	E536-L540 HydrophobicContact CG-CD1 3.87Å; E536-L540 HydrophobicContact CG-CG 4.3Å; E536-L540 VanDerWaalsContact O-CB 3.29Å; E536-L540 WeakPolarHBondContact O-CB 3.37Å; E536-L540 VanDerWaalsContact O-CG 3.24Å; E536-L540 WeakPolarHBondContact O-CG 3.45Å; E536-L540 PolarHBondContact O-N 2.95Å; L540-L543 PolarHBondContact O-N 3.19Å; L540-L544 VanDerWaalsContact O-CB 3.26Å; L540-L544 WeakPolarHBondContact O-CB 3.33Å; L540-L544 PolarHBondContact O-N 2.86Å; L540-V552 HydrophobicContact CD2-CG1 4.26Å; L540-K555 HydrophobicContact CD1-CB 4.04Å; L540-K555 HydrophobicContact CD2-CB 4.23Å; L540-F556 HydrophobicContact CB-CB 4.32Å; L540-F556 HydrophobicContact CB-CD2 4.01Å; L540-V559 HydrophobicContact CD1-CB 4.33Å; L540-V559 HydrophobicContact CD1-CG2 3.95Å
541	K	89.3	Confident	87	Confident	118 Å²	118	80 Å²	80	51%	0.513	42%	0.416	S	S	.	.	H	α-helix	trans	-65.3	-47.1	175.3	-176.9	-175.5	172.8	-169.3	0	112.2	C537 E538 L543 L544 E545 F556	C537-K541 WeakPolarHBondContact O-CB 3.22Å; C537-K541 PolarHBondContact O-N 3.39Å; E538-K541 PolarHBondContact O-N 3.17Å; K541-L543 VanDerWaalsContact C-N 3.33Å; K541-L543 PolarHBondContact O-N 2.97Å; K541-L544 WeakPolarHBondContact O-CB 3.44Å; K541-L544 PolarHBondContact O-N 3.23Å; K541-L544 VanDerWaalsContact O-N 3.13Å; K541-E545 PolarHBondContact O-N 3.11Å; K541-F556 HydrophobicContact CB-CE2 4.16Å
542	S	89.3	Confident	86.9	Confident	62 Å²	62	78.2 Å²	78.2	43%	0.434	41%	0.408	S	S	.	.	H	α-helix	trans	-68	-31.6	177.2	49.3	0	0	0	0	112.9	E538 K539 T546	E538-S542 PolarHBondContact O-N 3.16Å; E538-S542 PolarHBondContact O-OG 3.43Å; K539-S542 PolarHBondContact O-OG 2.85Å; K539-S542 VanDerWaalsContact O-OG 3.12Å; S542-T546 PolarHBondContact O-OG1 3.42Å
543	L	88.8	Confident	86.7	Confident	90 Å²	90	76.1 Å²	76.1	47%	0.471	40%	0.401	S	S	.	.	H	α-helix	trans	-65	-43.7	166.3	-74.7	170.3	0	0	0	111.8	K539 L540 K541 E545 T546 D547 V552	K539-L543 WeakPolarHBondContact O-CB 3.43Å; K539-L543 VanDerWaalsContact O-CG 3.24Å; K539-L543 WeakPolarHBondContact O-CG 3.26Å; K539-L543 PolarHBondContact O-N 2.77Å; L540-L543 PolarHBondContact O-N 3.19Å; K541-L543 VanDerWaalsContact C-N 3.33Å; K541-L543 PolarHBondContact O-N 2.97Å; L543-E545 PolarHBondContact O-N 3.46Å; L543-T546 CarbonylContact O-C 3.54Å; L543-T546 WeakPolarHBondContact O-CA 3.44Å; L543-T546 PolarHBondContact O-N 3.2Å; L543-D547 PolarHBondContact O-N 2.97Å; L543-V552 HydrophobicContact CB-CG1 4.2Å
544	L	84.8	Confident	86.6	Confident	48 Å²	48	80.7 Å²	80.7	25%	0.251	43%	0.426	S	S	.	.	H	α-helix	trans	-64.2	-25.7	179.6	-174.8	63.2	0	0	0	113.2	L540 K541 T546 H548 V552 V553	L540-L544 VanDerWaalsContact O-CB 3.26Å; L540-L544 WeakPolarHBondContact O-CB 3.33Å; L540-L544 PolarHBondContact O-N 2.86Å; K541-L544 WeakPolarHBondContact O-CB 3.44Å; K541-L544 PolarHBondContact O-N 3.23Å; K541-L544 VanDerWaalsContact O-N 3.13Å; L544-T546 PolarHBondContact O-N 3.28Å; L544-H548 PolarHBondContact O-CE1 2.76Å; L544-H548 PolarHBondContact O-ND1 3.27Å; L544-V552 HydrophobicContact CB-CG1 4.32Å; L544-V553 HydrophobicContact CD1-CG2 3.69Å
545	E	85.7	Confident	86.6	Confident	143 Å²	143	83.2 Å²	83.2	67%	0.668	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-15.1	170.4	-71.6	171.6	-163.6	0	0	113.2	K541 L543	K541-E545 PolarHBondContact O-N 3.11Å; L543-E545 PolarHBondContact O-N 3.46Å
546	T	83.7	Confident	86.5	Confident	124 Å²	124	80.4 Å²	80.4	76%	0.761	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114	-39.7	-175.7	-52	0	0	0	0	113.5	S542 L543 L544	S542-T546 PolarHBondContact O-OG1 3.42Å; L543-T546 CarbonylContact O-C 3.54Å; L543-T546 WeakPolarHBondContact O-CA 3.44Å; L543-T546 PolarHBondContact O-N 3.2Å; L544-T546 PolarHBondContact O-N 3.28Å
547	D	75.7	Confident	86.5	Confident	82 Å²	82	80.3 Å²	80.3	44%	0.439	42%	0.423	S	S	.	.			trans	-134.8	120	-179.5	175.8	31.8	0	0	0	110.4	L543 S549	L543-D547 PolarHBondContact O-N 2.97Å; D547-S549 VanDerWaalsContact C-N 3.27Å; D547-S549 PolarHBondContact O-N 2.78Å; D547-S549 PolarHBondContact OD1-N 3.36Å; D547-S549 WeakPolarHBondContact OD2-CB 3.38Å; D547-S549 PolarHBondContact OD2-OG 3.48Å
548	H	78.3	Confident	86.7	Confident	150 Å²	150	85.8 Å²	85.8	69%	0.694	45%	0.446	S	S	*	.			trans	-91.6	31.7	178.4	-59	-30.1	0	0	0	112.4	L544	L544-H548 PolarHBondContact O-CE1 2.76Å; L544-H548 PolarHBondContact O-ND1 3.27Å
549	S	81.5	Confident	86.7	Confident	28 Å²	28	79.7 Å²	79.7	20%	0.196	42%	0.418	C	S	.	.			trans	-65.4	137.1	177.9	61	0	0	0	0	111.2	D547 S551 V552 V553	D547-S549 VanDerWaalsContact C-N 3.27Å; D547-S549 PolarHBondContact O-N 2.78Å; D547-S549 PolarHBondContact OD1-N 3.36Å; D547-S549 WeakPolarHBondContact OD2-CB 3.38Å; D547-S549 PolarHBondContact OD2-OG 3.48Å; S549-S551 PolarHBondContact O-N 3.07Å; S549-S551 VanDerWaalsContact O-N 3.15Å; S549-V552 WeakPolarHBondContact O-CB 3.39Å; S549-V552 PolarHBondContact O-N 3.01Å; S549-V552 WeakPolarHBondContact OG-CG2 3.43Å; S549-V553 PolarHBondContact O-N 3.35Å
550	P	81.1	Confident	86.6	Confident	94 Å²	94	80.3 Å²	80.3	61%	0.61	42%	0.418	S	S	*	.	H	α-helix	trans	-61.2	-32.6	-170.3	22.2	-33.2	0	0	0	112.6	V552 V553 D554	P550-V552 PolarHBondContact O-N 2.95Å; P550-V553 WeakPolarHBondContact O-CB 3.06Å; P550-V553 PolarHBondContact O-N 3.03Å; P550-V553 VanDerWaalsContact O-N 3.12Å; P550-D554 VanDerWaalsContact O-CG 3.29Å; P550-D554 PolarHBondContact O-N 3.18Å
551	S	84.9	Confident	86.7	Confident	70 Å²	70	86.5 Å²	86.5	49%	0.49	45%	0.447	S	S	.	.	H	α-helix	trans	-64.1	-21	174.9	45.7	0	0	0	0	115.2	S549 K555	S549-S551 PolarHBondContact O-N 3.07Å; S549-S551 VanDerWaalsContact O-N 3.15Å; S551-K555 WeakPolarHBondContact O-CG 3.41Å
552	V	85.8	Confident	86.8	Confident	19 Å²	19	84.3 Å²	84.3	12%	0.115	44%	0.438	C	S	.	.	H	α-helix	trans	-82	-40.3	171.9	174.6	0	0	0	0	109.8	L540 L543 L544 S549 P550 F556	L540-V552 HydrophobicContact CD2-CG1 4.26Å; L543-V552 HydrophobicContact CB-CG1 4.2Å; L544-V552 HydrophobicContact CB-CG1 4.32Å; S549-V552 WeakPolarHBondContact O-CB 3.39Å; S549-V552 PolarHBondContact O-N 3.01Å; S549-V552 WeakPolarHBondContact OG-CG2 3.43Å; P550-V552 PolarHBondContact O-N 2.95Å; V552-F556 VanDerWaalsContact O-CB 3.28Å; V552-F556 WeakPolarHBondContact O-CB 3.45Å; V552-F556 PolarHBondContact O-N 3.26Å
553	V	87.4	Confident	86.8	Confident	51 Å²	51	81.9 Å²	81.9	31%	0.309	42%	0.421	S	S	.	.	H	α-helix	trans	-62.3	-47.9	175.5	-179.9	0	0	0	0	111.4	L544 S549 P550 K555 F556 N557	L544-V553 HydrophobicContact CD1-CG2 3.69Å; S549-V553 PolarHBondContact O-N 3.35Å; P550-V553 WeakPolarHBondContact O-CB 3.06Å; P550-V553 PolarHBondContact O-N 3.03Å; P550-V553 VanDerWaalsContact O-N 3.12Å; V553-K555 PolarHBondContact O-N 2.84Å; V553-F556 PolarHBondContact O-N 3.33Å; V553-N557 VanDerWaalsContact O-CG 3.26Å; V553-N557 PolarHBondContact O-N 3.1Å; V553-N557 PolarHBondContact O-ND2 3.21Å; V553-N557 VanDerWaalsContact O-ND2 3.13Å
554	D	89.9	Confident	86.8	Confident	95 Å²	95	81.1 Å²	81.1	51%	0.508	42%	0.419	S	S	.	.	H	α-helix	trans	-59.5	-48.9	-180	-67.5	-28.3	0	0	0	110.9	P550 F556 N557 E558	P550-D554 VanDerWaalsContact O-CG 3.29Å; P550-D554 PolarHBondContact O-N 3.18Å; D554-F556 PolarHBondContact O-N 3.12Å; D554-N557 WeakPolarHBondContact O-CB 3.15Å; D554-N557 PolarHBondContact O-N 3.39Å; D554-E558 WeakPolarHBondContact O-CG 3.16Å; D554-E558 PolarHBondContact O-N 3.49Å
555	K	89.5	Confident	87	Confident	112 Å²	112	82.5 Å²	82.5	49%	0.487	44%	0.438	S	S	.	.	H	α-helix	trans	-62.6	-39.8	175.5	-76	-176.6	172.8	-163.9	0	113.6	L540 S551 V553 N557 E558 V559	L540-K555 HydrophobicContact CD1-CB 4.04Å; L540-K555 HydrophobicContact CD2-CB 4.23Å; S551-K555 WeakPolarHBondContact O-CG 3.41Å; V553-K555 PolarHBondContact O-N 2.84Å; K555-N557 VanDerWaalsContact C-N 3.28Å; K555-N557 PolarHBondContact O-N 2.89Å; K555-E558 PolarHBondContact O-N 3.49Å; K555-V559 WeakPolarHBondContact O-CB 3.45Å; K555-V559 WeakPolarHBondContact O-CG2 3.28Å; K555-V559 PolarHBondContact O-N 2.92Å
556	F	89.8	Confident	86.9	Confident	43 Å²	43	78.9 Å²	78.9	19%	0.189	42%	0.422	C	S	.	.	H	α-helix	trans	-61.1	-41.5	176.7	177.1	-93.1	0	0	0	110.6	L540 K541 V552 V553 D554 Y560	L540-F556 HydrophobicContact CB-CB 4.32Å; L540-F556 HydrophobicContact CB-CD2 4.01Å; K541-F556 HydrophobicContact CB-CE2 4.16Å; V552-F556 VanDerWaalsContact O-CB 3.28Å; V552-F556 WeakPolarHBondContact O-CB 3.45Å; V552-F556 PolarHBondContact O-N 3.26Å; V553-F556 PolarHBondContact O-N 3.33Å; D554-F556 PolarHBondContact O-N 3.12Å; F556-Y560 WeakPolarHBondContact O-CB 3.39Å; F556-Y560 PolarHBondContact O-N 2.69Å
557	N	90.8	Very high	87	Confident	75 Å²	75	79.6 Å²	79.6	40%	0.401	42%	0.415	S	S	.	.	H	α-helix	trans	-65.5	-45	174.6	-64.2	-34	0	0	0	111.9	V553 D554 K555 V559 Y560 E561	V553-N557 VanDerWaalsContact O-CG 3.26Å; V553-N557 PolarHBondContact O-N 3.1Å; V553-N557 PolarHBondContact O-ND2 3.21Å; V553-N557 VanDerWaalsContact O-ND2 3.13Å; D554-N557 WeakPolarHBondContact O-CB 3.15Å; D554-N557 PolarHBondContact O-N 3.39Å; K555-N557 VanDerWaalsContact C-N 3.28Å; K555-N557 PolarHBondContact O-N 2.89Å; N557-V559 PolarHBondContact O-N 2.92Å; N557-Y560 PolarHBondContact O-N 3.34Å; N557-E561 WeakPolarHBondContact O-CB 3.49Å; N557-E561 WeakPolarHBondContact O-CG 3.28Å; N557-E561 PolarHBondContact O-N 3.45Å
558	E	92	Very high	87.2	Confident	136 Å²	136	76.3 Å²	76.3	64%	0.636	40%	0.399	S	S	*	.	H	α-helix	trans	-57.4	-48.6	176.2	-71.8	176.7	160	0	0	112.2	D554 K555 E561 E562	D554-E558 WeakPolarHBondContact O-CG 3.16Å; D554-E558 PolarHBondContact O-N 3.49Å; K555-E558 PolarHBondContact O-N 3.49Å; E558-E561 PolarHBondContact O-N 2.8Å; E558-E562 PolarHBondContact O-N 2.8Å
559	V	91	Very high	87.4	Confident	11 Å²	11	76.2 Å²	76.2	7%	0.067	40%	0.404	C	S	.	.	H	α-helix	trans	-66.1	-39.6	178.7	169.4	0	0	0	0	111.5	L533 E536 C537 L540 K555 N557 E562 L563	L533-V559 HydrophobicContact CD2-CG1 3.97Å; L533-V559 HydrophobicContact CD2-CG2 4.44Å; L533-V559 WeakPolarHBondContact O-CG1 3.42Å; E536-V559 HydrophobicContact CB-CG1 4.45Å; E536-V559 HydrophobicContact CG-CG2 4.03Å; C537-V559 HydrophobicContact CB-CG1 3.97Å; L540-V559 HydrophobicContact CD1-CB 4.33Å; L540-V559 HydrophobicContact CD1-CG2 3.95Å; K555-V559 WeakPolarHBondContact O-CB 3.45Å; K555-V559 WeakPolarHBondContact O-CG2 3.28Å; K555-V559 PolarHBondContact O-N 2.92Å; N557-V559 PolarHBondContact O-N 2.92Å; V559-E562 PolarHBondContact O-N 2.94Å; V559-L563 HydrophobicContact CG1-CD1 4.28Å; V559-L563 WeakPolarHBondContact O-CG 3.41Å; V559-L563 PolarHBondContact O-N 2.75Å
560	Y	90.2	Very high	87.8	Confident	123 Å²	123	77.7 Å²	77.7	48%	0.482	42%	0.418	S	S	.	.	H	α-helix	trans	-68.1	-39.5	176.9	-172	-103	0	0	0	112.2	F556 N557 E562 L563 V564	F556-Y560 WeakPolarHBondContact O-CB 3.39Å; F556-Y560 PolarHBondContact O-N 2.69Å; N557-Y560 PolarHBondContact O-N 3.34Å; Y560-E562 PolarHBondContact O-N 3.28Å; Y560-L563 PolarHBondContact O-N 3.06Å; Y560-V564 HydrophobicContact CD1-CG2 4.2Å; Y560-V564 HydrophobicContact CE1-CG2 3.83Å; Y560-V564 HydrophobicContact CE2-CG2 4.49Å; Y560-V564 WeakPolarHBondContact O-CB 3.41Å; Y560-V564 WeakPolarHBondContact O-CG2 3.14Å; Y560-V564 PolarHBondContact O-N 2.66Å
561	E	91.9	Very high	88.2	Confident	143 Å²	143	73.6 Å²	73.6	67%	0.668	39%	0.392	S	S	*	.	H	α-helix	trans	-62.3	-39.3	172.2	-76.8	-170.3	-171.5	0	0	111.9	N557 E558 V564 A565	N557-E561 WeakPolarHBondContact O-CB 3.49Å; N557-E561 WeakPolarHBondContact O-CG 3.28Å; N557-E561 PolarHBondContact O-N 3.45Å; E558-E561 PolarHBondContact O-N 2.8Å; E561-V564 PolarHBondContact O-N 2.79Å; E561-A565 VanDerWaalsContact O-CB 3.29Å; E561-A565 WeakPolarHBondContact O-CB 3.5Å; E561-A565 PolarHBondContact O-N 3.05Å
562	E	90	Very high	88.4	Confident	71 Å²	71	74.5 Å²	74.5	33%	0.332	39%	0.388	S	S	.	.	H	α-helix	trans	-66.5	-42.1	174.7	-162.4	179.1	155.2	0	0	112	R529 L533 E558 V559 Y560 V564 A565 I566	R529-E562 IonicContact CZ-OE1 3.24Å; R529-E562 IonicContact CZ-OE2 3.1Å; R529-E562 IonicContact NE-OE1 2.79Å; R529-E562 PolarHBondContact NE-OE1 3.49Å; R529-E562 IonicContact NE-OE2 2.71Å; R529-E562 VanDerWaalsContact NH2-CD 3.3Å; R529-E562 IonicContact NH2-OE1 2.77Å; R529-E562 PolarHBondContact NH2-OE1 3.12Å; R529-E562 VanDerWaalsContact NH2-OE1 3.15Å; R529-E562 IonicContact NH2-OE2 2.68Å; R529-E562 PolarHBondContact NH2-OE2 2.76Å; L533-E562 HydrophobicContact CD1-CB 4.21Å; L533-E562 HydrophobicContact CD1-CG 3.8Å; L533-E562 HydrophobicContact CD2-CB 4.18Å; L533-E562 HydrophobicContact CD2-CG 4.35Å; E558-E562 PolarHBondContact O-N 2.8Å; V559-E562 PolarHBondContact O-N 2.94Å; Y560-E562 PolarHBondContact O-N 3.28Å; E562-V564 PolarHBondContact O-N 2.86Å; E562-A565 PolarHBondContact O-N 3.08Å; E562-I566 HydrophobicContact CG-CD1 3.98Å; E562-I566 WeakPolarHBondContact O-CB 3.23Å; E562-I566 WeakPolarHBondContact O-CG1 3.32Å; E562-I566 PolarHBondContact O-N 3.03Å
563	L	89	Confident	88.7	Confident	11 Å²	11	75.8 Å²	75.8	6%	0.058	41%	0.405	C	S	.	.	H	α-helix	trans	-60.6	-41.2	174.4	-76.5	169.9	0	0	0	112.7	L533 L534 C537 V559 Y560 K567 A568	L533-L563 HydrophobicContact CB-CD1 4.5Å; L533-L563 HydrophobicContact CB-CD2 3.56Å; L533-L563 HydrophobicContact CB-CG 3.9Å; L533-L563 HydrophobicContact CD1-CD2 4.34Å; L534-L563 HydrophobicContact CD2-CD1 4.11Å; L534-L563 HydrophobicContact CD2-CD2 3.91Å; L534-L563 HydrophobicContact CG-CD2 3.9Å; C537-L563 HydrophobicContact CB-CD1 3.8Å; V559-L563 HydrophobicContact CG1-CD1 4.28Å; V559-L563 WeakPolarHBondContact O-CG 3.41Å; V559-L563 PolarHBondContact O-N 2.75Å; Y560-L563 PolarHBondContact O-N 3.06Å; L563-K567 WeakPolarHBondContact O-CA 3.43Å; L563-K567 PolarHBondContact O-N 2.74Å; L563-A568 HydrophobicContact CB-CB 4.45Å; L563-A568 HydrophobicContact CD2-CB 3.89Å; L563-A568 PolarHBondContact O-N 3.47Å
564	V	90.6	Very high	88.8	Confident	74 Å²	74	76.2 Å²	76.2	45%	0.448	40%	0.403	S	S	.	.	H	α-helix	trans	-69.2	-37.7	175.5	170.5	0	0	0	0	111.3	Y560 E561 E562 K567	Y560-V564 HydrophobicContact CD1-CG2 4.2Å; Y560-V564 HydrophobicContact CE1-CG2 3.83Å; Y560-V564 HydrophobicContact CE2-CG2 4.49Å; Y560-V564 WeakPolarHBondContact O-CB 3.41Å; Y560-V564 WeakPolarHBondContact O-CG2 3.14Å; Y560-V564 PolarHBondContact O-N 2.66Å; E561-V564 PolarHBondContact O-N 2.79Å; E562-V564 PolarHBondContact O-N 2.86Å; V564-K567 WeakPolarHBondContact O-CG 3.37Å; V564-K567 PolarHBondContact O-N 2.97Å
565	A	88.3	Confident	89	Confident	77 Å²	77	71.7 Å²	71.7	64%	0.636	38%	0.379	S	S	*	.	H	α-helix	trans	-66.3	-41	176.1	0	0	0	0	0	112.6	E561 E562 K567	E561-A565 VanDerWaalsContact O-CB 3.29Å; E561-A565 WeakPolarHBondContact O-CB 3.5Å; E561-A565 PolarHBondContact O-N 3.05Å; E562-A565 PolarHBondContact O-N 3.08Å; A565-K567 VanDerWaalsContact C-N 3.26Å
566	I	83.7	Confident	89.1	Confident	67 Å²	67	71.6 Å²	71.6	34%	0.344	38%	0.376	S	S	.	.	H	α-helix	trans	-70.9	-23.6	172.8	-68.2	169.7	0	0	0	111.5	R529 L533 E562	R529-I566 HydrophobicContact CG-CD1 4.33Å; L533-I566 HydrophobicContact CD1-CD1 3.5Å; L533-I566 VanDerWaalsContact CD1-CD1 3.5Å; E562-I566 HydrophobicContact CG-CD1 3.98Å; E562-I566 WeakPolarHBondContact O-CB 3.23Å; E562-I566 WeakPolarHBondContact O-CG1 3.32Å; E562-I566 PolarHBondContact O-N 3.03Å
567	K	85.3	Confident	89.2	Confident	140 Å²	140	75.4 Å²	75.4	61%	0.609	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.8	53.3	-175.6	-53.9	174.7	-177.8	178.3	0	112.5	L563 V564 A565 D569 A570	L563-K567 WeakPolarHBondContact O-CA 3.43Å; L563-K567 PolarHBondContact O-N 2.74Å; V564-K567 WeakPolarHBondContact O-CG 3.37Å; V564-K567 PolarHBondContact O-N 2.97Å; A565-K567 VanDerWaalsContact C-N 3.26Å; K567-D569 PolarHBondContact O-N 3.15Å; K567-D569 VanDerWaalsContact O-N 3.17Å; K567-A570 HydrophobicContact CB-CB 4.22Å; K567-A570 PolarHBondContact O-N 2.81Å
568	A	80.5	Confident	89.3	Confident	13 Å²	13	71.9 Å²	71.9	11%	0.107	37%	0.37	C	S	.	.	H	α-helix	trans	-49.2	-41.8	-179.1	0	0	0	0	0	113.2	R530 L563 A570 A571	R530-A568 HydrophobicContact CG-CB 4.25Å; L563-A568 HydrophobicContact CB-CB 4.45Å; L563-A568 HydrophobicContact CD2-CB 3.89Å; L563-A568 PolarHBondContact O-N 3.47Å; A568-A570 VanDerWaalsContact C-N 3.27Å; A568-A570 PolarHBondContact O-N 3.15Å; A568-A571 WeakPolarHBondContact O-CB 3.44Å; A568-A571 PolarHBondContact O-N 3.31Å
569	D	83	Confident	89.3	Confident	147 Å²	147	65.4 Å²	65.4	79%	0.786	34%	0.34	S	S	*	.	H	α-helix	trans	-60.3	-33.7	179.3	-47.9	-36.2	0	0	0	113.4	K567 A571	K567-D569 PolarHBondContact O-N 3.15Å; K567-D569 VanDerWaalsContact O-N 3.17Å; D569-A571 VanDerWaalsContact C-N 3.28Å; D569-A571 PolarHBondContact O-N 3.4Å
570	A	89.1	Confident	89.3	Confident	59 Å²	59	67.5 Å²	67.5	49%	0.488	36%	0.355	S	S	.	.	H	α-helix	trans	-79.9	-10.8	179.6	0	0	0	0	0	113	K567 A568 E572 G573 K574	K567-A570 HydrophobicContact CB-CB 4.22Å; K567-A570 PolarHBondContact O-N 2.81Å; A568-A570 VanDerWaalsContact C-N 3.27Å; A568-A570 PolarHBondContact O-N 3.15Å; A570-E572 PolarHBondContact O-N 2.9Å; A570-G573 PolarHBondContact O-N 2.85Å; A570-K574 WeakPolarHBondContact O-CB 3.37Å; A570-K574 PolarHBondContact O-N 3.48Å
571	A	88.8	Confident	89.3	Confident	9 Å²	9	61.9 Å²	61.9	7%	0.074	33%	0.334	C	S	.	.	H	α-helix	trans	-62.3	-42.4	-175.6	0	0	0	0	0	112.3	L524 A568 D569 K574 A575 F611	L524-A571 HydrophobicContact CD2-CB 4.05Å; A568-A571 WeakPolarHBondContact O-CB 3.44Å; A568-A571 PolarHBondContact O-N 3.31Å; D569-A571 VanDerWaalsContact C-N 3.28Å; D569-A571 PolarHBondContact O-N 3.4Å; A571-K574 PolarHBondContact O-N 2.75Å; A571-A575 WeakPolarHBondContact O-CB 3.21Å; A571-A575 PolarHBondContact O-N 2.74Å; A571-F611 HydrophobicContact CB-CE2 4.2Å; A571-F611 HydrophobicContact CB-CZ 4.04Å
572	E	90.4	Very high	89.2	Confident	88 Å²	88	55 Å²	55	41%	0.411	30%	0.302	S	S	.	.	H	α-helix	trans	-62.5	-47	178.2	-63	-148.1	154.4	0	0	112.2	F520 L524 A570 K574 A575 R576	F520-E572 HydrophobicContact CE2-CB 4.44Å; F520-E572 HydrophobicContact CZ-CB 4.13Å; F520-E572 HydrophobicContact CZ-CG 4.13Å; L524-E572 HydrophobicContact CD1-CG 4.12Å; A570-E572 PolarHBondContact O-N 2.9Å; E572-K574 VanDerWaalsContact C-N 3.3Å; E572-K574 PolarHBondContact O-N 3.1Å; E572-A575 PolarHBondContact O-N 2.79Å; E572-R576 WeakPolarHBondContact O-CG 3.41Å; E572-R576 PolarHBondContact O-N 3.04Å; E572-R576 IonicContact OE1-NH2 3.66Å; E572-R576 IonicContact OE2-CZ 3.35Å; E572-R576 IonicContact OE2-NH1 3.69Å; E572-R576 PolarHBondContact OE2-NH1 3.29Å; E572-R576 IonicContact OE2-NH2 2.64Å; E572-R576 PolarHBondContact OE2-NH2 3.11Å
573	G	91.3	Very high	89.2	Confident	46 Å²	46	53 Å²	53	47%	0.474	30%	0.3	S	S	.	.	H	α-helix	trans	-61.5	-40.3	178.3	0	0	0	0	0	111.8	A570 R577	A570-G573 PolarHBondContact O-N 2.85Å; G573-R577 VanDerWaalsContact O-CB 3.25Å; G573-R577 WeakPolarHBondContact O-CB 3.17Å; G573-R577 PolarHBondContact O-N 3.26Å
574	K	90.7	Very high	89.2	Confident	61 Å²	61	52.7 Å²	52.7	27%	0.265	30%	0.298	S	S	.	.	H	α-helix	trans	-61.8	-49.2	173.3	-172.2	-171.7	-176	-174	0	111.6	A570 A571 E572 R577 I578 F611 E613	A570-K574 WeakPolarHBondContact O-CB 3.37Å; A570-K574 PolarHBondContact O-N 3.48Å; A571-K574 PolarHBondContact O-N 2.75Å; E572-K574 VanDerWaalsContact C-N 3.3Å; E572-K574 PolarHBondContact O-N 3.1Å; K574-R577 PolarHBondContact O-N 2.83Å; K574-I578 HydrophobicContact CG-CD1 3.96Å; K574-I578 VanDerWaalsContact O-CG1 3.32Å; K574-I578 WeakPolarHBondContact O-CG1 3.39Å; K574-I578 PolarHBondContact O-N 2.89Å; K574-F611 HydrophobicContact CB-CE2 4.42Å; K574-F611 HydrophobicContact CD-CD2 3.87Å; K574-F611 HydrophobicContact CD-CE2 4.08Å; K574-F611 HydrophobicContact CG-CD2 4.17Å; K574-F611 HydrophobicContact CG-CE2 4.48Å; K574-F611 PolarHBondContact NZ-O 3.46Å; K574-E613 WeakPolarHBondContact CE-OE1 3.45Å; K574-E613 IonicContact NZ-OE1 3.16Å; K574-E613 PolarHBondContact NZ-OE1 3Å
575	A	92.5	Very high	89	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-64.4	-46.3	-178.7	0	0	0	0	0	112.3	F520 V523 L524 A571 E572 R577 I578 L579 F611	F520-A575 HydrophobicContact CD2-CB 4.14Å; F520-A575 HydrophobicContact CE2-CB 3.98Å; V523-A575 HydrophobicContact CG1-CB 3.95Å; L524-A575 HydrophobicContact CD2-CB 3.89Å; L524-A575 HydrophobicContact CG-CB 4.19Å; A571-A575 WeakPolarHBondContact O-CB 3.21Å; A571-A575 PolarHBondContact O-N 2.74Å; E572-A575 PolarHBondContact O-N 2.79Å; A575-R577 VanDerWaalsContact C-N 3.34Å; A575-R577 PolarHBondContact O-N 3.46Å; A575-I578 PolarHBondContact O-N 2.77Å; A575-L579 WeakPolarHBondContact O-CG 3.47Å; A575-L579 PolarHBondContact O-N 3.38Å; A575-F611 HydrophobicContact CB-CD2 4.12Å; A575-F611 HydrophobicContact CB-CE2 4.09Å
576	R	92.2	Very high	89	Confident	109 Å²	109	57.1 Å²	57.1	41%	0.411	30%	0.304	S	S	.	.	H	α-helix	trans	-61.5	-40	175.4	-67.5	-174	-174.5	108.9	7.9	111.8	F520 E572 S580 M589	F520-R576 HydrophobicContact CD2-CG 3.77Å; F520-R576 HydrophobicContact CE2-CG 3.49Å; F520-R576 VanDerWaalsContact CE2-CG 3.49Å; F520-R576 HydrophobicContact CZ-CG 4.22Å; F520-R576 VanDerWaalsContact CZ-CZ 3.49Å; E572-R576 WeakPolarHBondContact O-CG 3.41Å; E572-R576 PolarHBondContact O-N 3.04Å; E572-R576 IonicContact OE1-NH2 3.66Å; E572-R576 IonicContact OE2-CZ 3.35Å; E572-R576 IonicContact OE2-NH1 3.69Å; E572-R576 PolarHBondContact OE2-NH1 3.29Å; E572-R576 IonicContact OE2-NH2 2.64Å; E572-R576 PolarHBondContact OE2-NH2 3.11Å; R576-S580 VanDerWaalsContact O-CB 3.29Å; R576-S580 WeakPolarHBondContact O-CB 3Å; R576-S580 PolarHBondContact O-N 2.6Å; R576-M589 HydrophobicContact CB-SD 4.29Å; R576-M589 HydrophobicContact CG-SD 4.23Å; R576-M589 WeakPolarHBondContact O-CE 3.38Å
577	R	91.8	Very high	89.2	Confident	124 Å²	124	59.6 Å²	59.6	47%	0.468	32%	0.318	S	S	.	.	H	α-helix	trans	-62.8	-46.9	175.7	180	178.1	177.8	168	2.3	112.5	G573 K574 A575 S580 G581 E982	G573-R577 VanDerWaalsContact O-CB 3.25Å; G573-R577 WeakPolarHBondContact O-CB 3.17Å; G573-R577 PolarHBondContact O-N 3.26Å; K574-R577 PolarHBondContact O-N 2.83Å; A575-R577 VanDerWaalsContact C-N 3.34Å; A575-R577 PolarHBondContact O-N 3.46Å; R577-S580 PolarHBondContact O-N 2.81Å; R577-G581 PolarHBondContact O-N 2.99Å; R577-E982 IonicContact CZ-OE1 3.82Å; R577-E982 IonicContact CZ-OE2 3.76Å; R577-E982 IonicContact NE-OE1 2.77Å; R577-E982 PolarHBondContact NE-OE1 2.97Å; R577-E982 IonicContact NH2-OE1 3.72Å; R577-E982 PolarHBondContact NH2-OE1 3.03Å; R577-E982 IonicContact NH2-OE2 2.65Å; R577-E982 PolarHBondContact NH2-OE2 3.34Å
578	I	93	Very high	89.3	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-62.5	-45.6	178.6	-68.4	167.9	0	0	0	110.7	K574 A575 G581 L582 A607 L610 F611 W633 Y637	K574-I578 HydrophobicContact CG-CD1 3.96Å; K574-I578 VanDerWaalsContact O-CG1 3.32Å; K574-I578 WeakPolarHBondContact O-CG1 3.39Å; K574-I578 PolarHBondContact O-N 2.89Å; A575-I578 PolarHBondContact O-N 2.77Å; I578-G581 PolarHBondContact O-N 3.07Å; I578-L582 HydrophobicContact CG2-CD1 4.14Å; I578-L582 WeakPolarHBondContact O-CG 3.33Å; I578-L582 PolarHBondContact O-N 2.84Å; I578-L582 VanDerWaalsContact O-N 3.1Å; I578-A607 HydrophobicContact CG2-CB 3.81Å; I578-L610 HydrophobicContact CD1-CB 4.34Å; I578-L610 HydrophobicContact CG2-CB 4.27Å; I578-L610 HydrophobicContact CG2-CD1 4.31Å; I578-F611 HydrophobicContact CD1-CB 4.07Å; I578-W633 HydrophobicContact CB-CH2 4.19Å; I578-W633 HydrophobicContact CG1-CH2 4.14Å; I578-W633 HydrophobicContact CG1-CZ2 4.48Å; I578-W633 HydrophobicContact CG2-CH2 4.06Å; I578-Y637 HydrophobicContact CG1-CE2 4.33Å
579	L	92.5	Very high	89.7	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-65.2	-42.1	177.6	-72.8	167.2	0	0	0	111.9	F520 V523 A575 G581 L582 G583 F584 M589 A607	F520-L579 HydrophobicContact CB-CD1 4.03Å; F520-L579 HydrophobicContact CD2-CD1 4.41Å; V523-L579 HydrophobicContact CG2-CD1 4.18Å; V523-L579 HydrophobicContact CG2-CD2 4.21Å; V523-L579 HydrophobicContact CG2-CG 4.39Å; A575-L579 WeakPolarHBondContact O-CG 3.47Å; A575-L579 PolarHBondContact O-N 3.38Å; L579-G581 VanDerWaalsContact C-N 3.33Å; L579-G581 PolarHBondContact O-N 2.83Å; L579-L582 CarbonylContact O-C 3.5Å; L579-L582 PolarHBondContact O-N 2.95Å; L579-G583 PolarHBondContact O-N 3.2Å; L579-F584 HydrophobicContact CB-CB 4.1Å; L579-F584 HydrophobicContact CB-CD2 4.18Å; L579-F584 HydrophobicContact CB-CG 4.26Å; L579-F584 HydrophobicContact CD2-CD1 4.43Å; L579-F584 HydrophobicContact CD2-CD2 3.67Å; L579-F584 HydrophobicContact CD2-CE1 4.45Å; L579-F584 HydrophobicContact CD2-CE2 3.67Å; L579-F584 HydrophobicContact CD2-CG 4.07Å; L579-F584 HydrophobicContact CD2-CZ 4.08Å; L579-F584 WeakPolarHBondContact O-CB 3.4Å; L579-F584 WeakPolarHBondContact O-CD2 3.48Å; L579-F584 PolarHBondContact O-N 3.4Å; L579-M589 HydrophobicContact CB-CE 3.95Å; L579-M589 HydrophobicContact CB-CG 4.24Å; L579-M589 HydrophobicContact CB-SD 4.22Å; L579-M589 HydrophobicContact CD1-CG 4.38Å; L579-A607 HydrophobicContact CD2-CB 3.65Å; L579-A607 HydrophobicContact CG-CB 4.24Å
580	S	91.4	Very high	90.1	Very high	55 Å²	55	52.3 Å²	52.3	39%	0.385	28%	0.283	S	S	.	.	H	α-helix	trans	-61.3	-41.1	176.4	-165.6	0	0	0	0	112.1	R576 R577 L582 G583	R576-S580 VanDerWaalsContact O-CB 3.29Å; R576-S580 WeakPolarHBondContact O-CB 3Å; R576-S580 PolarHBondContact O-N 2.6Å; R577-S580 PolarHBondContact O-N 2.81Å; S580-L582 VanDerWaalsContact C-N 3.32Å; S580-L582 PolarHBondContact O-N 2.81Å; S580-G583 PolarHBondContact O-N 2.88Å; S580-G583 VanDerWaalsContact O-N 3.09Å
581	G	89.4	Confident	90.1	Very high	4 Å²	4	55.6 Å²	55.6	4%	0.041	28%	0.283	C	S	.	.	H	α-helix	trans	-67.7	-28	176.8	0	0	0	0	0	114.2	R577 I578 L579 G583 W633	R577-G581 PolarHBondContact O-N 2.99Å; I578-G581 PolarHBondContact O-N 3.07Å; L579-G581 VanDerWaalsContact C-N 3.33Å; L579-G581 PolarHBondContact O-N 2.83Å; G581-G583 PolarHBondContact O-N 3.39Å; G581-W633 VanDerWaalsContact CA-CD2 3.49Å; G581-W633 WeakPolarHBondContact O-CB 3.49Å
582	L	90.8	Very high	90.2	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	10.6	170.9	-65.5	171.2	0	0	0	113.4	I578 L579 S580 F584 R603 L606 A607 A630 W633	I578-L582 HydrophobicContact CG2-CD1 4.14Å; I578-L582 WeakPolarHBondContact O-CG 3.33Å; I578-L582 PolarHBondContact O-N 2.84Å; I578-L582 VanDerWaalsContact O-N 3.1Å; L579-L582 CarbonylContact O-C 3.5Å; L579-L582 PolarHBondContact O-N 2.95Å; S580-L582 VanDerWaalsContact C-N 3.32Å; S580-L582 PolarHBondContact O-N 2.81Å; L582-F584 HydrophobicContact CB-CD2 4.32Å; L582-F584 HydrophobicContact CB-CE2 4.43Å; L582-R603 WeakPolarHBondContact O-CD 3.45Å; L582-R603 PolarHBondContact O-NH1 3.49Å; L582-L606 HydrophobicContact CD1-CD2 4.48Å; L582-L606 HydrophobicContact CD1-CG 4.42Å; L582-L606 HydrophobicContact CD2-CD2 3.94Å; L582-A607 HydrophobicContact CD1-CB 3.82Å; L582-A630 HydrophobicContact CD2-CB 4.48Å; L582-W633 HydrophobicContact CD2-CE3 4.09Å; L582-W633 HydrophobicContact CD2-CZ3 4.03Å; L582-W633 HydrophobicContact CG-CE3 4.2Å; L582-W633 HydrophobicContact CG-CZ3 3.91Å
583	G	88.1	Confident	90.1	Very high	29 Å²	29	52.6 Å²	52.6	30%	0.299	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.3	8.8	172.7	0	0	0	0	0	115.9	L579 S580 G581 T585 W600	L579-G583 PolarHBondContact O-N 3.2Å; S580-G583 PolarHBondContact O-N 2.88Å; S580-G583 VanDerWaalsContact O-N 3.09Å; G581-G583 PolarHBondContact O-N 3.39Å; G583-T585 PolarHBondContact O-N 3.14Å; G583-W600 WeakPolarHBondContact O-CH2 3.39Å
584	F	89.8	Confident	90	Very high	3 Å²	3	55.2 Å²	55.2	1%	0.013	27%	0.268	C	S	.	.			trans	-73.3	119.8	174.8	-70.9	-103.2	0	0	0	110.7	A519 L579 L582 M588 M589 L596 W600 R603 V604	A519-F584 HydrophobicContact CB-CE1 4.11Å; L579-F584 HydrophobicContact CB-CB 4.1Å; L579-F584 HydrophobicContact CB-CD2 4.18Å; L579-F584 HydrophobicContact CB-CG 4.26Å; L579-F584 HydrophobicContact CD2-CD1 4.43Å; L579-F584 HydrophobicContact CD2-CD2 3.67Å; L579-F584 HydrophobicContact CD2-CE1 4.45Å; L579-F584 HydrophobicContact CD2-CE2 3.67Å; L579-F584 HydrophobicContact CD2-CG 4.07Å; L579-F584 HydrophobicContact CD2-CZ 4.08Å; L579-F584 WeakPolarHBondContact O-CB 3.4Å; L579-F584 WeakPolarHBondContact O-CD2 3.48Å; L579-F584 PolarHBondContact O-N 3.4Å; L582-F584 HydrophobicContact CB-CD2 4.32Å; L582-F584 HydrophobicContact CB-CE2 4.43Å; F584-M588 HydrophobicContact CD1-CB 4.15Å; F584-M589 HydrophobicContact CB-CE 4.24Å; F584-M589 HydrophobicContact CB-CG 3.94Å; F584-M589 VanDerWaalsContact O-CE 3.24Å; F584-M589 WeakPolarHBondContact O-CE 3.34Å; F584-L596 HydrophobicContact CE1-CD1 3.95Å; F584-W600 HydrophobicContact CD1-CE3 4.18Å; F584-W600 HydrophobicContact CD1-CZ3 4.31Å; F584-W600 HydrophobicContact CD2-CE3 4.19Å; F584-W600 AromaticContact CD2-CZ3 3.94Å; F584-W600 HydrophobicContact CD2-CZ3 3.94Å; F584-W600 AromaticContact CE1-CE3 3.84Å; F584-W600 HydrophobicContact CE1-CE3 3.84Å; F584-W600 HydrophobicContact CE1-CZ3 4.39Å; F584-W600 AromaticContact CE2-CE3 3.87Å; F584-W600 HydrophobicContact CE2-CE3 3.87Å; F584-W600 HydrophobicContact CE2-CZ3 4.05Å; F584-W600 HydrophobicContact CG-CE3 4.35Å; F584-W600 HydrophobicContact CG-CZ3 4.08Å; F584-W600 AromaticContact CZ-CE3 3.67Å; F584-W600 HydrophobicContact CZ-CE3 3.67Å; F584-W600 HydrophobicContact CZ-CZ3 4.26Å; F584-R603 HydrophobicContact CE2-CB 3.68Å; F584-R603 HydrophobicContact CZ-CB 4.05Å; F584-V604 HydrophobicContact CE1-CG2 3.94Å; F584-V604 HydrophobicContact CZ-CG2 3.53Å
585	T	87.4	Confident	89.8	Confident	79 Å²	79	56.8 Å²	56.8	49%	0.485	28%	0.28	S	S	.	.			trans	-69.5	159.3	164.1	65.9	0	0	0	0	110.5	G583 N587 M588 M589	G583-T585 PolarHBondContact O-N 3.14Å; T585-N587 VanDerWaalsContact C-N 3.3Å; T585-N587 PolarHBondContact O-N 3.11Å; T585-M588 HydrophobicContact CG2-SD 4.5Å; T585-M588 WeakPolarHBondContact O-CA 3.4Å; T585-M588 WeakPolarHBondContact O-CB 3.22Å; T585-M588 PolarHBondContact O-N 2.66Å; T585-M588 WeakPolarHBondContact OG1-CG 3.41Å; T585-M588 PolarHBondContact OG1-SD 3.44Å; T585-M589 PolarHBondContact O-N 2.66Å
586	K	88.2	Confident	89.4	Confident	165 Å²	165	57.2 Å²	57.2	72%	0.717	28%	0.282	S	S	*	.	H	α-helix	trans	-49.7	-51.9	176.3	-63	-176.9	-179.6	-178	0	111.4	M588 M589 D590	K586-M588 PolarHBondContact O-N 3.03Å; K586-M589 WeakPolarHBondContact O-CB 3.4Å; K586-M589 PolarHBondContact O-N 3.27Å; K586-D590 PolarHBondContact O-N 2.86Å
587	N	87.8	Confident	88.9	Confident	120 Å²	120	55.5 Å²	55.5	64%	0.642	29%	0.287	S	S	*	.	H	α-helix	trans	-62.4	-0.6	177	-54.5	15.9	0	0	0	115.1	T585 R591	T585-N587 VanDerWaalsContact C-N 3.3Å; T585-N587 PolarHBondContact O-N 3.11Å; N587-R591 WeakPolarHBondContact O-CD 3.18Å; N587-R591 WeakPolarHBondContact O-CG 3.36Å; N587-R591 PolarHBondContact O-NE 2.94Å
588	M	86.3	Confident	88.3	Confident	30 Å²	30	50.4 Å²	50.4	15%	0.148	27%	0.273	C	S	.	.	H	α-helix	trans	-115	-23.3	172.3	-67.7	172.4	63	0	0	112.9	F584 T585 K586 D590 R591 W600	F584-M588 HydrophobicContact CD1-CB 4.15Å; T585-M588 HydrophobicContact CG2-SD 4.5Å; T585-M588 WeakPolarHBondContact O-CA 3.4Å; T585-M588 WeakPolarHBondContact O-CB 3.22Å; T585-M588 PolarHBondContact O-N 2.66Å; T585-M588 WeakPolarHBondContact OG1-CG 3.41Å; T585-M588 PolarHBondContact OG1-SD 3.44Å; K586-M588 PolarHBondContact O-N 3.03Å; M588-D590 VanDerWaalsContact C-N 3.26Å; M588-R591 PolarHBondContact O-N 2.71Å; M588-W600 HydrophobicContact CE-CD2 3.76Å; M588-W600 HydrophobicContact CE-CE3 3.84Å; M588-W600 HydrophobicContact CE-CH2 3.69Å; M588-W600 HydrophobicContact CE-CZ2 3.59Å; M588-W600 HydrophobicContact CE-CZ3 3.81Å
589	M	90.1	Very high	87.6	Confident	13 Å²	13	51.7 Å²	51.7	6%	0.064	29%	0.286	C	S	.	.	H	α-helix	trans	-62.8	-37.9	169.4	-67.1	-172	-163.8	0	0	111.2	A519 F520 R576 L579 F584 T585 K586 R591	A519-M589 PolarHBondContact N-O 3.5Å; F520-M589 HydrophobicContact CB-CB 4Å; F520-M589 PolarHBondContact N-O 2.91Å; R576-M589 HydrophobicContact CB-SD 4.29Å; R576-M589 HydrophobicContact CG-SD 4.23Å; R576-M589 WeakPolarHBondContact O-CE 3.38Å; L579-M589 HydrophobicContact CB-CE 3.95Å; L579-M589 HydrophobicContact CB-CG 4.24Å; L579-M589 HydrophobicContact CB-SD 4.22Å; L579-M589 HydrophobicContact CD1-CG 4.38Å; F584-M589 HydrophobicContact CB-CE 4.24Å; F584-M589 HydrophobicContact CB-CG 3.94Å; F584-M589 VanDerWaalsContact O-CE 3.24Å; F584-M589 WeakPolarHBondContact O-CE 3.34Å; T585-M589 PolarHBondContact O-N 2.66Å; K586-M589 WeakPolarHBondContact O-CB 3.4Å; K586-M589 PolarHBondContact O-N 3.27Å; M589-R591 VanDerWaalsContact C-N 3.33Å
590	D	91	Very high	87.4	Confident	104 Å²	104	53.3 Å²	53.3	56%	0.556	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-3.6	-178.9	-51.3	-41.1	0	0	0	113.2	K586 M588	K586-D590 PolarHBondContact O-N 2.86Å; M588-D590 VanDerWaalsContact C-N 3.26Å
591	R	88.8	Confident	87.2	Confident	128 Å²	128	53.1 Å²	53.1	48%	0.483	28%	0.283	S	S	.	.	S	Bend	trans	-80.2	139.5	179	-75.3	179.8	-166.8	-155.2	-2.9	112	P518 A519 N587 M588 M589	P518-R591 WeakPolarHBondContact CA-O 3.33Å; A519-R591 PolarHBondContact N-O 3.08Å; N587-R591 WeakPolarHBondContact O-CD 3.18Å; N587-R591 WeakPolarHBondContact O-CG 3.36Å; N587-R591 PolarHBondContact O-NE 2.94Å; M588-R591 PolarHBondContact O-N 2.71Å; M589-R591 VanDerWaalsContact C-N 3.33Å
592	P	90.8	Very high	87	Confident	33 Å²	33	55.5 Å²	55.5	21%	0.214	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-53.8	138.4	168.4	-28.4	37.3	0	0	0	113.2	S516 T517 K594 D595	S516-P592 WeakPolarHBondContact O-CB 3.45Å; T517-P592 WeakPolarHBondContact O-CA 3.36Å; P592-K594 HydrophobicContact CB-CD 4.24Å; P592-K594 HydrophobicContact CB-CG 3.56Å; P592-K594 PolarHBondContact O-N 3Å; P592-D595 WeakPolarHBondContact CB-OD2 3.38Å; P592-D595 WeakPolarHBondContact CG-OD2 3.4Å; P592-D595 PolarHBondContact O-N 3.27Å
593	T	88.3	Confident	87	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-62.4	-26.3	179.6	57.3	0	0	0	0	114	V512 V513 D515 T517 A519 M522 D595 L596 R601	V512-T593 HydrophobicContact CG1-CG2 4.33Å; V513-T593 PolarHBondContact O-OG1 3.29Å; D515-T593 PolarHBondContact N-OG1 2.69Å; D515-T593 VanDerWaalsContact N-OG1 3.09Å; D515-T593 PolarHBondContact O-N 3.3Å; D515-T593 PolarHBondContact O-OG1 2.7Å; T517-T593 PolarHBondContact O-N 2.9Å; A519-T593 HydrophobicContact CB-CG2 4.46Å; M522-T593 HydrophobicContact CB-CG2 4.39Å; T593-D595 VanDerWaalsContact C-N 3.27Å; T593-D595 PolarHBondContact O-N 3.05Å; T593-L596 PolarHBondContact O-N 3.19Å; T593-R601 PolarHBondContact O-NE 2.69Å
594	K	89.1	Confident	87.1	Confident	101 Å²	101	54.4 Å²	54.4	44%	0.439	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-54.2	-39.1	168.4	53.9	157.5	-170.5	153.4	0	113.6	A514 D515 P592 L596 R601	A514-K594 HydrophobicContact CB-CB 4.48Å; A514-K594 WeakPolarHBondContact O-CB 3.47Å; D515-K594 WeakPolarHBondContact O-CG 3.46Å; D515-K594 PolarHBondContact O-N 3.08Å; P592-K594 HydrophobicContact CB-CD 4.24Å; P592-K594 HydrophobicContact CB-CG 3.56Å; P592-K594 PolarHBondContact O-N 3Å; K594-L596 VanDerWaalsContact C-N 3.29Å; K594-L596 PolarHBondContact O-N 2.75Å; K594-R601 PolarHBondContact O-NH2 2.9Å
595	D	87.2	Confident	87.2	Confident	95 Å²	95	54.9 Å²	54.9	51%	0.508	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-88.3	-1.5	-172	-53.3	-36.4	0	0	0	112	P592 T593	P592-D595 WeakPolarHBondContact CB-OD2 3.38Å; P592-D595 WeakPolarHBondContact CG-OD2 3.4Å; P592-D595 PolarHBondContact O-N 3.27Å; T593-D595 VanDerWaalsContact C-N 3.27Å; T593-D595 PolarHBondContact O-N 3.05Å
596	L	84	Confident	87.4	Confident	8 Å²	8	51.4 Å²	51.4	4%	0.042	26%	0.263	C	S	.	.	S	Bend	trans	-89.3	144.8	171	-62.2	-179.5	0	0	0	110.7	A519 F584 T593 K594 W600 R601 V604	A519-L596 HydrophobicContact CB-CD1 4.02Å; F584-L596 HydrophobicContact CE1-CD1 3.95Å; T593-L596 PolarHBondContact O-N 3.19Å; K594-L596 VanDerWaalsContact C-N 3.29Å; K594-L596 PolarHBondContact O-N 2.75Å; L596-W600 HydrophobicContact CB-CB 3.88Å; L596-W600 HydrophobicContact CD1-CB 4.37Å; L596-W600 HydrophobicContact CD2-CB 4.3Å; L596-W600 HydrophobicContact CG-CB 4.41Å; L596-R601 HydrophobicContact CB-CG 4.14Å; L596-R601 VanDerWaalsContact O-CZ 3.26Å; L596-R601 PolarHBondContact O-NE 2.8Å; L596-R601 PolarHBondContact O-NH2 2.91Å; L596-R601 VanDerWaalsContact O-NH2 3.13Å; L596-V604 HydrophobicContact CD1-CG2 4.01Å
597	S	81.7	Confident	87.6	Confident	73 Å²	73	43.6 Å²	43.6	51%	0.51	23%	0.229	S	C	.	.			trans	-72.2	162.6	170.9	74	0	0	0	0	111.5	G599 W600 R601	S597-G599 VanDerWaalsContact C-N 3.32Å; S597-G599 PolarHBondContact O-N 3.21Å; S597-W600 WeakPolarHBondContact O-CA 3.13Å; S597-W600 WeakPolarHBondContact O-CB 3.46Å; S597-W600 PolarHBondContact O-N 3.2Å; S597-R601 PolarHBondContact O-N 2.89Å
598	G	78.2	Confident	87.8	Confident	17 Å²	17	42 Å²	42	18%	0.175	21%	0.214	C	C	.	.	H	α-helix	trans	-53.9	-42.9	-175.5	0	0	0	0	0	114.6	E511 W600 R601 M602	E511-G598 WeakPolarHBondContact OE1-CA 3.23Å; E511-G598 WeakPolarHBondContact OE2-CA 3.46Å; G598-W600 VanDerWaalsContact C-N 3.33Å; G598-W600 PolarHBondContact O-N 3.34Å; G598-R601 CarbonylContact O-C 3.59Å; G598-R601 WeakPolarHBondContact O-CA 3.13Å; G598-R601 WeakPolarHBondContact O-CB 3.48Å; G598-R601 PolarHBondContact O-N 3.48Å; G598-R601 VanDerWaalsContact O-N 3.08Å; G598-M602 PolarHBondContact O-N 3.23Å
599	G	79.8	Confident	88.1	Confident	28 Å²	28	40.7 Å²	40.7	29%	0.289	21%	0.208	S	C	.	.	H	α-helix	trans	-59.8	-37.3	173.1	0	0	0	0	0	113.8	S597 M602 R603	S597-G599 VanDerWaalsContact C-N 3.32Å; S597-G599 PolarHBondContact O-N 3.21Å; G599-M602 WeakPolarHBondContact O-CB 3.31Å; G599-M602 PolarHBondContact O-N 2.88Å; G599-R603 WeakPolarHBondContact O-CG 3.28Å; G599-R603 PolarHBondContact O-N 2.98Å; G599-R603 VanDerWaalsContact O-N 3.1Å
600	W	86.9	Confident	88.2	Confident	34 Å²	34	40.1 Å²	40.1	13%	0.129	21%	0.205	C	C	.	.	H	α-helix	trans	-70.9	-37.8	172.5	-76.2	108	0	0	0	111.9	G583 F584 M588 L596 S597 G598 M602 R603 V604 N805	G583-W600 WeakPolarHBondContact O-CH2 3.39Å; F584-W600 HydrophobicContact CD1-CE3 4.18Å; F584-W600 HydrophobicContact CD1-CZ3 4.31Å; F584-W600 HydrophobicContact CD2-CE3 4.19Å; F584-W600 AromaticContact CD2-CZ3 3.94Å; F584-W600 HydrophobicContact CD2-CZ3 3.94Å; F584-W600 AromaticContact CE1-CE3 3.84Å; F584-W600 HydrophobicContact CE1-CE3 3.84Å; F584-W600 HydrophobicContact CE1-CZ3 4.39Å; F584-W600 AromaticContact CE2-CE3 3.87Å; F584-W600 HydrophobicContact CE2-CE3 3.87Å; F584-W600 HydrophobicContact CE2-CZ3 4.05Å; F584-W600 HydrophobicContact CG-CE3 4.35Å; F584-W600 HydrophobicContact CG-CZ3 4.08Å; F584-W600 AromaticContact CZ-CE3 3.67Å; F584-W600 HydrophobicContact CZ-CE3 3.67Å; F584-W600 HydrophobicContact CZ-CZ3 4.26Å; M588-W600 HydrophobicContact CE-CD2 3.76Å; M588-W600 HydrophobicContact CE-CE3 3.84Å; M588-W600 HydrophobicContact CE-CH2 3.69Å; M588-W600 HydrophobicContact CE-CZ2 3.59Å; M588-W600 HydrophobicContact CE-CZ3 3.81Å; L596-W600 HydrophobicContact CB-CB 3.88Å; L596-W600 HydrophobicContact CD1-CB 4.37Å; L596-W600 HydrophobicContact CD2-CB 4.3Å; L596-W600 HydrophobicContact CG-CB 4.41Å; S597-W600 WeakPolarHBondContact O-CA 3.13Å; S597-W600 WeakPolarHBondContact O-CB 3.46Å; S597-W600 PolarHBondContact O-N 3.2Å; G598-W600 VanDerWaalsContact C-N 3.33Å; G598-W600 PolarHBondContact O-N 3.34Å; W600-M602 VanDerWaalsContact C-N 3.3Å; W600-M602 PolarHBondContact O-N 3.45Å; W600-R603 WeakPolarHBondContact O-CB 3.46Å; W600-R603 PolarHBondContact O-N 3.34Å; W600-R603 VanDerWaalsContact O-N 3.12Å; W600-V604 WeakPolarHBondContact O-CG2 3.49Å; W600-V604 PolarHBondContact O-N 3.36Å; W600-N805 HydrophobicContact CZ2-CB 4.49Å
601	R	86.7	Confident	88.3	Confident	52 Å²	52	35.6 Å²	35.6	20%	0.196	18%	0.18	C	C	.	.	H	α-helix	trans	-63.8	-34.3	172.5	-61.5	-179	-165.6	145.7	-0	112.3	E511 V512 T593 K594 L596 S597 G598 V604 S605	E511-R601 HydrophobicContact CB-CB 4.11Å; E511-R601 HydrophobicContact CG-CB 4.46Å; E511-R601 IonicContact OE2-NH1 2.79Å; V512-R601 HydrophobicContact CB-CB 4.49Å; V512-R601 WeakPolarHBondContact O-CD 3.48Å; T593-R601 PolarHBondContact O-NE 2.69Å; K594-R601 PolarHBondContact O-NH2 2.9Å; L596-R601 HydrophobicContact CB-CG 4.14Å; L596-R601 VanDerWaalsContact O-CZ 3.26Å; L596-R601 PolarHBondContact O-NE 2.8Å; L596-R601 PolarHBondContact O-NH2 2.91Å; L596-R601 VanDerWaalsContact O-NH2 3.13Å; S597-R601 PolarHBondContact O-N 2.89Å; G598-R601 CarbonylContact O-C 3.59Å; G598-R601 WeakPolarHBondContact O-CA 3.13Å; G598-R601 WeakPolarHBondContact O-CB 3.48Å; G598-R601 PolarHBondContact O-N 3.48Å; G598-R601 VanDerWaalsContact O-N 3.08Å; R601-V604 PolarHBondContact O-N 3.05Å; R601-S605 PolarHBondContact O-N 3.42Å
602	M	86.3	Confident	88.3	Confident	54 Å²	54	32.3 Å²	32.3	27%	0.266	17%	0.172	S	C	.	.	H	α-helix	trans	-63.2	-42.2	170.6	-170.6	59.9	73.8	0	0	111.2	E509 E511 G598 G599 W600 V604 S605 L606	E509-M602 WeakPolarHBondContact O-CE 3.22Å; E511-M602 HydrophobicContact CG-CE 4.02Å; G598-M602 PolarHBondContact O-N 3.23Å; G599-M602 WeakPolarHBondContact O-CB 3.31Å; G599-M602 PolarHBondContact O-N 2.88Å; W600-M602 VanDerWaalsContact C-N 3.3Å; W600-M602 PolarHBondContact O-N 3.45Å; M602-V604 VanDerWaalsContact C-N 3.34Å; M602-V604 PolarHBondContact O-N 3.44Å; M602-S605 WeakPolarHBondContact O-CA 3.36Å; M602-S605 VanDerWaalsContact O-CB 3.26Å; M602-S605 WeakPolarHBondContact O-CB 3.23Å; M602-S605 PolarHBondContact O-N 2.94Å; M602-L606 PolarHBondContact O-N 3.31Å
603	R	90.3	Very high	88.3	Confident	4 Å²	4	33.8 Å²	33.8	2%	0.015	18%	0.176	C	C	.	.	H	α-helix	trans	-63.1	-34.7	172.8	-63.9	-174.8	-171.2	-164.4	5.7	113	L582 F584 G599 W600 S605 A607 H625 L626 D627 N805	L582-R603 WeakPolarHBondContact O-CD 3.45Å; L582-R603 PolarHBondContact O-NH1 3.49Å; F584-R603 HydrophobicContact CE2-CB 3.68Å; F584-R603 HydrophobicContact CZ-CB 4.05Å; G599-R603 WeakPolarHBondContact O-CG 3.28Å; G599-R603 PolarHBondContact O-N 2.98Å; G599-R603 VanDerWaalsContact O-N 3.1Å; W600-R603 WeakPolarHBondContact O-CB 3.46Å; W600-R603 PolarHBondContact O-N 3.34Å; W600-R603 VanDerWaalsContact O-N 3.12Å; R603-S605 VanDerWaalsContact C-N 3.34Å; R603-A607 VanDerWaalsContact O-CB 3.29Å; R603-A607 WeakPolarHBondContact O-CB 3.36Å; R603-A607 PolarHBondContact O-N 2.95Å; R603-H625 PolarHBondContact NH2-O 3.19Å; R603-H625 VanDerWaalsContact NH2-O 3.1Å; R603-L626 HydrophobicContact CG-CD2 3.67Å; R603-D627 IonicContact CZ-OD2 3.54Å; R603-D627 VanDerWaalsContact CZ-OD2 3.24Å; R603-D627 IonicContact NH1-OD1 2.81Å; R603-D627 IonicContact NH1-OD2 2.88Å; R603-D627 PolarHBondContact NH1-OD2 2.82Å; R603-D627 IonicContact NH2-OD2 2.67Å; R603-D627 PolarHBondContact NH2-OD2 2.87Å; R603-N805 PolarHBondContact NH2-ND2 3.37Å; R603-N805 VanDerWaalsContact NH2-ND2 3.13Å
604	V	91.4	Very high	88.4	Confident	1 Å²	1	34 Å²	34	1%	0.006	18%	0.178	C	C	.	.	H	α-helix	trans	-65.4	-38.6	170.4	-173	0	0	0	0	111	V512 A519 V523 F584 L596 W600 R601 M602 A607 R608	V512-V604 HydrophobicContact CG2-CB 3.94Å; V512-V604 HydrophobicContact CG2-CG1 3.98Å; A519-V604 HydrophobicContact CB-CG2 3.88Å; V523-V604 HydrophobicContact CG2-CG1 4.09Å; F584-V604 HydrophobicContact CE1-CG2 3.94Å; F584-V604 HydrophobicContact CZ-CG2 3.53Å; L596-V604 HydrophobicContact CD1-CG2 4.01Å; W600-V604 WeakPolarHBondContact O-CG2 3.49Å; W600-V604 PolarHBondContact O-N 3.36Å; R601-V604 PolarHBondContact O-N 3.05Å; M602-V604 VanDerWaalsContact C-N 3.34Å; M602-V604 PolarHBondContact O-N 3.44Å; V604-A607 PolarHBondContact O-N 3.33Å; V604-R608 WeakPolarHBondContact O-CB 3.47Å; V604-R608 PolarHBondContact O-N 3.48Å
605	S	90.4	Very high	88.6	Confident	14 Å²	14	30.9 Å²	30.9	10%	0.098	17%	0.167	C	C	.	.	H	α-helix	trans	-62	-46.1	176.3	-146.3	0	0	0	0	111.5	Q510 R601 M602 R603 R608 A609	Q510-S605 WeakPolarHBondContact O-CB 3.43Å; Q510-S605 PolarHBondContact O-OG 2.84Å; R601-S605 PolarHBondContact O-N 3.42Å; M602-S605 WeakPolarHBondContact O-CA 3.36Å; M602-S605 VanDerWaalsContact O-CB 3.26Å; M602-S605 WeakPolarHBondContact O-CB 3.23Å; M602-S605 PolarHBondContact O-N 2.94Å; R603-S605 VanDerWaalsContact C-N 3.34Å; S605-R608 WeakPolarHBondContact O-CB 3.42Å; S605-R608 PolarHBondContact O-N 3.46Å; S605-A609 PolarHBondContact O-N 2.98Å
606	L	92.3	Very high	88.9	Confident	6 Å²	6	26.4 Å²	26.4	3%	0.031	14%	0.143	C	C	.	.	H	α-helix	trans	-63.5	-43.6	173.8	-176.8	61.7	0	0	0	111.7	L582 M602 R608 A609 L610 L619 L626 L634	L582-L606 HydrophobicContact CD1-CD2 4.48Å; L582-L606 HydrophobicContact CD1-CG 4.42Å; L582-L606 HydrophobicContact CD2-CD2 3.94Å; M602-L606 PolarHBondContact O-N 3.31Å; L606-R608 VanDerWaalsContact C-N 3.34Å; L606-R608 PolarHBondContact O-N 3.23Å; L606-A609 PolarHBondContact O-N 3.13Å; L606-A609 VanDerWaalsContact O-N 3.12Å; L606-L610 HydrophobicContact CD1-CD1 4.37Å; L606-L610 HydrophobicContact CD1-CG 4.28Å; L606-L610 HydrophobicContact CG-CD1 4.12Å; L606-L610 HydrophobicContact CG-CG 4.44Å; L606-L610 WeakPolarHBondContact O-CG 3.48Å; L606-L610 PolarHBondContact O-N 3.25Å; L606-L619 HydrophobicContact CD1-CD2 3.82Å; L606-L626 HydrophobicContact CD2-CD1 4.26Å; L606-L634 HydrophobicContact CD2-CD1 4.34Å; L606-L634 HydrophobicContact CD2-CD2 4.14Å
607	A	92.8	Very high	89.4	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-58.3	-45.1	176.5	0	0	0	0	0	111.9	V523 I578 L579 L582 R603 V604 L610 F611	V523-A607 HydrophobicContact CG2-CB 3.82Å; I578-A607 HydrophobicContact CG2-CB 3.81Å; L579-A607 HydrophobicContact CD2-CB 3.65Å; L579-A607 HydrophobicContact CG-CB 4.24Å; L582-A607 HydrophobicContact CD1-CB 3.82Å; R603-A607 VanDerWaalsContact O-CB 3.29Å; R603-A607 WeakPolarHBondContact O-CB 3.36Å; R603-A607 PolarHBondContact O-N 2.95Å; V604-A607 PolarHBondContact O-N 3.33Å; A607-L610 PolarHBondContact O-N 3.48Å; A607-F611 WeakPolarHBondContact O-CB 3.42Å; A607-F611 PolarHBondContact O-N 3.36Å
608	R	91.9	Very high	90	Very high	88 Å²	88	22.6 Å²	22.6	33%	0.332	12%	0.117	S	C	.	.	H	α-helix	trans	-58.3	-46.1	171.9	157.5	174.9	175	-149.7	-4.2	111.9	V604 S605 L606 F611 L612	V604-R608 WeakPolarHBondContact O-CB 3.47Å; V604-R608 PolarHBondContact O-N 3.48Å; S605-R608 WeakPolarHBondContact O-CB 3.42Å; S605-R608 PolarHBondContact O-N 3.46Å; L606-R608 VanDerWaalsContact C-N 3.34Å; L606-R608 PolarHBondContact O-N 3.23Å; R608-F611 PolarHBondContact O-N 3.42Å; R608-L612 HydrophobicContact CG-CD1 3.95Å; R608-L612 WeakPolarHBondContact O-CG 3.39Å; R608-L612 PolarHBondContact O-N 3.45Å
609	A	91.8	Very high	90.7	Very high	2 Å²	2	21.8 Å²	21.8	2%	0.017	11%	0.109	C	C	.	.	H	α-helix	trans	-67	-37	-178.2	0	0	0	0	0	113	L506 C508 S605 L606 L617	L506-A609 HydrophobicContact CD2-CB 3.79Å; C508-A609 HydrophobicContact CB-CB 4.26Å; S605-A609 PolarHBondContact O-N 2.98Å; L606-A609 PolarHBondContact O-N 3.13Å; L606-A609 VanDerWaalsContact O-N 3.12Å; A609-L617 HydrophobicContact CB-CD1 3.92Å
610	L	93.1	Very high	91.2	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-72	-33.8	172.6	-64.6	174.4	0	0	0	112.5	I578 L606 A607 L617 W633 L634 Y637 L638 W641	I578-L610 HydrophobicContact CD1-CB 4.34Å; I578-L610 HydrophobicContact CG2-CB 4.27Å; I578-L610 HydrophobicContact CG2-CD1 4.31Å; L606-L610 HydrophobicContact CD1-CD1 4.37Å; L606-L610 HydrophobicContact CD1-CG 4.28Å; L606-L610 HydrophobicContact CG-CD1 4.12Å; L606-L610 HydrophobicContact CG-CG 4.44Å; L606-L610 WeakPolarHBondContact O-CG 3.48Å; L606-L610 PolarHBondContact O-N 3.25Å; A607-L610 PolarHBondContact O-N 3.48Å; L610-L617 HydrophobicContact CD2-CD2 4.18Å; L610-W633 HydrophobicContact CD1-CH2 4.24Å; L610-W633 HydrophobicContact CD1-CZ3 3.97Å; L610-L634 HydrophobicContact CD1-CD1 3.76Å; L610-L634 HydrophobicContact CD2-CD1 4.37Å; L610-Y637 HydrophobicContact CB-CE1 4.05Å; L610-Y637 HydrophobicContact CD1-CD1 4.32Å; L610-Y637 HydrophobicContact CD1-CE1 4.36Å; L610-Y637 HydrophobicContact CD2-CD1 4.1Å; L610-Y637 HydrophobicContact CD2-CE1 3.99Å; L610-Y637 HydrophobicContact CG-CE1 4.36Å; L610-L638 HydrophobicContact CD2-CD2 3.85Å; L610-W641 HydrophobicContact CD2-CH2 4.45Å; L610-W641 HydrophobicContact CD2-CZ3 4.14Å
611	F	92.7	Very high	91.3	Very high	9 Å²	9	21.5 Å²	21.5	4%	0.039	10%	0.103	C	C	.	.	H	α-helix	trans	-68.5	-44	178.4	175.8	-102.4	0	0	0	112.3	V523 L524 D527 A571 K574 A575 I578 A607 R608 E613	V523-F611 HydrophobicContact CG1-CB 3.67Å; V523-F611 HydrophobicContact CG1-CD1 3.98Å; V523-F611 HydrophobicContact CG1-CD2 4.1Å; V523-F611 HydrophobicContact CG1-CG 3.65Å; V523-F611 WeakPolarHBondContact O-CD1 3.43Å; L524-F611 HydrophobicContact CD2-CE2 4.19Å; L524-F611 HydrophobicContact CD2-CZ 3.88Å; D527-F611 HydrophobicContact CB-CE1 3.89Å; A571-F611 HydrophobicContact CB-CE2 4.2Å; A571-F611 HydrophobicContact CB-CZ 4.04Å; K574-F611 HydrophobicContact CB-CE2 4.42Å; K574-F611 HydrophobicContact CD-CD2 3.87Å; K574-F611 HydrophobicContact CD-CE2 4.08Å; K574-F611 HydrophobicContact CG-CD2 4.17Å; K574-F611 HydrophobicContact CG-CE2 4.48Å; K574-F611 PolarHBondContact NZ-O 3.46Å; A575-F611 HydrophobicContact CB-CD2 4.12Å; A575-F611 HydrophobicContact CB-CE2 4.09Å; I578-F611 HydrophobicContact CD1-CB 4.07Å; A607-F611 WeakPolarHBondContact O-CB 3.42Å; A607-F611 PolarHBondContact O-N 3.36Å; R608-F611 PolarHBondContact O-N 3.42Å; F611-E613 PolarHBondContact O-N 2.83Å
612	L	89.7	Confident	91.3	Very high	60 Å²	60	19.8 Å²	19.8	31%	0.314	10%	0.098	S	C	.	.	H	α-helix	trans	-67.6	-28.8	-179.2	-74.9	169	0	0	0	114.2	L506 D527 R608	L506-L612 HydrophobicContact CD2-CD1 3.96Å; D527-L612 HydrophobicContact CB-CD2 4.1Å; R608-L612 HydrophobicContact CG-CD1 3.95Å; R608-L612 WeakPolarHBondContact O-CG 3.39Å; R608-L612 PolarHBondContact O-N 3.45Å
613	E	90.6	Very high	91.3	Very high	63 Å²	63	17.3 Å²	17.3	29%	0.294	9%	0.086	S	C	.	.			trans	47.4	66.3	-175.7	-61	-178.3	-151.2	0	0	114.8	K574 F611 W641 K643	K574-E613 WeakPolarHBondContact CE-OE1 3.45Å; K574-E613 IonicContact NZ-OE1 3.16Å; K574-E613 PolarHBondContact NZ-OE1 3Å; F611-E613 PolarHBondContact O-N 2.83Å; E613-W641 HydrophobicContact CB-CH2 4Å; E613-W641 HydrophobicContact CB-CZ2 4.33Å; E613-W641 HydrophobicContact CG-CH2 3.74Å; E613-W641 HydrophobicContact CG-CZ2 4.47Å; E613-W641 HydrophobicContact CG-CZ3 3.93Å; E613-K643 HydrophobicContact CB-CD 4.13Å; E613-K643 WeakPolarHBondContact O-CD 3.5Å; E613-K643 WeakPolarHBondContact O-CE 3.38Å; E613-K643 PolarHBondContact O-NZ 3.01Å; E613-K643 WeakPolarHBondContact OE2-CE 3.4Å; E613-K643 IonicContact OE2-NZ 3.05Å
614	P	90.9	Very high	90.8	Very high	6 Å²	6	18.6 Å²	18.6	4%	0.039	9%	0.093	C	C	.	.			trans	-68.9	160.4	178.3	31.3	-37.7	0	0	0	112.7	D504 L506 L616 L617 K643	D504-P614 WeakPolarHBondContact OD2-CA 3.17Å; D504-P614 WeakPolarHBondContact OD2-CB 3.33Å; L506-P614 HydrophobicContact CB-CB 4.21Å; L506-P614 HydrophobicContact CB-CG 3.83Å; L506-P614 HydrophobicContact CD2-CG 4.4Å; P614-L616 VanDerWaalsContact C-N 3.27Å; P614-L616 PolarHBondContact O-N 2.94Å; P614-L617 HydrophobicContact CG-CB 3.81Å; P614-L617 HydrophobicContact CG-CD1 4.11Å; P614-L617 HydrophobicContact CG-CG 4.47Å; P614-K643 WeakPolarHBondContact O-CD 3.41Å
615	T	91.6	Very high	89.9	Confident	34 Å²	34	22.5 Å²	22.5	21%	0.209	11%	0.111	C	C	.	.	S	Bend	trans	-67.3	-27.3	176.9	63.4	0	0	0	0	113.2	D504 T644	D504-T615 PolarHBondContact O-OG1 3.09Å; D504-T615 WeakPolarHBondContact OD1-CB 3.29Å; D504-T615 WeakPolarHBondContact OD1-CG2 3.5Å; D504-T615 PolarHBondContact OD1-N 3.29Å; D504-T615 PolarHBondContact OD1-OG1 3.46Å; D504-T615 PolarHBondContact OD2-N 3.23Å; D504-T615 VanDerWaalsContact OD2-N 3.08Å; T615-T644 WeakPolarHBondContact O-CA 3.36Å; T615-T644 WeakPolarHBondContact O-CB 3.31Å; T615-T644 PolarHBondContact O-N 2.96Å; T615-T644 PolarHBondContact O-OG1 3.37Å
616	L	93.5	Very high	89.6	Confident	2 Å²	2	22 Å²	22	1%	0.01	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	104.6	165.2	178.3	58.6	0	0	0	111.1	I447 I469 I503 D504 V505 L506 P614 L618 T644 L646	I447-L616 HydrophobicContact CD1-CD2 3.54Å; I469-L616 HydrophobicContact CD1-CD2 4.38Å; I469-L616 HydrophobicContact CG2-CD1 4.49Å; I503-L616 HydrophobicContact CG2-CB 4.04Å; D504-L616 PolarHBondContact O-N 2.93Å; D504-L616 VanDerWaalsContact O-N 3.17Å; V505-L616 HydrophobicContact CG1-CD2 4.45Å; V505-L616 HydrophobicContact CG2-CB 4.43Å; V505-L616 HydrophobicContact CG2-CD2 4.22Å; L506-L616 PolarHBondContact N-O 2.92Å; P614-L616 VanDerWaalsContact C-N 3.27Å; P614-L616 PolarHBondContact O-N 2.94Å; L616-L618 HydrophobicContact CD1-CD2 3.94Å; L616-L618 HydrophobicContact CD2-CD2 3.94Å; L616-L618 HydrophobicContact CG-CD2 3.7Å; L616-T644 HydrophobicContact CD1-CG2 3.96Å; L616-L646 HydrophobicContact CD1-CB 4.3Å
617	L	94.7	Very high	89.2	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	122.2	171.1	180	53	0	0	0	110.2	A609 L610 P614 L619 W641 T644 L645 L646	A609-L617 HydrophobicContact CB-CD1 3.92Å; L610-L617 HydrophobicContact CD2-CD2 4.18Å; P614-L617 HydrophobicContact CG-CB 3.81Å; P614-L617 HydrophobicContact CG-CD1 4.11Å; P614-L617 HydrophobicContact CG-CG 4.47Å; L617-L619 HydrophobicContact CD1-CD2 3.87Å; L617-L619 HydrophobicContact CD1-CG 4.47Å; L617-L619 HydrophobicContact CD2-CD1 4.5Å; L617-L619 HydrophobicContact CD2-CD2 4.21Å; L617-L619 HydrophobicContact CD2-CG 4.43Å; L617-L619 HydrophobicContact CG-CD2 3.95Å; L617-L619 HydrophobicContact CG-CG 4.08Å; L617-W641 HydrophobicContact CB-CZ2 4.17Å; L617-W641 HydrophobicContact CD2-CH2 3.85Å; L617-W641 HydrophobicContact CD2-CZ2 3.64Å; L617-T644 PolarHBondContact N-O 3.39Å; L617-L645 HydrophobicContact CB-CD2 3.86Å; L617-L645 HydrophobicContact CD2-CD2 3.96Å; L617-L645 HydrophobicContact CG-CD2 3.97Å; L617-L646 PolarHBondContact O-N 3.47Å
618	L	94.6	Very high	88.9	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	125.1	172.7	-46.4	-179.2	0	0	0	109.7	L489 I492 A493 V505 L506 L507 C508 L616 L646	L489-L618 HydrophobicContact CD2-CB 4.4Å; L489-L618 HydrophobicContact CD2-CD1 4.49Å; L489-L618 HydrophobicContact CD2-CD2 4.39Å; I492-L618 HydrophobicContact CB-CD1 4.15Å; I492-L618 HydrophobicContact CG2-CD1 3.71Å; I492-L618 HydrophobicContact CG2-CD2 4.29Å; A493-L618 HydrophobicContact CB-CD1 4.28Å; V505-L618 HydrophobicContact CG1-CD1 3.57Å; V505-L618 HydrophobicContact CG1-CD2 4.49Å; V505-L618 HydrophobicContact CG1-CG 3.88Å; L506-L618 WeakPolarHBondContact O-CB 3.39Å; L506-L618 PolarHBondContact O-N 2.85Å; L507-L618 HydrophobicContact CB-CB 4.34Å; L507-L618 HydrophobicContact CB-CD1 4.32Å; L507-L618 HydrophobicContact CD1-CB 3.76Å; L507-L618 HydrophobicContact CD1-CD1 4.49Å; C508-L618 PolarHBondContact N-O 3.12Å; L616-L618 HydrophobicContact CD1-CD2 3.94Å; L616-L618 HydrophobicContact CD2-CD2 3.94Å; L616-L618 HydrophobicContact CG-CD2 3.7Å; L618-L646 WeakPolarHBondContact CA-O 3.34Å; L618-L646 HydrophobicContact CD2-CB 3.75Å; L618-L646 HydrophobicContact CD2-CD2 4.05Å; L618-L646 HydrophobicContact CD2-CG 4.36Å
619	L	93.3	Very high	88.7	Confident	0 Å²	0	19 Å²	19	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	122.6	176.1	-58.3	179.5	0	0	0	109.5	C508 L606 L617 P622 L638 L645 L646 I647 V648	C508-L619 HydrophobicContact CB-CD2 3.7Å; L606-L619 HydrophobicContact CD1-CD2 3.82Å; L617-L619 HydrophobicContact CD1-CD2 3.87Å; L617-L619 HydrophobicContact CD1-CG 4.47Å; L617-L619 HydrophobicContact CD2-CD1 4.5Å; L617-L619 HydrophobicContact CD2-CD2 4.21Å; L617-L619 HydrophobicContact CD2-CG 4.43Å; L617-L619 HydrophobicContact CG-CD2 3.95Å; L617-L619 HydrophobicContact CG-CG 4.08Å; L619-P622 HydrophobicContact CB-CB 4.05Å; L619-P622 HydrophobicContact CB-CG 3.78Å; L619-P622 HydrophobicContact CD1-CB 4.23Å; L619-P622 HydrophobicContact CD1-CG 4.05Å; L619-L638 HydrophobicContact CD1-CD1 4.16Å; L619-L645 HydrophobicContact CD1-CD2 4.38Å; L619-L646 PolarHBondContact N-O 2.82Å; L619-I647 HydrophobicContact CB-CG1 4.44Å; L619-I647 HydrophobicContact CD1-CG1 4.3Å; L619-V648 PolarHBondContact O-N 3Å
620	D	90.9	Very high	88.6	Confident	31 Å²	31	19 Å²	19	17%	0.166	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	109.8	174	-151.6	34.1	0	0	0	110.1	T486 L489 V648	T486-D620 WeakPolarHBondContact CA-OD2 3.39Å; T486-D620 WeakPolarHBondContact CB-OD2 3.49Å; T486-D620 WeakPolarHBondContact CG2-OD2 3.39Å; T486-D620 PolarHBondContact OG1-OD2 3.03Å; L489-D620 HydrophobicContact CD1-CB 3.69Å; L489-D620 WeakPolarHBondContact CD1-OD1 3.4Å; D620-V648 WeakPolarHBondContact OD1-CB 3.39Å; D620-V648 WeakPolarHBondContact OD1-CG1 3.5Å; D620-V648 WeakPolarHBondContact OD1-CG2 3.29Å
621	E	87.2	Confident	88.5	Confident	26 Å²	26	19.4 Å²	19.4	12%	0.121	10%	0.1	C	C	.	.	S	Bend	trans	45	52.5	-179.8	-56.3	-175	-173.9	0	0	114.6	K485 T623 N624 V648 H650	K485-E621 WeakPolarHBondContact CE-OE1 3.42Å; K485-E621 IonicContact NZ-OE1 2.97Å; K485-E621 PolarHBondContact NZ-OE1 3.46Å; E621-T623 PolarHBondContact O-N 3.26Å; E621-N624 VanDerWaalsContact CB-ND2 3.31Å; E621-N624 WeakPolarHBondContact CB-ND2 3.41Å; E621-N624 WeakPolarHBondContact O-CB 3.38Å; E621-N624 PolarHBondContact O-N 3.36Å; E621-N624 PolarHBondContact OE2-ND2 3.41Å; E621-V648 VanDerWaalsContact CA-O 3.23Å; E621-V648 WeakPolarHBondContact CA-O 3.47Å; E621-V648 HydrophobicContact CG-CG1 3.76Å; E621-V648 PolarHBondContact N-O 3.08Å; E621-H650 IonicContact OE1-CD2 2.83Å; E621-H650 PolarHBondContact OE1-CD2 3.18Å; E621-H650 IonicContact OE1-NE2 3.69Å
622	P	87.7	Confident	88.3	Confident	15 Å²	15	19.1 Å²	19.1	10%	0.097	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-7.9	-168.9	31.8	-39.5	0	0	0	115	L619 L626 L634 I647 V648 F654	L619-P622 HydrophobicContact CB-CB 4.05Å; L619-P622 HydrophobicContact CB-CG 3.78Å; L619-P622 HydrophobicContact CD1-CB 4.23Å; L619-P622 HydrophobicContact CD1-CG 4.05Å; P622-L626 WeakPolarHBondContact O-CD1 3.14Å; P622-L626 WeakPolarHBondContact O-CG 3.31Å; P622-L634 HydrophobicContact CB-CD2 4.41Å; P622-I647 HydrophobicContact CG-CG2 4.41Å; P622-V648 WeakPolarHBondContact CD-O 3.26Å; P622-F654 HydrophobicContact CG-CE1 4.03Å; P622-F654 HydrophobicContact CG-CZ 4.25Å
623	T	85.7	Confident	88.5	Confident	3 Å²	3	16.4 Å²	16.4	2%	0.018	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-22.6	173.2	46.4	0	0	0	0	112.4	E621 L626 V631 D651 F654	E621-T623 PolarHBondContact O-N 3.26Å; T623-L626 WeakPolarHBondContact O-CB 3.45Å; T623-L626 PolarHBondContact O-N 2.94Å; T623-V631 HydrophobicContact CG2-CG1 4.19Å; T623-V631 HydrophobicContact CG2-CG2 4.28Å; T623-D651 HydrophobicContact CG2-CB 4.43Å; T623-F654 HydrophobicContact CG2-CB 4.43Å; T623-F654 HydrophobicContact CG2-CD1 3.97Å; T623-F654 HydrophobicContact CG2-CD2 4.22Å; T623-F654 HydrophobicContact CG2-CE1 4.16Å; T623-F654 HydrophobicContact CG2-CE2 4.42Å; T623-F654 HydrophobicContact CG2-CG 3.99Å; T623-F654 HydrophobicContact CG2-CZ 4.37Å
624	N	79.5	Confident	88.5	Confident	30 Å²	30	13.4 Å²	13.4	16%	0.16	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	137.6	179	-61.8	-2.9	0	0	0	109.8	E621 L626	E621-N624 VanDerWaalsContact CB-ND2 3.31Å; E621-N624 WeakPolarHBondContact CB-ND2 3.41Å; E621-N624 WeakPolarHBondContact O-CB 3.38Å; E621-N624 PolarHBondContact O-N 3.36Å; E621-N624 PolarHBondContact OE2-ND2 3.41Å; N624-L626 PolarHBondContact O-N 2.99Å; N624-L626 VanDerWaalsContact O-N 3.11Å
625	H	73.1	Confident	88.6	Confident	83 Å²	83	13.3 Å²	13.3	38%	0.384	7%	0.07	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.9	4.7	-176	-38.9	-75.3	0	0	0	116	R603	R603-H625 PolarHBondContact NH2-O 3.19Å; R603-H625 VanDerWaalsContact NH2-O 3.1Å
626	L	84.2	Confident	88.6	Confident	5 Å²	5	11.9 Å²	11.9	3%	0.026	6%	0.061	C	C	.	.			trans	-83.2	145.5	163.7	-62.5	-168.7	0	0	0	110.3	R603 L606 P622 T623 N624 A630 V631 L634	R603-L626 HydrophobicContact CG-CD2 3.67Å; L606-L626 HydrophobicContact CD2-CD1 4.26Å; P622-L626 WeakPolarHBondContact O-CD1 3.14Å; P622-L626 WeakPolarHBondContact O-CG 3.31Å; T623-L626 WeakPolarHBondContact O-CB 3.45Å; T623-L626 PolarHBondContact O-N 2.94Å; N624-L626 PolarHBondContact O-N 2.99Å; N624-L626 VanDerWaalsContact O-N 3.11Å; L626-A630 HydrophobicContact CB-CB 4.21Å; L626-A630 HydrophobicContact CD1-CB 4.4Å; L626-A630 HydrophobicContact CD2-CB 4.25Å; L626-V631 HydrophobicContact CB-CG2 3.6Å; L626-V631 HydrophobicContact CD1-CG2 4.19Å; L626-L634 HydrophobicContact CD1-CD2 3.72Å
627	D	84.5	Confident	88.5	Confident	3 Å²	3	13.2 Å²	13.2	2%	0.016	7%	0.066	C	C	.	.			trans	-79.4	161.5	163.9	42.2	65.4	0	0	0	109.8	R603 N629 A630 V631 N805	R603-D627 IonicContact CZ-OD2 3.54Å; R603-D627 VanDerWaalsContact CZ-OD2 3.24Å; R603-D627 IonicContact NH1-OD1 2.81Å; R603-D627 IonicContact NH1-OD2 2.88Å; R603-D627 PolarHBondContact NH1-OD2 2.82Å; R603-D627 IonicContact NH2-OD2 2.67Å; R603-D627 PolarHBondContact NH2-OD2 2.87Å; D627-N629 PolarHBondContact O-N 3Å; D627-N629 VanDerWaalsContact O-N 3.14Å; D627-A630 PolarHBondContact O-N 2.83Å; D627-A630 VanDerWaalsContact O-N 3.08Å; D627-A630 VanDerWaalsContact OD1-CB 3.29Å; D627-A630 WeakPolarHBondContact OD1-CB 3.45Å; D627-A630 PolarHBondContact OD1-N 3.23Å; D627-V631 WeakPolarHBondContact O-CG2 3.29Å; D627-V631 PolarHBondContact O-N 3.27Å; D627-N805 HydrophobicContact CB-CB 4.48Å; D627-N805 WeakPolarHBondContact OD2-CB 3.34Å; D627-N805 PolarHBondContact OD2-N 2.59Å
628	L	84.8	Confident	88.4	Confident	5 Å²	5	13.2 Å²	13.2	3%	0.026	7%	0.066	C	C	.	.	H	α-helix	trans	-51.2	-38.9	179.6	-173.1	62.3	0	0	0	112.4	V631 I632 V802 H942 I947 F969 Y972	L628-V631 PolarHBondContact O-N 2.97Å; L628-I632 HydrophobicContact CD1-CD1 4.32Å; L628-I632 HydrophobicContact CG-CD1 3.91Å; L628-I632 WeakPolarHBondContact O-CB 3.35Å; L628-I632 WeakPolarHBondContact O-CD1 3.44Å; L628-I632 VanDerWaalsContact O-CG1 3.26Å; L628-I632 WeakPolarHBondContact O-CG1 3.43Å; L628-I632 PolarHBondContact O-N 2.9Å; L628-V802 HydrophobicContact CD2-CB 4.26Å; L628-V802 HydrophobicContact CD2-CG1 3.57Å; L628-H942 VanDerWaalsContact CD1-O 3.31Å; L628-H942 WeakPolarHBondContact CD1-O 3.34Å; L628-I947 HydrophobicContact CD2-CD1 4.46Å; L628-F969 HydrophobicContact CD1-CE2 3.79Å; L628-F969 HydrophobicContact CD1-CZ 3.82Å; L628-F969 HydrophobicContact CD2-CE2 3.86Å; L628-F969 HydrophobicContact CD2-CZ 4.47Å; L628-F969 HydrophobicContact CG-CE2 4.31Å; L628-F969 HydrophobicContact CG-CZ 4.48Å; L628-Y972 HydrophobicContact CD2-CD1 4.23Å; L628-Y972 HydrophobicContact CD2-CE1 3.92Å
629	N	88.7	Confident	88.2	Confident	23 Å²	23	13.8 Å²	13.8	12%	0.123	7%	0.069	C	C	.	.	H	α-helix	trans	-64.2	-48	179.8	-53.4	37.3	0	0	0	111.1	D627 I632 W633 Y972 I976	D627-N629 PolarHBondContact O-N 3Å; D627-N629 VanDerWaalsContact O-N 3.14Å; N629-I632 PolarHBondContact O-N 3.06Å; N629-W633 PolarHBondContact O-N 3.43Å; N629-Y972 PolarHBondContact OD1-OH 3.35Å; N629-I976 HydrophobicContact CB-CG2 4.16Å; N629-I976 WeakPolarHBondContact ND2-CD1 3.35Å
630	A	90.2	Very high	88	Confident	1 Å²	1	17.8 Å²	17.8	1%	0.008	8%	0.084	C	C	.	.	H	α-helix	trans	-66.4	-33.9	175.1	0	0	0	0	0	113	L582 L626 D627 L634	L582-A630 HydrophobicContact CD2-CB 4.48Å; L626-A630 HydrophobicContact CB-CB 4.21Å; L626-A630 HydrophobicContact CD1-CB 4.4Å; L626-A630 HydrophobicContact CD2-CB 4.25Å; D627-A630 PolarHBondContact O-N 2.83Å; D627-A630 VanDerWaalsContact O-N 3.08Å; D627-A630 VanDerWaalsContact OD1-CB 3.29Å; D627-A630 WeakPolarHBondContact OD1-CB 3.45Å; D627-A630 PolarHBondContact OD1-N 3.23Å; A630-L634 WeakPolarHBondContact O-CB 3.47Å; A630-L634 PolarHBondContact O-N 2.89Å
631	V	89.8	Confident	88.1	Confident	9 Å²	9	17.1 Å²	17.1	6%	0.055	8%	0.079	C	C	.	.	H	α-helix	trans	-65.9	-46.1	173.3	174.7	0	0	0	0	111.3	T623 L626 D627 L628 W633 L634 D635 H942	T623-V631 HydrophobicContact CG2-CG1 4.19Å; T623-V631 HydrophobicContact CG2-CG2 4.28Å; L626-V631 HydrophobicContact CB-CG2 3.6Å; L626-V631 HydrophobicContact CD1-CG2 4.19Å; D627-V631 WeakPolarHBondContact O-CG2 3.29Å; D627-V631 PolarHBondContact O-N 3.27Å; L628-V631 PolarHBondContact O-N 2.97Å; V631-W633 VanDerWaalsContact C-N 3.32Å; V631-W633 PolarHBondContact O-N 2.81Å; V631-L634 PolarHBondContact O-N 3.44Å; V631-D635 WeakPolarHBondContact O-CB 3.17Å; V631-D635 PolarHBondContact O-N 2.98Å; V631-H942 HydrophobicContact CG2-CB 4.23Å
632	I	90	Very high	88.2	Confident	3 Å²	3	24.7 Å²	24.7	2%	0.015	11%	0.111	C	C	.	.	H	α-helix	trans	-58.8	-43.1	176.6	-74.9	163.7	0	0	0	111.2	L628 N629 N636 F969 R973 I976 L977	L628-I632 HydrophobicContact CD1-CD1 4.32Å; L628-I632 HydrophobicContact CG-CD1 3.91Å; L628-I632 WeakPolarHBondContact O-CB 3.35Å; L628-I632 WeakPolarHBondContact O-CD1 3.44Å; L628-I632 VanDerWaalsContact O-CG1 3.26Å; L628-I632 WeakPolarHBondContact O-CG1 3.43Å; L628-I632 PolarHBondContact O-N 2.9Å; N629-I632 PolarHBondContact O-N 3.06Å; I632-N636 PolarHBondContact O-N 2.85Å; I632-F969 HydrophobicContact CD1-CZ 4.28Å; I632-R973 HydrophobicContact CD1-CB 4.33Å; I632-R973 HydrophobicContact CD1-CG 4.34Å; I632-R973 HydrophobicContact CG1-CG 4.27Å; I632-R973 HydrophobicContact CG2-CG 3.87Å; I632-I976 HydrophobicContact CG2-CG2 4.42Å; I632-L977 HydrophobicContact CG2-CD1 4.38Å; I632-L977 HydrophobicContact CG2-CD2 3.98Å; I632-L977 HydrophobicContact CG2-CG 3.87Å
633	W	92.2	Very high	88.5	Confident	3 Å²	3	27.1 Å²	27.1	1%	0.011	12%	0.12	C	C	.	.	H	α-helix	trans	-66.2	-46.6	175	179.6	85.2	0	0	0	112	I578 G581 L582 L610 N629 V631 D635 N636 Y637 L980 E982	I578-W633 HydrophobicContact CB-CH2 4.19Å; I578-W633 HydrophobicContact CG1-CH2 4.14Å; I578-W633 HydrophobicContact CG1-CZ2 4.48Å; I578-W633 HydrophobicContact CG2-CH2 4.06Å; G581-W633 VanDerWaalsContact CA-CD2 3.49Å; G581-W633 WeakPolarHBondContact O-CB 3.49Å; L582-W633 HydrophobicContact CD2-CE3 4.09Å; L582-W633 HydrophobicContact CD2-CZ3 4.03Å; L582-W633 HydrophobicContact CG-CE3 4.2Å; L582-W633 HydrophobicContact CG-CZ3 3.91Å; L610-W633 HydrophobicContact CD1-CH2 4.24Å; L610-W633 HydrophobicContact CD1-CZ3 3.97Å; N629-W633 PolarHBondContact O-N 3.43Å; V631-W633 VanDerWaalsContact C-N 3.32Å; V631-W633 PolarHBondContact O-N 2.81Å; W633-D635 VanDerWaalsContact C-N 3.33Å; W633-D635 PolarHBondContact O-N 3.21Å; W633-N636 PolarHBondContact O-N 3Å; W633-Y637 HydrophobicContact CH2-CD1 4.14Å; W633-Y637 AromaticContact CH2-CD2 3.65Å; W633-Y637 HydrophobicContact CH2-CD2 3.65Å; W633-Y637 HydrophobicContact CH2-CE2 4.06Å; W633-Y637 AromaticContact CH2-CG 3.69Å; W633-Y637 HydrophobicContact CH2-CG 3.69Å; W633-Y637 AromaticContact CZ2-CD2 3.38Å; W633-Y637 HydrophobicContact CZ2-CD2 3.38Å; W633-Y637 AromaticContact CZ2-CE2 3.91Å; W633-Y637 HydrophobicContact CZ2-CE2 3.91Å; W633-Y637 AromaticContact CZ2-CG 3.83Å; W633-Y637 HydrophobicContact CZ2-CG 3.83Å; W633-Y637 HydrophobicContact CZ3-CG 4.27Å; W633-Y637 WeakPolarHBondContact O-CB 3.27Å; W633-Y637 PolarHBondContact O-N 3.36Å; W633-L980 HydrophobicContact CB-CD1 4.16Å; W633-L980 HydrophobicContact CG-CD1 4.33Å; W633-E982 PolarHBondContact NE1-OE1 3.21Å
634	L	92.4	Very high	88.9	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-61.4	-39.2	-178.6	-177.8	66	0	0	0	112.1	L606 L610 P622 L626 A630 V631 Y637 L638 F654	L606-L634 HydrophobicContact CD2-CD1 4.34Å; L606-L634 HydrophobicContact CD2-CD2 4.14Å; L610-L634 HydrophobicContact CD1-CD1 3.76Å; L610-L634 HydrophobicContact CD2-CD1 4.37Å; P622-L634 HydrophobicContact CB-CD2 4.41Å; L626-L634 HydrophobicContact CD1-CD2 3.72Å; A630-L634 WeakPolarHBondContact O-CB 3.47Å; A630-L634 PolarHBondContact O-N 2.89Å; V631-L634 PolarHBondContact O-N 3.44Å; L634-Y637 PolarHBondContact O-N 3.45Å; L634-L638 HydrophobicContact CD1-CD1 3.82Å; L634-L638 HydrophobicContact CD1-CG 4Å; L634-L638 HydrophobicContact CD2-CD1 4.4Å; L634-L638 HydrophobicContact CG-CD1 3.8Å; L634-L638 HydrophobicContact CG-CG 4.3Å; L634-L638 WeakPolarHBondContact O-CB 3.4Å; L634-L638 VanDerWaalsContact O-CG 3.31Å; L634-L638 WeakPolarHBondContact O-CG 3.41Å; L634-L638 PolarHBondContact O-N 3.02Å; L634-F654 HydrophobicContact CD2-CE2 4.12Å; L634-F654 HydrophobicContact CD2-CZ 4Å; L634-F654 HydrophobicContact CG-CE2 4.12Å; L634-F654 HydrophobicContact CG-CZ 4.28Å
635	D	91.4	Very high	89.6	Confident	4 Å²	4	25.8 Å²	25.8	2%	0.021	11%	0.113	C	C	.	.	H	α-helix	trans	-60.5	-54.8	173.9	179.6	14.2	0	0	0	111.3	V631 W633 Y637 L638 Q639 F654 N657 V658 R973	V631-D635 WeakPolarHBondContact O-CB 3.17Å; V631-D635 PolarHBondContact O-N 2.98Å; W633-D635 VanDerWaalsContact C-N 3.33Å; W633-D635 PolarHBondContact O-N 3.21Å; D635-Y637 VanDerWaalsContact C-N 3.25Å; D635-Y637 PolarHBondContact O-N 2.63Å; D635-L638 PolarHBondContact O-N 3.11Å; D635-Q639 VanDerWaalsContact CG-NE2 3.34Å; D635-Q639 WeakPolarHBondContact O-CB 3.41Å; D635-Q639 VanDerWaalsContact O-CG 3.29Å; D635-Q639 WeakPolarHBondContact O-CG 3.46Å; D635-Q639 PolarHBondContact O-N 3.33Å; D635-Q639 PolarHBondContact OD1-NE2 3.39Å; D635-Q639 PolarHBondContact OD2-NE2 3.37Å; D635-F654 HydrophobicContact CB-CD2 4.12Å; D635-F654 HydrophobicContact CB-CE2 4.4Å; D635-N657 WeakPolarHBondContact OD1-CB 3.24Å; D635-N657 PolarHBondContact OD2-ND2 3.05Å; D635-V658 WeakPolarHBondContact OD1-CG2 3.46Å; D635-R973 IonicContact OD2-CZ 3.78Å; D635-R973 IonicContact OD2-NH1 2.69Å; D635-R973 PolarHBondContact OD2-NH1 3.12Å; D635-R973 IonicContact OD2-NH2 3.55Å; D635-R973 PolarHBondContact OD2-NH2 3.31Å
636	N	91.3	Very high	90.7	Very high	3 Å²	3	21.9 Å²	21.9	2%	0.016	10%	0.095	C	C	.	.	H	α-helix	trans	-58.2	-38.2	177.3	-170.5	-8.8	0	0	0	111.6	I632 W633 R640 L977 E983 S985	I632-N636 PolarHBondContact O-N 2.85Å; W633-N636 PolarHBondContact O-N 3Å; N636-R640 WeakPolarHBondContact O-CG 3.28Å; N636-R640 PolarHBondContact OD1-NE 3.48Å; N636-R640 VanDerWaalsContact OD1-NE 3.16Å; N636-R640 PolarHBondContact OD1-NH2 3.04Å; N636-L977 HydrophobicContact CB-CD2 4.11Å; N636-L977 WeakPolarHBondContact ND2-CD2 3.47Å; N636-E983 PolarHBondContact ND2-O 3.32Å; N636-E983 PolarHBondContact OD1-O 3.29Å; N636-S985 WeakPolarHBondContact OD1-CB 3.5Å; N636-S985 PolarHBondContact OD1-N 2.89Å
637	Y	92.1	Very high	91.1	Very high	31 Å²	31	21.6 Å²	21.6	12%	0.122	9%	0.094	C	C	.	.	H	α-helix	trans	-66.5	-48.1	176.6	-166.2	-95.4	0	0	0	112.7	I578 L610 W633 L634 D635 R640 W641	I578-Y637 HydrophobicContact CG1-CE2 4.33Å; L610-Y637 HydrophobicContact CB-CE1 4.05Å; L610-Y637 HydrophobicContact CD1-CD1 4.32Å; L610-Y637 HydrophobicContact CD1-CE1 4.36Å; L610-Y637 HydrophobicContact CD2-CD1 4.1Å; L610-Y637 HydrophobicContact CD2-CE1 3.99Å; L610-Y637 HydrophobicContact CG-CE1 4.36Å; W633-Y637 HydrophobicContact CH2-CD1 4.14Å; W633-Y637 AromaticContact CH2-CD2 3.65Å; W633-Y637 HydrophobicContact CH2-CD2 3.65Å; W633-Y637 HydrophobicContact CH2-CE2 4.06Å; W633-Y637 AromaticContact CH2-CG 3.69Å; W633-Y637 HydrophobicContact CH2-CG 3.69Å; W633-Y637 AromaticContact CZ2-CD2 3.38Å; W633-Y637 HydrophobicContact CZ2-CD2 3.38Å; W633-Y637 AromaticContact CZ2-CE2 3.91Å; W633-Y637 HydrophobicContact CZ2-CE2 3.91Å; W633-Y637 AromaticContact CZ2-CG 3.83Å; W633-Y637 HydrophobicContact CZ2-CG 3.83Å; W633-Y637 HydrophobicContact CZ3-CG 4.27Å; W633-Y637 WeakPolarHBondContact O-CB 3.27Å; W633-Y637 PolarHBondContact O-N 3.36Å; L634-Y637 PolarHBondContact O-N 3.45Å; D635-Y637 VanDerWaalsContact C-N 3.25Å; D635-Y637 PolarHBondContact O-N 2.63Å; Y637-R640 PolarHBondContact O-N 3.33Å; Y637-W641 HydrophobicContact CE1-CE3 4.11Å; Y637-W641 AromaticContact CE1-CZ3 3.91Å; Y637-W641 HydrophobicContact CE1-CZ3 3.91Å
638	L	92.8	Very high	91.5	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-74.1	-27	-178.2	-70.2	175.9	0	0	0	113.7	L610 L619 L634 D635 R640 W641 L645 I647 F654 V658	L610-L638 HydrophobicContact CD2-CD2 3.85Å; L619-L638 HydrophobicContact CD1-CD1 4.16Å; L634-L638 HydrophobicContact CD1-CD1 3.82Å; L634-L638 HydrophobicContact CD1-CG 4Å; L634-L638 HydrophobicContact CD2-CD1 4.4Å; L634-L638 HydrophobicContact CG-CD1 3.8Å; L634-L638 HydrophobicContact CG-CG 4.3Å; L634-L638 WeakPolarHBondContact O-CB 3.4Å; L634-L638 VanDerWaalsContact O-CG 3.31Å; L634-L638 WeakPolarHBondContact O-CG 3.41Å; L634-L638 PolarHBondContact O-N 3.02Å; D635-L638 PolarHBondContact O-N 3.11Å; L638-R640 PolarHBondContact O-N 2.98Å; L638-W641 HydrophobicContact CD2-CE3 4.44Å; L638-W641 WeakPolarHBondContact O-CB 3.37Å; L638-W641 PolarHBondContact O-N 3.37Å; L638-L645 HydrophobicContact CD2-CD1 4.05Å; L638-L645 HydrophobicContact CD2-CD2 4.18Å; L638-I647 HydrophobicContact CD1-CD1 4.25Å; L638-F654 HydrophobicContact CD1-CE2 4.06Å; L638-F654 HydrophobicContact CD1-CZ 3.6Å; L638-V658 HydrophobicContact CB-CG1 3.91Å; L638-V658 HydrophobicContact CB-CG2 4.06Å
639	Q	91	Very high	91.7	Very high	11 Å²	11	21.2 Å²	21.2	5%	0.051	9%	0.092	C	C	.	.	H	α-helix	trans	-58	-34.1	169.6	-77.5	176.5	40.5	0	0	112.6	R474 D635 W641 S985	R474-Q639 PolarHBondContact NH1-O 2.88Å; D635-Q639 VanDerWaalsContact CG-NE2 3.34Å; D635-Q639 WeakPolarHBondContact O-CB 3.41Å; D635-Q639 VanDerWaalsContact O-CG 3.29Å; D635-Q639 WeakPolarHBondContact O-CG 3.46Å; D635-Q639 PolarHBondContact O-N 3.33Å; D635-Q639 PolarHBondContact OD1-NE2 3.39Å; D635-Q639 PolarHBondContact OD2-NE2 3.37Å; Q639-W641 VanDerWaalsContact C-N 3.29Å; Q639-S985 VanDerWaalsContact OE1-CB 3.3Å; Q639-S985 PolarHBondContact OE1-O 2.86Å; Q639-S985 PolarHBondContact OE1-OG 3.25Å
640	R	89.2	Confident	91.6	Very high	85 Å²	85	20.7 Å²	20.7	32%	0.321	9%	0.089	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-6.7	178.1	-59.2	167.7	-175.4	176.9	0.9	113	N636 Y637 L638 E982 E983	N636-R640 WeakPolarHBondContact O-CG 3.28Å; N636-R640 PolarHBondContact OD1-NE 3.48Å; N636-R640 VanDerWaalsContact OD1-NE 3.16Å; N636-R640 PolarHBondContact OD1-NH2 3.04Å; Y637-R640 PolarHBondContact O-N 3.33Å; L638-R640 PolarHBondContact O-N 2.98Å; R640-E982 IonicContact CZ-OE2 2.81Å; R640-E982 VanDerWaalsContact CZ-OE2 3.25Å; R640-E982 IonicContact NH1-OE2 2.7Å; R640-E982 PolarHBondContact NH1-OE2 3.42Å; R640-E982 IonicContact NH2-OE2 2.99Å; R640-E982 PolarHBondContact NH2-OE2 3.42Å; R640-E983 PolarHBondContact NH2-O 3.33Å
641	W	91.7	Very high	91.4	Very high	16 Å²	16	21.1 Å²	21.1	6%	0.061	9%	0.091	C	C	.	.			trans	-70.4	131.8	-175.4	-163.8	-94.5	0	0	0	112.2	R474 L610 E613 L617 Y637 L638 Q639 K643 L645	R474-W641 PolarHBondContact NH1-O 2.97Å; R474-W641 VanDerWaalsContact NH1-O 3.12Å; L610-W641 HydrophobicContact CD2-CH2 4.45Å; L610-W641 HydrophobicContact CD2-CZ3 4.14Å; E613-W641 HydrophobicContact CB-CH2 4Å; E613-W641 HydrophobicContact CB-CZ2 4.33Å; E613-W641 HydrophobicContact CG-CH2 3.74Å; E613-W641 HydrophobicContact CG-CZ2 4.47Å; E613-W641 HydrophobicContact CG-CZ3 3.93Å; L617-W641 HydrophobicContact CB-CZ2 4.17Å; L617-W641 HydrophobicContact CD2-CH2 3.85Å; L617-W641 HydrophobicContact CD2-CZ2 3.64Å; Y637-W641 HydrophobicContact CE1-CE3 4.11Å; Y637-W641 AromaticContact CE1-CZ3 3.91Å; Y637-W641 HydrophobicContact CE1-CZ3 3.91Å; L638-W641 HydrophobicContact CD2-CE3 4.44Å; L638-W641 WeakPolarHBondContact O-CB 3.37Å; L638-W641 PolarHBondContact O-N 3.37Å; Q639-W641 VanDerWaalsContact C-N 3.29Å; W641-K643 VanDerWaalsContact CD1-O 3.23Å; W641-L645 HydrophobicContact CB-CD1 3.82Å; W641-L645 HydrophobicContact CD2-CD1 4.47Å; W641-L645 HydrophobicContact CG-CD1 3.65Å; W641-L645 HydrophobicContact CG-CG 4.25Å
642	K	90.2	Very high	91.3	Very high	185 Å²	185	21 Å²	21	80%	0.804	9%	0.09	S	C	*	.			trans	-106.6	-19.5	-172.8	-59.8	177.6	-175.7	172.5	0	114.2
643	K	92.9	Very high	91.1	Very high	66 Å²	66	21.7 Å²	21.7	29%	0.287	10%	0.095	S	C	.	.	S	Bend	trans	-86	179.3	177.8	-54.6	-174	-169.1	-174.7	0	109.6	E613 P614 W641	E613-K643 HydrophobicContact CB-CD 4.13Å; E613-K643 WeakPolarHBondContact O-CD 3.5Å; E613-K643 WeakPolarHBondContact O-CE 3.38Å; E613-K643 PolarHBondContact O-NZ 3.01Å; E613-K643 WeakPolarHBondContact OE2-CE 3.4Å; E613-K643 IonicContact OE2-NZ 3.05Å; P614-K643 WeakPolarHBondContact O-CD 3.41Å; W641-K643 VanDerWaalsContact CD1-O 3.23Å
644	T	94.4	Very high	91	Very high	5 Å²	5	21.7 Å²	21.7	3%	0.031	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	137.7	-176.7	-31.3	0	0	0	0	110.5	I469 G472 R473 T615 L616 L617	I469-T644 HydrophobicContact CG2-CG2 3.6Å; G472-T644 PolarHBondContact N-OG1 3.16Å; G472-T644 VanDerWaalsContact N-OG1 3.1Å; R473-T644 WeakPolarHBondContact O-CA 3.49Å; R473-T644 WeakPolarHBondContact O-CG2 3.39Å; T615-T644 WeakPolarHBondContact O-CA 3.36Å; T615-T644 WeakPolarHBondContact O-CB 3.31Å; T615-T644 PolarHBondContact O-N 2.96Å; T615-T644 PolarHBondContact O-OG1 3.37Å; L616-T644 HydrophobicContact CD1-CG2 3.96Å; L617-T644 PolarHBondContact N-O 3.39Å
645	L	95.2	Very high	91	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	137.9	174.7	-83.3	158.7	0	0	0	109.9	R473 R474 Y475 L617 L619 L638 W641 I647	R473-L645 PolarHBondContact O-N 3.15Å; R474-L645 HydrophobicContact CB-CB 4.13Å; R474-L645 HydrophobicContact CB-CD1 4.46Å; R474-L645 HydrophobicContact CG-CB 4.1Å; R474-L645 HydrophobicContact CG-CD1 3.89Å; Y475-L645 PolarHBondContact N-O 2.91Å; L617-L645 HydrophobicContact CB-CD2 3.86Å; L617-L645 HydrophobicContact CD2-CD2 3.96Å; L617-L645 HydrophobicContact CG-CD2 3.97Å; L619-L645 HydrophobicContact CD1-CD2 4.38Å; L638-L645 HydrophobicContact CD2-CD1 4.05Å; L638-L645 HydrophobicContact CD2-CD2 4.18Å; W641-L645 HydrophobicContact CB-CD1 3.82Å; W641-L645 HydrophobicContact CD2-CD1 4.47Å; W641-L645 HydrophobicContact CG-CD1 3.65Å; W641-L645 HydrophobicContact CG-CG 4.25Å; L645-I647 HydrophobicContact CB-CD1 4.44Å; L645-I647 HydrophobicContact CB-CG1 4.36Å; L645-I647 HydrophobicContact CD1-CD1 4.46Å; L645-I647 HydrophobicContact CD2-CD1 4.32Å; L645-I647 HydrophobicContact CD2-CG1 4.26Å
646	L	94.9	Very high	91	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.005	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	107.7	162	179.9	60.5	0	0	0	108.2	I469 Y475 L477 L489 I492 L616 L617 L618 L619 I663	I469-L646 HydrophobicContact CD1-CD2 4.1Å; Y475-L646 WeakPolarHBondContact O-CA 3.42Å; L477-L646 HydrophobicContact CB-CD1 4.02Å; L489-L646 HydrophobicContact CD2-CD2 3.64Å; L489-L646 HydrophobicContact CD2-CG 3.96Å; I492-L646 HydrophobicContact CD1-CD2 4.06Å; L616-L646 HydrophobicContact CD1-CB 4.3Å; L617-L646 PolarHBondContact O-N 3.47Å; L618-L646 WeakPolarHBondContact CA-O 3.34Å; L618-L646 HydrophobicContact CD2-CB 3.75Å; L618-L646 HydrophobicContact CD2-CD2 4.05Å; L618-L646 HydrophobicContact CD2-CG 4.36Å; L619-L646 PolarHBondContact N-O 2.82Å; L646-I663 HydrophobicContact CD1-CD1 3.81Å
647	I	94.3	Very high	90.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	122.5	-174.5	-63.8	174	0	0	0	107.8	Y475 G476 L477 L619 P622 L638 L645 F654 V658	Y475-I647 PolarHBondContact O-N 2.33Å; G476-I647 CarbonylContact C-O 2.94Å; G476-I647 WeakPolarHBondContact CA-O 3.23Å; L477-I647 PolarHBondContact N-O 3.02Å; L619-I647 HydrophobicContact CB-CG1 4.44Å; L619-I647 HydrophobicContact CD1-CG1 4.3Å; P622-I647 HydrophobicContact CG-CG2 4.41Å; L638-I647 HydrophobicContact CD1-CD1 4.25Å; L645-I647 HydrophobicContact CB-CD1 4.44Å; L645-I647 HydrophobicContact CB-CG1 4.36Å; L645-I647 HydrophobicContact CD1-CD1 4.46Å; L645-I647 HydrophobicContact CD2-CD1 4.32Å; L645-I647 HydrophobicContact CD2-CG1 4.26Å; I647-F654 HydrophobicContact CD1-CE1 4.36Å; I647-F654 HydrophobicContact CG2-CD1 4.46Å; I647-F654 HydrophobicContact CG2-CE1 3.84Å; I647-V658 HydrophobicContact CD1-CG1 3.76Å
648	V	92.8	Very high	90.9	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	130.7	158.4	174.9	0	0	0	0	107.4	L477 K485 L489 L619 D620 E621 P622	L477-V648 HydrophobicContact CB-CG2 3.85Å; L477-V648 HydrophobicContact CD2-CG2 3.72Å; L477-V648 HydrophobicContact CG-CG2 3.91Å; K485-V648 HydrophobicContact CB-CG1 4.01Å; K485-V648 HydrophobicContact CB-CG2 4.08Å; K485-V648 HydrophobicContact CD-CG1 3.86Å; L489-V648 HydrophobicContact CD1-CB 4.43Å; L489-V648 HydrophobicContact CD1-CG2 3.72Å; L489-V648 HydrophobicContact CG-CG2 4.16Å; L619-V648 PolarHBondContact O-N 3Å; D620-V648 WeakPolarHBondContact OD1-CB 3.39Å; D620-V648 WeakPolarHBondContact OD1-CG1 3.5Å; D620-V648 WeakPolarHBondContact OD1-CG2 3.29Å; E621-V648 VanDerWaalsContact CA-O 3.23Å; E621-V648 WeakPolarHBondContact CA-O 3.47Å; E621-V648 HydrophobicContact CG-CG1 3.76Å; E621-V648 PolarHBondContact N-O 3.08Å; P622-V648 WeakPolarHBondContact CD-O 3.26Å
649	S	89.2	Confident	91	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	11%	0.112	C	C	.	.			trans	-156	160.5	170.5	-173.9	0	0	0	0	111.1	D651	S649-D651 PolarHBondContact OG-N 2.83Å; S649-D651 VanDerWaalsContact OG-N 3.09Å
650	H	85	Confident	91	Very high	12 Å²	12	26.1 Å²	26.1	6%	0.056	12%	0.123	C	C	.	.	S	Bend	trans	-108	-9.3	168.2	-76.6	-55	0	0	0	113.7	G479 N481 K485 E621 Q652 L918 I920	G479-H650 PolarHBondContact O-CE1 2.9Å; N481-H650 PolarHBondContact OD1-NE2 3.13Å; K485-H650 PolarHBondContact NZ-NE2 3.32Å; E621-H650 IonicContact OE1-CD2 2.83Å; E621-H650 PolarHBondContact OE1-CD2 3.18Å; E621-H650 IonicContact OE1-NE2 3.69Å; H650-Q652 PolarHBondContact O-N 2.71Å; H650-L918 PolarHBondContact CD2-O 3.04Å; H650-L918 VanDerWaalsContact CD2-O 3.27Å; H650-I920 HydrophobicContact CB-CG1 4.33Å; H650-I920 WeakPolarHBondContact O-CG1 3.45Å
651	D	87	Confident	91.3	Very high	9 Å²	9	22.7 Å²	22.7	5%	0.048	11%	0.111	C	C	.	.			trans	-72	116.4	171.5	-179.9	-21.2	0	0	0	109.8	T623 S649 S653 F654 L655	T623-D651 HydrophobicContact CG2-CB 4.43Å; S649-D651 PolarHBondContact OG-N 2.83Å; S649-D651 VanDerWaalsContact OG-N 3.09Å; D651-S653 WeakPolarHBondContact OD1-CA 3.24Å; D651-S653 WeakPolarHBondContact OD1-CB 3.39Å; D651-S653 PolarHBondContact OD1-N 3.33Å; D651-F654 HydrophobicContact CB-CB 3.83Å; D651-F654 VanDerWaalsContact CG-CB 3.41Å; D651-F654 PolarHBondContact OD1-N 3.17Å; D651-F654 WeakPolarHBondContact OD2-CB 3.21Å; D651-L655 WeakPolarHBondContact O-CB 3.35Å; D651-L655 WeakPolarHBondContact O-CD1 3.29Å; D651-L655 WeakPolarHBondContact O-CG 3.38Å; D651-L655 PolarHBondContact O-N 3.45Å
652	Q	86.7	Confident	91.5	Very high	7 Å²	7	21.9 Å²	21.9	3%	0.033	11%	0.108	C	C	.	.	H	α-helix	trans	-73.3	-34.5	-179.1	-68	170.1	86	0	0	112.2	H650 D656 Y677 I920 D924 R945	H650-Q652 PolarHBondContact O-N 2.71Å; Q652-D656 WeakPolarHBondContact O-CB 3.05Å; Q652-D656 PolarHBondContact O-N 2.64Å; Q652-Y677 HydrophobicContact CB-CD1 4.1Å; Q652-Y677 HydrophobicContact CB-CE1 4.32Å; Q652-Y677 HydrophobicContact CG-CD1 3.94Å; Q652-Y677 HydrophobicContact CG-CE1 3.68Å; Q652-I920 VanDerWaalsContact CD-CG2 3.45Å; Q652-I920 HydrophobicContact CG-CD1 4.14Å; Q652-I920 HydrophobicContact CG-CG1 4Å; Q652-I920 HydrophobicContact CG-CG2 3.97Å; Q652-D924 PolarHBondContact NE2-OD1 2.96Å; Q652-R945 VanDerWaalsContact CD-NH1 3.32Å
653	S	86.7	Confident	91.7	Very high	18 Å²	18	13.2 Å²	13.2	13%	0.126	7%	0.071	C	C	.	.	H	α-helix	trans	-69.9	-46	-179.8	-55.3	0	0	0	0	110.7	D651 D656 N657	D651-S653 WeakPolarHBondContact OD1-CA 3.24Å; D651-S653 WeakPolarHBondContact OD1-CB 3.39Å; D651-S653 PolarHBondContact OD1-N 3.33Å; S653-D656 PolarHBondContact O-N 3.5Å; S653-N657 WeakPolarHBondContact O-CB 3.44Å; S653-N657 VanDerWaalsContact O-CG 3.25Å; S653-N657 PolarHBondContact O-N 2.7Å; S653-N657 PolarHBondContact O-ND2 2.99Å
654	F	89.5	Confident	91.7	Very high	3 Å²	3	11 Å²	11	1%	0.013	6%	0.061	C	C	.	.	H	α-helix	trans	-61.5	-44.2	174.5	-175.9	-110.1	0	0	0	111.9	P622 T623 L634 D635 L638 I647 D651 D656 N657 V658	P622-F654 HydrophobicContact CG-CE1 4.03Å; P622-F654 HydrophobicContact CG-CZ 4.25Å; T623-F654 HydrophobicContact CG2-CB 4.43Å; T623-F654 HydrophobicContact CG2-CD1 3.97Å; T623-F654 HydrophobicContact CG2-CD2 4.22Å; T623-F654 HydrophobicContact CG2-CE1 4.16Å; T623-F654 HydrophobicContact CG2-CE2 4.42Å; T623-F654 HydrophobicContact CG2-CG 3.99Å; T623-F654 HydrophobicContact CG2-CZ 4.37Å; L634-F654 HydrophobicContact CD2-CE2 4.12Å; L634-F654 HydrophobicContact CD2-CZ 4Å; L634-F654 HydrophobicContact CG-CE2 4.12Å; L634-F654 HydrophobicContact CG-CZ 4.28Å; D635-F654 HydrophobicContact CB-CD2 4.12Å; D635-F654 HydrophobicContact CB-CE2 4.4Å; L638-F654 HydrophobicContact CD1-CE2 4.06Å; L638-F654 HydrophobicContact CD1-CZ 3.6Å; I647-F654 HydrophobicContact CD1-CE1 4.36Å; I647-F654 HydrophobicContact CG2-CD1 4.46Å; I647-F654 HydrophobicContact CG2-CE1 3.84Å; D651-F654 HydrophobicContact CB-CB 3.83Å; D651-F654 VanDerWaalsContact CG-CB 3.41Å; D651-F654 PolarHBondContact OD1-N 3.17Å; D651-F654 WeakPolarHBondContact OD2-CB 3.21Å; F654-D656 VanDerWaalsContact C-N 3.34Å; F654-D656 PolarHBondContact O-N 3.28Å; F654-N657 PolarHBondContact O-N 3.49Å; F654-V658 HydrophobicContact CD2-CG2 4.18Å; F654-V658 HydrophobicContact CE2-CG2 4.13Å; F654-V658 WeakPolarHBondContact O-CB 3.45Å; F654-V658 WeakPolarHBondContact O-CG2 3.45Å; F654-V658 PolarHBondContact O-N 3.43Å
655	L	91.9	Very high	91.6	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-63.5	-38.2	173.9	-72.4	170.3	0	0	0	112.4	V478 D651 C659 Y677	V478-L655 HydrophobicContact CG1-CD1 3.51Å; V478-L655 HydrophobicContact CG1-CD2 4.49Å; D651-L655 WeakPolarHBondContact O-CB 3.35Å; D651-L655 WeakPolarHBondContact O-CD1 3.29Å; D651-L655 WeakPolarHBondContact O-CG 3.38Å; D651-L655 PolarHBondContact O-N 3.45Å; L655-C659 VanDerWaalsContact O-CB 3.23Å; L655-C659 WeakPolarHBondContact O-CB 3.41Å; L655-C659 PolarHBondContact O-N 3.19Å; L655-Y677 HydrophobicContact CD1-CD2 4.1Å
656	D	91.5	Very high	91.1	Very high	25 Å²	25	12.8 Å²	12.8	13%	0.134	7%	0.071	C	C	.	.	H	α-helix	trans	-71.1	-35	179.5	-95.6	-37.7	0	0	0	113.9	Q652 S653 F654 N676 Y677 N678	Q652-D656 WeakPolarHBondContact O-CB 3.05Å; Q652-D656 PolarHBondContact O-N 2.64Å; S653-D656 PolarHBondContact O-N 3.5Å; F654-D656 VanDerWaalsContact C-N 3.34Å; F654-D656 PolarHBondContact O-N 3.28Å; D656-N676 WeakPolarHBondContact OD1-CB 3.14Å; D656-N676 PolarHBondContact OD1-ND2 3.14Å; D656-Y677 WeakPolarHBondContact OD1-CA 3.15Å; D656-Y677 PolarHBondContact OD1-N 3.33Å; D656-N678 PolarHBondContact OD1-N 3.16Å; D656-N678 PolarHBondContact OD2-N 3.1Å; D656-N678 PolarHBondContact OD2-ND2 2.8Å
657	N	90.2	Very high	90.6	Very high	59 Å²	59	18.1 Å²	18.1	32%	0.316	10%	0.096	S	C	.	.	H	α-helix	trans	-79.5	-40.6	179.7	-67.8	-17.9	0	0	0	112.1	D635 S653 F654 R973	D635-N657 WeakPolarHBondContact OD1-CB 3.24Å; D635-N657 PolarHBondContact OD2-ND2 3.05Å; S653-N657 WeakPolarHBondContact O-CB 3.44Å; S653-N657 VanDerWaalsContact O-CG 3.25Å; S653-N657 PolarHBondContact O-N 2.7Å; S653-N657 PolarHBondContact O-ND2 2.99Å; F654-N657 PolarHBondContact O-N 3.49Å; N657-R973 PolarHBondContact ND2-NH1 3.22Å
658	V	91.9	Very high	90.2	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-89.6	-43.4	-173.8	-178.1	0	0	0	0	113	R474 D635 L638 I647 F654	R474-V658 PolarHBondContact NE-O 3.32Å; R474-V658 PolarHBondContact NH2-O 2.69Å; D635-V658 WeakPolarHBondContact OD1-CG2 3.46Å; L638-V658 HydrophobicContact CB-CG1 3.91Å; L638-V658 HydrophobicContact CB-CG2 4.06Å; I647-V658 HydrophobicContact CD1-CG1 3.76Å; F654-V658 HydrophobicContact CD2-CG2 4.18Å; F654-V658 HydrophobicContact CE2-CG2 4.13Å; F654-V658 WeakPolarHBondContact O-CB 3.45Å; F654-V658 WeakPolarHBondContact O-CG2 3.45Å; F654-V658 PolarHBondContact O-N 3.43Å
659	C	93.9	Very high	90.1	Very high	10 Å²	10	26.2 Å²	26.2	7%	0.068	13%	0.129	C	C	.	.			trans	-82.9	139.9	-163.5	-59.8	0	0	0	0	114.5	R474 G476 L655 I662	R474-C659 CarbonylContact O-C 3.55Å; R474-C659 WeakPolarHBondContact O-CA 3.26Å; G476-C659 VanDerWaalsContact CA-SG 3.59Å; L655-C659 VanDerWaalsContact O-CB 3.23Å; L655-C659 WeakPolarHBondContact O-CB 3.41Å; L655-C659 PolarHBondContact O-N 3.19Å; C659-I662 HydrophobicContact CB-CD1 3.97Å
660	T	92.9	Very high	90.2	Very high	47 Å²	47	26.7 Å²	26.7	29%	0.288	13%	0.132	S	C	.	.	S	Bend	trans	-92.8	-26.2	173	63.9	0	0	0	0	112.9	R474 G675	R474-T660 HydrophobicContact CB-CG2 4.35Å; R474-T660 PolarHBondContact N-OG1 3.07Å; R474-T660 VanDerWaalsContact N-OG1 3.13Å; R474-T660 PolarHBondContact O-N 3.16Å; R474-T660 PolarHBondContact O-OG1 3.4Å; T660-G675 CarbonylContact C-O 3.59Å; T660-G675 CarbonylContact O-C 3.54Å; T660-G675 WeakPolarHBondContact O-CA 3.46Å; T660-G675 PolarHBondContact O-N 3.05Å
661	D	94.8	Very high	90.6	Very high	13 Å²	13	27.9 Å²	27.9	7%	0.07	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	147.2	-176	-63.1	-97.5	0	0	0	109	R473 R474 Y475 G476 Y673 R674	R473-D661 WeakPolarHBondContact CD-OD2 3.48Å; R473-D661 IonicContact CZ-OD2 3.52Å; R473-D661 IonicContact NH1-OD1 2.68Å; R473-D661 PolarHBondContact NH1-OD1 3.35Å; R473-D661 IonicContact NH1-OD2 2.69Å; R473-D661 PolarHBondContact NH1-OD2 2.92Å; R474-D661 PolarHBondContact O-N 2.87Å; Y475-D661 WeakPolarHBondContact CA-O 3.45Å; Y475-D661 HydrophobicContact CD1-CB 3.74Å; Y475-D661 HydrophobicContact CE1-CB 3.78Å; G476-D661 PolarHBondContact N-O 2.91Å; D661-Y673 CarbonylContact C-O 3.59Å; D661-Y673 WeakPolarHBondContact CA-O 3.08Å; D661-R674 WeakPolarHBondContact OD1-CA 3.26Å; D661-R674 WeakPolarHBondContact OD1-CG 3.28Å
662	I	95.5	Very high	90.9	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	131	-180	-61.1	-63.6	0	0	0	109.6	G476 V478 C659 Y673 F680	G476-I662 CarbonylContact O-C 3.5Å; G476-I662 WeakPolarHBondContact O-CA 3.39Å; V478-I662 HydrophobicContact CG2-CG2 3.48Å; V478-I662 VanDerWaalsContact CG2-CG2 3.48Å; C659-I662 HydrophobicContact CB-CD1 3.97Å; I662-Y673 PolarHBondContact N-O 2.92Å; I662-Y673 PolarHBondContact O-N 2.91Å; I662-F680 HydrophobicContact CB-CB 4.06Å; I662-F680 HydrophobicContact CB-CG 4.24Å; I662-F680 HydrophobicContact CG1-CB 4.04Å; I662-F680 HydrophobicContact CG2-CB 4.1Å; I662-F680 HydrophobicContact CG2-CD1 3.95Å; I662-F680 HydrophobicContact CG2-CD2 4.11Å; I662-F680 HydrophobicContact CG2-CE1 4.46Å; I662-F680 HydrophobicContact CG2-CG 3.75Å
663	I	95.1	Very high	91.2	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.01	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	110.4	172.6	-43.3	-178.5	0	0	0	107.7	Y475 G476 L477 V478 L646 L670 Y672	Y475-I663 HydrophobicContact CD1-CD1 3.79Å; Y475-I663 HydrophobicContact CD1-CG1 3.75Å; Y475-I663 HydrophobicContact CG-CD1 4.07Å; Y475-I663 HydrophobicContact CG-CG1 4.37Å; G476-I663 PolarHBondContact O-N 2.85Å; L477-I663 WeakPolarHBondContact CA-O 3.38Å; L477-I663 HydrophobicContact CD1-CB 4.14Å; L477-I663 HydrophobicContact CD1-CG2 4.19Å; V478-I663 PolarHBondContact N-O 3.09Å; L646-I663 HydrophobicContact CD1-CD1 3.81Å; I663-L670 HydrophobicContact CG2-CB 3.89Å; I663-L670 HydrophobicContact CG2-CD1 4.45Å; I663-L670 HydrophobicContact CG2-CD2 3.78Å; I663-L670 HydrophobicContact CG2-CG 4.25Å; I663-Y672 HydrophobicContact CB-CE1 4.37Å; I663-Y672 HydrophobicContact CD1-CD1 4.4Å; I663-Y672 HydrophobicContact CD1-CE1 3.55Å; I663-Y672 HydrophobicContact CG1-CD1 3.96Å; I663-Y672 HydrophobicContact CG1-CE1 3.58Å; I663-Y672 HydrophobicContact CG2-CD1 4.43Å; I663-Y672 HydrophobicContact CG2-CE1 3.99Å; I663-Y672 HydrophobicContact CG2-CE2 4.42Å
664	H	93.1	Very high	91.5	Very high	19 Å²	19	41.2 Å²	41.2	9%	0.088	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	120.8	177.8	-175.3	-135.5	0	0	0	110.9	V478 D666 F671 Y673 F680 F684	V478-H664 HydrophobicContact CG2-CB 4.41Å; V478-H664 WeakPolarHBondContact O-CA 3.42Å; H664-D666 VanDerWaalsContact CE1-CB 3.5Å; H664-D666 WeakPolarHBondContact CE1-CB 3.17Å; H664-D666 PolarHBondContact O-N 3.19Å; H664-F671 HydrophobicContact CB-CB 4.42Å; H664-F671 PolarHBondContact N-O 3.25Å; H664-F671 PolarHBondContact O-N 2.89Å; H664-Y673 HydrophobicContact CB-CD2 4.31Å; H664-Y673 HydrophobicContact CB-CE2 3.84Å; H664-F680 HydrophobicContact CB-CE2 3.66Å; H664-F680 HydrophobicContact CB-CZ 3.88Å; H664-F680 AromaticContact CD2-CZ 3.59Å; H664-F680 AromaticContact CG-CE2 3.74Å; H664-F680 AromaticContact CG-CZ 3.58Å; H664-F684 AromaticContact CE1-CE2 3.48Å; H664-F684 VanDerWaalsContact CE1-CE2 3.48Å; H664-F684 WeakPolarHBondContact CE1-CE2 3.41Å; H664-F684 AromaticContact CE1-CZ 3.79Å
665	L	90.6	Very high	91.5	Very high	0 Å²	0	42 Å²	42	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	98.7	173.7	178.7	59.2	0	0	0	110	F462 L477 V478 K485 L670	F462-L665 HydrophobicContact CD1-CD1 4.16Å; F462-L665 HydrophobicContact CE1-CD1 3.44Å; F462-L665 VanDerWaalsContact CE1-CD1 3.44Å; F462-L665 HydrophobicContact CZ-CD1 3.79Å; F462-L665 HydrophobicContact CZ-CD2 4.11Å; L477-L665 HydrophobicContact CD1-CB 4.31Å; V478-L665 PolarHBondContact O-N 2.89Å; K485-L665 HydrophobicContact CG-CD2 4.18Å; L665-L670 HydrophobicContact CB-CD2 4.39Å; L665-L670 HydrophobicContact CD1-CD2 4.01Å
666	D	86.2	Confident	91.4	Very high	43 Å²	43	44.2 Å²	44.2	23%	0.23	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	150.1	179	176.3	34.4	0	0	0	110.5	H664 R668 Q669 F671	H664-D666 VanDerWaalsContact CE1-CB 3.5Å; H664-D666 WeakPolarHBondContact CE1-CB 3.17Å; H664-D666 PolarHBondContact O-N 3.19Å; D666-R668 PolarHBondContact O-N 3.39Å; D666-Q669 PolarHBondContact N-O 3.41Å; D666-Q669 VanDerWaalsContact N-O 3.13Å; D666-Q669 PolarHBondContact O-N 2.88Å; D666-F671 HydrophobicContact CB-CD2 4.17Å; D666-F671 HydrophobicContact CB-CE2 4.16Å
667	Q	83.9	Confident	91.4	Very high	114 Å²	114	43.9 Å²	43.9	53%	0.533	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	28.4	178.2	-70.9	162.2	75.6	0	0	114.3	Q669	Q667-Q669 VanDerWaalsContact C-N 3.28Å
668	R	86.4	Confident	91.4	Very high	94 Å²	94	45.7 Å²	45.7	36%	0.355	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.2	25.1	-174.8	-54	164.8	166.8	-171.7	-18.5	114.2	D460 L461 F462 V463 D666	D460-R668 VanDerWaalsContact O-CZ 3.32Å; D460-R668 PolarHBondContact O-NE 2.84Å; D460-R668 PolarHBondContact O-NH2 3.13Å; D460-R668 IonicContact OD2-CZ 3.84Å; D460-R668 IonicContact OD2-NH1 3.48Å; D460-R668 PolarHBondContact OD2-NH1 3.38Å; D460-R668 IonicContact OD2-NH2 3.83Å; D460-R668 PolarHBondContact OD2-NH2 3.34Å; L461-R668 WeakPolarHBondContact O-CA 3.35Å; L461-R668 VanDerWaalsContact O-CB 3.28Å; L461-R668 WeakPolarHBondContact O-CB 2.48Å; L461-R668 WeakPolarHBondContact O-CG 2.56Å; F462-R668 WeakPolarHBondContact CA-O 3.47Å; V463-R668 HydrophobicContact CB-CB 4.35Å; V463-R668 HydrophobicContact CG2-CB 4.26Å; V463-R668 PolarHBondContact N-O 2.96Å; D666-R668 PolarHBondContact O-N 3.39Å
669	Q	89.9	Confident	91.3	Very high	75 Å²	75	50.1 Å²	50.1	35%	0.35	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	162.2	179.1	-62.3	-165.9	-33	0	0	110.9	V463 D666 Q667 F671	V463-Q669 PolarHBondContact O-NE2 3.37Å; V463-Q669 VanDerWaalsContact O-NE2 3.15Å; D666-Q669 PolarHBondContact N-O 3.41Å; D666-Q669 VanDerWaalsContact N-O 3.13Å; D666-Q669 PolarHBondContact O-N 2.88Å; Q667-Q669 VanDerWaalsContact C-N 3.28Å; Q669-F671 HydrophobicContact CB-CE2 4.35Å; Q669-F671 HydrophobicContact CB-CZ 4.34Å
670	L	92.7	Very high	91.2	Very high	10 Å²	10	50 Å²	50	5%	0.052	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	122.1	176.3	-64.3	177.2	0	0	0	109.5	F452 F462 L467 L477 L488 I663 L665 Y672	F452-L670 HydrophobicContact CE1-CD1 4.27Å; F452-L670 HydrophobicContact CZ-CD1 4.03Å; F462-L670 HydrophobicContact CE1-CD2 3.92Å; F462-L670 HydrophobicContact CE1-CG 4.17Å; L467-L670 HydrophobicContact CD1-CD1 3.94Å; L477-L670 HydrophobicContact CD1-CD2 4.08Å; L488-L670 HydrophobicContact CD2-CD1 3.97Å; L488-L670 HydrophobicContact CD2-CD2 4.22Å; I663-L670 HydrophobicContact CG2-CB 3.89Å; I663-L670 HydrophobicContact CG2-CD1 4.45Å; I663-L670 HydrophobicContact CG2-CD2 3.78Å; I663-L670 HydrophobicContact CG2-CG 4.25Å; L665-L670 HydrophobicContact CB-CD2 4.39Å; L665-L670 HydrophobicContact CD1-CD2 4.01Å; L670-Y672 HydrophobicContact CB-CE2 4.08Å
671	F	92.2	Very high	91.1	Very high	38 Å²	38	50 Å²	50	17%	0.167	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	122.8	175.2	-65	-71.5	0	0	0	110.9	H664 D666 Q669 Y673	H664-F671 HydrophobicContact CB-CB 4.42Å; H664-F671 PolarHBondContact N-O 3.25Å; H664-F671 PolarHBondContact O-N 2.89Å; D666-F671 HydrophobicContact CB-CD2 4.17Å; D666-F671 HydrophobicContact CB-CE2 4.16Å; Q669-F671 HydrophobicContact CB-CE2 4.35Å; Q669-F671 HydrophobicContact CB-CZ 4.34Å; F671-Y673 HydrophobicContact CB-CE2 3.75Å; F671-Y673 WeakPolarHBondContact O-CD2 3.26Å
672	Y	93.5	Very high	90.9	Very high	70 Å²	70	52.5 Å²	52.5	28%	0.275	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	130.7	-177.7	-69.8	-89.5	0	0	0	112	L467 Q468 Y475 I663 L670	L467-Y672 WeakPolarHBondContact CA-OH 2.85Å; Q468-Y672 HydrophobicContact CB-CE1 4.47Å; Q468-Y672 HydrophobicContact CB-CE2 4.4Å; Q468-Y672 PolarHBondContact N-OH 2.87Å; Q468-Y672 WeakPolarHBondContact O-CE1 3.49Å; Q468-Y672 PolarHBondContact O-OH 3.11Å; Y475-Y672 HydrophobicContact CE1-CD1 4.29Å; Y475-Y672 HydrophobicContact CE1-CE1 4.26Å; I663-Y672 HydrophobicContact CB-CE1 4.37Å; I663-Y672 HydrophobicContact CD1-CD1 4.4Å; I663-Y672 HydrophobicContact CD1-CE1 3.55Å; I663-Y672 HydrophobicContact CG1-CD1 3.96Å; I663-Y672 HydrophobicContact CG1-CE1 3.58Å; I663-Y672 HydrophobicContact CG2-CD1 4.43Å; I663-Y672 HydrophobicContact CG2-CE1 3.99Å; I663-Y672 HydrophobicContact CG2-CE2 4.42Å; L670-Y672 HydrophobicContact CB-CE2 4.08Å
673	Y	93.5	Very high	90.6	Very high	30 Å²	30	57.5 Å²	57.5	12%	0.118	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	137.4	173.8	-59.8	-95.8	0	0	0	109.2	D661 I662 H664 F671 F680 M683 R687	D661-Y673 CarbonylContact C-O 3.59Å; D661-Y673 WeakPolarHBondContact CA-O 3.08Å; I662-Y673 PolarHBondContact N-O 2.92Å; I662-Y673 PolarHBondContact O-N 2.91Å; H664-Y673 HydrophobicContact CB-CD2 4.31Å; H664-Y673 HydrophobicContact CB-CE2 3.84Å; F671-Y673 HydrophobicContact CB-CE2 3.75Å; F671-Y673 WeakPolarHBondContact O-CD2 3.26Å; Y673-F680 HydrophobicContact CD1-CD2 4.19Å; Y673-F680 AromaticContact CD2-CD2 3.49Å; Y673-F680 HydrophobicContact CD2-CD2 3.49Å; Y673-F680 VanDerWaalsContact CD2-CD2 3.49Å; Y673-F680 AromaticContact CD2-CE2 3.81Å; Y673-F680 HydrophobicContact CD2-CE2 3.81Å; Y673-F680 HydrophobicContact CE1-CD2 4.38Å; Y673-F680 AromaticContact CE2-CD2 3.71Å; Y673-F680 HydrophobicContact CE2-CD2 3.71Å; Y673-F680 AromaticContact CE2-CE2 3.56Å; Y673-F680 HydrophobicContact CE2-CE2 3.56Å; Y673-F680 AromaticContact CG-CD2 3.74Å; Y673-F680 HydrophobicContact CG-CD2 3.74Å; Y673-F680 HydrophobicContact CG-CE2 4.44Å; Y673-M683 HydrophobicContact CD1-CB 4.41Å; Y673-R687 PolarHBondContact OH-NH1 3.01Å
674	R	92	Very high	90.3	Very high	213 Å²	213	59 Å²	59	80%	0.804	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.4	135.7	176.8	-176.7	179.6	-178.4	-163.4	-0.7	110.1	D661	D661-R674 WeakPolarHBondContact OD1-CA 3.26Å; D661-R674 WeakPolarHBondContact OD1-CG 3.28Å
675	G	90.5	Very high	90	Very high	20 Å²	20	61.6 Å²	61.6	21%	0.206	29%	0.293	C	S	.	.	S	Bend	trans	111.1	177.6	-173.9	0	0	0	0	0	112.2	T660	T660-G675 CarbonylContact C-O 3.59Å; T660-G675 CarbonylContact O-C 3.54Å; T660-G675 WeakPolarHBondContact O-CA 3.46Å; T660-G675 PolarHBondContact O-N 3.05Å
676	N	89.6	Confident	90	Very high	46 Å²	46	66.5 Å²	66.5	25%	0.246	32%	0.316	C	S	.	.			trans	-73.9	176.4	179.4	72.6	-16.3	0	0	0	112.8	D656 N678 N679 F680	D656-N676 WeakPolarHBondContact OD1-CB 3.14Å; D656-N676 PolarHBondContact OD1-ND2 3.14Å; N676-N678 PolarHBondContact O-N 2.91Å; N676-N679 PolarHBondContact O-N 3.47Å; N676-N679 WeakPolarHBondContact OD1-CB 3.37Å; N676-N679 PolarHBondContact OD1-N 3.11Å; N676-N679 VanDerWaalsContact OD1-N 3.14Å; N676-N679 PolarHBondContact OD1-ND2 2.99Å; N676-F680 PolarHBondContact O-N 3.42Å
677	Y	90.5	Very high	90.1	Very high	18 Å²	18	68.2 Å²	68.2	7%	0.071	32%	0.32	C	S	.	.	H	α-helix	trans	-59.8	-39.5	-177.5	-174.6	-94.1	0	0	0	113.3	V478 Q652 L655 D656 N679 F680 K681 I920	V478-Y677 HydrophobicContact CG1-CD2 4.2Å; V478-Y677 HydrophobicContact CG1-CE2 4.16Å; V478-Y677 HydrophobicContact CG2-CE2 4.39Å; Q652-Y677 HydrophobicContact CB-CD1 4.1Å; Q652-Y677 HydrophobicContact CB-CE1 4.32Å; Q652-Y677 HydrophobicContact CG-CD1 3.94Å; Q652-Y677 HydrophobicContact CG-CE1 3.68Å; L655-Y677 HydrophobicContact CD1-CD2 4.1Å; D656-Y677 WeakPolarHBondContact OD1-CA 3.15Å; D656-Y677 PolarHBondContact OD1-N 3.33Å; Y677-N679 PolarHBondContact O-N 3.28Å; Y677-F680 AromaticContact CD2-CD1 3.77Å; Y677-F680 HydrophobicContact CD2-CD1 3.77Å; Y677-F680 HydrophobicContact CD2-CE1 4.32Å; Y677-F680 AromaticContact CE2-CD1 3.56Å; Y677-F680 HydrophobicContact CE2-CD1 3.56Å; Y677-F680 AromaticContact CE2-CE1 3.67Å; Y677-F680 HydrophobicContact CE2-CE1 3.67Å; Y677-F680 CarbonylContact O-C 3.52Å; Y677-F680 WeakPolarHBondContact O-CA 3.45Å; Y677-F680 WeakPolarHBondContact O-CB 3.44Å; Y677-F680 PolarHBondContact O-N 2.88Å; Y677-F680 VanDerWaalsContact O-N 3.13Å; Y677-K681 HydrophobicContact CE1-CB 4.19Å; Y677-K681 HydrophobicContact CE1-CD 3.92Å; Y677-K681 HydrophobicContact CE1-CG 4.32Å; Y677-K681 WeakPolarHBondContact O-CB 3.48Å; Y677-K681 PolarHBondContact O-N 3.37Å; Y677-I920 HydrophobicContact CE2-CD1 3.89Å; Y677-I920 WeakPolarHBondContact OH-CG2 3.38Å
678	N	90	Very high	90.2	Very high	97 Å²	97	65.7 Å²	65.7	52%	0.519	31%	0.305	S	S	.	.	H	α-helix	trans	-64	-39.5	176.7	-102.3	-56.6	0	0	0	113.2	D656 N676 F680 K681 S682	D656-N678 PolarHBondContact OD1-N 3.16Å; D656-N678 PolarHBondContact OD2-N 3.1Å; D656-N678 PolarHBondContact OD2-ND2 2.8Å; N676-N678 PolarHBondContact O-N 2.91Å; N678-F680 VanDerWaalsContact C-N 3.33Å; N678-K681 PolarHBondContact O-N 2.94Å; N678-S682 PolarHBondContact O-N 3.39Å; N678-S682 VanDerWaalsContact O-N 3.14Å; N678-S682 PolarHBondContact O-OG 3.32Å
679	N	90.9	Very high	90.2	Very high	94 Å²	94	67.2 Å²	67.2	50%	0.503	31%	0.314	S	S	.	.	H	α-helix	trans	-65.5	-36.9	171.3	-79.4	-56.4	0	0	0	111.6	N676 Y677 S682 M683	N676-N679 PolarHBondContact O-N 3.47Å; N676-N679 WeakPolarHBondContact OD1-CB 3.37Å; N676-N679 PolarHBondContact OD1-N 3.11Å; N676-N679 VanDerWaalsContact OD1-N 3.14Å; N676-N679 PolarHBondContact OD1-ND2 2.99Å; Y677-N679 PolarHBondContact O-N 3.28Å; N679-S682 PolarHBondContact O-OG 2.94Å; N679-S682 VanDerWaalsContact O-OG 3.05Å; N679-M683 WeakPolarHBondContact O-CB 3.47Å; N679-M683 VanDerWaalsContact O-CG 3.23Å; N679-M683 WeakPolarHBondContact O-CG 3.43Å; N679-M683 PolarHBondContact O-N 3.08Å
680	F	92.3	Very high	90.3	Very high	7 Å²	7	68.4 Å²	68.4	3%	0.031	32%	0.32	C	S	.	.	H	α-helix	trans	-64.5	-47.9	170.8	159.7	-103.9	0	0	0	112.6	V478 I662 H664 Y673 N676 Y677 N678 S682 M683 F684	V478-F680 HydrophobicContact CG2-CD1 4.46Å; V478-F680 HydrophobicContact CG2-CE1 3.94Å; V478-F680 HydrophobicContact CG2-CZ 4.23Å; I662-F680 HydrophobicContact CB-CB 4.06Å; I662-F680 HydrophobicContact CB-CG 4.24Å; I662-F680 HydrophobicContact CG1-CB 4.04Å; I662-F680 HydrophobicContact CG2-CB 4.1Å; I662-F680 HydrophobicContact CG2-CD1 3.95Å; I662-F680 HydrophobicContact CG2-CD2 4.11Å; I662-F680 HydrophobicContact CG2-CE1 4.46Å; I662-F680 HydrophobicContact CG2-CG 3.75Å; H664-F680 HydrophobicContact CB-CE2 3.66Å; H664-F680 HydrophobicContact CB-CZ 3.88Å; H664-F680 AromaticContact CD2-CZ 3.59Å; H664-F680 AromaticContact CG-CE2 3.74Å; H664-F680 AromaticContact CG-CZ 3.58Å; Y673-F680 HydrophobicContact CD1-CD2 4.19Å; Y673-F680 AromaticContact CD2-CD2 3.49Å; Y673-F680 HydrophobicContact CD2-CD2 3.49Å; Y673-F680 VanDerWaalsContact CD2-CD2 3.49Å; Y673-F680 AromaticContact CD2-CE2 3.81Å; Y673-F680 HydrophobicContact CD2-CE2 3.81Å; Y673-F680 HydrophobicContact CE1-CD2 4.38Å; Y673-F680 AromaticContact CE2-CD2 3.71Å; Y673-F680 HydrophobicContact CE2-CD2 3.71Å; Y673-F680 AromaticContact CE2-CE2 3.56Å; Y673-F680 HydrophobicContact CE2-CE2 3.56Å; Y673-F680 AromaticContact CG-CD2 3.74Å; Y673-F680 HydrophobicContact CG-CD2 3.74Å; Y673-F680 HydrophobicContact CG-CE2 4.44Å; N676-F680 PolarHBondContact O-N 3.42Å; Y677-F680 AromaticContact CD2-CD1 3.77Å; Y677-F680 HydrophobicContact CD2-CD1 3.77Å; Y677-F680 HydrophobicContact CD2-CE1 4.32Å; Y677-F680 AromaticContact CE2-CD1 3.56Å; Y677-F680 HydrophobicContact CE2-CD1 3.56Å; Y677-F680 AromaticContact CE2-CE1 3.67Å; Y677-F680 HydrophobicContact CE2-CE1 3.67Å; Y677-F680 CarbonylContact O-C 3.52Å; Y677-F680 WeakPolarHBondContact O-CA 3.45Å; Y677-F680 WeakPolarHBondContact O-CB 3.44Å; Y677-F680 PolarHBondContact O-N 2.88Å; Y677-F680 VanDerWaalsContact O-N 3.13Å; N678-F680 VanDerWaalsContact C-N 3.33Å; F680-S682 VanDerWaalsContact C-N 3.35Å; F680-S682 PolarHBondContact O-N 2.85Å; F680-M683 PolarHBondContact O-N 3.26Å; F680-F684 HydrophobicContact CD2-CB 4.36Å; F680-F684 HydrophobicContact CE2-CB 3.89Å; F680-F684 HydrophobicContact CE2-CD2 4.47Å; F680-F684 HydrophobicContact CE2-CG 4.27Å; F680-F684 HydrophobicContact CZ-CB 4.09Å; F680-F684 HydrophobicContact CZ-CG 4.17Å; F680-F684 VanDerWaalsContact O-CB 3.26Å; F680-F684 WeakPolarHBondContact O-CB 3.28Å; F680-F684 PolarHBondContact O-N 3.12Å
681	K	89.2	Confident	89.9	Confident	46 Å²	46	70.8 Å²	70.8	20%	0.2	33%	0.331	C	S	.	.	H	α-helix	trans	-57.7	-45.7	-177.5	-161.9	175.4	-163.2	166.3	0	111	Y677 N678 I685 D924 R945	Y677-K681 HydrophobicContact CE1-CB 4.19Å; Y677-K681 HydrophobicContact CE1-CD 3.92Å; Y677-K681 HydrophobicContact CE1-CG 4.32Å; Y677-K681 WeakPolarHBondContact O-CB 3.48Å; Y677-K681 PolarHBondContact O-N 3.37Å; N678-K681 PolarHBondContact O-N 2.94Å; K681-I685 HydrophobicContact CG-CD1 4.26Å; K681-I685 WeakPolarHBondContact O-CB 3.41Å; K681-I685 WeakPolarHBondContact O-CD1 3.4Å; K681-I685 WeakPolarHBondContact O-CG1 3.36Å; K681-I685 PolarHBondContact O-N 3.21Å; K681-D924 IonicContact NZ-OD1 2.87Å; K681-D924 IonicContact NZ-OD2 3.38Å; K681-D924 PolarHBondContact NZ-OD2 3.41Å; K681-R945 VanDerWaalsContact NZ-NH1 3.1Å
682	S	90.8	Very high	89.7	Confident	67 Å²	67	71.4 Å²	71.4	47%	0.469	34%	0.336	S	S	.	.	H	α-helix	trans	-65.6	-47	176.3	54.7	0	0	0	0	113.2	N678 N679 F680 F684 I685 Q686	N678-S682 PolarHBondContact O-N 3.39Å; N678-S682 VanDerWaalsContact O-N 3.14Å; N678-S682 PolarHBondContact O-OG 3.32Å; N679-S682 PolarHBondContact O-OG 2.94Å; N679-S682 VanDerWaalsContact O-OG 3.05Å; F680-S682 VanDerWaalsContact C-N 3.35Å; F680-S682 PolarHBondContact O-N 2.85Å; S682-F684 VanDerWaalsContact C-N 3.35Å; S682-F684 PolarHBondContact O-N 3.31Å; S682-I685 PolarHBondContact O-N 2.96Å; S682-Q686 PolarHBondContact O-N 2.89Å
683	M	90	Very high	89.6	Confident	104 Å²	104	73.8 Å²	73.8	51%	0.512	35%	0.347	S	S	.	.	H	α-helix	trans	-63.1	-37.4	175.7	-73.8	-68.7	-71	0	0	112.8	Y673 N679 F680 Q686 R687	Y673-M683 HydrophobicContact CD1-CB 4.41Å; N679-M683 WeakPolarHBondContact O-CB 3.47Å; N679-M683 VanDerWaalsContact O-CG 3.23Å; N679-M683 WeakPolarHBondContact O-CG 3.43Å; N679-M683 PolarHBondContact O-N 3.08Å; F680-M683 PolarHBondContact O-N 3.26Å; M683-Q686 PolarHBondContact O-N 3.27Å; M683-R687 WeakPolarHBondContact O-CB 3.19Å; M683-R687 PolarHBondContact O-N 2.57Å
684	F	88.3	Confident	89.3	Confident	33 Å²	33	78 Å²	78	15%	0.145	37%	0.368	C	S	.	.	H	α-helix	trans	-67.5	-45	176.1	178.6	-117.1	0	0	0	111.4	H664 F680 S682 Q686 R687 R688	H664-F684 AromaticContact CE1-CE2 3.48Å; H664-F684 VanDerWaalsContact CE1-CE2 3.48Å; H664-F684 WeakPolarHBondContact CE1-CE2 3.41Å; H664-F684 AromaticContact CE1-CZ 3.79Å; F680-F684 HydrophobicContact CD2-CB 4.36Å; F680-F684 HydrophobicContact CE2-CB 3.89Å; F680-F684 HydrophobicContact CE2-CD2 4.47Å; F680-F684 HydrophobicContact CE2-CG 4.27Å; F680-F684 HydrophobicContact CZ-CB 4.09Å; F680-F684 HydrophobicContact CZ-CG 4.17Å; F680-F684 VanDerWaalsContact O-CB 3.26Å; F680-F684 WeakPolarHBondContact O-CB 3.28Å; F680-F684 PolarHBondContact O-N 3.12Å; S682-F684 VanDerWaalsContact C-N 3.35Å; S682-F684 PolarHBondContact O-N 3.31Å; F684-Q686 VanDerWaalsContact C-N 3.29Å; F684-Q686 PolarHBondContact O-N 3.04Å; F684-R687 PolarHBondContact O-N 3.38Å; F684-R688 WeakPolarHBondContact O-CB 3.31Å; F684-R688 PolarHBondContact O-N 3.15Å
685	I	87.8	Confident	89	Confident	74 Å²	74	70.5 Å²	70.5	38%	0.379	34%	0.34	S	S	.	.	H	α-helix	trans	-59.8	-39.9	174	-71.9	165.6	0	0	0	111	K681 S682 K689	K681-I685 HydrophobicContact CG-CD1 4.26Å; K681-I685 WeakPolarHBondContact O-CB 3.41Å; K681-I685 WeakPolarHBondContact O-CD1 3.4Å; K681-I685 WeakPolarHBondContact O-CG1 3.36Å; K681-I685 PolarHBondContact O-N 3.21Å; S682-I685 PolarHBondContact O-N 2.96Å; I685-K689 HydrophobicContact CG2-CD 3.93Å; I685-K689 VanDerWaalsContact CG2-NZ 3.34Å; I685-K689 WeakPolarHBondContact O-CB 3.43Å; I685-K689 WeakPolarHBondContact O-CD 3.49Å; I685-K689 VanDerWaalsContact O-CG 3.23Å; I685-K689 WeakPolarHBondContact O-CG 3.46Å; I685-K689 PolarHBondContact O-N 3.27Å
686	Q	90.6	Very high	89	Confident	103 Å²	103	73.2 Å²	73.2	48%	0.481	35%	0.348	S	S	.	.	H	α-helix	trans	-62.6	-51.9	172.4	179.3	175.1	-18.5	0	0	111.5	S682 M683 F684 R688 K689 E690	S682-Q686 PolarHBondContact O-N 2.89Å; M683-Q686 PolarHBondContact O-N 3.27Å; F684-Q686 VanDerWaalsContact C-N 3.29Å; F684-Q686 PolarHBondContact O-N 3.04Å; Q686-R688 VanDerWaalsContact C-N 3.32Å; Q686-R688 PolarHBondContact O-N 3.48Å; Q686-K689 CarbonylContact O-C 3.57Å; Q686-K689 WeakPolarHBondContact O-CB 3.33Å; Q686-K689 PolarHBondContact O-N 2.89Å; Q686-K689 VanDerWaalsContact O-N 3.13Å; Q686-E690 HydrophobicContact CG-CG 4.44Å; Q686-E690 WeakPolarHBondContact CG-OE1 3.49Å; Q686-E690 PolarHBondContact NE2-OE1 3.24Å; Q686-E690 WeakPolarHBondContact O-CG 3.13Å; Q686-E690 PolarHBondContact O-N 3.38Å
687	R	87.8	Confident	89	Confident	79 Å²	79	76.4 Å²	76.4	30%	0.298	36%	0.359	S	S	.	.	H	α-helix	trans	-57.9	-41.2	179.8	-171.5	176.3	177.2	-163.5	-6.6	112.1	Y673 M683 F684 E690 Q691	Y673-R687 PolarHBondContact OH-NH1 3.01Å; M683-R687 WeakPolarHBondContact O-CB 3.19Å; M683-R687 PolarHBondContact O-N 2.57Å; F684-R687 PolarHBondContact O-N 3.38Å; R687-E690 PolarHBondContact O-N 2.87Å; R687-Q691 WeakPolarHBondContact O-CB 3.04Å; R687-Q691 VanDerWaalsContact O-CG 3.29Å; R687-Q691 WeakPolarHBondContact O-CG 3.49Å; R687-Q691 PolarHBondContact O-N 3.16Å
688	R	85	Confident	88.7	Confident	62 Å²	62	76.7 Å²	76.7	23%	0.234	36%	0.361	C	S	.	.	H	α-helix	trans	-65.2	-43.3	175.9	-158.8	173.6	-171	172	3.5	111.1	F684 Q686 E690 L692 K751 E921	F684-R688 WeakPolarHBondContact O-CB 3.31Å; F684-R688 PolarHBondContact O-N 3.15Å; Q686-R688 VanDerWaalsContact C-N 3.32Å; Q686-R688 PolarHBondContact O-N 3.48Å; R688-E690 PolarHBondContact O-N 2.73Å; R688-L692 WeakPolarHBondContact O-CB 3.32Å; R688-L692 PolarHBondContact O-N 2.64Å; R688-K751 PolarHBondContact NH2-O 3.09Å; R688-E921 IonicContact NH1-OE1 2.81Å; R688-E921 PolarHBondContact NH1-OE1 2.85Å
689	K	88.2	Confident	88.5	Confident	125 Å²	125	74.9 Å²	74.9	54%	0.543	35%	0.35	S	S	.	.	H	α-helix	trans	-64.8	-34.2	173.9	-75.3	168.4	-179.8	170.7	0	112.9	I685 Q686 K693	I685-K689 HydrophobicContact CG2-CD 3.93Å; I685-K689 VanDerWaalsContact CG2-NZ 3.34Å; I685-K689 WeakPolarHBondContact O-CB 3.43Å; I685-K689 WeakPolarHBondContact O-CD 3.49Å; I685-K689 VanDerWaalsContact O-CG 3.23Å; I685-K689 WeakPolarHBondContact O-CG 3.46Å; I685-K689 PolarHBondContact O-N 3.27Å; Q686-K689 CarbonylContact O-C 3.57Å; Q686-K689 WeakPolarHBondContact O-CB 3.33Å; Q686-K689 PolarHBondContact O-N 2.89Å; Q686-K689 VanDerWaalsContact O-N 3.13Å; K689-K693 WeakPolarHBondContact O-CD 3.35Å; K689-K693 VanDerWaalsContact O-CG 3.22Å; K689-K693 WeakPolarHBondContact O-CG 3.36Å; K689-K693 PolarHBondContact O-N 3.01Å
690	E	90.1	Very high	88.4	Confident	100 Å²	100	75.4 Å²	75.4	47%	0.467	35%	0.347	S	S	.	.	H	α-helix	trans	-72.8	-48.6	175.5	-74.1	175.5	-169.8	0	0	111.6	Q686 R687 R688 L692 K693 E694	Q686-E690 HydrophobicContact CG-CG 4.44Å; Q686-E690 WeakPolarHBondContact CG-OE1 3.49Å; Q686-E690 PolarHBondContact NE2-OE1 3.24Å; Q686-E690 WeakPolarHBondContact O-CG 3.13Å; Q686-E690 PolarHBondContact O-N 3.38Å; R687-E690 PolarHBondContact O-N 2.87Å; R688-E690 PolarHBondContact O-N 2.73Å; E690-L692 VanDerWaalsContact C-N 3.31Å; E690-L692 PolarHBondContact O-N 2.81Å; E690-K693 CarbonylContact O-C 3.49Å; E690-K693 WeakPolarHBondContact O-CB 3.37Å; E690-K693 PolarHBondContact O-N 3.45Å; E690-K693 VanDerWaalsContact O-N 3.11Å; E690-E694 WeakPolarHBondContact O-CG 3.34Å; E690-E694 PolarHBondContact O-N 3.44Å
691	Q	85.5	Confident	88.1	Confident	61 Å²	61	79.5 Å²	79.5	29%	0.285	36%	0.363	S	S	.	.	H	α-helix	trans	-54.9	-44	174.1	-76	171.4	-13.9	0	0	112.3	R687 K693 E694 Y695	R687-Q691 WeakPolarHBondContact O-CB 3.04Å; R687-Q691 VanDerWaalsContact O-CG 3.29Å; R687-Q691 WeakPolarHBondContact O-CG 3.49Å; R687-Q691 PolarHBondContact O-N 3.16Å; Q691-K693 PolarHBondContact O-N 3.3Å; Q691-E694 PolarHBondContact O-N 2.79Å; Q691-Y695 WeakPolarHBondContact O-CB 3.34Å; Q691-Y695 PolarHBondContact O-N 2.78Å
692	L	87.9	Confident	87.8	Confident	51 Å²	51	78.2 Å²	78.2	27%	0.267	36%	0.358	S	S	.	.	H	α-helix	trans	-62.2	-43.5	176.6	-174.4	64.2	0	0	0	111.8	R688 E690 E694 Y695 E696	R688-L692 WeakPolarHBondContact O-CB 3.32Å; R688-L692 PolarHBondContact O-N 2.64Å; E690-L692 VanDerWaalsContact C-N 3.31Å; E690-L692 PolarHBondContact O-N 2.81Å; L692-E694 VanDerWaalsContact C-N 3.31Å; L692-E694 PolarHBondContact O-N 2.67Å; L692-Y695 PolarHBondContact O-N 3.26Å; L692-E696 PolarHBondContact O-N 3.42Å
693	K	90.6	Very high	87.7	Confident	119 Å²	119	79.9 Å²	79.9	52%	0.517	36%	0.357	S	S	.	.	H	α-helix	trans	-65.2	-31.4	174.9	-71.9	167.2	-174	174.1	0	112.7	K689 E690 Q691 K697	K689-K693 WeakPolarHBondContact O-CD 3.35Å; K689-K693 VanDerWaalsContact O-CG 3.22Å; K689-K693 WeakPolarHBondContact O-CG 3.36Å; K689-K693 PolarHBondContact O-N 3.01Å; E690-K693 CarbonylContact O-C 3.49Å; E690-K693 WeakPolarHBondContact O-CB 3.37Å; E690-K693 PolarHBondContact O-N 3.45Å; E690-K693 VanDerWaalsContact O-N 3.11Å; Q691-K693 PolarHBondContact O-N 3.3Å; K693-K697 WeakPolarHBondContact O-CD 3.18Å; K693-K697 WeakPolarHBondContact O-CE 3.38Å; K693-K697 WeakPolarHBondContact O-CG 3.49Å; K693-K697 PolarHBondContact O-N 3.22Å
694	E	87.5	Confident	87.6	Confident	119 Å²	119	80.4 Å²	80.4	56%	0.556	36%	0.358	S	S	*	.	H	α-helix	trans	-75.5	-42.5	174.2	-65.1	-142.1	131.9	0	0	112.2	E690 Q691 L692 K697 Q698 L747	E690-E694 WeakPolarHBondContact O-CG 3.34Å; E690-E694 PolarHBondContact O-N 3.44Å; Q691-E694 PolarHBondContact O-N 2.79Å; L692-E694 VanDerWaalsContact C-N 3.31Å; L692-E694 PolarHBondContact O-N 2.67Å; E694-K697 PolarHBondContact O-N 2.7Å; E694-Q698 PolarHBondContact O-N 3.5Å; E694-L747 HydrophobicContact CB-CD1 3.95Å
695	Y	86.4	Confident	87.5	Confident	56 Å²	56	79.9 Å²	79.9	22%	0.22	36%	0.356	C	S	.	.	H	α-helix	trans	-56.3	-50.2	172.3	175.1	-99.4	0	0	0	111	Q691 L692 K697 Q698 E699 L747 S748 K749	Q691-Y695 WeakPolarHBondContact O-CB 3.34Å; Q691-Y695 PolarHBondContact O-N 2.78Å; L692-Y695 PolarHBondContact O-N 3.26Å; Y695-K697 VanDerWaalsContact C-N 3.33Å; Y695-K697 PolarHBondContact O-N 2.82Å; Y695-Q698 PolarHBondContact O-N 3.27Å; Y695-Q698 VanDerWaalsContact O-N 3.08Å; Y695-E699 HydrophobicContact CE1-CB 4.45Å; Y695-E699 WeakPolarHBondContact O-CB 3.47Å; Y695-E699 PolarHBondContact O-N 3.03Å; Y695-L747 HydrophobicContact CD2-CB 4.02Å; Y695-L747 WeakPolarHBondContact CD2-O 3.45Å; Y695-L747 VanDerWaalsContact CE2-O 3.28Å; Y695-L747 WeakPolarHBondContact CE2-O 3.19Å; Y695-S748 VanDerWaalsContact CD2-C 3.5Å; Y695-S748 VanDerWaalsContact CD2-O 3.24Å; Y695-S748 WeakPolarHBondContact CD2-O 3.37Å; Y695-K749 HydrophobicContact CD1-CB 4.35Å; Y695-K749 HydrophobicContact CD1-CG 4.22Å; Y695-K749 HydrophobicContact CE1-CB 3.79Å; Y695-K749 HydrophobicContact CE1-CG 3.86Å; Y695-K749 HydrophobicContact CE2-CB 4.12Å; Y695-K749 VanDerWaalsContact CE2-N 3.27Å
696	E	89.9	Confident	87.4	Confident	76 Å²	76	80.7 Å²	80.7	36%	0.355	36%	0.357	S	S	.	.	H	α-helix	trans	-56.4	-43.2	174.5	-83.5	-170.3	-136.9	0	0	112.9	L692 Q698 E699 K700	L692-E696 PolarHBondContact O-N 3.42Å; E696-Q698 VanDerWaalsContact C-N 3.31Å; E696-Q698 PolarHBondContact O-N 2.89Å; E696-E699 PolarHBondContact O-N 3.29Å; E696-K700 VanDerWaalsContact O-CB 3.25Å; E696-K700 WeakPolarHBondContact O-CB 3.25Å; E696-K700 WeakPolarHBondContact O-CD 3.19Å; E696-K700 WeakPolarHBondContact O-CG 3.49Å; E696-K700 PolarHBondContact O-N 3.32Å; E696-K700 IonicContact OE2-NZ 2.61Å; E696-K700 PolarHBondContact OE2-NZ 3.27Å
697	K	89.6	Confident	87.2	Confident	113 Å²	113	83.6 Å²	83.6	49%	0.491	37%	0.371	S	S	.	.	H	α-helix	trans	-65.7	-35.4	177.3	-71.6	162	-165.8	165.8	0	111.5	K693 E694 Y695 R701	K693-K697 WeakPolarHBondContact O-CD 3.18Å; K693-K697 WeakPolarHBondContact O-CE 3.38Å; K693-K697 WeakPolarHBondContact O-CG 3.49Å; K693-K697 PolarHBondContact O-N 3.22Å; E694-K697 PolarHBondContact O-N 2.7Å; Y695-K697 VanDerWaalsContact C-N 3.33Å; Y695-K697 PolarHBondContact O-N 2.82Å; K697-R701 VanDerWaalsContact O-CG 3.29Å; K697-R701 WeakPolarHBondContact O-CG 3.45Å; K697-R701 PolarHBondContact O-N 3.26Å
698	Q	83.7	Confident	87	Confident	25 Å²	25	83.5 Å²	83.5	12%	0.117	38%	0.383	C	S	.	.	H	α-helix	trans	-70.7	-42.1	175.1	-163.3	178.5	29.9	0	0	111.1	E694 Y695 E696 R701 L702 N719 L747	E694-Q698 PolarHBondContact O-N 3.5Å; Y695-Q698 PolarHBondContact O-N 3.27Å; Y695-Q698 VanDerWaalsContact O-N 3.08Å; E696-Q698 VanDerWaalsContact C-N 3.31Å; E696-Q698 PolarHBondContact O-N 2.89Å; Q698-R701 PolarHBondContact O-N 3.36Å; Q698-L702 HydrophobicContact CG-CD1 4.2Å; Q698-L702 WeakPolarHBondContact O-CB 3.32Å; Q698-L702 VanDerWaalsContact O-CG 3.26Å; Q698-L702 WeakPolarHBondContact O-CG 3.18Å; Q698-L702 PolarHBondContact O-N 3.24Å; Q698-N719 VanDerWaalsContact CG-ND2 3.34Å; Q698-N719 WeakPolarHBondContact CG-ND2 3.33Å; Q698-L747 VanDerWaalsContact OE1-CB 3.32Å
699	E	86.6	Confident	86.8	Confident	59 Å²	59	83.9 Å²	83.9	28%	0.276	41%	0.406	S	S	.	.	H	α-helix	trans	-71.2	-40.7	-177.7	-159	-122.3	-172.4	0	0	112.1	Y695 E696 L702 K703	Y695-E699 HydrophobicContact CE1-CB 4.45Å; Y695-E699 WeakPolarHBondContact O-CB 3.47Å; Y695-E699 PolarHBondContact O-N 3.03Å; E696-E699 PolarHBondContact O-N 3.29Å; E699-L702 CarbonylContact O-C 3.59Å; E699-L702 PolarHBondContact O-N 2.91Å; E699-K703 WeakPolarHBondContact O-CG 3.25Å; E699-K703 PolarHBondContact O-N 3.39Å; E699-K703 WeakPolarHBondContact OE1-CE 3.38Å; E699-K703 IonicContact OE1-NZ 2.7Å; E699-K703 PolarHBondContact OE1-NZ 3.22Å; E699-K703 WeakPolarHBondContact OE2-CE 3.19Å; E699-K703 IonicContact OE2-NZ 2.66Å; E699-K703 PolarHBondContact OE2-NZ 2.86Å
700	K	89.2	Confident	86.3	Confident	104 Å²	104	80.4 Å²	80.4	45%	0.452	39%	0.392	S	S	.	.	H	α-helix	trans	-59.5	-47	171.2	-73.7	163	179.2	167.8	0	111.4	E696 L702 K703 E704	E696-K700 VanDerWaalsContact O-CB 3.25Å; E696-K700 WeakPolarHBondContact O-CB 3.25Å; E696-K700 WeakPolarHBondContact O-CD 3.19Å; E696-K700 WeakPolarHBondContact O-CG 3.49Å; E696-K700 PolarHBondContact O-N 3.32Å; E696-K700 IonicContact OE2-NZ 2.61Å; E696-K700 PolarHBondContact OE2-NZ 3.27Å; K700-L702 VanDerWaalsContact C-N 3.34Å; K700-L702 PolarHBondContact O-N 2.83Å; K700-K703 WeakPolarHBondContact O-CB 3.26Å; K700-K703 PolarHBondContact O-N 3.41Å; K700-K703 VanDerWaalsContact O-N 3.13Å; K700-E704 WeakPolarHBondContact O-CG 3.47Å; K700-E704 PolarHBondContact O-N 2.78Å
701	R	85.2	Confident	85.8	Confident	93 Å²	93	79.2 Å²	79.2	35%	0.351	39%	0.394	S	S	.	.	H	α-helix	trans	-61.7	-37.1	172.5	-73.3	175.9	-171.6	158.9	8.8	113.6	K697 Q698 K703 E704 L705	K697-R701 VanDerWaalsContact O-CG 3.29Å; K697-R701 WeakPolarHBondContact O-CG 3.45Å; K697-R701 PolarHBondContact O-N 3.26Å; Q698-R701 PolarHBondContact O-N 3.36Å; R701-K703 VanDerWaalsContact C-N 3.34Å; R701-E704 PolarHBondContact O-N 2.78Å; R701-L705 WeakPolarHBondContact O-CB 3.2Å; R701-L705 VanDerWaalsContact O-CG 3.29Å; R701-L705 WeakPolarHBondContact O-CG 3.43Å; R701-L705 PolarHBondContact O-N 2.92Å
702	L	83.7	Confident	85.4	Confident	19 Å²	19	80.6 Å²	80.6	10%	0.099	40%	0.404	C	S	.	.	H	α-helix	trans	-68.8	-33.5	175.1	-73.6	164.9	0	0	0	111.7	Q698 E699 K700 K706 A715 Q716 N719 L746	Q698-L702 HydrophobicContact CG-CD1 4.2Å; Q698-L702 WeakPolarHBondContact O-CB 3.32Å; Q698-L702 VanDerWaalsContact O-CG 3.26Å; Q698-L702 WeakPolarHBondContact O-CG 3.18Å; Q698-L702 PolarHBondContact O-N 3.24Å; E699-L702 CarbonylContact O-C 3.59Å; E699-L702 PolarHBondContact O-N 2.91Å; K700-L702 VanDerWaalsContact C-N 3.34Å; K700-L702 PolarHBondContact O-N 2.83Å; L702-K706 WeakPolarHBondContact O-CB 3.36Å; L702-K706 WeakPolarHBondContact O-CD 3.47Å; L702-K706 WeakPolarHBondContact O-CG 3.43Å; L702-K706 PolarHBondContact O-N 3.35Å; L702-K706 VanDerWaalsContact O-N 3.16Å; L702-A715 HydrophobicContact CD2-CB 4.38Å; L702-Q716 HydrophobicContact CD2-CG 4.15Å; L702-N719 HydrophobicContact CD2-CB 4.12Å; L702-L746 HydrophobicContact CD1-CD2 3.62Å
703	K	87.7	Confident	85	Confident	103 Å²	103	86.3 Å²	86.3	45%	0.448	43%	0.427	S	S	.	.	H	α-helix	trans	-67.6	-46.3	171.7	-74.1	167.5	173.5	166.9	0	111.1	E699 K700 R701 L705 K706 Q707	E699-K703 WeakPolarHBondContact O-CG 3.25Å; E699-K703 PolarHBondContact O-N 3.39Å; E699-K703 WeakPolarHBondContact OE1-CE 3.38Å; E699-K703 IonicContact OE1-NZ 2.7Å; E699-K703 PolarHBondContact OE1-NZ 3.22Å; E699-K703 WeakPolarHBondContact OE2-CE 3.19Å; E699-K703 IonicContact OE2-NZ 2.66Å; E699-K703 PolarHBondContact OE2-NZ 2.86Å; K700-K703 WeakPolarHBondContact O-CB 3.26Å; K700-K703 PolarHBondContact O-N 3.41Å; K700-K703 VanDerWaalsContact O-N 3.13Å; R701-K703 VanDerWaalsContact C-N 3.34Å; K703-L705 PolarHBondContact O-N 3.21Å; K703-K706 PolarHBondContact O-N 2.97Å; K703-Q707 WeakPolarHBondContact O-CB 3.4Å; K703-Q707 WeakPolarHBondContact O-CG 3.47Å; K703-Q707 PolarHBondContact O-N 3.48Å
704	E	89.2	Confident	84.3	Confident	115 Å²	115	85.9 Å²	85.9	54%	0.537	43%	0.426	S	S	.	.	H	α-helix	trans	-57	-48.3	174.4	-70.2	158.8	-166.3	0	0	112.2	K700 R701 K706 Q707 S708	K700-E704 WeakPolarHBondContact O-CG 3.47Å; K700-E704 PolarHBondContact O-N 2.78Å; R701-E704 PolarHBondContact O-N 2.78Å; E704-K706 VanDerWaalsContact C-N 3.33Å; E704-K706 PolarHBondContact O-N 3.04Å; E704-Q707 WeakPolarHBondContact O-CB 3.36Å; E704-Q707 PolarHBondContact O-N 2.98Å; E704-S708 PolarHBondContact O-N 3.17Å
705	L	85.6	Confident	83.7	Confident	21 Å²	21	80.2 Å²	80.2	11%	0.11	40%	0.4	C	S	.	.	H	α-helix	trans	-65.3	-33.4	178.9	-72.4	175.6	0	0	0	113.2	R701 K703 S708 M710 A715 K718 N719	R701-L705 WeakPolarHBondContact O-CB 3.2Å; R701-L705 VanDerWaalsContact O-CG 3.29Å; R701-L705 WeakPolarHBondContact O-CG 3.43Å; R701-L705 PolarHBondContact O-N 2.92Å; K703-L705 PolarHBondContact O-N 3.21Å; L705-S708 PolarHBondContact O-OG 3.43Å; L705-M710 HydrophobicContact CD2-SD 4.09Å; L705-M710 VanDerWaalsContact O-CB 3.26Å; L705-M710 WeakPolarHBondContact O-CB 3.29Å; L705-M710 WeakPolarHBondContact O-CG 3.24Å; L705-M710 PolarHBondContact O-N 3.24Å; L705-A715 HydrophobicContact CB-CB 3.78Å; L705-K718 HydrophobicContact CD1-CD 4.41Å; L705-K718 HydrophobicContact CD1-CG 4.48Å; L705-K718 HydrophobicContact CD2-CD 3.82Å; L705-N719 HydrophobicContact CD1-CB 4.27Å
706	K	86.5	Confident	83.2	Confident	92 Å²	92	81.1 Å²	81.1	40%	0.4	41%	0.406	S	S	.	.	H	α-helix	trans	-70.7	-39.3	172.2	-69.5	169.6	-160.9	-157.6	0	111.6	L702 K703 E704 S708 G709 N712 A715	L702-K706 WeakPolarHBondContact O-CB 3.36Å; L702-K706 WeakPolarHBondContact O-CD 3.47Å; L702-K706 WeakPolarHBondContact O-CG 3.43Å; L702-K706 PolarHBondContact O-N 3.35Å; L702-K706 VanDerWaalsContact O-N 3.16Å; K703-K706 PolarHBondContact O-N 2.97Å; E704-K706 VanDerWaalsContact C-N 3.33Å; E704-K706 PolarHBondContact O-N 3.04Å; K706-S708 VanDerWaalsContact C-N 3.28Å; K706-S708 PolarHBondContact O-N 3.13Å; K706-G709 PolarHBondContact O-N 3Å; K706-N712 WeakPolarHBondContact CD-OD1 3.2Å; K706-N712 WeakPolarHBondContact CE-OD1 3.13Å; K706-N712 PolarHBondContact NZ-OD1 3.11Å; K706-A715 HydrophobicContact CG-CB 4.19Å
707	Q	85.7	Confident	82.6	Confident	163 Å²	163	79.8 Å²	79.8	76%	0.762	41%	0.408	S	S	*	.	H	α-helix	trans	-64.5	-31.4	174.5	-74.1	173.1	-2.3	0	0	112.1	K703 E704 G709	K703-Q707 WeakPolarHBondContact O-CB 3.4Å; K703-Q707 WeakPolarHBondContact O-CG 3.47Å; K703-Q707 PolarHBondContact O-N 3.48Å; E704-Q707 WeakPolarHBondContact O-CB 3.36Å; E704-Q707 PolarHBondContact O-N 2.98Å; Q707-G709 PolarHBondContact O-N 3.46Å; Q707-G709 VanDerWaalsContact O-N 3.07Å
708	S	84.3	Confident	82.1	Confident	78 Å²	78	78.4 Å²	78.4	55%	0.545	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	24.8	168.8	71.5	0	0	0	0	114.1	E704 L705 K706 M710	E704-S708 PolarHBondContact O-N 3.17Å; L705-S708 PolarHBondContact O-OG 3.43Å; K706-S708 VanDerWaalsContact C-N 3.28Å; K706-S708 PolarHBondContact O-N 3.13Å; S708-M710 VanDerWaalsContact C-N 3.31Å; S708-M710 PolarHBondContact O-N 3.26Å
709	G	79.1	Confident	81.8	Confident	70 Å²	70	77.4 Å²	77.4	72%	0.722	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.1	4.3	173.9	0	0	0	0	0	116.4	K706 Q707	K706-G709 PolarHBondContact O-N 3Å; Q707-G709 PolarHBondContact O-N 3.46Å; Q707-G709 VanDerWaalsContact O-N 3.07Å
710	M	77.5	Confident	81.2	Confident	52 Å²	52	77.9 Å²	77.9	26%	0.256	40%	0.4	S	S	.	.			trans	-80.9	130.8	-178.8	-50.9	-168.4	78.9	0	0	111.1	L705 S708 Q714 A715 K718	L705-M710 HydrophobicContact CD2-SD 4.09Å; L705-M710 VanDerWaalsContact O-CB 3.26Å; L705-M710 WeakPolarHBondContact O-CB 3.29Å; L705-M710 WeakPolarHBondContact O-CG 3.24Å; L705-M710 PolarHBondContact O-N 3.24Å; S708-M710 VanDerWaalsContact C-N 3.31Å; S708-M710 PolarHBondContact O-N 3.26Å; M710-Q714 HydrophobicContact CB-CB 4.32Å; M710-Q714 HydrophobicContact CE-CB 4.23Å; M710-A715 HydrophobicContact CB-CB 4.42Å; M710-K718 HydrophobicContact CE-CD 3.96Å; M710-K718 HydrophobicContact SD-CD 3.66Å
711	S	80.3	Confident	80.5	Confident	74 Å²	74	81.8 Å²	81.8	52%	0.517	41%	0.412	S	S	.	.			trans	-59.5	150.8	175.9	177.4	0	0	0	0	111.6	K713 Q714 A715	S711-K713 VanDerWaalsContact C-N 3.27Å; S711-K713 PolarHBondContact O-N 2.89Å; S711-K713 VanDerWaalsContact O-N 3.08Å; S711-Q714 WeakPolarHBondContact O-CA 3.46Å; S711-Q714 WeakPolarHBondContact O-CB 3.43Å; S711-Q714 PolarHBondContact O-N 2.91Å; S711-A715 PolarHBondContact O-N 3.01Å
712	N	77.4	Confident	80	Confident	90 Å²	90	80.1 Å²	80.1	48%	0.481	41%	0.41	S	S	.	.	H	α-helix	trans	-43.2	-49.3	-177.9	-80.4	-41.4	0	0	0	113.3	K706 A715 Q716	K706-N712 WeakPolarHBondContact CD-OD1 3.2Å; K706-N712 WeakPolarHBondContact CE-OD1 3.13Å; K706-N712 PolarHBondContact NZ-OD1 3.11Å; N712-A715 PolarHBondContact O-N 2.87Å; N712-Q716 VanDerWaalsContact O-CG 3.27Å; N712-Q716 WeakPolarHBondContact O-CG 3.39Å; N712-Q716 PolarHBondContact O-N 2.88Å
713	K	78.6	Confident	79.4	Confident	171 Å²	171	81.2 Å²	81.2	74%	0.743	42%	0.417	S	S	*	.	H	α-helix	trans	-64.6	-39.6	179.3	-68	-176.5	175	-178.1	0	112.5	S711 A717	S711-K713 VanDerWaalsContact C-N 3.27Å; S711-K713 PolarHBondContact O-N 2.89Å; S711-K713 VanDerWaalsContact O-N 3.08Å; K713-A717 WeakPolarHBondContact O-CB 3.37Å; K713-A717 PolarHBondContact O-N 3.11Å
714	Q	76.5	Confident	78.5	Confident	110 Å²	110	79.6 Å²	79.6	51%	0.514	41%	0.413	S	S	.	.	H	α-helix	trans	-69.9	-41.8	177.8	-66.1	175.7	-19	0	0	111.9	M710 S711 Q716 A717 K718	M710-Q714 HydrophobicContact CB-CB 4.32Å; M710-Q714 HydrophobicContact CE-CB 4.23Å; S711-Q714 WeakPolarHBondContact O-CA 3.46Å; S711-Q714 WeakPolarHBondContact O-CB 3.43Å; S711-Q714 PolarHBondContact O-N 2.91Å; Q714-Q716 VanDerWaalsContact C-N 3.34Å; Q714-Q716 PolarHBondContact O-N 2.83Å; Q714-A717 PolarHBondContact O-N 3.47Å; Q714-K718 VanDerWaalsContact O-CB 3.28Å; Q714-K718 WeakPolarHBondContact O-CB 3.35Å; Q714-K718 PolarHBondContact O-N 3Å
715	A	75.7	Confident	77.8	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	41%	0.413	C	S	.	.	H	α-helix	trans	-61.7	-41.8	175.7	0	0	0	0	0	111.6	L702 L705 K706 M710 S711 N712 N719	L702-A715 HydrophobicContact CD2-CB 4.38Å; L705-A715 HydrophobicContact CB-CB 3.78Å; K706-A715 HydrophobicContact CG-CB 4.19Å; M710-A715 HydrophobicContact CB-CB 4.42Å; S711-A715 PolarHBondContact O-N 3.01Å; N712-A715 PolarHBondContact O-N 2.87Å; A715-N719 WeakPolarHBondContact O-CB 3.34Å; A715-N719 PolarHBondContact O-N 3.27Å
716	Q	76.1	Confident	76.9	Confident	76 Å²	76	83.7 Å²	83.7	36%	0.355	43%	0.432	S	S	.	.	H	α-helix	trans	-63.5	-51.4	173.6	-71.3	173	-33.5	0	0	112	L702 N712 Q714 K718 N719 Q720 L746	L702-Q716 HydrophobicContact CD2-CG 4.15Å; N712-Q716 VanDerWaalsContact O-CG 3.27Å; N712-Q716 WeakPolarHBondContact O-CG 3.39Å; N712-Q716 PolarHBondContact O-N 2.88Å; Q714-Q716 VanDerWaalsContact C-N 3.34Å; Q714-Q716 PolarHBondContact O-N 2.83Å; Q716-K718 VanDerWaalsContact C-N 3.35Å; Q716-K718 PolarHBondContact O-N 3.02Å; Q716-N719 PolarHBondContact O-N 3.42Å; Q716-Q720 WeakPolarHBondContact O-CG 3.46Å; Q716-Q720 PolarHBondContact O-N 2.92Å; Q716-L746 HydrophobicContact CB-CD1 4.5Å; Q716-L746 HydrophobicContact CG-CD1 4.38Å; Q716-L746 HydrophobicContact CG-CD2 4Å
717	A	77.2	Confident	75.7	Confident	48 Å²	48	85.7 Å²	85.7	40%	0.397	44%	0.441	S	S	.	.	H	α-helix	trans	-63.1	-37.2	-179.9	0	0	0	0	0	113.1	K713 Q714 R721	K713-A717 WeakPolarHBondContact O-CB 3.37Å; K713-A717 PolarHBondContact O-N 3.11Å; Q714-A717 PolarHBondContact O-N 3.47Å; A717-R721 WeakPolarHBondContact O-CB 3.44Å; A717-R721 PolarHBondContact O-N 3.29Å
718	K	79	Confident	74.5	Confident	83 Å²	83	84.3 Å²	84.3	36%	0.361	43%	0.434	S	S	.	.	H	α-helix	trans	-66.1	-46.1	173.6	-178.6	175.3	170.4	-172.3	0	111.4	L705 M710 Q714 Q716 Q720 R721 D722	L705-K718 HydrophobicContact CD1-CD 4.41Å; L705-K718 HydrophobicContact CD1-CG 4.48Å; L705-K718 HydrophobicContact CD2-CD 3.82Å; M710-K718 HydrophobicContact CE-CD 3.96Å; M710-K718 HydrophobicContact SD-CD 3.66Å; Q714-K718 VanDerWaalsContact O-CB 3.28Å; Q714-K718 WeakPolarHBondContact O-CB 3.35Å; Q714-K718 PolarHBondContact O-N 3Å; Q716-K718 VanDerWaalsContact C-N 3.35Å; Q716-K718 PolarHBondContact O-N 3.02Å; K718-Q720 VanDerWaalsContact C-N 3.34Å; K718-Q720 PolarHBondContact O-N 3.12Å; K718-R721 CarbonylContact O-C 3.43Å; K718-R721 PolarHBondContact O-N 2.98Å; K718-D722 WeakPolarHBondContact O-CB 3.5Å; K718-D722 VanDerWaalsContact O-CG 3.3Å; K718-D722 PolarHBondContact O-N 2.89Å
719	N	77.3	Confident	73.4	Confident	5 Å²	5	83.8 Å²	83.8	3%	0.027	44%	0.435	C	S	.	.	H	α-helix	trans	-63.8	-38.9	177.9	-163.8	8.1	0	0	0	111.8	Q698 L702 L705 A715 Q716 D722 V723	Q698-N719 VanDerWaalsContact CG-ND2 3.34Å; Q698-N719 WeakPolarHBondContact CG-ND2 3.33Å; L702-N719 HydrophobicContact CD2-CB 4.12Å; L705-N719 HydrophobicContact CD1-CB 4.27Å; A715-N719 WeakPolarHBondContact O-CB 3.34Å; A715-N719 PolarHBondContact O-N 3.27Å; Q716-N719 PolarHBondContact O-N 3.42Å; N719-D722 PolarHBondContact O-N 3.47Å; N719-V723 WeakPolarHBondContact O-CB 3.44Å; N719-V723 VanDerWaalsContact O-CG2 3.31Å; N719-V723 WeakPolarHBondContact O-CG2 3.46Å; N719-V723 PolarHBondContact O-N 3.4Å
720	Q	73.3	Confident	72.3	Confident	69 Å²	69	88.4 Å²	88.4	32%	0.322	44%	0.435	S	S	.	.	H	α-helix	trans	-61.3	-45.5	171.2	-74.2	175.5	-1.3	0	0	112	Q716 K718 V723 L724	Q716-Q720 WeakPolarHBondContact O-CG 3.46Å; Q716-Q720 PolarHBondContact O-N 2.92Å; K718-Q720 VanDerWaalsContact C-N 3.34Å; K718-Q720 PolarHBondContact O-N 3.12Å; Q720-V723 PolarHBondContact O-N 2.64Å; Q720-L724 WeakPolarHBondContact O-CG 3.48Å; Q720-L724 PolarHBondContact O-N 3.24Å
721	R	74.1	Confident	71.1	Confident	186 Å²	186	89.7 Å²	89.7	70%	0.702	44%	0.443	S	S	*	.	H	α-helix	trans	-59.8	-48.6	173	-88.7	-176.5	161.1	145.9	-2.7	111.9	A717 K718 V723 L724 T725	A717-R721 WeakPolarHBondContact O-CB 3.44Å; A717-R721 PolarHBondContact O-N 3.29Å; K718-R721 CarbonylContact O-C 3.43Å; K718-R721 PolarHBondContact O-N 2.98Å; R721-V723 VanDerWaalsContact C-N 3.26Å; R721-V723 PolarHBondContact O-N 3.32Å; R721-L724 PolarHBondContact O-N 2.86Å; R721-L724 VanDerWaalsContact O-N 3.11Å; R721-T725 PolarHBondContact O-N 3.39Å; R721-T725 PolarHBondContact O-OG1 3.4Å
722	D	76	Confident	69.7	Low	58 Å²	58	95.2 Å²	95.2	31%	0.31	46%	0.457	S	S	.	.	H	α-helix	trans	-60.4	-34.2	179.1	-70.6	-19.2	0	0	0	112.2	K718 N719 R726	K718-D722 WeakPolarHBondContact O-CB 3.5Å; K718-D722 VanDerWaalsContact O-CG 3.3Å; K718-D722 PolarHBondContact O-N 2.89Å; N719-D722 PolarHBondContact O-N 3.47Å; D722-R726 WeakPolarHBondContact O-CB 3.32Å; D722-R726 WeakPolarHBondContact O-CD 3.5Å; D722-R726 WeakPolarHBondContact O-CG 3.43Å; D722-R726 PolarHBondContact O-N 3.28Å; D722-R726 VanDerWaalsContact O-N 3.13Å; D722-R726 PolarHBondContact O-NE 2.9Å
723	V	71	Confident	68.3	Low	42 Å²	42	99.5 Å²	99.5	26%	0.255	47%	0.474	S	S	.	.	H	α-helix	trans	-71.6	-44.6	173.1	168.8	0	0	0	0	111.4	N719 Q720 R721 R726 K727	N719-V723 WeakPolarHBondContact O-CB 3.44Å; N719-V723 VanDerWaalsContact O-CG2 3.31Å; N719-V723 WeakPolarHBondContact O-CG2 3.46Å; N719-V723 PolarHBondContact O-N 3.4Å; Q720-V723 PolarHBondContact O-N 2.64Å; R721-V723 VanDerWaalsContact C-N 3.26Å; R721-V723 PolarHBondContact O-N 3.32Å; V723-R726 PolarHBondContact O-N 3.17Å; V723-K727 PolarHBondContact O-N 3.45Å
724	L	68.7	Low	66.3	Low	69 Å²	69	96.1 Å²	96.1	36%	0.361	47%	0.469	S	S	.	.	H	α-helix	trans	-60.8	-46.7	175.7	-74.6	168.3	0	0	0	111.6	Q720 R721 R726 K727 Q728 P744	Q720-L724 WeakPolarHBondContact O-CG 3.48Å; Q720-L724 PolarHBondContact O-N 3.24Å; R721-L724 PolarHBondContact O-N 2.86Å; R721-L724 VanDerWaalsContact O-N 3.11Å; L724-R726 VanDerWaalsContact C-N 3.32Å; L724-R726 PolarHBondContact O-N 3.08Å; L724-K727 PolarHBondContact O-N 2.91Å; L724-Q728 WeakPolarHBondContact O-CB 3.38Å; L724-Q728 WeakPolarHBondContact O-CG 3.41Å; L724-Q728 PolarHBondContact O-N 3.25Å; L724-P744 HydrophobicContact CD1-CG 4.24Å; L724-P744 HydrophobicContact CD2-CG 3.9Å; L724-P744 HydrophobicContact CG-CG 3.95Å
725	T	73.2	Confident	64.2	Low	87 Å²	87	95.7 Å²	95.7	53%	0.534	48%	0.478	S	S	.	.	H	α-helix	trans	-62.2	-37.9	177	-53.8	0	0	0	0	111.6	R721 A729	R721-T725 PolarHBondContact O-N 3.39Å; R721-T725 PolarHBondContact O-OG1 3.4Å; T725-A729 WeakPolarHBondContact O-CB 3.47Å; T725-A729 PolarHBondContact O-N 3.22Å
726	R	66.9	Low	62.1	Low	135 Å²	135	103.2 Å²	103.2	51%	0.509	52%	0.518	S	S	.	.	H	α-helix	trans	-67.1	-41.4	173.2	-73.4	170.8	-149.7	-133.1	5.4	112.9	D722 V723 L724 A729 K730	D722-R726 WeakPolarHBondContact O-CB 3.32Å; D722-R726 WeakPolarHBondContact O-CD 3.5Å; D722-R726 WeakPolarHBondContact O-CG 3.43Å; D722-R726 PolarHBondContact O-N 3.28Å; D722-R726 VanDerWaalsContact O-N 3.13Å; D722-R726 PolarHBondContact O-NE 2.9Å; V723-R726 PolarHBondContact O-N 3.17Å; L724-R726 VanDerWaalsContact C-N 3.32Å; L724-R726 PolarHBondContact O-N 3.08Å; R726-A729 PolarHBondContact O-N 2.86Å; R726-K730 PolarHBondContact O-N 3.45Å
727	K	61.1	Low	59.9	Low	133 Å²	133	108.6 Å²	108.6	58%	0.578	54%	0.543	S	S	*	.	H	α-helix	trans	-63.8	-47.4	175.1	-76.5	-169.7	173.8	-169.2	0	110.9	V723 L724 A729 K730 N731	V723-K727 PolarHBondContact O-N 3.45Å; L724-K727 PolarHBondContact O-N 2.91Å; K727-A729 VanDerWaalsContact C-N 3.34Å; K727-A729 PolarHBondContact O-N 2.84Å; K727-K730 PolarHBondContact O-N 2.99Å; K727-N731 PolarHBondContact O-N 2.81Å; K727-N731 PolarHBondContact O-OD1 3.49Å
728	Q	62.1	Low	57.8	Low	135 Å²	135	109.9 Å²	109.9	63%	0.631	55%	0.553	S	S	*	*	H	α-helix	trans	-61.9	-38.7	175.8	-71.4	175.5	-6.4	0	0	112.5	L724 K732	L724-Q728 WeakPolarHBondContact O-CB 3.38Å; L724-Q728 WeakPolarHBondContact O-CG 3.41Å; L724-Q728 PolarHBondContact O-N 3.25Å; Q728-K732 PolarHBondContact O-N 3.12Å
729	A	60.3	Low	55.7	Low	67 Å²	67	114.1 Å²	114.1	55%	0.554	58%	0.58	S	S	*	*	H	α-helix	trans	-66	-37.9	176.1	0	0	0	0	0	112.9	T725 R726 K727	T725-A729 WeakPolarHBondContact O-CB 3.47Å; T725-A729 PolarHBondContact O-N 3.22Å; R726-A729 PolarHBondContact O-N 2.86Å; K727-A729 VanDerWaalsContact C-N 3.34Å; K727-A729 PolarHBondContact O-N 2.84Å
730	K	55.2	Low	53.5	Low	167 Å²	167	121 Å²	121	73%	0.726	62%	0.617	S	S	*	*	H	α-helix	trans	-70.6	-51.5	173.7	-81.9	-166.5	167.8	-166.6	0	112.3	R726 K727 K732 Q733	R726-K730 PolarHBondContact O-N 3.45Å; K727-K730 PolarHBondContact O-N 2.99Å; K730-K732 PolarHBondContact O-N 3.44Å; K730-Q733 PolarHBondContact O-N 2.99Å; K730-Q733 VanDerWaalsContact O-N 3.09Å
731	N	53	Low	51.7	Low	78 Å²	78	125.2 Å²	125.2	42%	0.417	64%	0.641	S	S	.	*	H	α-helix	trans	-63.1	-18	-175.8	-73.2	29	0	0	0	113.1	K727 Q733 T734	K727-N731 PolarHBondContact O-N 2.81Å; K727-N731 PolarHBondContact O-OD1 3.49Å; N731-Q733 PolarHBondContact O-N 3.37Å; N731-Q733 VanDerWaalsContact O-N 3.14Å; N731-T734 CarbonylContact O-C 3.48Å; N731-T734 PolarHBondContact O-N 2.84Å
732	K	50.4	Low	49.9	Very low	190 Å²	190	119.5 Å²	119.5	83%	0.826	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-3.5	174.5	-141.5	169.2	-171.8	173.3	0	114.8	Q728 K730	Q728-K732 PolarHBondContact O-N 3.12Å; K730-K732 PolarHBondContact O-N 3.44Å
733	Q	48	Very low	48.2	Very low	180 Å²	180	126 Å²	126	84%	0.841	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.8	-13.1	170.6	-69.3	-172.1	-18.9	0	0	114.2	K730 N731	K730-Q733 PolarHBondContact O-N 2.99Å; K730-Q733 VanDerWaalsContact O-N 3.09Å; N731-Q733 PolarHBondContact O-N 3.37Å; N731-Q733 VanDerWaalsContact O-N 3.14Å
734	T	37.3	Very low	47.1	Very low	101 Å²	101	125.9 Å²	125.9	62%	0.62	67%	0.667	S	S	*	*	S	Bend	trans	-134.2	74.8	-178.4	52.6	0	0	0	0	110.3	N731 N736	N731-T734 CarbonylContact O-C 3.48Å; N731-T734 PolarHBondContact O-N 2.84Å; T734-N736 PolarHBondContact O-N 3.49Å
735	S	32.3	Very low	46.5	Very low	101 Å²	101	130.8 Å²	130.8	71%	0.706	69%	0.688	S	S	*	*			trans	-76.6	111.3	173	53.4	0	0	0	0	110.9
736	N	31.9	Very low	45.9	Very low	157 Å²	157	129.5 Å²	129.5	84%	0.84	68%	0.677	S	S	*	*	S	Bend		-179.9	-21.9	128.8	-94	6.2	0	0	0	113.6	T734	T734-N736 PolarHBondContact O-N 3.49Å
737	E	30.1	Very low	46	Very low	190 Å²	190	126.9 Å²	126.9	89%	0.888	67%	0.673	S	S	*	*			trans	-113.5	98	-175.1	-72.4	172.8	-163.6	0	0	111.9
738	A	32.7	Very low	46.4	Very low	74 Å²	74	124.8 Å²	124.8	61%	0.612	68%	0.675	S	S	*	*			trans	-151.5	79.8	168.6	0	0	0	0	0	108.1	D740	A738-D740 PolarHBondContact O-N 2.89Å
739	N	34.4	Very low	46.8	Very low	172 Å²	172	123.6 Å²	123.6	92%	0.92	67%	0.668	S	S	*	*			trans	-58.9	132.2	173	-105.4	0.1	0	0	0	109.4	N741	N739-N741 PolarHBondContact O-N 2.79Å
740	D	32	Very low	47	Very low	149 Å²	149	121.6 Å²	121.6	80%	0.797	65%	0.649	S	S	*	*			trans	-82.5	112.3	-177.9	-170	12.5	0	0	0	109.9	A738	A738-D740 PolarHBondContact O-N 2.89Å
741	N	34.1	Very low	47.4	Very low	158 Å²	158	122.5 Å²	122.5	85%	0.845	65%	0.653	S	S	*	*			trans	-174.9	131.3	147.4	-102.7	-52.4	0	0	0	110.3	N739	N739-N741 PolarHBondContact O-N 2.79Å
742	G	37.2	Very low	47.7	Very low	67 Å²	67	124 Å²	124	69%	0.691	66%	0.657	S	S	*	*			trans	119.5	99	172.7	0	0	0	0	0	114.6
743	K	39.8	Very low	48.2	Very low	193 Å²	193	118.2 Å²	118.2	84%	0.839	63%	0.631	S	S	*	*			trans	-52.9	132.7	160.8	-64.1	170.5	-176.6	169.7	0	108	Q745	K743-Q745 PolarHBondContact O-N 3.04Å
744	P	48	Very low	49.1	Very low	41 Å²	41	114.1 Å²	114.1	27%	0.266	62%	0.618	S	S	.	*			trans	-68.4	93.1	-177.8	27.8	-34.7	0	0	0	110.6	L724	L724-P744 HydrophobicContact CD1-CG 4.24Å; L724-P744 HydrophobicContact CD2-CG 3.9Å; L724-P744 HydrophobicContact CG-CG 3.95Å
745	Q	55.8	Low	51	Low	171 Å²	171	109.8 Å²	109.8	80%	0.799	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-61.7	158.6	172.6	-63.4	-175	1.7	0	0	110	K743	K743-Q745 PolarHBondContact O-N 3.04Å
746	L	61.1	Low	53.4	Low	60 Å²	60	110.9 Å²	110.9	31%	0.314	58%	0.583	S	S	.	*	P	Polyproline II helix	trans	-69	141.9	168.4	-77	91.9	0	0	0	108.8	L702 Q716 S748	L702-L746 HydrophobicContact CD1-CD2 3.62Å; Q716-L746 HydrophobicContact CB-CD1 4.5Å; Q716-L746 HydrophobicContact CG-CD1 4.38Å; Q716-L746 HydrophobicContact CG-CD2 4Å; L746-S748 PolarHBondContact O-N 2.71Å
747	L	68.2	Low	56	Low	80 Å²	80	103.6 Å²	103.6	42%	0.419	54%	0.544	S	S	.	.	P	Polyproline II helix	trans	-60.8	125.8	168.2	-62.3	169.7	0	0	0	107.5	E694 Y695 Q698	E694-L747 HydrophobicContact CB-CD1 3.95Å; Y695-L747 HydrophobicContact CD2-CB 4.02Å; Y695-L747 WeakPolarHBondContact CD2-O 3.45Å; Y695-L747 VanDerWaalsContact CE2-O 3.28Å; Y695-L747 WeakPolarHBondContact CE2-O 3.19Å; Q698-L747 VanDerWaalsContact OE1-CB 3.32Å
748	S	70	Confident	58.7	Low	90 Å²	90	97.5 Å²	97.5	63%	0.629	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-68.1	156.3	164.1	46.9	0	0	0	0	109.3	Y695 L746 P750	Y695-S748 VanDerWaalsContact CD2-C 3.5Å; Y695-S748 VanDerWaalsContact CD2-O 3.24Å; Y695-S748 WeakPolarHBondContact CD2-O 3.37Å; L746-S748 PolarHBondContact O-N 2.71Å; S748-P750 WeakPolarHBondContact O-CD 3.39Å
749	K	71	Confident	61.5	Low	109 Å²	109	94.3 Å²	94.3	47%	0.474	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-64	129.4	161.8	-169.1	-165.9	168.9	-165	0	105.9	Y695 K751 E752	Y695-K749 HydrophobicContact CD1-CB 4.35Å; Y695-K749 HydrophobicContact CD1-CG 4.22Å; Y695-K749 HydrophobicContact CE1-CB 3.79Å; Y695-K749 HydrophobicContact CE1-CG 3.86Å; Y695-K749 HydrophobicContact CE2-CB 4.12Å; Y695-K749 VanDerWaalsContact CE2-N 3.27Å; K749-K751 PolarHBondContact O-N 2.66Å; K749-K751 VanDerWaalsContact O-N 3.16Å; K749-E752 IonicContact NZ-OE2 2.77Å; K749-E752 PolarHBondContact NZ-OE2 2.86Å
750	P	64.6	Low	64.1	Low	25 Å²	25	88.7 Å²	88.7	16%	0.162	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-51.6	124.9	167.2	-24.9	34.5	0	0	0	108.9	S748 E752	S748-P750 WeakPolarHBondContact O-CD 3.39Å; P750-E752 PolarHBondContact O-N 2.65Å
751	K	63	Low	66.9	Low	187 Å²	187	85 Å²	85	81%	0.813	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-70.8	121.3	170.3	-75	-172.9	178.2	-177.8	0	107.2	R688 K749 Y753	R688-K751 PolarHBondContact NH2-O 3.09Å; K749-K751 PolarHBondContact O-N 2.66Å; K749-K751 VanDerWaalsContact O-N 3.16Å; K751-Y753 VanDerWaalsContact C-N 3.34Å; K751-Y753 PolarHBondContact O-N 2.86Å; K751-Y753 VanDerWaalsContact O-N 3.16Å
752	E	59.1	Low	69.6	Low	108 Å²	108	78.6 Å²	78.6	51%	0.505	41%	0.413	S	S	.	.			trans	-79.8	90.9	167.2	-86.3	150.4	178.7	0	0	106.9	K749 P750 V754	K749-E752 IonicContact NZ-OE2 2.77Å; K749-E752 PolarHBondContact NZ-OE2 2.86Å; P750-E752 PolarHBondContact O-N 2.65Å; E752-V754 HydrophobicContact CB-CG2 3.92Å; E752-V754 HydrophobicContact CG-CG2 4.49Å; E752-V754 PolarHBondContact O-N 3.07Å
753	Y	61.2	Low	71.9	Confident	70 Å²	70	80.2 Å²	80.2	28%	0.275	41%	0.409	S	S	.	.			trans	-61.9	116.4	148.8	-154.8	-124.2	0	0	0	105.2	K751 V755 G875 R895 E921	K751-Y753 VanDerWaalsContact C-N 3.34Å; K751-Y753 PolarHBondContact O-N 2.86Å; K751-Y753 VanDerWaalsContact O-N 3.16Å; Y753-V755 HydrophobicContact CD1-CG2 4.12Å; Y753-V755 HydrophobicContact CE1-CG2 3.71Å; Y753-G875 WeakPolarHBondContact CE2-O 3.31Å; Y753-G875 PolarHBondContact OH-O 3.2Å; Y753-R895 PolarHBondContact OH-NH1 3.01Å; Y753-R895 PolarHBondContact OH-NH2 3.34Å; Y753-R895 VanDerWaalsContact OH-NH2 3.1Å; Y753-E921 WeakPolarHBondContact CD1-OE2 3.15Å
754	V	66.8	Low	74.1	Confident	93 Å²	93	77.5 Å²	77.5	56%	0.564	41%	0.411	S	S	*	.			trans	-142.8	95.3	179.9	167.8	0	0	0	0	104.2	E752 K756	E752-V754 HydrophobicContact CB-CG2 3.92Å; E752-V754 HydrophobicContact CG-CG2 4.49Å; E752-V754 PolarHBondContact O-N 3.07Å; V754-K756 HydrophobicContact CG1-CD 4.5Å; V754-K756 HydrophobicContact CG1-CG 4.22Å
755	V	77.7	Confident	75.9	Confident	10 Å²	10	76.7 Å²	76.7	6%	0.061	40%	0.404	C	S	.	.			trans	-75.6	134.9	171.2	-171.7	0	0	0	0	106.9	Y753 F757 A925	Y753-V755 HydrophobicContact CD1-CG2 4.12Å; Y753-V755 HydrophobicContact CE1-CG2 3.71Å; V755-F757 HydrophobicContact CG1-CD1 3.62Å; V755-F757 HydrophobicContact CG1-CE1 3.32Å; V755-F757 HydrophobicContact CG1-CZ 4.19Å; V755-A925 HydrophobicContact CB-CB 4.08Å; V755-A925 HydrophobicContact CG1-CB 4.01Å
756	K	83	Confident	77.4	Confident	124 Å²	124	72.4 Å²	72.4	54%	0.539	39%	0.394	S	S	.	.			trans	-137	100.2	170.2	-82.2	-172.9	165	-85.6	0	108.8	V754 K873	V754-K756 HydrophobicContact CG1-CD 4.5Å; V754-K756 HydrophobicContact CG1-CG 4.22Å; K756-K873 CarbonylContact C-O 3.55Å; K756-K873 PolarHBondContact N-O 3.2Å; K756-K873 CarbonylContact O-C 3.5Å
757	F	87.2	Confident	78.6	Confident	5 Å²	5	73.8 Å²	73.8	2%	0.022	41%	0.406	C	S	.	.			trans	-73.3	148	166.4	-63.9	-1.7	0	0	0	107.9	V755 F874 F898 L918 L926 A929	V755-F757 HydrophobicContact CG1-CD1 3.62Å; V755-F757 HydrophobicContact CG1-CE1 3.32Å; V755-F757 HydrophobicContact CG1-CZ 4.19Å; F757-F874 HydrophobicContact CB-CD1 4.34Å; F757-F874 HydrophobicContact CB-CE1 3.85Å; F757-F874 HydrophobicContact CD1-CB 4.3Å; F757-F874 AromaticContact CD1-CD1 3.22Å; F757-F874 HydrophobicContact CD1-CD1 3.22Å; F757-F874 AromaticContact CD1-CE1 3.66Å; F757-F874 HydrophobicContact CD1-CE1 3.66Å; F757-F874 HydrophobicContact CD1-CG 4.04Å; F757-F874 HydrophobicContact CD2-CD1 4.48Å; F757-F874 HydrophobicContact CD2-CE1 4.43Å; F757-F874 HydrophobicContact CE1-CB 4.11Å; F757-F874 AromaticContact CE1-CD1 3.52Å; F757-F874 HydrophobicContact CE1-CD1 3.52Å; F757-F874 HydrophobicContact CE1-CE1 4.32Å; F757-F874 HydrophobicContact CE1-CG 4.25Å; F757-F874 AromaticContact CG-CD1 3.78Å; F757-F874 HydrophobicContact CG-CD1 3.78Å; F757-F874 AromaticContact CG-CE1 3.72Å; F757-F874 HydrophobicContact CG-CE1 3.72Å; F757-F874 HydrophobicContact CZ-CD1 4.27Å; F757-F898 HydrophobicContact CE2-CD2 4.14Å; F757-F898 HydrophobicContact CE2-CG 4.24Å; F757-F898 HydrophobicContact CZ-CD2 4.33Å; F757-L918 HydrophobicContact CE2-CD1 4.4Å; F757-L926 HydrophobicContact CD2-CB 3.8Å; F757-L926 HydrophobicContact CD2-CD1 3.9Å; F757-L926 HydrophobicContact CD2-CG 4.43Å; F757-L926 HydrophobicContact CE2-CB 4.02Å; F757-L926 HydrophobicContact CE2-CD1 4.35Å; F757-A929 HydrophobicContact CB-CB 3.74Å
758	T	86.5	Confident	79.4	Confident	62 Å²	62	74 Å²	74	38%	0.38	41%	0.413	S	S	.	.			trans	-154.9	122.2	176.8	-45.8	0	0	0	0	107	S902	T758-S902 PolarHBondContact O-OG 2.95Å
759	F	90.1	Very high	80.4	Confident	7 Å²	7	70 Å²	70	3%	0.031	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-99	138.1	171	-57.4	-69.8	0	0	0	108	F898 L901 L909 L926 A929 F933	F759-F898 HydrophobicContact CZ-CD1 4.31Å; F759-L901 HydrophobicContact CE1-CD2 4.13Å; F759-L901 HydrophobicContact CE1-CG 4.29Å; F759-L909 HydrophobicContact CD1-CD1 4.41Å; F759-L909 HydrophobicContact CD1-CD2 4.4Å; F759-L909 HydrophobicContact CD2-CD1 3.87Å; F759-L909 HydrophobicContact CE2-CD1 4.12Å; F759-L909 HydrophobicContact CG-CD1 4.03Å; F759-L926 HydrophobicContact CE2-CD1 4.13Å; F759-L926 HydrophobicContact CZ-CD1 4.2Å; F759-A929 HydrophobicContact CD2-CB 3.92Å; F759-A929 HydrophobicContact CE2-CB 3.82Å; F759-F933 HydrophobicContact CB-CD2 3.64Å; F759-F933 HydrophobicContact CB-CE2 4.08Å; F759-F933 HydrophobicContact CB-CG 4.25Å
760	P	90.7	Very high	81.4	Confident	54 Å²	54	65 Å²	65	35%	0.351	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-71.1	133.4	175.3	30.3	-33.5	0	0	0	109.4	S902 A905	P760-S902 WeakPolarHBondContact CD-O 3.36Å; P760-A905 HydrophobicContact CG-CB 3.59Å
761	N	91	Very high	82.8	Confident	72 Å²	72	63.9 Å²	63.9	39%	0.385	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-66.1	140	-179.8	-70	-2.1	0	0	0	111.2	E932 E934	N761-E932 PolarHBondContact OD1-O 3.23Å; N761-E934 HydrophobicContact CB-CB 4.11Å; N761-E934 HydrophobicContact CB-CG 4.48Å; N761-E934 WeakPolarHBondContact CB-OE2 3.39Å; N761-E934 VanDerWaalsContact ND2-CG 3.34Å; N761-E934 WeakPolarHBondContact ND2-CG 3.3Å; N761-E934 PolarHBondContact ND2-OE2 2.9Å; N761-E934 PolarHBondContact OD1-N 3.17Å
762	P	89.3	Confident	84.3	Confident	23 Å²	23	55 Å²	55	15%	0.149	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-73.1	164.2	-176.7	30.2	-35.7	0	0	0	112.8	D907	P762-D907 HydrophobicContact CB-CB 3.74Å; P762-D907 WeakPolarHBondContact CB-OD1 3.5Å
763	T	86.5	Confident	86	Confident	101 Å²	101	53.5 Å²	53.5	62%	0.62	31%	0.307	S	S	*	.	P	Polyproline II helix	trans	-76.4	142.6	166	51.9	0	0	0	0	110.2	I765	T763-I765 PolarHBondContact O-N 3.38Å
764	P	85.5	Confident	87.5	Confident	136 Å²	136	53 Å²	53	88%	0.883	31%	0.313	S	S	*	.	P	Polyproline II helix	trans	-57.2	123.5	175.8	-27.3	35.8	0	0	0	112.7
765	I	86.7	Confident	88.8	Confident	23 Å²	23	48.6 Å²	48.6	12%	0.118	29%	0.287	C	S	.	.			trans	-116.4	141.1	179.1	-71.1	169.6	0	0	0	109.1	T763 M795 N830 R832 V833 D907	T763-I765 PolarHBondContact O-N 3.38Å; I765-M795 HydrophobicContact CB-CE 3.85Å; I765-M795 HydrophobicContact CD1-CE 3.91Å; I765-M795 HydrophobicContact CG1-CE 4.3Å; I765-M795 HydrophobicContact CG2-CE 4.47Å; I765-N830 HydrophobicContact CG2-CB 4.48Å; I765-N830 VanDerWaalsContact CG2-ND2 3.33Å; I765-N830 WeakPolarHBondContact CG2-ND2 3.43Å; I765-R832 HydrophobicContact CD1-CB 4.09Å; I765-R832 HydrophobicContact CG1-CB 4.45Å; I765-V833 HydrophobicContact CD1-CG2 3.84Å; I765-V833 HydrophobicContact CG2-CG2 3.94Å; I765-D907 HydrophobicContact CD1-CB 4.4Å
766	S	86.3	Confident	89.5	Confident	82 Å²	82	49.6 Å²	49.6	57%	0.573	29%	0.293	S	S	*	.	P	Polyproline II helix	trans	-73	133.8	178.1	56.4	0	0	0	0	112.3	N830	S766-N830 PolarHBondContact O-ND2 3.23Å
767	P	86.5	Confident	90	Very high	89 Å²	89	44.2 Å²	44.2	58%	0.578	27%	0.27	S	S	*	.	S	Bend	trans	-59.4	159.6	167.5	-24.3	35.1	0	0	0	113.2	I769	P767-I769 HydrophobicContact CB-CG1 4.43Å
768	P	86	Confident	90.2	Very high	85 Å²	85	45.4 Å²	45.4	55%	0.552	28%	0.28	S	S	*	.	P	Polyproline II helix	cis	-69.5	150.6	-8	31.4	-35.9	0	0	0	111.2	N830	P768-N830 WeakPolarHBondContact O-CB 3.37Å
769	I	90.4	Very high	90.4	Very high	5 Å²	5	46 Å²	46	3%	0.026	28%	0.276	C	S	.	.			trans	-102.9	-64.8	-171.6	-43.5	-166.1	0	0	0	111	P767 I793 M795 L829 N830 V833 I908	P767-I769 HydrophobicContact CB-CG1 4.43Å; I769-I793 WeakPolarHBondContact CB-O 3.31Å; I769-M795 HydrophobicContact CD1-CB 4.31Å; I769-M795 HydrophobicContact CD1-CE 4.09Å; I769-M795 HydrophobicContact CD1-CG 3.57Å; I769-M795 HydrophobicContact CD1-SD 3.96Å; I769-M795 HydrophobicContact CG2-CE 3.8Å; I769-M795 HydrophobicContact CG2-SD 4.25Å; I769-L829 WeakPolarHBondContact O-CA 3.38Å; I769-N830 PolarHBondContact O-N 2.74Å; I769-V833 HydrophobicContact CG2-CG1 4.23Å; I769-V833 HydrophobicContact CG2-CG2 3.53Å; I769-I908 HydrophobicContact CG2-CD1 3.97Å
770	L	92.3	Very high	90.2	Very high	4 Å²	4	51 Å²	51	2%	0.021	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	134.4	171.5	173.2	57	0	0	0	109	I793 L816 R827 R828 L829 I835 I908	L770-I793 HydrophobicContact CB-CD1 3.99Å; L770-I793 HydrophobicContact CD2-CD1 3.76Å; L770-I793 HydrophobicContact CG-CD1 3.7Å; L770-I793 PolarHBondContact O-N 3.45Å; L770-L816 HydrophobicContact CD2-CB 4.32Å; L770-L816 HydrophobicContact CD2-CD2 4.23Å; L770-L816 HydrophobicContact CG-CD2 4.22Å; L770-R827 HydrophobicContact CD1-CG 4.4Å; L770-R828 WeakPolarHBondContact CA-O 3.44Å; L770-L829 HydrophobicContact CB-CD1 4.09Å; L770-L829 HydrophobicContact CD1-CB 4.23Å; L770-L829 HydrophobicContact CD1-CD1 4.15Å; L770-I835 HydrophobicContact CD2-CD1 3.9Å; L770-I908 HydrophobicContact CB-CD1 3.89Å; L770-I908 HydrophobicContact CD2-CD1 4.17Å
771	G	93	Very high	89.9	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.01	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	157.3	176	0	0	0	0	0	114.2	F791 R827 R828	G771-F791 CarbonylContact C-O 3.59Å; G771-F791 WeakPolarHBondContact CA-O 3.49Å; G771-R827 WeakPolarHBondContact O-CA 3.29Å; G771-R828 PolarHBondContact N-O 2.83Å; G771-R828 PolarHBondContact O-N 3.39Å
772	L	94.7	Very high	89.6	Confident	2 Å²	2	59.3 Å²	59.3	1%	0.01	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	132.3	173.3	-56.4	-179.7	0	0	0	107.9	V775 L789 N790 F791 F812 L815 L816 R827	L772-V775 HydrophobicContact CB-CB 4.28Å; L772-V775 HydrophobicContact CB-CG2 3.92Å; L772-V775 HydrophobicContact CD2-CG2 4.33Å; L772-L789 HydrophobicContact CD1-CD2 3.85Å; L772-N790 WeakPolarHBondContact O-CA 3.46Å; L772-F791 PolarHBondContact N-O 2.76Å; L772-F791 PolarHBondContact O-N 2.71Å; L772-F812 HydrophobicContact CD1-CD2 4.47Å; L772-F812 HydrophobicContact CD1-CE2 4.2Å; L772-L815 HydrophobicContact CD1-CB 4.31Å; L772-L816 HydrophobicContact CD1-CD2 3.99Å; L772-L816 HydrophobicContact CD1-CG 4.49Å; L772-L816 HydrophobicContact CD2-CD2 4.29Å; L772-L816 HydrophobicContact CG-CD2 3.91Å; L772-R827 HydrophobicContact CD2-CB 3.87Å; L772-R827 HydrophobicContact CD2-CG 3.83Å
773	Y	94.7	Very high	89.5	Confident	76 Å²	76	66.9 Å²	66.9	30%	0.298	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	117.2	-176.7	-63	-89.1	0	0	0	109.8	V775 N790 G825 E826 R828	Y773-V775 PolarHBondContact O-N 3.17Å; Y773-V775 VanDerWaalsContact O-N 3.11Å; Y773-N790 WeakPolarHBondContact CA-OD1 3.43Å; Y773-G825 WeakPolarHBondContact O-CA 3.36Å; Y773-E826 HydrophobicContact CD2-CG 4.47Å; Y773-E826 PolarHBondContact N-O 3.02Å; Y773-E826 PolarHBondContact O-N 3.14Å; Y773-R828 HydrophobicContact CD2-CB 4.37Å; Y773-R828 HydrophobicContact CD2-CG 3.87Å; Y773-R828 HydrophobicContact CE2-CB 3.92Å; Y773-R828 HydrophobicContact CE2-CG 3.8Å
774	S	93.2	Very high	89.6	Confident	59 Å²	59	64.7 Å²	64.7	41%	0.413	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	47.1	33.2	-175.8	-59.4	0	0	0	0	115.1	T776 L789 N790	S774-T776 PolarHBondContact O-N 2.99Å; S774-L789 PolarHBondContact N-O 2.88Å; S774-N790 PolarHBondContact N-ND2 2.89Å; S774-N790 PolarHBondContact N-OD1 3.41Å
775	V	93.1	Very high	89.8	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	123	-171.4	162.5	0	0	0	0	111.9	L772 Y773 E788 L789 L815 P822 D824 E826	L772-V775 HydrophobicContact CB-CB 4.28Å; L772-V775 HydrophobicContact CB-CG2 3.92Å; L772-V775 HydrophobicContact CD2-CG2 4.33Å; Y773-V775 PolarHBondContact O-N 3.17Å; Y773-V775 VanDerWaalsContact O-N 3.11Å; V775-E788 PolarHBondContact O-N 2.95Å; V775-L789 HydrophobicContact CB-CB 4.18Å; V775-L789 PolarHBondContact N-O 2.91Å; V775-L789 WeakPolarHBondContact O-CB 3.39Å; V775-L789 PolarHBondContact O-N 2.61Å; V775-L815 HydrophobicContact CG1-CD1 4.28Å; V775-P822 HydrophobicContact CB-CB 4.47Å; V775-P822 HydrophobicContact CG1-CB 3.81Å; V775-P822 HydrophobicContact CG2-CB 4.06Å; V775-D824 CarbonylContact C-O 3.59Å; V775-D824 WeakPolarHBondContact CA-O 3.3Å; V775-E826 WeakPolarHBondContact CG2-O 3.45Å
776	T	93.8	Very high	90.1	Very high	31 Å²	31	58.8 Å²	58.8	19%	0.19	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	133.6	168.5	-59.7	0	0	0	0	108.5	S774 F786 E788 T823 D824	S774-T776 PolarHBondContact O-N 2.99Å; T776-F786 WeakPolarHBondContact CA-O 3.26Å; T776-F786 WeakPolarHBondContact CG2-O 3.39Å; T776-E788 PolarHBondContact OG1-N 3.1Å; T776-T823 WeakPolarHBondContact O-CA 3.37Å; T776-T823 WeakPolarHBondContact O-CB 3.44Å; T776-T823 PolarHBondContact O-N 3.04Å; T776-D824 PolarHBondContact N-O 2.6Å; T776-D824 PolarHBondContact O-N 3.13Å; T776-D824 VanDerWaalsContact O-N 3.15Å
777	F	93.4	Very high	90.4	Very high	12 Å²	12	60 Å²	60	5%	0.053	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	131.7	-179.2	-179.5	-97.8	0	0	0	113	Y779 P784 L785 F786 T811 L815 V820 Q821	F777-Y779 HydrophobicContact CE1-CD1 4.03Å; F777-Y779 HydrophobicContact CE1-CD2 4.05Å; F777-Y779 AromaticContact CE1-CE1 3.94Å; F777-Y779 HydrophobicContact CE1-CE1 3.94Å; F777-Y779 AromaticContact CE1-CE2 3.97Å; F777-Y779 HydrophobicContact CE1-CE2 3.97Å; F777-Y779 HydrophobicContact CE1-CG 4.07Å; F777-Y779 AromaticContact CE1-CZ 3.91Å; F777-Y779 AromaticContact CZ-CD1 3.75Å; F777-Y779 HydrophobicContact CZ-CD1 3.75Å; F777-Y779 AromaticContact CZ-CE1 3.72Å; F777-Y779 HydrophobicContact CZ-CE1 3.72Å; F777-Y779 HydrophobicContact CZ-CG 4.18Å; F777-P784 WeakPolarHBondContact O-CA 3.22Å; F777-L785 PolarHBondContact O-N 3.39Å; F777-F786 HydrophobicContact CB-CD2 4.37Å; F777-F786 PolarHBondContact N-O 3.41Å; F777-F786 PolarHBondContact O-N 3.17Å; F777-T811 HydrophobicContact CD1-CG2 3.75Å; F777-T811 HydrophobicContact CE1-CG2 3.54Å; F777-T811 HydrophobicContact CZ-CG2 4.48Å; F777-L815 HydrophobicContact CB-CD1 4.04Å; F777-L815 HydrophobicContact CB-CD2 4.41Å; F777-L815 HydrophobicContact CD2-CD2 4.2Å; F777-L815 HydrophobicContact CG-CD1 4.26Å; F777-L815 HydrophobicContact CG-CD2 4.26Å; F777-V820 HydrophobicContact CD2-CG1 3.86Å; F777-V820 HydrophobicContact CE1-CG1 4.26Å; F777-V820 HydrophobicContact CE2-CG1 3.24Å; F777-V820 HydrophobicContact CZ-CG1 3.49Å; F777-V820 VanDerWaalsContact CZ-CG1 3.49Å; F777-Q821 WeakPolarHBondContact CD2-O 3.26Å
778	A	91.4	Very high	90.7	Very high	30 Å²	30	61.3 Å²	61.3	25%	0.248	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	144.2	170.5	0	0	0	0	0	110.5	P784 T823	A778-P784 HydrophobicContact CB-CB 4.26Å; A778-T823 PolarHBondContact N-OG1 2.92Å
779	Y	89.3	Confident	91	Very high	75 Å²	75	57.5 Å²	57.5	29%	0.294	29%	0.294	S	S	.	.			trans	-74.3	149.9	163.3	-75	-64.5	0	0	0	110.3	F777 N781 Q782 L785 T811	F777-Y779 HydrophobicContact CE1-CD1 4.03Å; F777-Y779 HydrophobicContact CE1-CD2 4.05Å; F777-Y779 AromaticContact CE1-CE1 3.94Å; F777-Y779 HydrophobicContact CE1-CE1 3.94Å; F777-Y779 AromaticContact CE1-CE2 3.97Å; F777-Y779 HydrophobicContact CE1-CE2 3.97Å; F777-Y779 HydrophobicContact CE1-CG 4.07Å; F777-Y779 AromaticContact CE1-CZ 3.91Å; F777-Y779 AromaticContact CZ-CD1 3.75Å; F777-Y779 HydrophobicContact CZ-CD1 3.75Å; F777-Y779 AromaticContact CZ-CE1 3.72Å; F777-Y779 HydrophobicContact CZ-CE1 3.72Å; F777-Y779 HydrophobicContact CZ-CG 4.18Å; Y779-N781 PolarHBondContact O-N 3.26Å; Y779-Q782 PolarHBondContact O-N 2.82Å; Y779-L785 HydrophobicContact CD2-CD1 3.85Å; Y779-L785 HydrophobicContact CE2-CD1 3.76Å; Y779-T811 HydrophobicContact CE2-CG2 4.03Å; Y779-T811 WeakPolarHBondContact OH-CG2 3.47Å; Y779-T811 PolarHBondContact OH-OG1 3.48Å
780	P	86.7	Confident	91.1	Very high	111 Å²	111	61.5 Å²	61.5	72%	0.721	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	132.3	176.7	-27	35.2	0	0	0	112.1	Q782	P780-Q782 PolarHBondContact O-N 2.98Å
781	N	84.3	Confident	91.2	Very high	178 Å²	178	61.9 Å²	61.9	95%	0.952	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	23.1	-177.4	-52.8	-21.2	0	0	0	115	Y779	Y779-N781 PolarHBondContact O-N 3.26Å
782	Q	85	Confident	91.1	Very high	123 Å²	123	64 Å²	64	58%	0.575	34%	0.339	S	S	*	.	S	Bend	trans	-121.7	164.6	174.4	-59.4	-172.1	6.9	0	0	111.5	Y779 P780	Y779-Q782 PolarHBondContact O-N 2.82Å; P780-Q782 PolarHBondContact O-N 2.98Å
783	K	86.1	Confident	91	Very high	181 Å²	181	64.2 Å²	64.2	79%	0.787	34%	0.34	S	S	*	.			trans	-64.9	151.3	170.2	-65.1	-169.9	177.3	-168.8	0	109.7
784	P	89.7	Confident	90.8	Very high	55 Å²	55	64.4 Å²	64.4	36%	0.357	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	144.2	170.4	26	-34.6	0	0	0	110.4	F777 A778 L960	F777-P784 WeakPolarHBondContact O-CA 3.22Å; A778-P784 HydrophobicContact CB-CB 4.26Å; P784-L960 HydrophobicContact CG-CD1 4.38Å; P784-L960 VanDerWaalsContact O-CD2 3.27Å; P784-L960 WeakPolarHBondContact O-CD2 3.14Å
785	L	89.8	Confident	90.6	Very high	35 Å²	35	62.8 Å²	62.8	18%	0.183	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	-31	172.1	-64.8	175.8	0	0	0	111.1	F777 Y779 T811	F777-L785 PolarHBondContact O-N 3.39Å; Y779-L785 HydrophobicContact CD2-CD1 3.85Å; Y779-L785 HydrophobicContact CE2-CD1 3.76Å; L785-T811 HydrophobicContact CD1-CG2 4.15Å
786	F	93.5	Very high	90.5	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	141.7	-179.9	-56.8	-73	0	0	0	110	T776 F777 L789 T811 F812 L815 I957 L960	T776-F786 WeakPolarHBondContact CA-O 3.26Å; T776-F786 WeakPolarHBondContact CG2-O 3.39Å; F777-F786 HydrophobicContact CB-CD2 4.37Å; F777-F786 PolarHBondContact N-O 3.41Å; F777-F786 PolarHBondContact O-N 3.17Å; F786-L789 HydrophobicContact CB-CB 4.32Å; F786-L789 HydrophobicContact CB-CD2 4.08Å; F786-L789 HydrophobicContact CD1-CD1 4.2Å; F786-L789 HydrophobicContact CD1-CD2 3.87Å; F786-L789 HydrophobicContact CG-CD2 3.97Å; F786-T811 HydrophobicContact CE2-CG2 4.3Å; F786-F812 HydrophobicContact CE1-CB 4.32Å; F786-F812 HydrophobicContact CE1-CD2 4.24Å; F786-F812 HydrophobicContact CE2-CB 4.23Å; F786-F812 HydrophobicContact CZ-CB 3.7Å; F786-F812 HydrophobicContact CZ-CD2 4.4Å; F786-L815 HydrophobicContact CD2-CD1 3.88Å; F786-L815 HydrophobicContact CE2-CD1 4.19Å; F786-I957 HydrophobicContact CE1-CD1 4.19Å; F786-I957 HydrophobicContact CE1-CG1 4.5Å; F786-I957 HydrophobicContact CE1-CG2 3.69Å; F786-I957 HydrophobicContact CZ-CD1 4.31Å; F786-I957 HydrophobicContact CZ-CG2 4.31Å; F786-L960 CarbonylContact C-O 3.53Å; F786-L960 VanDerWaalsContact CA-O 3.31Å; F786-L960 WeakPolarHBondContact CA-O 3.41Å
787	K	92.4	Very high	90.4	Very high	109 Å²	109	68.5 Å²	68.5	47%	0.474	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	131.8	173.9	-178.6	175.4	-178.9	-78.9	0	110	L789 L960	K787-L789 PolarHBondContact O-N 3.1Å; K787-L960 HydrophobicContact CB-CB 4.47Å; K787-L960 PolarHBondContact N-O 3.02Å
788	E	91.1	Very high	90.4	Very high	115 Å²	115	69.8 Å²	69.8	54%	0.537	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	51.5	31.3	176	-72.5	155.2	-139.5	0	0	114	V775 T776 N790	V775-E788 PolarHBondContact O-N 2.95Å; T776-E788 PolarHBondContact OG1-N 3.1Å; E788-N790 PolarHBondContact O-N 2.98Å; E788-N790 PolarHBondContact O-ND2 2.95Å
789	L	92.7	Very high	90.5	Very high	5 Å²	5	68.7 Å²	68.7	3%	0.026	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	118.8	-172.6	-174.2	74.1	0	0	0	111.6	L772 S774 V775 F786 K787 F812 I962	L772-L789 HydrophobicContact CD1-CD2 3.85Å; S774-L789 PolarHBondContact N-O 2.88Å; V775-L789 HydrophobicContact CB-CB 4.18Å; V775-L789 PolarHBondContact N-O 2.91Å; V775-L789 WeakPolarHBondContact O-CB 3.39Å; V775-L789 PolarHBondContact O-N 2.61Å; F786-L789 HydrophobicContact CB-CB 4.32Å; F786-L789 HydrophobicContact CB-CD2 4.08Å; F786-L789 HydrophobicContact CD1-CD1 4.2Å; F786-L789 HydrophobicContact CD1-CD2 3.87Å; F786-L789 HydrophobicContact CG-CD2 3.97Å; K787-L789 PolarHBondContact O-N 3.1Å; L789-F812 HydrophobicContact CD2-CD2 3.83Å; L789-F812 HydrophobicContact CD2-CE2 3.87Å; L789-I962 HydrophobicContact CD1-CB 3.98Å; L789-I962 HydrophobicContact CD1-CG2 3.63Å
790	N	92.7	Very high	90.7	Very high	90 Å²	90	65.1 Å²	65.1	48%	0.481	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	123.5	175.9	-75.9	-81	0	0	0	109.5	L772 Y773 S774 E788	L772-N790 WeakPolarHBondContact O-CA 3.46Å; Y773-N790 WeakPolarHBondContact CA-OD1 3.43Å; S774-N790 PolarHBondContact N-ND2 2.89Å; S774-N790 PolarHBondContact N-OD1 3.41Å; E788-N790 PolarHBondContact O-N 2.98Å; E788-N790 PolarHBondContact O-ND2 2.95Å
791	F	93.7	Very high	91	Very high	12 Å²	12	59.9 Å²	59.9	5%	0.053	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	142.6	-175.1	-177.1	-101	0	0	0	111.2	G771 L772 I793 I799 F812 L816 W955 I962	G771-F791 CarbonylContact C-O 3.59Å; G771-F791 WeakPolarHBondContact CA-O 3.49Å; L772-F791 PolarHBondContact N-O 2.76Å; L772-F791 PolarHBondContact O-N 2.71Å; F791-I793 HydrophobicContact CD1-CD1 4.25Å; F791-I793 HydrophobicContact CD1-CG1 4.27Å; F791-I793 HydrophobicContact CE1-CD1 3.76Å; F791-I793 HydrophobicContact CE1-CG1 3.58Å; F791-I793 HydrophobicContact CZ-CG1 4.25Å; F791-I799 HydrophobicContact CE2-CD1 4.12Å; F791-I799 HydrophobicContact CZ-CD1 3.62Å; F791-I799 HydrophobicContact CZ-CG2 4.26Å; F791-F812 HydrophobicContact CB-CZ 4.46Å; F791-F812 HydrophobicContact CD1-CE1 4.38Å; F791-F812 HydrophobicContact CD1-CE2 4.35Å; F791-F812 AromaticContact CD1-CZ 3.57Å; F791-F812 HydrophobicContact CD1-CZ 3.57Å; F791-F812 HydrophobicContact CD2-CZ 4.05Å; F791-F812 HydrophobicContact CE1-CE1 4.04Å; F791-F812 AromaticContact CE1-CZ 3.61Å; F791-F812 HydrophobicContact CE1-CZ 3.61Å; F791-F812 HydrophobicContact CE2-CZ 4.11Å; F791-F812 HydrophobicContact CG-CE2 4.29Å; F791-F812 AromaticContact CG-CZ 3.77Å; F791-F812 HydrophobicContact CG-CZ 3.77Å; F791-F812 HydrophobicContact CZ-CE1 4.28Å; F791-F812 AromaticContact CZ-CZ 3.88Å; F791-F812 HydrophobicContact CZ-CZ 3.88Å; F791-L816 HydrophobicContact CD1-CD2 4.13Å; F791-L816 HydrophobicContact CE1-CD1 4.14Å; F791-L816 HydrophobicContact CE1-CD2 4.33Å; F791-W955 AromaticContact CD2-CE3 3.98Å; F791-W955 HydrophobicContact CD2-CE3 3.98Å; F791-W955 HydrophobicContact CD2-CH2 4.33Å; F791-W955 AromaticContact CD2-CZ3 3.85Å; F791-W955 HydrophobicContact CD2-CZ3 3.85Å; F791-W955 AromaticContact CE2-CD2 3.93Å; F791-W955 HydrophobicContact CE2-CD2 3.93Å; F791-W955 AromaticContact CE2-CE3 3.79Å; F791-W955 HydrophobicContact CE2-CE3 3.79Å; F791-W955 HydrophobicContact CE2-CH2 4.41Å; F791-W955 HydrophobicContact CE2-CZ3 4.04Å; F791-I962 HydrophobicContact CD2-CG2 3.98Å; F791-I962 HydrophobicContact CE2-CD1 4.35Å
792	G	92.3	Very high	91.3	Very high	46 Å²	46	51.5 Å²	51.5	47%	0.474	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	151.7	-177.2	0	0	0	0	0	113
793	I	92.4	Very high	91.4	Very high	5 Å²	5	45.7 Å²	45.7	3%	0.026	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	135.2	-175.1	-55.7	133.7	0	0	0	109.9	I769 L770 F791 L816 I908 I938	I769-I793 WeakPolarHBondContact CB-O 3.31Å; L770-I793 HydrophobicContact CB-CD1 3.99Å; L770-I793 HydrophobicContact CD2-CD1 3.76Å; L770-I793 HydrophobicContact CG-CD1 3.7Å; L770-I793 PolarHBondContact O-N 3.45Å; F791-I793 HydrophobicContact CD1-CD1 4.25Å; F791-I793 HydrophobicContact CD1-CG1 4.27Å; F791-I793 HydrophobicContact CE1-CD1 3.76Å; F791-I793 HydrophobicContact CE1-CG1 3.58Å; F791-I793 HydrophobicContact CZ-CG1 4.25Å; I793-L816 HydrophobicContact CD1-CD1 4.3Å; I793-L816 HydrophobicContact CD1-CD2 3.87Å; I793-I908 HydrophobicContact CG2-CD1 4.4Å; I793-I938 HydrophobicContact CD1-CD1 3.54Å; I793-I938 HydrophobicContact CG1-CD1 3.83Å
794	D	91	Very high	91.3	Very high	80 Å²	80	39.3 Å²	39.3	43%	0.428	22%	0.22	S	C	.	.			trans	-111.3	167.8	171.1	-73.6	-49.5	0	0	0	111.4	T796 S797	D794-T796 PolarHBondContact O-N 3.28Å; D794-S797 PolarHBondContact N-OG 2.7Å; D794-S797 VanDerWaalsContact O-CB 3.29Å; D794-S797 WeakPolarHBondContact O-CB 3.46Å; D794-S797 PolarHBondContact O-N 2.7Å; D794-S797 PolarHBondContact O-OG 3.08Å
795	M	89	Confident	91	Very high	26 Å²	26	38.7 Å²	38.7	13%	0.128	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-24.8	178.6	-69	-46.8	-175.3	0	0	113.1	I765 I769 V833 D907 G935 G936	I765-M795 HydrophobicContact CB-CE 3.85Å; I765-M795 HydrophobicContact CD1-CE 3.91Å; I765-M795 HydrophobicContact CG1-CE 4.3Å; I765-M795 HydrophobicContact CG2-CE 4.47Å; I769-M795 HydrophobicContact CD1-CB 4.31Å; I769-M795 HydrophobicContact CD1-CE 4.09Å; I769-M795 HydrophobicContact CD1-CG 3.57Å; I769-M795 HydrophobicContact CD1-SD 3.96Å; I769-M795 HydrophobicContact CG2-CE 3.8Å; I769-M795 HydrophobicContact CG2-SD 4.25Å; M795-V833 HydrophobicContact CE-CG2 4.42Å; M795-D907 HydrophobicContact CE-CB 3.67Å; M795-D907 HydrophobicContact SD-CB 4.36Å; M795-G935 CarbonylContact O-C 3.3Å; M795-G935 VanDerWaalsContact O-O 3.1Å; M795-G936 WeakPolarHBondContact O-CA 3.42Å; M795-G936 PolarHBondContact O-N 3.26Å
796	T	89.6	Confident	90.5	Very high	126 Å²	126	40.4 Å²	40.4	77%	0.773	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-3.3	176.4	50.3	0	0	0	0	113.3	D794	D794-T796 PolarHBondContact O-N 3.28Å
797	S	92.1	Very high	90.2	Very high	24 Å²	24	42.3 Å²	42.3	17%	0.168	25%	0.252	C	S	.	.			trans	-65.5	138	-178.1	-62.7	0	0	0	0	111.9	D794 V937	D794-S797 PolarHBondContact N-OG 2.7Å; D794-S797 VanDerWaalsContact O-CB 3.29Å; D794-S797 WeakPolarHBondContact O-CB 3.46Å; D794-S797 PolarHBondContact O-N 2.7Å; D794-S797 PolarHBondContact O-OG 3.08Å; S797-V937 PolarHBondContact O-N 3.03Å
798	R	93.3	Very high	89.9	Confident	39 Å²	39	37.4 Å²	37.4	15%	0.147	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	100.8	170.7	-69.5	-62.1	-176.6	-88.4	8.5	107.6	I930 F933 G935 I953	R798-I930 PolarHBondContact NH2-O 2.96Å; R798-F933 PolarHBondContact NH2-O 3.39Å; R798-G935 PolarHBondContact NH1-O 3.4Å; R798-I953 PolarHBondContact O-N 2.96Å
799	I	94.1	Very high	89.8	Confident	7 Å²	7	32.8 Å²	32.8	4%	0.036	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	124.3	-170.5	-63.1	176.8	0	0	0	109.5	F791 I801 V937 I938 V939 W955	F791-I799 HydrophobicContact CE2-CD1 4.12Å; F791-I799 HydrophobicContact CZ-CD1 3.62Å; F791-I799 HydrophobicContact CZ-CG2 4.26Å; I799-I801 HydrophobicContact CG2-CG1 4.18Å; I799-V937 PolarHBondContact N-O 3.37Å; I799-I938 CarbonylContact O-C 3.48Å; I799-I938 WeakPolarHBondContact O-CA 3.5Å; I799-V939 PolarHBondContact O-N 2.85Å; I799-W955 HydrophobicContact CG2-CB 4.21Å; I799-W955 HydrophobicContact CG2-CG 3.98Å
800	S	93.6	Very high	89.6	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	118.2	170.7	-180	0	0	0	0	109.9	V939 I947 I953 W955	S800-V939 CarbonylContact C-O 3.5Å; S800-V939 VanDerWaalsContact CA-O 3.3Å; S800-V939 WeakPolarHBondContact CA-O 3.32Å; S800-I947 WeakPolarHBondContact OG-CD1 3.47Å; S800-I947 WeakPolarHBondContact OG-CG1 3.28Å; S800-I953 PolarHBondContact N-O 2.9Å; S800-W955 PolarHBondContact O-N 2.97Å
801	I	93.1	Very high	89.4	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	121.2	-178.6	-58.3	165.8	0	0	0	109.4	I799 K809 F812 L813 I938 V939 V940 W955 I957	I799-I801 HydrophobicContact CG2-CG1 4.18Å; I801-K809 HydrophobicContact CG2-CG 4.22Å; I801-F812 HydrophobicContact CD1-CD1 3.62Å; I801-F812 HydrophobicContact CD1-CE1 3.51Å; I801-F812 HydrophobicContact CG1-CE1 4.43Å; I801-L813 HydrophobicContact CD1-CD2 3.71Å; I801-I938 HydrophobicContact CD1-CG2 3.47Å; I801-I938 VanDerWaalsContact CD1-CG2 3.47Å; I801-I938 HydrophobicContact CG1-CG2 4.12Å; I801-V939 PolarHBondContact N-O 3.14Å; I801-V940 HydrophobicContact CB-CG2 3.99Å; I801-V940 HydrophobicContact CD1-CG2 4.39Å; I801-V940 HydrophobicContact CG2-CG2 4.45Å; I801-W955 CarbonylContact C-O 3.53Å; I801-W955 WeakPolarHBondContact CA-O 3.44Å; I801-I957 HydrophobicContact CG2-CD1 3.66Å; I801-I957 HydrophobicContact CG2-CG1 4.05Å
802	V	90.8	Very high	89.4	Confident	2 Å²	2	30.7 Å²	30.7	1%	0.012	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	166.4	-179.1	-60.7	0	0	0	0	111.9	L628 L954 W955 V956 I957 I965 Y972	L628-V802 HydrophobicContact CD2-CB 4.26Å; L628-V802 HydrophobicContact CD2-CG1 3.57Å; V802-L954 HydrophobicContact CG1-CD2 3.63Å; V802-L954 HydrophobicContact CG2-CD2 4.42Å; V802-W955 PolarHBondContact N-O 3.47Å; V802-V956 HydrophobicContact CG2-CB 3.95Å; V802-V956 HydrophobicContact CG2-CG2 4.27Å; V802-I957 PolarHBondContact O-N 2.97Å; V802-I957 VanDerWaalsContact O-N 3.13Å; V802-I965 HydrophobicContact CG2-CD1 3.76Å; V802-Y972 HydrophobicContact CB-CE1 4.24Å; V802-Y972 HydrophobicContact CG2-CE1 4.12Å; V802-Y972 HydrophobicContact CG2-CE2 4.16Å
803	G	86.3	Confident	89.5	Confident	1 Å²	1	28.5 Å²	28.5	1%	0.01	18%	0.182	C	C	.	.			trans	134.7	162.4	-175.7	0	0	0	0	0	113	K809	G803-K809 WeakPolarHBondContact O-CE 3.09Å; G803-K809 PolarHBondContact O-NZ 2.79Å
804	P	84.8	Confident	89.5	Confident	47 Å²	47	31.1 Å²	31.1	31%	0.305	19%	0.193	S	C	.	.			trans	-68.1	153.2	-174.8	27.1	-33.6	0	0	0	112.7	G806 V807	P804-G806 PolarHBondContact O-N 3.41Å; P804-V807 HydrophobicContact CG-CB 4.23Å; P804-V807 WeakPolarHBondContact O-CB 3.25Å; P804-V807 VanDerWaalsContact O-CG1 3.29Å; P804-V807 WeakPolarHBondContact O-CG1 3.45Å; P804-V807 PolarHBondContact O-N 3.04Å
805	N	83.5	Confident	89.6	Confident	42 Å²	42	27.4 Å²	27.4	23%	0.225	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	135.8	176.9	-80.9	-0.4	0	0	0	111.6	W600 R603 D627 K809	W600-N805 HydrophobicContact CZ2-CB 4.49Å; R603-N805 PolarHBondContact NH2-ND2 3.37Å; R603-N805 VanDerWaalsContact NH2-ND2 3.13Å; D627-N805 HydrophobicContact CB-CB 4.48Å; D627-N805 WeakPolarHBondContact OD2-CB 3.34Å; D627-N805 PolarHBondContact OD2-N 2.59Å; N805-K809 WeakPolarHBondContact OD1-CE 3.34Å; N805-K809 PolarHBondContact OD1-NZ 2.81Å
806	G	79	Confident	89.8	Confident	72 Å²	72	26.2 Å²	26.2	74%	0.742	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	97.2	-14.4	-172.5	0	0	0	0	0	115.2	P804 G808	P804-G806 PolarHBondContact O-N 3.41Å; G806-G808 PolarHBondContact O-N 3.17Å
807	V	86.5	Confident	89.9	Confident	39 Å²	39	21.5 Å²	21.5	24%	0.236	14%	0.138	C	C	.	.	S	Bend	trans	-70.5	-16.2	-178.7	83	0	0	0	0	114.3	P804 K809 I957	P804-V807 HydrophobicContact CG-CB 4.23Å; P804-V807 WeakPolarHBondContact O-CB 3.25Å; P804-V807 VanDerWaalsContact O-CG1 3.29Å; P804-V807 WeakPolarHBondContact O-CG1 3.45Å; P804-V807 PolarHBondContact O-N 3.04Å; V807-K809 HydrophobicContact CG1-CG 4.14Å; V807-I957 HydrophobicContact CG1-CB 3.99Å; V807-I957 HydrophobicContact CG1-CG2 3.85Å; V807-I957 HydrophobicContact CG2-CG2 4.04Å; V807-I957 WeakPolarHBondContact CG2-O 3.46Å
808	G	85.4	Confident	89.8	Confident	6 Å²	6	21.3 Å²	21.3	6%	0.062	14%	0.14	C	C	.	.	S	Bend	trans	119.5	8	175.5	0	0	0	0	0	116.4	G806 S810 T811 F812	G806-G808 PolarHBondContact O-N 3.17Å; G808-S810 PolarHBondContact O-N 2.78Å; G808-T811 CarbonylContact O-C 3.58Å; G808-T811 VanDerWaalsContact O-CA 3.28Å; G808-T811 WeakPolarHBondContact O-CA 3.3Å; G808-T811 WeakPolarHBondContact O-CB 3.37Å; G808-T811 PolarHBondContact O-N 3.43Å; G808-F812 PolarHBondContact O-N 2.71Å
809	K	89.3	Confident	89.7	Confident	18 Å²	18	24.4 Å²	24.4	8%	0.078	16%	0.156	C	C	.	.	H	α-helix	trans	-42.2	-59.3	-179.9	-65.2	-179.5	-64.9	-171.1	0	114.2	I801 G803 N805 V807 T811 F812 L813 V940 I957	I801-K809 HydrophobicContact CG2-CG 4.22Å; G803-K809 WeakPolarHBondContact O-CE 3.09Å; G803-K809 PolarHBondContact O-NZ 2.79Å; N805-K809 WeakPolarHBondContact OD1-CE 3.34Å; N805-K809 PolarHBondContact OD1-NZ 2.81Å; V807-K809 HydrophobicContact CG1-CG 4.14Å; K809-T811 PolarHBondContact O-N 3.24Å; K809-F812 WeakPolarHBondContact O-CB 3.14Å; K809-F812 PolarHBondContact O-N 3.2Å; K809-L813 PolarHBondContact O-N 3.05Å; K809-V940 HydrophobicContact CB-CG2 4.38Å; K809-V940 HydrophobicContact CD-CG1 4.14Å; K809-I957 HydrophobicContact CG-CD1 4.22Å
810	S	88.2	Confident	89.6	Confident	48 Å²	48	25.3 Å²	25.3	34%	0.336	16%	0.162	S	C	.	.	H	α-helix	trans	-68.2	-19.1	177.7	-44.4	0	0	0	0	113.8	G808 K814 D912	G808-S810 PolarHBondContact O-N 2.78Å; S810-K814 WeakPolarHBondContact O-CD 3.44Å; S810-K814 WeakPolarHBondContact O-CG 3.48Å; S810-K814 PolarHBondContact O-N 3.42Å; S810-K814 VanDerWaalsContact O-N 3.12Å; S810-D912 WeakPolarHBondContact CB-OD2 3.48Å; S810-D912 PolarHBondContact OG-OD2 3.45Å
811	T	90.3	Very high	89.5	Confident	15 Å²	15	31.8 Å²	31.8	9%	0.092	19%	0.192	C	C	.	.	H	α-helix	trans	-76.5	-41.1	172.8	-52.7	0	0	0	0	110.8	F777 Y779 L785 F786 G808 K809 L813 K814 L815	F777-T811 HydrophobicContact CD1-CG2 3.75Å; F777-T811 HydrophobicContact CE1-CG2 3.54Å; F777-T811 HydrophobicContact CZ-CG2 4.48Å; Y779-T811 HydrophobicContact CE2-CG2 4.03Å; Y779-T811 WeakPolarHBondContact OH-CG2 3.47Å; Y779-T811 PolarHBondContact OH-OG1 3.48Å; L785-T811 HydrophobicContact CD1-CG2 4.15Å; F786-T811 HydrophobicContact CE2-CG2 4.3Å; G808-T811 CarbonylContact O-C 3.58Å; G808-T811 VanDerWaalsContact O-CA 3.28Å; G808-T811 WeakPolarHBondContact O-CA 3.3Å; G808-T811 WeakPolarHBondContact O-CB 3.37Å; G808-T811 PolarHBondContact O-N 3.43Å; K809-T811 PolarHBondContact O-N 3.24Å; T811-L813 VanDerWaalsContact C-N 3.34Å; T811-K814 CarbonylContact O-C 3.57Å; T811-K814 WeakPolarHBondContact O-CB 3.5Å; T811-K814 PolarHBondContact O-N 3.07Å; T811-K814 VanDerWaalsContact O-N 3.1Å; T811-L815 WeakPolarHBondContact O-CG 3.29Å; T811-L815 PolarHBondContact O-N 3.39Å
812	F	93.3	Very high	89.5	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-59.2	-44.4	170.2	177.8	-90.8	0	0	0	111.1	L772 F786 L789 F791 I801 G808 K809 K814 L815 L816 I957 I962	L772-F812 HydrophobicContact CD1-CD2 4.47Å; L772-F812 HydrophobicContact CD1-CE2 4.2Å; F786-F812 HydrophobicContact CE1-CB 4.32Å; F786-F812 HydrophobicContact CE1-CD2 4.24Å; F786-F812 HydrophobicContact CE2-CB 4.23Å; F786-F812 HydrophobicContact CZ-CB 3.7Å; F786-F812 HydrophobicContact CZ-CD2 4.4Å; L789-F812 HydrophobicContact CD2-CD2 3.83Å; L789-F812 HydrophobicContact CD2-CE2 3.87Å; F791-F812 HydrophobicContact CB-CZ 4.46Å; F791-F812 HydrophobicContact CD1-CE1 4.38Å; F791-F812 HydrophobicContact CD1-CE2 4.35Å; F791-F812 AromaticContact CD1-CZ 3.57Å; F791-F812 HydrophobicContact CD1-CZ 3.57Å; F791-F812 HydrophobicContact CD2-CZ 4.05Å; F791-F812 HydrophobicContact CE1-CE1 4.04Å; F791-F812 AromaticContact CE1-CZ 3.61Å; F791-F812 HydrophobicContact CE1-CZ 3.61Å; F791-F812 HydrophobicContact CE2-CZ 4.11Å; F791-F812 HydrophobicContact CG-CE2 4.29Å; F791-F812 AromaticContact CG-CZ 3.77Å; F791-F812 HydrophobicContact CG-CZ 3.77Å; F791-F812 HydrophobicContact CZ-CE1 4.28Å; F791-F812 AromaticContact CZ-CZ 3.88Å; F791-F812 HydrophobicContact CZ-CZ 3.88Å; I801-F812 HydrophobicContact CD1-CD1 3.62Å; I801-F812 HydrophobicContact CD1-CE1 3.51Å; I801-F812 HydrophobicContact CG1-CE1 4.43Å; G808-F812 PolarHBondContact O-N 2.71Å; K809-F812 WeakPolarHBondContact O-CB 3.14Å; K809-F812 PolarHBondContact O-N 3.2Å; F812-K814 VanDerWaalsContact C-N 3.29Å; F812-K814 PolarHBondContact O-N 3.4Å; F812-L815 WeakPolarHBondContact O-CB 3.37Å; F812-L815 PolarHBondContact O-N 3.28Å; F812-L816 HydrophobicContact CD1-CD1 3.87Å; F812-L816 HydrophobicContact CD1-CG 4.36Å; F812-L816 HydrophobicContact CE1-CD1 3.43Å; F812-L816 VanDerWaalsContact CE1-CD1 3.43Å; F812-L816 HydrophobicContact CE1-CG 4.14Å; F812-L816 HydrophobicContact CZ-CD1 4.11Å; F812-L816 WeakPolarHBondContact O-CG 3.41Å; F812-L816 PolarHBondContact O-N 3.41Å; F812-I957 HydrophobicContact CB-CD1 3.96Å; F812-I957 HydrophobicContact CD2-CD1 4.47Å; F812-I957 HydrophobicContact CG-CD1 4.13Å; F812-I962 HydrophobicContact CD2-CD1 4.48Å; F812-I962 HydrophobicContact CE1-CD1 4.09Å; F812-I962 HydrophobicContact CE2-CD1 3.81Å; F812-I962 HydrophobicContact CE2-CG2 4.29Å; F812-I962 HydrophobicContact CZ-CD1 3.58Å
813	L	93.2	Very high	89.6	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-60.8	-36.3	172.8	-63.8	-169.7	0	0	0	112.7	I801 K809 T811 L816 T817 I910 D912 I938 V940	I801-L813 HydrophobicContact CD1-CD2 3.71Å; K809-L813 PolarHBondContact O-N 3.05Å; T811-L813 VanDerWaalsContact C-N 3.34Å; L813-L816 HydrophobicContact CD2-CD1 4.37Å; L813-L816 PolarHBondContact O-N 2.9Å; L813-T817 WeakPolarHBondContact O-CG2 3.27Å; L813-T817 PolarHBondContact O-N 3Å; L813-T817 PolarHBondContact O-OG1 3.26Å; L813-I910 HydrophobicContact CB-CG2 4.21Å; L813-I910 HydrophobicContact CD1-CG2 3.87Å; L813-I910 HydrophobicContact CD2-CG2 3.7Å; L813-I910 HydrophobicContact CG-CG2 4.14Å; L813-D912 HydrophobicContact CD1-CB 3.66Å; L813-I938 HydrophobicContact CD2-CG2 4.01Å; L813-V940 HydrophobicContact CD1-CG2 3.86Å; L813-V940 HydrophobicContact CG-CG2 4.34Å
814	K	92.3	Very high	89.9	Confident	60 Å²	60	42.9 Å²	42.9	26%	0.261	26%	0.257	S	S	.	.	H	α-helix	trans	-71.5	-31.8	175.8	-75.5	169.7	-179.2	173.7	0	113.9	S810 T811 F812 T817 G818 E819 V820	S810-K814 WeakPolarHBondContact O-CD 3.44Å; S810-K814 WeakPolarHBondContact O-CG 3.48Å; S810-K814 PolarHBondContact O-N 3.42Å; S810-K814 VanDerWaalsContact O-N 3.12Å; T811-K814 CarbonylContact O-C 3.57Å; T811-K814 WeakPolarHBondContact O-CB 3.5Å; T811-K814 PolarHBondContact O-N 3.07Å; T811-K814 VanDerWaalsContact O-N 3.1Å; F812-K814 VanDerWaalsContact C-N 3.29Å; F812-K814 PolarHBondContact O-N 3.4Å; K814-T817 WeakPolarHBondContact CA-OG1 3.44Å; K814-T817 PolarHBondContact O-OG1 2.89Å; K814-G818 PolarHBondContact O-N 3.03Å; K814-E819 HydrophobicContact CB-CB 4.07Å; K814-E819 HydrophobicContact CG-CB 4.09Å; K814-E819 PolarHBondContact O-N 2.9Å; K814-V820 HydrophobicContact CB-CB 4.17Å; K814-V820 HydrophobicContact CB-CG2 3.8Å; K814-V820 HydrophobicContact CD-CG2 4.45Å; K814-V820 PolarHBondContact O-N 3.43Å
815	L	93.4	Very high	90.3	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.01	26%	0.257	C	S	.	.	H	α-helix	trans	-66.8	-40.2	167.7	-69.9	166.1	0	0	0	110.3	L772 V775 F777 F786 T811 F812 G818 V820 R827	L772-L815 HydrophobicContact CD1-CB 4.31Å; V775-L815 HydrophobicContact CG1-CD1 4.28Å; F777-L815 HydrophobicContact CB-CD1 4.04Å; F777-L815 HydrophobicContact CB-CD2 4.41Å; F777-L815 HydrophobicContact CD2-CD2 4.2Å; F777-L815 HydrophobicContact CG-CD1 4.26Å; F777-L815 HydrophobicContact CG-CD2 4.26Å; F786-L815 HydrophobicContact CD2-CD1 3.88Å; F786-L815 HydrophobicContact CE2-CD1 4.19Å; T811-L815 WeakPolarHBondContact O-CG 3.29Å; T811-L815 PolarHBondContact O-N 3.39Å; F812-L815 WeakPolarHBondContact O-CB 3.37Å; F812-L815 PolarHBondContact O-N 3.28Å; L815-G818 PolarHBondContact O-N 3.33Å; L815-V820 HydrophobicContact CD2-CB 4.33Å; L815-V820 HydrophobicContact CD2-CG1 3.88Å; L815-V820 HydrophobicContact CG-CG1 4.45Å; L815-R827 WeakPolarHBondContact O-CD 3.48Å; L815-R827 PolarHBondContact O-NE 2.94Å; L815-R827 VanDerWaalsContact O-NE 3.16Å
816	L	92.9	Very high	90.8	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-67	-41.2	175.2	-71.8	-179.8	0	0	0	113.3	L770 L772 F791 I793 F812 L813 G818 R827 I910 I938	L770-L816 HydrophobicContact CD2-CB 4.32Å; L770-L816 HydrophobicContact CD2-CD2 4.23Å; L770-L816 HydrophobicContact CG-CD2 4.22Å; L772-L816 HydrophobicContact CD1-CD2 3.99Å; L772-L816 HydrophobicContact CD1-CG 4.49Å; L772-L816 HydrophobicContact CD2-CD2 4.29Å; L772-L816 HydrophobicContact CG-CD2 3.91Å; F791-L816 HydrophobicContact CD1-CD2 4.13Å; F791-L816 HydrophobicContact CE1-CD1 4.14Å; F791-L816 HydrophobicContact CE1-CD2 4.33Å; I793-L816 HydrophobicContact CD1-CD1 4.3Å; I793-L816 HydrophobicContact CD1-CD2 3.87Å; F812-L816 HydrophobicContact CD1-CD1 3.87Å; F812-L816 HydrophobicContact CD1-CG 4.36Å; F812-L816 HydrophobicContact CE1-CD1 3.43Å; F812-L816 VanDerWaalsContact CE1-CD1 3.43Å; F812-L816 HydrophobicContact CE1-CG 4.14Å; F812-L816 HydrophobicContact CZ-CD1 4.11Å; F812-L816 WeakPolarHBondContact O-CG 3.41Å; F812-L816 PolarHBondContact O-N 3.41Å; L813-L816 HydrophobicContact CD2-CD1 4.37Å; L813-L816 PolarHBondContact O-N 2.9Å; L816-G818 VanDerWaalsContact C-N 3.35Å; L816-R827 VanDerWaalsContact O-CZ 3.3Å; L816-R827 PolarHBondContact O-NE 2.98Å; L816-R827 PolarHBondContact O-NH2 3.39Å; L816-I910 HydrophobicContact CB-CD1 4.04Å; L816-I938 HydrophobicContact CD1-CD1 3.65Å
817	T	92.2	Very high	91.5	Very high	27 Å²	27	44 Å²	44	17%	0.166	24%	0.242	C	C	.	.	H	α-helix	trans	-73.5	-26	175.6	59.7	0	0	0	0	113	L813 K814 E819 R827 I835 K837 I910	L813-T817 WeakPolarHBondContact O-CG2 3.27Å; L813-T817 PolarHBondContact O-N 3Å; L813-T817 PolarHBondContact O-OG1 3.26Å; K814-T817 WeakPolarHBondContact CA-OG1 3.44Å; K814-T817 PolarHBondContact O-OG1 2.89Å; T817-E819 WeakPolarHBondContact CB-OE1 3.46Å; T817-E819 WeakPolarHBondContact OG1-CG 3.46Å; T817-E819 PolarHBondContact OG1-N 3.37Å; T817-E819 PolarHBondContact OG1-OE1 3.01Å; T817-R827 PolarHBondContact O-NH2 3.36Å; T817-I835 HydrophobicContact CG2-CG2 4.18Å; T817-K837 HydrophobicContact CG2-CB 4.24Å; T817-K837 HydrophobicContact CG2-CD 4.07Å; T817-K837 HydrophobicContact CG2-CG 4.08Å; T817-I910 HydrophobicContact CG2-CD1 4.08Å
818	G	91.1	Very high	91.8	Very high	21 Å²	21	47.6 Å²	47.6	22%	0.216	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.1	13.1	-174.7	0	0	0	0	0	113.9	K814 L815 L816 V820	K814-G818 PolarHBondContact O-N 3.03Å; L815-G818 PolarHBondContact O-N 3.33Å; L816-G818 VanDerWaalsContact C-N 3.35Å; G818-V820 PolarHBondContact O-N 3.35Å
819	E	90.5	Very high	92.2	Very high	104 Å²	104	50.3 Å²	50.3	49%	0.486	27%	0.265	S	S	.	.	S	Bend	trans	-63.2	-28	168.3	-78.3	162.3	-110.6	0	0	112.2	K814 T817 K837	K814-E819 HydrophobicContact CB-CB 4.07Å; K814-E819 HydrophobicContact CG-CB 4.09Å; K814-E819 PolarHBondContact O-N 2.9Å; T817-E819 WeakPolarHBondContact CB-OE1 3.46Å; T817-E819 WeakPolarHBondContact OG1-CG 3.46Å; T817-E819 PolarHBondContact OG1-N 3.37Å; T817-E819 PolarHBondContact OG1-OE1 3.01Å; E819-K837 VanDerWaalsContact OE1-CD 3.24Å; E819-K837 WeakPolarHBondContact OE1-CD 3.48Å; E819-K837 VanDerWaalsContact OE1-CE 3.23Å; E819-K837 WeakPolarHBondContact OE1-CE 3.18Å; E819-K837 IonicContact OE1-NZ 2.7Å; E819-K837 PolarHBondContact OE1-NZ 2.94Å; E819-K837 IonicContact OE2-NZ 3.77Å; E819-K837 PolarHBondContact OE2-NZ 3.04Å
820	V	92.3	Very high	92.3	Very high	25 Å²	25	50.5 Å²	50.5	15%	0.152	27%	0.266	C	S	.	.	S	Bend	trans	-122.6	134.2	177.7	171.9	0	0	0	0	108.2	F777 K814 L815 G818	F777-V820 HydrophobicContact CD2-CG1 3.86Å; F777-V820 HydrophobicContact CE1-CG1 4.26Å; F777-V820 HydrophobicContact CE2-CG1 3.24Å; F777-V820 HydrophobicContact CZ-CG1 3.49Å; F777-V820 VanDerWaalsContact CZ-CG1 3.49Å; K814-V820 HydrophobicContact CB-CB 4.17Å; K814-V820 HydrophobicContact CB-CG2 3.8Å; K814-V820 HydrophobicContact CD-CG2 4.45Å; K814-V820 PolarHBondContact O-N 3.43Å; L815-V820 HydrophobicContact CD2-CB 4.33Å; L815-V820 HydrophobicContact CD2-CG1 3.88Å; L815-V820 HydrophobicContact CG-CG1 4.45Å; G818-V820 PolarHBondContact O-N 3.35Å
821	Q	92	Very high	92.3	Very high	136 Å²	136	55.8 Å²	55.8	64%	0.636	29%	0.286	S	S	*	.			trans	-87	144.1	173.1	-61.7	-58.2	-34.6	0	0	110.2	F777	F777-Q821 WeakPolarHBondContact CD2-O 3.26Å
822	P	93	Very high	92.3	Very high	30 Å²	30	63.4 Å²	63.4	20%	0.195	31%	0.313	C	S	.	.			trans	-65.1	155.9	172.9	31.2	-36.5	0	0	0	111	V775	V775-P822 HydrophobicContact CB-CB 4.47Å; V775-P822 HydrophobicContact CG1-CB 3.81Å; V775-P822 HydrophobicContact CG2-CB 4.06Å
823	T	92.2	Very high	92.2	Very high	95 Å²	95	64 Å²	64	58%	0.583	32%	0.317	S	S	*	.	S	Bend	trans	-82.2	-35.4	173.9	-48.4	0	0	0	0	111.1	T776 A778	T776-T823 WeakPolarHBondContact O-CA 3.37Å; T776-T823 WeakPolarHBondContact O-CB 3.44Å; T776-T823 PolarHBondContact O-N 3.04Å; A778-T823 PolarHBondContact N-OG1 2.92Å
824	D	93.3	Very high	92.2	Very high	113 Å²	113	69.5 Å²	69.5	60%	0.604	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.3	161	170.1	-175.4	24.2	0	0	0	108.9	V775 T776	V775-D824 CarbonylContact C-O 3.59Å; V775-D824 WeakPolarHBondContact CA-O 3.3Å; T776-D824 PolarHBondContact N-O 2.6Å; T776-D824 PolarHBondContact O-N 3.13Å; T776-D824 VanDerWaalsContact O-N 3.15Å
825	G	92	Very high	92.2	Very high	31 Å²	31	68.5 Å²	68.5	32%	0.32	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	78	-176	-169	0	0	0	0	0	113.5	Y773	Y773-G825 WeakPolarHBondContact O-CA 3.36Å
826	E	93.6	Very high	92.2	Very high	88 Å²	88	68.4 Å²	68.4	41%	0.411	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	152.9	-174.3	66.6	170.3	125.4	0	0	114.6	Y773 V775 R828	Y773-E826 HydrophobicContact CD2-CG 4.47Å; Y773-E826 PolarHBondContact N-O 3.02Å; Y773-E826 PolarHBondContact O-N 3.14Å; V775-E826 WeakPolarHBondContact CG2-O 3.45Å; E826-R828 HydrophobicContact CG-CG 4.41Å; E826-R828 IonicContact OE1-CZ 2.79Å; E826-R828 IonicContact OE1-NE 2.81Å; E826-R828 PolarHBondContact OE1-NE 3.46Å; E826-R828 IonicContact OE1-NH2 3.21Å; E826-R828 PolarHBondContact OE1-NH2 3.04Å; E826-R828 WeakPolarHBondContact OE2-CG 3.4Å; E826-R828 IonicContact OE2-CZ 2.96Å; E826-R828 IonicContact OE2-NE 3.87Å; E826-R828 PolarHBondContact OE2-NE 3.47Å; E826-R828 IonicContact OE2-NH2 2.78Å
827	R	94.2	Very high	92.1	Very high	64 Å²	64	70.2 Å²	70.2	24%	0.242	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	117	172.9	174.6	-160.2	178.4	-110.3	-0.7	109	L770 G771 L772 L815 L816 T817	L770-R827 HydrophobicContact CD1-CG 4.4Å; G771-R827 WeakPolarHBondContact O-CA 3.29Å; L772-R827 HydrophobicContact CD2-CB 3.87Å; L772-R827 HydrophobicContact CD2-CG 3.83Å; L815-R827 WeakPolarHBondContact O-CD 3.48Å; L815-R827 PolarHBondContact O-NE 2.94Å; L815-R827 VanDerWaalsContact O-NE 3.16Å; L816-R827 VanDerWaalsContact O-CZ 3.3Å; L816-R827 PolarHBondContact O-NE 2.98Å; L816-R827 PolarHBondContact O-NH2 3.39Å; T817-R827 PolarHBondContact O-NH2 3.36Å
828	R	93.6	Very high	92.1	Very high	115 Å²	115	69.3 Å²	69.3	43%	0.434	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	130.4	175.7	-55.9	-177.7	-175.3	149.3	-1	110.4	L770 G771 Y773 E826	L770-R828 WeakPolarHBondContact CA-O 3.44Å; G771-R828 PolarHBondContact N-O 2.83Å; G771-R828 PolarHBondContact O-N 3.39Å; Y773-R828 HydrophobicContact CD2-CB 4.37Å; Y773-R828 HydrophobicContact CD2-CG 3.87Å; Y773-R828 HydrophobicContact CE2-CB 3.92Å; Y773-R828 HydrophobicContact CE2-CG 3.8Å; E826-R828 HydrophobicContact CG-CG 4.41Å; E826-R828 IonicContact OE1-CZ 2.79Å; E826-R828 IonicContact OE1-NE 2.81Å; E826-R828 PolarHBondContact OE1-NE 3.46Å; E826-R828 IonicContact OE1-NH2 3.21Å; E826-R828 PolarHBondContact OE1-NH2 3.04Å; E826-R828 WeakPolarHBondContact OE2-CG 3.4Å; E826-R828 IonicContact OE2-CZ 2.96Å; E826-R828 IonicContact OE2-NE 3.87Å; E826-R828 PolarHBondContact OE2-NE 3.47Å; E826-R828 IonicContact OE2-NH2 2.78Å
829	L	92.8	Very high	91.8	Very high	64 Å²	64	69 Å²	69	34%	0.335	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	134.7	174.8	173.6	67.4	0	0	0	108.6	I769 L770 H831 V833 I835	I769-L829 WeakPolarHBondContact O-CA 3.38Å; L770-L829 HydrophobicContact CB-CD1 4.09Å; L770-L829 HydrophobicContact CD1-CB 4.23Å; L770-L829 HydrophobicContact CD1-CD1 4.15Å; L829-H831 PolarHBondContact O-N 3.27Å; L829-V833 HydrophobicContact CD1-CB 3.82Å; L829-V833 HydrophobicContact CD1-CG1 3.87Å; L829-I835 HydrophobicContact CD1-CD1 4.1Å; L829-I835 HydrophobicContact CD1-CG1 4.45Å; L829-I835 HydrophobicContact CD2-CD1 4.1Å
830	N	92.3	Very high	91.1	Very high	21 Å²	21	67.3 Å²	67.3	11%	0.112	32%	0.324	C	S	.	.			trans	-69.5	125	172.3	-178	-28.6	0	0	0	110.3	I765 S766 P768 I769 R832 V833	I765-N830 HydrophobicContact CG2-CB 4.48Å; I765-N830 VanDerWaalsContact CG2-ND2 3.33Å; I765-N830 WeakPolarHBondContact CG2-ND2 3.43Å; S766-N830 PolarHBondContact O-ND2 3.23Å; P768-N830 WeakPolarHBondContact O-CB 3.37Å; I769-N830 PolarHBondContact O-N 2.74Å; N830-R832 PolarHBondContact O-N 3.3Å; N830-R832 PolarHBondContact OD1-N 3.32Å; N830-V833 HydrophobicContact CB-CG2 3.83Å; N830-V833 WeakPolarHBondContact O-CB 3.35Å; N830-V833 PolarHBondContact O-N 3.41Å
831	H	88.6	Confident	90.4	Very high	160 Å²	160	70.9 Å²	70.9	74%	0.741	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	-13.6	-176.6	69	-79.5	0	0	0	116.9	L829	L829-H831 PolarHBondContact O-N 3.27Å
832	R	90.3	Very high	89.2	Confident	174 Å²	174	65.4 Å²	65.4	66%	0.657	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-17.2	178.1	-55.9	-170.4	179.8	-171.4	-2.4	114.2	I765 N830	I765-R832 HydrophobicContact CD1-CB 4.09Å; I765-R832 HydrophobicContact CG1-CB 4.45Å; N830-R832 PolarHBondContact O-N 3.3Å; N830-R832 PolarHBondContact OD1-N 3.32Å
833	V	91.3	Very high	87.9	Confident	14 Å²	14	64.3 Å²	64.3	9%	0.085	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-79.4	126.8	-170.1	175.8	0	0	0	0	110.8	I765 I769 M795 L829 N830 D907 I908	I765-V833 HydrophobicContact CD1-CG2 3.84Å; I765-V833 HydrophobicContact CG2-CG2 3.94Å; I769-V833 HydrophobicContact CG2-CG1 4.23Å; I769-V833 HydrophobicContact CG2-CG2 3.53Å; M795-V833 HydrophobicContact CE-CG2 4.42Å; L829-V833 HydrophobicContact CD1-CB 3.82Å; L829-V833 HydrophobicContact CD1-CG1 3.87Å; N830-V833 HydrophobicContact CB-CG2 3.83Å; N830-V833 WeakPolarHBondContact O-CB 3.35Å; N830-V833 PolarHBondContact O-N 3.41Å; V833-D907 HydrophobicContact CG1-CB 4.46Å; V833-I908 HydrophobicContact CG1-CD1 3.83Å; V833-I908 HydrophobicContact CG1-CG1 3.96Å
834	K	91.7	Very high	86.9	Confident	115 Å²	115	63.8 Å²	63.8	50%	0.5	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-96.7	121.4	171.6	-61.8	167.1	-173.4	169.4	0	109.7	A905 D907 I908	K834-A905 VanDerWaalsContact CD-O 3.26Å; K834-A905 WeakPolarHBondContact CD-O 3.38Å; K834-D907 WeakPolarHBondContact CB-OD2 3.38Å; K834-D907 PolarHBondContact N-OD2 2.77Å; K834-D907 PolarHBondContact O-N 2.97Å; K834-I908 PolarHBondContact O-N 2.8Å
835	I	93	Very high	86	Confident	39 Å²	39	64.6 Å²	64.6	20%	0.2	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	120.7	173.7	-58.5	171.5	0	0	0	109	L770 T817 L829 I910	L770-I835 HydrophobicContact CD2-CD1 3.9Å; T817-I835 HydrophobicContact CG2-CG2 4.18Å; L829-I835 HydrophobicContact CD1-CD1 4.1Å; L829-I835 HydrophobicContact CD1-CG1 4.45Å; L829-I835 HydrophobicContact CD2-CD1 4.1Å; I835-I910 HydrophobicContact CG2-CD1 3.63Å; I835-I910 HydrophobicContact CG2-CG1 3.95Å
836	G	92.6	Very high	85.5	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	97.1	171.5	0	0	0	0	0	110.3	L901 P906 I908 I910	G836-L901 VanDerWaalsContact CA-CD1 3.47Å; G836-P906 VanDerWaalsContact N-CB 3.35Å; G836-I908 PolarHBondContact N-O 2.93Å; G836-I910 PolarHBondContact O-N 2.93Å
837	K	92	Very high	84.9	Confident	39 Å²	39	62.5 Å²	62.5	17%	0.17	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	133.5	175	-166.5	-161	-174.6	-168.6	0	111.3	T817 E819 D839 I910	T817-K837 HydrophobicContact CG2-CB 4.24Å; T817-K837 HydrophobicContact CG2-CD 4.07Å; T817-K837 HydrophobicContact CG2-CG 4.08Å; E819-K837 VanDerWaalsContact OE1-CD 3.24Å; E819-K837 WeakPolarHBondContact OE1-CD 3.48Å; E819-K837 VanDerWaalsContact OE1-CE 3.23Å; E819-K837 WeakPolarHBondContact OE1-CE 3.18Å; E819-K837 IonicContact OE1-NZ 2.7Å; E819-K837 PolarHBondContact OE1-NZ 2.94Å; E819-K837 IonicContact OE2-NZ 3.77Å; E819-K837 PolarHBondContact OE2-NZ 3.04Å; K837-D839 HydrophobicContact CD-CB 4.45Å; K837-D839 VanDerWaalsContact CE-OD2 3.25Å; K837-D839 WeakPolarHBondContact CE-OD2 3.48Å; K837-D839 IonicContact NZ-OD2 3.4Å; K837-D839 PolarHBondContact NZ-OD2 3.25Å; K837-I910 CarbonylContact C-O 3.55Å; K837-I910 WeakPolarHBondContact CA-O 3.32Å
838	Y	91.7	Very high	84.4	Confident	8 Å²	8	63.7 Å²	63.7	3%	0.031	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	133.6	158.5	-174.7	-83.7	0	0	0	108.1	A894 A897 F898 I910 D912 P914	Y838-A894 WeakPolarHBondContact OH-CB 3.44Å; Y838-A897 HydrophobicContact CD2-CB 4.29Å; Y838-A897 HydrophobicContact CE2-CB 3.91Å; Y838-F898 HydrophobicContact CD1-CZ 4.35Å; Y838-F898 HydrophobicContact CD2-CD1 4.18Å; Y838-F898 HydrophobicContact CD2-CD2 4.49Å; Y838-F898 AromaticContact CD2-CE1 3.82Å; Y838-F898 HydrophobicContact CD2-CE1 3.82Å; Y838-F898 HydrophobicContact CD2-CE2 4.15Å; Y838-F898 HydrophobicContact CD2-CG 4.49Å; Y838-F898 AromaticContact CD2-CZ 3.79Å; Y838-F898 HydrophobicContact CD2-CZ 3.79Å; Y838-F898 HydrophobicContact CE1-CE2 4.44Å; Y838-F898 HydrophobicContact CE1-CZ 4.15Å; Y838-F898 HydrophobicContact CE2-CD1 4.32Å; Y838-F898 AromaticContact CE2-CD2 3.84Å; Y838-F898 HydrophobicContact CE2-CD2 3.84Å; Y838-F898 AromaticContact CE2-CE1 4Å; Y838-F898 HydrophobicContact CE2-CE1 4Å; Y838-F898 AromaticContact CE2-CE2 3.46Å; Y838-F898 HydrophobicContact CE2-CE2 3.46Å; Y838-F898 VanDerWaalsContact CE2-CE2 3.46Å; Y838-F898 HydrophobicContact CE2-CG 4.24Å; Y838-F898 AromaticContact CE2-CZ 3.54Å; Y838-F898 HydrophobicContact CE2-CZ 3.54Å; Y838-F898 HydrophobicContact CG-CE1 4.24Å; Y838-F898 HydrophobicContact CG-CZ 4.19Å; Y838-F898 AromaticContact CZ-CE2 3.63Å; Y838-F898 AromaticContact CZ-CZ 3.73Å; Y838-I910 PolarHBondContact N-O 3.09Å; Y838-D912 PolarHBondContact O-N 2.79Å; Y838-P914 HydrophobicContact CD1-CB 4.37Å; Y838-P914 HydrophobicContact CE1-CB 4.46Å
839	D	85.1	Confident	84.1	Confident	13 Å²	13	63.2 Å²	63.2	7%	0.07	31%	0.312	C	S	.	.			trans	-131.2	153.2	-177	-168.8	-52.5	0	0	0	107.8	K837 H841 S842	K837-D839 HydrophobicContact CD-CB 4.45Å; K837-D839 VanDerWaalsContact CE-OD2 3.25Å; K837-D839 WeakPolarHBondContact CE-OD2 3.48Å; K837-D839 IonicContact NZ-OD2 3.4Å; K837-D839 PolarHBondContact NZ-OD2 3.25Å; D839-H841 PolarHBondContact O-N 3.1Å; D839-H841 VanDerWaalsContact O-N 3.12Å; D839-H841 IonicContact OD1-CD2 3.22Å; D839-H841 PolarHBondContact OD1-N 3.5Å; D839-H841 VanDerWaalsContact OD1-N 3.16Å; D839-S842 WeakPolarHBondContact CB-OG 3.47Å; D839-S842 PolarHBondContact N-OG 3.01Å; D839-S842 VanDerWaalsContact O-CB 3.26Å; D839-S842 WeakPolarHBondContact O-CB 3.5Å; D839-S842 PolarHBondContact O-N 3.05Å; D839-S842 PolarHBondContact O-OG 3.28Å
840	Q	75.7	Confident	83.9	Confident	69 Å²	69	62.1 Å²	62.1	32%	0.322	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-54.6	-33.7	176.1	-174.7	172.8	80.6	0	0	111.2	E913 N916	Q840-E913 PolarHBondContact NE2-OE2 2.94Å; Q840-E913 VanDerWaalsContact NE2-OE2 3.09Å; Q840-N916 PolarHBondContact NE2-ND2 3.35Å
841	H	76.7	Confident	83.9	Confident	101 Å²	101	62 Å²	62	47%	0.468	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-82.5	-6.5	176.1	-60.7	-54.6	0	0	0	115	D839 A843 D844 Q845	D839-H841 PolarHBondContact O-N 3.1Å; D839-H841 VanDerWaalsContact O-N 3.12Å; D839-H841 IonicContact OD1-CD2 3.22Å; D839-H841 PolarHBondContact OD1-N 3.5Å; D839-H841 VanDerWaalsContact OD1-N 3.16Å; H841-A843 PolarHBondContact O-N 3.48Å; H841-D844 PolarHBondContact O-N 3.13Å; H841-Q845 WeakPolarHBondContact O-CG 3.45Å; H841-Q845 PolarHBondContact O-N 3.05Å
842	S	67.9	Low	84.1	Confident	20 Å²	20	54.3 Å²	54.3	14%	0.14	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-61.7	-28.9	178.6	-66.5	0	0	0	0	112.7	D839 D844	D839-S842 WeakPolarHBondContact CB-OG 3.47Å; D839-S842 PolarHBondContact N-OG 3.01Å; D839-S842 VanDerWaalsContact O-CB 3.26Å; D839-S842 WeakPolarHBondContact O-CB 3.5Å; D839-S842 PolarHBondContact O-N 3.05Å; D839-S842 PolarHBondContact O-OG 3.28Å; S842-D844 VanDerWaalsContact C-N 3.34Å
843	A	65	Low	84.2	Confident	7 Å²	7	46 Å²	46	6%	0.058	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-72	-25.8	173.8	0	0	0	0	0	113.4	H841 R893	H841-A843 PolarHBondContact O-N 3.48Å; A843-R893 HydrophobicContact CB-CB 3.94Å; A843-R893 PolarHBondContact O-NH1 2.73Å
844	D	70.4	Confident	84.3	Confident	84 Å²	84	50.1 Å²	50.1	45%	0.449	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-23.5	176.8	-61.8	-43.4	0	0	0	113	H841 S842 L846 R893	H841-D844 PolarHBondContact O-N 3.13Å; S842-D844 VanDerWaalsContact C-N 3.34Å; D844-L846 PolarHBondContact O-N 3.21Å; D844-R893 IonicContact OD1-CZ 2.75Å; D844-R893 IonicContact OD1-NH1 3.97Å; D844-R893 PolarHBondContact OD1-NH1 2.85Å; D844-R893 IonicContact OD1-NH2 2.69Å; D844-R893 PolarHBondContact OD1-NH2 2.99Å
845	Q	76.5	Confident	84.4	Confident	131 Å²	131	45.5 Å²	45.5	61%	0.612	24%	0.236	S	C	*	.	S	Bend	trans	-76.1	-2.9	174.7	-69.9	168.2	14.7	0	0	114	H841	H841-Q845 WeakPolarHBondContact O-CG 3.45Å; H841-Q845 PolarHBondContact O-N 3.05Å
846	L	79.8	Confident	84.3	Confident	5 Å²	5	43.6 Å²	43.6	3%	0.026	23%	0.226	C	C	.	.	S	Bend	trans	-66.1	142.3	172.1	-61.9	178.2	0	0	0	110.7	D844 L848 Y855 N885 R893 V896	D844-L846 PolarHBondContact O-N 3.21Å; L846-L848 PolarHBondContact O-N 3.26Å; L846-Y855 HydrophobicContact CD2-CD1 4.33Å; L846-Y855 HydrophobicContact CD2-CE1 3.56Å; L846-Y855 HydrophobicContact CD2-CE2 4.38Å; L846-N885 HydrophobicContact CB-CB 4.46Å; L846-R893 HydrophobicContact CD1-CB 3.83Å; L846-R893 HydrophobicContact CD1-CG 4.26Å; L846-V896 HydrophobicContact CD1-CB 3.98Å; L846-V896 HydrophobicContact CD1-CG1 4.07Å; L846-V896 HydrophobicContact CD2-CG1 4.08Å
847	N	82.1	Confident	84.3	Confident	69 Å²	69	46.2 Å²	46.2	37%	0.369	24%	0.238	S	C	.	.			trans	-64.8	100.9	175.6	-79.9	0.2	0	0	0	110.4	S849 E850 Y855 R858 N885	N847-S849 PolarHBondContact O-N 3.49Å; N847-S849 VanDerWaalsContact O-N 3.1Å; N847-E850 HydrophobicContact CB-CB 4.25Å; N847-E850 HydrophobicContact CB-CG 4.06Å; N847-E850 WeakPolarHBondContact CB-OE2 3.47Å; N847-E850 PolarHBondContact ND2-OE2 3.11Å; N847-E850 PolarHBondContact O-N 3.13Å; N847-E850 VanDerWaalsContact O-N 3.11Å; N847-Y855 HydrophobicContact CB-CD2 4Å; N847-Y855 HydrophobicContact CB-CE2 4.11Å; N847-R858 PolarHBondContact ND2-NH2 3.34Å; N847-N885 WeakPolarHBondContact O-CB 3.36Å; N847-N885 PolarHBondContact O-ND2 3.38Å
848	L	82.7	Confident	84.2	Confident	90 Å²	90	49.6 Å²	49.6	47%	0.471	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-29.3	-173.6	-69.1	168.6	0	0	0	114.2	L846 N885 A886	L846-L848 PolarHBondContact O-N 3.26Å; L848-N885 PolarHBondContact O-N 3.25Å; L848-A886 HydrophobicContact CB-CB 4.16Å; L848-A886 HydrophobicContact CD2-CB 4.31Å; L848-A886 WeakPolarHBondContact O-CB 3.36Å; L848-A886 PolarHBondContact O-N 2.96Å
849	S	87	Confident	84.2	Confident	105 Å²	105	52.3 Å²	52.3	73%	0.734	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-22.9	-179.1	49.6	0	0	0	0	115.1	N847	N847-S849 PolarHBondContact O-N 3.49Å; N847-S849 VanDerWaalsContact O-N 3.1Å
850	E	89.5	Confident	84.4	Confident	40 Å²	40	54.4 Å²	54.4	19%	0.187	27%	0.273	C	S	.	.	S	Bend	trans	-89.7	154.5	-177.5	-64	179.7	141.2	0	0	110.9	N847 Y855 R858 N885	N847-E850 HydrophobicContact CB-CB 4.25Å; N847-E850 HydrophobicContact CB-CG 4.06Å; N847-E850 WeakPolarHBondContact CB-OE2 3.47Å; N847-E850 PolarHBondContact ND2-OE2 3.11Å; N847-E850 PolarHBondContact O-N 3.13Å; N847-E850 VanDerWaalsContact O-N 3.11Å; E850-Y855 WeakPolarHBondContact OE2-CD2 3.14Å; E850-R858 WeakPolarHBondContact OE1-CD 3.41Å; E850-R858 IonicContact OE1-CZ 2.82Å; E850-R858 IonicContact OE1-NE 2.71Å; E850-R858 PolarHBondContact OE1-NE 3.25Å; E850-R858 IonicContact OE1-NH2 2.76Å; E850-R858 IonicContact OE2-CZ 3.41Å; E850-R858 IonicContact OE2-NE 3.55Å; E850-R858 PolarHBondContact OE2-NE 3.1Å; E850-R858 IonicContact OE2-NH2 3.57Å; E850-R858 PolarHBondContact OE2-NH2 3.12Å; E850-N885 VanDerWaalsContact O-CG 3.3Å; E850-N885 PolarHBondContact O-N 3.23Å; E850-N885 PolarHBondContact O-ND2 3.32Å; E850-N885 VanDerWaalsContact O-ND2 3.1Å
851	T	92.8	Very high	85.1	Confident	18 Å²	18	58.3 Å²	58.3	11%	0.11	30%	0.297	C	S	.	.			trans	-78.2	155.7	166.3	68.6	0	0	0	0	110.8	T853 E854 Y855	T851-T853 PolarHBondContact O-N 2.99Å; T851-T853 VanDerWaalsContact O-N 3.1Å; T851-E854 VanDerWaalsContact CB-OE2 3.26Å; T851-E854 WeakPolarHBondContact CB-OE2 3.19Å; T851-E854 VanDerWaalsContact CG2-OE2 3.26Å; T851-E854 WeakPolarHBondContact CG2-OE2 3.43Å; T851-E854 PolarHBondContact N-OE2 3.1Å; T851-E854 PolarHBondContact O-N 3.35Å; T851-E854 VanDerWaalsContact O-N 3.17Å; T851-E854 WeakPolarHBondContact OG1-CG 3.4Å; T851-E854 PolarHBondContact OG1-N 3.49Å; T851-E854 PolarHBondContact OG1-OE2 3.43Å; T851-Y855 WeakPolarHBondContact O-CB 3.07Å; T851-Y855 PolarHBondContact O-N 3.06Å
852	P	92.2	Very high	85.6	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-52.8	-32.1	174.5	-30.5	34.7	0	0	0	114.6	L856 L871 L876 I883 N885 L888 V896	P852-L856 PolarHBondContact O-N 3.28Å; P852-L871 HydrophobicContact CB-CD1 3.71Å; P852-L871 HydrophobicContact CB-CD2 3.96Å; P852-L876 HydrophobicContact CB-CD2 4.06Å; P852-L876 HydrophobicContact CG-CD2 4.08Å; P852-I883 WeakPolarHBondContact CD-O 3.45Å; P852-N885 WeakPolarHBondContact CD-OD1 3.37Å; P852-N885 WeakPolarHBondContact CG-OD1 3.23Å; P852-L888 HydrophobicContact CG-CD1 3.49Å; P852-L888 VanDerWaalsContact CG-CD1 3.49Å; P852-V896 HydrophobicContact CB-CG1 4.34Å; P852-V896 HydrophobicContact CB-CG2 3.8Å; P852-V896 HydrophobicContact CG-CG2 3.88Å
853	T	93.3	Very high	86.8	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-70.8	-52	178.9	-51	0	0	0	0	110.1	T851 Y855 L856 Q857 Y864 A867 R868 H881	T851-T853 PolarHBondContact O-N 2.99Å; T851-T853 VanDerWaalsContact O-N 3.1Å; T853-Y855 VanDerWaalsContact C-N 3.31Å; T853-Y855 PolarHBondContact O-N 3.31Å; T853-L856 PolarHBondContact O-N 2.82Å; T853-Q857 VanDerWaalsContact O-CG 3.3Å; T853-Q857 WeakPolarHBondContact O-CG 3.39Å; T853-Q857 PolarHBondContact O-N 3.27Å; T853-Y864 HydrophobicContact CG2-CD2 3.55Å; T853-Y864 HydrophobicContact CG2-CE2 3.69Å; T853-Y864 HydrophobicContact CG2-CG 4.24Å; T853-A867 HydrophobicContact CG2-CB 3.78Å; T853-R868 HydrophobicContact CG2-CG 3.72Å; T853-H881 PolarHBondContact N-O 3.1Å; T853-H881 PolarHBondContact OG1-O 3.4Å
854	E	93.1	Very high	88.1	Confident	100 Å²	100	62.1 Å²	62.1	47%	0.467	31%	0.313	S	S	.	.	H	α-helix	trans	-61.5	-39.7	178.8	-67.9	154.5	154.1	0	0	111.7	T851 Q857 R858	T851-E854 VanDerWaalsContact CB-OE2 3.26Å; T851-E854 WeakPolarHBondContact CB-OE2 3.19Å; T851-E854 VanDerWaalsContact CG2-OE2 3.26Å; T851-E854 WeakPolarHBondContact CG2-OE2 3.43Å; T851-E854 PolarHBondContact N-OE2 3.1Å; T851-E854 PolarHBondContact O-N 3.35Å; T851-E854 VanDerWaalsContact O-N 3.17Å; T851-E854 WeakPolarHBondContact OG1-CG 3.4Å; T851-E854 PolarHBondContact OG1-N 3.49Å; T851-E854 PolarHBondContact OG1-OE2 3.43Å; E854-Q857 PolarHBondContact O-N 3.16Å; E854-R858 WeakPolarHBondContact O-CB 3.49Å; E854-R858 PolarHBondContact O-N 2.81Å
855	Y	92.3	Very high	89.1	Confident	17 Å²	17	65.6 Å²	65.6	7%	0.067	33%	0.327	C	S	.	.	H	α-helix	trans	-56	-52.7	175.5	-175.6	-100.9	0	0	0	112.2	L846 N847 E850 T851 T853 R858 L859 V896 E900	L846-Y855 HydrophobicContact CD2-CD1 4.33Å; L846-Y855 HydrophobicContact CD2-CE1 3.56Å; L846-Y855 HydrophobicContact CD2-CE2 4.38Å; N847-Y855 HydrophobicContact CB-CD2 4Å; N847-Y855 HydrophobicContact CB-CE2 4.11Å; E850-Y855 WeakPolarHBondContact OE2-CD2 3.14Å; T851-Y855 WeakPolarHBondContact O-CB 3.07Å; T851-Y855 PolarHBondContact O-N 3.06Å; T853-Y855 VanDerWaalsContact C-N 3.31Å; T853-Y855 PolarHBondContact O-N 3.31Å; Y855-R858 VanDerWaalsContact CD2-NH2 3.28Å; Y855-R858 PolarHBondContact O-N 3Å; Y855-L859 HydrophobicContact CD1-CD1 3.91Å; Y855-L859 HydrophobicContact CE1-CD1 3.41Å; Y855-L859 VanDerWaalsContact CE1-CD1 3.41Å; Y855-L859 HydrophobicContact CE2-CD1 4.16Å; Y855-L859 HydrophobicContact CG-CD1 4.47Å; Y855-L859 WeakPolarHBondContact O-CG 3.2Å; Y855-L859 PolarHBondContact O-N 2.78Å; Y855-L859 VanDerWaalsContact O-N 3.07Å; Y855-V896 HydrophobicContact CD1-CG1 4.17Å; Y855-E900 HydrophobicContact CE1-CG 4.5Å; Y855-E900 PolarHBondContact OH-OE2 2.89Å
856	L	91.6	Very high	89.9	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-68.8	-32.4	177.1	-69.6	-179	0	0	0	112.8	P852 T853 F860 A867 L871 A899 E900	P852-L856 PolarHBondContact O-N 3.28Å; T853-L856 PolarHBondContact O-N 2.82Å; L856-F860 HydrophobicContact CD2-CD2 4.1Å; L856-F860 HydrophobicContact CD2-CE2 3.83Å; L856-F860 PolarHBondContact O-N 3.12Å; L856-F860 VanDerWaalsContact O-N 3.16Å; L856-A867 HydrophobicContact CB-CB 4.26Å; L856-L871 HydrophobicContact CD1-CD1 4.31Å; L856-L871 HydrophobicContact CD1-CD2 3.64Å; L856-L871 HydrophobicContact CD1-CG 3.73Å; L856-A899 HydrophobicContact CD1-CB 4.26Å; L856-E900 HydrophobicContact CD2-CB 4.1Å; L856-E900 HydrophobicContact CD2-CG 4.36Å
857	Q	92.7	Very high	90.5	Very high	55 Å²	55	62.5 Å²	62.5	26%	0.257	31%	0.314	S	S	.	.	H	α-helix	trans	-66	-43.4	174	-72.1	-165.2	-100.9	0	0	111.8	T853 E854 N861 L862 A867	T853-Q857 VanDerWaalsContact O-CG 3.3Å; T853-Q857 WeakPolarHBondContact O-CG 3.39Å; T853-Q857 PolarHBondContact O-N 3.27Å; E854-Q857 PolarHBondContact O-N 3.16Å; Q857-N861 WeakPolarHBondContact O-CA 3.42Å; Q857-N861 PolarHBondContact O-N 3.34Å; Q857-L862 VanDerWaalsContact CG-O 3.31Å; Q857-L862 WeakPolarHBondContact CG-O 3.42Å; Q857-L862 PolarHBondContact NE2-O 3.39Å; Q857-A867 HydrophobicContact CG-CB 3.82Å
858	R	90.7	Very high	90.9	Very high	109 Å²	109	62.5 Å²	62.5	41%	0.411	31%	0.309	S	S	.	.	H	α-helix	trans	-68	-36.9	178.8	-175.3	-177.1	51	55	12	112.6	N847 E850 E854 Y855	N847-R858 PolarHBondContact ND2-NH2 3.34Å; E850-R858 WeakPolarHBondContact OE1-CD 3.41Å; E850-R858 IonicContact OE1-CZ 2.82Å; E850-R858 IonicContact OE1-NE 2.71Å; E850-R858 PolarHBondContact OE1-NE 3.25Å; E850-R858 IonicContact OE1-NH2 2.76Å; E850-R858 IonicContact OE2-CZ 3.41Å; E850-R858 IonicContact OE2-NE 3.55Å; E850-R858 PolarHBondContact OE2-NE 3.1Å; E850-R858 IonicContact OE2-NH2 3.57Å; E850-R858 PolarHBondContact OE2-NH2 3.12Å; E854-R858 WeakPolarHBondContact O-CB 3.49Å; E854-R858 PolarHBondContact O-N 2.81Å; Y855-R858 VanDerWaalsContact CD2-NH2 3.28Å; Y855-R858 PolarHBondContact O-N 3Å
859	L	90	Very high	91.3	Very high	65 Å²	65	60.8 Å²	60.8	34%	0.34	31%	0.308	S	S	.	.	H	α-helix	trans	-76	-36.1	-179.5	-72.8	177.1	0	0	0	113.8	Y855 E900	Y855-L859 HydrophobicContact CD1-CD1 3.91Å; Y855-L859 HydrophobicContact CE1-CD1 3.41Å; Y855-L859 VanDerWaalsContact CE1-CD1 3.41Å; Y855-L859 HydrophobicContact CE2-CD1 4.16Å; Y855-L859 HydrophobicContact CG-CD1 4.47Å; Y855-L859 WeakPolarHBondContact O-CG 3.2Å; Y855-L859 PolarHBondContact O-N 2.78Å; Y855-L859 VanDerWaalsContact O-N 3.07Å; L859-E900 HydrophobicContact CD1-CG 3.95Å
860	F	90	Very high	91.4	Very high	57 Å²	57	56.1 Å²	56.1	25%	0.25	28%	0.275	C	S	.	.	H	α-helix	trans	-121.5	6.5	-170.2	-59.5	-73.4	0	0	0	114.3	L856 L862 E900 R903 R904	L856-F860 HydrophobicContact CD2-CD2 4.1Å; L856-F860 HydrophobicContact CD2-CE2 3.83Å; L856-F860 PolarHBondContact O-N 3.12Å; L856-F860 VanDerWaalsContact O-N 3.16Å; F860-L862 HydrophobicContact CB-CD1 3.84Å; F860-L862 HydrophobicContact CB-CG 3.72Å; F860-L862 HydrophobicContact CD2-CD1 4.38Å; F860-L862 HydrophobicContact CG-CD1 4.46Å; F860-L862 PolarHBondContact O-N 3Å; F860-L862 VanDerWaalsContact O-N 3.16Å; F860-E900 HydrophobicContact CE2-CB 4.47Å; F860-E900 HydrophobicContact CE2-CG 3.67Å; F860-E900 HydrophobicContact CZ-CG 3.73Å; F860-R903 HydrophobicContact CD1-CB 4.13Å; F860-R903 HydrophobicContact CD2-CB 3.86Å; F860-R903 HydrophobicContact CE1-CB 3.85Å; F860-R903 WeakPolarHBondContact CE1-O 3.36Å; F860-R903 HydrophobicContact CE2-CB 3.56Å; F860-R903 HydrophobicContact CG-CB 4.14Å; F860-R903 HydrophobicContact CZ-CB 3.56Å; F860-R904 HydrophobicContact CE1-CG 4.03Å; F860-R904 HydrophobicContact CZ-CG 3.82Å
861	N	90.3	Very high	91.5	Very high	152 Å²	152	54.2 Å²	54.2	81%	0.813	27%	0.266	S	S	*	.			trans	51.3	33	-173.8	-64.8	-48.3	0	0	0	113.6	Q857	Q857-N861 WeakPolarHBondContact O-CA 3.42Å; Q857-N861 PolarHBondContact O-N 3.34Å
862	L	88.5	Confident	91.3	Very high	29 Å²	29	55.1 Å²	55.1	15%	0.152	28%	0.279	C	S	.	.			trans	-72.6	154.5	-177.5	-72	168.8	0	0	0	112.3	Q857 F860 D866 A867 R903	Q857-L862 VanDerWaalsContact CG-O 3.31Å; Q857-L862 WeakPolarHBondContact CG-O 3.42Å; Q857-L862 PolarHBondContact NE2-O 3.39Å; F860-L862 HydrophobicContact CB-CD1 3.84Å; F860-L862 HydrophobicContact CB-CG 3.72Å; F860-L862 HydrophobicContact CD2-CD1 4.38Å; F860-L862 HydrophobicContact CG-CD1 4.46Å; F860-L862 PolarHBondContact O-N 3Å; F860-L862 VanDerWaalsContact O-N 3.16Å; L862-D866 HydrophobicContact CB-CB 4.42Å; L862-D866 HydrophobicContact CD2-CB 4.1Å; L862-A867 HydrophobicContact CB-CB 4.45Å; L862-R903 HydrophobicContact CD1-CG 4.4Å
863	T	92.8	Very high	91.1	Very high	71 Å²	71	61.1 Å²	61.1	44%	0.436	31%	0.305	S	S	.	.			trans	-67.9	152.9	165.1	84.9	0	0	0	0	110.2	Q865 D866 A867	T863-Q865 PolarHBondContact O-N 3.45Å; T863-Q865 PolarHBondContact OG1-N 2.81Å; T863-D866 WeakPolarHBondContact CB-OD2 3.45Å; T863-D866 WeakPolarHBondContact CG2-OD2 3.3Å; T863-D866 PolarHBondContact O-N 3.45Å; T863-D866 VanDerWaalsContact O-N 3.13Å; T863-D866 PolarHBondContact OG1-N 3.08Å; T863-D866 PolarHBondContact OG1-OD2 3.34Å; T863-A867 WeakPolarHBondContact O-CB 3.38Å; T863-A867 PolarHBondContact O-N 2.95Å
864	Y	91.9	Very high	90.9	Very high	107 Å²	107	61.3 Å²	61.3	42%	0.42	31%	0.306	S	S	.	.	H	α-helix	trans	-56.1	-31.9	174.2	-177	-93.6	0	0	0	112.3	T853 R868	T853-Y864 HydrophobicContact CG2-CD2 3.55Å; T853-Y864 HydrophobicContact CG2-CE2 3.69Å; T853-Y864 HydrophobicContact CG2-CG 4.24Å; Y864-R868 HydrophobicContact CE1-CG 4.38Å; Y864-R868 WeakPolarHBondContact O-CG 3.29Å; Y864-R868 PolarHBondContact O-N 2.98Å; Y864-R868 PolarHBondContact OH-NH1 3.32Å
865	Q	92.2	Very high	90.5	Very high	158 Å²	158	56.9 Å²	56.9	74%	0.738	29%	0.287	S	S	*	.	H	α-helix	trans	-72.6	-44.4	177.9	-59.9	-174.9	11.4	0	0	111.1	T863 R868 A869	T863-Q865 PolarHBondContact O-N 3.45Å; T863-Q865 PolarHBondContact OG1-N 2.81Å; Q865-R868 PolarHBondContact O-N 2.88Å; Q865-A869 VanDerWaalsContact O-CB 3.24Å; Q865-A869 WeakPolarHBondContact O-CB 3.44Å; Q865-A869 PolarHBondContact O-N 2.89Å
866	D	92.1	Very high	90.2	Very high	71 Å²	71	56.4 Å²	56.4	38%	0.38	29%	0.286	S	S	.	.	H	α-helix	trans	-67.7	-39.7	177.9	-67.6	-63.2	0	0	0	112.9	L862 T863 A869 T870	L862-D866 HydrophobicContact CB-CB 4.42Å; L862-D866 HydrophobicContact CD2-CB 4.1Å; T863-D866 WeakPolarHBondContact CB-OD2 3.45Å; T863-D866 WeakPolarHBondContact CG2-OD2 3.3Å; T863-D866 PolarHBondContact O-N 3.45Å; T863-D866 VanDerWaalsContact O-N 3.13Å; T863-D866 PolarHBondContact OG1-N 3.08Å; T863-D866 PolarHBondContact OG1-OD2 3.34Å; D866-A869 PolarHBondContact O-N 3.24Å; D866-T870 WeakPolarHBondContact O-CB 3.38Å; D866-T870 PolarHBondContact O-N 3.18Å; D866-T870 PolarHBondContact O-OG1 3.16Å
867	A	92.5	Very high	89.9	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-60.3	-49.9	174.6	0	0	0	0	0	110.6	T853 L856 Q857 L862 T863 A869 T870 L871	T853-A867 HydrophobicContact CG2-CB 3.78Å; L856-A867 HydrophobicContact CB-CB 4.26Å; Q857-A867 HydrophobicContact CG-CB 3.82Å; L862-A867 HydrophobicContact CB-CB 4.45Å; T863-A867 WeakPolarHBondContact O-CB 3.38Å; T863-A867 PolarHBondContact O-N 2.95Å; A867-A869 PolarHBondContact O-N 3.24Å; A867-T870 WeakPolarHBondContact O-CB 3.46Å; A867-T870 PolarHBondContact O-N 2.87Å; A867-L871 WeakPolarHBondContact O-CG 3.45Å; A867-L871 PolarHBondContact O-N 3.34Å
868	R	91.4	Very high	89.6	Confident	68 Å²	68	60.9 Å²	60.9	26%	0.257	32%	0.317	S	S	.	.	H	α-helix	trans	-66.6	-34.7	176	-67	-171.7	73.7	161.2	5	113.1	T853 Y864 Q865 T870 G872 A878 H881	T853-R868 HydrophobicContact CG2-CG 3.72Å; Y864-R868 HydrophobicContact CE1-CG 4.38Å; Y864-R868 WeakPolarHBondContact O-CG 3.29Å; Y864-R868 PolarHBondContact O-N 2.98Å; Y864-R868 PolarHBondContact OH-NH1 3.32Å; Q865-R868 PolarHBondContact O-N 2.88Å; R868-T870 VanDerWaalsContact C-N 3.3Å; R868-G872 PolarHBondContact O-N 2.84Å; R868-A878 PolarHBondContact NH2-O 2.68Å; R868-H881 VanDerWaalsContact C-NE2 3.29Å; R868-H881 WeakPolarHBondContact CA-CE1 3.43Å; R868-H881 WeakPolarHBondContact CB-CE1 3.45Å; R868-H881 WeakPolarHBondContact CB-ND1 3.3Å; R868-H881 WeakPolarHBondContact CD-CE1 3.43Å; R868-H881 HydrophobicContact CG-CB 4.34Å; R868-H881 WeakPolarHBondContact CG-CE1 3.44Å; R868-H881 WeakPolarHBondContact CG-ND1 3.46Å; R868-H881 PolarHBondContact NE-CE1 2.86Å; R868-H881 PolarHBondContact NE-ND1 3.29Å; R868-H881 PolarHBondContact O-NE2 2.94Å
869	A	90.4	Very high	89.4	Confident	55 Å²	55	60.3 Å²	60.3	46%	0.455	32%	0.319	S	S	.	.	H	α-helix	trans	-67.1	-32.1	174.1	0	0	0	0	0	112.2	Q865 D866 A867 K873	Q865-A869 VanDerWaalsContact O-CB 3.24Å; Q865-A869 WeakPolarHBondContact O-CB 3.44Å; Q865-A869 PolarHBondContact O-N 2.89Å; D866-A869 PolarHBondContact O-N 3.24Å; A867-A869 PolarHBondContact O-N 3.24Å; A869-K873 WeakPolarHBondContact O-CG 3.35Å; A869-K873 PolarHBondContact O-N 2.68Å
870	T	89.9	Confident	89.3	Confident	6 Å²	6	57.2 Å²	57.2	4%	0.037	30%	0.302	C	S	.	.	H	α-helix	trans	-68.2	-56.9	173.6	-49.2	0	0	0	0	109.9	D866 A867 R868 G872 K873 F874 A899 R903	D866-T870 WeakPolarHBondContact O-CB 3.38Å; D866-T870 PolarHBondContact O-N 3.18Å; D866-T870 PolarHBondContact O-OG1 3.16Å; A867-T870 WeakPolarHBondContact O-CB 3.46Å; A867-T870 PolarHBondContact O-N 2.87Å; R868-T870 VanDerWaalsContact C-N 3.3Å; T870-G872 PolarHBondContact O-N 2.79Å; T870-K873 WeakPolarHBondContact O-CB 3.49Å; T870-K873 PolarHBondContact O-N 2.88Å; T870-F874 HydrophobicContact CG2-CD2 4.35Å; T870-F874 HydrophobicContact CG2-CE2 4.33Å; T870-F874 WeakPolarHBondContact O-CD2 3.4Å; T870-F874 PolarHBondContact O-N 2.82Å; T870-A899 HydrophobicContact CG2-CB 4.15Å; T870-R903 HydrophobicContact CG2-CG 3.91Å; T870-R903 PolarHBondContact OG1-NE 3.16Å; T870-R903 VanDerWaalsContact OG1-NE 3.09Å; T870-R903 PolarHBondContact OG1-NH2 2.77Å
871	L	91.4	Very high	89.4	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-54.5	-38.5	179.5	-67.1	167.6	0	0	0	112.8	P852 L856 A867 K873 F874 G875 L876 H881 V896 A899	P852-L871 HydrophobicContact CB-CD1 3.71Å; P852-L871 HydrophobicContact CB-CD2 3.96Å; L856-L871 HydrophobicContact CD1-CD1 4.31Å; L856-L871 HydrophobicContact CD1-CD2 3.64Å; L856-L871 HydrophobicContact CD1-CG 3.73Å; A867-L871 WeakPolarHBondContact O-CG 3.45Å; A867-L871 PolarHBondContact O-N 3.34Å; L871-K873 PolarHBondContact O-N 3.39Å; L871-F874 CarbonylContact O-C 3.59Å; L871-F874 PolarHBondContact O-N 3.24Å; L871-G875 PolarHBondContact O-N 2.71Å; L871-L876 HydrophobicContact CB-CB 4.31Å; L871-L876 HydrophobicContact CB-CD2 4.23Å; L871-L876 HydrophobicContact CD1-CD2 4.39Å; L871-L876 HydrophobicContact CD2-CD2 3.94Å; L871-L876 HydrophobicContact CG-CD2 4.41Å; L871-L876 WeakPolarHBondContact O-CB 3.47Å; L871-L876 PolarHBondContact O-N 3.36Å; L871-L876 VanDerWaalsContact O-N 3.13Å; L871-H881 HydrophobicContact CD1-CB 4.47Å; L871-V896 HydrophobicContact CD2-CG2 4.15Å; L871-A899 HydrophobicContact CD2-CB 4.17Å
872	G	88.6	Confident	89.4	Confident	37 Å²	37	51.3 Å²	51.3	38%	0.381	28%	0.276	S	S	.	.	H	α-helix	trans	-66.5	-30.3	177.1	0	0	0	0	0	114.6	R868 T870 G875 H881	R868-G872 PolarHBondContact O-N 2.84Å; T870-G872 PolarHBondContact O-N 2.79Å; G872-G875 PolarHBondContact O-N 2.83Å; G872-H881 WeakPolarHBondContact CA-NE2 3.24Å; G872-H881 PolarHBondContact N-NE2 3.21Å
873	K	87.7	Confident	89.5	Confident	127 Å²	127	52.3 Å²	52.3	55%	0.552	28%	0.281	S	S	*	.	H	α-helix	trans	-68.3	-42.9	173	-71.6	175.3	179.5	-171.9	0	111.3	K756 A869 T870 L871 G875	K756-K873 CarbonylContact C-O 3.55Å; K756-K873 PolarHBondContact N-O 3.2Å; K756-K873 CarbonylContact O-C 3.5Å; A869-K873 WeakPolarHBondContact O-CG 3.35Å; A869-K873 PolarHBondContact O-N 2.68Å; T870-K873 WeakPolarHBondContact O-CB 3.49Å; T870-K873 PolarHBondContact O-N 2.88Å; L871-K873 PolarHBondContact O-N 3.39Å; K873-G875 PolarHBondContact O-N 3.19Å
874	F	88.1	Confident	89.4	Confident	4 Å²	4	51.2 Å²	51.2	2%	0.018	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	9.4	174.8	-71.3	-89	0	0	0	113.7	F757 T870 L871 L876 R895 F898 A899 S902	F757-F874 HydrophobicContact CB-CD1 4.34Å; F757-F874 HydrophobicContact CB-CE1 3.85Å; F757-F874 HydrophobicContact CD1-CB 4.3Å; F757-F874 AromaticContact CD1-CD1 3.22Å; F757-F874 HydrophobicContact CD1-CD1 3.22Å; F757-F874 AromaticContact CD1-CE1 3.66Å; F757-F874 HydrophobicContact CD1-CE1 3.66Å; F757-F874 HydrophobicContact CD1-CG 4.04Å; F757-F874 HydrophobicContact CD2-CD1 4.48Å; F757-F874 HydrophobicContact CD2-CE1 4.43Å; F757-F874 HydrophobicContact CE1-CB 4.11Å; F757-F874 AromaticContact CE1-CD1 3.52Å; F757-F874 HydrophobicContact CE1-CD1 3.52Å; F757-F874 HydrophobicContact CE1-CE1 4.32Å; F757-F874 HydrophobicContact CE1-CG 4.25Å; F757-F874 AromaticContact CG-CD1 3.78Å; F757-F874 HydrophobicContact CG-CD1 3.78Å; F757-F874 AromaticContact CG-CE1 3.72Å; F757-F874 HydrophobicContact CG-CE1 3.72Å; F757-F874 HydrophobicContact CZ-CD1 4.27Å; T870-F874 HydrophobicContact CG2-CD2 4.35Å; T870-F874 HydrophobicContact CG2-CE2 4.33Å; T870-F874 WeakPolarHBondContact O-CD2 3.4Å; T870-F874 PolarHBondContact O-N 2.82Å; L871-F874 CarbonylContact O-C 3.59Å; L871-F874 PolarHBondContact O-N 3.24Å; F874-L876 VanDerWaalsContact C-N 3.27Å; F874-L876 PolarHBondContact O-N 3.07Å; F874-R895 HydrophobicContact CB-CB 4.48Å; F874-R895 WeakPolarHBondContact O-CD 3.48Å; F874-R895 WeakPolarHBondContact O-CG 3.42Å; F874-R895 PolarHBondContact O-NH1 3.34Å; F874-F898 HydrophobicContact CD1-CB 3.67Å; F874-F898 HydrophobicContact CE1-CB 3.83Å; F874-A899 HydrophobicContact CB-CB 4.3Å; F874-A899 HydrophobicContact CD2-CB 3.68Å; F874-A899 HydrophobicContact CE2-CB 4.27Å; F874-A899 HydrophobicContact CG-CB 3.93Å; F874-S902 VanDerWaalsContact CZ-CB 3.43Å
875	G	84.7	Confident	89.2	Confident	6 Å²	6	46.1 Å²	46.1	6%	0.062	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.7	11.2	172.1	0	0	0	0	0	114.5	Y753 L871 G872 K873 E877	Y753-G875 WeakPolarHBondContact CE2-O 3.31Å; Y753-G875 PolarHBondContact OH-O 3.2Å; L871-G875 PolarHBondContact O-N 2.71Å; G872-G875 PolarHBondContact O-N 2.83Å; K873-G875 PolarHBondContact O-N 3.19Å; G875-E877 PolarHBondContact O-N 2.88Å
876	L	87.1	Confident	88.9	Confident	8 Å²	8	41.7 Å²	41.7	4%	0.042	25%	0.245	C	C	.	.			trans	-67	130.7	171	-169.4	66	0	0	0	108.6	P852 L871 F874 A880 Q892 V896	P852-L876 HydrophobicContact CB-CD2 4.06Å; P852-L876 HydrophobicContact CG-CD2 4.08Å; L871-L876 HydrophobicContact CB-CB 4.31Å; L871-L876 HydrophobicContact CB-CD2 4.23Å; L871-L876 HydrophobicContact CD1-CD2 4.39Å; L871-L876 HydrophobicContact CD2-CD2 3.94Å; L871-L876 HydrophobicContact CG-CD2 4.41Å; L871-L876 WeakPolarHBondContact O-CB 3.47Å; L871-L876 PolarHBondContact O-N 3.36Å; L871-L876 VanDerWaalsContact O-N 3.13Å; F874-L876 VanDerWaalsContact C-N 3.27Å; F874-L876 PolarHBondContact O-N 3.07Å; L876-A880 HydrophobicContact CD1-CB 3.81Å; L876-A880 HydrophobicContact CD2-CB 4.45Å; L876-A880 HydrophobicContact CG-CB 4.01Å; L876-Q892 HydrophobicContact CD1-CB 3.78Å; L876-Q892 HydrophobicContact CD1-CG 3.84Å; L876-V896 HydrophobicContact CD2-CG2 4.08Å
877	E	84.9	Confident	88.6	Confident	87 Å²	87	44.3 Å²	44.3	41%	0.407	26%	0.259	S	S	.	.			trans	-67.9	140.1	179	-83.2	-157	-126.6	0	0	111.4	G875 H879 A880 H881	G875-E877 PolarHBondContact O-N 2.88Å; E877-H879 WeakPolarHBondContact CB-ND1 3.38Å; E877-H879 PolarHBondContact O-N 3.28Å; E877-H879 IonicContact OE1-CE1 3.19Å; E877-H879 IonicContact OE2-CE1 3.37Å; E877-H879 PolarHBondContact OE2-CE1 3.19Å; E877-H879 VanDerWaalsContact OE2-CE1 3.27Å; E877-H879 IonicContact OE2-ND1 2.71Å; E877-H879 PolarHBondContact OE2-ND1 3.11Å; E877-A880 WeakPolarHBondContact O-CB 3.34Å; E877-A880 PolarHBondContact O-N 2.92Å; E877-H881 PolarHBondContact O-CD2 3.1Å
878	A	87.2	Confident	88.2	Confident	61 Å²	61	44.8 Å²	44.8	50%	0.504	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-18.2	-177.2	0	0	0	0	0	115	R868	R868-A878 PolarHBondContact NH2-O 2.68Å
879	H	86.1	Confident	87.7	Confident	97 Å²	97	43.7 Å²	43.7	45%	0.449	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-33.1	173.3	75.7	-101.7	0	0	0	112.9	E877 H881 T882	E877-H879 WeakPolarHBondContact CB-ND1 3.38Å; E877-H879 PolarHBondContact O-N 3.28Å; E877-H879 IonicContact OE1-CE1 3.19Å; E877-H879 IonicContact OE2-CE1 3.37Å; E877-H879 PolarHBondContact OE2-CE1 3.19Å; E877-H879 VanDerWaalsContact OE2-CE1 3.27Å; E877-H879 IonicContact OE2-ND1 2.71Å; E877-H879 PolarHBondContact OE2-ND1 3.11Å; H879-H881 VanDerWaalsContact C-N 3.31Å; H879-H881 PolarHBondContact O-N 2.9Å; H879-T882 PolarHBondContact O-OG1 3.11Å
880	A	88	Confident	87.2	Confident	0 Å²	0	42 Å²	42	0%	0	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-78.2	-14.1	179.7	0	0	0	0	0	113.3	L876 E877 T882 I883 L888	L876-A880 HydrophobicContact CD1-CB 3.81Å; L876-A880 HydrophobicContact CD2-CB 4.45Å; L876-A880 HydrophobicContact CG-CB 4.01Å; E877-A880 WeakPolarHBondContact O-CB 3.34Å; E877-A880 PolarHBondContact O-N 2.92Å; A880-T882 PolarHBondContact O-N 3.42Å; A880-T882 VanDerWaalsContact O-N 3.14Å; A880-I883 PolarHBondContact O-N 3.44Å; A880-L888 HydrophobicContact CB-CD2 3.88Å
881	H	91.1	Very high	86.9	Confident	11 Å²	11	42 Å²	42	5%	0.051	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-60.7	-21.7	175.8	-68	-155.7	0	0	0	113.2	T853 R868 L871 G872 E877 H879	T853-H881 PolarHBondContact N-O 3.1Å; T853-H881 PolarHBondContact OG1-O 3.4Å; R868-H881 VanDerWaalsContact C-NE2 3.29Å; R868-H881 WeakPolarHBondContact CA-CE1 3.43Å; R868-H881 WeakPolarHBondContact CB-CE1 3.45Å; R868-H881 WeakPolarHBondContact CB-ND1 3.3Å; R868-H881 WeakPolarHBondContact CD-CE1 3.43Å; R868-H881 HydrophobicContact CG-CB 4.34Å; R868-H881 WeakPolarHBondContact CG-CE1 3.44Å; R868-H881 WeakPolarHBondContact CG-ND1 3.46Å; R868-H881 PolarHBondContact NE-CE1 2.86Å; R868-H881 PolarHBondContact NE-ND1 3.29Å; R868-H881 PolarHBondContact O-NE2 2.94Å; L871-H881 HydrophobicContact CD1-CB 4.47Å; G872-H881 WeakPolarHBondContact CA-NE2 3.24Å; G872-H881 PolarHBondContact N-NE2 3.21Å; E877-H881 PolarHBondContact O-CD2 3.1Å; H879-H881 VanDerWaalsContact C-N 3.31Å; H879-H881 PolarHBondContact O-N 2.9Å
882	T	91	Very high	86.7	Confident	74 Å²	74	44.1 Å²	44.1	45%	0.454	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-121.6	16.1	-176.5	55.4	0	0	0	0	112.6	H879 A880	H879-T882 PolarHBondContact O-OG1 3.11Å; A880-T882 PolarHBondContact O-N 3.42Å; A880-T882 VanDerWaalsContact O-N 3.14Å
883	I	90	Very high	86.7	Confident	50 Å²	50	44.5 Å²	44.5	26%	0.256	25%	0.254	S	S	.	.	S	Bend	trans	-97.5	137.8	171.1	-69.3	178.5	0	0	0	107	P852 A880 D887 L888	P852-I883 WeakPolarHBondContact CD-O 3.45Å; A880-I883 PolarHBondContact O-N 3.44Å; I883-D887 HydrophobicContact CG2-CB 3.5Å; I883-L888 HydrophobicContact CB-CD2 4.05Å; I883-L888 HydrophobicContact CG2-CD2 3.83Å; I883-L888 HydrophobicContact CG2-CG 4.39Å
884	P	90.3	Very high	86.8	Confident	49 Å²	49	38.5 Å²	38.5	32%	0.318	23%	0.228	S	C	.	.			trans	-59.8	146.7	176.7	-22.6	34.1	0	0	0	111.6	A886 D887	P884-A886 PolarHBondContact O-N 3.3Å; P884-D887 PolarHBondContact O-N 2.87Å
885	N	88.2	Confident	86.8	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-56	-28.5	-177.6	-72.1	-41.5	0	0	0	113.3	L846 N847 L848 E850 P852 D887 L888 R893	L846-N885 HydrophobicContact CB-CB 4.46Å; N847-N885 WeakPolarHBondContact O-CB 3.36Å; N847-N885 PolarHBondContact O-ND2 3.38Å; L848-N885 PolarHBondContact O-N 3.25Å; E850-N885 VanDerWaalsContact O-CG 3.3Å; E850-N885 PolarHBondContact O-N 3.23Å; E850-N885 PolarHBondContact O-ND2 3.32Å; E850-N885 VanDerWaalsContact O-ND2 3.1Å; P852-N885 WeakPolarHBondContact CD-OD1 3.37Å; P852-N885 WeakPolarHBondContact CG-OD1 3.23Å; N885-D887 VanDerWaalsContact C-N 3.34Å; N885-D887 PolarHBondContact O-N 3.29Å; N885-L888 PolarHBondContact O-N 3.1Å; N885-R893 WeakPolarHBondContact O-CD 3.49Å
886	A	85.7	Confident	87.2	Confident	64 Å²	64	38.3 Å²	38.3	53%	0.529	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-60.9	-33.7	174.6	0	0	0	0	0	114.9	L848 P884 L888	L848-A886 HydrophobicContact CB-CB 4.16Å; L848-A886 HydrophobicContact CD2-CB 4.31Å; L848-A886 WeakPolarHBondContact O-CB 3.36Å; L848-A886 PolarHBondContact O-N 2.96Å; P884-A886 PolarHBondContact O-N 3.3Å; A886-L888 VanDerWaalsContact C-N 3.33Å
887	D	85.5	Confident	87.4	Confident	126 Å²	126	38.3 Å²	38.3	67%	0.674	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-89.2	-0.7	-177.8	-74.9	-41.4	0	0	0	112.5	I883 P884 N885	I883-D887 HydrophobicContact CG2-CB 3.5Å; P884-D887 PolarHBondContact O-N 2.87Å; N885-D887 VanDerWaalsContact C-N 3.34Å; N885-D887 PolarHBondContact O-N 3.29Å
888	L	84.6	Confident	87.7	Confident	10 Å²	10	34.1 Å²	34.1	5%	0.052	21%	0.207	C	C	.	.	S	Bend	trans	-87	135.2	-179.3	-63.7	-176.8	0	0	0	112.1	P852 A880 I883 N885 A886 Q892 R893	P852-L888 HydrophobicContact CG-CD1 3.49Å; P852-L888 VanDerWaalsContact CG-CD1 3.49Å; A880-L888 HydrophobicContact CB-CD2 3.88Å; I883-L888 HydrophobicContact CB-CD2 4.05Å; I883-L888 HydrophobicContact CG2-CD2 3.83Å; I883-L888 HydrophobicContact CG2-CG 4.39Å; N885-L888 PolarHBondContact O-N 3.1Å; A886-L888 VanDerWaalsContact C-N 3.33Å; L888-Q892 HydrophobicContact CB-CB 4.03Å; L888-Q892 HydrophobicContact CD2-CB 4.39Å; L888-R893 HydrophobicContact CB-CG 3.7Å
889	S	81.2	Confident	87.9	Confident	45 Å²	45	31.2 Å²	31.2	32%	0.315	18%	0.183	S	C	.	.			trans	-61.3	154.1	171.7	62.7	0	0	0	0	111.8	G891 Q892 R893	S889-G891 VanDerWaalsContact C-N 3.25Å; S889-G891 PolarHBondContact O-N 2.98Å; S889-G891 VanDerWaalsContact O-N 3.17Å; S889-Q892 WeakPolarHBondContact O-CA 3.09Å; S889-Q892 WeakPolarHBondContact O-CB 3.3Å; S889-Q892 PolarHBondContact O-N 3.2Å; S889-Q892 VanDerWaalsContact OG-CD 3.31Å; S889-Q892 WeakPolarHBondContact OG-CG 3.26Å; S889-Q892 PolarHBondContact OG-OE1 3.25Å; S889-R893 PolarHBondContact O-N 3.29Å
890	G	80.7	Confident	88.2	Confident	19 Å²	19	27.5 Å²	27.5	20%	0.196	17%	0.165	C	C	.	.	H	α-helix	trans	-50	-44.1	-179.4	0	0	0	0	0	113.3	Q892 R893 A894	G890-Q892 VanDerWaalsContact C-N 3.29Å; G890-Q892 PolarHBondContact O-N 3.47Å; G890-R893 PolarHBondContact O-N 3.24Å; G890-R893 VanDerWaalsContact O-N 3.14Å; G890-A894 WeakPolarHBondContact O-CB 3.42Å; G890-A894 PolarHBondContact O-N 3.19Å
891	G	82.9	Confident	88.4	Confident	7 Å²	7	27.7 Å²	27.7	7%	0.072	17%	0.166	C	C	.	.	H	α-helix	trans	-69.1	-18.1	176.4	0	0	0	0	0	115.5	S889 R895 N917	S889-G891 VanDerWaalsContact C-N 3.25Å; S889-G891 PolarHBondContact O-N 2.98Å; S889-G891 VanDerWaalsContact O-N 3.17Å; G891-R895 WeakPolarHBondContact O-CD 3.34Å; G891-R895 VanDerWaalsContact O-CG 3.29Å; G891-R895 WeakPolarHBondContact O-CG 3.5Å; G891-R895 PolarHBondContact O-NE 3.08Å; G891-N917 WeakPolarHBondContact CA-O 3.45Å
892	Q	87.6	Confident	88.4	Confident	44 Å²	44	28 Å²	28	21%	0.206	17%	0.17	C	C	.	.	H	α-helix	trans	-82	-41.1	167.9	-71.5	166.5	-56.1	0	0	110.7	L876 L888 S889 G890 R895 V896	L876-Q892 HydrophobicContact CD1-CB 3.78Å; L876-Q892 HydrophobicContact CD1-CG 3.84Å; L888-Q892 HydrophobicContact CB-CB 4.03Å; L888-Q892 HydrophobicContact CD2-CB 4.39Å; S889-Q892 WeakPolarHBondContact O-CA 3.09Å; S889-Q892 WeakPolarHBondContact O-CB 3.3Å; S889-Q892 PolarHBondContact O-N 3.2Å; S889-Q892 VanDerWaalsContact OG-CD 3.31Å; S889-Q892 WeakPolarHBondContact OG-CG 3.26Å; S889-Q892 PolarHBondContact OG-OE1 3.25Å; G890-Q892 VanDerWaalsContact C-N 3.29Å; G890-Q892 PolarHBondContact O-N 3.47Å; Q892-R895 WeakPolarHBondContact O-CB 3.33Å; Q892-R895 PolarHBondContact O-N 2.68Å; Q892-V896 WeakPolarHBondContact O-CG2 3.32Å; Q892-V896 PolarHBondContact O-N 3.14Å
893	R	88.7	Confident	88.5	Confident	45 Å²	45	29.2 Å²	29.2	17%	0.17	17%	0.166	C	C	.	.	H	α-helix	trans	-62.9	-41.9	176	-63.5	-169	-63.6	137	-3.5	111.8	A843 D844 L846 N885 L888 S889 G890 R895 V896 A897	A843-R893 HydrophobicContact CB-CB 3.94Å; A843-R893 PolarHBondContact O-NH1 2.73Å; D844-R893 IonicContact OD1-CZ 2.75Å; D844-R893 IonicContact OD1-NH1 3.97Å; D844-R893 PolarHBondContact OD1-NH1 2.85Å; D844-R893 IonicContact OD1-NH2 2.69Å; D844-R893 PolarHBondContact OD1-NH2 2.99Å; L846-R893 HydrophobicContact CD1-CB 3.83Å; L846-R893 HydrophobicContact CD1-CG 4.26Å; N885-R893 WeakPolarHBondContact O-CD 3.49Å; L888-R893 HydrophobicContact CB-CG 3.7Å; S889-R893 PolarHBondContact O-N 3.29Å; G890-R893 PolarHBondContact O-N 3.24Å; G890-R893 VanDerWaalsContact O-N 3.14Å; R893-R895 PolarHBondContact O-N 2.79Å; R893-V896 WeakPolarHBondContact O-CB 3.47Å; R893-V896 PolarHBondContact O-N 3.44Å; R893-A897 PolarHBondContact O-N 2.85Å
894	A	89.3	Confident	88.5	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.008	18%	0.176	C	C	.	.	H	α-helix	trans	-53.1	-47.5	170.6	0	0	0	0	0	112.5	Y838 G890 V896 A897 F898 L918	Y838-A894 WeakPolarHBondContact OH-CB 3.44Å; G890-A894 WeakPolarHBondContact O-CB 3.42Å; G890-A894 PolarHBondContact O-N 3.19Å; A894-V896 VanDerWaalsContact C-N 3.29Å; A894-V896 PolarHBondContact O-N 3.43Å; A894-A897 PolarHBondContact O-N 2.71Å; A894-A897 VanDerWaalsContact O-N 3.17Å; A894-F898 WeakPolarHBondContact O-CD2 3.46Å; A894-F898 PolarHBondContact O-N 2.84Å; A894-L918 HydrophobicContact CB-CD2 4.04Å
895	R	88.8	Confident	88.5	Confident	7 Å²	7	32.1 Å²	32.1	3%	0.026	18%	0.175	C	C	.	.	H	α-helix	trans	-62.1	-33.1	176.5	-65.7	166.5	-168.6	-77	0.1	113.1	Y753 F874 G891 Q892 R893 A899 D919 S922	Y753-R895 PolarHBondContact OH-NH1 3.01Å; Y753-R895 PolarHBondContact OH-NH2 3.34Å; Y753-R895 VanDerWaalsContact OH-NH2 3.1Å; F874-R895 HydrophobicContact CB-CB 4.48Å; F874-R895 WeakPolarHBondContact O-CD 3.48Å; F874-R895 WeakPolarHBondContact O-CG 3.42Å; F874-R895 PolarHBondContact O-NH1 3.34Å; G891-R895 WeakPolarHBondContact O-CD 3.34Å; G891-R895 VanDerWaalsContact O-CG 3.29Å; G891-R895 WeakPolarHBondContact O-CG 3.5Å; G891-R895 PolarHBondContact O-NE 3.08Å; Q892-R895 WeakPolarHBondContact O-CB 3.33Å; Q892-R895 PolarHBondContact O-N 2.68Å; R893-R895 PolarHBondContact O-N 2.79Å; R895-A899 WeakPolarHBondContact O-CB 3.42Å; R895-A899 PolarHBondContact O-N 2.95Å; R895-D919 IonicContact NH2-OD1 2.77Å; R895-D919 PolarHBondContact NH2-OD1 2.94Å; R895-D919 IonicContact NH2-OD2 3.75Å; R895-D919 PolarHBondContact NH2-OD2 2.9Å; R895-S922 PolarHBondContact NH1-OG 2.69Å; R895-S922 PolarHBondContact NH2-OG 2.88Å
896	V	91.4	Very high	88.7	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-68.5	-43.4	174.7	179.1	0	0	0	0	110.3	L846 P852 Y855 L871 L876 Q892 R893 A894 A899 E900	L846-V896 HydrophobicContact CD1-CB 3.98Å; L846-V896 HydrophobicContact CD1-CG1 4.07Å; L846-V896 HydrophobicContact CD2-CG1 4.08Å; P852-V896 HydrophobicContact CB-CG1 4.34Å; P852-V896 HydrophobicContact CB-CG2 3.8Å; P852-V896 HydrophobicContact CG-CG2 3.88Å; Y855-V896 HydrophobicContact CD1-CG1 4.17Å; L871-V896 HydrophobicContact CD2-CG2 4.15Å; L876-V896 HydrophobicContact CD2-CG2 4.08Å; Q892-V896 WeakPolarHBondContact O-CG2 3.32Å; Q892-V896 PolarHBondContact O-N 3.14Å; R893-V896 WeakPolarHBondContact O-CB 3.47Å; R893-V896 PolarHBondContact O-N 3.44Å; A894-V896 VanDerWaalsContact C-N 3.29Å; A894-V896 PolarHBondContact O-N 3.43Å; V896-A899 PolarHBondContact O-N 3.09Å; V896-E900 PolarHBondContact O-N 3.47Å
897	A	91.8	Very high	89.1	Confident	7 Å²	7	29.5 Å²	29.5	6%	0.058	15%	0.152	C	C	.	.	H	α-helix	trans	-63.1	-40.2	174.2	0	0	0	0	0	112.5	Y838 R893 A894 E900 L901	Y838-A897 HydrophobicContact CD2-CB 4.29Å; Y838-A897 HydrophobicContact CE2-CB 3.91Å; R893-A897 PolarHBondContact O-N 2.85Å; A894-A897 PolarHBondContact O-N 2.71Å; A894-A897 VanDerWaalsContact O-N 3.17Å; A897-E900 WeakPolarHBondContact O-CB 3.32Å; A897-E900 PolarHBondContact O-N 3.44Å; A897-L901 WeakPolarHBondContact O-CB 3.26Å; A897-L901 PolarHBondContact O-N 2.71Å
898	F	92.1	Very high	89.5	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-66.2	-36.7	172.4	-76.3	-65.9	0	0	0	113.2	F757 F759 Y838 F874 A894 E900 L901 S902 L911 P914 L918 L926	F757-F898 HydrophobicContact CE2-CD2 4.14Å; F757-F898 HydrophobicContact CE2-CG 4.24Å; F757-F898 HydrophobicContact CZ-CD2 4.33Å; F759-F898 HydrophobicContact CZ-CD1 4.31Å; Y838-F898 HydrophobicContact CD1-CZ 4.35Å; Y838-F898 HydrophobicContact CD2-CD1 4.18Å; Y838-F898 HydrophobicContact CD2-CD2 4.49Å; Y838-F898 AromaticContact CD2-CE1 3.82Å; Y838-F898 HydrophobicContact CD2-CE1 3.82Å; Y838-F898 HydrophobicContact CD2-CE2 4.15Å; Y838-F898 HydrophobicContact CD2-CG 4.49Å; Y838-F898 AromaticContact CD2-CZ 3.79Å; Y838-F898 HydrophobicContact CD2-CZ 3.79Å; Y838-F898 HydrophobicContact CE1-CE2 4.44Å; Y838-F898 HydrophobicContact CE1-CZ 4.15Å; Y838-F898 HydrophobicContact CE2-CD1 4.32Å; Y838-F898 AromaticContact CE2-CD2 3.84Å; Y838-F898 HydrophobicContact CE2-CD2 3.84Å; Y838-F898 AromaticContact CE2-CE1 4Å; Y838-F898 HydrophobicContact CE2-CE1 4Å; Y838-F898 AromaticContact CE2-CE2 3.46Å; Y838-F898 HydrophobicContact CE2-CE2 3.46Å; Y838-F898 VanDerWaalsContact CE2-CE2 3.46Å; Y838-F898 HydrophobicContact CE2-CG 4.24Å; Y838-F898 AromaticContact CE2-CZ 3.54Å; Y838-F898 HydrophobicContact CE2-CZ 3.54Å; Y838-F898 HydrophobicContact CG-CE1 4.24Å; Y838-F898 HydrophobicContact CG-CZ 4.19Å; Y838-F898 AromaticContact CZ-CE2 3.63Å; Y838-F898 AromaticContact CZ-CZ 3.73Å; F874-F898 HydrophobicContact CD1-CB 3.67Å; F874-F898 HydrophobicContact CE1-CB 3.83Å; A894-F898 WeakPolarHBondContact O-CD2 3.46Å; A894-F898 PolarHBondContact O-N 2.84Å; F898-E900 VanDerWaalsContact C-N 3.33Å; F898-L901 HydrophobicContact CD1-CD2 4.11Å; F898-L901 HydrophobicContact CE1-CD2 4.43Å; F898-L901 PolarHBondContact O-N 3.39Å; F898-S902 WeakPolarHBondContact O-CB 3.37Å; F898-S902 PolarHBondContact O-N 2.88Å; F898-L911 HydrophobicContact CE1-CD2 4.43Å; F898-P914 HydrophobicContact CZ-CB 3.88Å; F898-L918 HydrophobicContact CD2-CD2 4.47Å; F898-L918 HydrophobicContact CE2-CD1 4Å; F898-L918 HydrophobicContact CE2-CD2 4.15Å; F898-L918 HydrophobicContact CE2-CG 4.43Å; F898-L918 HydrophobicContact CZ-CD1 4.49Å; F898-L926 HydrophobicContact CE1-CD1 4.16Å; F898-L926 HydrophobicContact CZ-CD2 4.37Å
899	A	91.8	Very high	90	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-66.2	-35.4	173.8	0	0	0	0	0	112.3	L856 T870 L871 F874 R895 V896 R903	L856-A899 HydrophobicContact CD1-CB 4.26Å; T870-A899 HydrophobicContact CG2-CB 4.15Å; L871-A899 HydrophobicContact CD2-CB 4.17Å; F874-A899 HydrophobicContact CB-CB 4.3Å; F874-A899 HydrophobicContact CD2-CB 3.68Å; F874-A899 HydrophobicContact CE2-CB 4.27Å; F874-A899 HydrophobicContact CG-CB 3.93Å; R895-A899 WeakPolarHBondContact O-CB 3.42Å; R895-A899 PolarHBondContact O-N 2.95Å; V896-A899 PolarHBondContact O-N 3.09Å; A899-R903 WeakPolarHBondContact O-CG 3.38Å; A899-R903 PolarHBondContact O-N 2.89Å
900	E	91.8	Very high	90.6	Very high	18 Å²	18	20.9 Å²	20.9	8%	0.084	10%	0.103	C	C	.	.	H	α-helix	trans	-66.4	-49.6	170.8	-164.2	-158.1	160.2	0	0	111.3	Y855 L856 L859 F860 V896 A897 F898 S902 R903 R904	Y855-E900 HydrophobicContact CE1-CG 4.5Å; Y855-E900 PolarHBondContact OH-OE2 2.89Å; L856-E900 HydrophobicContact CD2-CB 4.1Å; L856-E900 HydrophobicContact CD2-CG 4.36Å; L859-E900 HydrophobicContact CD1-CG 3.95Å; F860-E900 HydrophobicContact CE2-CB 4.47Å; F860-E900 HydrophobicContact CE2-CG 3.67Å; F860-E900 HydrophobicContact CZ-CG 3.73Å; V896-E900 PolarHBondContact O-N 3.47Å; A897-E900 WeakPolarHBondContact O-CB 3.32Å; A897-E900 PolarHBondContact O-N 3.44Å; F898-E900 VanDerWaalsContact C-N 3.33Å; E900-S902 VanDerWaalsContact C-N 3.33Å; E900-S902 PolarHBondContact O-N 2.86Å; E900-R903 CarbonylContact O-C 3.58Å; E900-R903 WeakPolarHBondContact O-CA 3.29Å; E900-R903 PolarHBondContact O-N 2.97Å; E900-R904 PolarHBondContact O-N 2.79Å; E900-R904 IonicContact OE1-CZ 2.67Å; E900-R904 IonicContact OE1-NE 3.3Å; E900-R904 PolarHBondContact OE1-NE 2.9Å; E900-R904 IonicContact OE1-NH2 2.66Å; E900-R904 PolarHBondContact OE1-NH2 3.3Å; E900-R904 IonicContact OE2-NH2 2.7Å
901	L	91.8	Very high	91.2	Very high	5 Å²	5	20 Å²	20	3%	0.026	9%	0.093	C	C	.	.	H	α-helix	trans	-55.4	-45.5	-179.9	-175.1	63.9	0	0	0	111.9	F759 G836 A897 F898 R903 R904 P906 L909 L911	F759-L901 HydrophobicContact CE1-CD2 4.13Å; F759-L901 HydrophobicContact CE1-CG 4.29Å; G836-L901 VanDerWaalsContact CA-CD1 3.47Å; A897-L901 WeakPolarHBondContact O-CB 3.26Å; A897-L901 PolarHBondContact O-N 2.71Å; F898-L901 HydrophobicContact CD1-CD2 4.11Å; F898-L901 HydrophobicContact CE1-CD2 4.43Å; F898-L901 PolarHBondContact O-N 3.39Å; L901-R903 VanDerWaalsContact C-N 3.33Å; L901-R903 PolarHBondContact O-N 2.89Å; L901-R904 PolarHBondContact O-N 3.32Å; L901-P906 HydrophobicContact CD1-CG 4.43Å; L901-P906 VanDerWaalsContact O-CD 3.3Å; L901-P906 WeakPolarHBondContact O-CD 3.37Å; L901-L909 HydrophobicContact CD1-CD2 4.18Å; L901-L909 HydrophobicContact CD2-CD2 3.94Å; L901-L909 HydrophobicContact CG-CD2 4Å; L901-L911 HydrophobicContact CD2-CD2 3.96Å
902	S	92	Very high	91.7	Very high	18 Å²	18	20.1 Å²	20.1	13%	0.126	9%	0.092	C	C	.	.	H	α-helix	trans	-61.5	-37.7	173.2	174.5	0	0	0	0	112.9	T758 P760 F874 F898 E900 A905	T758-S902 PolarHBondContact O-OG 2.95Å; P760-S902 WeakPolarHBondContact CD-O 3.36Å; F874-S902 VanDerWaalsContact CZ-CB 3.43Å; F898-S902 WeakPolarHBondContact O-CB 3.37Å; F898-S902 PolarHBondContact O-N 2.88Å; E900-S902 VanDerWaalsContact C-N 3.33Å; E900-S902 PolarHBondContact O-N 2.86Å; S902-A905 PolarHBondContact O-N 2.88Å
903	R	91.4	Very high	91.7	Very high	98 Å²	98	19 Å²	19	37%	0.37	9%	0.087	S	C	.	.	H	α-helix	trans	-76.8	-22.1	177.5	-73.1	-63.1	-168.3	166.7	3	114.6	F860 L862 T870 A899 E900 L901 A905	F860-R903 HydrophobicContact CD1-CB 4.13Å; F860-R903 HydrophobicContact CD2-CB 3.86Å; F860-R903 HydrophobicContact CE1-CB 3.85Å; F860-R903 WeakPolarHBondContact CE1-O 3.36Å; F860-R903 HydrophobicContact CE2-CB 3.56Å; F860-R903 HydrophobicContact CG-CB 4.14Å; F860-R903 HydrophobicContact CZ-CB 3.56Å; L862-R903 HydrophobicContact CD1-CG 4.4Å; T870-R903 HydrophobicContact CG2-CG 3.91Å; T870-R903 PolarHBondContact OG1-NE 3.16Å; T870-R903 VanDerWaalsContact OG1-NE 3.09Å; T870-R903 PolarHBondContact OG1-NH2 2.77Å; A899-R903 WeakPolarHBondContact O-CG 3.38Å; A899-R903 PolarHBondContact O-N 2.89Å; E900-R903 CarbonylContact O-C 3.58Å; E900-R903 WeakPolarHBondContact O-CA 3.29Å; E900-R903 PolarHBondContact O-N 2.97Å; L901-R903 VanDerWaalsContact C-N 3.33Å; L901-R903 PolarHBondContact O-N 2.89Å; R903-A905 PolarHBondContact O-N 3.21Å
904	R	90.6	Very high	91.7	Very high	126 Å²	126	16.8 Å²	16.8	48%	0.475	8%	0.079	S	C	.	.	H	α-helix	trans	-67.2	-20.4	169.1	-67.3	-176	179.7	-168.8	2	112.9	F860 E900 L901	F860-R904 HydrophobicContact CE1-CG 4.03Å; F860-R904 HydrophobicContact CZ-CG 3.82Å; E900-R904 PolarHBondContact O-N 2.79Å; E900-R904 IonicContact OE1-CZ 2.67Å; E900-R904 IonicContact OE1-NE 3.3Å; E900-R904 PolarHBondContact OE1-NE 2.9Å; E900-R904 IonicContact OE1-NH2 2.66Å; E900-R904 PolarHBondContact OE1-NH2 3.3Å; E900-R904 IonicContact OE2-NH2 2.7Å; L901-R904 PolarHBondContact O-N 3.32Å
905	A	91	Very high	91.6	Very high	35 Å²	35	17.1 Å²	17.1	29%	0.289	8%	0.081	S	C	.	.			trans	48.5	66.7	-175.9	0	0	0	0	0	113.2	P760 K834 S902 R903	P760-A905 HydrophobicContact CG-CB 3.59Å; K834-A905 VanDerWaalsContact CD-O 3.26Å; K834-A905 WeakPolarHBondContact CD-O 3.38Å; S902-A905 PolarHBondContact O-N 2.88Å; R903-A905 PolarHBondContact O-N 3.21Å
906	P	92.8	Very high	91.4	Very high	2 Å²	2	17 Å²	17	1%	0.013	8%	0.081	C	C	.	.			trans	-77.9	154.5	179.6	34.1	-36.2	0	0	0	112.5	G836 L901 L909 F933	G836-P906 VanDerWaalsContact N-CB 3.35Å; L901-P906 HydrophobicContact CD1-CG 4.43Å; L901-P906 VanDerWaalsContact O-CD 3.3Å; L901-P906 WeakPolarHBondContact O-CD 3.37Å; P906-L909 HydrophobicContact CG-CD2 3.56Å; P906-L909 HydrophobicContact CG-CG 4.39Å; P906-F933 WeakPolarHBondContact O-CZ 3.32Å
907	D	93.5	Very high	90.8	Very high	7 Å²	7	20.4 Å²	20.4	4%	0.037	10%	0.099	C	C	.	.	S	Bend	trans	-97.7	-24.3	174.1	-38.8	-82.4	0	0	0	112.4	P762 I765 M795 V833 K834 G935 G936	P762-D907 HydrophobicContact CB-CB 3.74Å; P762-D907 WeakPolarHBondContact CB-OD1 3.5Å; I765-D907 HydrophobicContact CD1-CB 4.4Å; M795-D907 HydrophobicContact CE-CB 3.67Å; M795-D907 HydrophobicContact SD-CB 4.36Å; V833-D907 HydrophobicContact CG1-CB 4.46Å; K834-D907 WeakPolarHBondContact CB-OD2 3.38Å; K834-D907 PolarHBondContact N-OD2 2.77Å; K834-D907 PolarHBondContact O-N 2.97Å; D907-G935 WeakPolarHBondContact O-CA 3.41Å; D907-G936 PolarHBondContact O-N 2.84Å; D907-G936 VanDerWaalsContact O-N 3.14Å
908	I	93.9	Very high	90.6	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	127.8	168	-59.6	178.7	0	0	0	109.1	I769 L770 I793 V833 K834 G836 I910 G936	I769-I908 HydrophobicContact CG2-CD1 3.97Å; L770-I908 HydrophobicContact CB-CD1 3.89Å; L770-I908 HydrophobicContact CD2-CD1 4.17Å; I793-I908 HydrophobicContact CG2-CD1 4.4Å; V833-I908 HydrophobicContact CG1-CD1 3.83Å; V833-I908 HydrophobicContact CG1-CG1 3.96Å; K834-I908 PolarHBondContact O-N 2.8Å; G836-I908 PolarHBondContact N-O 2.93Å; I908-I910 HydrophobicContact CG2-CG1 4.08Å; I908-G936 CarbonylContact C-O 3.52Å; I908-G936 WeakPolarHBondContact CA-O 3.38Å
909	L	94.6	Very high	90.2	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	127.8	168.6	-68.5	171.9	0	0	0	110.1	F759 L901 P906 L911 F933 G936 V937 I938	F759-L909 HydrophobicContact CD1-CD1 4.41Å; F759-L909 HydrophobicContact CD1-CD2 4.4Å; F759-L909 HydrophobicContact CD2-CD1 3.87Å; F759-L909 HydrophobicContact CE2-CD1 4.12Å; F759-L909 HydrophobicContact CG-CD1 4.03Å; L901-L909 HydrophobicContact CD1-CD2 4.18Å; L901-L909 HydrophobicContact CD2-CD2 3.94Å; L901-L909 HydrophobicContact CG-CD2 4Å; P906-L909 HydrophobicContact CG-CD2 3.56Å; P906-L909 HydrophobicContact CG-CG 4.39Å; L909-L911 HydrophobicContact CB-CG 4.48Å; L909-F933 HydrophobicContact CB-CE1 4.43Å; L909-F933 HydrophobicContact CD1-CD1 3.72Å; L909-F933 HydrophobicContact CD1-CE1 3.63Å; L909-F933 HydrophobicContact CD1-CG 4.25Å; L909-F933 HydrophobicContact CD1-CZ 4.1Å; L909-F933 HydrophobicContact CG-CD1 4.33Å; L909-F933 HydrophobicContact CG-CE1 3.72Å; L909-F933 HydrophobicContact CG-CZ 3.99Å; L909-G936 PolarHBondContact N-O 2.85Å; L909-V937 HydrophobicContact CB-CG1 4.27Å; L909-V937 HydrophobicContact CB-CG2 4.34Å; L909-V937 HydrophobicContact CD1-CG2 4.34Å; L909-V937 WeakPolarHBondContact O-CA 3.43Å; L909-I938 PolarHBondContact O-N 2.9Å
910	I	94.7	Very high	89.9	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	114.6	171.4	-63.4	-172.8	0	0	0	107.6	L813 L816 T817 I835 G836 K837 Y838 I908 I938	L813-I910 HydrophobicContact CB-CG2 4.21Å; L813-I910 HydrophobicContact CD1-CG2 3.87Å; L813-I910 HydrophobicContact CD2-CG2 3.7Å; L813-I910 HydrophobicContact CG-CG2 4.14Å; L816-I910 HydrophobicContact CB-CD1 4.04Å; T817-I910 HydrophobicContact CG2-CD1 4.08Å; I835-I910 HydrophobicContact CG2-CD1 3.63Å; I835-I910 HydrophobicContact CG2-CG1 3.95Å; G836-I910 PolarHBondContact O-N 2.93Å; K837-I910 CarbonylContact C-O 3.55Å; K837-I910 WeakPolarHBondContact CA-O 3.32Å; Y838-I910 PolarHBondContact N-O 3.09Å; I908-I910 HydrophobicContact CG2-CG1 4.08Å; I910-I938 WeakPolarHBondContact CA-O 3.32Å; I910-I938 HydrophobicContact CD1-CD1 4.38Å; I910-I938 HydrophobicContact CG1-CB 4.4Å; I910-I938 HydrophobicContact CG1-CD1 4.25Å
911	L	93.6	Very high	89.6	Confident	0 Å²	0	24 Å²	24	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	103.9	-170.7	-54.9	179.6	0	0	0	110.7	F898 L901 L909 P914 I930 I938 V939 V940	F898-L911 HydrophobicContact CE1-CD2 4.43Å; L901-L911 HydrophobicContact CD2-CD2 3.96Å; L909-L911 HydrophobicContact CB-CG 4.48Å; L911-P914 HydrophobicContact CB-CB 4.05Å; L911-P914 HydrophobicContact CB-CG 3.85Å; L911-P914 HydrophobicContact CD1-CB 4.43Å; L911-P914 HydrophobicContact CD1-CG 4.35Å; L911-I930 HydrophobicContact CD1-CD1 4.01Å; L911-I938 PolarHBondContact N-O 3.13Å; L911-V939 HydrophobicContact CB-CG2 4.33Å; L911-V939 WeakPolarHBondContact O-CA 3.42Å; L911-V940 PolarHBondContact O-N 2.88Å
912	D	91.6	Very high	89.4	Confident	9 Å²	9	23.8 Å²	23.8	5%	0.048	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	115.9	173.2	-148.7	-6.6	0	0	0	110.3	S810 L813 Y838 V940	S810-D912 WeakPolarHBondContact CB-OD2 3.48Å; S810-D912 PolarHBondContact OG-OD2 3.45Å; L813-D912 HydrophobicContact CD1-CB 3.66Å; Y838-D912 PolarHBondContact O-N 2.79Å; D912-V940 WeakPolarHBondContact OD1-CB 3.33Å; D912-V940 WeakPolarHBondContact OD1-CG1 3.5Å
913	E	87.6	Confident	89.2	Confident	20 Å²	20	23.2 Å²	23.2	9%	0.093	11%	0.109	C	C	.	.	S	Bend	trans	39.3	58.4	-174.6	-58.3	-171.3	168.9	0	0	115.4	Q840 T915 N916 V940	Q840-E913 PolarHBondContact NE2-OE2 2.94Å; Q840-E913 VanDerWaalsContact NE2-OE2 3.09Å; E913-T915 PolarHBondContact O-N 3.21Å; E913-T915 VanDerWaalsContact O-N 3.13Å; E913-N916 WeakPolarHBondContact CB-ND2 3.29Å; E913-N916 WeakPolarHBondContact O-CB 3.43Å; E913-N916 PolarHBondContact O-N 3.45Å; E913-N916 PolarHBondContact O-ND2 3.13Å; E913-N916 PolarHBondContact OE2-ND2 3.33Å; E913-V940 VanDerWaalsContact CA-O 3.23Å; E913-V940 WeakPolarHBondContact CA-O 3.48Å; E913-V940 HydrophobicContact CG-CG1 4.34Å; E913-V940 PolarHBondContact N-O 2.83Å
914	P	89.7	Confident	89.1	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-14.4	-172.2	29.5	-37.2	0	0	0	114.9	Y838 F898 L911 N916 L918 L926 V939 V940 L946	Y838-P914 HydrophobicContact CD1-CB 4.37Å; Y838-P914 HydrophobicContact CE1-CB 4.46Å; F898-P914 HydrophobicContact CZ-CB 3.88Å; L911-P914 HydrophobicContact CB-CB 4.05Å; L911-P914 HydrophobicContact CB-CG 3.85Å; L911-P914 HydrophobicContact CD1-CB 4.43Å; L911-P914 HydrophobicContact CD1-CG 4.35Å; P914-N916 VanDerWaalsContact C-N 3.33Å; P914-L918 WeakPolarHBondContact O-CD1 3.4Å; P914-L926 HydrophobicContact CB-CD2 3.97Å; P914-L926 HydrophobicContact CG-CD2 4.3Å; P914-V939 HydrophobicContact CG-CG2 3.87Å; P914-V940 VanDerWaalsContact CD-O 3.27Å; P914-V940 WeakPolarHBondContact CD-O 3.45Å; P914-L946 HydrophobicContact CG-CD2 4.15Å
915	T	86.5	Confident	89.1	Confident	8 Å²	8	14.4 Å²	14.4	5%	0.049	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-19.9	177.6	47	0	0	0	0	113.1	E913 N917 L918 I923 H942 D943 L946	E913-T915 PolarHBondContact O-N 3.21Å; E913-T915 VanDerWaalsContact O-N 3.13Å; T915-N917 PolarHBondContact O-N 3.43Å; T915-L918 PolarHBondContact O-N 3.39Å; T915-L918 VanDerWaalsContact O-N 3.11Å; T915-I923 HydrophobicContact CG2-CD1 4.17Å; T915-I923 HydrophobicContact CG2-CG1 4.31Å; T915-I923 HydrophobicContact CG2-CG2 4.33Å; T915-H942 PolarHBondContact OG1-CE1 3.33Å; T915-H942 PolarHBondContact OG1-NE2 2.78Å; T915-D943 HydrophobicContact CG2-CB 3.83Å; T915-L946 HydrophobicContact CG2-CD2 3.78Å
916	N	84.5	Confident	89.1	Confident	4 Å²	4	12.7 Å²	12.7	2%	0.021	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	128.1	-178.8	-77.9	-34.7	0	0	0	111.7	Q840 E913 P914 L918	Q840-N916 PolarHBondContact NE2-ND2 3.35Å; E913-N916 WeakPolarHBondContact CB-ND2 3.29Å; E913-N916 WeakPolarHBondContact O-CB 3.43Å; E913-N916 PolarHBondContact O-N 3.45Å; E913-N916 PolarHBondContact O-ND2 3.13Å; E913-N916 PolarHBondContact OE2-ND2 3.33Å; P914-N916 VanDerWaalsContact C-N 3.33Å; N916-L918 PolarHBondContact O-N 3.12Å
917	N	80.7	Confident	89.1	Confident	72 Å²	72	12.8 Å²	12.8	39%	0.385	7%	0.067	S	C	.	.	T	Hydrogen-bonded Turn	trans	60	3.1	-178.4	-45.4	110.7	0	0	0	116.7	N481 G891 T915	N481-N917 PolarHBondContact ND2-O 2.86Å; G891-N917 WeakPolarHBondContact CA-O 3.45Å; T915-N917 PolarHBondContact O-N 3.43Å
918	L	85.6	Confident	89.1	Confident	2 Å²	2	17.3 Å²	17.3	1%	0.01	9%	0.091	C	C	.	.			trans	-73.9	158.2	169.9	-66.8	-171	0	0	0	111	H650 F757 A894 F898 P914 T915 N916 I923 L926	H650-L918 PolarHBondContact CD2-O 3.04Å; H650-L918 VanDerWaalsContact CD2-O 3.27Å; F757-L918 HydrophobicContact CE2-CD1 4.4Å; A894-L918 HydrophobicContact CB-CD2 4.04Å; F898-L918 HydrophobicContact CD2-CD2 4.47Å; F898-L918 HydrophobicContact CE2-CD1 4Å; F898-L918 HydrophobicContact CE2-CD2 4.15Å; F898-L918 HydrophobicContact CE2-CG 4.43Å; F898-L918 HydrophobicContact CZ-CD1 4.49Å; P914-L918 WeakPolarHBondContact O-CD1 3.4Å; T915-L918 PolarHBondContact O-N 3.39Å; T915-L918 VanDerWaalsContact O-N 3.11Å; N916-L918 PolarHBondContact O-N 3.12Å; L918-I923 HydrophobicContact CB-CD1 4.43Å; L918-I923 HydrophobicContact CB-CG1 3.88Å; L918-I923 HydrophobicContact CD1-CG1 4.34Å; L918-L926 HydrophobicContact CD1-CD2 4.33Å
919	D	85.3	Confident	89	Confident	10 Å²	10	17.3 Å²	17.3	5%	0.053	9%	0.091	C	C	.	.			trans	-99.8	162.2	166.9	53	33.5	0	0	0	111.2	R895 E921 S922 I923	R895-D919 IonicContact NH2-OD1 2.77Å; R895-D919 PolarHBondContact NH2-OD1 2.94Å; R895-D919 IonicContact NH2-OD2 3.75Å; R895-D919 PolarHBondContact NH2-OD2 2.9Å; D919-E921 VanDerWaalsContact C-N 3.3Å; D919-E921 PolarHBondContact O-N 3.21Å; D919-S922 WeakPolarHBondContact O-CA 3.26Å; D919-S922 WeakPolarHBondContact O-CB 3.23Å; D919-S922 PolarHBondContact O-N 3.01Å; D919-S922 WeakPolarHBondContact OD1-CB 3.25Å; D919-S922 PolarHBondContact OD1-N 3.21Å; D919-S922 PolarHBondContact OD1-OG 2.89Å; D919-I923 PolarHBondContact O-N 2.65Å
920	I	85.2	Confident	89	Confident	14 Å²	14	17.4 Å²	17.4	7%	0.072	9%	0.092	C	C	.	.	H	α-helix	trans	-52.1	-43.7	-175.4	-71.5	162	0	0	0	112.7	H650 Q652 Y677 S922 I923 D924	H650-I920 HydrophobicContact CB-CG1 4.33Å; H650-I920 WeakPolarHBondContact O-CG1 3.45Å; Q652-I920 VanDerWaalsContact CD-CG2 3.45Å; Q652-I920 HydrophobicContact CG-CD1 4.14Å; Q652-I920 HydrophobicContact CG-CG1 4Å; Q652-I920 HydrophobicContact CG-CG2 3.97Å; Y677-I920 HydrophobicContact CE2-CD1 3.89Å; Y677-I920 WeakPolarHBondContact OH-CG2 3.38Å; I920-S922 PolarHBondContact O-N 3.24Å; I920-I923 PolarHBondContact O-N 2.97Å; I920-D924 PolarHBondContact O-N 2.99Å
921	E	84.7	Confident	88.9	Confident	74 Å²	74	21.2 Å²	21.2	35%	0.346	11%	0.112	S	C	.	.	H	α-helix	trans	-67.6	-17.5	178.6	-66.5	-167.7	165.4	0	0	112.6	R688 Y753 D919 A925	R688-E921 IonicContact NH1-OE1 2.81Å; R688-E921 PolarHBondContact NH1-OE1 2.85Å; Y753-E921 WeakPolarHBondContact CD1-OE2 3.15Å; D919-E921 VanDerWaalsContact C-N 3.3Å; D919-E921 PolarHBondContact O-N 3.21Å; E921-A925 WeakPolarHBondContact O-CB 3.24Å; E921-A925 PolarHBondContact O-N 3.16Å
922	S	87.4	Confident	88.8	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-92.6	-30.1	173.7	-51.2	0	0	0	0	113.8	R895 D919 I920 A925 L926	R895-S922 PolarHBondContact NH1-OG 2.69Å; R895-S922 PolarHBondContact NH2-OG 2.88Å; D919-S922 WeakPolarHBondContact O-CA 3.26Å; D919-S922 WeakPolarHBondContact O-CB 3.23Å; D919-S922 PolarHBondContact O-N 3.01Å; D919-S922 WeakPolarHBondContact OD1-CB 3.25Å; D919-S922 PolarHBondContact OD1-N 3.21Å; D919-S922 PolarHBondContact OD1-OG 2.89Å; I920-S922 PolarHBondContact O-N 3.24Å; S922-A925 PolarHBondContact O-N 3.13Å; S922-L926 WeakPolarHBondContact O-CB 3.48Å; S922-L926 PolarHBondContact O-N 2.86Å
923	I	88.7	Confident	88.9	Confident	6 Å²	6	27 Å²	27	3%	0.031	14%	0.138	C	C	.	.	H	α-helix	trans	-68.1	-45.8	172	-62.1	172.8	0	0	0	109.3	T915 L918 D919 I920 A925 L926 A927	T915-I923 HydrophobicContact CG2-CD1 4.17Å; T915-I923 HydrophobicContact CG2-CG1 4.31Å; T915-I923 HydrophobicContact CG2-CG2 4.33Å; L918-I923 HydrophobicContact CB-CD1 4.43Å; L918-I923 HydrophobicContact CB-CG1 3.88Å; L918-I923 HydrophobicContact CD1-CG1 4.34Å; D919-I923 PolarHBondContact O-N 2.65Å; I920-I923 PolarHBondContact O-N 2.97Å; I923-A925 VanDerWaalsContact C-N 3.29Å; I923-A925 PolarHBondContact O-N 3.03Å; I923-L926 PolarHBondContact O-N 2.97Å; I923-L926 VanDerWaalsContact O-N 3.11Å; I923-A927 PolarHBondContact O-N 3.32Å
924	D	88.8	Confident	89.1	Confident	33 Å²	33	32.5 Å²	32.5	18%	0.176	16%	0.164	C	C	.	.	H	α-helix	trans	-55	-44.9	171.5	-76	32.3	0	0	0	110.8	Q652 K681 I920 L926 A927 D928 R945	Q652-D924 PolarHBondContact NE2-OD1 2.96Å; K681-D924 IonicContact NZ-OD1 2.87Å; K681-D924 IonicContact NZ-OD2 3.38Å; K681-D924 PolarHBondContact NZ-OD2 3.41Å; I920-D924 PolarHBondContact O-N 2.99Å; D924-L926 PolarHBondContact O-N 2.94Å; D924-A927 PolarHBondContact O-N 3.36Å; D924-D928 PolarHBondContact O-N 3.09Å; D924-D928 VanDerWaalsContact O-N 3.13Å; D924-R945 IonicContact OD1-CZ 3.84Å; D924-R945 IonicContact OD1-NH1 3.39Å; D924-R945 PolarHBondContact OD1-NH1 2.87Å; D924-R945 IonicContact OD1-NH2 3.71Å; D924-R945 IonicContact OD2-CZ 3.56Å; D924-R945 IonicContact OD2-NH1 3.15Å; D924-R945 PolarHBondContact OD2-NH1 2.77Å; D924-R945 VanDerWaalsContact OD2-NH1 3.08Å; D924-R945 IonicContact OD2-NH2 3.9Å
925	A	90.6	Very high	89.2	Confident	6 Å²	6	32.5 Å²	32.5	5%	0.05	16%	0.164	C	C	.	.	H	α-helix	trans	-70.9	-24.4	177.9	0	0	0	0	0	114.6	V755 E921 S922 I923 A929	V755-A925 HydrophobicContact CB-CB 4.08Å; V755-A925 HydrophobicContact CG1-CB 4.01Å; E921-A925 WeakPolarHBondContact O-CB 3.24Å; E921-A925 PolarHBondContact O-N 3.16Å; S922-A925 PolarHBondContact O-N 3.13Å; I923-A925 VanDerWaalsContact C-N 3.29Å; I923-A925 PolarHBondContact O-N 3.03Å; A925-A929 WeakPolarHBondContact O-CB 3.14Å; A925-A929 PolarHBondContact O-N 2.77Å
926	L	92.3	Very high	89.5	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-75.7	-40.6	173.9	178.6	63.5	0	0	0	111.1	F757 F759 F898 P914 L918 S922 I923 D924 A929 I930 L946	F757-L926 HydrophobicContact CD2-CB 3.8Å; F757-L926 HydrophobicContact CD2-CD1 3.9Å; F757-L926 HydrophobicContact CD2-CG 4.43Å; F757-L926 HydrophobicContact CE2-CB 4.02Å; F757-L926 HydrophobicContact CE2-CD1 4.35Å; F759-L926 HydrophobicContact CE2-CD1 4.13Å; F759-L926 HydrophobicContact CZ-CD1 4.2Å; F898-L926 HydrophobicContact CE1-CD1 4.16Å; F898-L926 HydrophobicContact CZ-CD2 4.37Å; P914-L926 HydrophobicContact CB-CD2 3.97Å; P914-L926 HydrophobicContact CG-CD2 4.3Å; L918-L926 HydrophobicContact CD1-CD2 4.33Å; S922-L926 WeakPolarHBondContact O-CB 3.48Å; S922-L926 PolarHBondContact O-N 2.86Å; I923-L926 PolarHBondContact O-N 2.97Å; I923-L926 VanDerWaalsContact O-N 3.11Å; D924-L926 PolarHBondContact O-N 2.94Å; L926-A929 PolarHBondContact O-N 3.1Å; L926-I930 HydrophobicContact CD1-CD1 4.05Å; L926-I930 HydrophobicContact CD1-CG1 4.35Å; L926-I930 HydrophobicContact CG-CD1 3.93Å; L926-I930 WeakPolarHBondContact O-CG1 3.47Å; L926-I930 PolarHBondContact O-N 2.79Å; L926-L946 HydrophobicContact CD2-CD2 4.4Å
927	A	91.9	Very high	90	Very high	3 Å²	3	32 Å²	32	3%	0.025	16%	0.161	C	C	.	.	H	α-helix	trans	-61.5	-47.6	174.4	0	0	0	0	0	111.3	I923 D924 A929 I930 N931 L946 D949 T950	I923-A927 PolarHBondContact O-N 3.32Å; D924-A927 PolarHBondContact O-N 3.36Å; A927-A929 VanDerWaalsContact C-N 3.3Å; A927-A929 PolarHBondContact O-N 2.84Å; A927-I930 PolarHBondContact O-N 2.92Å; A927-N931 PolarHBondContact O-N 3.41Å; A927-N931 PolarHBondContact O-ND2 2.89Å; A927-L946 HydrophobicContact CB-CD1 3.97Å; A927-D949 HydrophobicContact CB-CB 4.02Å; A927-T950 HydrophobicContact CB-CG2 4.26Å
928	D	92.9	Very high	90.7	Very high	102 Å²	102	28.5 Å²	28.5	55%	0.545	14%	0.143	S	C	.	.	H	α-helix	trans	-52.9	-47	171.7	-78.4	-10	0	0	0	111.3	D924 I930 N931 E932	D924-D928 PolarHBondContact O-N 3.09Å; D924-D928 VanDerWaalsContact O-N 3.13Å; D928-I930 PolarHBondContact O-N 3.33Å; D928-N931 PolarHBondContact O-N 2.67Å; D928-E932 PolarHBondContact O-N 3.44Å
929	A	93	Very high	91.1	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.008	14%	0.143	C	C	.	.	H	α-helix	trans	-70.4	-29.2	-177.8	0	0	0	0	0	114.5	F757 F759 A925 L926 A927 F933	F757-A929 HydrophobicContact CB-CB 3.74Å; F759-A929 HydrophobicContact CD2-CB 3.92Å; F759-A929 HydrophobicContact CE2-CB 3.82Å; A925-A929 WeakPolarHBondContact O-CB 3.14Å; A925-A929 PolarHBondContact O-N 2.77Å; L926-A929 PolarHBondContact O-N 3.1Å; A927-A929 VanDerWaalsContact C-N 3.3Å; A927-A929 PolarHBondContact O-N 2.84Å; A929-F933 VanDerWaalsContact O-CB 3.3Å; A929-F933 WeakPolarHBondContact O-CB 3.49Å; A929-F933 PolarHBondContact O-N 3.06Å
930	I	93.2	Very high	91.4	Very high	2 Å²	2	28.1 Å²	28.1	1%	0.01	14%	0.141	C	C	.	.	H	α-helix	trans	-74.4	-29.6	173.4	-71.7	166.4	0	0	0	110.9	R798 L911 L926 A927 D928 V937 L946 T950	R798-I930 PolarHBondContact NH2-O 2.96Å; L911-I930 HydrophobicContact CD1-CD1 4.01Å; L926-I930 HydrophobicContact CD1-CD1 4.05Å; L926-I930 HydrophobicContact CD1-CG1 4.35Å; L926-I930 HydrophobicContact CG-CD1 3.93Å; L926-I930 WeakPolarHBondContact O-CG1 3.47Å; L926-I930 PolarHBondContact O-N 2.79Å; A927-I930 PolarHBondContact O-N 2.92Å; D928-I930 PolarHBondContact O-N 3.33Å; I930-V937 HydrophobicContact CG1-CG1 4.45Å; I930-V937 HydrophobicContact CG2-CB 4.49Å; I930-V937 HydrophobicContact CG2-CG1 4.12Å; I930-V937 HydrophobicContact CG2-CG2 4.28Å; I930-L946 HydrophobicContact CD1-CD1 4.42Å; I930-T950 HydrophobicContact CB-CG2 3.75Å; I930-T950 HydrophobicContact CD1-CG2 4.18Å; I930-T950 HydrophobicContact CG2-CG2 3.48Å; I930-T950 VanDerWaalsContact CG2-CG2 3.48Å
931	N	93	Very high	91.5	Very high	80 Å²	80	27.8 Å²	27.8	43%	0.428	14%	0.14	S	C	.	.	H	α-helix	trans	-77.6	-31.7	174.6	-74.2	-33.1	0	0	0	113.2	A927 D928 D949	A927-N931 PolarHBondContact O-N 3.41Å; A927-N931 PolarHBondContact O-ND2 2.89Å; D928-N931 PolarHBondContact O-N 2.67Å; N931-D949 PolarHBondContact ND2-O 3.03Å; N931-D949 PolarHBondContact OD1-O 3.05Å
932	E	92.5	Very high	91.5	Very high	125 Å²	125	24.8 Å²	24.8	58%	0.584	13%	0.125	S	C	*	.	H	α-helix	trans	-78	-20.5	174.2	-72.7	-173.6	167.6	0	0	114	N761 D928	N761-E932 PolarHBondContact OD1-O 3.23Å; D928-E932 PolarHBondContact O-N 3.44Å
933	F	92.9	Very high	91.4	Very high	4 Å²	4	24.9 Å²	24.9	2%	0.018	13%	0.126	C	C	.	.			trans	-81	123.4	-172	177.2	-115.3	0	0	0	113.8	F759 R798 P906 L909 A929 G935 V937	F759-F933 HydrophobicContact CB-CD2 3.64Å; F759-F933 HydrophobicContact CB-CE2 4.08Å; F759-F933 HydrophobicContact CB-CG 4.25Å; R798-F933 PolarHBondContact NH2-O 3.39Å; P906-F933 WeakPolarHBondContact O-CZ 3.32Å; L909-F933 HydrophobicContact CB-CE1 4.43Å; L909-F933 HydrophobicContact CD1-CD1 3.72Å; L909-F933 HydrophobicContact CD1-CE1 3.63Å; L909-F933 HydrophobicContact CD1-CG 4.25Å; L909-F933 HydrophobicContact CD1-CZ 4.1Å; L909-F933 HydrophobicContact CG-CD1 4.33Å; L909-F933 HydrophobicContact CG-CE1 3.72Å; L909-F933 HydrophobicContact CG-CZ 3.99Å; A929-F933 VanDerWaalsContact O-CB 3.3Å; A929-F933 WeakPolarHBondContact O-CB 3.49Å; A929-F933 PolarHBondContact O-N 3.06Å; F933-G935 VanDerWaalsContact C-N 3.3Å; F933-G935 WeakPolarHBondContact CD1-O 3.32Å; F933-G935 WeakPolarHBondContact CE1-O 3.46Å; F933-G935 PolarHBondContact O-N 2.99Å; F933-V937 HydrophobicContact CD1-CG2 3.67Å; F933-V937 HydrophobicContact CE1-CG2 4Å
934	E	91.6	Very high	91.3	Very high	137 Å²	137	25.5 Å²	25.5	64%	0.64	13%	0.129	S	C	*	.			trans	-84	8.3	-178.1	-70.1	173.7	138.3	0	0	115.1	N761	N761-E934 HydrophobicContact CB-CB 4.11Å; N761-E934 HydrophobicContact CB-CG 4.48Å; N761-E934 WeakPolarHBondContact CB-OE2 3.39Å; N761-E934 VanDerWaalsContact ND2-CG 3.34Å; N761-E934 WeakPolarHBondContact ND2-CG 3.3Å; N761-E934 PolarHBondContact ND2-OE2 2.9Å; N761-E934 PolarHBondContact OD1-N 3.17Å
935	G	91.4	Very high	91.1	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.13	C	C	.	.	S	Bend	trans	-101.9	172.8	176.2	0	0	0	0	0	114.3	M795 R798 D907 F933	M795-G935 CarbonylContact O-C 3.3Å; M795-G935 VanDerWaalsContact O-O 3.1Å; R798-G935 PolarHBondContact NH1-O 3.4Å; D907-G935 WeakPolarHBondContact O-CA 3.41Å; F933-G935 VanDerWaalsContact C-N 3.3Å; F933-G935 WeakPolarHBondContact CD1-O 3.32Å; F933-G935 WeakPolarHBondContact CE1-O 3.46Å; F933-G935 PolarHBondContact O-N 2.99Å
936	G	93	Very high	90.9	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	140.9	-177.6	0	0	0	0	0	111.7	M795 D907 I908 L909	M795-G936 WeakPolarHBondContact O-CA 3.42Å; M795-G936 PolarHBondContact O-N 3.26Å; D907-G936 PolarHBondContact O-N 2.84Å; D907-G936 VanDerWaalsContact O-N 3.14Å; I908-G936 CarbonylContact C-O 3.52Å; I908-G936 WeakPolarHBondContact CA-O 3.38Å; L909-G936 PolarHBondContact N-O 2.85Å
937	V	94.9	Very high	90.8	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	127.8	-178.3	-171.7	0	0	0	0	111	S797 I799 L909 I930 F933	S797-V937 PolarHBondContact O-N 3.03Å; I799-V937 PolarHBondContact N-O 3.37Å; L909-V937 HydrophobicContact CB-CG1 4.27Å; L909-V937 HydrophobicContact CB-CG2 4.34Å; L909-V937 HydrophobicContact CD1-CG2 4.34Å; L909-V937 WeakPolarHBondContact O-CA 3.43Å; I930-V937 HydrophobicContact CG1-CG1 4.45Å; I930-V937 HydrophobicContact CG2-CB 4.49Å; I930-V937 HydrophobicContact CG2-CG1 4.12Å; I930-V937 HydrophobicContact CG2-CG2 4.28Å; F933-V937 HydrophobicContact CD1-CG2 3.67Å; F933-V937 HydrophobicContact CE1-CG2 4Å
938	I	95.1	Very high	90.7	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	125.6	172.7	-51.1	178.2	0	0	0	107.8	I793 I799 I801 L813 L816 L909 I910 L911	I793-I938 HydrophobicContact CD1-CD1 3.54Å; I793-I938 HydrophobicContact CG1-CD1 3.83Å; I799-I938 CarbonylContact O-C 3.48Å; I799-I938 WeakPolarHBondContact O-CA 3.5Å; I801-I938 HydrophobicContact CD1-CG2 3.47Å; I801-I938 VanDerWaalsContact CD1-CG2 3.47Å; I801-I938 HydrophobicContact CG1-CG2 4.12Å; L813-I938 HydrophobicContact CD2-CG2 4.01Å; L816-I938 HydrophobicContact CD1-CD1 3.65Å; L909-I938 PolarHBondContact O-N 2.9Å; I910-I938 WeakPolarHBondContact CA-O 3.32Å; I910-I938 HydrophobicContact CD1-CD1 4.38Å; I910-I938 HydrophobicContact CG1-CB 4.4Å; I910-I938 HydrophobicContact CG1-CD1 4.25Å; L911-I938 PolarHBondContact N-O 3.13Å
939	V	94	Very high	90.5	Very high	2 Å²	2	28.8 Å²	28.8	1%	0.012	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	135.6	-180	62.4	0	0	0	0	111.2	I799 S800 I801 L911 P914 L946	I799-V939 PolarHBondContact O-N 2.85Å; S800-V939 CarbonylContact C-O 3.5Å; S800-V939 VanDerWaalsContact CA-O 3.3Å; S800-V939 WeakPolarHBondContact CA-O 3.32Å; I801-V939 PolarHBondContact N-O 3.14Å; L911-V939 HydrophobicContact CB-CG2 4.33Å; L911-V939 WeakPolarHBondContact O-CA 3.42Å; P914-V939 HydrophobicContact CG-CG2 3.87Å; V939-L946 HydrophobicContact CG2-CD2 4.44Å
940	V	92.2	Very high	90.3	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.012	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	120.6	158.7	175.1	0	0	0	0	105.9	I801 K809 L813 L911 D912 E913 P914	I801-V940 HydrophobicContact CB-CG2 3.99Å; I801-V940 HydrophobicContact CD1-CG2 4.39Å; I801-V940 HydrophobicContact CG2-CG2 4.45Å; K809-V940 HydrophobicContact CB-CG2 4.38Å; K809-V940 HydrophobicContact CD-CG1 4.14Å; L813-V940 HydrophobicContact CD1-CG2 3.86Å; L813-V940 HydrophobicContact CG-CG2 4.34Å; L911-V940 PolarHBondContact O-N 2.88Å; D912-V940 WeakPolarHBondContact OD1-CB 3.33Å; D912-V940 WeakPolarHBondContact OD1-CG1 3.5Å; E913-V940 VanDerWaalsContact CA-O 3.23Å; E913-V940 WeakPolarHBondContact CA-O 3.48Å; E913-V940 HydrophobicContact CG-CG1 4.34Å; E913-V940 PolarHBondContact N-O 2.83Å; P914-V940 VanDerWaalsContact CD-O 3.27Å; P914-V940 WeakPolarHBondContact CD-O 3.45Å
941	S	88.1	Confident	90.1	Very high	7 Å²	7	34.9 Å²	34.9	5%	0.049	17%	0.167	C	C	.	.			trans	-148.5	153.4	177.8	-170.7	0	0	0	0	111.8	D943	S941-D943 PolarHBondContact OG-N 3.29Å
942	H	84.7	Confident	89.9	Confident	10 Å²	10	31.8 Å²	31.8	5%	0.046	15%	0.151	C	C	.	.			trans	-96.1	-5.8	167.2	54.7	-110.8	0	0	0	112.6	L628 V631 T915 E944	L628-H942 VanDerWaalsContact CD1-O 3.31Å; L628-H942 WeakPolarHBondContact CD1-O 3.34Å; V631-H942 HydrophobicContact CG2-CB 4.23Å; T915-H942 PolarHBondContact OG1-CE1 3.33Å; T915-H942 PolarHBondContact OG1-NE2 2.78Å; H942-E944 PolarHBondContact O-N 3.47Å
943	D	85.5	Confident	89.8	Confident	2 Å²	2	29.6 Å²	29.6	1%	0.011	14%	0.143	C	C	.	.			trans	-85.7	106.3	-175.1	-174.8	-27.2	0	0	0	111.4	T915 S941 R945 L946 I947	T915-D943 HydrophobicContact CG2-CB 3.83Å; S941-D943 PolarHBondContact OG-N 3.29Å; D943-R945 PolarHBondContact O-N 3.34Å; D943-R945 WeakPolarHBondContact OD1-CA 3.48Å; D943-R945 WeakPolarHBondContact OD1-CB 3.47Å; D943-R945 PolarHBondContact OD1-N 2.89Å; D943-L946 HydrophobicContact CB-CB 4Å; D943-L946 PolarHBondContact O-N 2.8Å; D943-L946 PolarHBondContact OD1-N 3.21Å; D943-I947 WeakPolarHBondContact O-CG1 3.2Å; D943-I947 PolarHBondContact O-N 2.88Å
944	E	84.9	Confident	89.8	Confident	20 Å²	20	29.8 Å²	29.8	9%	0.093	14%	0.144	C	C	.	.	H	α-helix	trans	-52.2	-34.8	174.9	172.6	168.8	165.1	0	0	113.2	H942 R948 F969 R973	H942-E944 PolarHBondContact O-N 3.47Å; E944-R948 WeakPolarHBondContact O-CG 3.33Å; E944-R948 PolarHBondContact O-N 2.64Å; E944-R948 IonicContact OE1-CZ 3.43Å; E944-R948 IonicContact OE1-NH1 3.12Å; E944-R948 PolarHBondContact OE1-NH1 3.39Å; E944-R948 IonicContact OE1-NH2 3.6Å; E944-R948 PolarHBondContact OE1-NH2 3.23Å; E944-F969 HydrophobicContact CB-CE1 3.88Å; E944-F969 HydrophobicContact CB-CE2 4.04Å; E944-F969 HydrophobicContact CB-CZ 3.52Å; E944-F969 HydrophobicContact CG-CD1 3.82Å; E944-F969 HydrophobicContact CG-CE1 3.36Å; E944-F969 HydrophobicContact CG-CE2 4.18Å; E944-F969 HydrophobicContact CG-CG 4.43Å; E944-F969 HydrophobicContact CG-CZ 3.56Å; E944-F969 WeakPolarHBondContact OE2-CE1 3.38Å; E944-R973 IonicContact OE1-NH1 3.14Å; E944-R973 IonicContact OE2-NH1 3.58Å; E944-R973 PolarHBondContact OE2-NH1 3.05Å
945	R	85.1	Confident	89.8	Confident	55 Å²	55	25.5 Å²	25.5	21%	0.208	12%	0.122	C	C	.	.	H	α-helix	trans	-79.2	-42.9	-179.6	-178.8	173	172.2	-137.4	-26.2	111.6	Q652 K681 D924 D943 I947 R948 D949	Q652-R945 VanDerWaalsContact CD-NH1 3.32Å; K681-R945 VanDerWaalsContact NZ-NH1 3.1Å; D924-R945 IonicContact OD1-CZ 3.84Å; D924-R945 IonicContact OD1-NH1 3.39Å; D924-R945 PolarHBondContact OD1-NH1 2.87Å; D924-R945 IonicContact OD1-NH2 3.71Å; D924-R945 IonicContact OD2-CZ 3.56Å; D924-R945 IonicContact OD2-NH1 3.15Å; D924-R945 PolarHBondContact OD2-NH1 2.77Å; D924-R945 VanDerWaalsContact OD2-NH1 3.08Å; D924-R945 IonicContact OD2-NH2 3.9Å; D943-R945 PolarHBondContact O-N 3.34Å; D943-R945 WeakPolarHBondContact OD1-CA 3.48Å; D943-R945 WeakPolarHBondContact OD1-CB 3.47Å; D943-R945 PolarHBondContact OD1-N 2.89Å; R945-I947 VanDerWaalsContact C-N 3.28Å; R945-I947 PolarHBondContact O-N 3.3Å; R945-R948 PolarHBondContact O-N 3.04Å; R945-D949 IonicContact CZ-OD2 2.75Å; R945-D949 IonicContact NE-OD1 3.21Å; R945-D949 IonicContact NE-OD2 2.81Å; R945-D949 PolarHBondContact NE-OD2 2.94Å; R945-D949 IonicContact NH2-OD2 2.74Å; R945-D949 PolarHBondContact NH2-OD2 2.87Å; R945-D949 WeakPolarHBondContact O-CB 3.44Å; R945-D949 PolarHBondContact O-N 3.36Å
946	L	87.9	Confident	89.9	Confident	2 Å²	2	25.9 Å²	25.9	1%	0.01	12%	0.124	C	C	.	.	H	α-helix	trans	-58.6	-43.5	179.1	-179.2	62.2	0	0	0	111.2	P914 T915 L926 A927 I930 V939 D943 T950	P914-L946 HydrophobicContact CG-CD2 4.15Å; T915-L946 HydrophobicContact CG2-CD2 3.78Å; L926-L946 HydrophobicContact CD2-CD2 4.4Å; A927-L946 HydrophobicContact CB-CD1 3.97Å; I930-L946 HydrophobicContact CD1-CD1 4.42Å; V939-L946 HydrophobicContact CG2-CD2 4.44Å; D943-L946 HydrophobicContact CB-CB 4Å; D943-L946 PolarHBondContact O-N 2.8Å; D943-L946 PolarHBondContact OD1-N 3.21Å; L946-T950 HydrophobicContact CD1-CG2 4.05Å; L946-T950 WeakPolarHBondContact O-CB 3.47Å; L946-T950 WeakPolarHBondContact O-CG2 3.45Å; L946-T950 PolarHBondContact O-N 2.81Å; L946-T950 PolarHBondContact O-OG1 2.71Å
947	I	89.2	Confident	89.8	Confident	5 Å²	5	25.9 Å²	25.9	3%	0.026	12%	0.124	C	C	.	.	H	α-helix	trans	-63.3	-43.5	179.8	-63.7	169.5	0	0	0	111.2	L628 S800 D943 R945 T950 N951 C952 L954 F969	L628-I947 HydrophobicContact CD2-CD1 4.46Å; S800-I947 WeakPolarHBondContact OG-CD1 3.47Å; S800-I947 WeakPolarHBondContact OG-CG1 3.28Å; D943-I947 WeakPolarHBondContact O-CG1 3.2Å; D943-I947 PolarHBondContact O-N 2.88Å; R945-I947 VanDerWaalsContact C-N 3.28Å; R945-I947 PolarHBondContact O-N 3.3Å; I947-T950 PolarHBondContact O-OG1 3Å; I947-N951 PolarHBondContact O-N 3.46Å; I947-C952 HydrophobicContact CG2-CB 4.35Å; I947-C952 PolarHBondContact O-N 2.82Å; I947-L954 HydrophobicContact CG2-CD2 4.07Å; I947-F969 HydrophobicContact CD1-CE2 4.39Å
948	R	88.8	Confident	89.4	Confident	93 Å²	93	29.2 Å²	29.2	35%	0.351	14%	0.14	S	C	.	.	H	α-helix	trans	-68.9	-50.4	177.3	-80.4	-179.1	172	143.2	2.8	113	E944 R945 T950 N951 D970	E944-R948 WeakPolarHBondContact O-CG 3.33Å; E944-R948 PolarHBondContact O-N 2.64Å; E944-R948 IonicContact OE1-CZ 3.43Å; E944-R948 IonicContact OE1-NH1 3.12Å; E944-R948 PolarHBondContact OE1-NH1 3.39Å; E944-R948 IonicContact OE1-NH2 3.6Å; E944-R948 PolarHBondContact OE1-NH2 3.23Å; R945-R948 PolarHBondContact O-N 3.04Å; R948-T950 PolarHBondContact O-N 3.29Å; R948-N951 PolarHBondContact O-N 3.17Å; R948-D970 IonicContact CZ-OD2 3.87Å; R948-D970 IonicContact NH2-OD1 3.44Å; R948-D970 PolarHBondContact NH2-OD1 2.88Å; R948-D970 IonicContact NH2-OD2 3.15Å; R948-D970 PolarHBondContact NH2-OD2 2.8Å
949	D	89.3	Confident	88.9	Confident	57 Å²	57	37 Å²	37	31%	0.305	18%	0.182	S	C	.	.	H	α-helix	trans	-63.3	-24.8	-176.3	-78	12	0	0	0	112	A927 N931 R945	A927-D949 HydrophobicContact CB-CB 4.02Å; N931-D949 PolarHBondContact ND2-O 3.03Å; N931-D949 PolarHBondContact OD1-O 3.05Å; R945-D949 IonicContact CZ-OD2 2.75Å; R945-D949 IonicContact NE-OD1 3.21Å; R945-D949 IonicContact NE-OD2 2.81Å; R945-D949 PolarHBondContact NE-OD2 2.94Å; R945-D949 IonicContact NH2-OD2 2.74Å; R945-D949 PolarHBondContact NH2-OD2 2.87Å; R945-D949 WeakPolarHBondContact O-CB 3.44Å; R945-D949 PolarHBondContact O-N 3.36Å
950	T	88.7	Confident	88.6	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.018	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	2.3	177	59.8	0	0	0	0	114.6	A927 I930 L946 I947 R948 C952	A927-T950 HydrophobicContact CB-CG2 4.26Å; I930-T950 HydrophobicContact CB-CG2 3.75Å; I930-T950 HydrophobicContact CD1-CG2 4.18Å; I930-T950 HydrophobicContact CG2-CG2 3.48Å; I930-T950 VanDerWaalsContact CG2-CG2 3.48Å; L946-T950 HydrophobicContact CD1-CG2 4.05Å; L946-T950 WeakPolarHBondContact O-CB 3.47Å; L946-T950 WeakPolarHBondContact O-CG2 3.45Å; L946-T950 PolarHBondContact O-N 2.81Å; L946-T950 PolarHBondContact O-OG1 2.71Å; I947-T950 PolarHBondContact O-OG1 3Å; R948-T950 PolarHBondContact O-N 3.29Å; T950-C952 VanDerWaalsContact C-N 3.27Å; T950-C952 PolarHBondContact O-N 3.25Å; T950-C952 PolarHBondContact OG1-SG 3.23Å; T950-C952 VanDerWaalsContact OG1-SG 3.39Å
951	N	88.7	Confident	88.4	Confident	129 Å²	129	41.5 Å²	41.5	69%	0.69	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	50	42.5	-179.8	-56.8	-89.4	0	0	0	113.5	I947 R948	I947-N951 PolarHBondContact O-N 3.46Å; R948-N951 PolarHBondContact O-N 3.17Å
952	C	88.7	Confident	88.6	Confident	15 Å²	15	41.9 Å²	41.9	10%	0.101	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-75.5	133.7	-179.2	-80.3	0	0	0	0	112.7	I947 T950	I947-C952 HydrophobicContact CG2-CB 4.35Å; I947-C952 PolarHBondContact O-N 2.82Å; T950-C952 VanDerWaalsContact C-N 3.27Å; T950-C952 PolarHBondContact O-N 3.25Å; T950-C952 PolarHBondContact OG1-SG 3.23Å; T950-C952 VanDerWaalsContact OG1-SG 3.39Å
953	I	91.4	Very high	88.9	Confident	79 Å²	79	45.7 Å²	45.7	41%	0.405	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	131.6	167.1	-56.6	175.1	0	0	0	108.4	R798 S800 E964	R798-I953 PolarHBondContact O-N 2.96Å; S800-I953 PolarHBondContact N-O 2.9Å; I953-E964 HydrophobicContact CG2-CG 3.78Å; I953-E964 VanDerWaalsContact CG2-OE1 3.26Å; I953-E964 WeakPolarHBondContact CG2-OE1 3.43Å
954	L	91.9	Very high	89.2	Confident	8 Å²	8	50.4 Å²	50.4	4%	0.042	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	125.3	-179.1	-75.2	165.9	0	0	0	111	V802 I947 I965 F969	V802-L954 HydrophobicContact CG1-CD2 3.63Å; V802-L954 HydrophobicContact CG2-CD2 4.42Å; I947-L954 HydrophobicContact CG2-CD2 4.07Å; L954-I965 HydrophobicContact CB-CB 4Å; L954-I965 HydrophobicContact CB-CD1 3.83Å; L954-I965 HydrophobicContact CB-CG1 4.42Å; L954-I965 PolarHBondContact O-N 3.22Å; L954-F969 HydrophobicContact CD1-CB 4.37Å
955	W	93.2	Very high	89.3	Confident	46 Å²	46	50.1 Å²	50.1	17%	0.174	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	120.6	176.2	-76.8	68.3	0	0	0	109.8	F791 I799 S800 I801 V802 I962 N963 E964	F791-W955 AromaticContact CD2-CE3 3.98Å; F791-W955 HydrophobicContact CD2-CE3 3.98Å; F791-W955 HydrophobicContact CD2-CH2 4.33Å; F791-W955 AromaticContact CD2-CZ3 3.85Å; F791-W955 HydrophobicContact CD2-CZ3 3.85Å; F791-W955 AromaticContact CE2-CD2 3.93Å; F791-W955 HydrophobicContact CE2-CD2 3.93Å; F791-W955 AromaticContact CE2-CE3 3.79Å; F791-W955 HydrophobicContact CE2-CE3 3.79Å; F791-W955 HydrophobicContact CE2-CH2 4.41Å; F791-W955 HydrophobicContact CE2-CZ3 4.04Å; I799-W955 HydrophobicContact CG2-CB 4.21Å; I799-W955 HydrophobicContact CG2-CG 3.98Å; S800-W955 PolarHBondContact O-N 2.97Å; I801-W955 CarbonylContact C-O 3.53Å; I801-W955 WeakPolarHBondContact CA-O 3.44Å; V802-W955 PolarHBondContact N-O 3.47Å; W955-I962 HydrophobicContact CB-CD1 4.02Å; W955-I962 HydrophobicContact CB-CG1 4.21Å; W955-I962 HydrophobicContact CE3-CD1 4.23Å; W955-I962 HydrophobicContact CE3-CG1 4.03Å; W955-I962 HydrophobicContact CE3-CG2 4Å; W955-I962 HydrophobicContact CZ3-CG2 4.14Å; W955-N963 CarbonylContact C-O 3.58Å; W955-N963 WeakPolarHBondContact CA-O 3.27Å; W955-E964 HydrophobicContact CD2-CB 4.17Å; W955-E964 HydrophobicContact CE3-CB 4.43Å; W955-E964 HydrophobicContact CH2-CB 4.16Å; W955-E964 HydrophobicContact CZ2-CB 3.86Å; W955-E964 HydrophobicContact CZ2-CG 4.1Å; W955-E964 WeakPolarHBondContact CZ2-OE2 3.47Å; W955-E964 HydrophobicContact CZ3-CB 4.43Å
956	V	92	Very high	89.2	Confident	8 Å²	8	54.9 Å²	54.9	5%	0.048	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	131.9	-178.1	65.1	0	0	0	0	111.5	V802 E958 I962 N963 I965 Y972	V802-V956 HydrophobicContact CG2-CB 3.95Å; V802-V956 HydrophobicContact CG2-CG2 4.27Å; V956-E958 HydrophobicContact CG2-CB 4.4Å; V956-E958 HydrophobicContact CG2-CG 3.83Å; V956-E958 WeakPolarHBondContact CG2-OE1 3.49Å; V956-I962 WeakPolarHBondContact O-CA 3.21Å; V956-I962 WeakPolarHBondContact O-CG1 3.31Å; V956-N963 HydrophobicContact CG1-CB 4.1Å; V956-N963 PolarHBondContact N-O 3.04Å; V956-N963 PolarHBondContact O-N 3.35Å; V956-I965 HydrophobicContact CB-CD1 3.85Å; V956-I965 HydrophobicContact CB-CG1 4.21Å; V956-I965 HydrophobicContact CG1-CD1 4.15Å; V956-I965 HydrophobicContact CG1-CG1 3.96Å; V956-Y972 HydrophobicContact CG2-CE2 4.47Å
957	I	91.2	Very high	88.8	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.005	30%	0.297	C	S	.	.			trans	-92.1	103.7	169.9	-63	174	0	0	0	108.4	F786 I801 V802 V807 K809 F812 I962	F786-I957 HydrophobicContact CE1-CD1 4.19Å; F786-I957 HydrophobicContact CE1-CG1 4.5Å; F786-I957 HydrophobicContact CE1-CG2 3.69Å; F786-I957 HydrophobicContact CZ-CD1 4.31Å; F786-I957 HydrophobicContact CZ-CG2 4.31Å; I801-I957 HydrophobicContact CG2-CD1 3.66Å; I801-I957 HydrophobicContact CG2-CG1 4.05Å; V802-I957 PolarHBondContact O-N 2.97Å; V802-I957 VanDerWaalsContact O-N 3.13Å; V807-I957 HydrophobicContact CG1-CB 3.99Å; V807-I957 HydrophobicContact CG1-CG2 3.85Å; V807-I957 HydrophobicContact CG2-CG2 4.04Å; V807-I957 WeakPolarHBondContact CG2-O 3.46Å; K809-I957 HydrophobicContact CG-CD1 4.22Å; F812-I957 HydrophobicContact CB-CD1 3.96Å; F812-I957 HydrophobicContact CD2-CD1 4.47Å; F812-I957 HydrophobicContact CG-CD1 4.13Å; I957-I962 HydrophobicContact CD1-CD1 4.39Å; I957-I962 HydrophobicContact CG1-CB 4.3Å; I957-I962 HydrophobicContact CG1-CD1 3.82Å; I957-I962 HydrophobicContact CG1-CG1 3.7Å
958	E	87	Confident	88.4	Confident	69 Å²	69	62 Å²	62	32%	0.322	33%	0.327	S	S	.	.			trans	-144.2	160.7	178.5	-86.2	169.5	-162.2	0	0	109.6	V956 L960 G961	V956-E958 HydrophobicContact CG2-CB 4.4Å; V956-E958 HydrophobicContact CG2-CG 3.83Å; V956-E958 WeakPolarHBondContact CG2-OE1 3.49Å; E958-L960 PolarHBondContact O-N 2.74Å; E958-G961 PolarHBondContact O-N 2.91Å
959	D	84.7	Confident	88.1	Confident	165 Å²	165	58 Å²	58	88%	0.882	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.9	35.8	176.2	-68	-14.3	0	0	0	116.4	G961	D959-G961 PolarHBondContact O-N 3.22Å
960	L	86.9	Confident	87.9	Confident	80 Å²	80	59 Å²	59	42%	0.419	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	13	-177.3	-48.9	178.7	0	0	0	115.3	P784 F786 K787 E958	P784-L960 HydrophobicContact CG-CD1 4.38Å; P784-L960 VanDerWaalsContact O-CD2 3.27Å; P784-L960 WeakPolarHBondContact O-CD2 3.14Å; F786-L960 CarbonylContact C-O 3.53Å; F786-L960 VanDerWaalsContact CA-O 3.31Å; F786-L960 WeakPolarHBondContact CA-O 3.41Å; K787-L960 HydrophobicContact CB-CB 4.47Å; K787-L960 PolarHBondContact N-O 3.02Å; E958-L960 PolarHBondContact O-N 2.74Å
961	G	88.9	Confident	87.7	Confident	17 Å²	17	61.9 Å²	61.9	18%	0.175	33%	0.333	C	S	.	.	S	Bend	trans	-120.1	-164.7	175.1	0	0	0	0	0	112.9	E958 D959	E958-G961 PolarHBondContact O-N 2.91Å; D959-G961 PolarHBondContact O-N 3.22Å
962	I	91.8	Very high	87.6	Confident	16 Å²	16	56 Å²	56	8%	0.082	30%	0.301	C	S	.	.			trans	-136	130.2	163.5	-160.2	177.8	0	0	0	108.2	L789 F791 F812 W955 V956 I957	L789-I962 HydrophobicContact CD1-CB 3.98Å; L789-I962 HydrophobicContact CD1-CG2 3.63Å; F791-I962 HydrophobicContact CD2-CG2 3.98Å; F791-I962 HydrophobicContact CE2-CD1 4.35Å; F812-I962 HydrophobicContact CD2-CD1 4.48Å; F812-I962 HydrophobicContact CE1-CD1 4.09Å; F812-I962 HydrophobicContact CE2-CD1 3.81Å; F812-I962 HydrophobicContact CE2-CG2 4.29Å; F812-I962 HydrophobicContact CZ-CD1 3.58Å; W955-I962 HydrophobicContact CB-CD1 4.02Å; W955-I962 HydrophobicContact CB-CG1 4.21Å; W955-I962 HydrophobicContact CE3-CD1 4.23Å; W955-I962 HydrophobicContact CE3-CG1 4.03Å; W955-I962 HydrophobicContact CE3-CG2 4Å; W955-I962 HydrophobicContact CZ3-CG2 4.14Å; V956-I962 WeakPolarHBondContact O-CA 3.21Å; V956-I962 WeakPolarHBondContact O-CG1 3.31Å; I957-I962 HydrophobicContact CD1-CD1 4.39Å; I957-I962 HydrophobicContact CG1-CB 4.3Å; I957-I962 HydrophobicContact CG1-CD1 3.82Å; I957-I962 HydrophobicContact CG1-CG1 3.7Å
963	N	91.2	Very high	87.5	Confident	89 Å²	89	56.9 Å²	56.9	48%	0.476	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	139.7	-175.4	-62.5	-52.6	0	0	0	110.1	W955 V956	W955-N963 CarbonylContact C-O 3.58Å; W955-N963 WeakPolarHBondContact CA-O 3.27Å; V956-N963 HydrophobicContact CG1-CB 4.1Å; V956-N963 PolarHBondContact N-O 3.04Å; V956-N963 PolarHBondContact O-N 3.35Å
964	E	91.3	Very high	87.3	Confident	102 Å²	102	58 Å²	58	48%	0.477	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	140	167.7	-167.8	168.2	175.6	0	0	109.7	I953 W955	I953-E964 HydrophobicContact CG2-CG 3.78Å; I953-E964 VanDerWaalsContact CG2-OE1 3.26Å; I953-E964 WeakPolarHBondContact CG2-OE1 3.43Å; W955-E964 HydrophobicContact CD2-CB 4.17Å; W955-E964 HydrophobicContact CE3-CB 4.43Å; W955-E964 HydrophobicContact CH2-CB 4.16Å; W955-E964 HydrophobicContact CZ2-CB 3.86Å; W955-E964 HydrophobicContact CZ2-CG 4.1Å; W955-E964 WeakPolarHBondContact CZ2-OE2 3.47Å; W955-E964 HydrophobicContact CZ3-CB 4.43Å
965	I	88	Confident	87	Confident	14 Å²	14	61.1 Å²	61.1	7%	0.072	32%	0.316	C	S	.	.			trans	-92.7	113.7	176.9	-69	162.2	0	0	0	109.3	V802 L954 V956 G967 Y972	V802-I965 HydrophobicContact CG2-CD1 3.76Å; L954-I965 HydrophobicContact CB-CB 4Å; L954-I965 HydrophobicContact CB-CD1 3.83Å; L954-I965 HydrophobicContact CB-CG1 4.42Å; L954-I965 PolarHBondContact O-N 3.22Å; V956-I965 HydrophobicContact CB-CD1 3.85Å; V956-I965 HydrophobicContact CB-CG1 4.21Å; V956-I965 HydrophobicContact CG1-CD1 4.15Å; V956-I965 HydrophobicContact CG1-CG1 3.96Å; I965-G967 PolarHBondContact O-N 3.2Å; I965-Y972 HydrophobicContact CD1-CD2 3.48Å; I965-Y972 VanDerWaalsContact CD1-CD2 3.48Å; I965-Y972 HydrophobicContact CD1-CE2 3.75Å; I965-Y972 HydrophobicContact CD1-CG 4.15Å; I965-Y972 HydrophobicContact CG1-CD2 4.49Å
966	D	81.3	Confident	86.7	Confident	154 Å²	154	59.5 Å²	59.5	82%	0.824	31%	0.311	S	S	*	.	S	Bend	trans	-67.8	69.7	169.2	-72.7	-44.1	0	0	0	111.5
967	G	80.2	Confident	86.4	Confident	33 Å²	33	59.2 Å²	59.2	34%	0.34	31%	0.309	S	S	.	.	S	Bend	trans	169	169.1	176.3	0	0	0	0	0	116	I965	I965-G967 PolarHBondContact O-N 3.2Å
968	D	82.2	Confident	86.2	Confident	124 Å²	124	64 Å²	64	66%	0.663	33%	0.334	S	S	*	.			trans	-75.1	165.9	172.4	-78.3	-30.9	0	0	0	111.2	D970 D971 Y972	D968-D970 PolarHBondContact O-N 3.1Å; D968-D970 VanDerWaalsContact O-N 3.08Å; D968-D971 PolarHBondContact O-N 2.85Å; D968-Y972 PolarHBondContact O-N 2.88Å
969	F	82.2	Confident	86.1	Confident	8 Å²	8	64.8 Å²	64.8	4%	0.035	35%	0.348	C	S	.	.	H	α-helix	trans	-50.5	-34.7	174.6	-175	-80.4	0	0	0	113.7	L628 I632 E944 I947 L954 D971 Y972 R973	L628-F969 HydrophobicContact CD1-CE2 3.79Å; L628-F969 HydrophobicContact CD1-CZ 3.82Å; L628-F969 HydrophobicContact CD2-CE2 3.86Å; L628-F969 HydrophobicContact CD2-CZ 4.47Å; L628-F969 HydrophobicContact CG-CE2 4.31Å; L628-F969 HydrophobicContact CG-CZ 4.48Å; I632-F969 HydrophobicContact CD1-CZ 4.28Å; E944-F969 HydrophobicContact CB-CE1 3.88Å; E944-F969 HydrophobicContact CB-CE2 4.04Å; E944-F969 HydrophobicContact CB-CZ 3.52Å; E944-F969 HydrophobicContact CG-CD1 3.82Å; E944-F969 HydrophobicContact CG-CE1 3.36Å; E944-F969 HydrophobicContact CG-CE2 4.18Å; E944-F969 HydrophobicContact CG-CG 4.43Å; E944-F969 HydrophobicContact CG-CZ 3.56Å; E944-F969 WeakPolarHBondContact OE2-CE1 3.38Å; I947-F969 HydrophobicContact CD1-CE2 4.39Å; L954-F969 HydrophobicContact CD1-CB 4.37Å; F969-D971 VanDerWaalsContact C-N 3.28Å; F969-D971 PolarHBondContact O-N 3.26Å; F969-Y972 PolarHBondContact O-N 3.35Å; F969-R973 HydrophobicContact CD1-CB 4.41Å; F969-R973 HydrophobicContact CE1-CB 4.28Å; F969-R973 WeakPolarHBondContact O-CB 3.4Å; F969-R973 PolarHBondContact O-N 3.48Å
970	D	84	Confident	86	Confident	78 Å²	78	59.8 Å²	59.8	42%	0.417	32%	0.32	S	S	.	.	H	α-helix	trans	-71	-19.2	178.6	-71.1	-62.7	0	0	0	114.3	R948 D968 R974	R948-D970 IonicContact CZ-OD2 3.87Å; R948-D970 IonicContact NH2-OD1 3.44Å; R948-D970 PolarHBondContact NH2-OD1 2.88Å; R948-D970 IonicContact NH2-OD2 3.15Å; R948-D970 PolarHBondContact NH2-OD2 2.8Å; D968-D970 PolarHBondContact O-N 3.1Å; D968-D970 VanDerWaalsContact O-N 3.08Å; D970-R974 PolarHBondContact O-N 3.25Å; D970-R974 PolarHBondContact O-NH2 2.93Å
971	D	85.7	Confident	85.7	Confident	65 Å²	65	59 Å²	59	35%	0.348	33%	0.332	S	S	.	.	H	α-helix	trans	-84.8	-42.4	172.9	-65.8	-48.5	0	0	0	110.3	D968 F969 R973 R974 E975	D968-D971 PolarHBondContact O-N 2.85Å; F969-D971 VanDerWaalsContact C-N 3.28Å; F969-D971 PolarHBondContact O-N 3.26Å; D971-R973 VanDerWaalsContact C-N 3.34Å; D971-R973 PolarHBondContact O-N 2.85Å; D971-R974 WeakPolarHBondContact O-CB 3.13Å; D971-R974 PolarHBondContact O-N 2.93Å; D971-R974 VanDerWaalsContact O-N 3.1Å; D971-R974 IonicContact OD1-CZ 3.25Å; D971-R974 IonicContact OD1-NH1 2.87Å; D971-R974 PolarHBondContact OD1-NH1 3.06Å; D971-R974 IonicContact OD1-NH2 2.89Å; D971-R974 PolarHBondContact OD1-NH2 2.82Å; D971-E975 PolarHBondContact O-N 2.67Å
972	Y	85.7	Confident	85.3	Confident	4 Å²	4	58.6 Å²	58.6	2%	0.016	33%	0.326	C	S	.	.	H	α-helix	trans	-59.2	-44	169.7	-174.7	-110.9	0	0	0	111.9	L628 N629 V802 V956 I965 D968 F969 R974 E975 I976	L628-Y972 HydrophobicContact CD2-CD1 4.23Å; L628-Y972 HydrophobicContact CD2-CE1 3.92Å; N629-Y972 PolarHBondContact OD1-OH 3.35Å; V802-Y972 HydrophobicContact CB-CE1 4.24Å; V802-Y972 HydrophobicContact CG2-CE1 4.12Å; V802-Y972 HydrophobicContact CG2-CE2 4.16Å; V956-Y972 HydrophobicContact CG2-CE2 4.47Å; I965-Y972 HydrophobicContact CD1-CD2 3.48Å; I965-Y972 VanDerWaalsContact CD1-CD2 3.48Å; I965-Y972 HydrophobicContact CD1-CE2 3.75Å; I965-Y972 HydrophobicContact CD1-CG 4.15Å; I965-Y972 HydrophobicContact CG1-CD2 4.49Å; D968-Y972 PolarHBondContact O-N 2.88Å; F969-Y972 PolarHBondContact O-N 3.35Å; Y972-R974 PolarHBondContact O-N 3.2Å; Y972-E975 PolarHBondContact O-N 2.93Å; Y972-I976 HydrophobicContact CD1-CG1 4.3Å; Y972-I976 HydrophobicContact CD2-CG1 4.47Å; Y972-I976 HydrophobicContact CE1-CD1 4.46Å; Y972-I976 HydrophobicContact CE1-CG1 3.9Å; Y972-I976 HydrophobicContact CE2-CD1 4.04Å; Y972-I976 HydrophobicContact CE2-CG1 4.09Å; Y972-I976 WeakPolarHBondContact O-CG1 3.36Å; Y972-I976 PolarHBondContact O-N 3.26Å
973	R	85.9	Confident	84.6	Confident	34 Å²	34	65.3 Å²	65.3	13%	0.128	36%	0.357	C	S	.	.	H	α-helix	trans	-58.5	-32.7	175.1	-177.3	175.1	176	139.1	2.9	112.6	I632 D635 N657 E944 F969 D971 L977	I632-R973 HydrophobicContact CD1-CB 4.33Å; I632-R973 HydrophobicContact CD1-CG 4.34Å; I632-R973 HydrophobicContact CG1-CG 4.27Å; I632-R973 HydrophobicContact CG2-CG 3.87Å; D635-R973 IonicContact OD2-CZ 3.78Å; D635-R973 IonicContact OD2-NH1 2.69Å; D635-R973 PolarHBondContact OD2-NH1 3.12Å; D635-R973 IonicContact OD2-NH2 3.55Å; D635-R973 PolarHBondContact OD2-NH2 3.31Å; N657-R973 PolarHBondContact ND2-NH1 3.22Å; E944-R973 IonicContact OE1-NH1 3.14Å; E944-R973 IonicContact OE2-NH1 3.58Å; E944-R973 PolarHBondContact OE2-NH1 3.05Å; F969-R973 HydrophobicContact CD1-CB 4.41Å; F969-R973 HydrophobicContact CE1-CB 4.28Å; F969-R973 WeakPolarHBondContact O-CB 3.4Å; F969-R973 PolarHBondContact O-N 3.48Å; D971-R973 VanDerWaalsContact C-N 3.34Å; D971-R973 PolarHBondContact O-N 2.85Å; R973-L977 VanDerWaalsContact O-CG 3.3Å; R973-L977 WeakPolarHBondContact O-CG 3.46Å; R973-L977 PolarHBondContact O-N 2.86Å
974	R	87.1	Confident	83.3	Confident	103 Å²	103	64.9 Å²	64.9	39%	0.389	35%	0.354	S	S	.	.	H	α-helix	trans	-74.9	-49.1	174.8	-172	178.7	-39.9	113.5	29.5	111.4	D970 D971 Y972 I976 L977 D978 I984	D970-R974 PolarHBondContact O-N 3.25Å; D970-R974 PolarHBondContact O-NH2 2.93Å; D971-R974 WeakPolarHBondContact O-CB 3.13Å; D971-R974 PolarHBondContact O-N 2.93Å; D971-R974 VanDerWaalsContact O-N 3.1Å; D971-R974 IonicContact OD1-CZ 3.25Å; D971-R974 IonicContact OD1-NH1 2.87Å; D971-R974 PolarHBondContact OD1-NH1 3.06Å; D971-R974 IonicContact OD1-NH2 2.89Å; D971-R974 PolarHBondContact OD1-NH2 2.82Å; Y972-R974 PolarHBondContact O-N 3.2Å; R974-I976 VanDerWaalsContact C-N 3.28Å; R974-I976 PolarHBondContact O-N 2.98Å; R974-L977 PolarHBondContact O-N 3.32Å; R974-L977 VanDerWaalsContact O-N 3.11Å; R974-D978 WeakPolarHBondContact CG-OD2 3.36Å; R974-D978 WeakPolarHBondContact O-CB 3.4Å; R974-D978 PolarHBondContact O-N 2.95Å; R974-I984 HydrophobicContact CG-CD1 4.08Å
975	E	87.2	Confident	81.8	Confident	73 Å²	73	60.8 Å²	60.8	34%	0.341	34%	0.336	S	S	.	.	H	α-helix	trans	-54.1	-44.5	179	-170.9	169.1	168	0	0	111.7	R5 D971 Y972 S979	R5-E975 IonicContact CZ-OE1 3.69Å; R5-E975 IonicContact CZ-OE2 2.77Å; R5-E975 IonicContact NH1-OE1 2.67Å; R5-E975 PolarHBondContact NH1-OE1 2.97Å; R5-E975 IonicContact NH1-OE2 3.31Å; R5-E975 PolarHBondContact NH1-OE2 3.36Å; R5-E975 IonicContact NH2-OE1 2.7Å; R5-E975 IonicContact NH2-OE2 3.36Å; R5-E975 PolarHBondContact NH2-OE2 3.24Å; D971-E975 PolarHBondContact O-N 2.67Å; Y972-E975 PolarHBondContact O-N 2.93Å; E975-S979 VanDerWaalsContact O-CB 3.32Å; E975-S979 WeakPolarHBondContact O-CB 3.08Å; E975-S979 PolarHBondContact O-N 3.16Å
976	I	85.8	Confident	80.2	Confident	12 Å²	12	63.7 Å²	63.7	6%	0.062	35%	0.352	C	S	.	.	H	α-helix	trans	-65.1	-46	175.4	-64.4	-54	0	0	0	112.7	N629 I632 Y972 R974 S979 L980	N629-I976 HydrophobicContact CB-CG2 4.16Å; N629-I976 WeakPolarHBondContact ND2-CD1 3.35Å; I632-I976 HydrophobicContact CG2-CG2 4.42Å; Y972-I976 HydrophobicContact CD1-CG1 4.3Å; Y972-I976 HydrophobicContact CD2-CG1 4.47Å; Y972-I976 HydrophobicContact CE1-CD1 4.46Å; Y972-I976 HydrophobicContact CE1-CG1 3.9Å; Y972-I976 HydrophobicContact CE2-CD1 4.04Å; Y972-I976 HydrophobicContact CE2-CG1 4.09Å; Y972-I976 WeakPolarHBondContact O-CG1 3.36Å; Y972-I976 PolarHBondContact O-N 3.26Å; R974-I976 VanDerWaalsContact C-N 3.28Å; R974-I976 PolarHBondContact O-N 2.98Å; I976-S979 PolarHBondContact O-N 2.9Å; I976-S979 PolarHBondContact O-OG 2.84Å; I976-L980 HydrophobicContact CG2-CD1 4.17Å; I976-L980 WeakPolarHBondContact O-CG 3.21Å; I976-L980 PolarHBondContact O-N 3.24Å
977	L	85.8	Confident	78.8	Confident	3 Å²	3	60.4 Å²	60.4	2%	0.016	34%	0.339	C	S	.	.	H	α-helix	trans	-65.9	-41	-179.8	-74.3	176.9	0	0	0	112.5	I632 N636 R973 R974 S979 L980 G981 E982 I984	I632-L977 HydrophobicContact CG2-CD1 4.38Å; I632-L977 HydrophobicContact CG2-CD2 3.98Å; I632-L977 HydrophobicContact CG2-CG 3.87Å; N636-L977 HydrophobicContact CB-CD2 4.11Å; N636-L977 WeakPolarHBondContact ND2-CD2 3.47Å; R973-L977 VanDerWaalsContact O-CG 3.3Å; R973-L977 WeakPolarHBondContact O-CG 3.46Å; R973-L977 PolarHBondContact O-N 2.86Å; R974-L977 PolarHBondContact O-N 3.32Å; R974-L977 VanDerWaalsContact O-N 3.11Å; L977-S979 VanDerWaalsContact C-N 3.34Å; L977-L980 PolarHBondContact O-N 2.93Å; L977-G981 PolarHBondContact O-N 2.89Å; L977-E982 HydrophobicContact CD2-CB 4.12Å; L977-E982 PolarHBondContact O-N 3.4Å; L977-I984 HydrophobicContact CD1-CG1 4.37Å
978	D	88.2	Confident	77.1	Confident	100 Å²	100	62.6 Å²	62.6	54%	0.535	35%	0.349	S	S	.	.	H	α-helix	trans	-66	-38	175.8	-68.4	-17.6	0	0	0	110.6	R974 L980 G981	R974-D978 WeakPolarHBondContact CG-OD2 3.36Å; R974-D978 WeakPolarHBondContact O-CB 3.4Å; R974-D978 PolarHBondContact O-N 2.95Å; D978-L980 PolarHBondContact O-N 3.26Å; D978-G981 PolarHBondContact O-N 3.43Å; D978-G981 VanDerWaalsContact O-N 3.1Å
979	S	85.1	Confident	75.2	Confident	87 Å²	87	63.2 Å²	63.2	61%	0.608	35%	0.346	S	S	*	.	H	α-helix	trans	-62	-29.6	174.7	84.1	0	0	0	0	113.7	E975 I976 L977	E975-S979 VanDerWaalsContact O-CB 3.32Å; E975-S979 WeakPolarHBondContact O-CB 3.08Å; E975-S979 PolarHBondContact O-N 3.16Å; I976-S979 PolarHBondContact O-N 2.9Å; I976-S979 PolarHBondContact O-OG 2.84Å; L977-S979 VanDerWaalsContact C-N 3.34Å
980	L	81.2	Confident	73.6	Confident	59 Å²	59	65.3 Å²	65.3	31%	0.309	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-4.1	178.2	-68.6	171.8	0	0	0	113.1	W633 I976 L977 D978 E982	W633-L980 HydrophobicContact CB-CD1 4.16Å; W633-L980 HydrophobicContact CG-CD1 4.33Å; I976-L980 HydrophobicContact CG2-CD1 4.17Å; I976-L980 WeakPolarHBondContact O-CG 3.21Å; I976-L980 PolarHBondContact O-N 3.24Å; L977-L980 PolarHBondContact O-N 2.93Å; D978-L980 PolarHBondContact O-N 3.26Å; L980-E982 VanDerWaalsContact C-N 3.29Å; L980-E982 HydrophobicContact CB-CG 4.31Å; L980-E982 PolarHBondContact O-N 3.45Å
981	G	81.2	Confident	71.8	Confident	65 Å²	65	64.7 Å²	64.7	67%	0.67	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.2	26.6	-175.3	0	0	0	0	0	113.8	L977 D978	L977-G981 PolarHBondContact O-N 2.89Å; D978-G981 PolarHBondContact O-N 3.43Å; D978-G981 VanDerWaalsContact O-N 3.1Å
982	E	80.7	Confident	69.6	Low	7 Å²	7	64.4 Å²	64.4	3%	0.033	37%	0.372	C	S	.	.			trans	-100.5	113.1	-177.1	-78.4	-69.3	-179.9	0	0	112.2	R577 W633 R640 L977 L980 I984	R577-E982 IonicContact CZ-OE1 3.82Å; R577-E982 IonicContact CZ-OE2 3.76Å; R577-E982 IonicContact NE-OE1 2.77Å; R577-E982 PolarHBondContact NE-OE1 2.97Å; R577-E982 IonicContact NH2-OE1 3.72Å; R577-E982 PolarHBondContact NH2-OE1 3.03Å; R577-E982 IonicContact NH2-OE2 2.65Å; R577-E982 PolarHBondContact NH2-OE2 3.34Å; W633-E982 PolarHBondContact NE1-OE1 3.21Å; R640-E982 IonicContact CZ-OE2 2.81Å; R640-E982 VanDerWaalsContact CZ-OE2 3.25Å; R640-E982 IonicContact NH1-OE2 2.7Å; R640-E982 PolarHBondContact NH1-OE2 3.42Å; R640-E982 IonicContact NH2-OE2 2.99Å; R640-E982 PolarHBondContact NH2-OE2 3.42Å; L977-E982 HydrophobicContact CD2-CB 4.12Å; L977-E982 PolarHBondContact O-N 3.4Å; L980-E982 VanDerWaalsContact C-N 3.29Å; L980-E982 HydrophobicContact CB-CG 4.31Å; L980-E982 PolarHBondContact O-N 3.45Å; E982-I984 PolarHBondContact O-N 2.99Å
983	E	76	Confident	67.7	Low	157 Å²	157	68.5 Å²	68.5	73%	0.734	40%	0.397	S	S	*	.			trans	-51.9	136.4	173.6	-69.9	-167.2	-179.7	0	0	111.9	N636 R640 S985	N636-E983 PolarHBondContact ND2-O 3.32Å; N636-E983 PolarHBondContact OD1-O 3.29Å; R640-E983 PolarHBondContact NH2-O 3.33Å; E983-S985 PolarHBondContact O-N 3.32Å
984	I	64.3	Low	65.8	Low	81 Å²	81	69.6 Å²	69.6	42%	0.415	41%	0.413	S	S	.	.			trans	-65	110.4	175.8	-52.6	175.2	0	0	0	109.4	R974 L977 E982 N986	R974-I984 HydrophobicContact CG-CD1 4.08Å; L977-I984 HydrophobicContact CD1-CG1 4.37Å; E982-I984 PolarHBondContact O-N 2.99Å; I984-N986 VanDerWaalsContact C-N 3.32Å; I984-N986 PolarHBondContact O-N 3.47Å
985	S	59.7	Low	63.5	Low	16 Å²	16	66.9 Å²	66.9	11%	0.112	42%	0.418	C	S	.	.			trans	-61.2	94.8	166.4	172.7	0	0	0	0	109	N636 Q639 E983 P987	N636-S985 WeakPolarHBondContact OD1-CB 3.5Å; N636-S985 PolarHBondContact OD1-N 2.89Å; Q639-S985 VanDerWaalsContact OE1-CB 3.3Å; Q639-S985 PolarHBondContact OE1-O 2.86Å; Q639-S985 PolarHBondContact OE1-OG 3.25Å; E983-S985 PolarHBondContact O-N 3.32Å; S985-P987 WeakPolarHBondContact O-CD 3.34Å
986	N	54.9	Low	61.3	Low	75 Å²	75	68.7 Å²	68.7	40%	0.401	44%	0.437	S	S	.	.			trans	-84.8	113.7	176.3	-165.4	-54.6	0	0	0	108	I984 S988 K989 V990	I984-N986 VanDerWaalsContact C-N 3.32Å; I984-N986 PolarHBondContact O-N 3.47Å; N986-S988 PolarHBondContact O-N 3.3Å; N986-S988 PolarHBondContact OD1-N 3.05Å; N986-S988 PolarHBondContact OD1-OG 2.89Å; N986-K989 HydrophobicContact CB-CD 4.33Å; N986-K989 HydrophobicContact CB-CG 4.32Å; N986-K989 WeakPolarHBondContact O-CB 3.46Å; N986-K989 PolarHBondContact O-N 3.11Å; N986-V990 PolarHBondContact O-N 2.86Å
987	P	51.8	Low	59.1	Low	85 Å²	85	75.2 Å²	75.2	55%	0.552	47%	0.471	S	S	*	.	H	α-helix	trans	-60.8	-25.1	-169.5	21.9	-33.3	0	0	0	112.8	S985 V990 A991	S985-P987 WeakPolarHBondContact O-CD 3.34Å; P987-V990 PolarHBondContact O-N 3.06Å; P987-A991 VanDerWaalsContact O-CB 3.28Å; P987-A991 WeakPolarHBondContact O-CB 3.43Å; P987-A991 PolarHBondContact O-N 2.86Å
988	S	44	Very low	56.6	Low	79 Å²	79	82.3 Å²	82.3	55%	0.552	52%	0.521	S	S	*	.	H	α-helix	trans	-62.2	-39.2	172	69.3	0	0	0	0	113.5	N986 A992	N986-S988 PolarHBondContact O-N 3.3Å; N986-S988 PolarHBondContact OD1-N 3.05Å; N986-S988 PolarHBondContact OD1-OG 2.89Å; S988-A992 WeakPolarHBondContact O-CB 3.45Å; S988-A992 PolarHBondContact O-N 2.95Å; S988-A992 VanDerWaalsContact O-N 3.1Å
989	K	43	Very low	55	Low	137 Å²	137	81.4 Å²	81.4	60%	0.596	52%	0.52	S	S	*	.	H	α-helix	trans	-69.9	-44.9	174.5	-68	-178.8	-179.9	175.4	0	110.7	N986 A991 A992 V993	N986-K989 HydrophobicContact CB-CD 4.33Å; N986-K989 HydrophobicContact CB-CG 4.32Å; N986-K989 WeakPolarHBondContact O-CB 3.46Å; N986-K989 PolarHBondContact O-N 3.11Å; K989-A991 PolarHBondContact O-N 3.15Å; K989-A992 PolarHBondContact O-N 2.84Å; K989-V993 WeakPolarHBondContact O-CG2 3.46Å; K989-V993 PolarHBondContact O-N 3.3Å
990	V	48.1	Very low	53.4	Low	52 Å²	52	81.1 Å²	81.1	32%	0.315	52%	0.515	S	S	.	.	H	α-helix	trans	-62.4	-44.7	-179.2	-176.7	0	0	0	0	110.7	N986 P987 A992 V993 A994	N986-V990 PolarHBondContact O-N 2.86Å; P987-V990 PolarHBondContact O-N 3.06Å; V990-A992 PolarHBondContact O-N 2.86Å; V990-V993 PolarHBondContact O-N 3.03Å; V990-A994 WeakPolarHBondContact O-CB 3.36Å; V990-A994 PolarHBondContact O-N 3.26Å
991	A	46.5	Very low	51.9	Low	65 Å²	65	82.3 Å²	82.3	54%	0.537	53%	0.527	S	S	.	.	H	α-helix	trans	-62.9	-39.7	174.4	0	0	0	0	0	112.7	P987 K989 G995	P987-A991 VanDerWaalsContact O-CB 3.28Å; P987-A991 WeakPolarHBondContact O-CB 3.43Å; P987-A991 PolarHBondContact O-N 2.86Å; K989-A991 PolarHBondContact O-N 3.15Å; A991-G995 PolarHBondContact O-N 3.33Å
992	A	40.4	Very low	50.2	Low	59 Å²	59	83.4 Å²	83.4	49%	0.488	52%	0.518	S	S	.	.	H	α-helix	trans	-67.2	-36.4	176.8	0	0	0	0	0	112.8	S988 K989 V990 C996	S988-A992 WeakPolarHBondContact O-CB 3.45Å; S988-A992 PolarHBondContact O-N 2.95Å; S988-A992 VanDerWaalsContact O-N 3.1Å; K989-A992 PolarHBondContact O-N 2.84Å; V990-A992 PolarHBondContact O-N 2.86Å; A992-C996 PolarHBondContact O-N 2.77Å; A992-C996 PolarHBondContact O-SG 2.98Å
993	V	45.1	Very low	48.3	Very low	90 Å²	90	88.1 Å²	88.1	55%	0.545	55%	0.549	S	S	.	.	H	α-helix	trans	-70.7	-45.2	174.8	171.7	0	0	0	0	110.9	K989 V990 G995 C996 L997	K989-V993 WeakPolarHBondContact O-CG2 3.46Å; K989-V993 PolarHBondContact O-N 3.3Å; V990-V993 PolarHBondContact O-N 3.03Å; V993-G995 PolarHBondContact O-N 3.48Å; V993-C996 PolarHBondContact O-N 3.31Å; V993-C996 VanDerWaalsContact O-N 3.13Å; V993-L997 HydrophobicContact CG1-CD1 4.11Å; V993-L997 PolarHBondContact O-N 3.33Å
994	A	46.6	Very low	46.4	Very low	56 Å²	56	83.5 Å²	83.5	46%	0.463	54%	0.536	S	S	.	.	H	α-helix	trans	-60.3	-44.6	176.3	0	0	0	0	0	112	V990 C996 L997 S998	V990-A994 WeakPolarHBondContact O-CB 3.36Å; V990-A994 PolarHBondContact O-N 3.26Å; A994-C996 PolarHBondContact O-N 2.67Å; A994-L997 PolarHBondContact O-N 3.19Å; A994-S998 PolarHBondContact O-N 3.47Å
995	G	38.9	Very low	45.1	Very low	47 Å²	47	83.7 Å²	83.7	49%	0.485	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-2.2	176.1	0	0	0	0	0	115.6	A991 V993	A991-G995 PolarHBondContact O-N 3.33Å; V993-G995 PolarHBondContact O-N 3.48Å
996	C	39.5	Very low	44	Very low	110 Å²	110	88.9 Å²	88.9	74%	0.743	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	-3.3	167.8	-68.5	0	0	0	0	113	A992 V993 A994	A992-C996 PolarHBondContact O-N 2.77Å; A992-C996 PolarHBondContact O-SG 2.98Å; V993-C996 PolarHBondContact O-N 3.31Å; V993-C996 VanDerWaalsContact O-N 3.13Å; A994-C996 PolarHBondContact O-N 2.67Å
997	L	40.7	Very low	43.1	Very low	149 Å²	149	90.1 Å²	90.1	78%	0.78	59%	0.593	S	S	*	*			trans	-112.3	-0.8	179.5	-70.3	167.8	0	0	0	112.8	V993 A994	V993-L997 HydrophobicContact CG1-CD1 4.11Å; V993-L997 PolarHBondContact O-N 3.33Å; A994-L997 PolarHBondContact O-N 3.19Å
998	S	32.6	Very low	42.3	Very low	152 Å²	152	90.5 Å²	90.5	100%	1.063	60%	0.597	S	S	*	*			trans	-111.5	0	176.2	66.6	0	0	0	0	112.2	A994	A994-S998 PolarHBondContact O-N 3.47Å

Retrieved 998 of 998 residues in 184.9 ms (Link to these results)

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